USER MOD reduce.3.24.130724 H: found=0, std=0, add=846, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 846 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 66 MET CE :methyl -121:sc= -0.597 (180deg=-5.05!) USER MOD Set 1.2: A 90 MET CE :methyl -154:sc= -1.31 (180deg=-2.77) USER MOD Single : A 2 SER OG : rot -16:sc= 0.749 USER MOD Single : A 4 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 100:sc= -0.181 USER MOD Single : A 11 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 23 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 25 GLN : amide:sc=-0.00318 K(o=-0.0032,f=-0.94) USER MOD Single : A 28 HIS : no HD1:sc= -0.443 X(o=-0.44,f=-0.54) USER MOD Single : A 30 TYR OH : rot 180:sc= -0.698 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 THR OG1 : rot 180:sc= -1.32 USER MOD Single : A 36 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 39 LYS NZ :NH3+ 164:sc=-0.00202 (180deg=-0.137) USER MOD Single : A 42 LYS NZ :NH3+ -153:sc= -0.0544 (180deg=-0.211) USER MOD Single : A 43 ASN :FLIP amide:sc= 1.01 F(o=-0.043,f=1) USER MOD Single : A 46 MET CE :methyl 165:sc= -0.219 (180deg=-0.738) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 ASN : amide:sc= -0.0137 X(o=-0.014,f=-0.2) USER MOD Single : A 52 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 56 SER OG : rot 180:sc= 0.184 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 65 THR OG1 : rot 170:sc= -1.41 USER MOD Single : A 71 MET CE :methyl -109:sc= -4.88 (180deg=-11.3!) USER MOD Single : A 76 THR OG1 : rot -34:sc= 1.01 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 85 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= -0.0886 K(o=-0.089,f=-0.64) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 GLN : amide:sc= -0.688 X(o=-0.69,f=-0.37) USER MOD Single : A 108 SER OG : rot 81:sc= 0.872 USER MOD ----------------------------------------------------------------- ATOM 18 N SER A 2 0.335 -1.312 -1.702 1.00 0.00 N ATOM 19 CA SER A 2 0.055 -2.713 -1.992 1.00 0.00 C ATOM 20 C SER A 2 -1.429 -3.018 -1.817 1.00 0.00 C ATOM 21 O SER A 2 -1.955 -2.986 -0.703 1.00 0.00 O ATOM 22 CB SER A 2 0.885 -3.621 -1.081 1.00 0.00 C ATOM 23 OG SER A 2 1.355 -2.913 0.053 1.00 0.00 O ATOM 0 HA SER A 2 0.328 -2.905 -3.030 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.281 -4.469 -0.759 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.731 -4.025 -1.638 1.00 0.00 H new ATOM 0 HG SER A 2 1.266 -1.950 -0.103 1.00 0.00 H new ATOM 29 N LEU A 3 -2.101 -3.314 -2.925 1.00 0.00 N ATOM 30 CA LEU A 3 -3.526 -3.625 -2.895 1.00 0.00 C ATOM 31 C LEU A 3 -3.771 -5.087 -3.256 1.00 0.00 C ATOM 32 O LEU A 3 -3.254 -5.587 -4.254 1.00 0.00 O ATOM 33 CB LEU A 3 -4.286 -2.715 -3.862 1.00 0.00 C ATOM 34 CG LEU A 3 -4.532 -1.284 -3.383 1.00 0.00 C ATOM 35 CD1 LEU A 3 -4.055 -0.284 -4.424 1.00 0.00 C ATOM 36 CD2 LEU A 3 -6.007 -1.072 -3.072 1.00 0.00 C ATOM 0 H LEU A 3 -1.682 -3.345 -3.854 1.00 0.00 H new ATOM 0 HA LEU A 3 -3.890 -3.454 -1.882 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -3.733 -2.673 -4.800 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -5.250 -3.175 -4.080 1.00 0.00 H new ATOM 0 HG LEU A 3 -3.962 -1.124 -2.468 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -4.238 0.729 -4.066 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -2.988 -0.420 -4.597 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -4.597 -0.443 -5.356 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -6.164 -0.048 -2.732 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -6.598 -1.251 -3.970 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -6.317 -1.765 -2.290 1.00 0.00 H new ATOM 48 N LYS A 4 -4.566 -5.767 -2.436 1.00 0.00 N ATOM 49 CA LYS A 4 -4.884 -7.171 -2.669 1.00 0.00 C ATOM 50 C LYS A 4 -5.498 -7.368 -4.052 1.00 0.00 C ATOM 51 O LYS A 4 -5.314 -8.410 -4.680 1.00 0.00 O ATOM 52 CB LYS A 4 -5.847 -7.682 -1.595 1.00 0.00 C ATOM 53 CG LYS A 4 -5.148 -8.307 -0.400 1.00 0.00 C ATOM 54 CD LYS A 4 -5.157 -9.825 -0.480 1.00 0.00 C ATOM 55 CE LYS A 4 -4.167 -10.440 0.497 1.00 0.00 C ATOM 56 NZ LYS A 4 -4.084 -11.919 0.344 1.00 0.00 N ATOM 0 H LYS A 4 -5.002 -5.368 -1.604 1.00 0.00 H new ATOM 0 HA LYS A 4 -3.956 -7.741 -2.618 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -6.467 -6.854 -1.251 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -6.517 -8.418 -2.040 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -4.119 -7.950 -0.352 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -5.640 -7.987 0.519 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -6.159 -10.196 -0.266 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -4.911 -10.138 -1.495 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -3.181 -10.003 0.339 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -4.464 -10.196 1.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -3.399 -12.301 1.027 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -5.019 -12.339 0.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -3.776 -12.151 -0.622 1.00 0.00 H new ATOM 70 N SER A 5 -6.227 -6.359 -4.520 1.00 0.00 N ATOM 71 CA SER A 5 -6.870 -6.423 -5.827 1.00 0.00 C ATOM 72 C SER A 5 -5.841 -6.664 -6.927 1.00 0.00 C ATOM 73 O SER A 5 -6.169 -7.173 -7.999 1.00 0.00 O ATOM 74 CB SER A 5 -7.637 -5.129 -6.105 1.00 0.00 C ATOM 75 OG SER A 5 -6.926 -4.001 -5.623 1.00 0.00 O ATOM 0 H SER A 5 -6.387 -5.488 -4.013 1.00 0.00 H new ATOM 0 HA SER A 5 -7.571 -7.258 -5.820 1.00 0.00 H new ATOM 0 HB2 SER A 5 -7.806 -5.026 -7.177 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.617 -5.175 -5.631 1.00 0.00 H new ATOM 0 HG SER A 5 -6.457 -3.568 -6.366 1.00 0.00 H new ATOM 81 N ASP A 6 -4.594 -6.294 -6.654 1.00 0.00 N ATOM 82 CA ASP A 6 -3.515 -6.471 -7.619 1.00 0.00 C ATOM 83 C ASP A 6 -3.434 -7.922 -8.083 1.00 0.00 C ATOM 84 O ASP A 6 -3.131 -8.195 -9.244 1.00 0.00 O ATOM 85 CB ASP A 6 -2.181 -6.043 -7.007 1.00 0.00 C ATOM 86 CG ASP A 6 -2.034 -4.535 -6.935 1.00 0.00 C ATOM 87 OD1 ASP A 6 -2.702 -3.836 -7.725 1.00 0.00 O ATOM 88 OD2 ASP A 6 -1.252 -4.055 -6.088 1.00 0.00 O ATOM 0 H ASP A 6 -4.306 -5.870 -5.772 1.00 0.00 H new ATOM 0 HA ASP A 6 -3.727 -5.843 -8.484 1.00 0.00 H new ATOM 0 HB2 ASP A 6 -2.093 -6.462 -6.005 1.00 0.00 H new ATOM 0 HB3 ASP A 6 -1.364 -6.457 -7.598 1.00 0.00 H new ATOM 93 N GLU A 7 -3.705 -8.847 -7.168 1.00 0.00 N ATOM 94 CA GLU A 7 -3.660 -10.270 -7.485 1.00 0.00 C ATOM 95 C GLU A 7 -4.745 -10.637 -8.494 1.00 0.00 C ATOM 96 O GLU A 7 -4.474 -11.283 -9.506 1.00 0.00 O ATOM 97 CB GLU A 7 -3.828 -11.104 -6.213 1.00 0.00 C ATOM 98 CG GLU A 7 -2.628 -11.980 -5.897 1.00 0.00 C ATOM 99 CD GLU A 7 -3.001 -13.217 -5.105 1.00 0.00 C ATOM 100 OE1 GLU A 7 -4.138 -13.708 -5.272 1.00 0.00 O ATOM 101 OE2 GLU A 7 -2.158 -13.695 -4.317 1.00 0.00 O ATOM 0 H GLU A 7 -3.958 -8.637 -6.202 1.00 0.00 H new ATOM 0 HA GLU A 7 -2.688 -10.487 -7.927 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -4.011 -10.435 -5.372 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -4.711 -11.735 -6.316 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -2.147 -12.281 -6.828 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -1.897 -11.399 -5.334 1.00 0.00 H new ATOM 108 N VAL A 8 -5.975 -10.221 -8.209 1.00 0.00 N ATOM 109 CA VAL A 8 -7.101 -10.505 -9.091 1.00 0.00 C ATOM 110 C VAL A 8 -6.822 -10.026 -10.511 1.00 0.00 C ATOM 111 O VAL A 8 -6.992 -10.774 -11.475 1.00 0.00 O ATOM 112 CB VAL A 8 -8.394 -9.841 -8.582 1.00 0.00 C ATOM 113 CG1 VAL A 8 -9.453 -9.826 -9.673 1.00 0.00 C ATOM 114 CG2 VAL A 8 -8.906 -10.555 -7.340 1.00 0.00 C ATOM 0 H VAL A 8 -6.217 -9.686 -7.375 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.234 -11.587 -9.095 1.00 0.00 H new ATOM 0 HB VAL A 8 -8.170 -8.809 -8.313 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -10.359 -9.353 -9.294 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.083 -9.266 -10.532 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.677 -10.849 -9.976 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.820 -10.073 -6.994 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -9.114 -11.598 -7.580 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -8.151 -10.507 -6.555 1.00 0.00 H new ATOM 124 N PHE A 9 -6.391 -8.775 -10.634 1.00 0.00 N ATOM 125 CA PHE A 9 -6.088 -8.195 -11.937 1.00 0.00 C ATOM 126 C PHE A 9 -5.001 -8.995 -12.649 1.00 0.00 C ATOM 127 O PHE A 9 -5.023 -9.141 -13.871 1.00 0.00 O ATOM 128 CB PHE A 9 -5.645 -6.739 -11.780 1.00 0.00 C ATOM 129 CG PHE A 9 -6.772 -5.801 -11.457 1.00 0.00 C ATOM 130 CD1 PHE A 9 -7.869 -5.699 -12.297 1.00 0.00 C ATOM 131 CD2 PHE A 9 -6.734 -5.019 -10.313 1.00 0.00 C ATOM 132 CE1 PHE A 9 -8.908 -4.837 -12.002 1.00 0.00 C ATOM 133 CE2 PHE A 9 -7.771 -4.156 -10.013 1.00 0.00 C ATOM 134 CZ PHE A 9 -8.858 -4.064 -10.859 1.00 0.00 C ATOM 0 H PHE A 9 -6.244 -8.143 -9.847 1.00 0.00 H new ATOM 0 HA PHE A 9 -6.994 -8.229 -12.542 1.00 0.00 H new ATOM 0 HB2 PHE A 9 -4.895 -6.679 -10.991 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -5.164 -6.412 -12.702 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -7.913 -6.300 -13.193 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -5.885 -5.085 -9.649 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -9.758 -4.768 -12.665 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -7.731 -3.554 -9.117 1.00 0.00 H new ATOM 0 HZ PHE A 9 -9.668 -3.388 -10.627 1.00 0.00 H new ATOM 144 N ALA A 10 -4.052 -9.512 -11.875 1.00 0.00 N ATOM 145 CA ALA A 10 -2.958 -10.299 -12.431 1.00 0.00 C ATOM 146 C ALA A 10 -3.459 -11.637 -12.963 1.00 0.00 C ATOM 147 O ALA A 10 -3.045 -12.086 -14.032 1.00 0.00 O ATOM 148 CB ALA A 10 -1.879 -10.517 -11.380 1.00 0.00 C ATOM 0 H ALA A 10 -4.019 -9.400 -10.862 1.00 0.00 H new ATOM 0 HA ALA A 10 -2.531 -9.744 -13.266 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -1.068 -11.106 -11.808 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -1.492 -9.553 -11.050 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -2.303 -11.049 -10.528 1.00 0.00 H new ATOM 154 N LYS A 11 -4.352 -12.271 -12.211 1.00 0.00 N ATOM 155 CA LYS A 11 -4.911 -13.558 -12.607 1.00 0.00 C ATOM 156 C LYS A 11 -5.867 -13.397 -13.784 1.00 0.00 C ATOM 157 O LYS A 11 -5.797 -14.146 -14.759 1.00 0.00 O ATOM 158 CB LYS A 11 -5.642 -14.204 -11.428 1.00 0.00 C ATOM 159 CG LYS A 11 -4.857 -14.161 -10.128 1.00 0.00 C ATOM 160 CD LYS A 11 -5.759 -13.866 -8.941 1.00 0.00 C ATOM 161 CE LYS A 11 -5.916 -15.084 -8.044 1.00 0.00 C ATOM 162 NZ LYS A 11 -7.233 -15.095 -7.349 1.00 0.00 N ATOM 0 H LYS A 11 -4.704 -11.914 -11.323 1.00 0.00 H new ATOM 0 HA LYS A 11 -4.089 -14.204 -12.915 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -6.597 -13.699 -11.283 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -5.865 -15.242 -11.674 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -4.353 -15.115 -9.975 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -4.082 -13.398 -10.195 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -5.344 -13.039 -8.364 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -6.738 -13.547 -9.297 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.813 -15.990 -8.641 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -5.115 -15.096 -7.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -7.301 -15.941 -6.748 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -7.322 -14.243 -6.759 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -7.997 -15.109 -8.054 1.00 0.00 H new ATOM 176 N ILE A 12 -6.758 -12.416 -13.688 1.00 0.00 N ATOM 177 CA ILE A 12 -7.726 -12.156 -14.747 1.00 0.00 C ATOM 178 C ILE A 12 -7.026 -11.832 -16.062 1.00 0.00 C ATOM 179 O ILE A 12 -7.442 -12.289 -17.127 1.00 0.00 O ATOM 180 CB ILE A 12 -8.665 -10.994 -14.377 1.00 0.00 C ATOM 181 CG1 ILE A 12 -9.547 -11.380 -13.188 1.00 0.00 C ATOM 182 CG2 ILE A 12 -9.521 -10.604 -15.573 1.00 0.00 C ATOM 183 CD1 ILE A 12 -10.410 -10.245 -12.682 1.00 0.00 C ATOM 0 H ILE A 12 -6.830 -11.788 -12.888 1.00 0.00 H new ATOM 0 HA ILE A 12 -8.316 -13.064 -14.867 1.00 0.00 H new ATOM 0 HB ILE A 12 -8.059 -10.134 -14.092 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -10.189 -12.212 -13.477 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -8.913 -11.734 -12.375 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -10.180 -9.781 -15.296 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -8.877 -10.292 -16.395 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -10.120 -11.459 -15.886 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -11.008 -10.591 -11.839 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -9.774 -9.420 -12.362 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -11.070 -9.906 -13.480 1.00 0.00 H new ATOM 195 N ALA A 13 -5.961 -11.042 -15.981 1.00 0.00 N ATOM 196 CA ALA A 13 -5.202 -10.659 -17.165 1.00 0.00 C ATOM 197 C ALA A 13 -4.611 -11.882 -17.857 1.00 0.00 C ATOM 198 O ALA A 13 -4.600 -11.969 -19.086 1.00 0.00 O ATOM 199 CB ALA A 13 -4.100 -9.679 -16.791 1.00 0.00 C ATOM 0 H ALA A 13 -5.604 -10.655 -15.108 1.00 0.00 H new ATOM 0 HA ALA A 13 -5.884 -10.173 -17.862 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -3.541 -9.401 -17.685 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -4.542 -8.787 -16.348 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -3.426 -10.146 -16.072 1.00 0.00 H new ATOM 205 N LYS A 14 -4.120 -12.827 -17.063 1.00 0.00 N ATOM 206 CA LYS A 14 -3.528 -14.047 -17.598 1.00 0.00 C ATOM 207 C LYS A 14 -4.577 -14.893 -18.313 1.00 0.00 C ATOM 208 O LYS A 14 -4.274 -15.582 -19.287 1.00 0.00 O ATOM 209 CB LYS A 14 -2.881 -14.860 -16.475 1.00 0.00 C ATOM 210 CG LYS A 14 -2.005 -15.997 -16.974 1.00 0.00 C ATOM 211 CD LYS A 14 -0.972 -16.401 -15.936 1.00 0.00 C ATOM 212 CE LYS A 14 0.026 -17.400 -16.502 1.00 0.00 C ATOM 213 NZ LYS A 14 1.359 -16.780 -16.738 1.00 0.00 N ATOM 0 H LYS A 14 -4.120 -12.771 -16.045 1.00 0.00 H new ATOM 0 HA LYS A 14 -2.762 -13.763 -18.320 1.00 0.00 H new ATOM 0 HB2 LYS A 14 -2.280 -14.194 -15.856 1.00 0.00 H new ATOM 0 HB3 LYS A 14 -3.664 -15.269 -15.836 1.00 0.00 H new ATOM 0 HG2 LYS A 14 -2.628 -16.856 -17.222 1.00 0.00 H new ATOM 0 HG3 LYS A 14 -1.501 -15.694 -17.892 1.00 0.00 H new ATOM 0 HD2 LYS A 14 -0.442 -15.516 -15.584 1.00 0.00 H new ATOM 0 HD3 LYS A 14 -1.474 -16.836 -15.072 1.00 0.00 H new ATOM 0 HE2 LYS A 14 0.132 -18.238 -15.812 1.00 0.00 H new ATOM 0 HE3 LYS A 14 -0.357 -17.805 -17.439 1.00 0.00 H new ATOM 0 HZ1 LYS A 14 2.010 -17.493 -17.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 14 1.263 -15.997 -17.416 1.00 0.00 H new ATOM 0 HZ3 LYS A 14 1.737 -16.416 -15.840 1.00 0.00 H new ATOM 227 N ARG A 15 -5.812 -14.834 -17.824 1.00 0.00 N ATOM 228 CA ARG A 15 -6.905 -15.594 -18.417 1.00 0.00 C ATOM 229 C ARG A 15 -7.393 -14.933 -19.702 1.00 0.00 C ATOM 230 O ARG A 15 -7.824 -15.610 -20.637 1.00 0.00 O ATOM 231 CB ARG A 15 -8.063 -15.720 -17.424 1.00 0.00 C ATOM 232 CG ARG A 15 -8.709 -17.096 -17.414 1.00 0.00 C ATOM 233 CD ARG A 15 -8.839 -17.640 -16.000 1.00 0.00 C ATOM 234 NE ARG A 15 -7.857 -18.685 -15.723 1.00 0.00 N ATOM 235 CZ ARG A 15 -7.972 -19.935 -16.159 1.00 0.00 C ATOM 236 NH1 ARG A 15 -9.019 -20.293 -16.888 1.00 0.00 N ATOM 237 NH2 ARG A 15 -7.036 -20.829 -15.865 1.00 0.00 N ATOM 0 H ARG A 15 -6.080 -14.268 -17.019 1.00 0.00 H new ATOM 0 HA ARG A 15 -6.533 -16.589 -18.660 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -7.698 -15.492 -16.423 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -8.820 -14.974 -17.665 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -9.695 -17.040 -17.875 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -8.114 -17.783 -18.016 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -8.714 -16.826 -15.286 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -9.843 -18.039 -15.856 1.00 0.00 H new ATOM 0 HE ARG A 15 -7.039 -18.442 -15.165 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -9.740 -19.608 -17.116 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -9.104 -21.253 -17.221 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -6.229 -20.556 -15.304 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -7.124 -21.789 -16.200 1.00 0.00 H new ATOM 251 N LEU A 16 -7.323 -13.607 -19.743 1.00 0.00 N ATOM 252 CA LEU A 16 -7.758 -12.853 -20.913 1.00 0.00 C ATOM 253 C LEU A 16 -6.748 -12.981 -22.049 1.00 0.00 C ATOM 254 O LEU A 16 -7.026 -12.597 -23.185 1.00 0.00 O ATOM 255 CB LEU A 16 -7.953 -11.379 -20.552 1.00 0.00 C ATOM 256 CG LEU A 16 -8.964 -11.088 -19.443 1.00 0.00 C ATOM 257 CD1 LEU A 16 -8.544 -9.863 -18.646 1.00 0.00 C ATOM 258 CD2 LEU A 16 -10.356 -10.895 -20.027 1.00 0.00 C ATOM 0 H LEU A 16 -6.969 -13.032 -18.979 1.00 0.00 H new ATOM 0 HA LEU A 16 -8.709 -13.267 -21.248 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -6.988 -10.968 -20.254 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -8.264 -10.844 -21.449 1.00 0.00 H new ATOM 0 HG LEU A 16 -8.990 -11.944 -18.768 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -9.276 -9.671 -17.861 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -7.567 -10.039 -18.196 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -8.488 -8.999 -19.309 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -11.063 -10.689 -19.223 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -10.345 -10.057 -20.724 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -10.659 -11.801 -20.553 1.00 0.00 H new ATOM 270 N GLU A 17 -5.577 -13.524 -21.734 1.00 0.00 N ATOM 271 CA GLU A 17 -4.526 -13.704 -22.730 1.00 0.00 C ATOM 272 C GLU A 17 -4.800 -14.931 -23.594 1.00 0.00 C ATOM 273 O GLU A 17 -4.129 -15.157 -24.601 1.00 0.00 O ATOM 274 CB GLU A 17 -3.164 -13.841 -22.047 1.00 0.00 C ATOM 275 CG GLU A 17 -2.617 -12.528 -21.511 1.00 0.00 C ATOM 276 CD GLU A 17 -1.127 -12.377 -21.748 1.00 0.00 C ATOM 277 OE1 GLU A 17 -0.739 -12.047 -22.888 1.00 0.00 O ATOM 278 OE2 GLU A 17 -0.349 -12.588 -20.794 1.00 0.00 O ATOM 0 H GLU A 17 -5.331 -13.847 -20.798 1.00 0.00 H new ATOM 0 HA GLU A 17 -4.515 -12.824 -23.373 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -3.249 -14.552 -21.225 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -2.451 -14.259 -22.758 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -3.142 -11.699 -21.985 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -2.819 -12.464 -20.442 1.00 0.00 H new ATOM 285 N SER A 18 -5.790 -15.722 -23.192 1.00 0.00 N ATOM 286 CA SER A 18 -6.150 -16.929 -23.926 1.00 0.00 C ATOM 287 C SER A 18 -7.439 -16.720 -24.717 1.00 0.00 C ATOM 288 O SER A 18 -7.914 -17.627 -25.401 1.00 0.00 O ATOM 289 CB SER A 18 -6.315 -18.107 -22.964 1.00 0.00 C ATOM 290 OG SER A 18 -5.588 -19.238 -23.413 1.00 0.00 O ATOM 0 H SER A 18 -6.357 -15.548 -22.362 1.00 0.00 H new ATOM 0 HA SER A 18 -5.345 -17.151 -24.627 1.00 0.00 H new ATOM 0 HB2 SER A 18 -5.970 -17.820 -21.970 1.00 0.00 H new ATOM 0 HB3 SER A 18 -7.371 -18.362 -22.874 1.00 0.00 H new ATOM 0 HG SER A 18 -5.708 -19.977 -22.780 1.00 0.00 H new ATOM 296 N ILE A 19 -7.998 -15.519 -24.617 1.00 0.00 N ATOM 297 CA ILE A 19 -9.230 -15.190 -25.323 1.00 0.00 C ATOM 298 C ILE A 19 -9.086 -15.431 -26.822 1.00 0.00 C ATOM 299 O ILE A 19 -8.031 -15.176 -27.403 1.00 0.00 O ATOM 300 CB ILE A 19 -9.640 -13.724 -25.087 1.00 0.00 C ATOM 301 CG1 ILE A 19 -9.748 -13.437 -23.588 1.00 0.00 C ATOM 302 CG2 ILE A 19 -10.957 -13.423 -25.786 1.00 0.00 C ATOM 303 CD1 ILE A 19 -10.982 -14.032 -22.946 1.00 0.00 C ATOM 0 H ILE A 19 -7.618 -14.758 -24.054 1.00 0.00 H new ATOM 0 HA ILE A 19 -10.006 -15.844 -24.925 1.00 0.00 H new ATOM 0 HB ILE A 19 -8.872 -13.075 -25.508 1.00 0.00 H new ATOM 0 HG12 ILE A 19 -8.863 -13.829 -23.087 1.00 0.00 H new ATOM 0 HG13 ILE A 19 -9.752 -12.358 -23.432 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -11.233 -12.383 -25.610 1.00 0.00 H new ATOM 0 HG22 ILE A 19 -10.848 -13.593 -26.857 1.00 0.00 H new ATOM 0 HG23 ILE A 19 -11.735 -14.077 -25.393 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -10.993 -13.789 -21.884 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -11.873 -13.622 -23.421 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -10.971 -15.115 -23.070 1.00 0.00 H new ATOM 315 N ASP A 20 -10.154 -15.921 -27.442 1.00 0.00 N ATOM 316 CA ASP A 20 -10.149 -16.193 -28.874 1.00 0.00 C ATOM 317 C ASP A 20 -11.327 -15.511 -29.562 1.00 0.00 C ATOM 318 O ASP A 20 -12.395 -15.325 -28.978 1.00 0.00 O ATOM 319 CB ASP A 20 -10.196 -17.701 -29.128 1.00 0.00 C ATOM 320 CG ASP A 20 -9.029 -18.184 -29.967 1.00 0.00 C ATOM 321 OD1 ASP A 20 -7.872 -17.901 -29.592 1.00 0.00 O ATOM 322 OD2 ASP A 20 -9.273 -18.846 -30.997 1.00 0.00 O ATOM 0 H ASP A 20 -11.034 -16.138 -26.975 1.00 0.00 H new ATOM 0 HA ASP A 20 -9.226 -15.790 -29.292 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -10.196 -18.227 -28.174 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -11.130 -17.953 -29.631 1.00 0.00 H new ATOM 327 N PRO A 21 -11.131 -15.129 -30.832 1.00 0.00 N ATOM 328 CA PRO A 21 -12.167 -14.461 -31.627 1.00 0.00 C ATOM 329 C PRO A 21 -13.317 -15.396 -31.983 1.00 0.00 C ATOM 330 O PRO A 21 -14.334 -14.966 -32.527 1.00 0.00 O ATOM 331 CB PRO A 21 -11.419 -14.027 -32.890 1.00 0.00 C ATOM 332 CG PRO A 21 -10.279 -14.979 -33.002 1.00 0.00 C ATOM 333 CD PRO A 21 -9.884 -15.319 -31.591 1.00 0.00 C ATOM 0 HA PRO A 21 -12.630 -13.636 -31.084 1.00 0.00 H new ATOM 0 HB2 PRO A 21 -12.063 -14.076 -33.768 1.00 0.00 H new ATOM 0 HB3 PRO A 21 -11.069 -12.998 -32.809 1.00 0.00 H new ATOM 0 HG2 PRO A 21 -10.570 -15.874 -33.552 1.00 0.00 H new ATOM 0 HG3 PRO A 21 -9.446 -14.529 -33.543 1.00 0.00 H new ATOM 0 HD2 PRO A 21 -9.518 -16.343 -31.512 1.00 0.00 H new ATOM 0 HD3 PRO A 21 -9.089 -14.667 -31.228 1.00 0.00 H new ATOM 341 N ALA A 22 -13.150 -16.678 -31.673 1.00 0.00 N ATOM 342 CA ALA A 22 -14.175 -17.673 -31.958 1.00 0.00 C ATOM 343 C ALA A 22 -15.182 -17.768 -30.816 1.00 0.00 C ATOM 344 O ALA A 22 -16.273 -18.311 -30.982 1.00 0.00 O ATOM 345 CB ALA A 22 -13.537 -19.030 -32.216 1.00 0.00 C ATOM 0 H ALA A 22 -12.314 -17.051 -31.224 1.00 0.00 H new ATOM 0 HA ALA A 22 -14.710 -17.359 -32.854 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -14.315 -19.764 -32.428 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -12.863 -18.959 -33.070 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -12.975 -19.341 -31.335 1.00 0.00 H new ATOM 351 N ASN A 23 -14.806 -17.236 -29.658 1.00 0.00 N ATOM 352 CA ASN A 23 -15.676 -17.261 -28.487 1.00 0.00 C ATOM 353 C ASN A 23 -15.716 -15.895 -27.809 1.00 0.00 C ATOM 354 O ASN A 23 -14.706 -15.419 -27.291 1.00 0.00 O ATOM 355 CB ASN A 23 -15.198 -18.323 -27.494 1.00 0.00 C ATOM 356 CG ASN A 23 -16.206 -19.442 -27.315 1.00 0.00 C ATOM 357 OD1 ASN A 23 -16.861 -19.543 -26.278 1.00 0.00 O ATOM 358 ND2 ASN A 23 -16.333 -20.291 -28.329 1.00 0.00 N ATOM 0 H ASN A 23 -13.905 -16.782 -29.505 1.00 0.00 H new ATOM 0 HA ASN A 23 -16.684 -17.511 -28.819 1.00 0.00 H new ATOM 0 HB2 ASN A 23 -14.253 -18.741 -27.840 1.00 0.00 H new ATOM 0 HB3 ASN A 23 -15.005 -17.854 -26.529 1.00 0.00 H new ATOM 0 HD21 ASN A 23 -16.994 -21.065 -28.266 1.00 0.00 H new ATOM 0 HD22 ASN A 23 -15.769 -20.169 -29.170 1.00 0.00 H new ATOM 365 N ARG A 24 -16.889 -15.272 -27.816 1.00 0.00 N ATOM 366 CA ARG A 24 -17.061 -13.961 -27.202 1.00 0.00 C ATOM 367 C ARG A 24 -18.506 -13.487 -27.327 1.00 0.00 C ATOM 368 O ARG A 24 -19.358 -14.198 -27.858 1.00 0.00 O ATOM 369 CB ARG A 24 -16.121 -12.943 -27.850 1.00 0.00 C ATOM 370 CG ARG A 24 -16.215 -12.907 -29.367 1.00 0.00 C ATOM 371 CD ARG A 24 -14.856 -13.120 -30.015 1.00 0.00 C ATOM 372 NE ARG A 24 -14.793 -12.545 -31.356 1.00 0.00 N ATOM 373 CZ ARG A 24 -14.765 -11.239 -31.595 1.00 0.00 C ATOM 374 NH1 ARG A 24 -14.793 -10.377 -30.588 1.00 0.00 N ATOM 375 NH2 ARG A 24 -14.707 -10.793 -32.843 1.00 0.00 N ATOM 0 H ARG A 24 -17.735 -15.654 -28.240 1.00 0.00 H new ATOM 0 HA ARG A 24 -16.816 -14.049 -26.144 1.00 0.00 H new ATOM 0 HB2 ARG A 24 -16.346 -11.952 -27.457 1.00 0.00 H new ATOM 0 HB3 ARG A 24 -15.095 -13.174 -27.563 1.00 0.00 H new ATOM 0 HG2 ARG A 24 -16.907 -13.677 -29.708 1.00 0.00 H new ATOM 0 HG3 ARG A 24 -16.624 -11.948 -29.685 1.00 0.00 H new ATOM 0 HD2 ARG A 24 -14.083 -12.671 -29.391 1.00 0.00 H new ATOM 0 HD3 ARG A 24 -14.643 -14.188 -30.068 1.00 0.00 H new ATOM 0 HE ARG A 24 -14.769 -13.181 -32.153 1.00 0.00 H new ATOM 0 HH11 ARG A 24 -14.836 -10.716 -29.627 1.00 0.00 H new ATOM 0 HH12 ARG A 24 -14.771 -9.374 -30.774 1.00 0.00 H new ATOM 0 HH21 ARG A 24 -14.684 -11.453 -33.620 1.00 0.00 H new ATOM 0 HH22 ARG A 24 -14.686 -9.790 -33.026 1.00 0.00 H new ATOM 389 N GLN A 25 -18.773 -12.281 -26.835 1.00 0.00 N ATOM 390 CA GLN A 25 -20.115 -11.713 -26.891 1.00 0.00 C ATOM 391 C GLN A 25 -20.059 -10.201 -27.079 1.00 0.00 C ATOM 392 O GLN A 25 -20.750 -9.645 -27.933 1.00 0.00 O ATOM 393 CB GLN A 25 -20.889 -12.052 -25.615 1.00 0.00 C ATOM 394 CG GLN A 25 -20.976 -13.543 -25.334 1.00 0.00 C ATOM 395 CD GLN A 25 -22.188 -13.910 -24.501 1.00 0.00 C ATOM 396 OE1 GLN A 25 -22.827 -13.046 -23.901 1.00 0.00 O ATOM 397 NE2 GLN A 25 -22.510 -15.198 -24.460 1.00 0.00 N ATOM 0 H GLN A 25 -18.078 -11.679 -26.393 1.00 0.00 H new ATOM 0 HA GLN A 25 -20.631 -12.148 -27.747 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -20.411 -11.559 -24.769 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -21.898 -11.646 -25.693 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -21.011 -14.085 -26.279 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -20.073 -13.864 -24.816 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -21.952 -15.880 -24.973 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -23.316 -15.505 -23.915 1.00 0.00 H new ATOM 406 N VAL A 26 -19.231 -9.540 -26.276 1.00 0.00 N ATOM 407 CA VAL A 26 -19.084 -8.091 -26.354 1.00 0.00 C ATOM 408 C VAL A 26 -17.686 -7.657 -25.931 1.00 0.00 C ATOM 409 O VAL A 26 -17.154 -8.135 -24.929 1.00 0.00 O ATOM 410 CB VAL A 26 -20.122 -7.373 -25.471 1.00 0.00 C ATOM 411 CG1 VAL A 26 -19.860 -7.657 -24.000 1.00 0.00 C ATOM 412 CG2 VAL A 26 -20.109 -5.877 -25.745 1.00 0.00 C ATOM 0 H VAL A 26 -18.652 -9.985 -25.564 1.00 0.00 H new ATOM 0 HA VAL A 26 -19.248 -7.812 -27.395 1.00 0.00 H new ATOM 0 HB VAL A 26 -21.112 -7.756 -25.719 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -20.603 -7.141 -23.392 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -19.925 -8.730 -23.819 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -18.864 -7.303 -23.733 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -20.848 -5.385 -25.113 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -19.120 -5.476 -25.526 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -20.350 -5.697 -26.793 1.00 0.00 H new ATOM 422 N GLU A 27 -17.095 -6.749 -26.701 1.00 0.00 N ATOM 423 CA GLU A 27 -15.757 -6.251 -26.405 1.00 0.00 C ATOM 424 C GLU A 27 -15.733 -4.725 -26.403 1.00 0.00 C ATOM 425 O GLU A 27 -16.055 -4.086 -27.405 1.00 0.00 O ATOM 426 CB GLU A 27 -14.752 -6.786 -27.427 1.00 0.00 C ATOM 427 CG GLU A 27 -14.065 -8.069 -26.990 1.00 0.00 C ATOM 428 CD GLU A 27 -13.062 -7.843 -25.875 1.00 0.00 C ATOM 429 OE1 GLU A 27 -12.566 -6.704 -25.745 1.00 0.00 O ATOM 430 OE2 GLU A 27 -12.773 -8.805 -25.133 1.00 0.00 O ATOM 0 H GLU A 27 -17.521 -6.343 -27.534 1.00 0.00 H new ATOM 0 HA GLU A 27 -15.477 -6.603 -25.412 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -15.266 -6.963 -28.372 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -13.995 -6.024 -27.614 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -14.817 -8.784 -26.658 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -13.557 -8.515 -27.846 1.00 0.00 H new ATOM 437 N HIS A 28 -15.349 -4.147 -25.269 1.00 0.00 N ATOM 438 CA HIS A 28 -15.282 -2.696 -25.136 1.00 0.00 C ATOM 439 C HIS A 28 -14.326 -2.297 -24.015 1.00 0.00 C ATOM 440 O HIS A 28 -13.848 -3.145 -23.262 1.00 0.00 O ATOM 441 CB HIS A 28 -16.673 -2.123 -24.863 1.00 0.00 C ATOM 442 CG HIS A 28 -17.313 -1.504 -26.067 1.00 0.00 C ATOM 443 ND1 HIS A 28 -16.857 -0.339 -26.646 1.00 0.00 N ATOM 444 CD2 HIS A 28 -18.379 -1.896 -26.804 1.00 0.00 C ATOM 445 CE1 HIS A 28 -17.616 -0.040 -27.686 1.00 0.00 C ATOM 446 NE2 HIS A 28 -18.546 -0.970 -27.803 1.00 0.00 N ATOM 0 H HIS A 28 -15.080 -4.661 -24.430 1.00 0.00 H new ATOM 0 HA HIS A 28 -14.906 -2.287 -26.074 1.00 0.00 H new ATOM 0 HB2 HIS A 28 -17.317 -2.918 -24.488 1.00 0.00 H new ATOM 0 HB3 HIS A 28 -16.600 -1.374 -24.075 1.00 0.00 H new ATOM 0 HD2 HIS A 28 -18.985 -2.774 -26.637 1.00 0.00 H new ATOM 0 HE1 HIS A 28 -17.496 0.819 -28.330 1.00 0.00 H new ATOM 0 HE2 HIS A 28 -19.271 -0.996 -28.520 1.00 0.00 H new ATOM 454 N VAL A 29 -14.052 -1.000 -23.912 1.00 0.00 N ATOM 455 CA VAL A 29 -13.153 -0.489 -22.884 1.00 0.00 C ATOM 456 C VAL A 29 -13.840 -0.451 -21.523 1.00 0.00 C ATOM 457 O VAL A 29 -15.015 -0.098 -21.418 1.00 0.00 O ATOM 458 CB VAL A 29 -12.650 0.925 -23.231 1.00 0.00 C ATOM 459 CG1 VAL A 29 -11.561 1.357 -22.261 1.00 0.00 C ATOM 460 CG2 VAL A 29 -12.147 0.973 -24.666 1.00 0.00 C ATOM 0 H VAL A 29 -14.439 -0.285 -24.527 1.00 0.00 H new ATOM 0 HA VAL A 29 -12.303 -1.169 -22.841 1.00 0.00 H new ATOM 0 HB VAL A 29 -13.483 1.622 -23.138 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -11.218 2.358 -22.522 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -11.959 1.363 -21.246 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -10.725 0.660 -22.319 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -11.795 1.979 -24.895 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -11.327 0.265 -24.788 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -12.958 0.709 -25.345 1.00 0.00 H new ATOM 470 N TYR A 30 -13.100 -0.818 -20.483 1.00 0.00 N ATOM 471 CA TYR A 30 -13.638 -0.828 -19.127 1.00 0.00 C ATOM 472 C TYR A 30 -12.627 -0.260 -18.136 1.00 0.00 C ATOM 473 O TYR A 30 -11.445 -0.114 -18.450 1.00 0.00 O ATOM 474 CB TYR A 30 -14.024 -2.251 -18.721 1.00 0.00 C ATOM 475 CG TYR A 30 -15.053 -2.883 -19.630 1.00 0.00 C ATOM 476 CD1 TYR A 30 -16.366 -2.429 -19.647 1.00 0.00 C ATOM 477 CD2 TYR A 30 -14.713 -3.934 -20.473 1.00 0.00 C ATOM 478 CE1 TYR A 30 -17.310 -3.004 -20.476 1.00 0.00 C ATOM 479 CE2 TYR A 30 -15.650 -4.514 -21.306 1.00 0.00 C ATOM 480 CZ TYR A 30 -16.947 -4.045 -21.304 1.00 0.00 C ATOM 481 OH TYR A 30 -17.883 -4.621 -22.132 1.00 0.00 O ATOM 0 H TYR A 30 -12.126 -1.113 -20.552 1.00 0.00 H new ATOM 0 HA TYR A 30 -14.528 -0.199 -19.111 1.00 0.00 H new ATOM 0 HB2 TYR A 30 -13.129 -2.873 -18.712 1.00 0.00 H new ATOM 0 HB3 TYR A 30 -14.412 -2.236 -17.702 1.00 0.00 H new ATOM 0 HD1 TYR A 30 -16.654 -1.613 -19.001 1.00 0.00 H new ATOM 0 HD2 TYR A 30 -13.698 -4.304 -20.477 1.00 0.00 H new ATOM 0 HE1 TYR A 30 -18.327 -2.640 -20.475 1.00 0.00 H new ATOM 0 HE2 TYR A 30 -15.369 -5.330 -21.955 1.00 0.00 H new ATOM 0 HH TYR A 30 -17.464 -5.339 -22.650 1.00 0.00 H new ATOM 491 N LYS A 31 -13.100 0.058 -16.936 1.00 0.00 N ATOM 492 CA LYS A 31 -12.240 0.608 -15.895 1.00 0.00 C ATOM 493 C LYS A 31 -12.702 0.158 -14.513 1.00 0.00 C ATOM 494 O LYS A 31 -13.899 0.140 -14.223 1.00 0.00 O ATOM 495 CB LYS A 31 -12.230 2.136 -15.968 1.00 0.00 C ATOM 496 CG LYS A 31 -10.988 2.705 -16.632 1.00 0.00 C ATOM 497 CD LYS A 31 -10.412 3.866 -15.838 1.00 0.00 C ATOM 498 CE LYS A 31 -11.410 5.007 -15.717 1.00 0.00 C ATOM 499 NZ LYS A 31 -10.734 6.310 -15.463 1.00 0.00 N ATOM 0 H LYS A 31 -14.075 -0.056 -16.660 1.00 0.00 H new ATOM 0 HA LYS A 31 -11.229 0.235 -16.060 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -13.111 2.471 -16.516 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -12.310 2.540 -14.959 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -10.236 1.922 -16.730 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -11.234 3.039 -17.640 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -10.128 3.523 -14.843 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -9.504 4.225 -16.323 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -11.997 5.075 -16.633 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -12.107 4.795 -14.906 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -11.448 7.062 -15.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -10.194 6.254 -14.576 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -10.087 6.525 -16.249 1.00 0.00 H new ATOM 513 N PHE A 32 -11.747 -0.204 -13.663 1.00 0.00 N ATOM 514 CA PHE A 32 -12.057 -0.654 -12.311 1.00 0.00 C ATOM 515 C PHE A 32 -11.254 0.134 -11.279 1.00 0.00 C ATOM 516 O PHE A 32 -10.074 -0.136 -11.057 1.00 0.00 O ATOM 517 CB PHE A 32 -11.764 -2.149 -12.168 1.00 0.00 C ATOM 518 CG PHE A 32 -12.009 -2.930 -13.427 1.00 0.00 C ATOM 519 CD1 PHE A 32 -13.263 -3.453 -13.700 1.00 0.00 C ATOM 520 CD2 PHE A 32 -10.986 -3.142 -14.337 1.00 0.00 C ATOM 521 CE1 PHE A 32 -13.491 -4.173 -14.858 1.00 0.00 C ATOM 522 CE2 PHE A 32 -11.208 -3.861 -15.496 1.00 0.00 C ATOM 523 CZ PHE A 32 -12.463 -4.376 -15.757 1.00 0.00 C ATOM 0 H PHE A 32 -10.752 -0.195 -13.886 1.00 0.00 H new ATOM 0 HA PHE A 32 -13.118 -0.480 -12.131 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.725 -2.280 -11.865 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -12.383 -2.558 -11.370 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -14.071 -3.296 -13.001 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -10.003 -2.741 -14.138 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -14.472 -4.576 -15.059 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -10.402 -4.020 -16.197 1.00 0.00 H new ATOM 0 HZ PHE A 32 -12.640 -4.937 -16.663 1.00 0.00 H new ATOM 533 N ARG A 33 -11.904 1.108 -10.651 1.00 0.00 N ATOM 534 CA ARG A 33 -11.252 1.937 -9.644 1.00 0.00 C ATOM 535 C ARG A 33 -11.357 1.297 -8.263 1.00 0.00 C ATOM 536 O ARG A 33 -12.456 1.081 -7.750 1.00 0.00 O ATOM 537 CB ARG A 33 -11.875 3.334 -9.620 1.00 0.00 C ATOM 538 CG ARG A 33 -13.353 3.335 -9.264 1.00 0.00 C ATOM 539 CD ARG A 33 -14.047 4.588 -9.773 1.00 0.00 C ATOM 540 NE ARG A 33 -14.459 5.468 -8.682 1.00 0.00 N ATOM 541 CZ ARG A 33 -15.342 6.450 -8.823 1.00 0.00 C ATOM 542 NH1 ARG A 33 -15.905 6.676 -10.003 1.00 0.00 N ATOM 543 NH2 ARG A 33 -15.666 7.208 -7.783 1.00 0.00 N ATOM 0 H ARG A 33 -12.882 1.343 -10.822 1.00 0.00 H new ATOM 0 HA ARG A 33 -10.198 2.022 -9.907 1.00 0.00 H new ATOM 0 HB2 ARG A 33 -11.336 3.951 -8.901 1.00 0.00 H new ATOM 0 HB3 ARG A 33 -11.745 3.798 -10.598 1.00 0.00 H new ATOM 0 HG2 ARG A 33 -13.832 2.454 -9.691 1.00 0.00 H new ATOM 0 HG3 ARG A 33 -13.468 3.268 -8.182 1.00 0.00 H new ATOM 0 HD2 ARG A 33 -13.376 5.128 -10.440 1.00 0.00 H new ATOM 0 HD3 ARG A 33 -14.921 4.305 -10.360 1.00 0.00 H new ATOM 0 HE ARG A 33 -14.046 5.320 -7.761 1.00 0.00 H new ATOM 0 HH11 ARG A 33 -15.660 6.095 -10.805 1.00 0.00 H new ATOM 0 HH12 ARG A 33 -16.583 7.431 -10.108 1.00 0.00 H new ATOM 0 HH21 ARG A 33 -15.237 7.037 -6.874 1.00 0.00 H new ATOM 0 HH22 ARG A 33 -16.344 7.962 -7.893 1.00 0.00 H new ATOM 557 N ILE A 34 -10.209 0.997 -7.666 1.00 0.00 N ATOM 558 CA ILE A 34 -10.173 0.383 -6.344 1.00 0.00 C ATOM 559 C ILE A 34 -10.150 1.442 -5.247 1.00 0.00 C ATOM 560 O ILE A 34 -9.382 2.403 -5.311 1.00 0.00 O ATOM 561 CB ILE A 34 -8.946 -0.533 -6.183 1.00 0.00 C ATOM 562 CG1 ILE A 34 -8.944 -1.615 -7.265 1.00 0.00 C ATOM 563 CG2 ILE A 34 -8.933 -1.163 -4.798 1.00 0.00 C ATOM 564 CD1 ILE A 34 -10.195 -2.465 -7.272 1.00 0.00 C ATOM 0 H ILE A 34 -9.291 1.169 -8.076 1.00 0.00 H new ATOM 0 HA ILE A 34 -11.079 -0.216 -6.249 1.00 0.00 H new ATOM 0 HB ILE A 34 -8.045 0.070 -6.296 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.831 -1.142 -8.240 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -8.077 -2.260 -7.121 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -8.060 -1.808 -4.700 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -8.892 -0.379 -4.042 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -9.838 -1.754 -4.659 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -10.124 -3.210 -8.064 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -10.299 -2.967 -6.310 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -11.064 -1.831 -7.447 1.00 0.00 H new ATOM 576 N THR A 35 -10.997 1.259 -4.238 1.00 0.00 N ATOM 577 CA THR A 35 -11.074 2.197 -3.126 1.00 0.00 C ATOM 578 C THR A 35 -10.487 1.594 -1.855 1.00 0.00 C ATOM 579 O THR A 35 -10.624 0.396 -1.606 1.00 0.00 O ATOM 580 CB THR A 35 -12.529 2.626 -2.852 1.00 0.00 C ATOM 581 OG1 THR A 35 -13.285 1.510 -2.369 1.00 0.00 O ATOM 582 CG2 THR A 35 -13.177 3.176 -4.113 1.00 0.00 C ATOM 0 H THR A 35 -11.639 0.469 -4.169 1.00 0.00 H new ATOM 0 HA THR A 35 -10.492 3.073 -3.412 1.00 0.00 H new ATOM 0 HB THR A 35 -12.517 3.411 -2.096 1.00 0.00 H new ATOM 0 HG1 THR A 35 -14.208 1.791 -2.195 1.00 0.00 H new ATOM 0 HG21 THR A 35 -14.203 3.472 -3.895 1.00 0.00 H new ATOM 0 HG22 THR A 35 -12.616 4.043 -4.462 1.00 0.00 H new ATOM 0 HG23 THR A 35 -13.177 2.408 -4.887 1.00 0.00 H new ATOM 590 N GLN A 36 -9.833 2.430 -1.056 1.00 0.00 N ATOM 591 CA GLN A 36 -9.225 1.977 0.190 1.00 0.00 C ATOM 592 C GLN A 36 -10.071 2.389 1.390 1.00 0.00 C ATOM 593 O GLN A 36 -10.145 3.568 1.735 1.00 0.00 O ATOM 594 CB GLN A 36 -7.811 2.546 0.328 1.00 0.00 C ATOM 595 CG GLN A 36 -6.995 1.886 1.427 1.00 0.00 C ATOM 596 CD GLN A 36 -5.775 2.698 1.815 1.00 0.00 C ATOM 597 OE1 GLN A 36 -5.788 3.424 2.809 1.00 0.00 O ATOM 598 NE2 GLN A 36 -4.710 2.578 1.030 1.00 0.00 N ATOM 0 H GLN A 36 -9.710 3.424 -1.249 1.00 0.00 H new ATOM 0 HA GLN A 36 -9.171 0.889 0.164 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -7.288 2.431 -0.621 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -7.876 3.616 0.528 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -7.625 1.741 2.305 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -6.678 0.897 1.095 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -4.743 1.964 0.216 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -3.859 3.099 1.242 1.00 0.00 H new ATOM 607 N GLY A 37 -10.708 1.409 2.023 1.00 0.00 N ATOM 608 CA GLY A 37 -11.541 1.689 3.178 1.00 0.00 C ATOM 609 C GLY A 37 -12.916 2.195 2.791 1.00 0.00 C ATOM 610 O GLY A 37 -13.923 1.773 3.358 1.00 0.00 O ATOM 0 H GLY A 37 -10.662 0.426 1.756 1.00 0.00 H new ATOM 0 HA2 GLY A 37 -11.645 0.783 3.775 1.00 0.00 H new ATOM 0 HA3 GLY A 37 -11.048 2.430 3.807 1.00 0.00 H new ATOM 614 N GLY A 38 -12.960 3.106 1.823 1.00 0.00 N ATOM 615 CA GLY A 38 -14.227 3.656 1.379 1.00 0.00 C ATOM 616 C GLY A 38 -14.051 4.790 0.388 1.00 0.00 C ATOM 617 O GLY A 38 -15.026 5.411 -0.036 1.00 0.00 O ATOM 0 H GLY A 38 -12.141 3.473 1.339 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -14.822 2.866 0.921 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -14.786 4.016 2.243 1.00 0.00 H new ATOM 621 N LYS A 39 -12.804 5.064 0.020 1.00 0.00 N ATOM 622 CA LYS A 39 -12.502 6.131 -0.927 1.00 0.00 C ATOM 623 C LYS A 39 -11.544 5.643 -2.009 1.00 0.00 C ATOM 624 O LYS A 39 -10.573 4.943 -1.723 1.00 0.00 O ATOM 625 CB LYS A 39 -11.896 7.331 -0.197 1.00 0.00 C ATOM 626 CG LYS A 39 -11.751 8.565 -1.071 1.00 0.00 C ATOM 627 CD LYS A 39 -10.963 9.658 -0.368 1.00 0.00 C ATOM 628 CE LYS A 39 -11.259 11.027 -0.959 1.00 0.00 C ATOM 629 NZ LYS A 39 -12.614 11.515 -0.578 1.00 0.00 N ATOM 0 H LYS A 39 -11.986 4.561 0.363 1.00 0.00 H new ATOM 0 HA LYS A 39 -13.434 6.436 -1.403 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -12.520 7.576 0.662 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -10.916 7.053 0.190 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -11.251 8.296 -2.001 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -12.739 8.941 -1.337 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -11.208 9.659 0.694 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -9.896 9.448 -0.449 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -10.508 11.740 -0.619 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -11.183 10.978 -2.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -12.679 12.537 -0.761 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -13.333 11.016 -1.140 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -12.777 11.333 0.433 1.00 0.00 H new ATOM 643 N VAL A 40 -11.823 6.019 -3.253 1.00 0.00 N ATOM 644 CA VAL A 40 -10.984 5.623 -4.378 1.00 0.00 C ATOM 645 C VAL A 40 -9.524 5.978 -4.126 1.00 0.00 C ATOM 646 O VAL A 40 -9.217 7.025 -3.555 1.00 0.00 O ATOM 647 CB VAL A 40 -11.446 6.292 -5.686 1.00 0.00 C ATOM 648 CG1 VAL A 40 -11.098 7.773 -5.680 1.00 0.00 C ATOM 649 CG2 VAL A 40 -10.827 5.595 -6.888 1.00 0.00 C ATOM 0 H VAL A 40 -12.624 6.597 -3.507 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.080 4.542 -4.479 1.00 0.00 H new ATOM 0 HB VAL A 40 -12.530 6.198 -5.759 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -11.432 8.229 -6.612 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -11.593 8.260 -4.840 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -10.019 7.893 -5.584 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -11.164 6.081 -7.804 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.741 5.656 -6.824 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -11.132 4.549 -6.899 1.00 0.00 H new ATOM 659 N VAL A 41 -8.624 5.099 -4.557 1.00 0.00 N ATOM 660 CA VAL A 41 -7.193 5.321 -4.380 1.00 0.00 C ATOM 661 C VAL A 41 -6.455 5.235 -5.711 1.00 0.00 C ATOM 662 O VAL A 41 -5.406 5.853 -5.893 1.00 0.00 O ATOM 663 CB VAL A 41 -6.584 4.300 -3.400 1.00 0.00 C ATOM 664 CG1 VAL A 41 -7.013 4.607 -1.974 1.00 0.00 C ATOM 665 CG2 VAL A 41 -6.981 2.884 -3.792 1.00 0.00 C ATOM 0 H VAL A 41 -8.860 4.227 -5.031 1.00 0.00 H new ATOM 0 HA VAL A 41 -7.076 6.323 -3.968 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.498 4.376 -3.451 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -6.573 3.875 -1.296 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -6.674 5.606 -1.699 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -8.100 4.560 -1.903 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -6.542 2.175 -3.089 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -8.067 2.791 -3.770 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -6.618 2.670 -4.797 1.00 0.00 H new ATOM 675 N LYS A 42 -7.010 4.464 -6.640 1.00 0.00 N ATOM 676 CA LYS A 42 -6.407 4.297 -7.957 1.00 0.00 C ATOM 677 C LYS A 42 -7.456 3.897 -8.989 1.00 0.00 C ATOM 678 O LYS A 42 -8.607 3.632 -8.647 1.00 0.00 O ATOM 679 CB LYS A 42 -5.300 3.242 -7.903 1.00 0.00 C ATOM 680 CG LYS A 42 -5.798 1.826 -8.135 1.00 0.00 C ATOM 681 CD LYS A 42 -4.856 0.798 -7.532 1.00 0.00 C ATOM 682 CE LYS A 42 -3.628 0.587 -8.405 1.00 0.00 C ATOM 683 NZ LYS A 42 -2.885 -0.648 -8.029 1.00 0.00 N ATOM 0 H LYS A 42 -7.877 3.944 -6.505 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.976 5.252 -8.256 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -4.546 3.480 -8.653 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -4.810 3.291 -6.931 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -6.790 1.712 -7.698 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -5.898 1.645 -9.205 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -4.546 1.125 -6.539 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -5.381 -0.149 -7.406 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -3.932 0.524 -9.450 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -2.967 1.449 -8.317 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -1.882 -0.540 -8.282 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -2.968 -0.805 -7.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -3.285 -1.462 -8.538 1.00 0.00 H new ATOM 697 N ASN A 43 -7.049 3.854 -10.254 1.00 0.00 N ATOM 698 CA ASN A 43 -7.954 3.485 -11.336 1.00 0.00 C ATOM 699 C ASN A 43 -7.277 2.523 -12.307 1.00 0.00 C ATOM 700 O ASN A 43 -6.171 2.780 -12.782 1.00 0.00 O ATOM 701 CB ASN A 43 -8.425 4.734 -12.084 1.00 0.00 C ATOM 702 CG ASN A 43 -7.342 5.792 -12.181 1.00 0.00 C ATOM 703 OD1 ASN A 43 -7.669 7.012 -11.772 1.00 0.00 O flip ATOM 704 ND2 ASN A 43 -6.226 5.515 -12.619 1.00 0.00 N flip ATOM 0 H ASN A 43 -6.099 4.070 -10.554 1.00 0.00 H new ATOM 0 HA ASN A 43 -8.818 2.984 -10.898 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -8.747 4.454 -13.087 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -9.294 5.153 -11.576 1.00 0.00 H new ATOM 0 HD21 ASN A 43 -6.019 4.563 -12.922 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -5.508 6.237 -12.679 1.00 0.00 H new ATOM 711 N TRP A 44 -7.949 1.414 -12.597 1.00 0.00 N ATOM 712 CA TRP A 44 -7.413 0.413 -13.512 1.00 0.00 C ATOM 713 C TRP A 44 -8.144 0.451 -14.850 1.00 0.00 C ATOM 714 O TRP A 44 -9.346 0.713 -14.904 1.00 0.00 O ATOM 715 CB TRP A 44 -7.523 -0.982 -12.896 1.00 0.00 C ATOM 716 CG TRP A 44 -6.472 -1.261 -11.864 1.00 0.00 C ATOM 717 CD1 TRP A 44 -6.556 -1.018 -10.523 1.00 0.00 C ATOM 718 CD2 TRP A 44 -5.180 -1.833 -12.091 1.00 0.00 C ATOM 719 NE1 TRP A 44 -5.393 -1.405 -9.902 1.00 0.00 N ATOM 720 CE2 TRP A 44 -4.533 -1.909 -10.841 1.00 0.00 C ATOM 721 CE3 TRP A 44 -4.506 -2.291 -13.226 1.00 0.00 C ATOM 722 CZ2 TRP A 44 -3.247 -2.423 -10.699 1.00 0.00 C ATOM 723 CZ3 TRP A 44 -3.230 -2.801 -13.083 1.00 0.00 C ATOM 724 CH2 TRP A 44 -2.611 -2.864 -11.828 1.00 0.00 C ATOM 0 H TRP A 44 -8.865 1.186 -12.212 1.00 0.00 H new ATOM 0 HA TRP A 44 -6.362 0.643 -13.687 1.00 0.00 H new ATOM 0 HB2 TRP A 44 -8.507 -1.094 -12.441 1.00 0.00 H new ATOM 0 HB3 TRP A 44 -7.451 -1.728 -13.688 1.00 0.00 H new ATOM 0 HD1 TRP A 44 -7.411 -0.585 -10.024 1.00 0.00 H new ATOM 0 HE1 TRP A 44 -5.201 -1.329 -8.903 1.00 0.00 H new ATOM 0 HE3 TRP A 44 -4.974 -2.247 -14.198 1.00 0.00 H new ATOM 0 HZ2 TRP A 44 -2.768 -2.472 -9.732 1.00 0.00 H new ATOM 0 HZ3 TRP A 44 -2.700 -3.157 -13.954 1.00 0.00 H new ATOM 0 HH2 TRP A 44 -1.613 -3.268 -11.750 1.00 0.00 H new ATOM 735 N VAL A 45 -7.411 0.189 -15.928 1.00 0.00 N ATOM 736 CA VAL A 45 -7.991 0.192 -17.265 1.00 0.00 C ATOM 737 C VAL A 45 -7.774 -1.147 -17.961 1.00 0.00 C ATOM 738 O VAL A 45 -6.738 -1.789 -17.786 1.00 0.00 O ATOM 739 CB VAL A 45 -7.392 1.313 -18.134 1.00 0.00 C ATOM 740 CG1 VAL A 45 -7.968 1.265 -19.541 1.00 0.00 C ATOM 741 CG2 VAL A 45 -7.637 2.671 -17.495 1.00 0.00 C ATOM 0 H VAL A 45 -6.415 -0.028 -15.901 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.060 0.367 -17.146 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.315 1.158 -18.203 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -7.533 2.065 -20.140 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -7.735 0.303 -19.997 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -9.050 1.393 -19.496 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -7.207 3.451 -18.123 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -8.709 2.837 -17.393 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -7.170 2.699 -16.510 1.00 0.00 H new ATOM 751 N MET A 46 -8.757 -1.563 -18.753 1.00 0.00 N ATOM 752 CA MET A 46 -8.673 -2.826 -19.477 1.00 0.00 C ATOM 753 C MET A 46 -8.204 -2.599 -20.911 1.00 0.00 C ATOM 754 O MET A 46 -8.963 -2.119 -21.753 1.00 0.00 O ATOM 755 CB MET A 46 -10.031 -3.530 -19.478 1.00 0.00 C ATOM 756 CG MET A 46 -9.967 -4.971 -19.957 1.00 0.00 C ATOM 757 SD MET A 46 -10.615 -6.136 -18.743 1.00 0.00 S ATOM 758 CE MET A 46 -12.368 -6.063 -19.105 1.00 0.00 C ATOM 0 H MET A 46 -9.621 -1.044 -18.910 1.00 0.00 H new ATOM 0 HA MET A 46 -7.945 -3.459 -18.970 1.00 0.00 H new ATOM 0 HB2 MET A 46 -10.443 -3.509 -18.469 1.00 0.00 H new ATOM 0 HB3 MET A 46 -10.719 -2.974 -20.115 1.00 0.00 H new ATOM 0 HG2 MET A 46 -10.532 -5.067 -20.884 1.00 0.00 H new ATOM 0 HG3 MET A 46 -8.933 -5.228 -20.186 1.00 0.00 H new ATOM 0 HE1 MET A 46 -12.872 -6.907 -18.635 1.00 0.00 H new ATOM 0 HE2 MET A 46 -12.781 -5.132 -18.717 1.00 0.00 H new ATOM 0 HE3 MET A 46 -12.519 -6.106 -20.184 1.00 0.00 H new ATOM 768 N ASP A 47 -6.951 -2.947 -21.181 1.00 0.00 N ATOM 769 CA ASP A 47 -6.382 -2.783 -22.514 1.00 0.00 C ATOM 770 C ASP A 47 -6.976 -3.796 -23.487 1.00 0.00 C ATOM 771 O ASP A 47 -6.723 -4.997 -23.382 1.00 0.00 O ATOM 772 CB ASP A 47 -4.861 -2.935 -22.464 1.00 0.00 C ATOM 773 CG ASP A 47 -4.148 -1.920 -23.337 1.00 0.00 C ATOM 774 OD1 ASP A 47 -4.028 -0.753 -22.910 1.00 0.00 O ATOM 775 OD2 ASP A 47 -3.712 -2.293 -24.446 1.00 0.00 O ATOM 0 H ASP A 47 -6.310 -3.345 -20.495 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.628 -1.781 -22.867 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -4.522 -2.826 -21.434 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -4.589 -3.941 -22.785 1.00 0.00 H new ATOM 780 N LEU A 48 -7.768 -3.305 -24.434 1.00 0.00 N ATOM 781 CA LEU A 48 -8.399 -4.167 -25.427 1.00 0.00 C ATOM 782 C LEU A 48 -7.433 -4.490 -26.562 1.00 0.00 C ATOM 783 O LEU A 48 -7.628 -5.453 -27.303 1.00 0.00 O ATOM 784 CB LEU A 48 -9.656 -3.498 -25.987 1.00 0.00 C ATOM 785 CG LEU A 48 -10.966 -3.824 -25.269 1.00 0.00 C ATOM 786 CD1 LEU A 48 -10.890 -3.415 -23.806 1.00 0.00 C ATOM 787 CD2 LEU A 48 -12.136 -3.136 -25.957 1.00 0.00 C ATOM 0 H LEU A 48 -7.988 -2.314 -24.535 1.00 0.00 H new ATOM 0 HA LEU A 48 -8.678 -5.099 -24.937 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -9.510 -2.418 -25.962 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -9.759 -3.782 -27.034 1.00 0.00 H new ATOM 0 HG LEU A 48 -11.125 -4.901 -25.315 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -11.831 -3.655 -23.312 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -10.077 -3.954 -23.319 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -10.707 -2.343 -23.737 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -13.060 -3.379 -25.433 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -11.983 -2.057 -25.942 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -12.204 -3.479 -26.990 1.00 0.00 H new ATOM 799 N LYS A 49 -6.388 -3.679 -26.691 1.00 0.00 N ATOM 800 CA LYS A 49 -5.387 -3.879 -27.733 1.00 0.00 C ATOM 801 C LYS A 49 -4.447 -5.025 -27.371 1.00 0.00 C ATOM 802 O LYS A 49 -4.129 -5.867 -28.210 1.00 0.00 O ATOM 803 CB LYS A 49 -4.584 -2.595 -27.950 1.00 0.00 C ATOM 804 CG LYS A 49 -4.623 -2.088 -29.381 1.00 0.00 C ATOM 805 CD LYS A 49 -4.057 -0.682 -29.490 1.00 0.00 C ATOM 806 CE LYS A 49 -4.095 -0.176 -30.924 1.00 0.00 C ATOM 807 NZ LYS A 49 -4.255 1.303 -30.986 1.00 0.00 N ATOM 0 H LYS A 49 -6.212 -2.876 -26.086 1.00 0.00 H new ATOM 0 HA LYS A 49 -5.906 -4.136 -28.657 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -4.969 -1.819 -27.288 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -3.547 -2.772 -27.664 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -4.054 -2.761 -30.022 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -5.651 -2.096 -29.743 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -4.627 -0.008 -28.850 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -3.029 -0.673 -29.127 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -3.176 -0.464 -31.435 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.918 -0.653 -31.456 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -4.276 1.609 -31.980 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -5.144 1.576 -30.521 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -3.456 1.759 -30.501 1.00 0.00 H new ATOM 821 N ASN A 50 -4.008 -5.051 -26.117 1.00 0.00 N ATOM 822 CA ASN A 50 -3.104 -6.094 -25.645 1.00 0.00 C ATOM 823 C ASN A 50 -3.857 -7.132 -24.819 1.00 0.00 C ATOM 824 O ASN A 50 -3.309 -8.175 -24.463 1.00 0.00 O ATOM 825 CB ASN A 50 -1.976 -5.483 -24.812 1.00 0.00 C ATOM 826 CG ASN A 50 -0.656 -6.203 -25.009 1.00 0.00 C ATOM 827 OD1 ASN A 50 -0.627 -7.390 -25.334 1.00 0.00 O ATOM 828 ND2 ASN A 50 0.444 -5.485 -24.813 1.00 0.00 N ATOM 0 H ASN A 50 -4.263 -4.362 -25.409 1.00 0.00 H new ATOM 0 HA ASN A 50 -2.675 -6.590 -26.516 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -1.858 -4.433 -25.080 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -2.249 -5.514 -23.757 1.00 0.00 H new ATOM 0 HD21 ASN A 50 1.361 -5.915 -24.931 1.00 0.00 H new ATOM 0 HD22 ASN A 50 0.371 -4.504 -24.544 1.00 0.00 H new ATOM 835 N VAL A 51 -5.118 -6.839 -24.517 1.00 0.00 N ATOM 836 CA VAL A 51 -5.948 -7.747 -23.734 1.00 0.00 C ATOM 837 C VAL A 51 -5.334 -8.008 -22.363 1.00 0.00 C ATOM 838 O VAL A 51 -5.382 -9.127 -21.851 1.00 0.00 O ATOM 839 CB VAL A 51 -6.147 -9.091 -24.459 1.00 0.00 C ATOM 840 CG1 VAL A 51 -7.349 -9.831 -23.892 1.00 0.00 C ATOM 841 CG2 VAL A 51 -6.305 -8.870 -25.956 1.00 0.00 C ATOM 0 H VAL A 51 -5.587 -5.980 -24.803 1.00 0.00 H new ATOM 0 HA VAL A 51 -6.917 -7.263 -23.609 1.00 0.00 H new ATOM 0 HB VAL A 51 -5.262 -9.706 -24.297 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -7.474 -10.778 -24.417 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -7.191 -10.022 -22.831 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.245 -9.224 -24.022 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -6.445 -9.830 -26.453 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -7.172 -8.236 -26.141 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -5.411 -8.385 -26.349 1.00 0.00 H new ATOM 851 N LYS A 52 -4.758 -6.967 -21.771 1.00 0.00 N ATOM 852 CA LYS A 52 -4.135 -7.082 -20.458 1.00 0.00 C ATOM 853 C LYS A 52 -4.631 -5.983 -19.524 1.00 0.00 C ATOM 854 O LYS A 52 -5.191 -4.980 -19.970 1.00 0.00 O ATOM 855 CB LYS A 52 -2.612 -7.009 -20.585 1.00 0.00 C ATOM 856 CG LYS A 52 -1.877 -7.372 -19.306 1.00 0.00 C ATOM 857 CD LYS A 52 -0.535 -8.023 -19.599 1.00 0.00 C ATOM 858 CE LYS A 52 0.547 -6.982 -19.844 1.00 0.00 C ATOM 859 NZ LYS A 52 1.566 -6.976 -18.759 1.00 0.00 N ATOM 0 H LYS A 52 -4.710 -6.034 -22.180 1.00 0.00 H new ATOM 0 HA LYS A 52 -4.412 -8.048 -20.035 1.00 0.00 H new ATOM 0 HB2 LYS A 52 -2.290 -7.679 -21.382 1.00 0.00 H new ATOM 0 HB3 LYS A 52 -2.329 -6.000 -20.883 1.00 0.00 H new ATOM 0 HG2 LYS A 52 -1.724 -6.475 -18.706 1.00 0.00 H new ATOM 0 HG3 LYS A 52 -2.490 -8.051 -18.713 1.00 0.00 H new ATOM 0 HD2 LYS A 52 -0.247 -8.659 -18.762 1.00 0.00 H new ATOM 0 HD3 LYS A 52 -0.625 -8.668 -20.473 1.00 0.00 H new ATOM 0 HE2 LYS A 52 1.034 -7.182 -20.798 1.00 0.00 H new ATOM 0 HE3 LYS A 52 0.091 -5.995 -19.919 1.00 0.00 H new ATOM 0 HZ1 LYS A 52 2.286 -6.253 -18.963 1.00 0.00 H new ATOM 0 HZ2 LYS A 52 1.106 -6.760 -17.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 52 2.020 -7.910 -18.703 1.00 0.00 H new ATOM 873 N LEU A 53 -4.420 -6.176 -18.226 1.00 0.00 N ATOM 874 CA LEU A 53 -4.844 -5.200 -17.228 1.00 0.00 C ATOM 875 C LEU A 53 -3.690 -4.281 -16.841 1.00 0.00 C ATOM 876 O LEU A 53 -2.590 -4.742 -16.538 1.00 0.00 O ATOM 877 CB LEU A 53 -5.383 -5.912 -15.986 1.00 0.00 C ATOM 878 CG LEU A 53 -6.889 -6.175 -15.964 1.00 0.00 C ATOM 879 CD1 LEU A 53 -7.660 -4.874 -16.119 1.00 0.00 C ATOM 880 CD2 LEU A 53 -7.275 -7.160 -17.057 1.00 0.00 C ATOM 0 H LEU A 53 -3.958 -6.999 -17.840 1.00 0.00 H new ATOM 0 HA LEU A 53 -5.637 -4.593 -17.664 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -4.866 -6.866 -15.886 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -5.125 -5.317 -15.110 1.00 0.00 H new ATOM 0 HG LEU A 53 -7.148 -6.614 -15.000 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -8.730 -5.081 -16.101 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -7.407 -4.201 -15.300 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -7.397 -4.406 -17.068 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -8.350 -7.335 -17.026 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -7.002 -6.750 -18.029 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -6.749 -8.102 -16.900 1.00 0.00 H new ATOM 892 N VAL A 54 -3.950 -2.977 -16.852 1.00 0.00 N ATOM 893 CA VAL A 54 -2.935 -1.992 -16.498 1.00 0.00 C ATOM 894 C VAL A 54 -3.563 -0.759 -15.859 1.00 0.00 C ATOM 895 O VAL A 54 -4.786 -0.642 -15.786 1.00 0.00 O ATOM 896 CB VAL A 54 -2.120 -1.559 -17.732 1.00 0.00 C ATOM 897 CG1 VAL A 54 -1.240 -2.700 -18.219 1.00 0.00 C ATOM 898 CG2 VAL A 54 -3.046 -1.079 -18.839 1.00 0.00 C ATOM 0 H VAL A 54 -4.855 -2.579 -17.102 1.00 0.00 H new ATOM 0 HA VAL A 54 -2.268 -2.469 -15.779 1.00 0.00 H new ATOM 0 HB VAL A 54 -1.472 -0.730 -17.446 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.672 -2.375 -19.091 1.00 0.00 H new ATOM 0 HG12 VAL A 54 -0.552 -2.992 -17.426 1.00 0.00 H new ATOM 0 HG13 VAL A 54 -1.865 -3.551 -18.489 1.00 0.00 H new ATOM 0 HG21 VAL A 54 -2.454 -0.777 -19.703 1.00 0.00 H new ATOM 0 HG22 VAL A 54 -3.720 -1.886 -19.125 1.00 0.00 H new ATOM 0 HG23 VAL A 54 -3.628 -0.229 -18.483 1.00 0.00 H new ATOM 908 N GLU A 55 -2.718 0.157 -15.397 1.00 0.00 N ATOM 909 CA GLU A 55 -3.192 1.382 -14.763 1.00 0.00 C ATOM 910 C GLU A 55 -3.046 2.574 -15.705 1.00 0.00 C ATOM 911 O GLU A 55 -1.935 2.953 -16.075 1.00 0.00 O ATOM 912 CB GLU A 55 -2.421 1.643 -13.468 1.00 0.00 C ATOM 913 CG GLU A 55 -0.964 1.218 -13.531 1.00 0.00 C ATOM 914 CD GLU A 55 -0.059 2.115 -12.709 1.00 0.00 C ATOM 915 OE1 GLU A 55 -0.507 2.602 -11.651 1.00 0.00 O ATOM 916 OE2 GLU A 55 1.100 2.329 -13.125 1.00 0.00 O ATOM 0 H GLU A 55 -1.703 0.074 -15.450 1.00 0.00 H new ATOM 0 HA GLU A 55 -4.249 1.254 -14.528 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -2.471 2.706 -13.234 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -2.910 1.113 -12.651 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -0.873 0.192 -13.175 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -0.632 1.226 -14.569 1.00 0.00 H new ATOM 923 N SER A 56 -4.176 3.160 -16.088 1.00 0.00 N ATOM 924 CA SER A 56 -4.175 4.305 -16.990 1.00 0.00 C ATOM 925 C SER A 56 -5.393 5.191 -16.745 1.00 0.00 C ATOM 926 O SER A 56 -6.329 4.798 -16.049 1.00 0.00 O ATOM 927 CB SER A 56 -4.156 3.835 -18.446 1.00 0.00 C ATOM 928 OG SER A 56 -4.623 4.852 -19.316 1.00 0.00 O ATOM 0 H SER A 56 -5.104 2.860 -15.788 1.00 0.00 H new ATOM 0 HA SER A 56 -3.277 4.890 -16.793 1.00 0.00 H new ATOM 0 HB2 SER A 56 -3.142 3.550 -18.726 1.00 0.00 H new ATOM 0 HB3 SER A 56 -4.778 2.946 -18.553 1.00 0.00 H new ATOM 0 HG SER A 56 -4.600 4.528 -20.241 1.00 0.00 H new ATOM 934 N ASP A 57 -5.372 6.387 -17.323 1.00 0.00 N ATOM 935 CA ASP A 57 -6.475 7.329 -17.169 1.00 0.00 C ATOM 936 C ASP A 57 -7.306 7.406 -18.445 1.00 0.00 C ATOM 937 O ASP A 57 -8.224 8.220 -18.552 1.00 0.00 O ATOM 938 CB ASP A 57 -5.941 8.716 -16.808 1.00 0.00 C ATOM 939 CG ASP A 57 -6.873 9.472 -15.880 1.00 0.00 C ATOM 940 OD1 ASP A 57 -7.996 9.808 -16.311 1.00 0.00 O ATOM 941 OD2 ASP A 57 -6.479 9.725 -14.722 1.00 0.00 O ATOM 0 H ASP A 57 -4.604 6.727 -17.902 1.00 0.00 H new ATOM 0 HA ASP A 57 -7.115 6.973 -16.362 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -4.965 8.614 -16.334 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -5.794 9.294 -17.720 1.00 0.00 H new ATOM 946 N ASP A 58 -6.977 6.556 -19.412 1.00 0.00 N ATOM 947 CA ASP A 58 -7.693 6.528 -20.682 1.00 0.00 C ATOM 948 C ASP A 58 -9.200 6.459 -20.455 1.00 0.00 C ATOM 949 O ASP A 58 -9.662 5.905 -19.458 1.00 0.00 O ATOM 950 CB ASP A 58 -7.236 5.335 -21.523 1.00 0.00 C ATOM 951 CG ASP A 58 -7.851 5.334 -22.908 1.00 0.00 C ATOM 952 OD1 ASP A 58 -7.602 6.293 -23.668 1.00 0.00 O ATOM 953 OD2 ASP A 58 -8.581 4.374 -23.233 1.00 0.00 O ATOM 0 H ASP A 58 -6.219 5.877 -19.340 1.00 0.00 H new ATOM 0 HA ASP A 58 -7.467 7.449 -21.219 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -6.150 5.351 -21.611 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -7.501 4.410 -21.010 1.00 0.00 H new ATOM 958 N ALA A 59 -9.960 7.025 -21.387 1.00 0.00 N ATOM 959 CA ALA A 59 -11.414 7.026 -21.289 1.00 0.00 C ATOM 960 C ALA A 59 -11.972 5.609 -21.375 1.00 0.00 C ATOM 961 O ALA A 59 -11.513 4.800 -22.181 1.00 0.00 O ATOM 962 CB ALA A 59 -12.016 7.900 -22.380 1.00 0.00 C ATOM 0 H ALA A 59 -9.593 7.488 -22.218 1.00 0.00 H new ATOM 0 HA ALA A 59 -11.687 7.437 -20.317 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -13.103 7.891 -22.295 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -11.651 8.921 -22.271 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -11.726 7.514 -23.357 1.00 0.00 H new ATOM 968 N ALA A 60 -12.963 5.316 -20.540 1.00 0.00 N ATOM 969 CA ALA A 60 -13.583 3.998 -20.524 1.00 0.00 C ATOM 970 C ALA A 60 -15.087 4.096 -20.755 1.00 0.00 C ATOM 971 O ALA A 60 -15.710 5.106 -20.429 1.00 0.00 O ATOM 972 CB ALA A 60 -13.295 3.295 -19.205 1.00 0.00 C ATOM 0 H ALA A 60 -13.354 5.974 -19.866 1.00 0.00 H new ATOM 0 HA ALA A 60 -13.154 3.412 -21.337 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -13.764 2.311 -19.207 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -12.218 3.183 -19.080 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -13.696 3.887 -18.382 1.00 0.00 H new ATOM 978 N GLU A 61 -15.665 3.040 -21.321 1.00 0.00 N ATOM 979 CA GLU A 61 -17.096 3.010 -21.597 1.00 0.00 C ATOM 980 C GLU A 61 -17.899 2.959 -20.300 1.00 0.00 C ATOM 981 O GLU A 61 -19.104 3.210 -20.294 1.00 0.00 O ATOM 982 CB GLU A 61 -17.444 1.804 -22.473 1.00 0.00 C ATOM 983 CG GLU A 61 -17.048 1.976 -23.930 1.00 0.00 C ATOM 984 CD GLU A 61 -18.163 2.564 -24.772 1.00 0.00 C ATOM 985 OE1 GLU A 61 -18.958 3.361 -24.232 1.00 0.00 O ATOM 986 OE2 GLU A 61 -18.240 2.226 -25.972 1.00 0.00 O ATOM 0 H GLU A 61 -15.164 2.195 -21.597 1.00 0.00 H new ATOM 0 HA GLU A 61 -17.357 3.924 -22.130 1.00 0.00 H new ATOM 0 HB2 GLU A 61 -16.949 0.920 -22.072 1.00 0.00 H new ATOM 0 HB3 GLU A 61 -18.517 1.622 -22.416 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -16.172 2.622 -23.991 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -16.759 1.009 -24.341 1.00 0.00 H new ATOM 993 N ALA A 62 -17.223 2.631 -19.205 1.00 0.00 N ATOM 994 CA ALA A 62 -17.872 2.548 -17.902 1.00 0.00 C ATOM 995 C ALA A 62 -16.844 2.543 -16.776 1.00 0.00 C ATOM 996 O ALA A 62 -15.665 2.263 -16.997 1.00 0.00 O ATOM 997 CB ALA A 62 -18.746 1.306 -17.826 1.00 0.00 C ATOM 0 H ALA A 62 -16.226 2.418 -19.194 1.00 0.00 H new ATOM 0 HA ALA A 62 -18.501 3.430 -17.780 1.00 0.00 H new ATOM 0 HB1 ALA A 62 -19.224 1.257 -16.848 1.00 0.00 H new ATOM 0 HB2 ALA A 62 -19.510 1.351 -18.602 1.00 0.00 H new ATOM 0 HB3 ALA A 62 -18.131 0.419 -17.974 1.00 0.00 H new ATOM 1003 N THR A 63 -17.297 2.856 -15.566 1.00 0.00 N ATOM 1004 CA THR A 63 -16.416 2.890 -14.405 1.00 0.00 C ATOM 1005 C THR A 63 -16.918 1.959 -13.307 1.00 0.00 C ATOM 1006 O THR A 63 -18.055 2.079 -12.849 1.00 0.00 O ATOM 1007 CB THR A 63 -16.291 4.315 -13.836 1.00 0.00 C ATOM 1008 OG1 THR A 63 -16.464 5.278 -14.882 1.00 0.00 O ATOM 1009 CG2 THR A 63 -14.936 4.517 -13.173 1.00 0.00 C ATOM 0 H THR A 63 -18.269 3.090 -15.365 1.00 0.00 H new ATOM 0 HA THR A 63 -15.435 2.554 -14.743 1.00 0.00 H new ATOM 0 HB THR A 63 -17.069 4.451 -13.085 1.00 0.00 H new ATOM 0 HG1 THR A 63 -16.385 6.182 -14.511 1.00 0.00 H new ATOM 0 HG21 THR A 63 -14.871 5.531 -12.779 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.820 3.803 -12.358 1.00 0.00 H new ATOM 0 HG23 THR A 63 -14.145 4.362 -13.907 1.00 0.00 H new ATOM 1017 N LEU A 64 -16.064 1.031 -12.888 1.00 0.00 N ATOM 1018 CA LEU A 64 -16.421 0.079 -11.842 1.00 0.00 C ATOM 1019 C LEU A 64 -15.672 0.385 -10.549 1.00 0.00 C ATOM 1020 O LEU A 64 -14.465 0.166 -10.450 1.00 0.00 O ATOM 1021 CB LEU A 64 -16.113 -1.348 -12.297 1.00 0.00 C ATOM 1022 CG LEU A 64 -17.129 -1.983 -13.248 1.00 0.00 C ATOM 1023 CD1 LEU A 64 -16.501 -2.234 -14.610 1.00 0.00 C ATOM 1024 CD2 LEU A 64 -17.670 -3.279 -12.661 1.00 0.00 C ATOM 0 H LEU A 64 -15.120 0.918 -13.257 1.00 0.00 H new ATOM 0 HA LEU A 64 -17.490 0.170 -11.652 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -15.138 -1.350 -12.785 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -16.029 -1.980 -11.413 1.00 0.00 H new ATOM 0 HG LEU A 64 -17.961 -1.290 -13.377 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -17.239 -2.686 -15.273 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -16.163 -1.289 -15.034 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -15.651 -2.907 -14.500 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -18.391 -3.717 -13.350 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -16.848 -3.978 -12.503 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -18.158 -3.071 -11.709 1.00 0.00 H new ATOM 1036 N THR A 65 -16.398 0.892 -9.556 1.00 0.00 N ATOM 1037 CA THR A 65 -15.803 1.227 -8.269 1.00 0.00 C ATOM 1038 C THR A 65 -16.056 0.128 -7.244 1.00 0.00 C ATOM 1039 O THR A 65 -17.202 -0.181 -6.921 1.00 0.00 O ATOM 1040 CB THR A 65 -16.356 2.558 -7.724 1.00 0.00 C ATOM 1041 OG1 THR A 65 -16.451 3.519 -8.782 1.00 0.00 O ATOM 1042 CG2 THR A 65 -15.465 3.101 -6.617 1.00 0.00 C ATOM 0 H THR A 65 -17.399 1.079 -9.620 1.00 0.00 H new ATOM 0 HA THR A 65 -14.730 1.327 -8.433 1.00 0.00 H new ATOM 0 HB THR A 65 -17.348 2.373 -7.312 1.00 0.00 H new ATOM 0 HG1 THR A 65 -16.949 4.303 -8.468 1.00 0.00 H new ATOM 0 HG21 THR A 65 -15.875 4.041 -6.248 1.00 0.00 H new ATOM 0 HG22 THR A 65 -15.418 2.380 -5.801 1.00 0.00 H new ATOM 0 HG23 THR A 65 -14.462 3.272 -7.008 1.00 0.00 H new ATOM 1050 N MET A 66 -14.978 -0.460 -6.735 1.00 0.00 N ATOM 1051 CA MET A 66 -15.083 -1.525 -5.745 1.00 0.00 C ATOM 1052 C MET A 66 -13.881 -1.515 -4.806 1.00 0.00 C ATOM 1053 O MET A 66 -12.737 -1.429 -5.250 1.00 0.00 O ATOM 1054 CB MET A 66 -15.195 -2.885 -6.436 1.00 0.00 C ATOM 1055 CG MET A 66 -16.549 -3.130 -7.081 1.00 0.00 C ATOM 1056 SD MET A 66 -16.523 -2.884 -8.867 1.00 0.00 S ATOM 1057 CE MET A 66 -16.255 -4.560 -9.436 1.00 0.00 C ATOM 0 H MET A 66 -14.021 -0.217 -6.992 1.00 0.00 H new ATOM 0 HA MET A 66 -15.983 -1.351 -5.156 1.00 0.00 H new ATOM 0 HB2 MET A 66 -14.420 -2.961 -7.198 1.00 0.00 H new ATOM 0 HB3 MET A 66 -15.002 -3.671 -5.706 1.00 0.00 H new ATOM 0 HG2 MET A 66 -16.872 -4.148 -6.863 1.00 0.00 H new ATOM 0 HG3 MET A 66 -17.285 -2.460 -6.637 1.00 0.00 H new ATOM 0 HE1 MET A 66 -15.337 -4.603 -10.023 1.00 0.00 H new ATOM 0 HE2 MET A 66 -16.168 -5.226 -8.578 1.00 0.00 H new ATOM 0 HE3 MET A 66 -17.096 -4.873 -10.055 1.00 0.00 H new ATOM 1067 N GLU A 67 -14.149 -1.605 -3.507 1.00 0.00 N ATOM 1068 CA GLU A 67 -13.088 -1.606 -2.507 1.00 0.00 C ATOM 1069 C GLU A 67 -12.064 -2.698 -2.801 1.00 0.00 C ATOM 1070 O GLU A 67 -12.332 -3.625 -3.565 1.00 0.00 O ATOM 1071 CB GLU A 67 -13.675 -1.805 -1.108 1.00 0.00 C ATOM 1072 CG GLU A 67 -13.648 -0.550 -0.252 1.00 0.00 C ATOM 1073 CD GLU A 67 -14.080 -0.810 1.178 1.00 0.00 C ATOM 1074 OE1 GLU A 67 -15.272 -1.112 1.393 1.00 0.00 O ATOM 1075 OE2 GLU A 67 -13.225 -0.710 2.083 1.00 0.00 O ATOM 0 H GLU A 67 -15.091 -1.678 -3.123 1.00 0.00 H new ATOM 0 HA GLU A 67 -12.585 -0.640 -2.548 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -14.705 -2.149 -1.201 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -13.120 -2.594 -0.599 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -12.640 -0.135 -0.253 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -14.302 0.201 -0.694 1.00 0.00 H new ATOM 1082 N ASP A 68 -10.891 -2.581 -2.189 1.00 0.00 N ATOM 1083 CA ASP A 68 -9.826 -3.557 -2.383 1.00 0.00 C ATOM 1084 C ASP A 68 -10.192 -4.895 -1.747 1.00 0.00 C ATOM 1085 O ASP A 68 -10.164 -5.935 -2.405 1.00 0.00 O ATOM 1086 CB ASP A 68 -8.515 -3.039 -1.791 1.00 0.00 C ATOM 1087 CG ASP A 68 -7.353 -3.980 -2.044 1.00 0.00 C ATOM 1088 OD1 ASP A 68 -7.589 -5.086 -2.575 1.00 0.00 O ATOM 1089 OD2 ASP A 68 -6.207 -3.610 -1.712 1.00 0.00 O ATOM 0 H ASP A 68 -10.654 -1.819 -1.554 1.00 0.00 H new ATOM 0 HA ASP A 68 -9.697 -3.708 -3.455 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -8.288 -2.063 -2.219 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -8.636 -2.896 -0.717 1.00 0.00 H new ATOM 1094 N ASP A 69 -10.534 -4.860 -0.464 1.00 0.00 N ATOM 1095 CA ASP A 69 -10.906 -6.069 0.261 1.00 0.00 C ATOM 1096 C ASP A 69 -12.163 -6.695 -0.335 1.00 0.00 C ATOM 1097 O ASP A 69 -12.352 -7.910 -0.273 1.00 0.00 O ATOM 1098 CB ASP A 69 -11.131 -5.753 1.741 1.00 0.00 C ATOM 1099 CG ASP A 69 -10.205 -6.539 2.648 1.00 0.00 C ATOM 1100 OD1 ASP A 69 -9.891 -7.700 2.312 1.00 0.00 O ATOM 1101 OD2 ASP A 69 -9.794 -5.993 3.693 1.00 0.00 O ATOM 0 H ASP A 69 -10.561 -4.008 0.095 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.088 -6.784 0.170 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -10.980 -4.687 1.909 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -12.166 -5.974 2.003 1.00 0.00 H new ATOM 1106 N ILE A 70 -13.020 -5.857 -0.909 1.00 0.00 N ATOM 1107 CA ILE A 70 -14.259 -6.329 -1.515 1.00 0.00 C ATOM 1108 C ILE A 70 -14.011 -6.878 -2.916 1.00 0.00 C ATOM 1109 O ILE A 70 -14.443 -7.982 -3.247 1.00 0.00 O ATOM 1110 CB ILE A 70 -15.310 -5.206 -1.594 1.00 0.00 C ATOM 1111 CG1 ILE A 70 -15.303 -4.379 -0.307 1.00 0.00 C ATOM 1112 CG2 ILE A 70 -16.692 -5.791 -1.847 1.00 0.00 C ATOM 1113 CD1 ILE A 70 -15.746 -5.156 0.913 1.00 0.00 C ATOM 0 H ILE A 70 -12.879 -4.848 -0.967 1.00 0.00 H new ATOM 0 HA ILE A 70 -14.639 -7.127 -0.877 1.00 0.00 H new ATOM 0 HB ILE A 70 -15.057 -4.549 -2.426 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -14.297 -3.994 -0.137 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -15.957 -3.516 -0.435 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -17.424 -4.985 -1.900 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -16.688 -6.340 -2.788 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -16.955 -6.467 -1.034 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -15.716 -4.507 1.788 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -16.763 -5.518 0.764 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -15.078 -6.004 1.067 1.00 0.00 H new ATOM 1125 N MET A 71 -13.311 -6.100 -3.735 1.00 0.00 N ATOM 1126 CA MET A 71 -13.003 -6.510 -5.100 1.00 0.00 C ATOM 1127 C MET A 71 -12.287 -7.857 -5.115 1.00 0.00 C ATOM 1128 O MET A 71 -12.417 -8.630 -6.064 1.00 0.00 O ATOM 1129 CB MET A 71 -12.139 -5.453 -5.790 1.00 0.00 C ATOM 1130 CG MET A 71 -11.855 -5.759 -7.252 1.00 0.00 C ATOM 1131 SD MET A 71 -13.028 -4.965 -8.368 1.00 0.00 S ATOM 1132 CE MET A 71 -11.912 -4.162 -9.517 1.00 0.00 C ATOM 0 H MET A 71 -12.947 -5.183 -3.477 1.00 0.00 H new ATOM 0 HA MET A 71 -13.943 -6.612 -5.643 1.00 0.00 H new ATOM 0 HB2 MET A 71 -12.637 -4.486 -5.720 1.00 0.00 H new ATOM 0 HB3 MET A 71 -11.193 -5.364 -5.256 1.00 0.00 H new ATOM 0 HG2 MET A 71 -10.845 -5.430 -7.499 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.886 -6.838 -7.406 1.00 0.00 H new ATOM 0 HE1 MET A 71 -11.942 -3.084 -9.360 1.00 0.00 H new ATOM 0 HE2 MET A 71 -10.897 -4.525 -9.352 1.00 0.00 H new ATOM 0 HE3 MET A 71 -12.217 -4.389 -10.539 1.00 0.00 H new ATOM 1142 N PHE A 72 -11.530 -8.131 -4.058 1.00 0.00 N ATOM 1143 CA PHE A 72 -10.792 -9.384 -3.950 1.00 0.00 C ATOM 1144 C PHE A 72 -11.746 -10.565 -3.791 1.00 0.00 C ATOM 1145 O PHE A 72 -11.575 -11.605 -4.426 1.00 0.00 O ATOM 1146 CB PHE A 72 -9.826 -9.331 -2.765 1.00 0.00 C ATOM 1147 CG PHE A 72 -8.624 -10.217 -2.932 1.00 0.00 C ATOM 1148 CD1 PHE A 72 -7.894 -10.202 -4.109 1.00 0.00 C ATOM 1149 CD2 PHE A 72 -8.225 -11.065 -1.911 1.00 0.00 C ATOM 1150 CE1 PHE A 72 -6.787 -11.016 -4.266 1.00 0.00 C ATOM 1151 CE2 PHE A 72 -7.119 -11.880 -2.061 1.00 0.00 C ATOM 1152 CZ PHE A 72 -6.400 -11.857 -3.241 1.00 0.00 C ATOM 0 H PHE A 72 -11.411 -7.502 -3.264 1.00 0.00 H new ATOM 0 HA PHE A 72 -10.222 -9.521 -4.869 1.00 0.00 H new ATOM 0 HB2 PHE A 72 -9.493 -8.303 -2.624 1.00 0.00 H new ATOM 0 HB3 PHE A 72 -10.358 -9.621 -1.859 1.00 0.00 H new ATOM 0 HD1 PHE A 72 -8.193 -9.547 -4.914 1.00 0.00 H new ATOM 0 HD2 PHE A 72 -8.785 -11.089 -0.988 1.00 0.00 H new ATOM 0 HE1 PHE A 72 -6.226 -10.994 -5.189 1.00 0.00 H new ATOM 0 HE2 PHE A 72 -6.817 -12.534 -1.257 1.00 0.00 H new ATOM 0 HZ PHE A 72 -5.537 -12.495 -3.361 1.00 0.00 H new ATOM 1162 N ALA A 73 -12.750 -10.395 -2.937 1.00 0.00 N ATOM 1163 CA ALA A 73 -13.732 -11.445 -2.694 1.00 0.00 C ATOM 1164 C ALA A 73 -14.435 -11.848 -3.986 1.00 0.00 C ATOM 1165 O ALA A 73 -14.577 -13.035 -4.282 1.00 0.00 O ATOM 1166 CB ALA A 73 -14.748 -10.988 -1.658 1.00 0.00 C ATOM 0 H ALA A 73 -12.905 -9.540 -2.402 1.00 0.00 H new ATOM 0 HA ALA A 73 -13.206 -12.319 -2.309 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -15.475 -11.782 -1.487 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -14.236 -10.757 -0.724 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -15.262 -10.098 -2.020 1.00 0.00 H new ATOM 1172 N ILE A 74 -14.873 -10.854 -4.751 1.00 0.00 N ATOM 1173 CA ILE A 74 -15.561 -11.106 -6.011 1.00 0.00 C ATOM 1174 C ILE A 74 -14.570 -11.437 -7.122 1.00 0.00 C ATOM 1175 O ILE A 74 -14.865 -12.230 -8.015 1.00 0.00 O ATOM 1176 CB ILE A 74 -16.411 -9.896 -6.440 1.00 0.00 C ATOM 1177 CG1 ILE A 74 -17.212 -9.360 -5.252 1.00 0.00 C ATOM 1178 CG2 ILE A 74 -17.340 -10.280 -7.583 1.00 0.00 C ATOM 1179 CD1 ILE A 74 -17.938 -8.067 -5.547 1.00 0.00 C ATOM 0 H ILE A 74 -14.764 -9.866 -4.520 1.00 0.00 H new ATOM 0 HA ILE A 74 -16.217 -11.961 -5.847 1.00 0.00 H new ATOM 0 HB ILE A 74 -15.744 -9.108 -6.789 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -17.938 -10.113 -4.944 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -16.538 -9.205 -4.410 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -17.934 -9.414 -7.875 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -16.749 -10.619 -8.434 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -18.003 -11.083 -7.259 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -18.485 -7.746 -4.660 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -17.216 -7.300 -5.826 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -18.638 -8.222 -6.368 1.00 0.00 H new ATOM 1191 N GLY A 75 -13.391 -10.826 -7.058 1.00 0.00 N ATOM 1192 CA GLY A 75 -12.373 -11.069 -8.063 1.00 0.00 C ATOM 1193 C GLY A 75 -11.927 -12.518 -8.097 1.00 0.00 C ATOM 1194 O GLY A 75 -11.557 -13.037 -9.150 1.00 0.00 O ATOM 0 H GLY A 75 -13.123 -10.167 -6.327 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -12.759 -10.788 -9.043 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -11.512 -10.431 -7.865 1.00 0.00 H new ATOM 1198 N THR A 76 -11.960 -13.173 -6.941 1.00 0.00 N ATOM 1199 CA THR A 76 -11.553 -14.569 -6.842 1.00 0.00 C ATOM 1200 C THR A 76 -12.764 -15.496 -6.849 1.00 0.00 C ATOM 1201 O THR A 76 -12.627 -16.712 -6.718 1.00 0.00 O ATOM 1202 CB THR A 76 -10.732 -14.826 -5.564 1.00 0.00 C ATOM 1203 OG1 THR A 76 -10.316 -16.195 -5.516 1.00 0.00 O ATOM 1204 CG2 THR A 76 -11.545 -14.493 -4.322 1.00 0.00 C ATOM 0 H THR A 76 -12.264 -12.759 -6.060 1.00 0.00 H new ATOM 0 HA THR A 76 -10.932 -14.780 -7.712 1.00 0.00 H new ATOM 0 HB THR A 76 -9.854 -14.181 -5.587 1.00 0.00 H new ATOM 0 HG1 THR A 76 -11.006 -16.761 -5.921 1.00 0.00 H new ATOM 0 HG21 THR A 76 -10.944 -14.682 -3.432 1.00 0.00 H new ATOM 0 HG22 THR A 76 -11.834 -13.442 -4.347 1.00 0.00 H new ATOM 0 HG23 THR A 76 -12.440 -15.115 -4.295 1.00 0.00 H new ATOM 1212 N GLY A 77 -13.949 -14.913 -7.003 1.00 0.00 N ATOM 1213 CA GLY A 77 -15.166 -15.703 -7.025 1.00 0.00 C ATOM 1214 C GLY A 77 -15.714 -15.962 -5.635 1.00 0.00 C ATOM 1215 O GLY A 77 -16.834 -16.450 -5.483 1.00 0.00 O ATOM 0 H GLY A 77 -14.088 -13.908 -7.113 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -15.920 -15.187 -7.619 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -14.969 -16.655 -7.518 1.00 0.00 H new ATOM 1219 N ALA A 78 -14.923 -15.637 -4.618 1.00 0.00 N ATOM 1220 CA ALA A 78 -15.335 -15.838 -3.235 1.00 0.00 C ATOM 1221 C ALA A 78 -16.761 -15.347 -3.010 1.00 0.00 C ATOM 1222 O ALA A 78 -17.690 -16.145 -2.882 1.00 0.00 O ATOM 1223 CB ALA A 78 -14.376 -15.129 -2.290 1.00 0.00 C ATOM 0 H ALA A 78 -13.993 -15.233 -4.726 1.00 0.00 H new ATOM 0 HA ALA A 78 -15.309 -16.908 -3.026 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -14.696 -15.288 -1.260 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -13.371 -15.530 -2.423 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -14.373 -14.061 -2.508 1.00 0.00 H new ATOM 1229 N LEU A 79 -16.928 -14.030 -2.963 1.00 0.00 N ATOM 1230 CA LEU A 79 -18.242 -13.432 -2.753 1.00 0.00 C ATOM 1231 C LEU A 79 -18.912 -13.108 -4.085 1.00 0.00 C ATOM 1232 O LEU A 79 -18.263 -12.716 -5.055 1.00 0.00 O ATOM 1233 CB LEU A 79 -18.117 -12.162 -1.909 1.00 0.00 C ATOM 1234 CG LEU A 79 -18.184 -12.355 -0.394 1.00 0.00 C ATOM 1235 CD1 LEU A 79 -17.657 -11.121 0.324 1.00 0.00 C ATOM 1236 CD2 LEU A 79 -19.609 -12.660 0.043 1.00 0.00 C ATOM 0 H LEU A 79 -16.170 -13.356 -3.067 1.00 0.00 H new ATOM 0 HA LEU A 79 -18.862 -14.154 -2.222 1.00 0.00 H new ATOM 0 HB2 LEU A 79 -17.170 -11.680 -2.152 1.00 0.00 H new ATOM 0 HB3 LEU A 79 -18.910 -11.475 -2.203 1.00 0.00 H new ATOM 0 HG LEU A 79 -17.554 -13.204 -0.127 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -17.712 -11.276 1.402 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -16.621 -10.947 0.035 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -18.260 -10.255 0.050 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -19.637 -12.794 1.124 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -20.260 -11.832 -0.237 1.00 0.00 H new ATOM 0 HD23 LEU A 79 -19.952 -13.572 -0.445 1.00 0.00 H new ATOM 1248 N PRO A 80 -20.242 -13.273 -4.134 1.00 0.00 N ATOM 1249 CA PRO A 80 -21.029 -13.001 -5.340 1.00 0.00 C ATOM 1250 C PRO A 80 -21.104 -11.512 -5.660 1.00 0.00 C ATOM 1251 O PRO A 80 -21.471 -10.702 -4.809 1.00 0.00 O ATOM 1252 CB PRO A 80 -22.417 -13.542 -4.987 1.00 0.00 C ATOM 1253 CG PRO A 80 -22.480 -13.483 -3.500 1.00 0.00 C ATOM 1254 CD PRO A 80 -21.080 -13.738 -3.015 1.00 0.00 C ATOM 0 HA PRO A 80 -20.589 -13.460 -6.225 1.00 0.00 H new ATOM 0 HB2 PRO A 80 -23.204 -12.939 -5.441 1.00 0.00 H new ATOM 0 HB3 PRO A 80 -22.548 -14.562 -5.349 1.00 0.00 H new ATOM 0 HG2 PRO A 80 -22.838 -12.510 -3.163 1.00 0.00 H new ATOM 0 HG3 PRO A 80 -23.171 -14.230 -3.109 1.00 0.00 H new ATOM 0 HD2 PRO A 80 -20.866 -13.189 -2.098 1.00 0.00 H new ATOM 0 HD3 PRO A 80 -20.915 -14.794 -2.801 1.00 0.00 H new ATOM 1262 N ALA A 81 -20.754 -11.158 -6.892 1.00 0.00 N ATOM 1263 CA ALA A 81 -20.784 -9.766 -7.325 1.00 0.00 C ATOM 1264 C ALA A 81 -22.180 -9.173 -7.170 1.00 0.00 C ATOM 1265 O ALA A 81 -22.337 -7.963 -7.007 1.00 0.00 O ATOM 1266 CB ALA A 81 -20.317 -9.652 -8.768 1.00 0.00 C ATOM 0 H ALA A 81 -20.446 -11.816 -7.608 1.00 0.00 H new ATOM 0 HA ALA A 81 -20.104 -9.199 -6.689 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -20.345 -8.607 -9.078 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -19.297 -10.028 -8.851 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -20.974 -10.238 -9.410 1.00 0.00 H new ATOM 1272 N LYS A 82 -23.192 -10.033 -7.221 1.00 0.00 N ATOM 1273 CA LYS A 82 -24.576 -9.595 -7.086 1.00 0.00 C ATOM 1274 C LYS A 82 -24.837 -9.041 -5.689 1.00 0.00 C ATOM 1275 O LYS A 82 -25.251 -7.893 -5.535 1.00 0.00 O ATOM 1276 CB LYS A 82 -25.530 -10.756 -7.373 1.00 0.00 C ATOM 1277 CG LYS A 82 -25.137 -11.582 -8.586 1.00 0.00 C ATOM 1278 CD LYS A 82 -24.483 -12.892 -8.180 1.00 0.00 C ATOM 1279 CE LYS A 82 -23.576 -13.426 -9.277 1.00 0.00 C ATOM 1280 NZ LYS A 82 -23.859 -14.855 -9.585 1.00 0.00 N ATOM 0 H LYS A 82 -23.079 -11.038 -7.355 1.00 0.00 H new ATOM 0 HA LYS A 82 -24.752 -8.801 -7.811 1.00 0.00 H new ATOM 0 HB2 LYS A 82 -25.571 -11.406 -6.499 1.00 0.00 H new ATOM 0 HB3 LYS A 82 -26.535 -10.361 -7.523 1.00 0.00 H new ATOM 0 HG2 LYS A 82 -26.021 -11.787 -9.190 1.00 0.00 H new ATOM 0 HG3 LYS A 82 -24.451 -11.010 -9.210 1.00 0.00 H new ATOM 0 HD2 LYS A 82 -23.904 -12.744 -7.268 1.00 0.00 H new ATOM 0 HD3 LYS A 82 -25.253 -13.629 -7.952 1.00 0.00 H new ATOM 0 HE2 LYS A 82 -23.706 -12.828 -10.179 1.00 0.00 H new ATOM 0 HE3 LYS A 82 -22.535 -13.320 -8.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 -23.220 -15.181 -10.338 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 -23.710 -15.430 -8.731 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 -24.845 -14.953 -9.901 1.00 0.00 H new ATOM 1294 N GLU A 83 -24.591 -9.865 -4.675 1.00 0.00 N ATOM 1295 CA GLU A 83 -24.800 -9.456 -3.291 1.00 0.00 C ATOM 1296 C GLU A 83 -24.035 -8.172 -2.982 1.00 0.00 C ATOM 1297 O GLU A 83 -24.614 -7.186 -2.528 1.00 0.00 O ATOM 1298 CB GLU A 83 -24.361 -10.567 -2.336 1.00 0.00 C ATOM 1299 CG GLU A 83 -25.164 -11.849 -2.483 1.00 0.00 C ATOM 1300 CD GLU A 83 -26.613 -11.680 -2.069 1.00 0.00 C ATOM 1301 OE1 GLU A 83 -26.857 -11.194 -0.946 1.00 0.00 O ATOM 1302 OE2 GLU A 83 -27.503 -12.035 -2.871 1.00 0.00 O ATOM 0 H GLU A 83 -24.247 -10.819 -4.786 1.00 0.00 H new ATOM 0 HA GLU A 83 -25.864 -9.267 -3.151 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -23.307 -10.787 -2.508 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -24.449 -10.209 -1.310 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -25.123 -12.182 -3.520 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -24.706 -12.632 -1.878 1.00 0.00 H new ATOM 1309 N ALA A 84 -22.729 -8.194 -3.231 1.00 0.00 N ATOM 1310 CA ALA A 84 -21.884 -7.033 -2.981 1.00 0.00 C ATOM 1311 C ALA A 84 -22.483 -5.775 -3.600 1.00 0.00 C ATOM 1312 O ALA A 84 -22.477 -4.708 -2.988 1.00 0.00 O ATOM 1313 CB ALA A 84 -20.483 -7.274 -3.521 1.00 0.00 C ATOM 0 H ALA A 84 -22.234 -9.003 -3.606 1.00 0.00 H new ATOM 0 HA ALA A 84 -21.825 -6.883 -1.903 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -19.863 -6.399 -3.327 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -20.048 -8.143 -3.028 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -20.533 -7.453 -4.595 1.00 0.00 H new ATOM 1319 N MET A 85 -22.998 -5.908 -4.818 1.00 0.00 N ATOM 1320 CA MET A 85 -23.601 -4.781 -5.520 1.00 0.00 C ATOM 1321 C MET A 85 -24.887 -4.336 -4.830 1.00 0.00 C ATOM 1322 O MET A 85 -25.194 -3.146 -4.777 1.00 0.00 O ATOM 1323 CB MET A 85 -23.891 -5.154 -6.975 1.00 0.00 C ATOM 1324 CG MET A 85 -22.940 -4.508 -7.969 1.00 0.00 C ATOM 1325 SD MET A 85 -23.727 -4.150 -9.551 1.00 0.00 S ATOM 1326 CE MET A 85 -24.474 -2.559 -9.205 1.00 0.00 C ATOM 0 H MET A 85 -23.010 -6.785 -5.339 1.00 0.00 H new ATOM 0 HA MET A 85 -22.893 -3.952 -5.500 1.00 0.00 H new ATOM 0 HB2 MET A 85 -23.835 -6.237 -7.082 1.00 0.00 H new ATOM 0 HB3 MET A 85 -24.912 -4.862 -7.220 1.00 0.00 H new ATOM 0 HG2 MET A 85 -22.550 -3.583 -7.544 1.00 0.00 H new ATOM 0 HG3 MET A 85 -22.088 -5.168 -8.133 1.00 0.00 H new ATOM 0 HE1 MET A 85 -25.000 -2.204 -10.091 1.00 0.00 H new ATOM 0 HE2 MET A 85 -25.179 -2.660 -8.380 1.00 0.00 H new ATOM 0 HE3 MET A 85 -23.698 -1.844 -8.933 1.00 0.00 H new ATOM 1336 N ALA A 86 -25.635 -5.301 -4.305 1.00 0.00 N ATOM 1337 CA ALA A 86 -26.886 -5.008 -3.617 1.00 0.00 C ATOM 1338 C ALA A 86 -26.629 -4.472 -2.213 1.00 0.00 C ATOM 1339 O ALA A 86 -27.502 -3.850 -1.607 1.00 0.00 O ATOM 1340 CB ALA A 86 -27.760 -6.252 -3.558 1.00 0.00 C ATOM 0 H ALA A 86 -25.396 -6.292 -4.343 1.00 0.00 H new ATOM 0 HA ALA A 86 -27.410 -4.236 -4.181 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -28.691 -6.018 -3.041 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -27.982 -6.589 -4.571 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -27.234 -7.041 -3.020 1.00 0.00 H new ATOM 1346 N GLN A 87 -25.428 -4.719 -1.701 1.00 0.00 N ATOM 1347 CA GLN A 87 -25.058 -4.263 -0.367 1.00 0.00 C ATOM 1348 C GLN A 87 -24.519 -2.836 -0.409 1.00 0.00 C ATOM 1349 O GLN A 87 -24.033 -2.316 0.595 1.00 0.00 O ATOM 1350 CB GLN A 87 -24.012 -5.197 0.243 1.00 0.00 C ATOM 1351 CG GLN A 87 -24.517 -6.614 0.464 1.00 0.00 C ATOM 1352 CD GLN A 87 -24.446 -7.039 1.918 1.00 0.00 C ATOM 1353 OE1 GLN A 87 -24.657 -6.231 2.823 1.00 0.00 O ATOM 1354 NE2 GLN A 87 -24.150 -8.312 2.149 1.00 0.00 N ATOM 0 H GLN A 87 -24.695 -5.232 -2.190 1.00 0.00 H new ATOM 0 HA GLN A 87 -25.953 -4.276 0.255 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -23.140 -5.229 -0.410 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -23.681 -4.785 1.196 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -25.548 -6.686 0.118 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -23.929 -7.304 -0.141 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -23.983 -8.947 1.368 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -24.090 -8.656 3.107 1.00 0.00 H new ATOM 1363 N ASP A 88 -24.609 -2.210 -1.578 1.00 0.00 N ATOM 1364 CA ASP A 88 -24.131 -0.843 -1.751 1.00 0.00 C ATOM 1365 C ASP A 88 -22.621 -0.766 -1.551 1.00 0.00 C ATOM 1366 O ASP A 88 -22.062 0.316 -1.370 1.00 0.00 O ATOM 1367 CB ASP A 88 -24.837 0.094 -0.770 1.00 0.00 C ATOM 1368 CG ASP A 88 -25.096 1.465 -1.364 1.00 0.00 C ATOM 1369 OD1 ASP A 88 -24.157 2.048 -1.944 1.00 0.00 O ATOM 1370 OD2 ASP A 88 -26.240 1.953 -1.251 1.00 0.00 O ATOM 0 H ASP A 88 -25.008 -2.627 -2.419 1.00 0.00 H new ATOM 0 HA ASP A 88 -24.360 -0.530 -2.770 1.00 0.00 H new ATOM 0 HB2 ASP A 88 -25.784 -0.351 -0.464 1.00 0.00 H new ATOM 0 HB3 ASP A 88 -24.229 0.199 0.129 1.00 0.00 H new ATOM 1375 N LYS A 89 -21.965 -1.921 -1.584 1.00 0.00 N ATOM 1376 CA LYS A 89 -20.519 -1.986 -1.406 1.00 0.00 C ATOM 1377 C LYS A 89 -19.801 -1.881 -2.748 1.00 0.00 C ATOM 1378 O LYS A 89 -18.572 -1.846 -2.803 1.00 0.00 O ATOM 1379 CB LYS A 89 -20.128 -3.290 -0.707 1.00 0.00 C ATOM 1380 CG LYS A 89 -20.563 -3.355 0.747 1.00 0.00 C ATOM 1381 CD LYS A 89 -20.116 -4.649 1.405 1.00 0.00 C ATOM 1382 CE LYS A 89 -20.512 -4.694 2.873 1.00 0.00 C ATOM 1383 NZ LYS A 89 -19.478 -5.367 3.706 1.00 0.00 N ATOM 0 H LYS A 89 -22.412 -2.826 -1.733 1.00 0.00 H new ATOM 0 HA LYS A 89 -20.216 -1.143 -0.784 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -20.568 -4.128 -1.247 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -19.046 -3.410 -0.760 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -20.147 -2.507 1.290 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -21.648 -3.271 0.807 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -20.559 -5.496 0.882 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -19.034 -4.749 1.316 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -20.668 -3.679 3.238 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -21.461 -5.220 2.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -19.785 -5.377 4.700 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -19.347 -6.344 3.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -18.579 -4.851 3.627 1.00 0.00 H new ATOM 1397 N MET A 90 -20.576 -1.830 -3.826 1.00 0.00 N ATOM 1398 CA MET A 90 -20.013 -1.726 -5.167 1.00 0.00 C ATOM 1399 C MET A 90 -20.968 -0.992 -6.103 1.00 0.00 C ATOM 1400 O MET A 90 -22.181 -1.196 -6.050 1.00 0.00 O ATOM 1401 CB MET A 90 -19.705 -3.117 -5.724 1.00 0.00 C ATOM 1402 CG MET A 90 -19.727 -3.184 -7.242 1.00 0.00 C ATOM 1403 SD MET A 90 -19.357 -4.833 -7.871 1.00 0.00 S ATOM 1404 CE MET A 90 -19.943 -4.691 -9.558 1.00 0.00 C ATOM 0 H MET A 90 -21.595 -1.859 -3.797 1.00 0.00 H new ATOM 0 HA MET A 90 -19.087 -1.155 -5.101 1.00 0.00 H new ATOM 0 HB2 MET A 90 -18.724 -3.432 -5.369 1.00 0.00 H new ATOM 0 HB3 MET A 90 -20.431 -3.827 -5.327 1.00 0.00 H new ATOM 0 HG2 MET A 90 -20.708 -2.874 -7.601 1.00 0.00 H new ATOM 0 HG3 MET A 90 -19.003 -2.475 -7.643 1.00 0.00 H new ATOM 0 HE1 MET A 90 -20.219 -5.677 -9.932 1.00 0.00 H new ATOM 0 HE2 MET A 90 -20.813 -4.036 -9.587 1.00 0.00 H new ATOM 0 HE3 MET A 90 -19.154 -4.274 -10.183 1.00 0.00 H new ATOM 1414 N GLU A 91 -20.414 -0.138 -6.957 1.00 0.00 N ATOM 1415 CA GLU A 91 -21.218 0.627 -7.903 1.00 0.00 C ATOM 1416 C GLU A 91 -20.548 0.675 -9.273 1.00 0.00 C ATOM 1417 O GLU A 91 -19.354 0.405 -9.402 1.00 0.00 O ATOM 1418 CB GLU A 91 -21.444 2.048 -7.383 1.00 0.00 C ATOM 1419 CG GLU A 91 -22.418 2.856 -8.223 1.00 0.00 C ATOM 1420 CD GLU A 91 -23.738 2.141 -8.435 1.00 0.00 C ATOM 1421 OE1 GLU A 91 -24.481 1.960 -7.448 1.00 0.00 O ATOM 1422 OE2 GLU A 91 -24.027 1.762 -9.590 1.00 0.00 O ATOM 0 H GLU A 91 -19.412 0.042 -7.013 1.00 0.00 H new ATOM 0 HA GLU A 91 -22.182 0.129 -8.007 1.00 0.00 H new ATOM 0 HB2 GLU A 91 -21.816 1.996 -6.360 1.00 0.00 H new ATOM 0 HB3 GLU A 91 -20.488 2.570 -7.349 1.00 0.00 H new ATOM 0 HG2 GLU A 91 -22.602 3.814 -7.738 1.00 0.00 H new ATOM 0 HG3 GLU A 91 -21.966 3.071 -9.191 1.00 0.00 H new ATOM 1429 N VAL A 92 -21.326 1.021 -10.294 1.00 0.00 N ATOM 1430 CA VAL A 92 -20.809 1.106 -11.654 1.00 0.00 C ATOM 1431 C VAL A 92 -21.433 2.275 -12.408 1.00 0.00 C ATOM 1432 O VAL A 92 -22.610 2.587 -12.226 1.00 0.00 O ATOM 1433 CB VAL A 92 -21.073 -0.194 -12.437 1.00 0.00 C ATOM 1434 CG1 VAL A 92 -20.104 -1.284 -12.005 1.00 0.00 C ATOM 1435 CG2 VAL A 92 -22.513 -0.645 -12.250 1.00 0.00 C ATOM 0 H VAL A 92 -22.317 1.247 -10.205 1.00 0.00 H new ATOM 0 HA VAL A 92 -19.733 1.262 -11.574 1.00 0.00 H new ATOM 0 HB VAL A 92 -20.912 0.002 -13.497 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -20.306 -2.195 -12.569 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -19.081 -0.958 -12.196 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -20.229 -1.481 -10.940 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -22.682 -1.565 -12.810 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -22.704 -0.824 -11.192 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -23.187 0.130 -12.614 1.00 0.00 H new ATOM 1445 N ASP A 93 -20.636 2.919 -13.254 1.00 0.00 N ATOM 1446 CA ASP A 93 -21.110 4.054 -14.037 1.00 0.00 C ATOM 1447 C ASP A 93 -20.924 3.801 -15.529 1.00 0.00 C ATOM 1448 O ASP A 93 -20.392 2.767 -15.932 1.00 0.00 O ATOM 1449 CB ASP A 93 -20.371 5.329 -13.627 1.00 0.00 C ATOM 1450 CG ASP A 93 -21.316 6.437 -13.206 1.00 0.00 C ATOM 1451 OD1 ASP A 93 -21.907 6.329 -12.111 1.00 0.00 O ATOM 1452 OD2 ASP A 93 -21.464 7.413 -13.971 1.00 0.00 O ATOM 0 H ASP A 93 -19.659 2.674 -13.415 1.00 0.00 H new ATOM 0 HA ASP A 93 -22.174 4.181 -13.838 1.00 0.00 H new ATOM 0 HB2 ASP A 93 -19.692 5.103 -12.805 1.00 0.00 H new ATOM 0 HB3 ASP A 93 -19.759 5.675 -14.460 1.00 0.00 H new ATOM 1457 N GLY A 94 -21.366 4.752 -16.346 1.00 0.00 N ATOM 1458 CA GLY A 94 -21.240 4.612 -17.785 1.00 0.00 C ATOM 1459 C GLY A 94 -22.400 3.854 -18.398 1.00 0.00 C ATOM 1460 O GLY A 94 -23.545 4.299 -18.330 1.00 0.00 O ATOM 0 H GLY A 94 -21.809 5.617 -16.037 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -21.176 5.601 -18.239 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -20.309 4.094 -18.016 1.00 0.00 H new ATOM 1464 N GLN A 95 -22.103 2.707 -19.000 1.00 0.00 N ATOM 1465 CA GLN A 95 -23.131 1.887 -19.630 1.00 0.00 C ATOM 1466 C GLN A 95 -23.513 0.711 -18.737 1.00 0.00 C ATOM 1467 O GLN A 95 -22.724 -0.214 -18.540 1.00 0.00 O ATOM 1468 CB GLN A 95 -22.645 1.375 -20.987 1.00 0.00 C ATOM 1469 CG GLN A 95 -23.641 1.599 -22.114 1.00 0.00 C ATOM 1470 CD GLN A 95 -24.022 3.058 -22.274 1.00 0.00 C ATOM 1471 OE1 GLN A 95 -23.293 3.838 -22.888 1.00 0.00 O ATOM 1472 NE2 GLN A 95 -25.169 3.435 -21.722 1.00 0.00 N ATOM 0 H GLN A 95 -21.160 2.325 -19.065 1.00 0.00 H new ATOM 0 HA GLN A 95 -24.014 2.508 -19.779 1.00 0.00 H new ATOM 0 HB2 GLN A 95 -21.707 1.870 -21.238 1.00 0.00 H new ATOM 0 HB3 GLN A 95 -22.431 0.309 -20.909 1.00 0.00 H new ATOM 0 HG2 GLN A 95 -23.215 1.234 -23.048 1.00 0.00 H new ATOM 0 HG3 GLN A 95 -24.539 1.012 -21.922 1.00 0.00 H new ATOM 0 HE21 GLN A 95 -25.742 2.755 -21.222 1.00 0.00 H new ATOM 0 HE22 GLN A 95 -25.477 4.404 -21.798 1.00 0.00 H new ATOM 1481 N VAL A 96 -24.727 0.752 -18.198 1.00 0.00 N ATOM 1482 CA VAL A 96 -25.213 -0.310 -17.326 1.00 0.00 C ATOM 1483 C VAL A 96 -25.549 -1.565 -18.123 1.00 0.00 C ATOM 1484 O VAL A 96 -25.644 -2.659 -17.567 1.00 0.00 O ATOM 1485 CB VAL A 96 -26.462 0.135 -16.541 1.00 0.00 C ATOM 1486 CG1 VAL A 96 -26.900 -0.952 -15.572 1.00 0.00 C ATOM 1487 CG2 VAL A 96 -26.190 1.439 -15.804 1.00 0.00 C ATOM 0 H VAL A 96 -25.392 1.510 -18.350 1.00 0.00 H new ATOM 0 HA VAL A 96 -24.411 -0.533 -16.623 1.00 0.00 H new ATOM 0 HB VAL A 96 -27.273 0.305 -17.249 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -27.783 -0.619 -15.027 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -27.137 -1.860 -16.127 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -26.094 -1.157 -14.867 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -27.082 1.739 -15.255 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -25.365 1.297 -15.106 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -25.928 2.215 -16.523 1.00 0.00 H new ATOM 1497 N GLU A 97 -25.728 -1.399 -19.430 1.00 0.00 N ATOM 1498 CA GLU A 97 -26.053 -2.520 -20.304 1.00 0.00 C ATOM 1499 C GLU A 97 -24.835 -3.412 -20.522 1.00 0.00 C ATOM 1500 O GLU A 97 -24.939 -4.639 -20.511 1.00 0.00 O ATOM 1501 CB GLU A 97 -26.574 -2.011 -21.650 1.00 0.00 C ATOM 1502 CG GLU A 97 -26.931 -3.122 -22.624 1.00 0.00 C ATOM 1503 CD GLU A 97 -27.867 -2.656 -23.722 1.00 0.00 C ATOM 1504 OE1 GLU A 97 -28.421 -1.544 -23.598 1.00 0.00 O ATOM 1505 OE2 GLU A 97 -28.046 -3.405 -24.705 1.00 0.00 O ATOM 0 H GLU A 97 -25.654 -0.500 -19.906 1.00 0.00 H new ATOM 0 HA GLU A 97 -26.831 -3.110 -19.821 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -27.455 -1.392 -21.479 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -25.818 -1.370 -22.104 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -26.018 -3.515 -23.072 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -27.397 -3.943 -22.078 1.00 0.00 H new ATOM 1512 N LEU A 98 -23.680 -2.787 -20.722 1.00 0.00 N ATOM 1513 CA LEU A 98 -22.440 -3.522 -20.944 1.00 0.00 C ATOM 1514 C LEU A 98 -21.892 -4.075 -19.631 1.00 0.00 C ATOM 1515 O LEU A 98 -21.530 -5.249 -19.544 1.00 0.00 O ATOM 1516 CB LEU A 98 -21.397 -2.617 -21.603 1.00 0.00 C ATOM 1517 CG LEU A 98 -21.333 -2.670 -23.130 1.00 0.00 C ATOM 1518 CD1 LEU A 98 -21.474 -1.275 -23.719 1.00 0.00 C ATOM 1519 CD2 LEU A 98 -20.033 -3.315 -23.587 1.00 0.00 C ATOM 0 H LEU A 98 -23.576 -1.772 -20.735 1.00 0.00 H new ATOM 0 HA LEU A 98 -22.657 -4.359 -21.608 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -21.596 -1.588 -21.303 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -20.415 -2.880 -21.209 1.00 0.00 H new ATOM 0 HG LEU A 98 -22.163 -3.279 -23.488 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -21.426 -1.333 -24.806 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -22.432 -0.849 -23.420 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -20.665 -0.642 -23.353 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -20.005 -3.344 -24.676 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -19.189 -2.733 -23.218 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -19.973 -4.330 -23.195 1.00 0.00 H new ATOM 1531 N ILE A 99 -21.837 -3.222 -18.614 1.00 0.00 N ATOM 1532 CA ILE A 99 -21.337 -3.627 -17.306 1.00 0.00 C ATOM 1533 C ILE A 99 -22.062 -4.870 -16.800 1.00 0.00 C ATOM 1534 O ILE A 99 -21.477 -5.705 -16.111 1.00 0.00 O ATOM 1535 CB ILE A 99 -21.494 -2.498 -16.269 1.00 0.00 C ATOM 1536 CG1 ILE A 99 -20.711 -1.259 -16.710 1.00 0.00 C ATOM 1537 CG2 ILE A 99 -21.027 -2.968 -14.900 1.00 0.00 C ATOM 1538 CD1 ILE A 99 -21.215 0.026 -16.091 1.00 0.00 C ATOM 0 H ILE A 99 -22.132 -2.247 -18.670 1.00 0.00 H new ATOM 0 HA ILE A 99 -20.278 -3.852 -17.430 1.00 0.00 H new ATOM 0 HB ILE A 99 -22.549 -2.232 -16.199 1.00 0.00 H new ATOM 0 HG12 ILE A 99 -19.661 -1.391 -16.449 1.00 0.00 H new ATOM 0 HG13 ILE A 99 -20.762 -1.174 -17.796 1.00 0.00 H new ATOM 0 HG21 ILE A 99 -21.144 -2.160 -14.178 1.00 0.00 H new ATOM 0 HG22 ILE A 99 -21.624 -3.824 -14.586 1.00 0.00 H new ATOM 0 HG23 ILE A 99 -19.978 -3.258 -14.953 1.00 0.00 H new ATOM 0 HD11 ILE A 99 -20.614 0.862 -16.448 1.00 0.00 H new ATOM 0 HD12 ILE A 99 -22.256 0.181 -16.373 1.00 0.00 H new ATOM 0 HD13 ILE A 99 -21.138 -0.038 -15.006 1.00 0.00 H new ATOM 1550 N PHE A 100 -23.339 -4.986 -17.149 1.00 0.00 N ATOM 1551 CA PHE A 100 -24.145 -6.128 -16.732 1.00 0.00 C ATOM 1552 C PHE A 100 -23.722 -7.392 -17.475 1.00 0.00 C ATOM 1553 O PHE A 100 -23.748 -8.491 -16.919 1.00 0.00 O ATOM 1554 CB PHE A 100 -25.629 -5.850 -16.979 1.00 0.00 C ATOM 1555 CG PHE A 100 -26.543 -6.634 -16.082 1.00 0.00 C ATOM 1556 CD1 PHE A 100 -26.897 -7.936 -16.399 1.00 0.00 C ATOM 1557 CD2 PHE A 100 -27.048 -6.070 -14.922 1.00 0.00 C ATOM 1558 CE1 PHE A 100 -27.739 -8.659 -15.576 1.00 0.00 C ATOM 1559 CE2 PHE A 100 -27.890 -6.789 -14.095 1.00 0.00 C ATOM 1560 CZ PHE A 100 -28.235 -8.086 -14.422 1.00 0.00 C ATOM 0 H PHE A 100 -23.838 -4.303 -17.719 1.00 0.00 H new ATOM 0 HA PHE A 100 -23.985 -6.284 -15.665 1.00 0.00 H new ATOM 0 HB2 PHE A 100 -25.819 -4.786 -16.838 1.00 0.00 H new ATOM 0 HB3 PHE A 100 -25.866 -6.081 -18.017 1.00 0.00 H new ATOM 0 HD1 PHE A 100 -26.510 -8.390 -17.299 1.00 0.00 H new ATOM 0 HD2 PHE A 100 -26.781 -5.057 -14.661 1.00 0.00 H new ATOM 0 HE1 PHE A 100 -28.009 -9.672 -15.835 1.00 0.00 H new ATOM 0 HE2 PHE A 100 -28.278 -6.337 -13.194 1.00 0.00 H new ATOM 0 HZ PHE A 100 -28.891 -8.651 -13.776 1.00 0.00 H new ATOM 1570 N LEU A 101 -23.333 -7.229 -18.734 1.00 0.00 N ATOM 1571 CA LEU A 101 -22.905 -8.356 -19.555 1.00 0.00 C ATOM 1572 C LEU A 101 -21.535 -8.861 -19.114 1.00 0.00 C ATOM 1573 O LEU A 101 -21.072 -9.908 -19.569 1.00 0.00 O ATOM 1574 CB LEU A 101 -22.861 -7.951 -21.030 1.00 0.00 C ATOM 1575 CG LEU A 101 -24.060 -8.377 -21.878 1.00 0.00 C ATOM 1576 CD1 LEU A 101 -24.059 -9.883 -22.086 1.00 0.00 C ATOM 1577 CD2 LEU A 101 -25.360 -7.927 -21.229 1.00 0.00 C ATOM 0 H LEU A 101 -23.305 -6.327 -19.209 1.00 0.00 H new ATOM 0 HA LEU A 101 -23.628 -9.162 -19.427 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -22.769 -6.866 -21.086 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -21.959 -8.371 -21.475 1.00 0.00 H new ATOM 0 HG LEU A 101 -23.979 -7.896 -22.853 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -24.920 -10.167 -22.692 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -23.142 -10.179 -22.596 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -24.114 -10.384 -21.119 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -26.202 -8.239 -21.847 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -25.448 -8.378 -20.241 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -25.362 -6.841 -21.134 1.00 0.00 H new ATOM 1589 N LEU A 102 -20.892 -8.112 -18.225 1.00 0.00 N ATOM 1590 CA LEU A 102 -19.575 -8.485 -17.720 1.00 0.00 C ATOM 1591 C LEU A 102 -19.695 -9.311 -16.444 1.00 0.00 C ATOM 1592 O LEU A 102 -18.887 -10.205 -16.194 1.00 0.00 O ATOM 1593 CB LEU A 102 -18.736 -7.234 -17.455 1.00 0.00 C ATOM 1594 CG LEU A 102 -18.112 -6.571 -18.683 1.00 0.00 C ATOM 1595 CD1 LEU A 102 -17.319 -5.338 -18.280 1.00 0.00 C ATOM 1596 CD2 LEU A 102 -17.224 -7.558 -19.429 1.00 0.00 C ATOM 0 H LEU A 102 -21.261 -7.243 -17.839 1.00 0.00 H new ATOM 0 HA LEU A 102 -19.081 -9.092 -18.478 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -19.364 -6.500 -16.951 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -17.936 -7.498 -16.763 1.00 0.00 H new ATOM 0 HG LEU A 102 -18.915 -6.259 -19.350 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -16.883 -4.880 -19.168 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -17.981 -4.623 -17.791 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -16.524 -5.626 -17.592 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -16.788 -7.069 -20.300 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -16.427 -7.901 -18.769 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -17.820 -8.411 -19.752 1.00 0.00 H new ATOM 1608 N GLU A 103 -20.710 -9.007 -15.641 1.00 0.00 N ATOM 1609 CA GLU A 103 -20.936 -9.723 -14.391 1.00 0.00 C ATOM 1610 C GLU A 103 -20.844 -11.231 -14.604 1.00 0.00 C ATOM 1611 O GLU A 103 -20.042 -11.923 -13.977 1.00 0.00 O ATOM 1612 CB GLU A 103 -22.305 -9.361 -13.811 1.00 0.00 C ATOM 1613 CG GLU A 103 -22.249 -8.277 -12.747 1.00 0.00 C ATOM 1614 CD GLU A 103 -23.165 -8.563 -11.574 1.00 0.00 C ATOM 1615 OE1 GLU A 103 -24.316 -8.987 -11.809 1.00 0.00 O ATOM 1616 OE2 GLU A 103 -22.731 -8.364 -10.420 1.00 0.00 O ATOM 0 H GLU A 103 -21.388 -8.270 -15.834 1.00 0.00 H new ATOM 0 HA GLU A 103 -20.160 -9.425 -13.686 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -22.957 -9.031 -14.620 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -22.757 -10.256 -13.383 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -21.225 -8.179 -12.388 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -22.524 -7.321 -13.193 1.00 0.00 H new ATOM 1623 N PRO A 104 -21.686 -11.753 -15.508 1.00 0.00 N ATOM 1624 CA PRO A 104 -21.719 -13.184 -15.825 1.00 0.00 C ATOM 1625 C PRO A 104 -20.473 -13.641 -16.575 1.00 0.00 C ATOM 1626 O PRO A 104 -20.299 -14.830 -16.844 1.00 0.00 O ATOM 1627 CB PRO A 104 -22.959 -13.322 -16.712 1.00 0.00 C ATOM 1628 CG PRO A 104 -23.139 -11.976 -17.323 1.00 0.00 C ATOM 1629 CD PRO A 104 -22.669 -10.987 -16.292 1.00 0.00 C ATOM 0 HA PRO A 104 -21.750 -13.800 -14.926 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -22.817 -14.087 -17.475 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -23.833 -13.612 -16.129 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -22.562 -11.885 -18.243 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -24.183 -11.802 -17.583 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -22.218 -10.109 -16.754 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -23.491 -10.633 -15.670 1.00 0.00 H new ATOM 1637 N PHE A 105 -19.608 -12.690 -16.911 1.00 0.00 N ATOM 1638 CA PHE A 105 -18.378 -12.995 -17.632 1.00 0.00 C ATOM 1639 C PHE A 105 -17.291 -13.474 -16.673 1.00 0.00 C ATOM 1640 O PHE A 105 -16.349 -14.157 -17.078 1.00 0.00 O ATOM 1641 CB PHE A 105 -17.891 -11.764 -18.398 1.00 0.00 C ATOM 1642 CG PHE A 105 -17.367 -12.079 -19.770 1.00 0.00 C ATOM 1643 CD1 PHE A 105 -18.208 -12.586 -20.747 1.00 0.00 C ATOM 1644 CD2 PHE A 105 -16.034 -11.869 -20.081 1.00 0.00 C ATOM 1645 CE1 PHE A 105 -17.728 -12.878 -22.010 1.00 0.00 C ATOM 1646 CE2 PHE A 105 -15.548 -12.159 -21.343 1.00 0.00 C ATOM 1647 CZ PHE A 105 -16.397 -12.663 -22.309 1.00 0.00 C ATOM 0 H PHE A 105 -19.736 -11.701 -16.695 1.00 0.00 H new ATOM 0 HA PHE A 105 -18.591 -13.794 -18.342 1.00 0.00 H new ATOM 0 HB2 PHE A 105 -18.712 -11.053 -18.486 1.00 0.00 H new ATOM 0 HB3 PHE A 105 -17.106 -11.275 -17.822 1.00 0.00 H new ATOM 0 HD1 PHE A 105 -19.250 -12.755 -20.519 1.00 0.00 H new ATOM 0 HD2 PHE A 105 -15.366 -11.474 -19.330 1.00 0.00 H new ATOM 0 HE1 PHE A 105 -18.394 -13.274 -22.763 1.00 0.00 H new ATOM 0 HE2 PHE A 105 -14.506 -11.992 -21.573 1.00 0.00 H new ATOM 0 HZ PHE A 105 -16.021 -12.888 -23.296 1.00 0.00 H new ATOM 1657 N ILE A 106 -17.429 -13.110 -15.403 1.00 0.00 N ATOM 1658 CA ILE A 106 -16.460 -13.503 -14.387 1.00 0.00 C ATOM 1659 C ILE A 106 -16.454 -15.014 -14.187 1.00 0.00 C ATOM 1660 O ILE A 106 -15.443 -15.595 -13.794 1.00 0.00 O ATOM 1661 CB ILE A 106 -16.750 -12.819 -13.038 1.00 0.00 C ATOM 1662 CG1 ILE A 106 -16.605 -11.301 -13.169 1.00 0.00 C ATOM 1663 CG2 ILE A 106 -15.818 -13.354 -11.961 1.00 0.00 C ATOM 1664 CD1 ILE A 106 -17.647 -10.526 -12.394 1.00 0.00 C ATOM 0 H ILE A 106 -18.202 -12.544 -15.053 1.00 0.00 H new ATOM 0 HA ILE A 106 -15.481 -13.183 -14.745 1.00 0.00 H new ATOM 0 HB ILE A 106 -17.776 -13.044 -12.747 1.00 0.00 H new ATOM 0 HG12 ILE A 106 -15.614 -11.008 -12.823 1.00 0.00 H new ATOM 0 HG13 ILE A 106 -16.669 -11.027 -14.222 1.00 0.00 H new ATOM 0 HG21 ILE A 106 -16.036 -12.861 -11.014 1.00 0.00 H new ATOM 0 HG22 ILE A 106 -15.966 -14.429 -11.853 1.00 0.00 H new ATOM 0 HG23 ILE A 106 -14.784 -13.157 -12.244 1.00 0.00 H new ATOM 0 HD11 ILE A 106 -17.483 -9.457 -12.533 1.00 0.00 H new ATOM 0 HD12 ILE A 106 -18.641 -10.791 -12.755 1.00 0.00 H new ATOM 0 HD13 ILE A 106 -17.569 -10.771 -11.335 1.00 0.00 H new ATOM 1676 N ALA A 107 -17.590 -15.646 -14.464 1.00 0.00 N ATOM 1677 CA ALA A 107 -17.715 -17.091 -14.318 1.00 0.00 C ATOM 1678 C ALA A 107 -16.692 -17.821 -15.183 1.00 0.00 C ATOM 1679 O ALA A 107 -16.068 -18.785 -14.741 1.00 0.00 O ATOM 1680 CB ALA A 107 -19.125 -17.537 -14.675 1.00 0.00 C ATOM 0 H ALA A 107 -18.437 -15.180 -14.791 1.00 0.00 H new ATOM 0 HA ALA A 107 -17.518 -17.345 -13.276 1.00 0.00 H new ATOM 0 HB1 ALA A 107 -19.204 -18.618 -14.562 1.00 0.00 H new ATOM 0 HB2 ALA A 107 -19.840 -17.049 -14.012 1.00 0.00 H new ATOM 0 HB3 ALA A 107 -19.343 -17.264 -15.707 1.00 0.00 H new ATOM 1686 N SER A 108 -16.527 -17.354 -16.416 1.00 0.00 N ATOM 1687 CA SER A 108 -15.583 -17.966 -17.344 1.00 0.00 C ATOM 1688 C SER A 108 -14.177 -17.988 -16.753 1.00 0.00 C ATOM 1689 O SER A 108 -13.579 -19.052 -16.582 1.00 0.00 O ATOM 1690 CB SER A 108 -15.577 -17.207 -18.673 1.00 0.00 C ATOM 1691 OG SER A 108 -16.743 -16.414 -18.812 1.00 0.00 O ATOM 0 H SER A 108 -17.034 -16.555 -16.796 1.00 0.00 H new ATOM 0 HA SER A 108 -15.900 -18.994 -17.521 1.00 0.00 H new ATOM 0 HB2 SER A 108 -14.693 -16.572 -18.729 1.00 0.00 H new ATOM 0 HB3 SER A 108 -15.514 -17.915 -19.499 1.00 0.00 H new ATOM 0 HG SER A 108 -16.631 -15.577 -18.315 1.00 0.00 H new