USER MOD reduce.3.24.130724 H: found=0, std=0, add=684, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 684 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 11 THR OG1 : rot 123:sc= 0.192 USER MOD Set 1.2: A 22 SER OG : rot 180:sc= 0.898 USER MOD Single : A 1 MET CE :methyl -164:sc= -0.143 (180deg=-0.497) USER MOD Single : A 1 MET N :NH3+ 162:sc= 0.00942 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc=0.000863 USER MOD Single : A 5 THR OG1 : rot -62:sc= 0.325 USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 16 CYS SG : rot -167:sc= -0.212 USER MOD Single : A 39 TYR OH : rot 180:sc= -0.769 USER MOD Single : A 41 SER OG : rot 70:sc= 1.09 USER MOD Single : A 46 ASN : amide:sc= -1.33 K(o=-1.3,f=-0.53) USER MOD Single : A 47 THR OG1 : rot -80:sc= -0.738 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : A 58 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 THR OG1 : rot 180:sc= 0 USER MOD Single : A 69 THR OG1 : rot 180:sc= 0.00625 USER MOD Single : A 76 MET CE :methyl -148:sc= -0.824 (180deg=-1.21) USER MOD Single : A 77 THR OG1 : rot 92:sc= 1.26 USER MOD Single : A 78 ASN : amide:sc= -8.3! C(o=-8.3!,f=-11!) USER MOD Single : A 80 SER OG : rot -80:sc= -0.496 USER MOD Single : A 82 THR OG1 : rot 180:sc= 0 USER MOD Single : A 85 SER OG : rot 180:sc= -1.24 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 62.705 13.503 5.937 1.00 0.00 N ATOM 2 CA MET A 1 63.940 12.719 5.650 1.00 0.00 C ATOM 3 C MET A 1 64.254 12.796 4.159 1.00 0.00 C ATOM 4 O MET A 1 63.383 13.086 3.340 1.00 0.00 O ATOM 5 CB MET A 1 63.722 11.257 6.052 1.00 0.00 C ATOM 6 CG MET A 1 65.028 10.677 6.599 1.00 0.00 C ATOM 7 SD MET A 1 65.108 10.951 8.388 1.00 0.00 S ATOM 8 CE MET A 1 66.456 12.158 8.371 1.00 0.00 C ATOM 0 H1 MET A 1 62.318 13.216 6.858 1.00 0.00 H new ATOM 0 H2 MET A 1 62.935 14.517 5.959 1.00 0.00 H new ATOM 0 H3 MET A 1 62.000 13.324 5.194 1.00 0.00 H new ATOM 0 HA MET A 1 64.773 13.131 6.219 1.00 0.00 H new ATOM 0 HB2 MET A 1 62.938 11.189 6.806 1.00 0.00 H new ATOM 0 HB3 MET A 1 63.387 10.678 5.191 1.00 0.00 H new ATOM 0 HG2 MET A 1 65.084 9.611 6.381 1.00 0.00 H new ATOM 0 HG3 MET A 1 65.881 11.148 6.110 1.00 0.00 H new ATOM 0 HE1 MET A 1 66.867 12.258 9.375 1.00 0.00 H new ATOM 0 HE2 MET A 1 67.238 11.820 7.691 1.00 0.00 H new ATOM 0 HE3 MET A 1 66.076 13.123 8.036 1.00 0.00 H new ATOM 20 N THR A 2 65.513 12.534 3.818 1.00 0.00 N ATOM 21 CA THR A 2 65.938 12.577 2.421 1.00 0.00 C ATOM 22 C THR A 2 65.852 11.189 1.795 1.00 0.00 C ATOM 23 O THR A 2 65.984 10.175 2.481 1.00 0.00 O ATOM 24 CB THR A 2 67.378 13.082 2.313 1.00 0.00 C ATOM 25 OG1 THR A 2 68.218 12.291 3.142 1.00 0.00 O ATOM 26 CG2 THR A 2 67.444 14.543 2.762 1.00 0.00 C ATOM 0 H THR A 2 66.250 12.292 4.481 1.00 0.00 H new ATOM 0 HA THR A 2 65.274 13.259 1.890 1.00 0.00 H new ATOM 0 HB THR A 2 67.713 13.008 1.278 1.00 0.00 H new ATOM 0 HG1 THR A 2 69.141 12.612 3.073 1.00 0.00 H new ATOM 0 HG21 THR A 2 68.470 14.901 2.685 1.00 0.00 H new ATOM 0 HG22 THR A 2 66.799 15.149 2.125 1.00 0.00 H new ATOM 0 HG23 THR A 2 67.109 14.621 3.796 1.00 0.00 H new ATOM 34 N LEU A 3 65.633 11.157 0.483 1.00 0.00 N ATOM 35 CA LEU A 3 65.531 9.888 -0.236 1.00 0.00 C ATOM 36 C LEU A 3 66.826 9.083 -0.086 1.00 0.00 C ATOM 37 O LEU A 3 67.634 9.355 0.803 1.00 0.00 O ATOM 38 CB LEU A 3 65.232 10.141 -1.717 1.00 0.00 C ATOM 39 CG LEU A 3 66.377 10.746 -2.529 1.00 0.00 C ATOM 40 CD1 LEU A 3 66.182 10.413 -4.011 1.00 0.00 C ATOM 41 CD2 LEU A 3 66.379 12.265 -2.345 1.00 0.00 C ATOM 0 H LEU A 3 65.523 11.986 -0.100 1.00 0.00 H new ATOM 0 HA LEU A 3 64.712 9.310 0.193 1.00 0.00 H new ATOM 0 HB2 LEU A 3 64.944 9.196 -2.177 1.00 0.00 H new ATOM 0 HB3 LEU A 3 64.371 10.805 -1.787 1.00 0.00 H new ATOM 0 HG LEU A 3 67.326 10.334 -2.186 1.00 0.00 H new ATOM 0 HD11 LEU A 3 66.998 10.844 -4.591 1.00 0.00 H new ATOM 0 HD12 LEU A 3 66.175 9.331 -4.143 1.00 0.00 H new ATOM 0 HD13 LEU A 3 65.234 10.827 -4.355 1.00 0.00 H new ATOM 0 HD21 LEU A 3 67.194 12.700 -2.923 1.00 0.00 H new ATOM 0 HD22 LEU A 3 65.430 12.675 -2.691 1.00 0.00 H new ATOM 0 HD23 LEU A 3 66.514 12.504 -1.290 1.00 0.00 H new ATOM 53 N LEU A 4 67.011 8.081 -0.943 1.00 0.00 N ATOM 54 CA LEU A 4 68.207 7.243 -0.860 1.00 0.00 C ATOM 55 C LEU A 4 68.893 7.126 -2.218 1.00 0.00 C ATOM 56 O LEU A 4 68.336 7.510 -3.246 1.00 0.00 O ATOM 57 CB LEU A 4 67.827 5.845 -0.371 1.00 0.00 C ATOM 58 CG LEU A 4 68.914 5.110 0.427 1.00 0.00 C ATOM 59 CD1 LEU A 4 68.292 4.429 1.649 1.00 0.00 C ATOM 60 CD2 LEU A 4 69.571 4.046 -0.456 1.00 0.00 C ATOM 0 H LEU A 4 66.362 7.832 -1.690 1.00 0.00 H new ATOM 0 HA LEU A 4 68.897 7.711 -0.158 1.00 0.00 H new ATOM 0 HB2 LEU A 4 66.935 5.926 0.251 1.00 0.00 H new ATOM 0 HB3 LEU A 4 67.560 5.236 -1.235 1.00 0.00 H new ATOM 0 HG LEU A 4 69.662 5.832 0.753 1.00 0.00 H new ATOM 0 HD11 LEU A 4 69.068 3.910 2.211 1.00 0.00 H new ATOM 0 HD12 LEU A 4 67.825 5.180 2.286 1.00 0.00 H new ATOM 0 HD13 LEU A 4 67.539 3.712 1.322 1.00 0.00 H new ATOM 0 HD21 LEU A 4 70.342 3.526 0.113 1.00 0.00 H new ATOM 0 HD22 LEU A 4 68.818 3.330 -0.785 1.00 0.00 H new ATOM 0 HD23 LEU A 4 70.022 4.523 -1.326 1.00 0.00 H new ATOM 72 N THR A 5 70.108 6.583 -2.209 1.00 0.00 N ATOM 73 CA THR A 5 70.861 6.410 -3.448 1.00 0.00 C ATOM 74 C THR A 5 71.663 5.113 -3.419 1.00 0.00 C ATOM 75 O THR A 5 71.793 4.465 -2.380 1.00 0.00 O ATOM 76 CB THR A 5 71.822 7.578 -3.660 1.00 0.00 C ATOM 77 OG1 THR A 5 72.434 7.920 -2.424 1.00 0.00 O ATOM 78 CG2 THR A 5 71.044 8.774 -4.197 1.00 0.00 C ATOM 0 H THR A 5 70.587 6.259 -1.369 1.00 0.00 H new ATOM 0 HA THR A 5 70.143 6.373 -4.267 1.00 0.00 H new ATOM 0 HB THR A 5 72.594 7.294 -4.375 1.00 0.00 H new ATOM 0 HG1 THR A 5 71.748 8.214 -1.789 1.00 0.00 H new ATOM 0 HG21 THR A 5 71.725 9.612 -4.351 1.00 0.00 H new ATOM 0 HG22 THR A 5 70.576 8.508 -5.145 1.00 0.00 H new ATOM 0 HG23 THR A 5 70.274 9.059 -3.480 1.00 0.00 H new ATOM 86 N LEU A 6 72.202 4.750 -4.578 1.00 0.00 N ATOM 87 CA LEU A 6 73.000 3.531 -4.692 1.00 0.00 C ATOM 88 C LEU A 6 74.249 3.635 -3.828 1.00 0.00 C ATOM 89 O LEU A 6 74.697 2.654 -3.237 1.00 0.00 O ATOM 90 CB LEU A 6 73.412 3.289 -6.146 1.00 0.00 C ATOM 91 CG LEU A 6 74.362 4.334 -6.738 1.00 0.00 C ATOM 92 CD1 LEU A 6 75.810 3.899 -6.504 1.00 0.00 C ATOM 93 CD2 LEU A 6 74.106 4.462 -8.242 1.00 0.00 C ATOM 0 H LEU A 6 72.103 5.276 -5.446 1.00 0.00 H new ATOM 0 HA LEU A 6 72.390 2.695 -4.350 1.00 0.00 H new ATOM 0 HB2 LEU A 6 73.887 2.310 -6.214 1.00 0.00 H new ATOM 0 HB3 LEU A 6 72.512 3.250 -6.760 1.00 0.00 H new ATOM 0 HG LEU A 6 74.189 5.296 -6.256 1.00 0.00 H new ATOM 0 HD11 LEU A 6 76.486 4.643 -6.925 1.00 0.00 H new ATOM 0 HD12 LEU A 6 75.994 3.807 -5.434 1.00 0.00 H new ATOM 0 HD13 LEU A 6 75.983 2.937 -6.986 1.00 0.00 H new ATOM 0 HD21 LEU A 6 74.782 5.206 -8.664 1.00 0.00 H new ATOM 0 HD22 LEU A 6 74.279 3.500 -8.724 1.00 0.00 H new ATOM 0 HD23 LEU A 6 73.075 4.772 -8.410 1.00 0.00 H new ATOM 105 N SER A 7 74.799 4.839 -3.759 1.00 0.00 N ATOM 106 CA SER A 7 75.999 5.075 -2.960 1.00 0.00 C ATOM 107 C SER A 7 75.699 4.869 -1.477 1.00 0.00 C ATOM 108 O SER A 7 76.572 4.476 -0.702 1.00 0.00 O ATOM 109 CB SER A 7 76.512 6.500 -3.173 1.00 0.00 C ATOM 110 OG SER A 7 77.457 6.504 -4.235 1.00 0.00 O ATOM 0 H SER A 7 74.439 5.663 -4.241 1.00 0.00 H new ATOM 0 HA SER A 7 76.762 4.365 -3.279 1.00 0.00 H new ATOM 0 HB2 SER A 7 75.682 7.167 -3.407 1.00 0.00 H new ATOM 0 HB3 SER A 7 76.973 6.873 -2.259 1.00 0.00 H new ATOM 0 HG SER A 7 77.787 7.416 -4.376 1.00 0.00 H new ATOM 116 N ASP A 8 74.455 5.141 -1.091 1.00 0.00 N ATOM 117 CA ASP A 8 74.045 4.988 0.298 1.00 0.00 C ATOM 118 C ASP A 8 73.984 3.514 0.685 1.00 0.00 C ATOM 119 O ASP A 8 74.725 3.052 1.550 1.00 0.00 O ATOM 120 CB ASP A 8 72.665 5.608 0.510 1.00 0.00 C ATOM 121 CG ASP A 8 72.751 7.127 0.390 1.00 0.00 C ATOM 122 OD1 ASP A 8 73.787 7.674 0.730 1.00 0.00 O ATOM 123 OD2 ASP A 8 71.775 7.720 -0.040 1.00 0.00 O ATOM 0 H ASP A 8 73.719 5.466 -1.718 1.00 0.00 H new ATOM 0 HA ASP A 8 74.781 5.495 0.922 1.00 0.00 H new ATOM 0 HB2 ASP A 8 71.964 5.216 -0.227 1.00 0.00 H new ATOM 0 HB3 ASP A 8 72.281 5.334 1.493 1.00 0.00 H new ATOM 128 N LEU A 9 73.078 2.786 0.038 1.00 0.00 N ATOM 129 CA LEU A 9 72.900 1.361 0.321 1.00 0.00 C ATOM 130 C LEU A 9 74.208 0.586 0.168 1.00 0.00 C ATOM 131 O LEU A 9 74.434 -0.414 0.850 1.00 0.00 O ATOM 132 CB LEU A 9 71.860 0.759 -0.624 1.00 0.00 C ATOM 133 CG LEU A 9 71.573 -0.729 -0.410 1.00 0.00 C ATOM 134 CD1 LEU A 9 70.630 -0.901 0.782 1.00 0.00 C ATOM 135 CD2 LEU A 9 70.916 -1.304 -1.666 1.00 0.00 C ATOM 0 H LEU A 9 72.458 3.155 -0.683 1.00 0.00 H new ATOM 0 HA LEU A 9 72.563 1.279 1.354 1.00 0.00 H new ATOM 0 HB2 LEU A 9 70.928 1.313 -0.513 1.00 0.00 H new ATOM 0 HB3 LEU A 9 72.197 0.904 -1.650 1.00 0.00 H new ATOM 0 HG LEU A 9 72.507 -1.255 -0.212 1.00 0.00 H new ATOM 0 HD11 LEU A 9 70.426 -1.961 0.934 1.00 0.00 H new ATOM 0 HD12 LEU A 9 71.096 -0.489 1.677 1.00 0.00 H new ATOM 0 HD13 LEU A 9 69.695 -0.376 0.585 1.00 0.00 H new ATOM 0 HD21 LEU A 9 70.710 -2.364 -1.516 1.00 0.00 H new ATOM 0 HD22 LEU A 9 69.982 -0.777 -1.862 1.00 0.00 H new ATOM 0 HD23 LEU A 9 71.587 -1.181 -2.516 1.00 0.00 H new ATOM 147 N LEU A 10 75.059 1.045 -0.743 1.00 0.00 N ATOM 148 CA LEU A 10 76.331 0.369 -0.986 1.00 0.00 C ATOM 149 C LEU A 10 77.288 0.534 0.193 1.00 0.00 C ATOM 150 O LEU A 10 77.860 -0.441 0.678 1.00 0.00 O ATOM 151 CB LEU A 10 76.993 0.908 -2.261 1.00 0.00 C ATOM 152 CG LEU A 10 76.728 0.084 -3.525 1.00 0.00 C ATOM 153 CD1 LEU A 10 75.221 -0.007 -3.781 1.00 0.00 C ATOM 154 CD2 LEU A 10 77.403 0.756 -4.723 1.00 0.00 C ATOM 0 H LEU A 10 74.896 1.871 -1.319 1.00 0.00 H new ATOM 0 HA LEU A 10 76.115 -0.692 -1.109 1.00 0.00 H new ATOM 0 HB2 LEU A 10 76.645 1.927 -2.430 1.00 0.00 H new ATOM 0 HB3 LEU A 10 78.070 0.961 -2.099 1.00 0.00 H new ATOM 0 HG LEU A 10 77.133 -0.919 -3.389 1.00 0.00 H new ATOM 0 HD11 LEU A 10 75.040 -0.594 -4.681 1.00 0.00 H new ATOM 0 HD12 LEU A 10 74.736 -0.487 -2.931 1.00 0.00 H new ATOM 0 HD13 LEU A 10 74.813 0.995 -3.913 1.00 0.00 H new ATOM 0 HD21 LEU A 10 77.215 0.170 -5.623 1.00 0.00 H new ATOM 0 HD22 LEU A 10 76.999 1.760 -4.853 1.00 0.00 H new ATOM 0 HD23 LEU A 10 78.477 0.817 -4.548 1.00 0.00 H new ATOM 166 N THR A 11 77.471 1.772 0.639 1.00 0.00 N ATOM 167 CA THR A 11 78.384 2.030 1.750 1.00 0.00 C ATOM 168 C THR A 11 77.924 1.296 3.016 1.00 0.00 C ATOM 169 O THR A 11 78.702 0.585 3.650 1.00 0.00 O ATOM 170 CB THR A 11 78.543 3.554 1.992 1.00 0.00 C ATOM 171 OG1 THR A 11 79.829 3.806 2.537 1.00 0.00 O ATOM 172 CG2 THR A 11 77.478 4.116 2.948 1.00 0.00 C ATOM 0 H THR A 11 77.010 2.599 0.259 1.00 0.00 H new ATOM 0 HA THR A 11 79.367 1.639 1.486 1.00 0.00 H new ATOM 0 HB THR A 11 78.417 4.051 1.030 1.00 0.00 H new ATOM 0 HG1 THR A 11 80.311 4.435 1.961 1.00 0.00 H new ATOM 0 HG21 THR A 11 77.637 5.186 3.081 1.00 0.00 H new ATOM 0 HG22 THR A 11 76.486 3.946 2.528 1.00 0.00 H new ATOM 0 HG23 THR A 11 77.554 3.615 3.913 1.00 0.00 H new ATOM 180 N LEU A 12 76.652 1.476 3.371 1.00 0.00 N ATOM 181 CA LEU A 12 76.110 0.822 4.564 1.00 0.00 C ATOM 182 C LEU A 12 76.239 -0.693 4.445 1.00 0.00 C ATOM 183 O LEU A 12 76.403 -1.395 5.443 1.00 0.00 O ATOM 184 CB LEU A 12 74.642 1.205 4.792 1.00 0.00 C ATOM 185 CG LEU A 12 73.724 1.114 3.565 1.00 0.00 C ATOM 186 CD1 LEU A 12 72.962 -0.213 3.583 1.00 0.00 C ATOM 187 CD2 LEU A 12 72.717 2.269 3.594 1.00 0.00 C ATOM 0 H LEU A 12 75.987 2.058 2.861 1.00 0.00 H new ATOM 0 HA LEU A 12 76.689 1.165 5.422 1.00 0.00 H new ATOM 0 HB2 LEU A 12 74.236 0.562 5.573 1.00 0.00 H new ATOM 0 HB3 LEU A 12 74.608 2.226 5.171 1.00 0.00 H new ATOM 0 HG LEU A 12 74.330 1.173 2.661 1.00 0.00 H new ATOM 0 HD11 LEU A 12 72.312 -0.271 2.710 1.00 0.00 H new ATOM 0 HD12 LEU A 12 73.671 -1.040 3.563 1.00 0.00 H new ATOM 0 HD13 LEU A 12 72.359 -0.274 4.489 1.00 0.00 H new ATOM 0 HD21 LEU A 12 72.065 2.205 2.723 1.00 0.00 H new ATOM 0 HD22 LEU A 12 72.117 2.206 4.502 1.00 0.00 H new ATOM 0 HD23 LEU A 12 73.252 3.219 3.578 1.00 0.00 H new ATOM 199 N LEU A 13 76.193 -1.189 3.210 1.00 0.00 N ATOM 200 CA LEU A 13 76.339 -2.618 2.977 1.00 0.00 C ATOM 201 C LEU A 13 77.802 -3.005 3.156 1.00 0.00 C ATOM 202 O LEU A 13 78.124 -4.034 3.750 1.00 0.00 O ATOM 203 CB LEU A 13 75.875 -2.988 1.563 1.00 0.00 C ATOM 204 CG LEU A 13 74.460 -3.566 1.474 1.00 0.00 C ATOM 205 CD1 LEU A 13 74.024 -3.626 0.009 1.00 0.00 C ATOM 206 CD2 LEU A 13 74.451 -4.978 2.064 1.00 0.00 C ATOM 0 H LEU A 13 76.058 -0.629 2.368 1.00 0.00 H new ATOM 0 HA LEU A 13 75.720 -3.159 3.693 1.00 0.00 H new ATOM 0 HB2 LEU A 13 75.927 -2.098 0.936 1.00 0.00 H new ATOM 0 HB3 LEU A 13 76.574 -3.713 1.146 1.00 0.00 H new ATOM 0 HG LEU A 13 73.772 -2.931 2.032 1.00 0.00 H new ATOM 0 HD11 LEU A 13 73.017 -4.038 -0.054 1.00 0.00 H new ATOM 0 HD12 LEU A 13 74.033 -2.622 -0.415 1.00 0.00 H new ATOM 0 HD13 LEU A 13 74.711 -4.262 -0.549 1.00 0.00 H new ATOM 0 HD21 LEU A 13 73.445 -5.392 2.002 1.00 0.00 H new ATOM 0 HD22 LEU A 13 75.139 -5.611 1.503 1.00 0.00 H new ATOM 0 HD23 LEU A 13 74.763 -4.938 3.108 1.00 0.00 H new ATOM 218 N ARG A 14 78.685 -2.154 2.638 1.00 0.00 N ATOM 219 CA ARG A 14 80.118 -2.396 2.747 1.00 0.00 C ATOM 220 C ARG A 14 80.555 -2.356 4.206 1.00 0.00 C ATOM 221 O ARG A 14 81.294 -3.223 4.669 1.00 0.00 O ATOM 222 CB ARG A 14 80.898 -1.342 1.962 1.00 0.00 C ATOM 223 CG ARG A 14 80.439 -1.352 0.499 1.00 0.00 C ATOM 224 CD ARG A 14 81.518 -1.989 -0.379 1.00 0.00 C ATOM 225 NE ARG A 14 81.516 -3.446 -0.222 1.00 0.00 N ATOM 226 CZ ARG A 14 82.503 -4.215 -0.704 1.00 0.00 C ATOM 227 NH1 ARG A 14 83.522 -3.694 -1.344 1.00 0.00 N ATOM 228 NH2 ARG A 14 82.447 -5.509 -0.533 1.00 0.00 N ATOM 0 H ARG A 14 78.434 -1.298 2.143 1.00 0.00 H new ATOM 0 HA ARG A 14 80.326 -3.383 2.334 1.00 0.00 H new ATOM 0 HB2 ARG A 14 80.738 -0.356 2.398 1.00 0.00 H new ATOM 0 HB3 ARG A 14 81.967 -1.547 2.020 1.00 0.00 H new ATOM 0 HG2 ARG A 14 79.506 -1.908 0.405 1.00 0.00 H new ATOM 0 HG3 ARG A 14 80.239 -0.334 0.164 1.00 0.00 H new ATOM 0 HD2 ARG A 14 81.344 -1.730 -1.423 1.00 0.00 H new ATOM 0 HD3 ARG A 14 82.496 -1.590 -0.110 1.00 0.00 H new ATOM 0 HE ARG A 14 80.740 -3.889 0.269 1.00 0.00 H new ATOM 0 HH11 ARG A 14 83.575 -2.685 -1.483 1.00 0.00 H new ATOM 0 HH12 ARG A 14 84.262 -4.298 -1.702 1.00 0.00 H new ATOM 0 HH21 ARG A 14 81.658 -5.924 -0.037 1.00 0.00 H new ATOM 0 HH22 ARG A 14 83.192 -6.104 -0.895 1.00 0.00 H new ATOM 242 N GLU A 15 80.077 -1.344 4.936 1.00 0.00 N ATOM 243 CA GLU A 15 80.418 -1.213 6.356 1.00 0.00 C ATOM 244 C GLU A 15 79.959 -2.459 7.098 1.00 0.00 C ATOM 245 O GLU A 15 80.637 -2.966 7.992 1.00 0.00 O ATOM 246 CB GLU A 15 79.727 0.005 6.985 1.00 0.00 C ATOM 247 CG GLU A 15 79.827 1.222 6.057 1.00 0.00 C ATOM 248 CD GLU A 15 80.519 2.377 6.776 1.00 0.00 C ATOM 249 OE1 GLU A 15 81.674 2.220 7.133 1.00 0.00 O ATOM 250 OE2 GLU A 15 79.882 3.401 6.960 1.00 0.00 O ATOM 0 H GLU A 15 79.463 -0.614 4.575 1.00 0.00 H new ATOM 0 HA GLU A 15 81.498 -1.087 6.434 1.00 0.00 H new ATOM 0 HB2 GLU A 15 78.680 -0.225 7.180 1.00 0.00 H new ATOM 0 HB3 GLU A 15 80.187 0.235 7.946 1.00 0.00 H new ATOM 0 HG2 GLU A 15 80.384 0.958 5.158 1.00 0.00 H new ATOM 0 HG3 GLU A 15 78.831 1.528 5.737 1.00 0.00 H new ATOM 257 N CYS A 16 78.793 -2.944 6.693 1.00 0.00 N ATOM 258 CA CYS A 16 78.218 -4.143 7.296 1.00 0.00 C ATOM 259 C CYS A 16 79.062 -5.362 6.948 1.00 0.00 C ATOM 260 O CYS A 16 79.358 -6.199 7.800 1.00 0.00 O ATOM 261 CB CYS A 16 76.800 -4.365 6.779 1.00 0.00 C ATOM 262 SG CYS A 16 75.869 -5.352 7.976 1.00 0.00 S ATOM 0 H CYS A 16 78.227 -2.529 5.953 1.00 0.00 H new ATOM 0 HA CYS A 16 78.198 -4.005 8.377 1.00 0.00 H new ATOM 0 HB2 CYS A 16 76.306 -3.407 6.619 1.00 0.00 H new ATOM 0 HB3 CYS A 16 76.828 -4.874 5.816 1.00 0.00 H new ATOM 0 HG CYS A 16 74.770 -5.776 7.427 1.00 0.00 H new ATOM 268 N ALA A 17 79.442 -5.447 5.678 1.00 0.00 N ATOM 269 CA ALA A 17 80.256 -6.567 5.203 1.00 0.00 C ATOM 270 C ALA A 17 81.571 -6.646 5.975 1.00 0.00 C ATOM 271 O ALA A 17 82.120 -7.727 6.185 1.00 0.00 O ATOM 272 CB ALA A 17 80.561 -6.412 3.713 1.00 0.00 C ATOM 0 H ALA A 17 79.203 -4.761 4.962 1.00 0.00 H new ATOM 0 HA ALA A 17 79.689 -7.483 5.366 1.00 0.00 H new ATOM 0 HB1 ALA A 17 81.167 -7.253 3.376 1.00 0.00 H new ATOM 0 HB2 ALA A 17 79.627 -6.389 3.151 1.00 0.00 H new ATOM 0 HB3 ALA A 17 81.106 -5.483 3.548 1.00 0.00 H new ATOM 278 N GLY A 18 82.069 -5.486 6.395 1.00 0.00 N ATOM 279 CA GLY A 18 83.321 -5.435 7.145 1.00 0.00 C ATOM 280 C GLY A 18 84.180 -4.260 6.689 1.00 0.00 C ATOM 281 O GLY A 18 84.640 -3.456 7.500 1.00 0.00 O ATOM 0 H GLY A 18 81.631 -4.579 6.232 1.00 0.00 H new ATOM 0 HA2 GLY A 18 83.108 -5.344 8.210 1.00 0.00 H new ATOM 0 HA3 GLY A 18 83.870 -6.367 7.008 1.00 0.00 H new ATOM 285 N GLU A 19 84.393 -4.172 5.379 1.00 0.00 N ATOM 286 CA GLU A 19 85.200 -3.092 4.817 1.00 0.00 C ATOM 287 C GLU A 19 84.576 -1.736 5.131 1.00 0.00 C ATOM 288 O GLU A 19 83.407 -1.488 4.835 1.00 0.00 O ATOM 289 CB GLU A 19 85.330 -3.243 3.296 1.00 0.00 C ATOM 290 CG GLU A 19 83.945 -3.459 2.671 1.00 0.00 C ATOM 291 CD GLU A 19 83.769 -4.928 2.298 1.00 0.00 C ATOM 292 OE1 GLU A 19 84.300 -5.326 1.274 1.00 0.00 O ATOM 293 OE2 GLU A 19 83.107 -5.632 3.041 1.00 0.00 O ATOM 0 H GLU A 19 84.022 -4.828 4.692 1.00 0.00 H new ATOM 0 HA GLU A 19 86.190 -3.150 5.270 1.00 0.00 H new ATOM 0 HB2 GLU A 19 85.795 -2.353 2.872 1.00 0.00 H new ATOM 0 HB3 GLU A 19 85.980 -4.085 3.060 1.00 0.00 H new ATOM 0 HG2 GLU A 19 83.168 -3.157 3.373 1.00 0.00 H new ATOM 0 HG3 GLU A 19 83.834 -2.834 1.785 1.00 0.00 H new ATOM 300 N GLU A 20 85.373 -0.862 5.735 1.00 0.00 N ATOM 301 CA GLU A 20 84.897 0.472 6.090 1.00 0.00 C ATOM 302 C GLU A 20 85.056 1.426 4.905 1.00 0.00 C ATOM 303 O GLU A 20 85.735 2.451 4.992 1.00 0.00 O ATOM 304 CB GLU A 20 85.677 1.015 7.292 1.00 0.00 C ATOM 305 CG GLU A 20 84.946 2.229 7.870 1.00 0.00 C ATOM 306 CD GLU A 20 85.509 2.553 9.249 1.00 0.00 C ATOM 307 OE1 GLU A 20 85.836 1.623 9.967 1.00 0.00 O ATOM 308 OE2 GLU A 20 85.604 3.727 9.567 1.00 0.00 O ATOM 0 H GLU A 20 86.343 -1.049 5.988 1.00 0.00 H new ATOM 0 HA GLU A 20 83.842 0.400 6.352 1.00 0.00 H new ATOM 0 HB2 GLU A 20 85.777 0.241 8.053 1.00 0.00 H new ATOM 0 HB3 GLU A 20 86.685 1.295 6.988 1.00 0.00 H new ATOM 0 HG2 GLU A 20 85.063 3.086 7.207 1.00 0.00 H new ATOM 0 HG3 GLU A 20 83.878 2.024 7.941 1.00 0.00 H new ATOM 315 N GLU A 21 84.415 1.073 3.794 1.00 0.00 N ATOM 316 CA GLU A 21 84.483 1.894 2.595 1.00 0.00 C ATOM 317 C GLU A 21 83.103 2.017 1.957 1.00 0.00 C ATOM 318 O GLU A 21 82.137 1.405 2.411 1.00 0.00 O ATOM 319 CB GLU A 21 85.452 1.286 1.580 1.00 0.00 C ATOM 320 CG GLU A 21 86.879 1.729 1.907 1.00 0.00 C ATOM 321 CD GLU A 21 87.509 0.740 2.882 1.00 0.00 C ATOM 322 OE1 GLU A 21 87.549 -0.435 2.559 1.00 0.00 O ATOM 323 OE2 GLU A 21 87.941 1.174 3.938 1.00 0.00 O ATOM 0 H GLU A 21 83.848 0.230 3.702 1.00 0.00 H new ATOM 0 HA GLU A 21 84.840 2.883 2.884 1.00 0.00 H new ATOM 0 HB2 GLU A 21 85.384 0.198 1.602 1.00 0.00 H new ATOM 0 HB3 GLU A 21 85.184 1.601 0.572 1.00 0.00 H new ATOM 0 HG2 GLU A 21 87.472 1.784 0.994 1.00 0.00 H new ATOM 0 HG3 GLU A 21 86.870 2.729 2.342 1.00 0.00 H new ATOM 330 N SER A 22 83.023 2.817 0.898 1.00 0.00 N ATOM 331 CA SER A 22 81.754 3.016 0.202 1.00 0.00 C ATOM 332 C SER A 22 81.693 2.158 -1.054 1.00 0.00 C ATOM 333 O SER A 22 80.808 1.318 -1.208 1.00 0.00 O ATOM 334 CB SER A 22 81.578 4.484 -0.186 1.00 0.00 C ATOM 335 OG SER A 22 81.602 5.286 0.987 1.00 0.00 O ATOM 0 H SER A 22 83.811 3.333 0.506 1.00 0.00 H new ATOM 0 HA SER A 22 80.952 2.723 0.879 1.00 0.00 H new ATOM 0 HB2 SER A 22 82.373 4.790 -0.866 1.00 0.00 H new ATOM 0 HB3 SER A 22 80.635 4.622 -0.715 1.00 0.00 H new ATOM 0 HG SER A 22 81.491 6.228 0.741 1.00 0.00 H new ATOM 341 N ILE A 23 82.645 2.380 -1.949 1.00 0.00 N ATOM 342 CA ILE A 23 82.694 1.622 -3.192 1.00 0.00 C ATOM 343 C ILE A 23 84.073 0.999 -3.375 1.00 0.00 C ATOM 344 O ILE A 23 84.901 1.487 -4.144 1.00 0.00 O ATOM 345 CB ILE A 23 82.382 2.528 -4.385 1.00 0.00 C ATOM 346 CG1 ILE A 23 81.088 3.319 -4.125 1.00 0.00 C ATOM 347 CG2 ILE A 23 82.215 1.665 -5.632 1.00 0.00 C ATOM 348 CD1 ILE A 23 79.915 2.363 -3.862 1.00 0.00 C ATOM 0 H ILE A 23 83.387 3.071 -1.840 1.00 0.00 H new ATOM 0 HA ILE A 23 81.945 0.832 -3.140 1.00 0.00 H new ATOM 0 HB ILE A 23 83.200 3.234 -4.529 1.00 0.00 H new ATOM 0 HG12 ILE A 23 81.225 3.980 -3.269 1.00 0.00 H new ATOM 0 HG13 ILE A 23 80.863 3.952 -4.984 1.00 0.00 H new ATOM 0 HG21 ILE A 23 81.992 2.302 -6.488 1.00 0.00 H new ATOM 0 HG22 ILE A 23 83.137 1.114 -5.819 1.00 0.00 H new ATOM 0 HG23 ILE A 23 81.396 0.961 -5.481 1.00 0.00 H new ATOM 0 HD11 ILE A 23 79.009 2.941 -3.680 1.00 0.00 H new ATOM 0 HD12 ILE A 23 79.768 1.720 -4.730 1.00 0.00 H new ATOM 0 HD13 ILE A 23 80.135 1.749 -2.989 1.00 0.00 H new ATOM 360 N ASP A 24 84.306 -0.087 -2.647 1.00 0.00 N ATOM 361 CA ASP A 24 85.588 -0.784 -2.719 1.00 0.00 C ATOM 362 C ASP A 24 85.522 -1.976 -3.677 1.00 0.00 C ATOM 363 O ASP A 24 86.553 -2.476 -4.129 1.00 0.00 O ATOM 364 CB ASP A 24 85.997 -1.287 -1.335 1.00 0.00 C ATOM 365 CG ASP A 24 87.500 -1.548 -1.311 1.00 0.00 C ATOM 366 OD1 ASP A 24 88.244 -0.636 -1.632 1.00 0.00 O ATOM 367 OD2 ASP A 24 87.883 -2.656 -0.973 1.00 0.00 O ATOM 0 H ASP A 24 83.631 -0.503 -2.005 1.00 0.00 H new ATOM 0 HA ASP A 24 86.325 -0.072 -3.090 1.00 0.00 H new ATOM 0 HB2 ASP A 24 85.733 -0.550 -0.576 1.00 0.00 H new ATOM 0 HB3 ASP A 24 85.455 -2.201 -1.094 1.00 0.00 H new ATOM 372 N LEU A 25 84.307 -2.435 -3.982 1.00 0.00 N ATOM 373 CA LEU A 25 84.142 -3.574 -4.885 1.00 0.00 C ATOM 374 C LEU A 25 83.872 -3.108 -6.315 1.00 0.00 C ATOM 375 O LEU A 25 83.148 -3.761 -7.067 1.00 0.00 O ATOM 376 CB LEU A 25 82.986 -4.463 -4.419 1.00 0.00 C ATOM 377 CG LEU A 25 81.595 -3.809 -4.472 1.00 0.00 C ATOM 378 CD1 LEU A 25 80.832 -4.305 -5.704 1.00 0.00 C ATOM 379 CD2 LEU A 25 80.806 -4.171 -3.207 1.00 0.00 C ATOM 0 H LEU A 25 83.436 -2.043 -3.624 1.00 0.00 H new ATOM 0 HA LEU A 25 85.071 -4.144 -4.869 1.00 0.00 H new ATOM 0 HB2 LEU A 25 82.970 -5.363 -5.033 1.00 0.00 H new ATOM 0 HB3 LEU A 25 83.182 -4.780 -3.395 1.00 0.00 H new ATOM 0 HG LEU A 25 81.714 -2.727 -4.532 1.00 0.00 H new ATOM 0 HD11 LEU A 25 79.848 -3.838 -5.735 1.00 0.00 H new ATOM 0 HD12 LEU A 25 81.387 -4.043 -6.605 1.00 0.00 H new ATOM 0 HD13 LEU A 25 80.718 -5.388 -5.650 1.00 0.00 H new ATOM 0 HD21 LEU A 25 79.821 -3.706 -3.247 1.00 0.00 H new ATOM 0 HD22 LEU A 25 80.694 -5.253 -3.145 1.00 0.00 H new ATOM 0 HD23 LEU A 25 81.342 -3.811 -2.329 1.00 0.00 H new ATOM 391 N GLY A 26 84.467 -1.977 -6.688 1.00 0.00 N ATOM 392 CA GLY A 26 84.286 -1.442 -8.035 1.00 0.00 C ATOM 393 C GLY A 26 83.009 -0.614 -8.130 1.00 0.00 C ATOM 394 O GLY A 26 83.042 0.568 -8.475 1.00 0.00 O ATOM 0 H GLY A 26 85.071 -1.419 -6.085 1.00 0.00 H new ATOM 0 HA2 GLY A 26 85.144 -0.825 -8.303 1.00 0.00 H new ATOM 0 HA3 GLY A 26 84.246 -2.261 -8.753 1.00 0.00 H new ATOM 398 N GLY A 27 81.882 -1.248 -7.821 1.00 0.00 N ATOM 399 CA GLY A 27 80.598 -0.565 -7.877 1.00 0.00 C ATOM 400 C GLY A 27 79.986 -0.678 -9.268 1.00 0.00 C ATOM 401 O GLY A 27 79.957 0.288 -10.031 1.00 0.00 O ATOM 0 H GLY A 27 81.833 -2.225 -7.532 1.00 0.00 H new ATOM 0 HA2 GLY A 27 79.920 -0.995 -7.140 1.00 0.00 H new ATOM 0 HA3 GLY A 27 80.728 0.485 -7.616 1.00 0.00 H new ATOM 405 N ASP A 28 79.494 -1.871 -9.590 1.00 0.00 N ATOM 406 CA ASP A 28 78.881 -2.110 -10.889 1.00 0.00 C ATOM 407 C ASP A 28 77.926 -3.297 -10.811 1.00 0.00 C ATOM 408 O ASP A 28 77.830 -4.104 -11.736 1.00 0.00 O ATOM 409 CB ASP A 28 79.952 -2.390 -11.947 1.00 0.00 C ATOM 410 CG ASP A 28 79.329 -2.311 -13.336 1.00 0.00 C ATOM 411 OD1 ASP A 28 78.533 -1.411 -13.556 1.00 0.00 O ATOM 412 OD2 ASP A 28 79.656 -3.148 -14.159 1.00 0.00 O ATOM 0 H ASP A 28 79.508 -2.682 -8.972 1.00 0.00 H new ATOM 0 HA ASP A 28 78.326 -1.216 -11.172 1.00 0.00 H new ATOM 0 HB2 ASP A 28 80.763 -1.667 -11.859 1.00 0.00 H new ATOM 0 HB3 ASP A 28 80.386 -3.377 -11.787 1.00 0.00 H new ATOM 417 N VAL A 29 77.218 -3.388 -9.690 1.00 0.00 N ATOM 418 CA VAL A 29 76.265 -4.474 -9.482 1.00 0.00 C ATOM 419 C VAL A 29 74.926 -3.913 -9.011 1.00 0.00 C ATOM 420 O VAL A 29 74.243 -4.505 -8.174 1.00 0.00 O ATOM 421 CB VAL A 29 76.795 -5.457 -8.435 1.00 0.00 C ATOM 422 CG1 VAL A 29 78.028 -6.175 -8.986 1.00 0.00 C ATOM 423 CG2 VAL A 29 77.177 -4.693 -7.165 1.00 0.00 C ATOM 0 H VAL A 29 77.285 -2.728 -8.916 1.00 0.00 H new ATOM 0 HA VAL A 29 76.129 -4.997 -10.429 1.00 0.00 H new ATOM 0 HB VAL A 29 76.022 -6.189 -8.201 1.00 0.00 H new ATOM 0 HG11 VAL A 29 78.405 -6.875 -8.240 1.00 0.00 H new ATOM 0 HG12 VAL A 29 77.758 -6.720 -9.891 1.00 0.00 H new ATOM 0 HG13 VAL A 29 78.801 -5.443 -9.220 1.00 0.00 H new ATOM 0 HG21 VAL A 29 77.554 -5.393 -6.419 1.00 0.00 H new ATOM 0 HG22 VAL A 29 77.950 -3.961 -7.399 1.00 0.00 H new ATOM 0 HG23 VAL A 29 76.299 -4.181 -6.771 1.00 0.00 H new ATOM 433 N GLU A 30 74.565 -2.755 -9.556 1.00 0.00 N ATOM 434 CA GLU A 30 73.315 -2.104 -9.188 1.00 0.00 C ATOM 435 C GLU A 30 72.105 -2.924 -9.643 1.00 0.00 C ATOM 436 O GLU A 30 71.025 -2.841 -9.058 1.00 0.00 O ATOM 437 CB GLU A 30 73.252 -0.708 -9.815 1.00 0.00 C ATOM 438 CG GLU A 30 73.259 -0.814 -11.345 1.00 0.00 C ATOM 439 CD GLU A 30 74.094 0.317 -11.936 1.00 0.00 C ATOM 440 OE1 GLU A 30 73.532 1.369 -12.194 1.00 0.00 O ATOM 441 OE2 GLU A 30 75.283 0.115 -12.122 1.00 0.00 O ATOM 0 H GLU A 30 75.118 -2.252 -10.250 1.00 0.00 H new ATOM 0 HA GLU A 30 73.285 -2.023 -8.101 1.00 0.00 H new ATOM 0 HB2 GLU A 30 72.351 -0.193 -9.483 1.00 0.00 H new ATOM 0 HB3 GLU A 30 74.101 -0.112 -9.481 1.00 0.00 H new ATOM 0 HG2 GLU A 30 73.667 -1.778 -11.650 1.00 0.00 H new ATOM 0 HG3 GLU A 30 72.239 -0.764 -11.727 1.00 0.00 H new ATOM 448 N ASP A 31 72.299 -3.710 -10.701 1.00 0.00 N ATOM 449 CA ASP A 31 71.220 -4.534 -11.236 1.00 0.00 C ATOM 450 C ASP A 31 71.540 -6.021 -11.085 1.00 0.00 C ATOM 451 O ASP A 31 71.012 -6.859 -11.817 1.00 0.00 O ATOM 452 CB ASP A 31 70.995 -4.222 -12.716 1.00 0.00 C ATOM 453 CG ASP A 31 70.315 -2.863 -12.851 1.00 0.00 C ATOM 454 OD1 ASP A 31 69.392 -2.607 -12.096 1.00 0.00 O ATOM 455 OD2 ASP A 31 70.728 -2.100 -13.708 1.00 0.00 O ATOM 0 H ASP A 31 73.185 -3.793 -11.200 1.00 0.00 H new ATOM 0 HA ASP A 31 70.317 -4.304 -10.670 1.00 0.00 H new ATOM 0 HB2 ASP A 31 71.947 -4.219 -13.247 1.00 0.00 H new ATOM 0 HB3 ASP A 31 70.378 -4.996 -13.172 1.00 0.00 H new ATOM 460 N VAL A 32 72.398 -6.345 -10.118 1.00 0.00 N ATOM 461 CA VAL A 32 72.762 -7.734 -9.871 1.00 0.00 C ATOM 462 C VAL A 32 72.265 -8.154 -8.493 1.00 0.00 C ATOM 463 O VAL A 32 72.378 -7.402 -7.525 1.00 0.00 O ATOM 464 CB VAL A 32 74.280 -7.912 -9.935 1.00 0.00 C ATOM 465 CG1 VAL A 32 74.625 -9.399 -9.847 1.00 0.00 C ATOM 466 CG2 VAL A 32 74.806 -7.347 -11.256 1.00 0.00 C ATOM 0 H VAL A 32 72.848 -5.670 -9.500 1.00 0.00 H new ATOM 0 HA VAL A 32 72.301 -8.356 -10.638 1.00 0.00 H new ATOM 0 HB VAL A 32 74.741 -7.381 -9.102 1.00 0.00 H new ATOM 0 HG11 VAL A 32 75.707 -9.525 -9.893 1.00 0.00 H new ATOM 0 HG12 VAL A 32 74.252 -9.804 -8.906 1.00 0.00 H new ATOM 0 HG13 VAL A 32 74.163 -9.930 -10.679 1.00 0.00 H new ATOM 0 HG21 VAL A 32 75.888 -7.474 -11.301 1.00 0.00 H new ATOM 0 HG22 VAL A 32 74.343 -7.877 -12.088 1.00 0.00 H new ATOM 0 HG23 VAL A 32 74.562 -6.287 -11.321 1.00 0.00 H new ATOM 476 N ALA A 33 71.706 -9.359 -8.412 1.00 0.00 N ATOM 477 CA ALA A 33 71.182 -9.864 -7.140 1.00 0.00 C ATOM 478 C ALA A 33 72.253 -9.824 -6.054 1.00 0.00 C ATOM 479 O ALA A 33 73.445 -9.963 -6.329 1.00 0.00 O ATOM 480 CB ALA A 33 70.686 -11.302 -7.294 1.00 0.00 C ATOM 0 H ALA A 33 71.604 -9.999 -9.200 1.00 0.00 H new ATOM 0 HA ALA A 33 70.352 -9.220 -6.850 1.00 0.00 H new ATOM 0 HB1 ALA A 33 70.301 -11.658 -6.339 1.00 0.00 H new ATOM 0 HB2 ALA A 33 69.892 -11.335 -8.040 1.00 0.00 H new ATOM 0 HB3 ALA A 33 71.511 -11.939 -7.613 1.00 0.00 H new ATOM 486 N PHE A 34 71.809 -9.631 -4.813 1.00 0.00 N ATOM 487 CA PHE A 34 72.729 -9.569 -3.671 1.00 0.00 C ATOM 488 C PHE A 34 73.635 -10.799 -3.633 1.00 0.00 C ATOM 489 O PHE A 34 74.848 -10.690 -3.455 1.00 0.00 O ATOM 490 CB PHE A 34 71.940 -9.493 -2.366 1.00 0.00 C ATOM 491 CG PHE A 34 71.147 -8.208 -2.335 1.00 0.00 C ATOM 492 CD1 PHE A 34 71.813 -6.977 -2.385 1.00 0.00 C ATOM 493 CD2 PHE A 34 69.751 -8.245 -2.259 1.00 0.00 C ATOM 494 CE1 PHE A 34 71.083 -5.784 -2.359 1.00 0.00 C ATOM 495 CE2 PHE A 34 69.021 -7.050 -2.233 1.00 0.00 C ATOM 496 CZ PHE A 34 69.687 -5.821 -2.283 1.00 0.00 C ATOM 0 H PHE A 34 70.825 -9.515 -4.570 1.00 0.00 H new ATOM 0 HA PHE A 34 73.345 -8.677 -3.785 1.00 0.00 H new ATOM 0 HB2 PHE A 34 71.270 -10.349 -2.282 1.00 0.00 H new ATOM 0 HB3 PHE A 34 72.619 -9.535 -1.514 1.00 0.00 H new ATOM 0 HD1 PHE A 34 72.891 -6.949 -2.444 1.00 0.00 H new ATOM 0 HD2 PHE A 34 69.237 -9.194 -2.220 1.00 0.00 H new ATOM 0 HE1 PHE A 34 71.597 -4.835 -2.398 1.00 0.00 H new ATOM 0 HE2 PHE A 34 67.943 -7.077 -2.174 1.00 0.00 H new ATOM 0 HZ PHE A 34 69.123 -4.900 -2.263 1.00 0.00 H new ATOM 506 N ASP A 35 73.031 -11.968 -3.808 1.00 0.00 N ATOM 507 CA ASP A 35 73.783 -13.213 -3.800 1.00 0.00 C ATOM 508 C ASP A 35 74.650 -13.335 -5.055 1.00 0.00 C ATOM 509 O ASP A 35 75.635 -14.074 -5.072 1.00 0.00 O ATOM 510 CB ASP A 35 72.825 -14.402 -3.740 1.00 0.00 C ATOM 511 CG ASP A 35 71.965 -14.300 -2.485 1.00 0.00 C ATOM 512 OD1 ASP A 35 71.122 -13.419 -2.438 1.00 0.00 O ATOM 513 OD2 ASP A 35 72.161 -15.104 -1.589 1.00 0.00 O ATOM 0 H ASP A 35 72.028 -12.078 -3.956 1.00 0.00 H new ATOM 0 HA ASP A 35 74.428 -13.211 -2.921 1.00 0.00 H new ATOM 0 HB2 ASP A 35 72.192 -14.418 -4.627 1.00 0.00 H new ATOM 0 HB3 ASP A 35 73.387 -15.336 -3.733 1.00 0.00 H new ATOM 518 N ALA A 36 74.268 -12.615 -6.111 1.00 0.00 N ATOM 519 CA ALA A 36 75.012 -12.666 -7.362 1.00 0.00 C ATOM 520 C ALA A 36 76.224 -11.735 -7.336 1.00 0.00 C ATOM 521 O ALA A 36 77.185 -11.942 -8.078 1.00 0.00 O ATOM 522 CB ALA A 36 74.109 -12.265 -8.530 1.00 0.00 C ATOM 0 H ALA A 36 73.456 -11.997 -6.122 1.00 0.00 H new ATOM 0 HA ALA A 36 75.361 -13.691 -7.489 1.00 0.00 H new ATOM 0 HB1 ALA A 36 74.676 -12.307 -9.460 1.00 0.00 H new ATOM 0 HB2 ALA A 36 73.264 -12.951 -8.589 1.00 0.00 H new ATOM 0 HB3 ALA A 36 73.742 -11.251 -8.374 1.00 0.00 H new ATOM 528 N LEU A 37 76.177 -10.706 -6.489 1.00 0.00 N ATOM 529 CA LEU A 37 77.294 -9.764 -6.415 1.00 0.00 C ATOM 530 C LEU A 37 78.270 -10.154 -5.305 1.00 0.00 C ATOM 531 O LEU A 37 79.460 -9.849 -5.381 1.00 0.00 O ATOM 532 CB LEU A 37 76.792 -8.332 -6.192 1.00 0.00 C ATOM 533 CG LEU A 37 76.275 -8.011 -4.786 1.00 0.00 C ATOM 534 CD1 LEU A 37 77.446 -7.589 -3.887 1.00 0.00 C ATOM 535 CD2 LEU A 37 75.250 -6.872 -4.873 1.00 0.00 C ATOM 0 H LEU A 37 75.399 -10.506 -5.860 1.00 0.00 H new ATOM 0 HA LEU A 37 77.820 -9.804 -7.369 1.00 0.00 H new ATOM 0 HB2 LEU A 37 77.604 -7.643 -6.424 1.00 0.00 H new ATOM 0 HB3 LEU A 37 75.992 -8.134 -6.905 1.00 0.00 H new ATOM 0 HG LEU A 37 75.801 -8.896 -4.360 1.00 0.00 H new ATOM 0 HD11 LEU A 37 77.074 -7.362 -2.888 1.00 0.00 H new ATOM 0 HD12 LEU A 37 78.171 -8.401 -3.828 1.00 0.00 H new ATOM 0 HD13 LEU A 37 77.926 -6.704 -4.306 1.00 0.00 H new ATOM 0 HD21 LEU A 37 74.879 -6.640 -3.875 1.00 0.00 H new ATOM 0 HD22 LEU A 37 75.724 -5.988 -5.299 1.00 0.00 H new ATOM 0 HD23 LEU A 37 74.418 -7.179 -5.507 1.00 0.00 H new ATOM 547 N GLY A 38 77.769 -10.840 -4.279 1.00 0.00 N ATOM 548 CA GLY A 38 78.639 -11.264 -3.182 1.00 0.00 C ATOM 549 C GLY A 38 77.973 -11.129 -1.809 1.00 0.00 C ATOM 550 O GLY A 38 78.522 -11.589 -0.807 1.00 0.00 O ATOM 0 H GLY A 38 76.790 -11.109 -4.183 1.00 0.00 H new ATOM 0 HA2 GLY A 38 78.932 -12.302 -3.338 1.00 0.00 H new ATOM 0 HA3 GLY A 38 79.552 -10.669 -3.198 1.00 0.00 H new ATOM 554 N TYR A 39 76.797 -10.503 -1.752 1.00 0.00 N ATOM 555 CA TYR A 39 76.110 -10.339 -0.475 1.00 0.00 C ATOM 556 C TYR A 39 75.413 -11.638 -0.085 1.00 0.00 C ATOM 557 O TYR A 39 75.016 -12.422 -0.946 1.00 0.00 O ATOM 558 CB TYR A 39 75.077 -9.218 -0.575 1.00 0.00 C ATOM 559 CG TYR A 39 75.778 -7.884 -0.601 1.00 0.00 C ATOM 560 CD1 TYR A 39 76.667 -7.535 0.422 1.00 0.00 C ATOM 561 CD2 TYR A 39 75.539 -6.993 -1.653 1.00 0.00 C ATOM 562 CE1 TYR A 39 77.318 -6.296 0.392 1.00 0.00 C ATOM 563 CE2 TYR A 39 76.188 -5.754 -1.683 1.00 0.00 C ATOM 564 CZ TYR A 39 77.077 -5.405 -0.662 1.00 0.00 C ATOM 565 OH TYR A 39 77.720 -4.184 -0.694 1.00 0.00 O ATOM 0 H TYR A 39 76.310 -10.110 -2.557 1.00 0.00 H new ATOM 0 HA TYR A 39 76.847 -10.083 0.286 1.00 0.00 H new ATOM 0 HB2 TYR A 39 74.477 -9.342 -1.476 1.00 0.00 H new ATOM 0 HB3 TYR A 39 74.393 -9.264 0.272 1.00 0.00 H new ATOM 0 HD1 TYR A 39 76.851 -8.222 1.235 1.00 0.00 H new ATOM 0 HD2 TYR A 39 74.853 -7.262 -2.443 1.00 0.00 H new ATOM 0 HE1 TYR A 39 78.005 -6.027 1.181 1.00 0.00 H new ATOM 0 HE2 TYR A 39 76.002 -5.067 -2.495 1.00 0.00 H new ATOM 0 HH TYR A 39 77.441 -3.688 -1.492 1.00 0.00 H new ATOM 575 N ASP A 40 75.268 -11.865 1.218 1.00 0.00 N ATOM 576 CA ASP A 40 74.617 -13.082 1.689 1.00 0.00 C ATOM 577 C ASP A 40 73.170 -12.793 2.065 1.00 0.00 C ATOM 578 O ASP A 40 72.237 -13.164 1.352 1.00 0.00 O ATOM 579 CB ASP A 40 75.356 -13.650 2.906 1.00 0.00 C ATOM 580 CG ASP A 40 76.703 -14.215 2.466 1.00 0.00 C ATOM 581 OD1 ASP A 40 76.740 -14.871 1.438 1.00 0.00 O ATOM 582 OD2 ASP A 40 77.676 -13.982 3.163 1.00 0.00 O ATOM 0 H ASP A 40 75.586 -11.235 1.954 1.00 0.00 H new ATOM 0 HA ASP A 40 74.641 -13.816 0.883 1.00 0.00 H new ATOM 0 HB2 ASP A 40 75.504 -12.869 3.652 1.00 0.00 H new ATOM 0 HB3 ASP A 40 74.758 -14.431 3.376 1.00 0.00 H new ATOM 587 N SER A 41 73.000 -12.123 3.197 1.00 0.00 N ATOM 588 CA SER A 41 71.673 -11.767 3.693 1.00 0.00 C ATOM 589 C SER A 41 71.808 -11.178 5.086 1.00 0.00 C ATOM 590 O SER A 41 71.208 -10.153 5.410 1.00 0.00 O ATOM 591 CB SER A 41 70.754 -12.992 3.758 1.00 0.00 C ATOM 592 OG SER A 41 70.045 -13.113 2.531 1.00 0.00 O ATOM 0 H SER A 41 73.767 -11.813 3.793 1.00 0.00 H new ATOM 0 HA SER A 41 71.233 -11.043 3.007 1.00 0.00 H new ATOM 0 HB2 SER A 41 71.341 -13.892 3.943 1.00 0.00 H new ATOM 0 HB3 SER A 41 70.054 -12.892 4.588 1.00 0.00 H new ATOM 0 HG SER A 41 70.664 -13.382 1.821 1.00 0.00 H new ATOM 598 N LEU A 42 72.625 -11.841 5.903 1.00 0.00 N ATOM 599 CA LEU A 42 72.865 -11.391 7.275 1.00 0.00 C ATOM 600 C LEU A 42 73.314 -9.933 7.292 1.00 0.00 C ATOM 601 O LEU A 42 72.879 -9.142 8.131 1.00 0.00 O ATOM 602 CB LEU A 42 73.941 -12.253 7.940 1.00 0.00 C ATOM 603 CG LEU A 42 73.427 -13.533 8.602 1.00 0.00 C ATOM 604 CD1 LEU A 42 72.494 -13.171 9.760 1.00 0.00 C ATOM 605 CD2 LEU A 42 72.661 -14.367 7.573 1.00 0.00 C ATOM 0 H LEU A 42 73.130 -12.688 5.641 1.00 0.00 H new ATOM 0 HA LEU A 42 71.930 -11.486 7.827 1.00 0.00 H new ATOM 0 HB2 LEU A 42 74.684 -12.523 7.189 1.00 0.00 H new ATOM 0 HB3 LEU A 42 74.452 -11.653 8.693 1.00 0.00 H new ATOM 0 HG LEU A 42 74.271 -14.109 8.982 1.00 0.00 H new ATOM 0 HD11 LEU A 42 72.128 -14.083 10.231 1.00 0.00 H new ATOM 0 HD12 LEU A 42 73.038 -12.577 10.494 1.00 0.00 H new ATOM 0 HD13 LEU A 42 71.650 -12.595 9.381 1.00 0.00 H new ATOM 0 HD21 LEU A 42 72.295 -15.279 8.044 1.00 0.00 H new ATOM 0 HD22 LEU A 42 71.817 -13.791 7.193 1.00 0.00 H new ATOM 0 HD23 LEU A 42 73.325 -14.626 6.748 1.00 0.00 H new ATOM 617 N ALA A 43 74.178 -9.580 6.343 1.00 0.00 N ATOM 618 CA ALA A 43 74.661 -8.209 6.256 1.00 0.00 C ATOM 619 C ALA A 43 73.527 -7.291 5.840 1.00 0.00 C ATOM 620 O ALA A 43 73.324 -6.237 6.433 1.00 0.00 O ATOM 621 CB ALA A 43 75.801 -8.098 5.241 1.00 0.00 C ATOM 0 H ALA A 43 74.551 -10.213 5.636 1.00 0.00 H new ATOM 0 HA ALA A 43 75.034 -7.914 7.237 1.00 0.00 H new ATOM 0 HB1 ALA A 43 76.146 -7.065 5.193 1.00 0.00 H new ATOM 0 HB2 ALA A 43 76.625 -8.742 5.548 1.00 0.00 H new ATOM 0 HB3 ALA A 43 75.445 -8.408 4.259 1.00 0.00 H new ATOM 627 N LEU A 44 72.780 -7.722 4.826 1.00 0.00 N ATOM 628 CA LEU A 44 71.645 -6.942 4.332 1.00 0.00 C ATOM 629 C LEU A 44 70.628 -6.741 5.447 1.00 0.00 C ATOM 630 O LEU A 44 70.134 -5.639 5.670 1.00 0.00 O ATOM 631 CB LEU A 44 70.974 -7.666 3.166 1.00 0.00 C ATOM 632 CG LEU A 44 71.613 -7.412 1.803 1.00 0.00 C ATOM 633 CD1 LEU A 44 71.047 -8.394 0.777 1.00 0.00 C ATOM 634 CD2 LEU A 44 71.303 -5.981 1.364 1.00 0.00 C ATOM 0 H LEU A 44 72.937 -8.601 4.333 1.00 0.00 H new ATOM 0 HA LEU A 44 72.012 -5.973 3.992 1.00 0.00 H new ATOM 0 HB2 LEU A 44 70.989 -8.738 3.365 1.00 0.00 H new ATOM 0 HB3 LEU A 44 69.927 -7.364 3.123 1.00 0.00 H new ATOM 0 HG LEU A 44 72.692 -7.551 1.874 1.00 0.00 H new ATOM 0 HD11 LEU A 44 71.505 -8.210 -0.195 1.00 0.00 H new ATOM 0 HD12 LEU A 44 71.263 -9.415 1.092 1.00 0.00 H new ATOM 0 HD13 LEU A 44 69.968 -8.259 0.701 1.00 0.00 H new ATOM 0 HD21 LEU A 44 71.757 -5.793 0.391 1.00 0.00 H new ATOM 0 HD22 LEU A 44 70.223 -5.848 1.293 1.00 0.00 H new ATOM 0 HD23 LEU A 44 71.708 -5.281 2.095 1.00 0.00 H new ATOM 646 N LEU A 45 70.333 -7.831 6.152 1.00 0.00 N ATOM 647 CA LEU A 45 69.378 -7.797 7.265 1.00 0.00 C ATOM 648 C LEU A 45 69.704 -6.651 8.227 1.00 0.00 C ATOM 649 O LEU A 45 68.844 -5.835 8.561 1.00 0.00 O ATOM 650 CB LEU A 45 69.415 -9.133 8.025 1.00 0.00 C ATOM 651 CG LEU A 45 68.677 -9.166 9.371 1.00 0.00 C ATOM 652 CD1 LEU A 45 67.254 -8.632 9.193 1.00 0.00 C ATOM 653 CD2 LEU A 45 68.619 -10.606 9.882 1.00 0.00 C ATOM 0 H LEU A 45 70.739 -8.750 5.975 1.00 0.00 H new ATOM 0 HA LEU A 45 68.381 -7.635 6.856 1.00 0.00 H new ATOM 0 HB2 LEU A 45 68.991 -9.905 7.383 1.00 0.00 H new ATOM 0 HB3 LEU A 45 70.457 -9.400 8.199 1.00 0.00 H new ATOM 0 HG LEU A 45 69.209 -8.543 10.090 1.00 0.00 H new ATOM 0 HD11 LEU A 45 66.734 -8.657 10.150 1.00 0.00 H new ATOM 0 HD12 LEU A 45 67.294 -7.606 8.828 1.00 0.00 H new ATOM 0 HD13 LEU A 45 66.720 -9.252 8.473 1.00 0.00 H new ATOM 0 HD21 LEU A 45 68.095 -10.632 10.838 1.00 0.00 H new ATOM 0 HD22 LEU A 45 68.088 -11.227 9.160 1.00 0.00 H new ATOM 0 HD23 LEU A 45 69.632 -10.987 10.013 1.00 0.00 H new ATOM 665 N ASN A 46 70.957 -6.602 8.658 1.00 0.00 N ATOM 666 CA ASN A 46 71.393 -5.553 9.574 1.00 0.00 C ATOM 667 C ASN A 46 71.263 -4.185 8.914 1.00 0.00 C ATOM 668 O ASN A 46 70.693 -3.255 9.486 1.00 0.00 O ATOM 669 CB ASN A 46 72.849 -5.768 9.985 1.00 0.00 C ATOM 670 CG ASN A 46 72.997 -7.133 10.646 1.00 0.00 C ATOM 671 OD1 ASN A 46 72.277 -7.454 11.593 1.00 0.00 O ATOM 672 ND2 ASN A 46 73.897 -7.963 10.201 1.00 0.00 N ATOM 0 H ASN A 46 71.683 -7.267 8.393 1.00 0.00 H new ATOM 0 HA ASN A 46 70.758 -5.595 10.459 1.00 0.00 H new ATOM 0 HB2 ASN A 46 73.497 -5.704 9.111 1.00 0.00 H new ATOM 0 HB3 ASN A 46 73.163 -4.983 10.673 1.00 0.00 H new ATOM 0 HD21 ASN A 46 74.006 -8.879 10.636 1.00 0.00 H new ATOM 0 HD22 ASN A 46 74.493 -7.697 9.417 1.00 0.00 H new ATOM 679 N THR A 47 71.805 -4.069 7.702 1.00 0.00 N ATOM 680 CA THR A 47 71.749 -2.799 6.969 1.00 0.00 C ATOM 681 C THR A 47 70.305 -2.335 6.780 1.00 0.00 C ATOM 682 O THR A 47 69.994 -1.157 6.949 1.00 0.00 O ATOM 683 CB THR A 47 72.426 -2.929 5.594 1.00 0.00 C ATOM 684 OG1 THR A 47 72.542 -4.293 5.247 1.00 0.00 O ATOM 685 CG2 THR A 47 73.818 -2.301 5.645 1.00 0.00 C ATOM 0 H THR A 47 72.282 -4.825 7.211 1.00 0.00 H new ATOM 0 HA THR A 47 72.284 -2.058 7.563 1.00 0.00 H new ATOM 0 HB THR A 47 71.821 -2.414 4.848 1.00 0.00 H new ATOM 0 HG1 THR A 47 73.312 -4.684 5.711 1.00 0.00 H new ATOM 0 HG21 THR A 47 74.295 -2.395 4.670 1.00 0.00 H new ATOM 0 HG22 THR A 47 73.732 -1.247 5.907 1.00 0.00 H new ATOM 0 HG23 THR A 47 74.421 -2.813 6.395 1.00 0.00 H new ATOM 693 N VAL A 48 69.428 -3.270 6.430 1.00 0.00 N ATOM 694 CA VAL A 48 68.017 -2.938 6.223 1.00 0.00 C ATOM 695 C VAL A 48 67.417 -2.364 7.507 1.00 0.00 C ATOM 696 O VAL A 48 66.538 -1.506 7.464 1.00 0.00 O ATOM 697 CB VAL A 48 67.225 -4.183 5.793 1.00 0.00 C ATOM 698 CG1 VAL A 48 65.757 -3.813 5.542 1.00 0.00 C ATOM 699 CG2 VAL A 48 67.828 -4.753 4.502 1.00 0.00 C ATOM 0 H VAL A 48 69.662 -4.252 6.284 1.00 0.00 H new ATOM 0 HA VAL A 48 67.954 -2.191 5.431 1.00 0.00 H new ATOM 0 HB VAL A 48 67.278 -4.928 6.587 1.00 0.00 H new ATOM 0 HG11 VAL A 48 65.205 -4.702 5.238 1.00 0.00 H new ATOM 0 HG12 VAL A 48 65.322 -3.411 6.457 1.00 0.00 H new ATOM 0 HG13 VAL A 48 65.701 -3.063 4.753 1.00 0.00 H new ATOM 0 HG21 VAL A 48 67.266 -5.636 4.197 1.00 0.00 H new ATOM 0 HG22 VAL A 48 67.778 -4.001 3.714 1.00 0.00 H new ATOM 0 HG23 VAL A 48 68.868 -5.027 4.677 1.00 0.00 H new ATOM 709 N GLY A 49 67.909 -2.847 8.646 1.00 0.00 N ATOM 710 CA GLY A 49 67.420 -2.373 9.938 1.00 0.00 C ATOM 711 C GLY A 49 67.849 -0.928 10.183 1.00 0.00 C ATOM 712 O GLY A 49 67.077 -0.104 10.679 1.00 0.00 O ATOM 0 H GLY A 49 68.638 -3.558 8.701 1.00 0.00 H new ATOM 0 HA2 GLY A 49 66.333 -2.445 9.969 1.00 0.00 H new ATOM 0 HA3 GLY A 49 67.804 -3.011 10.734 1.00 0.00 H new ATOM 716 N ARG A 50 69.096 -0.630 9.833 1.00 0.00 N ATOM 717 CA ARG A 50 69.626 0.714 10.021 1.00 0.00 C ATOM 718 C ARG A 50 68.925 1.702 9.095 1.00 0.00 C ATOM 719 O ARG A 50 68.641 2.837 9.479 1.00 0.00 O ATOM 720 CB ARG A 50 71.130 0.742 9.736 1.00 0.00 C ATOM 721 CG ARG A 50 71.759 1.970 10.403 1.00 0.00 C ATOM 722 CD ARG A 50 72.434 1.557 11.712 1.00 0.00 C ATOM 723 NE ARG A 50 71.455 1.489 12.801 1.00 0.00 N ATOM 724 CZ ARG A 50 71.002 2.589 13.421 1.00 0.00 C ATOM 725 NH1 ARG A 50 71.418 3.784 13.076 1.00 0.00 N ATOM 726 NH2 ARG A 50 70.132 2.466 14.385 1.00 0.00 N ATOM 0 H ARG A 50 69.752 -1.294 9.422 1.00 0.00 H new ATOM 0 HA ARG A 50 69.448 1.002 11.057 1.00 0.00 H new ATOM 0 HB2 ARG A 50 71.598 -0.168 10.112 1.00 0.00 H new ATOM 0 HB3 ARG A 50 71.306 0.770 8.661 1.00 0.00 H new ATOM 0 HG2 ARG A 50 72.489 2.425 9.734 1.00 0.00 H new ATOM 0 HG3 ARG A 50 70.994 2.721 10.598 1.00 0.00 H new ATOM 0 HD2 ARG A 50 72.916 0.587 11.588 1.00 0.00 H new ATOM 0 HD3 ARG A 50 73.217 2.272 11.964 1.00 0.00 H new ATOM 0 HE ARG A 50 71.107 0.577 13.097 1.00 0.00 H new ATOM 0 HH11 ARG A 50 72.098 3.890 12.324 1.00 0.00 H new ATOM 0 HH12 ARG A 50 71.061 4.608 13.560 1.00 0.00 H new ATOM 0 HH21 ARG A 50 69.803 1.541 14.660 1.00 0.00 H new ATOM 0 HH22 ARG A 50 69.781 3.295 14.864 1.00 0.00 H new ATOM 740 N ILE A 51 68.652 1.263 7.871 1.00 0.00 N ATOM 741 CA ILE A 51 67.986 2.124 6.898 1.00 0.00 C ATOM 742 C ILE A 51 66.558 2.429 7.342 1.00 0.00 C ATOM 743 O ILE A 51 66.125 3.579 7.318 1.00 0.00 O ATOM 744 CB ILE A 51 67.956 1.460 5.516 1.00 0.00 C ATOM 745 CG1 ILE A 51 69.379 1.070 5.104 1.00 0.00 C ATOM 746 CG2 ILE A 51 67.385 2.440 4.485 1.00 0.00 C ATOM 747 CD1 ILE A 51 69.341 -0.183 4.222 1.00 0.00 C ATOM 0 H ILE A 51 68.878 0.328 7.531 1.00 0.00 H new ATOM 0 HA ILE A 51 68.550 3.054 6.834 1.00 0.00 H new ATOM 0 HB ILE A 51 67.329 0.570 5.560 1.00 0.00 H new ATOM 0 HG12 ILE A 51 69.849 1.892 4.564 1.00 0.00 H new ATOM 0 HG13 ILE A 51 69.985 0.883 5.990 1.00 0.00 H new ATOM 0 HG21 ILE A 51 67.365 1.965 3.504 1.00 0.00 H new ATOM 0 HG22 ILE A 51 66.372 2.722 4.773 1.00 0.00 H new ATOM 0 HG23 ILE A 51 68.011 3.331 4.444 1.00 0.00 H new ATOM 0 HD11 ILE A 51 70.356 -0.455 3.932 1.00 0.00 H new ATOM 0 HD12 ILE A 51 68.889 -1.005 4.777 1.00 0.00 H new ATOM 0 HD13 ILE A 51 68.751 0.019 3.328 1.00 0.00 H new ATOM 759 N GLU A 52 65.826 1.394 7.745 1.00 0.00 N ATOM 760 CA GLU A 52 64.445 1.590 8.183 1.00 0.00 C ATOM 761 C GLU A 52 64.386 2.527 9.388 1.00 0.00 C ATOM 762 O GLU A 52 63.385 3.204 9.608 1.00 0.00 O ATOM 763 CB GLU A 52 63.780 0.256 8.539 1.00 0.00 C ATOM 764 CG GLU A 52 64.551 -0.429 9.669 1.00 0.00 C ATOM 765 CD GLU A 52 63.732 -1.596 10.211 1.00 0.00 C ATOM 766 OE1 GLU A 52 63.757 -2.647 9.594 1.00 0.00 O ATOM 767 OE2 GLU A 52 63.093 -1.419 11.235 1.00 0.00 O ATOM 0 H GLU A 52 66.156 0.429 7.778 1.00 0.00 H new ATOM 0 HA GLU A 52 63.902 2.040 7.352 1.00 0.00 H new ATOM 0 HB2 GLU A 52 62.747 0.425 8.843 1.00 0.00 H new ATOM 0 HB3 GLU A 52 63.752 -0.391 7.662 1.00 0.00 H new ATOM 0 HG2 GLU A 52 65.513 -0.786 9.302 1.00 0.00 H new ATOM 0 HG3 GLU A 52 64.758 0.285 10.466 1.00 0.00 H new ATOM 774 N ARG A 53 65.464 2.559 10.169 1.00 0.00 N ATOM 775 CA ARG A 53 65.499 3.426 11.344 1.00 0.00 C ATOM 776 C ARG A 53 66.056 4.801 10.987 1.00 0.00 C ATOM 777 O ARG A 53 65.534 5.828 11.418 1.00 0.00 O ATOM 778 CB ARG A 53 66.363 2.808 12.446 1.00 0.00 C ATOM 779 CG ARG A 53 65.806 3.204 13.816 1.00 0.00 C ATOM 780 CD ARG A 53 66.960 3.411 14.799 1.00 0.00 C ATOM 781 NE ARG A 53 66.542 4.261 15.915 1.00 0.00 N ATOM 782 CZ ARG A 53 66.237 5.557 15.750 1.00 0.00 C ATOM 783 NH1 ARG A 53 66.305 6.127 14.571 1.00 0.00 N ATOM 784 NH2 ARG A 53 65.869 6.265 16.783 1.00 0.00 N ATOM 0 H ARG A 53 66.308 2.007 10.015 1.00 0.00 H new ATOM 0 HA ARG A 53 64.476 3.535 11.704 1.00 0.00 H new ATOM 0 HB2 ARG A 53 66.376 1.723 12.347 1.00 0.00 H new ATOM 0 HB3 ARG A 53 67.394 3.149 12.349 1.00 0.00 H new ATOM 0 HG2 ARG A 53 65.219 4.119 13.731 1.00 0.00 H new ATOM 0 HG3 ARG A 53 65.135 2.428 14.185 1.00 0.00 H new ATOM 0 HD2 ARG A 53 67.300 2.447 15.177 1.00 0.00 H new ATOM 0 HD3 ARG A 53 67.805 3.868 14.284 1.00 0.00 H new ATOM 0 HE ARG A 53 66.481 3.855 16.849 1.00 0.00 H new ATOM 0 HH11 ARG A 53 66.594 5.584 13.758 1.00 0.00 H new ATOM 0 HH12 ARG A 53 66.069 7.114 14.467 1.00 0.00 H new ATOM 0 HH21 ARG A 53 65.815 5.832 17.705 1.00 0.00 H new ATOM 0 HH22 ARG A 53 65.635 7.251 16.668 1.00 0.00 H new ATOM 798 N ASP A 54 67.125 4.808 10.199 1.00 0.00 N ATOM 799 CA ASP A 54 67.751 6.059 9.791 1.00 0.00 C ATOM 800 C ASP A 54 66.856 6.824 8.820 1.00 0.00 C ATOM 801 O ASP A 54 66.711 8.042 8.918 1.00 0.00 O ATOM 802 CB ASP A 54 69.097 5.788 9.117 1.00 0.00 C ATOM 803 CG ASP A 54 70.169 5.546 10.177 1.00 0.00 C ATOM 804 OD1 ASP A 54 70.047 6.100 11.258 1.00 0.00 O ATOM 805 OD2 ASP A 54 71.102 4.814 9.889 1.00 0.00 O ATOM 0 H ASP A 54 67.573 3.968 9.832 1.00 0.00 H new ATOM 0 HA ASP A 54 67.904 6.660 10.687 1.00 0.00 H new ATOM 0 HB2 ASP A 54 69.018 4.920 8.463 1.00 0.00 H new ATOM 0 HB3 ASP A 54 69.377 6.635 8.491 1.00 0.00 H new ATOM 810 N TYR A 55 66.262 6.096 7.879 1.00 0.00 N ATOM 811 CA TYR A 55 65.387 6.719 6.890 1.00 0.00 C ATOM 812 C TYR A 55 63.939 6.734 7.377 1.00 0.00 C ATOM 813 O TYR A 55 63.152 7.597 6.986 1.00 0.00 O ATOM 814 CB TYR A 55 65.459 5.968 5.558 1.00 0.00 C ATOM 815 CG TYR A 55 66.814 6.193 4.928 1.00 0.00 C ATOM 816 CD1 TYR A 55 67.935 5.515 5.418 1.00 0.00 C ATOM 817 CD2 TYR A 55 66.947 7.081 3.853 1.00 0.00 C ATOM 818 CE1 TYR A 55 69.190 5.723 4.835 1.00 0.00 C ATOM 819 CE2 TYR A 55 68.202 7.291 3.269 1.00 0.00 C ATOM 820 CZ TYR A 55 69.324 6.611 3.760 1.00 0.00 C ATOM 821 OH TYR A 55 70.562 6.818 3.185 1.00 0.00 O ATOM 0 H TYR A 55 66.368 5.086 7.780 1.00 0.00 H new ATOM 0 HA TYR A 55 65.728 7.745 6.748 1.00 0.00 H new ATOM 0 HB2 TYR A 55 65.293 4.903 5.719 1.00 0.00 H new ATOM 0 HB3 TYR A 55 64.672 6.316 4.889 1.00 0.00 H new ATOM 0 HD1 TYR A 55 67.832 4.830 6.247 1.00 0.00 H new ATOM 0 HD2 TYR A 55 66.081 7.604 3.474 1.00 0.00 H new ATOM 0 HE1 TYR A 55 70.055 5.199 5.214 1.00 0.00 H new ATOM 0 HE2 TYR A 55 68.305 7.977 2.441 1.00 0.00 H new ATOM 0 HH TYR A 55 70.478 7.463 2.452 1.00 0.00 H new ATOM 831 N GLY A 56 63.591 5.776 8.236 1.00 0.00 N ATOM 832 CA GLY A 56 62.228 5.709 8.761 1.00 0.00 C ATOM 833 C GLY A 56 61.273 5.125 7.724 1.00 0.00 C ATOM 834 O GLY A 56 60.096 5.484 7.675 1.00 0.00 O ATOM 0 H GLY A 56 64.220 5.049 8.578 1.00 0.00 H new ATOM 0 HA2 GLY A 56 62.211 5.097 9.663 1.00 0.00 H new ATOM 0 HA3 GLY A 56 61.895 6.707 9.047 1.00 0.00 H new ATOM 838 N VAL A 57 61.790 4.222 6.896 1.00 0.00 N ATOM 839 CA VAL A 57 60.969 3.595 5.862 1.00 0.00 C ATOM 840 C VAL A 57 60.258 2.363 6.425 1.00 0.00 C ATOM 841 O VAL A 57 60.795 1.650 7.275 1.00 0.00 O ATOM 842 CB VAL A 57 61.836 3.195 4.654 1.00 0.00 C ATOM 843 CG1 VAL A 57 62.928 2.217 5.094 1.00 0.00 C ATOM 844 CG2 VAL A 57 60.964 2.538 3.574 1.00 0.00 C ATOM 0 H VAL A 57 62.761 3.910 6.918 1.00 0.00 H new ATOM 0 HA VAL A 57 60.221 4.316 5.532 1.00 0.00 H new ATOM 0 HB VAL A 57 62.300 4.092 4.244 1.00 0.00 H new ATOM 0 HG11 VAL A 57 63.536 1.940 4.233 1.00 0.00 H new ATOM 0 HG12 VAL A 57 63.559 2.690 5.847 1.00 0.00 H new ATOM 0 HG13 VAL A 57 62.468 1.324 5.516 1.00 0.00 H new ATOM 0 HG21 VAL A 57 61.586 2.259 2.724 1.00 0.00 H new ATOM 0 HG22 VAL A 57 60.488 1.647 3.983 1.00 0.00 H new ATOM 0 HG23 VAL A 57 60.198 3.241 3.247 1.00 0.00 H new ATOM 854 N GLN A 58 59.044 2.123 5.938 1.00 0.00 N ATOM 855 CA GLN A 58 58.264 0.976 6.393 1.00 0.00 C ATOM 856 C GLN A 58 57.013 0.807 5.531 1.00 0.00 C ATOM 857 O GLN A 58 55.887 0.783 6.033 1.00 0.00 O ATOM 858 CB GLN A 58 57.856 1.157 7.858 1.00 0.00 C ATOM 859 CG GLN A 58 57.308 -0.165 8.399 1.00 0.00 C ATOM 860 CD GLN A 58 57.353 -0.149 9.924 1.00 0.00 C ATOM 861 OE1 GLN A 58 56.318 -0.036 10.581 1.00 0.00 O ATOM 862 NE2 GLN A 58 58.502 -0.257 10.532 1.00 0.00 N ATOM 0 H GLN A 58 58.582 2.701 5.235 1.00 0.00 H new ATOM 0 HA GLN A 58 58.883 0.084 6.302 1.00 0.00 H new ATOM 0 HB2 GLN A 58 58.714 1.477 8.449 1.00 0.00 H new ATOM 0 HB3 GLN A 58 57.101 1.939 7.943 1.00 0.00 H new ATOM 0 HG2 GLN A 58 56.284 -0.314 8.056 1.00 0.00 H new ATOM 0 HG3 GLN A 58 57.896 -0.999 8.016 1.00 0.00 H new ATOM 0 HE21 GLN A 58 59.360 -0.351 9.988 1.00 0.00 H new ATOM 0 HE22 GLN A 58 58.543 -0.248 11.551 1.00 0.00 H new ATOM 871 N LEU A 59 57.222 0.686 4.223 1.00 0.00 N ATOM 872 CA LEU A 59 56.104 0.517 3.297 1.00 0.00 C ATOM 873 C LEU A 59 55.621 -0.932 3.304 1.00 0.00 C ATOM 874 O LEU A 59 54.437 -1.205 3.108 1.00 0.00 O ATOM 875 CB LEU A 59 56.517 0.886 1.871 1.00 0.00 C ATOM 876 CG LEU A 59 57.372 2.149 1.740 1.00 0.00 C ATOM 877 CD1 LEU A 59 58.043 2.163 0.366 1.00 0.00 C ATOM 878 CD2 LEU A 59 56.484 3.391 1.889 1.00 0.00 C ATOM 0 H LEU A 59 58.142 0.701 3.784 1.00 0.00 H new ATOM 0 HA LEU A 59 55.302 1.178 3.625 1.00 0.00 H new ATOM 0 HB2 LEU A 59 57.068 0.049 1.443 1.00 0.00 H new ATOM 0 HB3 LEU A 59 55.616 1.014 1.272 1.00 0.00 H new ATOM 0 HG LEU A 59 58.133 2.156 2.520 1.00 0.00 H new ATOM 0 HD11 LEU A 59 58.653 3.061 0.268 1.00 0.00 H new ATOM 0 HD12 LEU A 59 58.675 1.281 0.261 1.00 0.00 H new ATOM 0 HD13 LEU A 59 57.279 2.157 -0.412 1.00 0.00 H new ATOM 0 HD21 LEU A 59 57.095 4.289 1.795 1.00 0.00 H new ATOM 0 HD22 LEU A 59 55.721 3.388 1.110 1.00 0.00 H new ATOM 0 HD23 LEU A 59 56.004 3.380 2.867 1.00 0.00 H new ATOM 890 N GLY A 60 56.551 -1.855 3.530 1.00 0.00 N ATOM 891 CA GLY A 60 56.208 -3.273 3.560 1.00 0.00 C ATOM 892 C GLY A 60 57.395 -4.110 4.027 1.00 0.00 C ATOM 893 O GLY A 60 58.498 -4.004 3.492 1.00 0.00 O ATOM 0 H GLY A 60 57.537 -1.650 3.693 1.00 0.00 H new ATOM 0 HA2 GLY A 60 55.361 -3.432 4.227 1.00 0.00 H new ATOM 0 HA3 GLY A 60 55.897 -3.597 2.567 1.00 0.00 H new ATOM 897 N ASP A 61 57.150 -4.943 5.034 1.00 0.00 N ATOM 898 CA ASP A 61 58.200 -5.801 5.577 1.00 0.00 C ATOM 899 C ASP A 61 58.718 -6.770 4.516 1.00 0.00 C ATOM 900 O ASP A 61 59.861 -7.224 4.579 1.00 0.00 O ATOM 901 CB ASP A 61 57.672 -6.604 6.767 1.00 0.00 C ATOM 902 CG ASP A 61 57.666 -5.725 8.013 1.00 0.00 C ATOM 903 OD1 ASP A 61 58.715 -5.201 8.349 1.00 0.00 O ATOM 904 OD2 ASP A 61 56.612 -5.589 8.613 1.00 0.00 O ATOM 0 H ASP A 61 56.242 -5.043 5.488 1.00 0.00 H new ATOM 0 HA ASP A 61 59.017 -5.157 5.902 1.00 0.00 H new ATOM 0 HB2 ASP A 61 56.664 -6.963 6.558 1.00 0.00 H new ATOM 0 HB3 ASP A 61 58.296 -7.482 6.932 1.00 0.00 H new ATOM 909 N ASP A 62 57.869 -7.085 3.538 1.00 0.00 N ATOM 910 CA ASP A 62 58.261 -8.008 2.478 1.00 0.00 C ATOM 911 C ASP A 62 59.139 -7.324 1.425 1.00 0.00 C ATOM 912 O ASP A 62 59.588 -7.965 0.475 1.00 0.00 O ATOM 913 CB ASP A 62 57.027 -8.590 1.790 1.00 0.00 C ATOM 914 CG ASP A 62 56.133 -7.457 1.302 1.00 0.00 C ATOM 915 OD1 ASP A 62 55.307 -7.003 2.078 1.00 0.00 O ATOM 916 OD2 ASP A 62 56.286 -7.057 0.159 1.00 0.00 O ATOM 0 H ASP A 62 56.920 -6.720 3.459 1.00 0.00 H new ATOM 0 HA ASP A 62 58.836 -8.806 2.948 1.00 0.00 H new ATOM 0 HB2 ASP A 62 57.328 -9.217 0.951 1.00 0.00 H new ATOM 0 HB3 ASP A 62 56.478 -9.227 2.483 1.00 0.00 H new ATOM 921 N ALA A 63 59.402 -6.025 1.602 1.00 0.00 N ATOM 922 CA ALA A 63 60.249 -5.296 0.661 1.00 0.00 C ATOM 923 C ALA A 63 61.617 -5.963 0.567 1.00 0.00 C ATOM 924 O ALA A 63 62.254 -5.974 -0.487 1.00 0.00 O ATOM 925 CB ALA A 63 60.435 -3.853 1.125 1.00 0.00 C ATOM 0 H ALA A 63 59.045 -5.466 2.377 1.00 0.00 H new ATOM 0 HA ALA A 63 59.765 -5.305 -0.316 1.00 0.00 H new ATOM 0 HB1 ALA A 63 61.068 -3.321 0.415 1.00 0.00 H new ATOM 0 HB2 ALA A 63 59.464 -3.362 1.184 1.00 0.00 H new ATOM 0 HB3 ALA A 63 60.906 -3.845 2.108 1.00 0.00 H new ATOM 931 N VAL A 64 62.049 -6.529 1.688 1.00 0.00 N ATOM 932 CA VAL A 64 63.335 -7.214 1.738 1.00 0.00 C ATOM 933 C VAL A 64 63.273 -8.510 0.923 1.00 0.00 C ATOM 934 O VAL A 64 64.279 -8.970 0.383 1.00 0.00 O ATOM 935 CB VAL A 64 63.714 -7.523 3.198 1.00 0.00 C ATOM 936 CG1 VAL A 64 62.684 -8.474 3.820 1.00 0.00 C ATOM 937 CG2 VAL A 64 65.108 -8.164 3.253 1.00 0.00 C ATOM 0 H VAL A 64 61.533 -6.528 2.568 1.00 0.00 H new ATOM 0 HA VAL A 64 64.097 -6.564 1.308 1.00 0.00 H new ATOM 0 HB VAL A 64 63.725 -6.591 3.763 1.00 0.00 H new ATOM 0 HG11 VAL A 64 62.962 -8.686 4.853 1.00 0.00 H new ATOM 0 HG12 VAL A 64 61.699 -8.008 3.797 1.00 0.00 H new ATOM 0 HG13 VAL A 64 62.659 -9.404 3.253 1.00 0.00 H new ATOM 0 HG21 VAL A 64 65.369 -8.380 4.289 1.00 0.00 H new ATOM 0 HG22 VAL A 64 65.105 -9.091 2.679 1.00 0.00 H new ATOM 0 HG23 VAL A 64 65.841 -7.477 2.830 1.00 0.00 H new ATOM 947 N GLU A 65 62.075 -9.090 0.836 1.00 0.00 N ATOM 948 CA GLU A 65 61.893 -10.326 0.084 1.00 0.00 C ATOM 949 C GLU A 65 62.109 -10.077 -1.404 1.00 0.00 C ATOM 950 O GLU A 65 63.014 -10.640 -2.019 1.00 0.00 O ATOM 951 CB GLU A 65 60.483 -10.882 0.297 1.00 0.00 C ATOM 952 CG GLU A 65 60.412 -12.313 -0.239 1.00 0.00 C ATOM 953 CD GLU A 65 58.985 -12.835 -0.106 1.00 0.00 C ATOM 954 OE1 GLU A 65 58.084 -12.174 -0.595 1.00 0.00 O ATOM 955 OE2 GLU A 65 58.814 -13.889 0.485 1.00 0.00 O ATOM 0 H GLU A 65 61.227 -8.727 1.272 1.00 0.00 H new ATOM 0 HA GLU A 65 62.625 -11.050 0.443 1.00 0.00 H new ATOM 0 HB2 GLU A 65 60.231 -10.867 1.357 1.00 0.00 H new ATOM 0 HB3 GLU A 65 59.752 -10.255 -0.213 1.00 0.00 H new ATOM 0 HG2 GLU A 65 60.724 -12.338 -1.283 1.00 0.00 H new ATOM 0 HG3 GLU A 65 61.098 -12.954 0.314 1.00 0.00 H new ATOM 962 N LYS A 66 61.266 -9.222 -1.974 1.00 0.00 N ATOM 963 CA LYS A 66 61.370 -8.897 -3.394 1.00 0.00 C ATOM 964 C LYS A 66 62.706 -8.221 -3.691 1.00 0.00 C ATOM 965 O LYS A 66 63.259 -8.359 -4.782 1.00 0.00 O ATOM 966 CB LYS A 66 60.234 -7.963 -3.815 1.00 0.00 C ATOM 967 CG LYS A 66 58.889 -8.641 -3.552 1.00 0.00 C ATOM 968 CD LYS A 66 58.416 -9.353 -4.821 1.00 0.00 C ATOM 969 CE LYS A 66 56.889 -9.298 -4.900 1.00 0.00 C ATOM 970 NZ LYS A 66 56.428 -10.040 -6.107 1.00 0.00 N ATOM 0 H LYS A 66 60.510 -8.745 -1.482 1.00 0.00 H new ATOM 0 HA LYS A 66 61.301 -9.828 -3.957 1.00 0.00 H new ATOM 0 HB2 LYS A 66 60.295 -7.026 -3.261 1.00 0.00 H new ATOM 0 HB3 LYS A 66 60.327 -7.714 -4.872 1.00 0.00 H new ATOM 0 HG2 LYS A 66 58.985 -9.357 -2.736 1.00 0.00 H new ATOM 0 HG3 LYS A 66 58.152 -7.901 -3.242 1.00 0.00 H new ATOM 0 HD2 LYS A 66 58.853 -8.880 -5.700 1.00 0.00 H new ATOM 0 HD3 LYS A 66 58.753 -10.390 -4.816 1.00 0.00 H new ATOM 0 HE2 LYS A 66 56.452 -9.735 -4.002 1.00 0.00 H new ATOM 0 HE3 LYS A 66 56.553 -8.262 -4.946 1.00 0.00 H new ATOM 0 HZ1 LYS A 66 55.390 -10.003 -6.162 1.00 0.00 H new ATOM 0 HZ2 LYS A 66 56.835 -9.604 -6.959 1.00 0.00 H new ATOM 0 HZ3 LYS A 66 56.736 -11.031 -6.044 1.00 0.00 H new ATOM 984 N ALA A 67 63.215 -7.486 -2.705 1.00 0.00 N ATOM 985 CA ALA A 67 64.487 -6.785 -2.864 1.00 0.00 C ATOM 986 C ALA A 67 65.619 -7.770 -3.150 1.00 0.00 C ATOM 987 O ALA A 67 66.155 -8.401 -2.240 1.00 0.00 O ATOM 988 CB ALA A 67 64.823 -6.000 -1.597 1.00 0.00 C ATOM 0 H ALA A 67 62.771 -7.361 -1.795 1.00 0.00 H new ATOM 0 HA ALA A 67 64.386 -6.100 -3.706 1.00 0.00 H new ATOM 0 HB1 ALA A 67 65.773 -5.483 -1.731 1.00 0.00 H new ATOM 0 HB2 ALA A 67 64.037 -5.270 -1.402 1.00 0.00 H new ATOM 0 HB3 ALA A 67 64.899 -6.686 -0.753 1.00 0.00 H new ATOM 994 N THR A 68 65.980 -7.883 -4.425 1.00 0.00 N ATOM 995 CA THR A 68 67.063 -8.780 -4.827 1.00 0.00 C ATOM 996 C THR A 68 68.299 -7.963 -5.202 1.00 0.00 C ATOM 997 O THR A 68 69.434 -8.380 -4.976 1.00 0.00 O ATOM 998 CB THR A 68 66.641 -9.644 -6.021 1.00 0.00 C ATOM 999 OG1 THR A 68 67.723 -10.485 -6.398 1.00 0.00 O ATOM 1000 CG2 THR A 68 66.254 -8.751 -7.202 1.00 0.00 C ATOM 0 H THR A 68 65.545 -7.371 -5.192 1.00 0.00 H new ATOM 0 HA THR A 68 67.295 -9.435 -3.987 1.00 0.00 H new ATOM 0 HB THR A 68 65.782 -10.253 -5.738 1.00 0.00 H new ATOM 0 HG1 THR A 68 67.456 -11.040 -7.160 1.00 0.00 H new ATOM 0 HG21 THR A 68 65.956 -9.373 -8.046 1.00 0.00 H new ATOM 0 HG22 THR A 68 65.423 -8.107 -6.914 1.00 0.00 H new ATOM 0 HG23 THR A 68 67.107 -8.136 -7.488 1.00 0.00 H new ATOM 1008 N THR A 69 68.053 -6.784 -5.770 1.00 0.00 N ATOM 1009 CA THR A 69 69.136 -5.888 -6.167 1.00 0.00 C ATOM 1010 C THR A 69 69.145 -4.673 -5.238 1.00 0.00 C ATOM 1011 O THR A 69 68.197 -4.466 -4.479 1.00 0.00 O ATOM 1012 CB THR A 69 68.940 -5.404 -7.618 1.00 0.00 C ATOM 1013 OG1 THR A 69 67.613 -5.690 -8.044 1.00 0.00 O ATOM 1014 CG2 THR A 69 69.931 -6.109 -8.545 1.00 0.00 C ATOM 0 H THR A 69 67.117 -6.428 -5.965 1.00 0.00 H new ATOM 0 HA THR A 69 70.080 -6.429 -6.099 1.00 0.00 H new ATOM 0 HB THR A 69 69.114 -4.329 -7.657 1.00 0.00 H new ATOM 0 HG1 THR A 69 67.491 -5.380 -8.966 1.00 0.00 H new ATOM 0 HG21 THR A 69 69.784 -5.760 -9.567 1.00 0.00 H new ATOM 0 HG22 THR A 69 70.949 -5.884 -8.228 1.00 0.00 H new ATOM 0 HG23 THR A 69 69.767 -7.186 -8.502 1.00 0.00 H new ATOM 1022 N PRO A 70 70.191 -3.837 -5.288 1.00 0.00 N ATOM 1023 CA PRO A 70 70.251 -2.642 -4.432 1.00 0.00 C ATOM 1024 C PRO A 70 69.221 -1.610 -4.867 1.00 0.00 C ATOM 1025 O PRO A 70 68.613 -0.930 -4.043 1.00 0.00 O ATOM 1026 CB PRO A 70 71.674 -2.144 -4.646 1.00 0.00 C ATOM 1027 CG PRO A 70 72.127 -2.703 -5.983 1.00 0.00 C ATOM 1028 CD PRO A 70 71.354 -4.007 -6.191 1.00 0.00 C ATOM 0 HA PRO A 70 70.026 -2.843 -3.385 1.00 0.00 H new ATOM 0 HB2 PRO A 70 71.708 -1.055 -4.649 1.00 0.00 H new ATOM 0 HB3 PRO A 70 72.329 -2.481 -3.842 1.00 0.00 H new ATOM 0 HG2 PRO A 70 71.922 -1.998 -6.788 1.00 0.00 H new ATOM 0 HG3 PRO A 70 73.202 -2.884 -5.984 1.00 0.00 H new ATOM 0 HD2 PRO A 70 71.047 -4.136 -7.229 1.00 0.00 H new ATOM 0 HD3 PRO A 70 71.951 -4.880 -5.925 1.00 0.00 H new ATOM 1036 N ARG A 71 69.010 -1.528 -6.180 1.00 0.00 N ATOM 1037 CA ARG A 71 68.023 -0.601 -6.723 1.00 0.00 C ATOM 1038 C ARG A 71 66.632 -0.923 -6.171 1.00 0.00 C ATOM 1039 O ARG A 71 65.763 -0.055 -6.102 1.00 0.00 O ATOM 1040 CB ARG A 71 67.987 -0.691 -8.250 1.00 0.00 C ATOM 1041 CG ARG A 71 69.374 -0.377 -8.812 1.00 0.00 C ATOM 1042 CD ARG A 71 69.564 1.138 -8.889 1.00 0.00 C ATOM 1043 NE ARG A 71 70.479 1.488 -9.977 1.00 0.00 N ATOM 1044 CZ ARG A 71 70.730 2.760 -10.317 1.00 0.00 C ATOM 1045 NH1 ARG A 71 70.162 3.759 -9.683 1.00 0.00 N ATOM 1046 NH2 ARG A 71 71.556 3.011 -11.296 1.00 0.00 N ATOM 0 H ARG A 71 69.503 -2.085 -6.878 1.00 0.00 H new ATOM 0 HA ARG A 71 68.308 0.409 -6.427 1.00 0.00 H new ATOM 0 HB2 ARG A 71 67.675 -1.689 -8.559 1.00 0.00 H new ATOM 0 HB3 ARG A 71 67.254 0.010 -8.649 1.00 0.00 H new ATOM 0 HG2 ARG A 71 70.143 -0.819 -8.178 1.00 0.00 H new ATOM 0 HG3 ARG A 71 69.485 -0.819 -9.802 1.00 0.00 H new ATOM 0 HD2 ARG A 71 68.601 1.623 -9.046 1.00 0.00 H new ATOM 0 HD3 ARG A 71 69.957 1.509 -7.942 1.00 0.00 H new ATOM 0 HE ARG A 71 70.941 0.739 -10.493 1.00 0.00 H new ATOM 0 HH11 ARG A 71 69.516 3.575 -8.916 1.00 0.00 H new ATOM 0 HH12 ARG A 71 70.367 4.720 -9.958 1.00 0.00 H new ATOM 0 HH21 ARG A 71 72.004 2.242 -11.795 1.00 0.00 H new ATOM 0 HH22 ARG A 71 71.753 3.976 -11.562 1.00 0.00 H new ATOM 1060 N ALA A 72 66.431 -2.185 -5.772 1.00 0.00 N ATOM 1061 CA ALA A 72 65.145 -2.601 -5.222 1.00 0.00 C ATOM 1062 C ALA A 72 64.915 -1.931 -3.873 1.00 0.00 C ATOM 1063 O ALA A 72 63.927 -1.226 -3.670 1.00 0.00 O ATOM 1064 CB ALA A 72 65.106 -4.119 -5.039 1.00 0.00 C ATOM 0 H ALA A 72 67.134 -2.923 -5.820 1.00 0.00 H new ATOM 0 HA ALA A 72 64.362 -2.304 -5.920 1.00 0.00 H new ATOM 0 HB1 ALA A 72 64.140 -4.411 -4.628 1.00 0.00 H new ATOM 0 HB2 ALA A 72 65.252 -4.606 -6.003 1.00 0.00 H new ATOM 0 HB3 ALA A 72 65.898 -4.424 -4.355 1.00 0.00 H new ATOM 1070 N LEU A 73 65.853 -2.155 -2.956 1.00 0.00 N ATOM 1071 CA LEU A 73 65.768 -1.565 -1.619 1.00 0.00 C ATOM 1072 C LEU A 73 65.713 -0.046 -1.721 1.00 0.00 C ATOM 1073 O LEU A 73 64.889 0.608 -1.083 1.00 0.00 O ATOM 1074 CB LEU A 73 66.984 -1.951 -0.775 1.00 0.00 C ATOM 1075 CG LEU A 73 67.271 -3.451 -0.694 1.00 0.00 C ATOM 1076 CD1 LEU A 73 68.680 -3.671 -0.140 1.00 0.00 C ATOM 1077 CD2 LEU A 73 66.252 -4.113 0.235 1.00 0.00 C ATOM 0 H LEU A 73 66.676 -2.737 -3.111 1.00 0.00 H new ATOM 0 HA LEU A 73 64.863 -1.944 -1.144 1.00 0.00 H new ATOM 0 HB2 LEU A 73 67.863 -1.451 -1.182 1.00 0.00 H new ATOM 0 HB3 LEU A 73 66.840 -1.570 0.236 1.00 0.00 H new ATOM 0 HG LEU A 73 67.198 -3.890 -1.689 1.00 0.00 H new ATOM 0 HD11 LEU A 73 68.885 -4.740 -0.082 1.00 0.00 H new ATOM 0 HD12 LEU A 73 69.408 -3.197 -0.798 1.00 0.00 H new ATOM 0 HD13 LEU A 73 68.752 -3.233 0.856 1.00 0.00 H new ATOM 0 HD21 LEU A 73 66.455 -5.182 0.294 1.00 0.00 H new ATOM 0 HD22 LEU A 73 66.327 -3.674 1.230 1.00 0.00 H new ATOM 0 HD23 LEU A 73 65.247 -3.955 -0.156 1.00 0.00 H new ATOM 1089 N ILE A 74 66.601 0.504 -2.547 1.00 0.00 N ATOM 1090 CA ILE A 74 66.649 1.950 -2.747 1.00 0.00 C ATOM 1091 C ILE A 74 65.318 2.437 -3.315 1.00 0.00 C ATOM 1092 O ILE A 74 64.796 3.475 -2.910 1.00 0.00 O ATOM 1093 CB ILE A 74 67.782 2.324 -3.716 1.00 0.00 C ATOM 1094 CG1 ILE A 74 69.115 1.817 -3.162 1.00 0.00 C ATOM 1095 CG2 ILE A 74 67.856 3.846 -3.877 1.00 0.00 C ATOM 1096 CD1 ILE A 74 70.145 1.760 -4.291 1.00 0.00 C ATOM 0 H ILE A 74 67.290 -0.023 -3.083 1.00 0.00 H new ATOM 0 HA ILE A 74 66.835 2.426 -1.784 1.00 0.00 H new ATOM 0 HB ILE A 74 67.583 1.867 -4.685 1.00 0.00 H new ATOM 0 HG12 ILE A 74 69.466 2.476 -2.368 1.00 0.00 H new ATOM 0 HG13 ILE A 74 68.986 0.828 -2.722 1.00 0.00 H new ATOM 0 HG21 ILE A 74 68.662 4.100 -4.565 1.00 0.00 H new ATOM 0 HG22 ILE A 74 66.910 4.216 -4.273 1.00 0.00 H new ATOM 0 HG23 ILE A 74 68.049 4.305 -2.908 1.00 0.00 H new ATOM 0 HD11 ILE A 74 71.096 1.399 -3.898 1.00 0.00 H new ATOM 0 HD12 ILE A 74 69.794 1.083 -5.070 1.00 0.00 H new ATOM 0 HD13 ILE A 74 70.281 2.757 -4.710 1.00 0.00 H new ATOM 1108 N GLU A 75 64.771 1.670 -4.254 1.00 0.00 N ATOM 1109 CA GLU A 75 63.498 2.034 -4.862 1.00 0.00 C ATOM 1110 C GLU A 75 62.397 2.030 -3.813 1.00 0.00 C ATOM 1111 O GLU A 75 61.593 2.958 -3.727 1.00 0.00 O ATOM 1112 CB GLU A 75 63.133 1.055 -5.979 1.00 0.00 C ATOM 1113 CG GLU A 75 63.697 1.562 -7.308 1.00 0.00 C ATOM 1114 CD GLU A 75 62.689 2.500 -7.963 1.00 0.00 C ATOM 1115 OE1 GLU A 75 62.427 3.547 -7.395 1.00 0.00 O ATOM 1116 OE2 GLU A 75 62.194 2.158 -9.025 1.00 0.00 O ATOM 0 H GLU A 75 65.183 0.806 -4.605 1.00 0.00 H new ATOM 0 HA GLU A 75 63.598 3.034 -5.284 1.00 0.00 H new ATOM 0 HB2 GLU A 75 63.534 0.066 -5.756 1.00 0.00 H new ATOM 0 HB3 GLU A 75 62.050 0.952 -6.047 1.00 0.00 H new ATOM 0 HG2 GLU A 75 64.639 2.083 -7.140 1.00 0.00 H new ATOM 0 HG3 GLU A 75 63.911 0.722 -7.969 1.00 0.00 H new ATOM 1123 N MET A 76 62.381 0.978 -3.004 1.00 0.00 N ATOM 1124 CA MET A 76 61.389 0.861 -1.948 1.00 0.00 C ATOM 1125 C MET A 76 61.596 1.971 -0.926 1.00 0.00 C ATOM 1126 O MET A 76 60.640 2.530 -0.389 1.00 0.00 O ATOM 1127 CB MET A 76 61.513 -0.495 -1.252 1.00 0.00 C ATOM 1128 CG MET A 76 60.824 -1.567 -2.100 1.00 0.00 C ATOM 1129 SD MET A 76 61.652 -3.158 -1.855 1.00 0.00 S ATOM 1130 CE MET A 76 60.498 -4.164 -2.819 1.00 0.00 C ATOM 0 H MET A 76 63.039 0.200 -3.059 1.00 0.00 H new ATOM 0 HA MET A 76 60.396 0.946 -2.389 1.00 0.00 H new ATOM 0 HB2 MET A 76 62.564 -0.748 -1.109 1.00 0.00 H new ATOM 0 HB3 MET A 76 61.059 -0.451 -0.262 1.00 0.00 H new ATOM 0 HG2 MET A 76 59.773 -1.646 -1.822 1.00 0.00 H new ATOM 0 HG3 MET A 76 60.855 -1.288 -3.153 1.00 0.00 H new ATOM 0 HE1 MET A 76 60.439 -5.164 -2.388 1.00 0.00 H new ATOM 0 HE2 MET A 76 59.511 -3.703 -2.801 1.00 0.00 H new ATOM 0 HE3 MET A 76 60.848 -4.233 -3.849 1.00 0.00 H new ATOM 1140 N THR A 77 62.861 2.293 -0.671 1.00 0.00 N ATOM 1141 CA THR A 77 63.186 3.347 0.281 1.00 0.00 C ATOM 1142 C THR A 77 62.778 4.704 -0.278 1.00 0.00 C ATOM 1143 O THR A 77 62.063 5.468 0.369 1.00 0.00 O ATOM 1144 CB THR A 77 64.687 3.358 0.576 1.00 0.00 C ATOM 1145 OG1 THR A 77 65.107 2.050 0.937 1.00 0.00 O ATOM 1146 CG2 THR A 77 64.976 4.324 1.727 1.00 0.00 C ATOM 0 H THR A 77 63.668 1.845 -1.105 1.00 0.00 H new ATOM 0 HA THR A 77 62.639 3.152 1.204 1.00 0.00 H new ATOM 0 HB THR A 77 65.229 3.682 -0.312 1.00 0.00 H new ATOM 0 HG1 THR A 77 65.413 1.572 0.138 1.00 0.00 H new ATOM 0 HG21 THR A 77 66.046 4.331 1.936 1.00 0.00 H new ATOM 0 HG22 THR A 77 64.654 5.328 1.449 1.00 0.00 H new ATOM 0 HG23 THR A 77 64.434 4.002 2.617 1.00 0.00 H new ATOM 1154 N ASN A 78 63.234 4.992 -1.496 1.00 0.00 N ATOM 1155 CA ASN A 78 62.914 6.264 -2.146 1.00 0.00 C ATOM 1156 C ASN A 78 61.406 6.437 -2.267 1.00 0.00 C ATOM 1157 O ASN A 78 60.881 7.543 -2.162 1.00 0.00 O ATOM 1158 CB ASN A 78 63.529 6.316 -3.544 1.00 0.00 C ATOM 1159 CG ASN A 78 65.004 6.688 -3.439 1.00 0.00 C ATOM 1160 OD1 ASN A 78 65.403 7.790 -3.809 1.00 0.00 O ATOM 1161 ND2 ASN A 78 65.846 5.826 -2.949 1.00 0.00 N ATOM 0 H ASN A 78 63.821 4.368 -2.050 1.00 0.00 H new ATOM 0 HA ASN A 78 63.325 7.067 -1.534 1.00 0.00 H new ATOM 0 HB2 ASN A 78 63.421 5.349 -4.036 1.00 0.00 H new ATOM 0 HB3 ASN A 78 63.002 7.047 -4.158 1.00 0.00 H new ATOM 0 HD21 ASN A 78 66.835 6.065 -2.873 1.00 0.00 H new ATOM 0 HD22 ASN A 78 65.518 4.911 -2.641 1.00 0.00 H new ATOM 1168 N ALA A 79 60.725 5.320 -2.478 1.00 0.00 N ATOM 1169 CA ALA A 79 59.274 5.325 -2.607 1.00 0.00 C ATOM 1170 C ALA A 79 58.640 5.721 -1.283 1.00 0.00 C ATOM 1171 O ALA A 79 57.601 6.379 -1.241 1.00 0.00 O ATOM 1172 CB ALA A 79 58.774 3.937 -2.999 1.00 0.00 C ATOM 0 H ALA A 79 61.153 4.398 -2.564 1.00 0.00 H new ATOM 0 HA ALA A 79 58.997 6.042 -3.380 1.00 0.00 H new ATOM 0 HB1 ALA A 79 57.688 3.954 -3.092 1.00 0.00 H new ATOM 0 HB2 ALA A 79 59.215 3.647 -3.953 1.00 0.00 H new ATOM 0 HB3 ALA A 79 59.061 3.217 -2.233 1.00 0.00 H new ATOM 1178 N SER A 80 59.283 5.304 -0.200 1.00 0.00 N ATOM 1179 CA SER A 80 58.789 5.608 1.130 1.00 0.00 C ATOM 1180 C SER A 80 59.033 7.078 1.459 1.00 0.00 C ATOM 1181 O SER A 80 58.154 7.765 1.980 1.00 0.00 O ATOM 1182 CB SER A 80 59.475 4.712 2.166 1.00 0.00 C ATOM 1183 OG SER A 80 60.724 5.278 2.549 1.00 0.00 O ATOM 0 H SER A 80 60.144 4.757 -0.219 1.00 0.00 H new ATOM 0 HA SER A 80 57.716 5.417 1.158 1.00 0.00 H new ATOM 0 HB2 SER A 80 58.835 4.598 3.041 1.00 0.00 H new ATOM 0 HB3 SER A 80 59.630 3.716 1.752 1.00 0.00 H new ATOM 0 HG SER A 80 61.397 5.078 1.866 1.00 0.00 H new ATOM 1189 N LEU A 81 60.233 7.554 1.142 1.00 0.00 N ATOM 1190 CA LEU A 81 60.569 8.947 1.405 1.00 0.00 C ATOM 1191 C LEU A 81 59.713 9.869 0.543 1.00 0.00 C ATOM 1192 O LEU A 81 59.130 10.833 1.037 1.00 0.00 O ATOM 1193 CB LEU A 81 62.050 9.221 1.110 1.00 0.00 C ATOM 1194 CG LEU A 81 63.063 8.733 2.165 1.00 0.00 C ATOM 1195 CD1 LEU A 81 62.537 8.981 3.582 1.00 0.00 C ATOM 1196 CD2 LEU A 81 63.319 7.239 1.981 1.00 0.00 C ATOM 0 H LEU A 81 60.977 7.006 0.710 1.00 0.00 H new ATOM 0 HA LEU A 81 60.374 9.142 2.460 1.00 0.00 H new ATOM 0 HB2 LEU A 81 62.300 8.756 0.156 1.00 0.00 H new ATOM 0 HB3 LEU A 81 62.180 10.296 0.984 1.00 0.00 H new ATOM 0 HG LEU A 81 63.990 9.290 2.031 1.00 0.00 H new ATOM 0 HD11 LEU A 81 63.269 8.628 4.309 1.00 0.00 H new ATOM 0 HD12 LEU A 81 62.368 10.048 3.726 1.00 0.00 H new ATOM 0 HD13 LEU A 81 61.599 8.443 3.721 1.00 0.00 H new ATOM 0 HD21 LEU A 81 64.035 6.898 2.728 1.00 0.00 H new ATOM 0 HD22 LEU A 81 62.383 6.692 2.099 1.00 0.00 H new ATOM 0 HD23 LEU A 81 63.721 7.059 0.984 1.00 0.00 H new ATOM 1208 N THR A 82 59.643 9.565 -0.751 1.00 0.00 N ATOM 1209 CA THR A 82 58.847 10.387 -1.663 1.00 0.00 C ATOM 1210 C THR A 82 57.365 10.293 -1.304 1.00 0.00 C ATOM 1211 O THR A 82 56.611 11.253 -1.458 1.00 0.00 O ATOM 1212 CB THR A 82 59.051 9.949 -3.120 1.00 0.00 C ATOM 1213 OG1 THR A 82 58.294 10.795 -3.974 1.00 0.00 O ATOM 1214 CG2 THR A 82 58.597 8.498 -3.308 1.00 0.00 C ATOM 0 H THR A 82 60.116 8.773 -1.186 1.00 0.00 H new ATOM 0 HA THR A 82 59.180 11.420 -1.560 1.00 0.00 H new ATOM 0 HB THR A 82 60.110 10.022 -3.368 1.00 0.00 H new ATOM 0 HG1 THR A 82 58.423 10.519 -4.906 1.00 0.00 H new ATOM 0 HG21 THR A 82 58.748 8.201 -4.346 1.00 0.00 H new ATOM 0 HG22 THR A 82 59.180 7.847 -2.656 1.00 0.00 H new ATOM 0 HG23 THR A 82 57.540 8.412 -3.056 1.00 0.00 H new ATOM 1222 N GLY A 83 56.961 9.119 -0.822 1.00 0.00 N ATOM 1223 CA GLY A 83 55.569 8.900 -0.439 1.00 0.00 C ATOM 1224 C GLY A 83 55.405 9.015 1.072 1.00 0.00 C ATOM 1225 O GLY A 83 54.590 8.320 1.678 1.00 0.00 O ATOM 0 H GLY A 83 57.571 8.313 -0.689 1.00 0.00 H new ATOM 0 HA2 GLY A 83 54.930 9.630 -0.936 1.00 0.00 H new ATOM 0 HA3 GLY A 83 55.245 7.914 -0.772 1.00 0.00 H new ATOM 1229 N ALA A 84 56.191 9.904 1.674 1.00 0.00 N ATOM 1230 CA ALA A 84 56.131 10.109 3.113 1.00 0.00 C ATOM 1231 C ALA A 84 55.262 11.318 3.451 1.00 0.00 C ATOM 1232 O ALA A 84 55.486 12.000 4.452 1.00 0.00 O ATOM 1233 CB ALA A 84 57.533 10.328 3.684 1.00 0.00 C ATOM 0 H ALA A 84 56.872 10.489 1.189 1.00 0.00 H new ATOM 0 HA ALA A 84 55.693 9.215 3.557 1.00 0.00 H new ATOM 0 HB1 ALA A 84 57.467 10.480 4.761 1.00 0.00 H new ATOM 0 HB2 ALA A 84 58.151 9.454 3.477 1.00 0.00 H new ATOM 0 HB3 ALA A 84 57.981 11.207 3.221 1.00 0.00 H new ATOM 1239 N SER A 85 54.265 11.577 2.607 1.00 0.00 N ATOM 1240 CA SER A 85 53.365 12.708 2.826 1.00 0.00 C ATOM 1241 C SER A 85 54.150 14.027 2.809 1.00 0.00 C ATOM 1242 O SER A 85 55.381 14.018 2.808 1.00 0.00 O ATOM 1243 CB SER A 85 52.638 12.563 4.168 1.00 0.00 C ATOM 1244 OG SER A 85 51.243 12.752 3.968 1.00 0.00 O ATOM 0 H SER A 85 54.061 11.026 1.773 1.00 0.00 H new ATOM 0 HA SER A 85 52.630 12.718 2.021 1.00 0.00 H new ATOM 0 HB2 SER A 85 52.826 11.577 4.592 1.00 0.00 H new ATOM 0 HB3 SER A 85 53.017 13.295 4.881 1.00 0.00 H new ATOM 0 HG SER A 85 50.774 12.658 4.824 1.00 0.00 H new ATOM 1250 N PRO A 86 53.452 15.176 2.795 1.00 0.00 N ATOM 1251 CA PRO A 86 54.118 16.490 2.777 1.00 0.00 C ATOM 1252 C PRO A 86 54.550 16.950 4.168 1.00 0.00 C ATOM 1253 O PRO A 86 53.992 16.523 5.180 1.00 0.00 O ATOM 1254 CB PRO A 86 53.028 17.399 2.222 1.00 0.00 C ATOM 1255 CG PRO A 86 51.691 16.727 2.516 1.00 0.00 C ATOM 1256 CD PRO A 86 51.972 15.247 2.796 1.00 0.00 C ATOM 0 HA PRO A 86 55.040 16.484 2.195 1.00 0.00 H new ATOM 0 HB2 PRO A 86 53.074 18.384 2.686 1.00 0.00 H new ATOM 0 HB3 PRO A 86 53.158 17.546 1.150 1.00 0.00 H new ATOM 0 HG2 PRO A 86 51.207 17.194 3.374 1.00 0.00 H new ATOM 0 HG3 PRO A 86 51.013 16.835 1.669 1.00 0.00 H new ATOM 0 HD2 PRO A 86 51.555 14.932 3.752 1.00 0.00 H new ATOM 0 HD3 PRO A 86 51.538 14.603 2.031 1.00 0.00 H new ATOM 1264 N SER A 87 55.550 17.825 4.204 1.00 0.00 N ATOM 1265 CA SER A 87 56.054 18.340 5.474 1.00 0.00 C ATOM 1266 C SER A 87 56.757 19.677 5.264 1.00 0.00 C ATOM 1267 O SER A 87 56.433 20.674 5.909 1.00 0.00 O ATOM 1268 CB SER A 87 57.038 17.352 6.101 1.00 0.00 C ATOM 1269 OG SER A 87 57.541 17.896 7.313 1.00 0.00 O ATOM 0 H SER A 87 56.024 18.190 3.378 1.00 0.00 H new ATOM 0 HA SER A 87 55.204 18.477 6.143 1.00 0.00 H new ATOM 0 HB2 SER A 87 56.543 16.401 6.294 1.00 0.00 H new ATOM 0 HB3 SER A 87 57.858 17.150 5.412 1.00 0.00 H new ATOM 0 HG SER A 87 58.171 17.264 7.718 1.00 0.00 H new ATOM 1275 N ALA A 88 57.725 19.685 4.351 1.00 0.00 N ATOM 1276 CA ALA A 88 58.476 20.905 4.056 1.00 0.00 C ATOM 1277 C ALA A 88 59.201 21.402 5.303 1.00 0.00 C ATOM 1278 O ALA A 88 58.581 21.900 6.243 1.00 0.00 O ATOM 1279 CB ALA A 88 57.539 22.005 3.553 1.00 0.00 C ATOM 0 H ALA A 88 58.007 18.870 3.807 1.00 0.00 H new ATOM 0 HA ALA A 88 59.206 20.669 3.282 1.00 0.00 H new ATOM 0 HB1 ALA A 88 58.116 22.905 3.339 1.00 0.00 H new ATOM 0 HB2 ALA A 88 57.039 21.670 2.644 1.00 0.00 H new ATOM 0 HB3 ALA A 88 56.793 22.225 4.317 1.00 0.00 H new ATOM 1285 N GLY A 89 60.523 21.262 5.299 1.00 0.00 N ATOM 1286 CA GLY A 89 61.330 21.700 6.435 1.00 0.00 C ATOM 1287 C GLY A 89 62.519 20.770 6.644 1.00 0.00 C ATOM 1288 O GLY A 89 62.559 19.995 7.601 1.00 0.00 O ATOM 0 H GLY A 89 61.055 20.853 4.531 1.00 0.00 H new ATOM 0 HA2 GLY A 89 61.683 22.717 6.265 1.00 0.00 H new ATOM 0 HA3 GLY A 89 60.717 21.722 7.336 1.00 0.00 H new ATOM 1292 N GLY A 90 63.489 20.856 5.738 1.00 0.00 N ATOM 1293 CA GLY A 90 64.681 20.017 5.831 1.00 0.00 C ATOM 1294 C GLY A 90 65.514 20.394 7.051 1.00 0.00 C ATOM 1295 O GLY A 90 65.929 21.542 7.207 1.00 0.00 O ATOM 0 H GLY A 90 63.475 21.490 4.939 1.00 0.00 H new ATOM 0 HA2 GLY A 90 64.389 18.969 5.894 1.00 0.00 H new ATOM 0 HA3 GLY A 90 65.280 20.127 4.927 1.00 0.00 H new ATOM 1299 N ALA A 91 65.753 19.412 7.915 1.00 0.00 N ATOM 1300 CA ALA A 91 66.539 19.648 9.123 1.00 0.00 C ATOM 1301 C ALA A 91 67.957 20.072 8.761 1.00 0.00 C ATOM 1302 O ALA A 91 68.417 21.147 9.142 1.00 0.00 O ATOM 1303 CB ALA A 91 66.600 18.381 9.979 1.00 0.00 C ATOM 0 H ALA A 91 65.418 18.455 7.804 1.00 0.00 H new ATOM 0 HA ALA A 91 66.055 20.444 9.689 1.00 0.00 H new ATOM 0 HB1 ALA A 91 67.190 18.575 10.875 1.00 0.00 H new ATOM 0 HB2 ALA A 91 65.590 18.087 10.266 1.00 0.00 H new ATOM 0 HB3 ALA A 91 67.063 17.577 9.407 1.00 0.00 H new ATOM 1309 N ALA A 92 68.642 19.210 8.019 1.00 0.00 N ATOM 1310 CA ALA A 92 70.013 19.495 7.603 1.00 0.00 C ATOM 1311 C ALA A 92 70.543 18.374 6.715 1.00 0.00 C ATOM 1312 O ALA A 92 70.022 17.259 6.720 1.00 0.00 O ATOM 1313 CB ALA A 92 70.924 19.638 8.824 1.00 0.00 C ATOM 0 H ALA A 92 68.276 18.315 7.694 1.00 0.00 H new ATOM 0 HA ALA A 92 70.008 20.430 7.043 1.00 0.00 H new ATOM 0 HB1 ALA A 92 71.942 19.850 8.496 1.00 0.00 H new ATOM 0 HB2 ALA A 92 70.567 20.455 9.451 1.00 0.00 H new ATOM 0 HB3 ALA A 92 70.913 18.711 9.397 1.00 0.00 H new ATOM 1319 N ARG A 93 71.587 18.685 5.952 1.00 0.00 N ATOM 1320 CA ARG A 93 72.186 17.697 5.059 1.00 0.00 C ATOM 1321 C ARG A 93 73.591 17.337 5.530 1.00 0.00 C ATOM 1322 O ARG A 93 73.937 16.162 5.658 1.00 0.00 O ATOM 1323 CB ARG A 93 72.264 18.243 3.632 1.00 0.00 C ATOM 1324 CG ARG A 93 72.611 17.107 2.668 1.00 0.00 C ATOM 1325 CD ARG A 93 73.464 17.651 1.522 1.00 0.00 C ATOM 1326 NE ARG A 93 73.344 16.796 0.337 1.00 0.00 N ATOM 1327 CZ ARG A 93 74.008 17.056 -0.799 1.00 0.00 C ATOM 1328 NH1 ARG A 93 74.800 18.097 -0.901 1.00 0.00 N ATOM 1329 NH2 ARG A 93 73.862 16.259 -1.822 1.00 0.00 N ATOM 0 H ARG A 93 72.032 19.603 5.933 1.00 0.00 H new ATOM 0 HA ARG A 93 71.558 16.806 5.073 1.00 0.00 H new ATOM 0 HB2 ARG A 93 71.312 18.694 3.352 1.00 0.00 H new ATOM 0 HB3 ARG A 93 73.018 19.028 3.572 1.00 0.00 H new ATOM 0 HG2 ARG A 93 73.151 16.321 3.196 1.00 0.00 H new ATOM 0 HG3 ARG A 93 71.699 16.658 2.275 1.00 0.00 H new ATOM 0 HD2 ARG A 93 73.150 18.666 1.278 1.00 0.00 H new ATOM 0 HD3 ARG A 93 74.507 17.706 1.833 1.00 0.00 H new ATOM 0 HE ARG A 93 72.736 15.978 0.378 1.00 0.00 H new ATOM 0 HH11 ARG A 93 74.920 18.726 -0.107 1.00 0.00 H new ATOM 0 HH12 ARG A 93 75.296 18.277 -1.774 1.00 0.00 H new ATOM 0 HH21 ARG A 93 73.248 15.448 -1.753 1.00 0.00 H new ATOM 0 HH22 ARG A 93 74.362 16.447 -2.691 1.00 0.00 H new ATOM 1343 N ASP A 94 74.398 18.362 5.786 1.00 0.00 N ATOM 1344 CA ASP A 94 75.768 18.146 6.244 1.00 0.00 C ATOM 1345 C ASP A 94 76.326 19.419 6.873 1.00 0.00 C ATOM 1346 O ASP A 94 77.522 19.701 6.784 1.00 0.00 O ATOM 1347 CB ASP A 94 76.664 17.732 5.074 1.00 0.00 C ATOM 1348 CG ASP A 94 77.973 17.164 5.612 1.00 0.00 C ATOM 1349 OD1 ASP A 94 77.924 16.449 6.599 1.00 0.00 O ATOM 1350 OD2 ASP A 94 79.005 17.452 5.029 1.00 0.00 O ATOM 0 H ASP A 94 74.132 19.341 5.686 1.00 0.00 H new ATOM 0 HA ASP A 94 75.753 17.350 6.988 1.00 0.00 H new ATOM 0 HB2 ASP A 94 76.157 16.988 4.460 1.00 0.00 H new ATOM 0 HB3 ASP A 94 76.864 18.591 4.434 1.00 0.00 H new ATOM 1355 N LYS A 95 75.445 20.184 7.512 1.00 0.00 N ATOM 1356 CA LYS A 95 75.858 21.428 8.155 1.00 0.00 C ATOM 1357 C LYS A 95 75.747 21.305 9.671 1.00 0.00 C ATOM 1358 O LYS A 95 74.654 21.046 10.147 1.00 0.00 O ATOM 1359 CB LYS A 95 74.982 22.591 7.685 1.00 0.00 C ATOM 1360 CG LYS A 95 75.120 22.754 6.170 1.00 0.00 C ATOM 1361 CD LYS A 95 76.413 23.506 5.852 1.00 0.00 C ATOM 1362 CE LYS A 95 76.123 25.005 5.761 1.00 0.00 C ATOM 1363 NZ LYS A 95 77.388 25.770 5.956 1.00 0.00 N ATOM 1364 OXT LYS A 95 76.758 21.471 10.335 1.00 0.00 O ATOM 0 H LYS A 95 74.452 19.968 7.598 1.00 0.00 H new ATOM 0 HA LYS A 95 76.895 21.621 7.880 1.00 0.00 H new ATOM 0 HB2 LYS A 95 73.941 22.405 7.948 1.00 0.00 H new ATOM 0 HB3 LYS A 95 75.279 23.511 8.189 1.00 0.00 H new ATOM 0 HG2 LYS A 95 75.128 21.776 5.688 1.00 0.00 H new ATOM 0 HG3 LYS A 95 74.263 23.299 5.773 1.00 0.00 H new ATOM 0 HD2 LYS A 95 77.157 23.315 6.626 1.00 0.00 H new ATOM 0 HD3 LYS A 95 76.832 23.148 4.912 1.00 0.00 H new ATOM 0 HE2 LYS A 95 75.687 25.243 4.791 1.00 0.00 H new ATOM 0 HE3 LYS A 95 75.392 25.291 6.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 77.190 26.789 5.894 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 77.786 25.551 6.892 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 78.071 25.504 5.218 1.00 0.00 H new TER 1378 LYS A 95