USER MOD reduce.3.24.130724 H: found=0, std=0, add=632, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 630 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 Single : A 1 GLY N :NH3+ 145:sc= 0.0348 (180deg=0) USER MOD Single : A 2 SER OG : rot 36:sc= 0.839 USER MOD Single : A 3 SER OG : rot 18:sc= 0.307 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -9:sc= 0.94 USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot 150:sc= -1.22 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0.0615 USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -0.012 X(o=-0.012,f=0) USER MOD Single : A 36 CYS SG : rot 180:sc= 0 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 GLN : amide:sc=-0.00939 X(o=-0.0094,f=-0.29) USER MOD Single : A 45 ASN : amide:sc= -0.646 K(o=-0.65,f=-7.7!) USER MOD Single : A 46 THR OG1 : rot 180:sc= -0.528 USER MOD Single : A 50 LYS NZ :NH3+ 142:sc= -4.95! (180deg=-9.45!) USER MOD Single : A 52 ASN : amide:sc= 0 X(o=0,f=0.031) USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 66 CYS SG : rot -71:sc= -5.01! USER MOD Single : A 67 THR OG1 : rot 180:sc= 0.0537 USER MOD Single : A 72 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 82 TYR OH : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= 0 USER MOD Single : A 86 SER OG : rot 16:sc= 0.859 USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -20.743 8.425 -12.835 1.00 0.00 N ATOM 2 CA GLY A 1 -19.829 9.271 -13.583 1.00 0.00 C ATOM 3 C GLY A 1 -19.699 10.649 -12.930 1.00 0.00 C ATOM 4 O GLY A 1 -20.652 11.150 -12.334 1.00 0.00 O ATOM 0 H1 GLY A 1 -21.270 7.816 -13.493 1.00 0.00 H new ATOM 0 H2 GLY A 1 -20.204 7.833 -12.171 1.00 0.00 H new ATOM 0 H3 GLY A 1 -21.411 9.020 -12.304 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -18.849 8.796 -13.637 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -20.186 9.382 -14.607 1.00 0.00 H new ATOM 8 N SER A 2 -18.512 11.223 -13.064 1.00 0.00 N ATOM 9 CA SER A 2 -18.246 12.533 -12.494 1.00 0.00 C ATOM 10 C SER A 2 -18.853 12.628 -11.094 1.00 0.00 C ATOM 11 O SER A 2 -19.976 13.105 -10.931 1.00 0.00 O ATOM 12 CB SER A 2 -18.797 13.645 -13.389 1.00 0.00 C ATOM 13 OG SER A 2 -20.202 13.517 -13.595 1.00 0.00 O ATOM 0 H SER A 2 -17.724 10.805 -13.559 1.00 0.00 H new ATOM 0 HA SER A 2 -17.166 12.662 -12.423 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.583 14.614 -12.937 1.00 0.00 H new ATOM 0 HB3 SER A 2 -18.286 13.623 -14.351 1.00 0.00 H new ATOM 0 HG SER A 2 -20.624 13.185 -12.775 1.00 0.00 H new ATOM 19 N SER A 3 -18.086 12.166 -10.117 1.00 0.00 N ATOM 20 CA SER A 3 -18.534 12.193 -8.736 1.00 0.00 C ATOM 21 C SER A 3 -17.331 12.300 -7.797 1.00 0.00 C ATOM 22 O SER A 3 -17.234 13.242 -7.011 1.00 0.00 O ATOM 23 CB SER A 3 -19.361 10.950 -8.400 1.00 0.00 C ATOM 24 OG SER A 3 -20.700 11.056 -8.874 1.00 0.00 O ATOM 0 H SER A 3 -17.156 11.770 -10.255 1.00 0.00 H new ATOM 0 HA SER A 3 -19.171 13.067 -8.601 1.00 0.00 H new ATOM 0 HB2 SER A 3 -18.889 10.071 -8.839 1.00 0.00 H new ATOM 0 HB3 SER A 3 -19.369 10.801 -7.320 1.00 0.00 H new ATOM 0 HG SER A 3 -20.751 11.757 -9.557 1.00 0.00 H new ATOM 30 N GLY A 4 -16.445 11.322 -7.909 1.00 0.00 N ATOM 31 CA GLY A 4 -15.252 11.294 -7.080 1.00 0.00 C ATOM 32 C GLY A 4 -14.921 9.865 -6.643 1.00 0.00 C ATOM 33 O GLY A 4 -15.155 8.914 -7.388 1.00 0.00 O ATOM 0 H GLY A 4 -16.529 10.543 -8.562 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -14.411 11.713 -7.632 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -15.401 11.922 -6.201 1.00 0.00 H new ATOM 37 N SER A 5 -14.383 9.759 -5.437 1.00 0.00 N ATOM 38 CA SER A 5 -14.018 8.462 -4.891 1.00 0.00 C ATOM 39 C SER A 5 -14.102 8.495 -3.364 1.00 0.00 C ATOM 40 O SER A 5 -13.559 9.396 -2.728 1.00 0.00 O ATOM 41 CB SER A 5 -12.613 8.053 -5.337 1.00 0.00 C ATOM 42 OG SER A 5 -12.595 6.753 -5.919 1.00 0.00 O ATOM 0 H SER A 5 -14.191 10.550 -4.822 1.00 0.00 H new ATOM 0 HA SER A 5 -14.721 7.720 -5.271 1.00 0.00 H new ATOM 0 HB2 SER A 5 -12.236 8.778 -6.058 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.940 8.076 -4.480 1.00 0.00 H new ATOM 0 HG SER A 5 -11.681 6.530 -6.192 1.00 0.00 H new ATOM 48 N SER A 6 -14.787 7.500 -2.820 1.00 0.00 N ATOM 49 CA SER A 6 -14.949 7.403 -1.379 1.00 0.00 C ATOM 50 C SER A 6 -15.394 5.990 -0.996 1.00 0.00 C ATOM 51 O SER A 6 -16.212 5.384 -1.687 1.00 0.00 O ATOM 52 CB SER A 6 -15.958 8.433 -0.868 1.00 0.00 C ATOM 53 OG SER A 6 -15.510 9.769 -1.078 1.00 0.00 O ATOM 0 H SER A 6 -15.236 6.754 -3.351 1.00 0.00 H new ATOM 0 HA SER A 6 -13.987 7.613 -0.912 1.00 0.00 H new ATOM 0 HB2 SER A 6 -16.913 8.287 -1.374 1.00 0.00 H new ATOM 0 HB3 SER A 6 -16.133 8.272 0.196 1.00 0.00 H new ATOM 0 HG SER A 6 -14.577 9.758 -1.376 1.00 0.00 H new ATOM 59 N GLY A 7 -14.835 5.505 0.103 1.00 0.00 N ATOM 60 CA GLY A 7 -15.164 4.175 0.586 1.00 0.00 C ATOM 61 C GLY A 7 -14.189 3.732 1.679 1.00 0.00 C ATOM 62 O GLY A 7 -12.978 3.888 1.536 1.00 0.00 O ATOM 0 H GLY A 7 -14.156 6.010 0.673 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -16.182 4.167 0.977 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.135 3.466 -0.241 1.00 0.00 H new ATOM 66 N ASP A 8 -14.755 3.189 2.747 1.00 0.00 N ATOM 67 CA ASP A 8 -13.952 2.723 3.864 1.00 0.00 C ATOM 68 C ASP A 8 -13.091 1.542 3.410 1.00 0.00 C ATOM 69 O ASP A 8 -13.324 0.973 2.345 1.00 0.00 O ATOM 70 CB ASP A 8 -14.836 2.247 5.018 1.00 0.00 C ATOM 71 CG ASP A 8 -14.454 2.794 6.395 1.00 0.00 C ATOM 72 OD1 ASP A 8 -13.274 3.180 6.544 1.00 0.00 O ATOM 73 OD2 ASP A 8 -15.349 2.814 7.266 1.00 0.00 O ATOM 0 H ASP A 8 -15.760 3.061 2.862 1.00 0.00 H new ATOM 0 HA ASP A 8 -13.333 3.553 4.203 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -15.867 2.529 4.805 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -14.804 1.158 5.055 1.00 0.00 H new ATOM 78 N SER A 9 -12.114 1.210 4.240 1.00 0.00 N ATOM 79 CA SER A 9 -11.217 0.107 3.937 1.00 0.00 C ATOM 80 C SER A 9 -12.025 -1.156 3.633 1.00 0.00 C ATOM 81 O SER A 9 -13.226 -1.206 3.891 1.00 0.00 O ATOM 82 CB SER A 9 -10.248 -0.148 5.094 1.00 0.00 C ATOM 83 OG SER A 9 -10.913 -0.164 6.354 1.00 0.00 O ATOM 0 H SER A 9 -11.923 1.685 5.122 1.00 0.00 H new ATOM 0 HA SER A 9 -10.630 0.375 3.059 1.00 0.00 H new ATOM 0 HB2 SER A 9 -9.742 -1.101 4.939 1.00 0.00 H new ATOM 0 HB3 SER A 9 -9.479 0.625 5.100 1.00 0.00 H new ATOM 0 HG SER A 9 -10.261 -0.331 7.066 1.00 0.00 H new ATOM 89 N LYS A 10 -11.332 -2.145 3.088 1.00 0.00 N ATOM 90 CA LYS A 10 -11.970 -3.405 2.745 1.00 0.00 C ATOM 91 C LYS A 10 -10.896 -4.470 2.517 1.00 0.00 C ATOM 92 O LYS A 10 -9.723 -4.146 2.338 1.00 0.00 O ATOM 93 CB LYS A 10 -12.916 -3.221 1.557 1.00 0.00 C ATOM 94 CG LYS A 10 -12.137 -3.144 0.242 1.00 0.00 C ATOM 95 CD LYS A 10 -13.064 -2.800 -0.925 1.00 0.00 C ATOM 96 CE LYS A 10 -13.201 -3.984 -1.884 1.00 0.00 C ATOM 97 NZ LYS A 10 -14.439 -4.741 -1.598 1.00 0.00 N ATOM 0 H LYS A 10 -10.335 -2.100 2.875 1.00 0.00 H new ATOM 0 HA LYS A 10 -12.594 -3.752 3.568 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -13.622 -4.051 1.518 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -13.501 -2.311 1.691 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -11.353 -2.391 0.323 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -11.644 -4.097 0.051 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -14.046 -2.521 -0.544 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -12.673 -1.936 -1.462 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -13.216 -3.626 -2.913 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -12.336 -4.640 -1.787 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -14.517 -5.541 -2.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -14.410 -5.099 -0.622 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -15.262 -4.116 -1.713 1.00 0.00 H new ATOM 111 N PRO A 11 -11.347 -5.753 2.530 1.00 0.00 N ATOM 112 CA PRO A 11 -10.437 -6.868 2.326 1.00 0.00 C ATOM 113 C PRO A 11 -10.038 -6.988 0.854 1.00 0.00 C ATOM 114 O PRO A 11 -10.869 -7.308 0.006 1.00 0.00 O ATOM 115 CB PRO A 11 -11.188 -8.087 2.839 1.00 0.00 C ATOM 116 CG PRO A 11 -12.654 -7.687 2.879 1.00 0.00 C ATOM 117 CD PRO A 11 -12.729 -6.175 2.739 1.00 0.00 C ATOM 0 HA PRO A 11 -9.494 -6.744 2.858 1.00 0.00 H new ATOM 0 HB2 PRO A 11 -11.035 -8.944 2.184 1.00 0.00 H new ATOM 0 HB3 PRO A 11 -10.835 -8.375 3.829 1.00 0.00 H new ATOM 0 HG2 PRO A 11 -13.204 -8.173 2.073 1.00 0.00 H new ATOM 0 HG3 PRO A 11 -13.111 -8.007 3.815 1.00 0.00 H new ATOM 0 HD2 PRO A 11 -13.362 -5.886 1.900 1.00 0.00 H new ATOM 0 HD3 PRO A 11 -13.153 -5.715 3.632 1.00 0.00 H new ATOM 125 N ILE A 12 -8.765 -6.724 0.597 1.00 0.00 N ATOM 126 CA ILE A 12 -8.245 -6.798 -0.758 1.00 0.00 C ATOM 127 C ILE A 12 -7.375 -8.049 -0.898 1.00 0.00 C ATOM 128 O ILE A 12 -6.947 -8.627 0.100 1.00 0.00 O ATOM 129 CB ILE A 12 -7.520 -5.502 -1.125 1.00 0.00 C ATOM 130 CG1 ILE A 12 -6.297 -5.285 -0.232 1.00 0.00 C ATOM 131 CG2 ILE A 12 -8.478 -4.309 -1.086 1.00 0.00 C ATOM 132 CD1 ILE A 12 -5.340 -4.265 -0.851 1.00 0.00 C ATOM 0 H ILE A 12 -8.079 -6.459 1.304 1.00 0.00 H new ATOM 0 HA ILE A 12 -9.061 -6.894 -1.474 1.00 0.00 H new ATOM 0 HB ILE A 12 -7.158 -5.591 -2.149 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -6.617 -4.939 0.751 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -5.778 -6.232 -0.083 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -7.938 -3.400 -1.351 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -9.288 -4.470 -1.797 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -8.891 -4.207 -0.082 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -4.479 -4.129 -0.196 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -5.003 -4.625 -1.823 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -5.855 -3.312 -0.976 1.00 0.00 H new ATOM 144 N LYS A 13 -7.141 -8.432 -2.145 1.00 0.00 N ATOM 145 CA LYS A 13 -6.330 -9.604 -2.428 1.00 0.00 C ATOM 146 C LYS A 13 -5.033 -9.168 -3.113 1.00 0.00 C ATOM 147 O LYS A 13 -5.065 -8.457 -4.116 1.00 0.00 O ATOM 148 CB LYS A 13 -7.134 -10.630 -3.230 1.00 0.00 C ATOM 149 CG LYS A 13 -7.505 -11.834 -2.362 1.00 0.00 C ATOM 150 CD LYS A 13 -6.321 -12.791 -2.217 1.00 0.00 C ATOM 151 CE LYS A 13 -6.673 -13.964 -1.299 1.00 0.00 C ATOM 152 NZ LYS A 13 -7.307 -15.055 -2.073 1.00 0.00 N ATOM 0 H LYS A 13 -7.499 -7.951 -2.970 1.00 0.00 H new ATOM 0 HA LYS A 13 -6.049 -10.106 -1.502 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -8.040 -10.164 -3.619 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -6.552 -10.962 -4.090 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -7.824 -11.492 -1.377 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -8.350 -12.360 -2.806 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -6.030 -13.167 -3.198 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -5.462 -12.254 -1.814 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -5.772 -14.333 -0.809 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -7.348 -13.628 -0.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -7.540 -15.843 -1.436 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -8.177 -14.703 -2.520 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -6.650 -15.387 -2.808 1.00 0.00 H new ATOM 166 N VAL A 14 -3.922 -9.612 -2.543 1.00 0.00 N ATOM 167 CA VAL A 14 -2.617 -9.277 -3.086 1.00 0.00 C ATOM 168 C VAL A 14 -1.867 -10.565 -3.431 1.00 0.00 C ATOM 169 O VAL A 14 -1.530 -11.348 -2.545 1.00 0.00 O ATOM 170 CB VAL A 14 -1.854 -8.386 -2.103 1.00 0.00 C ATOM 171 CG1 VAL A 14 -0.385 -8.255 -2.509 1.00 0.00 C ATOM 172 CG2 VAL A 14 -2.515 -7.012 -1.982 1.00 0.00 C ATOM 0 H VAL A 14 -3.899 -10.201 -1.711 1.00 0.00 H new ATOM 0 HA VAL A 14 -2.722 -8.705 -4.008 1.00 0.00 H new ATOM 0 HB VAL A 14 -1.889 -8.861 -1.123 1.00 0.00 H new ATOM 0 HG11 VAL A 14 0.135 -7.617 -1.794 1.00 0.00 H new ATOM 0 HG12 VAL A 14 0.079 -9.241 -2.519 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -0.320 -7.813 -3.503 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -1.953 -6.399 -1.278 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -2.526 -6.526 -2.958 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -3.538 -7.131 -1.624 1.00 0.00 H new ATOM 182 N THR A 15 -1.627 -10.744 -4.722 1.00 0.00 N ATOM 183 CA THR A 15 -0.923 -11.924 -5.196 1.00 0.00 C ATOM 184 C THR A 15 0.585 -11.670 -5.222 1.00 0.00 C ATOM 185 O THR A 15 1.041 -10.674 -5.781 1.00 0.00 O ATOM 186 CB THR A 15 -1.500 -12.302 -6.561 1.00 0.00 C ATOM 187 OG1 THR A 15 -2.756 -12.900 -6.255 1.00 0.00 O ATOM 188 CG2 THR A 15 -0.709 -13.422 -7.241 1.00 0.00 C ATOM 0 H THR A 15 -1.907 -10.092 -5.454 1.00 0.00 H new ATOM 0 HA THR A 15 -1.067 -12.768 -4.522 1.00 0.00 H new ATOM 0 HB THR A 15 -1.512 -11.423 -7.205 1.00 0.00 H new ATOM 0 HG1 THR A 15 -3.199 -13.173 -7.085 1.00 0.00 H new ATOM 0 HG21 THR A 15 -1.160 -13.652 -8.206 1.00 0.00 H new ATOM 0 HG22 THR A 15 0.322 -13.101 -7.390 1.00 0.00 H new ATOM 0 HG23 THR A 15 -0.725 -14.312 -6.612 1.00 0.00 H new ATOM 196 N LEU A 16 1.318 -12.588 -4.610 1.00 0.00 N ATOM 197 CA LEU A 16 2.766 -12.477 -4.556 1.00 0.00 C ATOM 198 C LEU A 16 3.333 -12.568 -5.974 1.00 0.00 C ATOM 199 O LEU A 16 2.668 -13.064 -6.881 1.00 0.00 O ATOM 200 CB LEU A 16 3.348 -13.513 -3.592 1.00 0.00 C ATOM 201 CG LEU A 16 2.872 -13.421 -2.141 1.00 0.00 C ATOM 202 CD1 LEU A 16 3.239 -14.686 -1.362 1.00 0.00 C ATOM 203 CD2 LEU A 16 3.410 -12.157 -1.467 1.00 0.00 C ATOM 0 H LEU A 16 0.936 -13.413 -4.147 1.00 0.00 H new ATOM 0 HA LEU A 16 3.059 -11.506 -4.157 1.00 0.00 H new ATOM 0 HB2 LEU A 16 3.108 -14.507 -3.970 1.00 0.00 H new ATOM 0 HB3 LEU A 16 4.434 -13.421 -3.604 1.00 0.00 H new ATOM 0 HG LEU A 16 1.784 -13.348 -2.142 1.00 0.00 H new ATOM 0 HD11 LEU A 16 2.889 -14.594 -0.334 1.00 0.00 H new ATOM 0 HD12 LEU A 16 2.768 -15.551 -1.830 1.00 0.00 H new ATOM 0 HD13 LEU A 16 4.321 -14.815 -1.367 1.00 0.00 H new ATOM 0 HD21 LEU A 16 3.057 -12.116 -0.437 1.00 0.00 H new ATOM 0 HD22 LEU A 16 4.500 -12.175 -1.477 1.00 0.00 H new ATOM 0 HD23 LEU A 16 3.057 -11.278 -2.007 1.00 0.00 H new ATOM 215 N PRO A 17 4.590 -12.069 -6.123 1.00 0.00 N ATOM 216 CA PRO A 17 5.254 -12.090 -7.415 1.00 0.00 C ATOM 217 C PRO A 17 5.736 -13.500 -7.761 1.00 0.00 C ATOM 218 O PRO A 17 6.348 -13.712 -8.807 1.00 0.00 O ATOM 219 CB PRO A 17 6.391 -11.089 -7.289 1.00 0.00 C ATOM 220 CG PRO A 17 6.607 -10.889 -5.798 1.00 0.00 C ATOM 221 CD PRO A 17 5.408 -11.474 -5.070 1.00 0.00 C ATOM 0 HA PRO A 17 4.589 -11.817 -8.234 1.00 0.00 H new ATOM 0 HB2 PRO A 17 7.296 -11.463 -7.768 1.00 0.00 H new ATOM 0 HB3 PRO A 17 6.138 -10.148 -7.777 1.00 0.00 H new ATOM 0 HG2 PRO A 17 7.526 -11.380 -5.476 1.00 0.00 H new ATOM 0 HG3 PRO A 17 6.714 -9.829 -5.567 1.00 0.00 H new ATOM 0 HD2 PRO A 17 5.715 -12.220 -4.337 1.00 0.00 H new ATOM 0 HD3 PRO A 17 4.858 -10.704 -4.529 1.00 0.00 H new ATOM 229 N ASP A 18 5.441 -14.429 -6.863 1.00 0.00 N ATOM 230 CA ASP A 18 5.836 -15.813 -7.061 1.00 0.00 C ATOM 231 C ASP A 18 4.608 -16.640 -7.446 1.00 0.00 C ATOM 232 O ASP A 18 4.725 -17.823 -7.762 1.00 0.00 O ATOM 233 CB ASP A 18 6.423 -16.407 -5.778 1.00 0.00 C ATOM 234 CG ASP A 18 7.935 -16.638 -5.805 1.00 0.00 C ATOM 235 OD1 ASP A 18 8.335 -17.721 -6.282 1.00 0.00 O ATOM 236 OD2 ASP A 18 8.657 -15.725 -5.348 1.00 0.00 O ATOM 0 H ASP A 18 4.933 -14.250 -5.997 1.00 0.00 H new ATOM 0 HA ASP A 18 6.589 -15.839 -7.849 1.00 0.00 H new ATOM 0 HB2 ASP A 18 6.187 -15.743 -4.947 1.00 0.00 H new ATOM 0 HB3 ASP A 18 5.929 -17.357 -5.576 1.00 0.00 H new ATOM 241 N GLY A 19 3.457 -15.985 -7.406 1.00 0.00 N ATOM 242 CA GLY A 19 2.208 -16.644 -7.747 1.00 0.00 C ATOM 243 C GLY A 19 1.323 -16.816 -6.511 1.00 0.00 C ATOM 244 O GLY A 19 0.098 -16.783 -6.610 1.00 0.00 O ATOM 0 H GLY A 19 3.363 -15.004 -7.142 1.00 0.00 H new ATOM 0 HA2 GLY A 19 1.678 -16.060 -8.499 1.00 0.00 H new ATOM 0 HA3 GLY A 19 2.416 -17.619 -8.188 1.00 0.00 H new ATOM 248 N LYS A 20 1.979 -16.995 -5.374 1.00 0.00 N ATOM 249 CA LYS A 20 1.268 -17.172 -4.119 1.00 0.00 C ATOM 250 C LYS A 20 0.272 -16.025 -3.936 1.00 0.00 C ATOM 251 O LYS A 20 0.337 -15.023 -4.647 1.00 0.00 O ATOM 252 CB LYS A 20 2.255 -17.320 -2.959 1.00 0.00 C ATOM 253 CG LYS A 20 2.659 -18.783 -2.767 1.00 0.00 C ATOM 254 CD LYS A 20 4.041 -19.053 -3.365 1.00 0.00 C ATOM 255 CE LYS A 20 5.042 -19.446 -2.277 1.00 0.00 C ATOM 256 NZ LYS A 20 5.655 -20.758 -2.586 1.00 0.00 N ATOM 0 H LYS A 20 2.996 -17.021 -5.295 1.00 0.00 H new ATOM 0 HA LYS A 20 0.691 -18.097 -4.136 1.00 0.00 H new ATOM 0 HB2 LYS A 20 3.142 -16.716 -3.152 1.00 0.00 H new ATOM 0 HB3 LYS A 20 1.804 -16.940 -2.042 1.00 0.00 H new ATOM 0 HG2 LYS A 20 2.665 -19.026 -1.704 1.00 0.00 H new ATOM 0 HG3 LYS A 20 1.922 -19.433 -3.238 1.00 0.00 H new ATOM 0 HD2 LYS A 20 3.971 -19.850 -4.105 1.00 0.00 H new ATOM 0 HD3 LYS A 20 4.396 -18.164 -3.886 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.818 -18.685 -2.197 1.00 0.00 H new ATOM 0 HE3 LYS A 20 4.539 -19.491 -1.311 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 6.332 -21.010 -1.838 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 4.912 -21.484 -2.640 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 6.152 -20.703 -3.498 1.00 0.00 H new ATOM 270 N GLN A 21 -0.626 -16.209 -2.980 1.00 0.00 N ATOM 271 CA GLN A 21 -1.634 -15.202 -2.695 1.00 0.00 C ATOM 272 C GLN A 21 -1.600 -14.822 -1.213 1.00 0.00 C ATOM 273 O GLN A 21 -1.216 -15.631 -0.370 1.00 0.00 O ATOM 274 CB GLN A 21 -3.025 -15.688 -3.105 1.00 0.00 C ATOM 275 CG GLN A 21 -3.005 -16.285 -4.513 1.00 0.00 C ATOM 276 CD GLN A 21 -4.419 -16.630 -4.984 1.00 0.00 C ATOM 277 OE1 GLN A 21 -4.919 -17.724 -4.783 1.00 0.00 O ATOM 278 NE2 GLN A 21 -5.035 -15.637 -5.619 1.00 0.00 N ATOM 0 H GLN A 21 -0.677 -17.041 -2.392 1.00 0.00 H new ATOM 0 HA GLN A 21 -1.408 -14.313 -3.283 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -3.377 -16.436 -2.394 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -3.730 -14.857 -3.069 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -2.550 -15.577 -5.205 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -2.386 -17.182 -4.522 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -4.559 -14.745 -5.754 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -5.983 -15.767 -5.971 1.00 0.00 H new ATOM 287 N VAL A 22 -2.008 -13.591 -0.941 1.00 0.00 N ATOM 288 CA VAL A 22 -2.029 -13.095 0.424 1.00 0.00 C ATOM 289 C VAL A 22 -3.278 -12.235 0.630 1.00 0.00 C ATOM 290 O VAL A 22 -3.905 -11.803 -0.337 1.00 0.00 O ATOM 291 CB VAL A 22 -0.731 -12.345 0.729 1.00 0.00 C ATOM 292 CG1 VAL A 22 -0.710 -11.850 2.176 1.00 0.00 C ATOM 293 CG2 VAL A 22 0.489 -13.219 0.430 1.00 0.00 C ATOM 0 H VAL A 22 -2.326 -12.923 -1.643 1.00 0.00 H new ATOM 0 HA VAL A 22 -2.084 -13.924 1.130 1.00 0.00 H new ATOM 0 HB VAL A 22 -0.687 -11.473 0.077 1.00 0.00 H new ATOM 0 HG11 VAL A 22 0.224 -11.320 2.366 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -1.550 -11.176 2.342 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -0.789 -12.701 2.853 1.00 0.00 H new ATOM 0 HG21 VAL A 22 1.399 -12.663 0.655 1.00 0.00 H new ATOM 0 HG22 VAL A 22 0.452 -14.118 1.045 1.00 0.00 H new ATOM 0 HG23 VAL A 22 0.486 -13.499 -0.623 1.00 0.00 H new ATOM 303 N ASP A 23 -3.602 -12.011 1.895 1.00 0.00 N ATOM 304 CA ASP A 23 -4.764 -11.211 2.240 1.00 0.00 C ATOM 305 C ASP A 23 -4.305 -9.830 2.713 1.00 0.00 C ATOM 306 O ASP A 23 -3.413 -9.723 3.553 1.00 0.00 O ATOM 307 CB ASP A 23 -5.563 -11.858 3.373 1.00 0.00 C ATOM 308 CG ASP A 23 -4.754 -12.182 4.630 1.00 0.00 C ATOM 309 OD1 ASP A 23 -3.739 -12.897 4.484 1.00 0.00 O ATOM 310 OD2 ASP A 23 -5.169 -11.708 5.710 1.00 0.00 O ATOM 0 H ASP A 23 -3.079 -12.370 2.694 1.00 0.00 H new ATOM 0 HA ASP A 23 -5.394 -11.133 1.354 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -6.381 -11.192 3.647 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -6.013 -12.779 3.001 1.00 0.00 H new ATOM 315 N ALA A 24 -4.936 -8.808 2.154 1.00 0.00 N ATOM 316 CA ALA A 24 -4.604 -7.439 2.509 1.00 0.00 C ATOM 317 C ALA A 24 -5.887 -6.609 2.582 1.00 0.00 C ATOM 318 O ALA A 24 -6.970 -7.107 2.279 1.00 0.00 O ATOM 319 CB ALA A 24 -3.603 -6.877 1.496 1.00 0.00 C ATOM 0 H ALA A 24 -5.676 -8.901 1.458 1.00 0.00 H new ATOM 0 HA ALA A 24 -4.131 -7.402 3.490 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -3.354 -5.850 1.762 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -2.698 -7.484 1.504 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -4.044 -6.897 0.499 1.00 0.00 H new ATOM 325 N GLU A 25 -5.723 -5.358 2.985 1.00 0.00 N ATOM 326 CA GLU A 25 -6.855 -4.455 3.102 1.00 0.00 C ATOM 327 C GLU A 25 -6.494 -3.076 2.544 1.00 0.00 C ATOM 328 O GLU A 25 -5.436 -2.534 2.858 1.00 0.00 O ATOM 329 CB GLU A 25 -7.328 -4.352 4.553 1.00 0.00 C ATOM 330 CG GLU A 25 -8.136 -5.588 4.955 1.00 0.00 C ATOM 331 CD GLU A 25 -8.043 -5.837 6.462 1.00 0.00 C ATOM 332 OE1 GLU A 25 -7.027 -5.404 7.047 1.00 0.00 O ATOM 333 OE2 GLU A 25 -8.991 -6.454 6.994 1.00 0.00 O ATOM 0 H GLU A 25 -4.823 -4.948 3.235 1.00 0.00 H new ATOM 0 HA GLU A 25 -7.679 -4.860 2.514 1.00 0.00 H new ATOM 0 HB2 GLU A 25 -6.467 -4.245 5.213 1.00 0.00 H new ATOM 0 HB3 GLU A 25 -7.938 -3.458 4.678 1.00 0.00 H new ATOM 0 HG2 GLU A 25 -9.179 -5.454 4.669 1.00 0.00 H new ATOM 0 HG3 GLU A 25 -7.767 -6.460 4.415 1.00 0.00 H new ATOM 340 N SER A 26 -7.394 -2.550 1.727 1.00 0.00 N ATOM 341 CA SER A 26 -7.184 -1.245 1.122 1.00 0.00 C ATOM 342 C SER A 26 -6.999 -0.187 2.212 1.00 0.00 C ATOM 343 O SER A 26 -7.810 -0.091 3.132 1.00 0.00 O ATOM 344 CB SER A 26 -8.350 -0.867 0.207 1.00 0.00 C ATOM 345 OG SER A 26 -9.612 -1.149 0.807 1.00 0.00 O ATOM 0 H SER A 26 -8.271 -3.003 1.469 1.00 0.00 H new ATOM 0 HA SER A 26 -6.281 -1.292 0.513 1.00 0.00 H new ATOM 0 HB2 SER A 26 -8.292 0.194 -0.034 1.00 0.00 H new ATOM 0 HB3 SER A 26 -8.265 -1.413 -0.733 1.00 0.00 H new ATOM 0 HG SER A 26 -10.280 -0.512 0.478 1.00 0.00 H new ATOM 351 N TRP A 27 -5.928 0.580 2.073 1.00 0.00 N ATOM 352 CA TRP A 27 -5.627 1.627 3.034 1.00 0.00 C ATOM 353 C TRP A 27 -5.488 0.978 4.412 1.00 0.00 C ATOM 354 O TRP A 27 -5.963 1.520 5.409 1.00 0.00 O ATOM 355 CB TRP A 27 -6.689 2.727 2.996 1.00 0.00 C ATOM 356 CG TRP A 27 -7.196 3.056 1.590 1.00 0.00 C ATOM 357 CD1 TRP A 27 -8.260 2.545 0.957 1.00 0.00 C ATOM 358 CD2 TRP A 27 -6.612 3.996 0.664 1.00 0.00 C ATOM 359 NE1 TRP A 27 -8.405 3.084 -0.305 1.00 0.00 N ATOM 360 CE2 TRP A 27 -7.370 3.995 -0.489 1.00 0.00 C ATOM 361 CE3 TRP A 27 -5.480 4.820 0.796 1.00 0.00 C ATOM 362 CZ2 TRP A 27 -7.080 4.798 -1.598 1.00 0.00 C ATOM 363 CZ3 TRP A 27 -5.204 5.616 -0.322 1.00 0.00 C ATOM 364 CH2 TRP A 27 -5.957 5.627 -1.490 1.00 0.00 C ATOM 0 H TRP A 27 -5.258 0.497 1.309 1.00 0.00 H new ATOM 0 HA TRP A 27 -4.687 2.121 2.785 1.00 0.00 H new ATOM 0 HB2 TRP A 27 -7.534 2.423 3.614 1.00 0.00 H new ATOM 0 HB3 TRP A 27 -6.276 3.631 3.443 1.00 0.00 H new ATOM 0 HD1 TRP A 27 -8.921 1.804 1.381 1.00 0.00 H new ATOM 0 HE1 TRP A 27 -9.136 2.856 -0.979 1.00 0.00 H new ATOM 0 HE3 TRP A 27 -4.872 4.837 1.689 1.00 0.00 H new ATOM 0 HZ2 TRP A 27 -7.690 4.779 -2.489 1.00 0.00 H new ATOM 0 HZ3 TRP A 27 -4.344 6.268 -0.273 1.00 0.00 H new ATOM 0 HH2 TRP A 27 -5.677 6.272 -2.310 1.00 0.00 H new ATOM 375 N LYS A 28 -4.834 -0.175 4.425 1.00 0.00 N ATOM 376 CA LYS A 28 -4.626 -0.904 5.664 1.00 0.00 C ATOM 377 C LYS A 28 -3.242 -1.556 5.641 1.00 0.00 C ATOM 378 O LYS A 28 -2.373 -1.206 6.438 1.00 0.00 O ATOM 379 CB LYS A 28 -5.769 -1.893 5.902 1.00 0.00 C ATOM 380 CG LYS A 28 -6.837 -1.287 6.814 1.00 0.00 C ATOM 381 CD LYS A 28 -7.405 -2.340 7.769 1.00 0.00 C ATOM 382 CE LYS A 28 -7.811 -1.709 9.102 1.00 0.00 C ATOM 383 NZ LYS A 28 -7.636 -2.677 10.208 1.00 0.00 N ATOM 0 H LYS A 28 -4.441 -0.622 3.596 1.00 0.00 H new ATOM 0 HA LYS A 28 -4.643 -0.223 6.515 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -6.216 -2.173 4.948 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -5.377 -2.806 6.351 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -6.407 -0.465 7.387 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -7.641 -0.868 6.209 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -8.270 -2.822 7.312 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -6.661 -3.118 7.942 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -7.208 -0.821 9.289 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -8.851 -1.384 9.056 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -7.916 -2.233 11.106 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -8.230 -3.513 10.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -6.639 -2.967 10.261 1.00 0.00 H new ATOM 397 N THR A 29 -3.081 -2.494 4.719 1.00 0.00 N ATOM 398 CA THR A 29 -1.818 -3.199 4.581 1.00 0.00 C ATOM 399 C THR A 29 -0.991 -2.594 3.445 1.00 0.00 C ATOM 400 O THR A 29 -1.541 -2.000 2.519 1.00 0.00 O ATOM 401 CB THR A 29 -2.124 -4.685 4.386 1.00 0.00 C ATOM 402 OG1 THR A 29 -2.843 -5.049 5.561 1.00 0.00 O ATOM 403 CG2 THR A 29 -0.866 -5.554 4.435 1.00 0.00 C ATOM 0 H THR A 29 -3.804 -2.782 4.060 1.00 0.00 H new ATOM 0 HA THR A 29 -1.207 -3.094 5.477 1.00 0.00 H new ATOM 0 HB THR A 29 -2.627 -4.829 3.430 1.00 0.00 H new ATOM 0 HG1 THR A 29 -3.083 -5.998 5.517 1.00 0.00 H new ATOM 0 HG21 THR A 29 -1.140 -6.599 4.291 1.00 0.00 H new ATOM 0 HG22 THR A 29 -0.180 -5.247 3.645 1.00 0.00 H new ATOM 0 HG23 THR A 29 -0.380 -5.436 5.404 1.00 0.00 H new ATOM 411 N THR A 30 0.319 -2.766 3.552 1.00 0.00 N ATOM 412 CA THR A 30 1.227 -2.245 2.545 1.00 0.00 C ATOM 413 C THR A 30 2.118 -3.363 2.001 1.00 0.00 C ATOM 414 O THR A 30 2.083 -4.488 2.498 1.00 0.00 O ATOM 415 CB THR A 30 2.014 -1.091 3.170 1.00 0.00 C ATOM 416 OG1 THR A 30 3.183 -1.714 3.698 1.00 0.00 O ATOM 417 CG2 THR A 30 1.317 -0.505 4.399 1.00 0.00 C ATOM 0 H THR A 30 0.773 -3.259 4.321 1.00 0.00 H new ATOM 0 HA THR A 30 0.683 -1.858 1.684 1.00 0.00 H new ATOM 0 HB THR A 30 2.160 -0.307 2.427 1.00 0.00 H new ATOM 0 HG1 THR A 30 3.752 -1.037 4.121 1.00 0.00 H new ATOM 0 HG21 THR A 30 1.917 0.310 4.804 1.00 0.00 H new ATOM 0 HG22 THR A 30 0.335 -0.126 4.114 1.00 0.00 H new ATOM 0 HG23 THR A 30 1.201 -1.281 5.156 1.00 0.00 H new ATOM 425 N PRO A 31 2.916 -3.007 0.959 1.00 0.00 N ATOM 426 CA PRO A 31 3.815 -3.967 0.341 1.00 0.00 C ATOM 427 C PRO A 31 5.032 -4.229 1.229 1.00 0.00 C ATOM 428 O PRO A 31 5.691 -5.259 1.098 1.00 0.00 O ATOM 429 CB PRO A 31 4.179 -3.357 -1.002 1.00 0.00 C ATOM 430 CG PRO A 31 3.847 -1.878 -0.892 1.00 0.00 C ATOM 431 CD PRO A 31 2.984 -1.685 0.343 1.00 0.00 C ATOM 0 HA PRO A 31 3.357 -4.947 0.207 1.00 0.00 H new ATOM 0 HB2 PRO A 31 5.236 -3.504 -1.224 1.00 0.00 H new ATOM 0 HB3 PRO A 31 3.615 -3.825 -1.809 1.00 0.00 H new ATOM 0 HG2 PRO A 31 4.759 -1.287 -0.816 1.00 0.00 H new ATOM 0 HG3 PRO A 31 3.320 -1.538 -1.783 1.00 0.00 H new ATOM 0 HD2 PRO A 31 3.423 -0.954 1.022 1.00 0.00 H new ATOM 0 HD3 PRO A 31 1.992 -1.320 0.079 1.00 0.00 H new ATOM 439 N TYR A 32 5.295 -3.278 2.114 1.00 0.00 N ATOM 440 CA TYR A 32 6.422 -3.392 3.024 1.00 0.00 C ATOM 441 C TYR A 32 6.137 -4.417 4.123 1.00 0.00 C ATOM 442 O TYR A 32 7.045 -5.109 4.582 1.00 0.00 O ATOM 443 CB TYR A 32 6.591 -2.012 3.662 1.00 0.00 C ATOM 444 CG TYR A 32 7.955 -1.793 4.319 1.00 0.00 C ATOM 445 CD1 TYR A 32 9.111 -2.009 3.597 1.00 0.00 C ATOM 446 CD2 TYR A 32 8.029 -1.379 5.633 1.00 0.00 C ATOM 447 CE1 TYR A 32 10.395 -1.802 4.215 1.00 0.00 C ATOM 448 CE2 TYR A 32 9.313 -1.172 6.252 1.00 0.00 C ATOM 449 CZ TYR A 32 10.433 -1.395 5.512 1.00 0.00 C ATOM 450 OH TYR A 32 11.646 -1.200 6.096 1.00 0.00 O ATOM 0 H TYR A 32 4.746 -2.425 2.220 1.00 0.00 H new ATOM 0 HA TYR A 32 7.315 -3.718 2.490 1.00 0.00 H new ATOM 0 HB2 TYR A 32 6.440 -1.249 2.898 1.00 0.00 H new ATOM 0 HB3 TYR A 32 5.812 -1.871 4.411 1.00 0.00 H new ATOM 0 HD1 TYR A 32 9.053 -2.333 2.568 1.00 0.00 H new ATOM 0 HD2 TYR A 32 7.124 -1.210 6.198 1.00 0.00 H new ATOM 0 HE1 TYR A 32 11.307 -1.966 3.661 1.00 0.00 H new ATOM 0 HE2 TYR A 32 9.385 -0.847 7.280 1.00 0.00 H new ATOM 0 HH TYR A 32 11.520 -0.909 7.023 1.00 0.00 H new ATOM 460 N GLN A 33 4.873 -4.483 4.514 1.00 0.00 N ATOM 461 CA GLN A 33 4.457 -5.412 5.551 1.00 0.00 C ATOM 462 C GLN A 33 4.354 -6.829 4.984 1.00 0.00 C ATOM 463 O GLN A 33 4.946 -7.762 5.524 1.00 0.00 O ATOM 464 CB GLN A 33 3.132 -4.975 6.179 1.00 0.00 C ATOM 465 CG GLN A 33 3.368 -4.004 7.338 1.00 0.00 C ATOM 466 CD GLN A 33 2.083 -3.255 7.696 1.00 0.00 C ATOM 467 OE1 GLN A 33 1.075 -3.838 8.058 1.00 0.00 O ATOM 468 NE2 GLN A 33 2.176 -1.934 7.575 1.00 0.00 N ATOM 0 H GLN A 33 4.123 -3.908 4.131 1.00 0.00 H new ATOM 0 HA GLN A 33 5.212 -5.410 6.337 1.00 0.00 H new ATOM 0 HB2 GLN A 33 2.507 -4.500 5.423 1.00 0.00 H new ATOM 0 HB3 GLN A 33 2.589 -5.850 6.538 1.00 0.00 H new ATOM 0 HG2 GLN A 33 3.728 -4.552 8.209 1.00 0.00 H new ATOM 0 HG3 GLN A 33 4.146 -3.290 7.066 1.00 0.00 H new ATOM 0 HE21 GLN A 33 3.051 -1.510 7.266 1.00 0.00 H new ATOM 0 HE22 GLN A 33 1.372 -1.344 7.791 1.00 0.00 H new ATOM 477 N ILE A 34 3.598 -6.946 3.902 1.00 0.00 N ATOM 478 CA ILE A 34 3.411 -8.233 3.255 1.00 0.00 C ATOM 479 C ILE A 34 4.737 -8.996 3.251 1.00 0.00 C ATOM 480 O ILE A 34 4.779 -10.177 3.591 1.00 0.00 O ATOM 481 CB ILE A 34 2.802 -8.051 1.864 1.00 0.00 C ATOM 482 CG1 ILE A 34 1.392 -7.465 1.954 1.00 0.00 C ATOM 483 CG2 ILE A 34 2.829 -9.363 1.077 1.00 0.00 C ATOM 484 CD1 ILE A 34 0.430 -8.203 1.020 1.00 0.00 C ATOM 0 H ILE A 34 3.108 -6.170 3.457 1.00 0.00 H new ATOM 0 HA ILE A 34 2.697 -8.838 3.813 1.00 0.00 H new ATOM 0 HB ILE A 34 3.413 -7.334 1.315 1.00 0.00 H new ATOM 0 HG12 ILE A 34 1.031 -7.532 2.980 1.00 0.00 H new ATOM 0 HG13 ILE A 34 1.417 -6.407 1.694 1.00 0.00 H new ATOM 0 HG21 ILE A 34 2.390 -9.205 0.092 1.00 0.00 H new ATOM 0 HG22 ILE A 34 3.860 -9.699 0.965 1.00 0.00 H new ATOM 0 HG23 ILE A 34 2.256 -10.120 1.612 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -0.565 -7.766 1.104 1.00 0.00 H new ATOM 0 HD12 ILE A 34 0.780 -8.113 -0.008 1.00 0.00 H new ATOM 0 HD13 ILE A 34 0.389 -9.256 1.298 1.00 0.00 H new ATOM 496 N ALA A 35 5.788 -8.288 2.864 1.00 0.00 N ATOM 497 CA ALA A 35 7.113 -8.883 2.811 1.00 0.00 C ATOM 498 C ALA A 35 7.564 -9.240 4.229 1.00 0.00 C ATOM 499 O ALA A 35 7.938 -10.380 4.497 1.00 0.00 O ATOM 500 CB ALA A 35 8.078 -7.920 2.117 1.00 0.00 C ATOM 0 H ALA A 35 5.749 -7.308 2.584 1.00 0.00 H new ATOM 0 HA ALA A 35 7.097 -9.804 2.228 1.00 0.00 H new ATOM 0 HB1 ALA A 35 9.072 -8.366 2.077 1.00 0.00 H new ATOM 0 HB2 ALA A 35 7.728 -7.722 1.104 1.00 0.00 H new ATOM 0 HB3 ALA A 35 8.122 -6.985 2.675 1.00 0.00 H new ATOM 506 N CYS A 36 7.513 -8.243 5.100 1.00 0.00 N ATOM 507 CA CYS A 36 7.911 -8.437 6.483 1.00 0.00 C ATOM 508 C CYS A 36 7.192 -9.676 7.021 1.00 0.00 C ATOM 509 O CYS A 36 7.806 -10.521 7.671 1.00 0.00 O ATOM 510 CB CYS A 36 7.626 -7.197 7.334 1.00 0.00 C ATOM 511 SG CYS A 36 8.923 -7.001 8.610 1.00 0.00 S ATOM 0 H CYS A 36 7.202 -7.298 4.874 1.00 0.00 H new ATOM 0 HA CYS A 36 8.989 -8.592 6.535 1.00 0.00 H new ATOM 0 HB2 CYS A 36 7.591 -6.311 6.700 1.00 0.00 H new ATOM 0 HB3 CYS A 36 6.649 -7.288 7.808 1.00 0.00 H new ATOM 0 HG CYS A 36 8.672 -5.944 9.325 1.00 0.00 H new ATOM 517 N GLY A 37 5.901 -9.744 6.731 1.00 0.00 N ATOM 518 CA GLY A 37 5.092 -10.865 7.178 1.00 0.00 C ATOM 519 C GLY A 37 5.882 -12.174 7.107 1.00 0.00 C ATOM 520 O GLY A 37 6.085 -12.836 8.124 1.00 0.00 O ATOM 0 H GLY A 37 5.395 -9.041 6.192 1.00 0.00 H new ATOM 0 HA2 GLY A 37 4.759 -10.692 8.201 1.00 0.00 H new ATOM 0 HA3 GLY A 37 4.197 -10.942 6.560 1.00 0.00 H new ATOM 524 N ILE A 38 6.307 -12.507 5.897 1.00 0.00 N ATOM 525 CA ILE A 38 7.070 -13.724 5.681 1.00 0.00 C ATOM 526 C ILE A 38 8.067 -13.907 6.827 1.00 0.00 C ATOM 527 O ILE A 38 7.987 -14.881 7.575 1.00 0.00 O ATOM 528 CB ILE A 38 7.721 -13.710 4.296 1.00 0.00 C ATOM 529 CG1 ILE A 38 6.663 -13.627 3.194 1.00 0.00 C ATOM 530 CG2 ILE A 38 8.648 -14.913 4.113 1.00 0.00 C ATOM 531 CD1 ILE A 38 6.875 -12.388 2.322 1.00 0.00 C ATOM 0 H ILE A 38 6.137 -11.955 5.056 1.00 0.00 H new ATOM 0 HA ILE A 38 6.411 -14.592 5.690 1.00 0.00 H new ATOM 0 HB ILE A 38 8.338 -12.815 4.217 1.00 0.00 H new ATOM 0 HG12 ILE A 38 6.706 -14.523 2.575 1.00 0.00 H new ATOM 0 HG13 ILE A 38 5.669 -13.596 3.641 1.00 0.00 H new ATOM 0 HG21 ILE A 38 9.097 -14.878 3.121 1.00 0.00 H new ATOM 0 HG22 ILE A 38 9.434 -14.885 4.868 1.00 0.00 H new ATOM 0 HG23 ILE A 38 8.075 -15.834 4.220 1.00 0.00 H new ATOM 0 HD11 ILE A 38 6.110 -12.353 1.547 1.00 0.00 H new ATOM 0 HD12 ILE A 38 6.807 -11.492 2.940 1.00 0.00 H new ATOM 0 HD13 ILE A 38 7.860 -12.434 1.857 1.00 0.00 H new ATOM 543 N SER A 39 8.982 -12.955 6.930 1.00 0.00 N ATOM 544 CA SER A 39 9.994 -12.998 7.973 1.00 0.00 C ATOM 545 C SER A 39 10.482 -11.583 8.288 1.00 0.00 C ATOM 546 O SER A 39 10.524 -10.726 7.406 1.00 0.00 O ATOM 547 CB SER A 39 11.170 -13.886 7.563 1.00 0.00 C ATOM 548 OG SER A 39 11.257 -15.061 8.365 1.00 0.00 O ATOM 0 H SER A 39 9.044 -12.149 6.308 1.00 0.00 H new ATOM 0 HA SER A 39 9.544 -13.428 8.868 1.00 0.00 H new ATOM 0 HB2 SER A 39 11.063 -14.169 6.516 1.00 0.00 H new ATOM 0 HB3 SER A 39 12.098 -13.320 7.647 1.00 0.00 H new ATOM 0 HG SER A 39 12.019 -15.602 8.071 1.00 0.00 H new ATOM 554 N GLN A 40 10.838 -11.381 9.548 1.00 0.00 N ATOM 555 CA GLN A 40 11.321 -10.084 9.990 1.00 0.00 C ATOM 556 C GLN A 40 12.680 -9.780 9.356 1.00 0.00 C ATOM 557 O GLN A 40 13.629 -10.547 9.513 1.00 0.00 O ATOM 558 CB GLN A 40 11.403 -10.020 11.517 1.00 0.00 C ATOM 559 CG GLN A 40 10.263 -9.176 12.091 1.00 0.00 C ATOM 560 CD GLN A 40 9.166 -10.065 12.680 1.00 0.00 C ATOM 561 OE1 GLN A 40 8.731 -11.037 12.084 1.00 0.00 O ATOM 562 NE2 GLN A 40 8.743 -9.679 13.881 1.00 0.00 N ATOM 0 H GLN A 40 10.802 -12.094 10.277 1.00 0.00 H new ATOM 0 HA GLN A 40 10.611 -9.324 9.665 1.00 0.00 H new ATOM 0 HB2 GLN A 40 11.358 -11.028 11.930 1.00 0.00 H new ATOM 0 HB3 GLN A 40 12.361 -9.595 11.816 1.00 0.00 H new ATOM 0 HG2 GLN A 40 10.651 -8.511 12.863 1.00 0.00 H new ATOM 0 HG3 GLN A 40 9.843 -8.545 11.308 1.00 0.00 H new ATOM 0 HE21 GLN A 40 9.150 -8.855 14.325 1.00 0.00 H new ATOM 0 HE22 GLN A 40 8.012 -10.207 14.358 1.00 0.00 H new ATOM 571 N GLY A 41 12.731 -8.658 8.652 1.00 0.00 N ATOM 572 CA GLY A 41 13.957 -8.243 7.993 1.00 0.00 C ATOM 573 C GLY A 41 13.786 -8.229 6.473 1.00 0.00 C ATOM 574 O GLY A 41 14.349 -7.376 5.789 1.00 0.00 O ATOM 0 H GLY A 41 11.942 -8.024 8.524 1.00 0.00 H new ATOM 0 HA2 GLY A 41 14.242 -7.250 8.339 1.00 0.00 H new ATOM 0 HA3 GLY A 41 14.767 -8.920 8.265 1.00 0.00 H new ATOM 578 N LEU A 42 13.005 -9.184 5.989 1.00 0.00 N ATOM 579 CA LEU A 42 12.752 -9.292 4.562 1.00 0.00 C ATOM 580 C LEU A 42 12.312 -7.930 4.022 1.00 0.00 C ATOM 581 O LEU A 42 12.631 -7.576 2.888 1.00 0.00 O ATOM 582 CB LEU A 42 11.755 -10.417 4.279 1.00 0.00 C ATOM 583 CG LEU A 42 11.837 -11.052 2.889 1.00 0.00 C ATOM 584 CD1 LEU A 42 10.862 -12.224 2.763 1.00 0.00 C ATOM 585 CD2 LEU A 42 11.618 -10.005 1.794 1.00 0.00 C ATOM 0 H LEU A 42 12.539 -9.890 6.559 1.00 0.00 H new ATOM 0 HA LEU A 42 13.665 -9.565 4.033 1.00 0.00 H new ATOM 0 HB2 LEU A 42 11.900 -11.200 5.023 1.00 0.00 H new ATOM 0 HB3 LEU A 42 10.747 -10.026 4.419 1.00 0.00 H new ATOM 0 HG LEU A 42 12.842 -11.453 2.756 1.00 0.00 H new ATOM 0 HD11 LEU A 42 10.941 -12.657 1.766 1.00 0.00 H new ATOM 0 HD12 LEU A 42 11.106 -12.982 3.508 1.00 0.00 H new ATOM 0 HD13 LEU A 42 9.844 -11.870 2.925 1.00 0.00 H new ATOM 0 HD21 LEU A 42 11.681 -10.482 0.816 1.00 0.00 H new ATOM 0 HD22 LEU A 42 10.633 -9.553 1.914 1.00 0.00 H new ATOM 0 HD23 LEU A 42 12.383 -9.233 1.871 1.00 0.00 H new ATOM 597 N ALA A 43 11.587 -7.203 4.859 1.00 0.00 N ATOM 598 CA ALA A 43 11.100 -5.888 4.479 1.00 0.00 C ATOM 599 C ALA A 43 12.284 -5.008 4.073 1.00 0.00 C ATOM 600 O ALA A 43 12.211 -4.280 3.084 1.00 0.00 O ATOM 601 CB ALA A 43 10.297 -5.287 5.635 1.00 0.00 C ATOM 0 H ALA A 43 11.325 -7.500 5.799 1.00 0.00 H new ATOM 0 HA ALA A 43 10.432 -5.960 3.620 1.00 0.00 H new ATOM 0 HB1 ALA A 43 9.932 -4.300 5.350 1.00 0.00 H new ATOM 0 HB2 ALA A 43 9.451 -5.935 5.866 1.00 0.00 H new ATOM 0 HB3 ALA A 43 10.936 -5.197 6.514 1.00 0.00 H new ATOM 607 N ASP A 44 13.348 -5.104 4.857 1.00 0.00 N ATOM 608 CA ASP A 44 14.546 -4.326 4.592 1.00 0.00 C ATOM 609 C ASP A 44 14.995 -4.565 3.149 1.00 0.00 C ATOM 610 O ASP A 44 15.460 -3.644 2.479 1.00 0.00 O ATOM 611 CB ASP A 44 15.690 -4.743 5.518 1.00 0.00 C ATOM 612 CG ASP A 44 16.719 -3.648 5.808 1.00 0.00 C ATOM 613 OD1 ASP A 44 17.253 -3.096 4.822 1.00 0.00 O ATOM 614 OD2 ASP A 44 16.948 -3.389 7.009 1.00 0.00 O ATOM 0 H ASP A 44 13.405 -5.709 5.676 1.00 0.00 H new ATOM 0 HA ASP A 44 14.310 -3.275 4.761 1.00 0.00 H new ATOM 0 HB2 ASP A 44 15.267 -5.083 6.463 1.00 0.00 H new ATOM 0 HB3 ASP A 44 16.204 -5.596 5.074 1.00 0.00 H new ATOM 619 N ASN A 45 14.839 -5.806 2.712 1.00 0.00 N ATOM 620 CA ASN A 45 15.222 -6.178 1.361 1.00 0.00 C ATOM 621 C ASN A 45 14.357 -5.409 0.360 1.00 0.00 C ATOM 622 O ASN A 45 13.691 -4.441 0.725 1.00 0.00 O ATOM 623 CB ASN A 45 15.008 -7.673 1.120 1.00 0.00 C ATOM 624 CG ASN A 45 15.604 -8.503 2.259 1.00 0.00 C ATOM 625 OD1 ASN A 45 15.473 -8.183 3.429 1.00 0.00 O ATOM 626 ND2 ASN A 45 16.263 -9.585 1.853 1.00 0.00 N ATOM 0 H ASN A 45 14.452 -6.567 3.270 1.00 0.00 H new ATOM 0 HA ASN A 45 16.278 -5.939 1.232 1.00 0.00 H new ATOM 0 HB2 ASN A 45 13.942 -7.882 1.032 1.00 0.00 H new ATOM 0 HB3 ASN A 45 15.468 -7.962 0.175 1.00 0.00 H new ATOM 0 HD21 ASN A 45 16.696 -10.205 2.537 1.00 0.00 H new ATOM 0 HD22 ASN A 45 16.335 -9.795 0.857 1.00 0.00 H new ATOM 633 N THR A 46 14.394 -5.869 -0.882 1.00 0.00 N ATOM 634 CA THR A 46 13.622 -5.237 -1.937 1.00 0.00 C ATOM 635 C THR A 46 14.112 -3.807 -2.174 1.00 0.00 C ATOM 636 O THR A 46 14.930 -3.293 -1.411 1.00 0.00 O ATOM 637 CB THR A 46 12.143 -5.316 -1.554 1.00 0.00 C ATOM 638 OG1 THR A 46 11.868 -6.714 -1.520 1.00 0.00 O ATOM 639 CG2 THR A 46 11.223 -4.783 -2.654 1.00 0.00 C ATOM 0 H THR A 46 14.947 -6.672 -1.181 1.00 0.00 H new ATOM 0 HA THR A 46 13.755 -5.754 -2.887 1.00 0.00 H new ATOM 0 HB THR A 46 11.976 -4.752 -0.636 1.00 0.00 H new ATOM 0 HG1 THR A 46 10.929 -6.857 -1.278 1.00 0.00 H new ATOM 0 HG21 THR A 46 10.185 -4.862 -2.330 1.00 0.00 H new ATOM 0 HG22 THR A 46 11.462 -3.738 -2.854 1.00 0.00 H new ATOM 0 HG23 THR A 46 11.365 -5.368 -3.563 1.00 0.00 H new ATOM 647 N VAL A 47 13.592 -3.204 -3.233 1.00 0.00 N ATOM 648 CA VAL A 47 13.967 -1.843 -3.579 1.00 0.00 C ATOM 649 C VAL A 47 12.702 -1.003 -3.765 1.00 0.00 C ATOM 650 O VAL A 47 12.584 0.082 -3.196 1.00 0.00 O ATOM 651 CB VAL A 47 14.869 -1.847 -4.814 1.00 0.00 C ATOM 652 CG1 VAL A 47 14.040 -1.798 -6.099 1.00 0.00 C ATOM 653 CG2 VAL A 47 15.872 -0.693 -4.764 1.00 0.00 C ATOM 0 H VAL A 47 12.914 -3.633 -3.863 1.00 0.00 H new ATOM 0 HA VAL A 47 14.544 -1.389 -2.774 1.00 0.00 H new ATOM 0 HB VAL A 47 15.432 -2.780 -4.814 1.00 0.00 H new ATOM 0 HG11 VAL A 47 14.706 -1.802 -6.962 1.00 0.00 H new ATOM 0 HG12 VAL A 47 13.385 -2.668 -6.143 1.00 0.00 H new ATOM 0 HG13 VAL A 47 13.438 -0.889 -6.109 1.00 0.00 H new ATOM 0 HG21 VAL A 47 16.501 -0.719 -5.654 1.00 0.00 H new ATOM 0 HG22 VAL A 47 15.335 0.255 -4.727 1.00 0.00 H new ATOM 0 HG23 VAL A 47 16.496 -0.791 -3.876 1.00 0.00 H new ATOM 663 N ILE A 48 11.788 -1.535 -4.564 1.00 0.00 N ATOM 664 CA ILE A 48 10.537 -0.847 -4.832 1.00 0.00 C ATOM 665 C ILE A 48 9.435 -1.879 -5.079 1.00 0.00 C ATOM 666 O ILE A 48 9.602 -2.789 -5.891 1.00 0.00 O ATOM 667 CB ILE A 48 10.710 0.153 -5.976 1.00 0.00 C ATOM 668 CG1 ILE A 48 11.525 1.367 -5.525 1.00 0.00 C ATOM 669 CG2 ILE A 48 9.355 0.558 -6.561 1.00 0.00 C ATOM 670 CD1 ILE A 48 10.792 2.142 -4.428 1.00 0.00 C ATOM 0 H ILE A 48 11.889 -2.434 -5.034 1.00 0.00 H new ATOM 0 HA ILE A 48 10.234 -0.257 -3.967 1.00 0.00 H new ATOM 0 HB ILE A 48 11.272 -0.334 -6.773 1.00 0.00 H new ATOM 0 HG12 ILE A 48 12.497 1.040 -5.157 1.00 0.00 H new ATOM 0 HG13 ILE A 48 11.710 2.022 -6.376 1.00 0.00 H new ATOM 0 HG21 ILE A 48 9.507 1.270 -7.373 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.845 -0.326 -6.944 1.00 0.00 H new ATOM 0 HG23 ILE A 48 8.746 1.019 -5.783 1.00 0.00 H new ATOM 0 HD11 ILE A 48 11.393 3.000 -4.125 1.00 0.00 H new ATOM 0 HD12 ILE A 48 9.830 2.488 -4.807 1.00 0.00 H new ATOM 0 HD13 ILE A 48 10.630 1.491 -3.569 1.00 0.00 H new ATOM 682 N ALA A 49 8.333 -1.705 -4.364 1.00 0.00 N ATOM 683 CA ALA A 49 7.205 -2.610 -4.495 1.00 0.00 C ATOM 684 C ALA A 49 6.239 -2.065 -5.550 1.00 0.00 C ATOM 685 O ALA A 49 5.878 -0.889 -5.517 1.00 0.00 O ATOM 686 CB ALA A 49 6.536 -2.794 -3.132 1.00 0.00 C ATOM 0 H ALA A 49 8.198 -0.950 -3.692 1.00 0.00 H new ATOM 0 HA ALA A 49 7.539 -3.592 -4.829 1.00 0.00 H new ATOM 0 HB1 ALA A 49 5.689 -3.473 -3.231 1.00 0.00 H new ATOM 0 HB2 ALA A 49 7.255 -3.211 -2.427 1.00 0.00 H new ATOM 0 HB3 ALA A 49 6.186 -1.829 -2.765 1.00 0.00 H new ATOM 692 N LYS A 50 5.848 -2.945 -6.459 1.00 0.00 N ATOM 693 CA LYS A 50 4.931 -2.566 -7.521 1.00 0.00 C ATOM 694 C LYS A 50 3.514 -3.005 -7.146 1.00 0.00 C ATOM 695 O LYS A 50 3.324 -4.071 -6.563 1.00 0.00 O ATOM 696 CB LYS A 50 5.411 -3.119 -8.865 1.00 0.00 C ATOM 697 CG LYS A 50 6.335 -2.123 -9.569 1.00 0.00 C ATOM 698 CD LYS A 50 6.622 -2.563 -11.006 1.00 0.00 C ATOM 699 CE LYS A 50 6.748 -1.354 -11.935 1.00 0.00 C ATOM 700 NZ LYS A 50 5.438 -0.683 -12.092 1.00 0.00 N ATOM 0 H LYS A 50 6.149 -3.919 -6.483 1.00 0.00 H new ATOM 0 HA LYS A 50 4.909 -1.482 -7.637 1.00 0.00 H new ATOM 0 HB2 LYS A 50 5.937 -4.060 -8.708 1.00 0.00 H new ATOM 0 HB3 LYS A 50 4.552 -3.336 -9.501 1.00 0.00 H new ATOM 0 HG2 LYS A 50 5.875 -1.135 -9.572 1.00 0.00 H new ATOM 0 HG3 LYS A 50 7.271 -2.037 -9.017 1.00 0.00 H new ATOM 0 HD2 LYS A 50 7.543 -3.146 -11.035 1.00 0.00 H new ATOM 0 HD3 LYS A 50 5.822 -3.214 -11.357 1.00 0.00 H new ATOM 0 HE2 LYS A 50 7.477 -0.652 -11.531 1.00 0.00 H new ATOM 0 HE3 LYS A 50 7.119 -1.673 -12.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 5.577 0.347 -12.124 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 4.989 -1.000 -12.975 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 4.826 -0.924 -11.287 1.00 0.00 H new ATOM 714 N VAL A 51 2.555 -2.160 -7.497 1.00 0.00 N ATOM 715 CA VAL A 51 1.161 -2.448 -7.205 1.00 0.00 C ATOM 716 C VAL A 51 0.336 -2.303 -8.485 1.00 0.00 C ATOM 717 O VAL A 51 -0.022 -1.193 -8.875 1.00 0.00 O ATOM 718 CB VAL A 51 0.668 -1.547 -6.071 1.00 0.00 C ATOM 719 CG1 VAL A 51 -0.850 -1.649 -5.910 1.00 0.00 C ATOM 720 CG2 VAL A 51 1.383 -1.876 -4.759 1.00 0.00 C ATOM 0 H VAL A 51 2.716 -1.276 -7.981 1.00 0.00 H new ATOM 0 HA VAL A 51 1.047 -3.476 -6.860 1.00 0.00 H new ATOM 0 HB VAL A 51 0.908 -0.517 -6.333 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -1.174 -0.999 -5.097 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -1.336 -1.342 -6.836 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -1.123 -2.679 -5.681 1.00 0.00 H new ATOM 0 HG21 VAL A 51 1.014 -1.221 -3.969 1.00 0.00 H new ATOM 0 HG22 VAL A 51 1.189 -2.914 -4.490 1.00 0.00 H new ATOM 0 HG23 VAL A 51 2.456 -1.727 -4.882 1.00 0.00 H new ATOM 730 N ASN A 52 0.059 -3.442 -9.104 1.00 0.00 N ATOM 731 CA ASN A 52 -0.718 -3.456 -10.332 1.00 0.00 C ATOM 732 C ASN A 52 0.194 -3.107 -11.511 1.00 0.00 C ATOM 733 O ASN A 52 -0.259 -2.538 -12.503 1.00 0.00 O ATOM 734 CB ASN A 52 -1.844 -2.422 -10.284 1.00 0.00 C ATOM 735 CG ASN A 52 -3.021 -2.852 -11.162 1.00 0.00 C ATOM 736 OD1 ASN A 52 -3.109 -2.521 -12.333 1.00 0.00 O ATOM 737 ND2 ASN A 52 -3.918 -3.607 -10.533 1.00 0.00 N ATOM 0 H ASN A 52 0.359 -4.361 -8.778 1.00 0.00 H new ATOM 0 HA ASN A 52 -1.147 -4.451 -10.448 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -2.181 -2.293 -9.255 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -1.469 -1.455 -10.620 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -4.740 -3.945 -11.033 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -3.783 -3.847 -9.551 1.00 0.00 H new ATOM 744 N ASN A 53 1.462 -3.462 -11.362 1.00 0.00 N ATOM 745 CA ASN A 53 2.440 -3.193 -12.402 1.00 0.00 C ATOM 746 C ASN A 53 2.823 -1.712 -12.366 1.00 0.00 C ATOM 747 O ASN A 53 3.319 -1.172 -13.353 1.00 0.00 O ATOM 748 CB ASN A 53 1.870 -3.501 -13.788 1.00 0.00 C ATOM 749 CG ASN A 53 2.813 -4.409 -14.580 1.00 0.00 C ATOM 750 OD1 ASN A 53 3.972 -4.099 -14.804 1.00 0.00 O ATOM 751 ND2 ASN A 53 2.254 -5.544 -14.989 1.00 0.00 N ATOM 0 H ASN A 53 1.834 -3.933 -10.537 1.00 0.00 H new ATOM 0 HA ASN A 53 3.308 -3.827 -12.220 1.00 0.00 H new ATOM 0 HB2 ASN A 53 0.897 -3.982 -13.686 1.00 0.00 H new ATOM 0 HB3 ASN A 53 1.711 -2.571 -14.334 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.801 -6.218 -15.525 1.00 0.00 H new ATOM 0 HD22 ASN A 53 1.278 -5.741 -14.767 1.00 0.00 H new ATOM 758 N VAL A 54 2.577 -1.098 -11.218 1.00 0.00 N ATOM 759 CA VAL A 54 2.890 0.310 -11.041 1.00 0.00 C ATOM 760 C VAL A 54 3.677 0.493 -9.741 1.00 0.00 C ATOM 761 O VAL A 54 3.297 -0.041 -8.701 1.00 0.00 O ATOM 762 CB VAL A 54 1.606 1.140 -11.084 1.00 0.00 C ATOM 763 CG1 VAL A 54 0.484 0.379 -11.793 1.00 0.00 C ATOM 764 CG2 VAL A 54 1.177 1.562 -9.677 1.00 0.00 C ATOM 0 H VAL A 54 2.165 -1.549 -10.402 1.00 0.00 H new ATOM 0 HA VAL A 54 3.520 0.667 -11.856 1.00 0.00 H new ATOM 0 HB VAL A 54 1.812 2.044 -11.657 1.00 0.00 H new ATOM 0 HG11 VAL A 54 -0.417 0.992 -11.810 1.00 0.00 H new ATOM 0 HG12 VAL A 54 0.787 0.152 -12.815 1.00 0.00 H new ATOM 0 HG13 VAL A 54 0.281 -0.550 -11.260 1.00 0.00 H new ATOM 0 HG21 VAL A 54 0.262 2.151 -9.737 1.00 0.00 H new ATOM 0 HG22 VAL A 54 0.999 0.675 -9.070 1.00 0.00 H new ATOM 0 HG23 VAL A 54 1.965 2.162 -9.221 1.00 0.00 H new ATOM 774 N VAL A 55 4.759 1.251 -9.844 1.00 0.00 N ATOM 775 CA VAL A 55 5.602 1.511 -8.690 1.00 0.00 C ATOM 776 C VAL A 55 4.724 1.900 -7.499 1.00 0.00 C ATOM 777 O VAL A 55 3.810 2.711 -7.636 1.00 0.00 O ATOM 778 CB VAL A 55 6.647 2.575 -9.035 1.00 0.00 C ATOM 779 CG1 VAL A 55 7.359 3.072 -7.776 1.00 0.00 C ATOM 780 CG2 VAL A 55 7.652 2.044 -10.060 1.00 0.00 C ATOM 0 H VAL A 55 5.071 1.693 -10.709 1.00 0.00 H new ATOM 0 HA VAL A 55 6.152 0.613 -8.409 1.00 0.00 H new ATOM 0 HB VAL A 55 6.128 3.422 -9.483 1.00 0.00 H new ATOM 0 HG11 VAL A 55 8.096 3.827 -8.049 1.00 0.00 H new ATOM 0 HG12 VAL A 55 6.629 3.507 -7.093 1.00 0.00 H new ATOM 0 HG13 VAL A 55 7.860 2.236 -7.287 1.00 0.00 H new ATOM 0 HG21 VAL A 55 8.383 2.819 -10.288 1.00 0.00 H new ATOM 0 HG22 VAL A 55 8.163 1.172 -9.651 1.00 0.00 H new ATOM 0 HG23 VAL A 55 7.127 1.762 -10.972 1.00 0.00 H new ATOM 790 N TRP A 56 5.033 1.303 -6.357 1.00 0.00 N ATOM 791 CA TRP A 56 4.283 1.577 -5.143 1.00 0.00 C ATOM 792 C TRP A 56 5.276 1.654 -3.982 1.00 0.00 C ATOM 793 O TRP A 56 6.046 0.721 -3.756 1.00 0.00 O ATOM 794 CB TRP A 56 3.189 0.530 -4.926 1.00 0.00 C ATOM 795 CG TRP A 56 1.939 1.071 -4.231 1.00 0.00 C ATOM 796 CD1 TRP A 56 1.671 1.097 -2.918 1.00 0.00 C ATOM 797 CD2 TRP A 56 0.789 1.667 -4.869 1.00 0.00 C ATOM 798 NE1 TRP A 56 0.439 1.664 -2.664 1.00 0.00 N ATOM 799 CE2 TRP A 56 -0.115 2.021 -3.888 1.00 0.00 C ATOM 800 CE3 TRP A 56 0.523 1.898 -6.230 1.00 0.00 C ATOM 801 CZ2 TRP A 56 -1.346 2.628 -4.164 1.00 0.00 C ATOM 802 CZ3 TRP A 56 -0.712 2.506 -6.488 1.00 0.00 C ATOM 803 CH2 TRP A 56 -1.633 2.869 -5.513 1.00 0.00 C ATOM 0 H TRP A 56 5.792 0.631 -6.247 1.00 0.00 H new ATOM 0 HA TRP A 56 3.761 2.531 -5.219 1.00 0.00 H new ATOM 0 HB2 TRP A 56 2.903 0.113 -5.892 1.00 0.00 H new ATOM 0 HB3 TRP A 56 3.596 -0.289 -4.333 1.00 0.00 H new ATOM 0 HD1 TRP A 56 2.336 0.721 -2.155 1.00 0.00 H new ATOM 0 HE1 TRP A 56 0.013 1.797 -1.747 1.00 0.00 H new ATOM 0 HE3 TRP A 56 1.215 1.628 -7.014 1.00 0.00 H new ATOM 0 HZ2 TRP A 56 -2.037 2.896 -3.379 1.00 0.00 H new ATOM 0 HZ3 TRP A 56 -0.967 2.707 -7.518 1.00 0.00 H new ATOM 0 HH2 TRP A 56 -2.566 3.335 -5.794 1.00 0.00 H new ATOM 814 N ASP A 57 5.226 2.773 -3.275 1.00 0.00 N ATOM 815 CA ASP A 57 6.111 2.984 -2.142 1.00 0.00 C ATOM 816 C ASP A 57 5.807 1.943 -1.062 1.00 0.00 C ATOM 817 O ASP A 57 4.650 1.585 -0.849 1.00 0.00 O ATOM 818 CB ASP A 57 5.905 4.372 -1.532 1.00 0.00 C ATOM 819 CG ASP A 57 6.589 5.516 -2.283 1.00 0.00 C ATOM 820 OD1 ASP A 57 7.772 5.773 -1.970 1.00 0.00 O ATOM 821 OD2 ASP A 57 5.915 6.107 -3.154 1.00 0.00 O ATOM 0 H ASP A 57 4.586 3.544 -3.465 1.00 0.00 H new ATOM 0 HA ASP A 57 7.138 2.895 -2.496 1.00 0.00 H new ATOM 0 HB2 ASP A 57 4.835 4.577 -1.485 1.00 0.00 H new ATOM 0 HB3 ASP A 57 6.273 4.360 -0.506 1.00 0.00 H new ATOM 826 N LEU A 58 6.866 1.487 -0.410 1.00 0.00 N ATOM 827 CA LEU A 58 6.727 0.495 0.643 1.00 0.00 C ATOM 828 C LEU A 58 5.927 1.095 1.801 1.00 0.00 C ATOM 829 O LEU A 58 5.087 0.421 2.395 1.00 0.00 O ATOM 830 CB LEU A 58 8.098 -0.044 1.056 1.00 0.00 C ATOM 831 CG LEU A 58 9.064 -0.365 -0.086 1.00 0.00 C ATOM 832 CD1 LEU A 58 10.446 0.235 0.180 1.00 0.00 C ATOM 833 CD2 LEU A 58 9.132 -1.872 -0.339 1.00 0.00 C ATOM 0 H LEU A 58 7.824 1.786 -0.590 1.00 0.00 H new ATOM 0 HA LEU A 58 6.167 -0.368 0.282 1.00 0.00 H new ATOM 0 HB2 LEU A 58 8.571 0.687 1.711 1.00 0.00 H new ATOM 0 HB3 LEU A 58 7.948 -0.949 1.644 1.00 0.00 H new ATOM 0 HG LEU A 58 8.683 0.097 -0.996 1.00 0.00 H new ATOM 0 HD11 LEU A 58 11.113 -0.008 -0.647 1.00 0.00 H new ATOM 0 HD12 LEU A 58 10.361 1.318 0.272 1.00 0.00 H new ATOM 0 HD13 LEU A 58 10.850 -0.177 1.105 1.00 0.00 H new ATOM 0 HD21 LEU A 58 9.826 -2.073 -1.156 1.00 0.00 H new ATOM 0 HD22 LEU A 58 9.477 -2.377 0.563 1.00 0.00 H new ATOM 0 HD23 LEU A 58 8.142 -2.241 -0.605 1.00 0.00 H new ATOM 845 N ASP A 59 6.217 2.356 2.087 1.00 0.00 N ATOM 846 CA ASP A 59 5.536 3.055 3.164 1.00 0.00 C ATOM 847 C ASP A 59 4.210 3.615 2.644 1.00 0.00 C ATOM 848 O ASP A 59 3.922 4.798 2.817 1.00 0.00 O ATOM 849 CB ASP A 59 6.375 4.226 3.678 1.00 0.00 C ATOM 850 CG ASP A 59 7.726 3.838 4.281 1.00 0.00 C ATOM 851 OD1 ASP A 59 7.786 2.745 4.885 1.00 0.00 O ATOM 852 OD2 ASP A 59 8.670 4.642 4.124 1.00 0.00 O ATOM 0 H ASP A 59 6.914 2.912 1.592 1.00 0.00 H new ATOM 0 HA ASP A 59 5.372 2.346 3.976 1.00 0.00 H new ATOM 0 HB2 ASP A 59 6.547 4.919 2.854 1.00 0.00 H new ATOM 0 HB3 ASP A 59 5.799 4.763 4.431 1.00 0.00 H new ATOM 857 N ARG A 60 3.439 2.739 2.017 1.00 0.00 N ATOM 858 CA ARG A 60 2.152 3.131 1.470 1.00 0.00 C ATOM 859 C ARG A 60 1.246 1.908 1.313 1.00 0.00 C ATOM 860 O ARG A 60 1.642 0.912 0.710 1.00 0.00 O ATOM 861 CB ARG A 60 2.315 3.814 0.111 1.00 0.00 C ATOM 862 CG ARG A 60 1.011 4.485 -0.326 1.00 0.00 C ATOM 863 CD ARG A 60 1.279 5.589 -1.351 1.00 0.00 C ATOM 864 NE ARG A 60 0.677 6.861 -0.893 1.00 0.00 N ATOM 865 CZ ARG A 60 1.231 7.669 0.021 1.00 0.00 C ATOM 866 NH1 ARG A 60 2.404 7.342 0.580 1.00 0.00 N ATOM 867 NH2 ARG A 60 0.613 8.804 0.375 1.00 0.00 N ATOM 0 H ARG A 60 3.681 1.758 1.876 1.00 0.00 H new ATOM 0 HA ARG A 60 1.698 3.836 2.166 1.00 0.00 H new ATOM 0 HB2 ARG A 60 3.110 4.558 0.167 1.00 0.00 H new ATOM 0 HB3 ARG A 60 2.618 3.079 -0.635 1.00 0.00 H new ATOM 0 HG2 ARG A 60 0.341 3.740 -0.755 1.00 0.00 H new ATOM 0 HG3 ARG A 60 0.505 4.906 0.543 1.00 0.00 H new ATOM 0 HD2 ARG A 60 2.353 5.715 -1.490 1.00 0.00 H new ATOM 0 HD3 ARG A 60 0.863 5.308 -2.318 1.00 0.00 H new ATOM 0 HE ARG A 60 -0.216 7.140 -1.299 1.00 0.00 H new ATOM 0 HH11 ARG A 60 2.875 6.478 0.310 1.00 0.00 H new ATOM 0 HH12 ARG A 60 2.826 7.957 1.276 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -0.280 9.053 -0.051 1.00 0.00 H new ATOM 0 HH22 ARG A 60 1.035 9.419 1.071 1.00 0.00 H new ATOM 881 N PRO A 61 0.016 2.026 1.881 1.00 0.00 N ATOM 882 CA PRO A 61 -0.948 0.942 1.810 1.00 0.00 C ATOM 883 C PRO A 61 -1.564 0.847 0.413 1.00 0.00 C ATOM 884 O PRO A 61 -1.739 1.860 -0.263 1.00 0.00 O ATOM 885 CB PRO A 61 -1.971 1.253 2.890 1.00 0.00 C ATOM 886 CG PRO A 61 -1.801 2.729 3.211 1.00 0.00 C ATOM 887 CD PRO A 61 -0.487 3.191 2.604 1.00 0.00 C ATOM 0 HA PRO A 61 -0.495 -0.035 1.979 1.00 0.00 H new ATOM 0 HB2 PRO A 61 -2.982 1.043 2.542 1.00 0.00 H new ATOM 0 HB3 PRO A 61 -1.804 0.639 3.775 1.00 0.00 H new ATOM 0 HG2 PRO A 61 -2.632 3.306 2.805 1.00 0.00 H new ATOM 0 HG3 PRO A 61 -1.800 2.887 4.289 1.00 0.00 H new ATOM 0 HD2 PRO A 61 -0.636 4.039 1.935 1.00 0.00 H new ATOM 0 HD3 PRO A 61 0.214 3.512 3.374 1.00 0.00 H new ATOM 895 N LEU A 62 -1.877 -0.380 0.021 1.00 0.00 N ATOM 896 CA LEU A 62 -2.470 -0.620 -1.284 1.00 0.00 C ATOM 897 C LEU A 62 -3.778 0.165 -1.397 1.00 0.00 C ATOM 898 O LEU A 62 -4.152 0.892 -0.478 1.00 0.00 O ATOM 899 CB LEU A 62 -2.630 -2.121 -1.531 1.00 0.00 C ATOM 900 CG LEU A 62 -1.398 -2.983 -1.247 1.00 0.00 C ATOM 901 CD1 LEU A 62 -0.111 -2.232 -1.597 1.00 0.00 C ATOM 902 CD2 LEU A 62 -1.397 -3.478 0.200 1.00 0.00 C ATOM 0 H LEU A 62 -1.731 -1.218 0.584 1.00 0.00 H new ATOM 0 HA LEU A 62 -1.812 -0.259 -2.074 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -3.453 -2.485 -0.916 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -2.920 -2.269 -2.571 1.00 0.00 H new ATOM 0 HG LEU A 62 -1.442 -3.863 -1.888 1.00 0.00 H new ATOM 0 HD11 LEU A 62 0.750 -2.867 -1.386 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -0.118 -1.971 -2.655 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -0.046 -1.323 -0.999 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -0.511 -4.088 0.375 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -1.389 -2.624 0.877 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -2.290 -4.076 0.381 1.00 0.00 H new ATOM 914 N GLU A 63 -4.439 -0.009 -2.532 1.00 0.00 N ATOM 915 CA GLU A 63 -5.698 0.674 -2.777 1.00 0.00 C ATOM 916 C GLU A 63 -6.828 -0.343 -2.951 1.00 0.00 C ATOM 917 O GLU A 63 -7.958 -0.098 -2.531 1.00 0.00 O ATOM 918 CB GLU A 63 -5.595 1.593 -3.996 1.00 0.00 C ATOM 919 CG GLU A 63 -5.016 2.955 -3.608 1.00 0.00 C ATOM 920 CD GLU A 63 -4.912 3.873 -4.828 1.00 0.00 C ATOM 921 OE1 GLU A 63 -4.774 3.324 -5.942 1.00 0.00 O ATOM 922 OE2 GLU A 63 -4.972 5.104 -4.618 1.00 0.00 O ATOM 0 H GLU A 63 -4.126 -0.613 -3.292 1.00 0.00 H new ATOM 0 HA GLU A 63 -5.926 1.297 -1.912 1.00 0.00 H new ATOM 0 HB2 GLU A 63 -4.964 1.128 -4.754 1.00 0.00 H new ATOM 0 HB3 GLU A 63 -6.582 1.726 -4.440 1.00 0.00 H new ATOM 0 HG2 GLU A 63 -5.647 3.420 -2.851 1.00 0.00 H new ATOM 0 HG3 GLU A 63 -4.030 2.822 -3.163 1.00 0.00 H new ATOM 929 N GLU A 64 -6.484 -1.462 -3.570 1.00 0.00 N ATOM 930 CA GLU A 64 -7.456 -2.517 -3.805 1.00 0.00 C ATOM 931 C GLU A 64 -6.778 -3.731 -4.443 1.00 0.00 C ATOM 932 O GLU A 64 -5.569 -3.723 -4.671 1.00 0.00 O ATOM 933 CB GLU A 64 -8.612 -2.015 -4.673 1.00 0.00 C ATOM 934 CG GLU A 64 -8.133 -1.692 -6.090 1.00 0.00 C ATOM 935 CD GLU A 64 -8.993 -0.596 -6.723 1.00 0.00 C ATOM 936 OE1 GLU A 64 -8.765 0.580 -6.366 1.00 0.00 O ATOM 937 OE2 GLU A 64 -9.858 -0.959 -7.548 1.00 0.00 O ATOM 0 H GLU A 64 -5.546 -1.662 -3.916 1.00 0.00 H new ATOM 0 HA GLU A 64 -7.872 -2.821 -2.845 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -9.396 -2.771 -4.714 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -9.051 -1.125 -4.222 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -7.092 -1.371 -6.061 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -8.173 -2.591 -6.705 1.00 0.00 H new ATOM 944 N ASP A 65 -7.586 -4.745 -4.714 1.00 0.00 N ATOM 945 CA ASP A 65 -7.080 -5.964 -5.322 1.00 0.00 C ATOM 946 C ASP A 65 -6.060 -5.603 -6.405 1.00 0.00 C ATOM 947 O ASP A 65 -6.422 -5.055 -7.445 1.00 0.00 O ATOM 948 CB ASP A 65 -8.207 -6.761 -5.981 1.00 0.00 C ATOM 949 CG ASP A 65 -9.185 -5.930 -6.814 1.00 0.00 C ATOM 950 OD1 ASP A 65 -8.853 -4.753 -7.072 1.00 0.00 O ATOM 951 OD2 ASP A 65 -10.242 -6.491 -7.175 1.00 0.00 O ATOM 0 H ASP A 65 -8.588 -4.748 -4.524 1.00 0.00 H new ATOM 0 HA ASP A 65 -6.624 -6.567 -4.537 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -7.765 -7.525 -6.621 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -8.766 -7.281 -5.204 1.00 0.00 H new ATOM 956 N CYS A 66 -4.806 -5.925 -6.123 1.00 0.00 N ATOM 957 CA CYS A 66 -3.733 -5.642 -7.060 1.00 0.00 C ATOM 958 C CYS A 66 -2.621 -6.670 -6.841 1.00 0.00 C ATOM 959 O CYS A 66 -2.689 -7.475 -5.914 1.00 0.00 O ATOM 960 CB CYS A 66 -3.220 -4.207 -6.916 1.00 0.00 C ATOM 961 SG CYS A 66 -2.825 -3.857 -5.164 1.00 0.00 S ATOM 0 H CYS A 66 -4.510 -6.379 -5.259 1.00 0.00 H new ATOM 0 HA CYS A 66 -4.107 -5.724 -8.081 1.00 0.00 H new ATOM 0 HB2 CYS A 66 -2.332 -4.066 -7.533 1.00 0.00 H new ATOM 0 HB3 CYS A 66 -3.973 -3.505 -7.275 1.00 0.00 H new ATOM 0 HG CYS A 66 -3.927 -3.769 -4.480 1.00 0.00 H new ATOM 967 N THR A 67 -1.622 -6.608 -7.710 1.00 0.00 N ATOM 968 CA THR A 67 -0.497 -7.524 -7.623 1.00 0.00 C ATOM 969 C THR A 67 0.651 -6.885 -6.839 1.00 0.00 C ATOM 970 O THR A 67 0.697 -5.666 -6.682 1.00 0.00 O ATOM 971 CB THR A 67 -0.109 -7.931 -9.046 1.00 0.00 C ATOM 972 OG1 THR A 67 -0.164 -6.713 -9.784 1.00 0.00 O ATOM 973 CG2 THR A 67 -1.165 -8.817 -9.710 1.00 0.00 C ATOM 0 H THR A 67 -1.568 -5.938 -8.477 1.00 0.00 H new ATOM 0 HA THR A 67 -0.762 -8.426 -7.072 1.00 0.00 H new ATOM 0 HB THR A 67 0.845 -8.457 -9.025 1.00 0.00 H new ATOM 0 HG1 THR A 67 0.076 -6.886 -10.718 1.00 0.00 H new ATOM 0 HG21 THR A 67 -0.840 -9.077 -10.718 1.00 0.00 H new ATOM 0 HG22 THR A 67 -1.296 -9.727 -9.125 1.00 0.00 H new ATOM 0 HG23 THR A 67 -2.111 -8.279 -9.761 1.00 0.00 H new ATOM 981 N LEU A 68 1.550 -7.737 -6.369 1.00 0.00 N ATOM 982 CA LEU A 68 2.695 -7.271 -5.605 1.00 0.00 C ATOM 983 C LEU A 68 3.977 -7.828 -6.226 1.00 0.00 C ATOM 984 O LEU A 68 4.090 -9.032 -6.451 1.00 0.00 O ATOM 985 CB LEU A 68 2.528 -7.618 -4.124 1.00 0.00 C ATOM 986 CG LEU A 68 3.709 -7.269 -3.217 1.00 0.00 C ATOM 987 CD1 LEU A 68 4.089 -5.793 -3.354 1.00 0.00 C ATOM 988 CD2 LEU A 68 3.417 -7.652 -1.765 1.00 0.00 C ATOM 0 H LEU A 68 1.509 -8.747 -6.502 1.00 0.00 H new ATOM 0 HA LEU A 68 2.765 -6.184 -5.648 1.00 0.00 H new ATOM 0 HB2 LEU A 68 1.643 -7.105 -3.748 1.00 0.00 H new ATOM 0 HB3 LEU A 68 2.335 -8.688 -4.041 1.00 0.00 H new ATOM 0 HG LEU A 68 4.570 -7.855 -3.538 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.931 -5.572 -2.698 1.00 0.00 H new ATOM 0 HD12 LEU A 68 4.368 -5.583 -4.387 1.00 0.00 H new ATOM 0 HD13 LEU A 68 3.239 -5.171 -3.075 1.00 0.00 H new ATOM 0 HD21 LEU A 68 4.273 -7.393 -1.141 1.00 0.00 H new ATOM 0 HD22 LEU A 68 2.537 -7.112 -1.416 1.00 0.00 H new ATOM 0 HD23 LEU A 68 3.233 -8.724 -1.702 1.00 0.00 H new ATOM 1000 N GLU A 69 4.911 -6.925 -6.486 1.00 0.00 N ATOM 1001 CA GLU A 69 6.182 -7.311 -7.077 1.00 0.00 C ATOM 1002 C GLU A 69 7.327 -6.533 -6.427 1.00 0.00 C ATOM 1003 O GLU A 69 7.341 -5.303 -6.454 1.00 0.00 O ATOM 1004 CB GLU A 69 6.167 -7.102 -8.593 1.00 0.00 C ATOM 1005 CG GLU A 69 7.474 -7.585 -9.225 1.00 0.00 C ATOM 1006 CD GLU A 69 7.415 -7.485 -10.751 1.00 0.00 C ATOM 1007 OE1 GLU A 69 6.979 -6.417 -11.233 1.00 0.00 O ATOM 1008 OE2 GLU A 69 7.806 -8.479 -11.400 1.00 0.00 O ATOM 0 H GLU A 69 4.813 -5.927 -6.298 1.00 0.00 H new ATOM 0 HA GLU A 69 6.340 -8.373 -6.891 1.00 0.00 H new ATOM 0 HB2 GLU A 69 5.326 -7.641 -9.030 1.00 0.00 H new ATOM 0 HB3 GLU A 69 6.019 -6.046 -8.817 1.00 0.00 H new ATOM 0 HG2 GLU A 69 8.306 -6.989 -8.850 1.00 0.00 H new ATOM 0 HG3 GLU A 69 7.664 -8.617 -8.932 1.00 0.00 H new ATOM 1015 N LEU A 70 8.261 -7.282 -5.858 1.00 0.00 N ATOM 1016 CA LEU A 70 9.408 -6.678 -5.202 1.00 0.00 C ATOM 1017 C LEU A 70 10.530 -6.482 -6.225 1.00 0.00 C ATOM 1018 O LEU A 70 10.891 -7.414 -6.941 1.00 0.00 O ATOM 1019 CB LEU A 70 9.825 -7.504 -3.984 1.00 0.00 C ATOM 1020 CG LEU A 70 8.707 -7.862 -3.002 1.00 0.00 C ATOM 1021 CD1 LEU A 70 7.990 -6.605 -2.505 1.00 0.00 C ATOM 1022 CD2 LEU A 70 7.735 -8.868 -3.622 1.00 0.00 C ATOM 0 H LEU A 70 8.246 -8.302 -5.838 1.00 0.00 H new ATOM 0 HA LEU A 70 9.151 -5.691 -4.816 1.00 0.00 H new ATOM 0 HB2 LEU A 70 10.282 -8.429 -4.336 1.00 0.00 H new ATOM 0 HB3 LEU A 70 10.595 -6.954 -3.443 1.00 0.00 H new ATOM 0 HG LEU A 70 9.157 -8.341 -2.132 1.00 0.00 H new ATOM 0 HD11 LEU A 70 7.200 -6.888 -1.809 1.00 0.00 H new ATOM 0 HD12 LEU A 70 8.704 -5.955 -1.999 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.554 -6.076 -3.352 1.00 0.00 H new ATOM 0 HD21 LEU A 70 6.950 -9.106 -2.904 1.00 0.00 H new ATOM 0 HD22 LEU A 70 7.288 -8.438 -4.518 1.00 0.00 H new ATOM 0 HD23 LEU A 70 8.273 -9.778 -3.886 1.00 0.00 H new ATOM 1034 N LEU A 71 11.049 -5.264 -6.260 1.00 0.00 N ATOM 1035 CA LEU A 71 12.121 -4.933 -7.182 1.00 0.00 C ATOM 1036 C LEU A 71 13.466 -5.071 -6.464 1.00 0.00 C ATOM 1037 O LEU A 71 13.537 -4.947 -5.243 1.00 0.00 O ATOM 1038 CB LEU A 71 11.892 -3.552 -7.799 1.00 0.00 C ATOM 1039 CG LEU A 71 10.979 -3.509 -9.026 1.00 0.00 C ATOM 1040 CD1 LEU A 71 9.923 -4.614 -8.963 1.00 0.00 C ATOM 1041 CD2 LEU A 71 10.350 -2.124 -9.193 1.00 0.00 C ATOM 0 H LEU A 71 10.747 -4.494 -5.664 1.00 0.00 H new ATOM 0 HA LEU A 71 12.132 -5.631 -8.019 1.00 0.00 H new ATOM 0 HB2 LEU A 71 11.471 -2.900 -7.034 1.00 0.00 H new ATOM 0 HB3 LEU A 71 12.860 -3.135 -8.076 1.00 0.00 H new ATOM 0 HG LEU A 71 11.587 -3.695 -9.911 1.00 0.00 H new ATOM 0 HD11 LEU A 71 9.287 -4.561 -9.847 1.00 0.00 H new ATOM 0 HD12 LEU A 71 10.415 -5.586 -8.928 1.00 0.00 H new ATOM 0 HD13 LEU A 71 9.313 -4.484 -8.069 1.00 0.00 H new ATOM 0 HD21 LEU A 71 9.706 -2.121 -10.072 1.00 0.00 H new ATOM 0 HD22 LEU A 71 9.759 -1.884 -8.309 1.00 0.00 H new ATOM 0 HD23 LEU A 71 11.137 -1.380 -9.317 1.00 0.00 H new ATOM 1053 N LYS A 72 14.499 -5.324 -7.254 1.00 0.00 N ATOM 1054 CA LYS A 72 15.837 -5.480 -6.709 1.00 0.00 C ATOM 1055 C LYS A 72 16.581 -4.147 -6.809 1.00 0.00 C ATOM 1056 O LYS A 72 17.465 -3.863 -6.002 1.00 0.00 O ATOM 1057 CB LYS A 72 16.562 -6.641 -7.392 1.00 0.00 C ATOM 1058 CG LYS A 72 17.175 -7.588 -6.358 1.00 0.00 C ATOM 1059 CD LYS A 72 17.518 -8.940 -6.988 1.00 0.00 C ATOM 1060 CE LYS A 72 18.856 -9.465 -6.463 1.00 0.00 C ATOM 1061 NZ LYS A 72 18.688 -10.812 -5.872 1.00 0.00 N ATOM 0 H LYS A 72 14.437 -5.425 -8.267 1.00 0.00 H new ATOM 0 HA LYS A 72 15.790 -5.742 -5.652 1.00 0.00 H new ATOM 0 HB2 LYS A 72 15.863 -7.190 -8.024 1.00 0.00 H new ATOM 0 HB3 LYS A 72 17.344 -6.253 -8.044 1.00 0.00 H new ATOM 0 HG2 LYS A 72 18.075 -7.140 -5.938 1.00 0.00 H new ATOM 0 HG3 LYS A 72 16.477 -7.733 -5.534 1.00 0.00 H new ATOM 0 HD2 LYS A 72 16.729 -9.659 -6.767 1.00 0.00 H new ATOM 0 HD3 LYS A 72 17.563 -8.839 -8.072 1.00 0.00 H new ATOM 0 HE2 LYS A 72 19.582 -9.506 -7.275 1.00 0.00 H new ATOM 0 HE3 LYS A 72 19.254 -8.780 -5.714 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 19.605 -11.154 -5.521 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 18.011 -10.763 -5.084 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 18.329 -11.467 -6.596 1.00 0.00 H new ATOM 1075 N PHE A 73 16.197 -3.364 -7.806 1.00 0.00 N ATOM 1076 CA PHE A 73 16.817 -2.068 -8.022 1.00 0.00 C ATOM 1077 C PHE A 73 16.104 -1.297 -9.136 1.00 0.00 C ATOM 1078 O PHE A 73 15.800 -1.858 -10.187 1.00 0.00 O ATOM 1079 CB PHE A 73 18.264 -2.329 -8.445 1.00 0.00 C ATOM 1080 CG PHE A 73 18.991 -1.091 -8.973 1.00 0.00 C ATOM 1081 CD1 PHE A 73 19.420 -0.133 -8.109 1.00 0.00 C ATOM 1082 CD2 PHE A 73 19.209 -0.949 -10.308 1.00 0.00 C ATOM 1083 CE1 PHE A 73 20.095 1.016 -8.599 1.00 0.00 C ATOM 1084 CE2 PHE A 73 19.884 0.201 -10.799 1.00 0.00 C ATOM 1085 CZ PHE A 73 20.313 1.159 -9.934 1.00 0.00 C ATOM 0 H PHE A 73 15.464 -3.602 -8.474 1.00 0.00 H new ATOM 0 HA PHE A 73 16.760 -1.473 -7.111 1.00 0.00 H new ATOM 0 HB2 PHE A 73 18.815 -2.725 -7.592 1.00 0.00 H new ATOM 0 HB3 PHE A 73 18.273 -3.099 -9.216 1.00 0.00 H new ATOM 0 HD1 PHE A 73 19.247 -0.246 -7.049 1.00 0.00 H new ATOM 0 HD2 PHE A 73 18.869 -1.710 -10.995 1.00 0.00 H new ATOM 0 HE1 PHE A 73 20.435 1.776 -7.912 1.00 0.00 H new ATOM 0 HE2 PHE A 73 20.056 0.314 -11.859 1.00 0.00 H new ATOM 0 HZ PHE A 73 20.827 2.033 -10.307 1.00 0.00 H new ATOM 1095 N GLU A 74 15.859 -0.024 -8.866 1.00 0.00 N ATOM 1096 CA GLU A 74 15.187 0.829 -9.832 1.00 0.00 C ATOM 1097 C GLU A 74 16.149 1.899 -10.354 1.00 0.00 C ATOM 1098 O GLU A 74 17.297 1.973 -9.919 1.00 0.00 O ATOM 1099 CB GLU A 74 13.936 1.466 -9.225 1.00 0.00 C ATOM 1100 CG GLU A 74 12.705 1.190 -10.091 1.00 0.00 C ATOM 1101 CD GLU A 74 11.926 2.479 -10.364 1.00 0.00 C ATOM 1102 OE1 GLU A 74 12.592 3.530 -10.481 1.00 0.00 O ATOM 1103 OE2 GLU A 74 10.683 2.383 -10.448 1.00 0.00 O ATOM 0 H GLU A 74 16.113 0.438 -7.993 1.00 0.00 H new ATOM 0 HA GLU A 74 14.869 0.212 -10.672 1.00 0.00 H new ATOM 0 HB2 GLU A 74 13.774 1.073 -8.221 1.00 0.00 H new ATOM 0 HB3 GLU A 74 14.082 2.542 -9.127 1.00 0.00 H new ATOM 0 HG2 GLU A 74 13.013 0.740 -11.035 1.00 0.00 H new ATOM 0 HG3 GLU A 74 12.058 0.469 -9.591 1.00 0.00 H new ATOM 1110 N ASP A 75 15.644 2.702 -11.279 1.00 0.00 N ATOM 1111 CA ASP A 75 16.444 3.765 -11.865 1.00 0.00 C ATOM 1112 C ASP A 75 15.523 4.752 -12.585 1.00 0.00 C ATOM 1113 O ASP A 75 15.263 4.606 -13.779 1.00 0.00 O ATOM 1114 CB ASP A 75 17.434 3.208 -12.889 1.00 0.00 C ATOM 1115 CG ASP A 75 18.907 3.311 -12.488 1.00 0.00 C ATOM 1116 OD1 ASP A 75 19.224 4.256 -11.732 1.00 0.00 O ATOM 1117 OD2 ASP A 75 19.682 2.444 -12.945 1.00 0.00 O ATOM 0 H ASP A 75 14.691 2.638 -11.637 1.00 0.00 H new ATOM 0 HA ASP A 75 16.994 4.256 -11.062 1.00 0.00 H new ATOM 0 HB2 ASP A 75 17.195 2.160 -13.070 1.00 0.00 H new ATOM 0 HB3 ASP A 75 17.292 3.735 -13.833 1.00 0.00 H new ATOM 1122 N GLU A 76 15.056 5.735 -11.830 1.00 0.00 N ATOM 1123 CA GLU A 76 14.171 6.746 -12.382 1.00 0.00 C ATOM 1124 C GLU A 76 14.459 8.108 -11.747 1.00 0.00 C ATOM 1125 O GLU A 76 14.792 9.065 -12.445 1.00 0.00 O ATOM 1126 CB GLU A 76 12.704 6.353 -12.193 1.00 0.00 C ATOM 1127 CG GLU A 76 12.064 5.965 -13.528 1.00 0.00 C ATOM 1128 CD GLU A 76 11.608 7.205 -14.298 1.00 0.00 C ATOM 1129 OE1 GLU A 76 10.454 7.626 -14.064 1.00 0.00 O ATOM 1130 OE2 GLU A 76 12.422 7.704 -15.104 1.00 0.00 O ATOM 0 H GLU A 76 15.274 5.853 -10.841 1.00 0.00 H new ATOM 0 HA GLU A 76 14.359 6.819 -13.453 1.00 0.00 H new ATOM 0 HB2 GLU A 76 12.634 5.518 -11.496 1.00 0.00 H new ATOM 0 HB3 GLU A 76 12.155 7.184 -11.750 1.00 0.00 H new ATOM 0 HG2 GLU A 76 12.779 5.402 -14.128 1.00 0.00 H new ATOM 0 HG3 GLU A 76 11.212 5.309 -13.350 1.00 0.00 H new ATOM 1137 N GLU A 77 14.320 8.153 -10.430 1.00 0.00 N ATOM 1138 CA GLU A 77 14.562 9.381 -9.693 1.00 0.00 C ATOM 1139 C GLU A 77 15.514 9.121 -8.525 1.00 0.00 C ATOM 1140 O GLU A 77 15.838 7.972 -8.227 1.00 0.00 O ATOM 1141 CB GLU A 77 13.248 9.994 -9.204 1.00 0.00 C ATOM 1142 CG GLU A 77 12.606 9.123 -8.123 1.00 0.00 C ATOM 1143 CD GLU A 77 11.134 9.493 -7.923 1.00 0.00 C ATOM 1144 OE1 GLU A 77 10.893 10.624 -7.448 1.00 0.00 O ATOM 1145 OE2 GLU A 77 10.284 8.636 -8.249 1.00 0.00 O ATOM 0 H GLU A 77 14.043 7.358 -9.854 1.00 0.00 H new ATOM 0 HA GLU A 77 15.032 10.099 -10.365 1.00 0.00 H new ATOM 0 HB2 GLU A 77 13.433 10.993 -8.809 1.00 0.00 H new ATOM 0 HB3 GLU A 77 12.560 10.105 -10.042 1.00 0.00 H new ATOM 0 HG2 GLU A 77 12.686 8.072 -8.402 1.00 0.00 H new ATOM 0 HG3 GLU A 77 13.146 9.245 -7.184 1.00 0.00 H new ATOM 1152 N ALA A 78 15.936 10.207 -7.894 1.00 0.00 N ATOM 1153 CA ALA A 78 16.845 10.111 -6.764 1.00 0.00 C ATOM 1154 C ALA A 78 16.232 10.826 -5.559 1.00 0.00 C ATOM 1155 O ALA A 78 16.577 11.971 -5.271 1.00 0.00 O ATOM 1156 CB ALA A 78 18.207 10.688 -7.154 1.00 0.00 C ATOM 0 H ALA A 78 15.665 11.158 -8.144 1.00 0.00 H new ATOM 0 HA ALA A 78 17.000 9.069 -6.484 1.00 0.00 H new ATOM 0 HB1 ALA A 78 18.889 10.616 -6.307 1.00 0.00 H new ATOM 0 HB2 ALA A 78 18.613 10.126 -7.995 1.00 0.00 H new ATOM 0 HB3 ALA A 78 18.091 11.734 -7.439 1.00 0.00 H new ATOM 1162 N GLN A 79 15.333 10.122 -4.887 1.00 0.00 N ATOM 1163 CA GLN A 79 14.669 10.675 -3.720 1.00 0.00 C ATOM 1164 C GLN A 79 14.024 9.558 -2.897 1.00 0.00 C ATOM 1165 O GLN A 79 14.350 9.378 -1.724 1.00 0.00 O ATOM 1166 CB GLN A 79 13.633 11.726 -4.125 1.00 0.00 C ATOM 1167 CG GLN A 79 14.043 13.116 -3.636 1.00 0.00 C ATOM 1168 CD GLN A 79 12.899 14.118 -3.811 1.00 0.00 C ATOM 1169 OE1 GLN A 79 11.976 13.917 -4.583 1.00 0.00 O ATOM 1170 NE2 GLN A 79 13.011 15.205 -3.053 1.00 0.00 N ATOM 0 H GLN A 79 15.049 9.173 -5.129 1.00 0.00 H new ATOM 0 HA GLN A 79 15.417 11.170 -3.101 1.00 0.00 H new ATOM 0 HB2 GLN A 79 13.524 11.736 -5.210 1.00 0.00 H new ATOM 0 HB3 GLN A 79 12.660 11.462 -3.709 1.00 0.00 H new ATOM 0 HG2 GLN A 79 14.330 13.066 -2.586 1.00 0.00 H new ATOM 0 HG3 GLN A 79 14.918 13.457 -4.190 1.00 0.00 H new ATOM 0 HE21 GLN A 79 13.810 15.311 -2.428 1.00 0.00 H new ATOM 0 HE22 GLN A 79 12.298 15.933 -3.097 1.00 0.00 H new ATOM 1179 N ALA A 80 13.120 8.837 -3.543 1.00 0.00 N ATOM 1180 CA ALA A 80 12.426 7.742 -2.886 1.00 0.00 C ATOM 1181 C ALA A 80 12.951 6.412 -3.429 1.00 0.00 C ATOM 1182 O ALA A 80 12.424 5.886 -4.409 1.00 0.00 O ATOM 1183 CB ALA A 80 10.917 7.900 -3.087 1.00 0.00 C ATOM 0 H ALA A 80 12.852 8.990 -4.515 1.00 0.00 H new ATOM 0 HA ALA A 80 12.615 7.757 -1.813 1.00 0.00 H new ATOM 0 HB1 ALA A 80 10.396 7.079 -2.594 1.00 0.00 H new ATOM 0 HB2 ALA A 80 10.590 8.847 -2.657 1.00 0.00 H new ATOM 0 HB3 ALA A 80 10.689 7.887 -4.153 1.00 0.00 H new ATOM 1189 N VAL A 81 13.982 5.905 -2.770 1.00 0.00 N ATOM 1190 CA VAL A 81 14.584 4.646 -3.175 1.00 0.00 C ATOM 1191 C VAL A 81 15.325 4.034 -1.985 1.00 0.00 C ATOM 1192 O VAL A 81 15.897 4.754 -1.168 1.00 0.00 O ATOM 1193 CB VAL A 81 15.485 4.864 -4.392 1.00 0.00 C ATOM 1194 CG1 VAL A 81 16.719 5.689 -4.020 1.00 0.00 C ATOM 1195 CG2 VAL A 81 15.887 3.530 -5.023 1.00 0.00 C ATOM 0 H VAL A 81 14.416 6.343 -1.958 1.00 0.00 H new ATOM 0 HA VAL A 81 13.815 3.936 -3.480 1.00 0.00 H new ATOM 0 HB VAL A 81 14.917 5.427 -5.133 1.00 0.00 H new ATOM 0 HG11 VAL A 81 17.343 5.829 -4.903 1.00 0.00 H new ATOM 0 HG12 VAL A 81 16.406 6.661 -3.639 1.00 0.00 H new ATOM 0 HG13 VAL A 81 17.289 5.165 -3.253 1.00 0.00 H new ATOM 0 HG21 VAL A 81 16.527 3.714 -5.886 1.00 0.00 H new ATOM 0 HG22 VAL A 81 16.428 2.930 -4.291 1.00 0.00 H new ATOM 0 HG23 VAL A 81 14.993 2.994 -5.342 1.00 0.00 H new ATOM 1205 N TYR A 82 15.291 2.711 -1.924 1.00 0.00 N ATOM 1206 CA TYR A 82 15.953 1.994 -0.847 1.00 0.00 C ATOM 1207 C TYR A 82 15.608 2.606 0.512 1.00 0.00 C ATOM 1208 O TYR A 82 16.256 3.554 0.952 1.00 0.00 O ATOM 1209 CB TYR A 82 17.454 2.149 -1.097 1.00 0.00 C ATOM 1210 CG TYR A 82 18.322 1.856 0.128 1.00 0.00 C ATOM 1211 CD1 TYR A 82 18.142 0.686 0.837 1.00 0.00 C ATOM 1212 CD2 TYR A 82 19.285 2.761 0.524 1.00 0.00 C ATOM 1213 CE1 TYR A 82 18.960 0.410 1.990 1.00 0.00 C ATOM 1214 CE2 TYR A 82 20.103 2.485 1.677 1.00 0.00 C ATOM 1215 CZ TYR A 82 19.899 1.323 2.353 1.00 0.00 C ATOM 1216 OH TYR A 82 20.671 1.063 3.442 1.00 0.00 O ATOM 0 H TYR A 82 14.815 2.117 -2.603 1.00 0.00 H new ATOM 0 HA TYR A 82 15.638 0.951 -0.830 1.00 0.00 H new ATOM 0 HB2 TYR A 82 17.748 1.481 -1.906 1.00 0.00 H new ATOM 0 HB3 TYR A 82 17.653 3.166 -1.435 1.00 0.00 H new ATOM 0 HD1 TYR A 82 17.388 -0.023 0.528 1.00 0.00 H new ATOM 0 HD2 TYR A 82 19.426 3.677 -0.031 1.00 0.00 H new ATOM 0 HE1 TYR A 82 18.830 -0.502 2.553 1.00 0.00 H new ATOM 0 HE2 TYR A 82 20.861 3.185 1.997 1.00 0.00 H new ATOM 0 HH TYR A 82 21.299 1.802 3.582 1.00 0.00 H new ATOM 1226 N SER A 83 14.588 2.038 1.139 1.00 0.00 N ATOM 1227 CA SER A 83 14.150 2.516 2.439 1.00 0.00 C ATOM 1228 C SER A 83 13.617 3.946 2.319 1.00 0.00 C ATOM 1229 O SER A 83 14.364 4.864 1.985 1.00 0.00 O ATOM 1230 CB SER A 83 15.288 2.459 3.460 1.00 0.00 C ATOM 1231 OG SER A 83 15.129 1.379 4.376 1.00 0.00 O ATOM 0 H SER A 83 14.053 1.252 0.771 1.00 0.00 H new ATOM 0 HA SER A 83 13.350 1.864 2.790 1.00 0.00 H new ATOM 0 HB2 SER A 83 16.239 2.354 2.938 1.00 0.00 H new ATOM 0 HB3 SER A 83 15.328 3.399 4.011 1.00 0.00 H new ATOM 0 HG SER A 83 15.876 1.375 5.010 1.00 0.00 H new ATOM 1237 N GLY A 84 12.330 4.089 2.598 1.00 0.00 N ATOM 1238 CA GLY A 84 11.688 5.390 2.525 1.00 0.00 C ATOM 1239 C GLY A 84 11.930 6.193 3.805 1.00 0.00 C ATOM 1240 O GLY A 84 12.586 5.713 4.728 1.00 0.00 O ATOM 0 H GLY A 84 11.714 3.325 2.875 1.00 0.00 H new ATOM 0 HA2 GLY A 84 12.072 5.942 1.667 1.00 0.00 H new ATOM 0 HA3 GLY A 84 10.617 5.263 2.368 1.00 0.00 H new ATOM 1244 N PRO A 85 11.371 7.433 3.820 1.00 0.00 N ATOM 1245 CA PRO A 85 11.519 8.306 4.972 1.00 0.00 C ATOM 1246 C PRO A 85 10.622 7.851 6.125 1.00 0.00 C ATOM 1247 O PRO A 85 9.398 7.857 6.003 1.00 0.00 O ATOM 1248 CB PRO A 85 11.169 9.694 4.460 1.00 0.00 C ATOM 1249 CG PRO A 85 10.394 9.480 3.171 1.00 0.00 C ATOM 1250 CD PRO A 85 10.587 8.034 2.745 1.00 0.00 C ATOM 0 HA PRO A 85 12.528 8.290 5.385 1.00 0.00 H new ATOM 0 HB2 PRO A 85 10.570 10.240 5.189 1.00 0.00 H new ATOM 0 HB3 PRO A 85 12.069 10.283 4.281 1.00 0.00 H new ATOM 0 HG2 PRO A 85 9.336 9.696 3.321 1.00 0.00 H new ATOM 0 HG3 PRO A 85 10.750 10.157 2.395 1.00 0.00 H new ATOM 0 HD2 PRO A 85 9.630 7.527 2.621 1.00 0.00 H new ATOM 0 HD3 PRO A 85 11.109 7.969 1.790 1.00 0.00 H new ATOM 1258 N SER A 86 11.266 7.466 7.217 1.00 0.00 N ATOM 1259 CA SER A 86 10.541 7.008 8.390 1.00 0.00 C ATOM 1260 C SER A 86 9.501 8.051 8.803 1.00 0.00 C ATOM 1261 O SER A 86 9.850 9.181 9.142 1.00 0.00 O ATOM 1262 CB SER A 86 11.497 6.723 9.551 1.00 0.00 C ATOM 1263 OG SER A 86 11.977 7.921 10.154 1.00 0.00 O ATOM 0 H SER A 86 12.281 7.462 7.314 1.00 0.00 H new ATOM 0 HA SER A 86 10.032 6.078 8.136 1.00 0.00 H new ATOM 0 HB2 SER A 86 10.986 6.119 10.301 1.00 0.00 H new ATOM 0 HB3 SER A 86 12.341 6.136 9.190 1.00 0.00 H new ATOM 0 HG SER A 86 11.416 8.675 9.875 1.00 0.00 H new ATOM 1269 N SER A 87 8.244 7.635 8.762 1.00 0.00 N ATOM 1270 CA SER A 87 7.151 8.519 9.128 1.00 0.00 C ATOM 1271 C SER A 87 6.901 8.447 10.636 1.00 0.00 C ATOM 1272 O SER A 87 7.036 7.385 11.241 1.00 0.00 O ATOM 1273 CB SER A 87 5.875 8.164 8.362 1.00 0.00 C ATOM 1274 OG SER A 87 5.635 9.060 7.280 1.00 0.00 O ATOM 0 H SER A 87 7.958 6.697 8.481 1.00 0.00 H new ATOM 0 HA SER A 87 7.432 9.538 8.861 1.00 0.00 H new ATOM 0 HB2 SER A 87 5.953 7.146 7.979 1.00 0.00 H new ATOM 0 HB3 SER A 87 5.025 8.184 9.044 1.00 0.00 H new ATOM 0 HG SER A 87 4.813 8.799 6.815 1.00 0.00 H new ATOM 1280 N GLY A 88 6.543 9.592 11.199 1.00 0.00 N ATOM 1281 CA GLY A 88 6.274 9.672 12.625 1.00 0.00 C ATOM 1282 C GLY A 88 5.413 10.893 12.952 1.00 0.00 C ATOM 1283 O GLY A 88 5.919 11.899 13.449 1.00 0.00 O ATOM 0 H GLY A 88 6.433 10.471 10.694 1.00 0.00 H new ATOM 0 HA2 GLY A 88 5.766 8.766 12.954 1.00 0.00 H new ATOM 0 HA3 GLY A 88 7.214 9.728 13.174 1.00 0.00 H new TER 1287 GLY A 88