USER MOD reduce.3.24.130724 H: found=0, std=0, add=779, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 773 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 2:sc= 1.72 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 31:sc= 0.288 USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 HIS : no HD1:sc= -0.23 K(o=-0.23,f=-1.4) USER MOD Single : A 18 SER OG : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 24 ASN : amide:sc=-0.00601 X(o=-0.006,f=0) USER MOD Single : A 31 SER OG : rot 180:sc= 0 USER MOD Single : A 34 ASN : amide:sc=-0.00489 X(o=-0.0049,f=0) USER MOD Single : A 35 HIS : no HD1:sc= -0.0614 K(o=-0.061,f=-0.57) USER MOD Single : A 38 SER OG : rot 180:sc= 0.135 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 46 SER OG : rot -30:sc= 0.653 USER MOD Single : A 47 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 61 GLN : amide:sc= -0.246 X(o=-0.25,f=0) USER MOD Single : A 63 HIS : no HD1:sc= -3.26! C(o=-3.3!,f=-2.5!) USER MOD Single : A 70 ASN : amide:sc= -1.75! K(o=-1.8!,f=-0.5) USER MOD Single : A 75 SER OG : rot -23:sc= 0.991 USER MOD Single : A 78 THR OG1 : rot -100:sc= -0.901 USER MOD Single : A 79 HIS : no HD1:sc= -2.32 K(o=-2.3,f=-1.5) USER MOD Single : A 81 GLN : amide:sc= -0.569 K(o=-0.57,f=-3.7!) USER MOD Single : A 87 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.101) USER MOD Single : A 88 THR OG1 : rot -73:sc= 0.0431 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 GLN : amide:sc= -6! K(o=-6!,f=-1.9) USER MOD Single : A 101 THR OG1 : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 106 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -16.720 -27.094 -7.862 1.00 0.00 N ATOM 2 CA GLY A 1 -17.622 -26.026 -7.467 1.00 0.00 C ATOM 3 C GLY A 1 -17.424 -25.657 -5.995 1.00 0.00 C ATOM 4 O GLY A 1 -18.200 -26.076 -5.138 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.874 -27.326 -8.864 1.00 0.00 H new ATOM 0 H2 GLY A 1 -15.736 -26.786 -7.725 1.00 0.00 H new ATOM 0 H3 GLY A 1 -16.903 -27.936 -7.280 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -17.449 -25.150 -8.092 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -18.654 -26.337 -7.632 1.00 0.00 H new ATOM 8 N SER A 2 -16.381 -24.878 -5.748 1.00 0.00 N ATOM 9 CA SER A 2 -16.072 -24.449 -4.395 1.00 0.00 C ATOM 10 C SER A 2 -15.583 -22.999 -4.405 1.00 0.00 C ATOM 11 O SER A 2 -14.392 -22.743 -4.570 1.00 0.00 O ATOM 12 CB SER A 2 -15.022 -25.359 -3.755 1.00 0.00 C ATOM 13 OG SER A 2 -15.320 -25.642 -2.391 1.00 0.00 O ATOM 0 H SER A 2 -15.739 -24.533 -6.462 1.00 0.00 H new ATOM 0 HA SER A 2 -16.982 -24.515 -3.799 1.00 0.00 H new ATOM 0 HB2 SER A 2 -14.962 -26.293 -4.314 1.00 0.00 H new ATOM 0 HB3 SER A 2 -14.043 -24.885 -3.821 1.00 0.00 H new ATOM 0 HG SER A 2 -14.627 -26.227 -2.019 1.00 0.00 H new ATOM 19 N SER A 3 -16.529 -22.089 -4.225 1.00 0.00 N ATOM 20 CA SER A 3 -16.209 -20.671 -4.211 1.00 0.00 C ATOM 21 C SER A 3 -16.075 -20.179 -2.769 1.00 0.00 C ATOM 22 O SER A 3 -16.653 -20.764 -1.853 1.00 0.00 O ATOM 23 CB SER A 3 -17.274 -19.859 -4.951 1.00 0.00 C ATOM 24 OG SER A 3 -16.704 -19.010 -5.943 1.00 0.00 O ATOM 0 H SER A 3 -17.516 -22.305 -4.088 1.00 0.00 H new ATOM 0 HA SER A 3 -15.259 -20.530 -4.726 1.00 0.00 H new ATOM 0 HB2 SER A 3 -17.986 -20.538 -5.420 1.00 0.00 H new ATOM 0 HB3 SER A 3 -17.833 -19.256 -4.235 1.00 0.00 H new ATOM 0 HG SER A 3 -17.416 -18.510 -6.394 1.00 0.00 H new ATOM 30 N GLY A 4 -15.309 -19.110 -2.611 1.00 0.00 N ATOM 31 CA GLY A 4 -15.091 -18.533 -1.295 1.00 0.00 C ATOM 32 C GLY A 4 -14.178 -17.308 -1.378 1.00 0.00 C ATOM 33 O GLY A 4 -13.668 -16.981 -2.448 1.00 0.00 O ATOM 0 H GLY A 4 -14.831 -18.628 -3.372 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -16.047 -18.249 -0.855 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -14.646 -19.279 -0.636 1.00 0.00 H new ATOM 37 N SER A 5 -13.999 -16.664 -0.234 1.00 0.00 N ATOM 38 CA SER A 5 -13.157 -15.483 -0.163 1.00 0.00 C ATOM 39 C SER A 5 -13.678 -14.410 -1.121 1.00 0.00 C ATOM 40 O SER A 5 -13.605 -14.572 -2.339 1.00 0.00 O ATOM 41 CB SER A 5 -11.701 -15.824 -0.490 1.00 0.00 C ATOM 42 OG SER A 5 -11.503 -16.038 -1.885 1.00 0.00 O ATOM 0 H SER A 5 -14.423 -16.939 0.652 1.00 0.00 H new ATOM 0 HA SER A 5 -13.192 -15.099 0.857 1.00 0.00 H new ATOM 0 HB2 SER A 5 -11.054 -15.014 -0.152 1.00 0.00 H new ATOM 0 HB3 SER A 5 -11.406 -16.718 0.059 1.00 0.00 H new ATOM 0 HG SER A 5 -12.348 -15.897 -2.361 1.00 0.00 H new ATOM 48 N SER A 6 -14.193 -13.339 -0.536 1.00 0.00 N ATOM 49 CA SER A 6 -14.726 -12.240 -1.323 1.00 0.00 C ATOM 50 C SER A 6 -14.639 -10.936 -0.527 1.00 0.00 C ATOM 51 O SER A 6 -15.537 -10.617 0.249 1.00 0.00 O ATOM 52 CB SER A 6 -16.173 -12.512 -1.738 1.00 0.00 C ATOM 53 OG SER A 6 -16.565 -11.721 -2.857 1.00 0.00 O ATOM 0 H SER A 6 -14.253 -13.209 0.474 1.00 0.00 H new ATOM 0 HA SER A 6 -14.127 -12.146 -2.229 1.00 0.00 H new ATOM 0 HB2 SER A 6 -16.288 -13.568 -1.982 1.00 0.00 H new ATOM 0 HB3 SER A 6 -16.836 -12.305 -0.898 1.00 0.00 H new ATOM 0 HG SER A 6 -17.494 -11.925 -3.092 1.00 0.00 H new ATOM 59 N GLY A 7 -13.547 -10.217 -0.748 1.00 0.00 N ATOM 60 CA GLY A 7 -13.331 -8.955 -0.062 1.00 0.00 C ATOM 61 C GLY A 7 -13.402 -7.780 -1.039 1.00 0.00 C ATOM 62 O GLY A 7 -13.591 -7.976 -2.238 1.00 0.00 O ATOM 0 H GLY A 7 -12.803 -10.485 -1.392 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -14.081 -8.829 0.719 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -12.358 -8.966 0.429 1.00 0.00 H new ATOM 66 N LYS A 8 -13.246 -6.585 -0.489 1.00 0.00 N ATOM 67 CA LYS A 8 -13.290 -5.378 -1.297 1.00 0.00 C ATOM 68 C LYS A 8 -11.862 -4.907 -1.581 1.00 0.00 C ATOM 69 O LYS A 8 -10.967 -5.099 -0.759 1.00 0.00 O ATOM 70 CB LYS A 8 -14.166 -4.317 -0.629 1.00 0.00 C ATOM 71 CG LYS A 8 -15.617 -4.425 -1.104 1.00 0.00 C ATOM 72 CD LYS A 8 -16.462 -5.220 -0.107 1.00 0.00 C ATOM 73 CE LYS A 8 -17.758 -5.712 -0.756 1.00 0.00 C ATOM 74 NZ LYS A 8 -17.692 -7.169 -1.005 1.00 0.00 N ATOM 0 H LYS A 8 -13.089 -6.427 0.506 1.00 0.00 H new ATOM 0 HA LYS A 8 -13.757 -5.582 -2.261 1.00 0.00 H new ATOM 0 HB2 LYS A 8 -14.124 -4.435 0.454 1.00 0.00 H new ATOM 0 HB3 LYS A 8 -13.778 -3.324 -0.857 1.00 0.00 H new ATOM 0 HG2 LYS A 8 -16.038 -3.427 -1.229 1.00 0.00 H new ATOM 0 HG3 LYS A 8 -15.649 -4.909 -2.080 1.00 0.00 H new ATOM 0 HD2 LYS A 8 -15.890 -6.071 0.262 1.00 0.00 H new ATOM 0 HD3 LYS A 8 -16.697 -4.596 0.755 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -18.605 -5.486 -0.108 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -17.925 -5.184 -1.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -18.579 -7.486 -1.446 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -16.896 -7.377 -1.641 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -17.555 -7.669 -0.104 1.00 0.00 H new ATOM 88 N SER A 9 -11.694 -4.299 -2.746 1.00 0.00 N ATOM 89 CA SER A 9 -10.390 -3.799 -3.148 1.00 0.00 C ATOM 90 C SER A 9 -10.491 -2.320 -3.525 1.00 0.00 C ATOM 91 O SER A 9 -11.256 -1.953 -4.415 1.00 0.00 O ATOM 92 CB SER A 9 -9.827 -4.608 -4.318 1.00 0.00 C ATOM 93 OG SER A 9 -10.651 -4.516 -5.477 1.00 0.00 O ATOM 0 H SER A 9 -12.439 -4.141 -3.425 1.00 0.00 H new ATOM 0 HA SER A 9 -9.707 -3.907 -2.305 1.00 0.00 H new ATOM 0 HB2 SER A 9 -8.825 -4.251 -4.556 1.00 0.00 H new ATOM 0 HB3 SER A 9 -9.731 -5.653 -4.023 1.00 0.00 H new ATOM 0 HG SER A 9 -11.093 -3.642 -5.495 1.00 0.00 H new ATOM 99 N LEU A 10 -9.707 -1.510 -2.829 1.00 0.00 N ATOM 100 CA LEU A 10 -9.698 -0.079 -3.079 1.00 0.00 C ATOM 101 C LEU A 10 -8.324 0.333 -3.612 1.00 0.00 C ATOM 102 O LEU A 10 -7.311 -0.265 -3.253 1.00 0.00 O ATOM 103 CB LEU A 10 -10.127 0.688 -1.826 1.00 0.00 C ATOM 104 CG LEU A 10 -10.977 -0.093 -0.821 1.00 0.00 C ATOM 105 CD1 LEU A 10 -12.211 -0.693 -1.496 1.00 0.00 C ATOM 106 CD2 LEU A 10 -10.141 -1.155 -0.105 1.00 0.00 C ATOM 0 H LEU A 10 -9.073 -1.818 -2.092 1.00 0.00 H new ATOM 0 HA LEU A 10 -10.428 0.177 -3.846 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -9.231 1.043 -1.316 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -10.687 1.570 -2.138 1.00 0.00 H new ATOM 0 HG LEU A 10 -11.333 0.603 -0.061 1.00 0.00 H new ATOM 0 HD11 LEU A 10 -12.797 -1.243 -0.760 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -12.818 0.106 -1.920 1.00 0.00 H new ATOM 0 HD13 LEU A 10 -11.898 -1.371 -2.290 1.00 0.00 H new ATOM 0 HD21 LEU A 10 -10.769 -1.696 0.603 1.00 0.00 H new ATOM 0 HD22 LEU A 10 -9.736 -1.853 -0.837 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -9.322 -0.674 0.430 1.00 0.00 H new ATOM 118 N THR A 11 -8.334 1.352 -4.459 1.00 0.00 N ATOM 119 CA THR A 11 -7.101 1.851 -5.044 1.00 0.00 C ATOM 120 C THR A 11 -6.658 3.135 -4.340 1.00 0.00 C ATOM 121 O THR A 11 -7.487 3.977 -3.998 1.00 0.00 O ATOM 122 CB THR A 11 -7.328 2.028 -6.546 1.00 0.00 C ATOM 123 OG1 THR A 11 -8.243 0.989 -6.884 1.00 0.00 O ATOM 124 CG2 THR A 11 -6.079 1.708 -7.370 1.00 0.00 C ATOM 0 H THR A 11 -9.176 1.846 -4.754 1.00 0.00 H new ATOM 0 HA THR A 11 -6.283 1.144 -4.906 1.00 0.00 H new ATOM 0 HB THR A 11 -7.642 3.052 -6.747 1.00 0.00 H new ATOM 0 HG1 THR A 11 -8.446 1.031 -7.842 1.00 0.00 H new ATOM 0 HG21 THR A 11 -6.295 1.850 -8.429 1.00 0.00 H new ATOM 0 HG22 THR A 11 -5.267 2.372 -7.073 1.00 0.00 H new ATOM 0 HG23 THR A 11 -5.783 0.673 -7.196 1.00 0.00 H new ATOM 132 N LEU A 12 -5.352 3.245 -4.145 1.00 0.00 N ATOM 133 CA LEU A 12 -4.789 4.412 -3.488 1.00 0.00 C ATOM 134 C LEU A 12 -3.509 4.832 -4.214 1.00 0.00 C ATOM 135 O LEU A 12 -2.676 3.991 -4.548 1.00 0.00 O ATOM 136 CB LEU A 12 -4.590 4.143 -1.995 1.00 0.00 C ATOM 137 CG LEU A 12 -5.017 2.760 -1.500 1.00 0.00 C ATOM 138 CD1 LEU A 12 -3.843 1.780 -1.531 1.00 0.00 C ATOM 139 CD2 LEU A 12 -5.654 2.848 -0.112 1.00 0.00 C ATOM 0 H LEU A 12 -4.668 2.545 -4.431 1.00 0.00 H new ATOM 0 HA LEU A 12 -5.480 5.253 -3.547 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -3.535 4.282 -1.759 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -5.144 4.895 -1.434 1.00 0.00 H new ATOM 0 HG LEU A 12 -5.777 2.373 -2.179 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -4.174 0.805 -1.174 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -3.474 1.687 -2.552 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -3.044 2.149 -0.889 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -5.949 1.851 0.217 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -4.934 3.265 0.593 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -6.533 3.491 -0.155 1.00 0.00 H new ATOM 151 N VAL A 13 -3.393 6.133 -4.435 1.00 0.00 N ATOM 152 CA VAL A 13 -2.228 6.675 -5.115 1.00 0.00 C ATOM 153 C VAL A 13 -1.255 7.241 -4.078 1.00 0.00 C ATOM 154 O VAL A 13 -1.589 8.177 -3.354 1.00 0.00 O ATOM 155 CB VAL A 13 -2.664 7.711 -6.154 1.00 0.00 C ATOM 156 CG1 VAL A 13 -2.599 9.126 -5.577 1.00 0.00 C ATOM 157 CG2 VAL A 13 -1.822 7.598 -7.426 1.00 0.00 C ATOM 0 H VAL A 13 -4.086 6.828 -4.156 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.703 5.890 -5.659 1.00 0.00 H new ATOM 0 HB VAL A 13 -3.701 7.505 -6.419 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -2.914 9.843 -6.335 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -3.260 9.198 -4.713 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.577 9.347 -5.271 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -2.152 8.345 -8.148 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -0.773 7.766 -7.184 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.941 6.602 -7.854 1.00 0.00 H new ATOM 167 N LEU A 14 -0.071 6.648 -4.041 1.00 0.00 N ATOM 168 CA LEU A 14 0.953 7.081 -3.105 1.00 0.00 C ATOM 169 C LEU A 14 2.087 7.761 -3.875 1.00 0.00 C ATOM 170 O LEU A 14 2.286 7.493 -5.059 1.00 0.00 O ATOM 171 CB LEU A 14 1.415 5.909 -2.237 1.00 0.00 C ATOM 172 CG LEU A 14 0.309 5.099 -1.560 1.00 0.00 C ATOM 173 CD1 LEU A 14 0.898 4.044 -0.621 1.00 0.00 C ATOM 174 CD2 LEU A 14 -0.682 6.017 -0.841 1.00 0.00 C ATOM 0 H LEU A 14 0.202 5.872 -4.644 1.00 0.00 H new ATOM 0 HA LEU A 14 0.549 7.820 -2.413 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.005 5.234 -2.857 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.080 6.295 -1.464 1.00 0.00 H new ATOM 0 HG LEU A 14 -0.247 4.568 -2.333 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.090 3.482 -0.152 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.531 3.363 -1.190 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.493 4.534 0.149 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -1.458 5.415 -0.368 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.157 6.595 -0.080 1.00 0.00 H new ATOM 0 HD23 LEU A 14 -1.138 6.696 -1.562 1.00 0.00 H new ATOM 186 N HIS A 15 2.801 8.627 -3.171 1.00 0.00 N ATOM 187 CA HIS A 15 3.910 9.347 -3.774 1.00 0.00 C ATOM 188 C HIS A 15 5.169 9.152 -2.927 1.00 0.00 C ATOM 189 O HIS A 15 5.179 8.344 -2.000 1.00 0.00 O ATOM 190 CB HIS A 15 3.554 10.822 -3.976 1.00 0.00 C ATOM 191 CG HIS A 15 2.305 11.046 -4.794 1.00 0.00 C ATOM 192 ND1 HIS A 15 2.338 11.429 -6.123 1.00 0.00 N ATOM 193 CD2 HIS A 15 0.988 10.936 -4.457 1.00 0.00 C ATOM 194 CE1 HIS A 15 1.091 11.543 -6.557 1.00 0.00 C ATOM 195 NE2 HIS A 15 0.256 11.237 -5.523 1.00 0.00 N ATOM 0 H HIS A 15 2.633 8.846 -2.189 1.00 0.00 H new ATOM 0 HA HIS A 15 4.115 8.943 -4.766 1.00 0.00 H new ATOM 0 HB2 HIS A 15 3.426 11.291 -3.000 1.00 0.00 H new ATOM 0 HB3 HIS A 15 4.390 11.323 -4.464 1.00 0.00 H new ATOM 0 HD2 HIS A 15 0.606 10.652 -3.488 1.00 0.00 H new ATOM 0 HE1 HIS A 15 0.789 11.828 -7.554 1.00 0.00 H new ATOM 0 HE2 HIS A 15 -0.763 11.239 -5.562 1.00 0.00 H new ATOM 203 N ARG A 16 6.202 9.905 -3.278 1.00 0.00 N ATOM 204 CA ARG A 16 7.464 9.824 -2.562 1.00 0.00 C ATOM 205 C ARG A 16 7.815 11.183 -1.952 1.00 0.00 C ATOM 206 O ARG A 16 8.146 12.124 -2.672 1.00 0.00 O ATOM 207 CB ARG A 16 8.596 9.381 -3.490 1.00 0.00 C ATOM 208 CG ARG A 16 8.700 7.856 -3.540 1.00 0.00 C ATOM 209 CD ARG A 16 10.144 7.397 -3.330 1.00 0.00 C ATOM 210 NE ARG A 16 10.164 6.044 -2.730 1.00 0.00 N ATOM 211 CZ ARG A 16 11.230 5.508 -2.121 1.00 0.00 C ATOM 212 NH1 ARG A 16 12.370 6.206 -2.028 1.00 0.00 N ATOM 213 NH2 ARG A 16 11.156 4.273 -1.606 1.00 0.00 N ATOM 0 H ARG A 16 6.191 10.574 -4.048 1.00 0.00 H new ATOM 0 HA ARG A 16 7.350 9.084 -1.769 1.00 0.00 H new ATOM 0 HB2 ARG A 16 8.422 9.770 -4.493 1.00 0.00 H new ATOM 0 HB3 ARG A 16 9.540 9.802 -3.144 1.00 0.00 H new ATOM 0 HG2 ARG A 16 8.061 7.419 -2.773 1.00 0.00 H new ATOM 0 HG3 ARG A 16 8.336 7.495 -4.502 1.00 0.00 H new ATOM 0 HD2 ARG A 16 10.674 7.389 -4.283 1.00 0.00 H new ATOM 0 HD3 ARG A 16 10.667 8.099 -2.681 1.00 0.00 H new ATOM 0 HE ARG A 16 9.313 5.485 -2.784 1.00 0.00 H new ATOM 0 HH11 ARG A 16 12.426 7.146 -2.421 1.00 0.00 H new ATOM 0 HH12 ARG A 16 13.182 5.798 -1.564 1.00 0.00 H new ATOM 0 HH21 ARG A 16 10.288 3.742 -1.678 1.00 0.00 H new ATOM 0 HH22 ARG A 16 11.967 3.864 -1.142 1.00 0.00 H new ATOM 227 N ASP A 17 7.732 11.241 -0.631 1.00 0.00 N ATOM 228 CA ASP A 17 8.038 12.469 0.084 1.00 0.00 C ATOM 229 C ASP A 17 9.440 12.367 0.688 1.00 0.00 C ATOM 230 O ASP A 17 9.594 11.996 1.851 1.00 0.00 O ATOM 231 CB ASP A 17 7.047 12.702 1.227 1.00 0.00 C ATOM 232 CG ASP A 17 7.556 13.608 2.349 1.00 0.00 C ATOM 233 OD1 ASP A 17 7.876 14.775 2.035 1.00 0.00 O ATOM 234 OD2 ASP A 17 7.613 13.114 3.496 1.00 0.00 O ATOM 0 H ASP A 17 7.458 10.458 -0.037 1.00 0.00 H new ATOM 0 HA ASP A 17 7.974 13.296 -0.623 1.00 0.00 H new ATOM 0 HB2 ASP A 17 6.136 13.136 0.815 1.00 0.00 H new ATOM 0 HB3 ASP A 17 6.775 11.737 1.655 1.00 0.00 H new ATOM 239 N SER A 18 10.427 12.703 -0.130 1.00 0.00 N ATOM 240 CA SER A 18 11.811 12.654 0.309 1.00 0.00 C ATOM 241 C SER A 18 12.137 11.264 0.861 1.00 0.00 C ATOM 242 O SER A 18 12.165 11.065 2.074 1.00 0.00 O ATOM 243 CB SER A 18 12.092 13.723 1.366 1.00 0.00 C ATOM 244 OG SER A 18 12.827 14.822 0.832 1.00 0.00 O ATOM 0 H SER A 18 10.296 13.010 -1.094 1.00 0.00 H new ATOM 0 HA SER A 18 12.449 12.855 -0.551 1.00 0.00 H new ATOM 0 HB2 SER A 18 11.149 14.083 1.777 1.00 0.00 H new ATOM 0 HB3 SER A 18 12.650 13.280 2.190 1.00 0.00 H new ATOM 0 HG SER A 18 12.985 15.484 1.537 1.00 0.00 H new ATOM 250 N GLY A 19 12.374 10.339 -0.057 1.00 0.00 N ATOM 251 CA GLY A 19 12.696 8.974 0.322 1.00 0.00 C ATOM 252 C GLY A 19 11.823 8.508 1.489 1.00 0.00 C ATOM 253 O GLY A 19 12.327 8.242 2.579 1.00 0.00 O ATOM 0 H GLY A 19 12.349 10.508 -1.063 1.00 0.00 H new ATOM 0 HA2 GLY A 19 12.551 8.312 -0.532 1.00 0.00 H new ATOM 0 HA3 GLY A 19 13.748 8.909 0.601 1.00 0.00 H new ATOM 257 N SER A 20 10.528 8.425 1.221 1.00 0.00 N ATOM 258 CA SER A 20 9.580 7.996 2.235 1.00 0.00 C ATOM 259 C SER A 20 8.166 7.968 1.651 1.00 0.00 C ATOM 260 O SER A 20 7.619 9.008 1.290 1.00 0.00 O ATOM 261 CB SER A 20 9.630 8.913 3.459 1.00 0.00 C ATOM 262 OG SER A 20 9.431 8.194 4.673 1.00 0.00 O ATOM 0 H SER A 20 10.113 8.648 0.316 1.00 0.00 H new ATOM 0 HA SER A 20 9.854 6.991 2.556 1.00 0.00 H new ATOM 0 HB2 SER A 20 10.594 9.421 3.492 1.00 0.00 H new ATOM 0 HB3 SER A 20 8.866 9.685 3.365 1.00 0.00 H new ATOM 0 HG SER A 20 9.472 8.814 5.431 1.00 0.00 H new ATOM 268 N LEU A 21 7.615 6.765 1.577 1.00 0.00 N ATOM 269 CA LEU A 21 6.275 6.588 1.043 1.00 0.00 C ATOM 270 C LEU A 21 5.264 7.242 1.987 1.00 0.00 C ATOM 271 O LEU A 21 4.190 7.662 1.557 1.00 0.00 O ATOM 272 CB LEU A 21 5.997 5.107 0.774 1.00 0.00 C ATOM 273 CG LEU A 21 6.474 4.570 -0.576 1.00 0.00 C ATOM 274 CD1 LEU A 21 5.754 5.270 -1.730 1.00 0.00 C ATOM 275 CD2 LEU A 21 7.995 4.675 -0.702 1.00 0.00 C ATOM 0 H LEU A 21 8.072 5.904 1.878 1.00 0.00 H new ATOM 0 HA LEU A 21 6.180 7.087 0.079 1.00 0.00 H new ATOM 0 HB2 LEU A 21 6.468 4.520 1.563 1.00 0.00 H new ATOM 0 HB3 LEU A 21 4.923 4.940 0.850 1.00 0.00 H new ATOM 0 HG LEU A 21 6.219 3.512 -0.632 1.00 0.00 H new ATOM 0 HD11 LEU A 21 6.112 4.869 -2.679 1.00 0.00 H new ATOM 0 HD12 LEU A 21 4.681 5.100 -1.646 1.00 0.00 H new ATOM 0 HD13 LEU A 21 5.956 6.340 -1.689 1.00 0.00 H new ATOM 0 HD21 LEU A 21 8.307 4.286 -1.671 1.00 0.00 H new ATOM 0 HD22 LEU A 21 8.296 5.719 -0.616 1.00 0.00 H new ATOM 0 HD23 LEU A 21 8.467 4.095 0.091 1.00 0.00 H new ATOM 287 N GLY A 22 5.642 7.308 3.255 1.00 0.00 N ATOM 288 CA GLY A 22 4.782 7.903 4.263 1.00 0.00 C ATOM 289 C GLY A 22 4.075 6.825 5.087 1.00 0.00 C ATOM 290 O GLY A 22 2.971 7.042 5.583 1.00 0.00 O ATOM 0 H GLY A 22 6.533 6.959 3.607 1.00 0.00 H new ATOM 0 HA2 GLY A 22 5.374 8.539 4.921 1.00 0.00 H new ATOM 0 HA3 GLY A 22 4.041 8.543 3.783 1.00 0.00 H new ATOM 294 N PHE A 23 4.742 5.687 5.209 1.00 0.00 N ATOM 295 CA PHE A 23 4.192 4.575 5.965 1.00 0.00 C ATOM 296 C PHE A 23 5.205 3.433 6.076 1.00 0.00 C ATOM 297 O PHE A 23 6.348 3.569 5.644 1.00 0.00 O ATOM 298 CB PHE A 23 2.964 4.078 5.200 1.00 0.00 C ATOM 299 CG PHE A 23 3.293 3.143 4.034 1.00 0.00 C ATOM 300 CD1 PHE A 23 4.267 3.478 3.147 1.00 0.00 C ATOM 301 CD2 PHE A 23 2.611 1.975 3.886 1.00 0.00 C ATOM 302 CE1 PHE A 23 4.573 2.610 2.066 1.00 0.00 C ATOM 303 CE2 PHE A 23 2.916 1.107 2.804 1.00 0.00 C ATOM 304 CZ PHE A 23 3.890 1.443 1.917 1.00 0.00 C ATOM 0 H PHE A 23 5.658 5.511 4.797 1.00 0.00 H new ATOM 0 HA PHE A 23 3.939 4.900 6.974 1.00 0.00 H new ATOM 0 HB2 PHE A 23 2.303 3.558 5.893 1.00 0.00 H new ATOM 0 HB3 PHE A 23 2.414 4.938 4.818 1.00 0.00 H new ATOM 0 HD1 PHE A 23 4.808 4.405 3.265 1.00 0.00 H new ATOM 0 HD2 PHE A 23 1.838 1.708 4.591 1.00 0.00 H new ATOM 0 HE1 PHE A 23 5.348 2.876 1.362 1.00 0.00 H new ATOM 0 HE2 PHE A 23 2.374 0.180 2.686 1.00 0.00 H new ATOM 0 HZ PHE A 23 4.122 0.783 1.094 1.00 0.00 H new ATOM 314 N ASN A 24 4.748 2.334 6.658 1.00 0.00 N ATOM 315 CA ASN A 24 5.600 1.170 6.832 1.00 0.00 C ATOM 316 C ASN A 24 4.789 -0.096 6.548 1.00 0.00 C ATOM 317 O ASN A 24 3.560 -0.064 6.547 1.00 0.00 O ATOM 318 CB ASN A 24 6.127 1.082 8.266 1.00 0.00 C ATOM 319 CG ASN A 24 7.656 1.034 8.286 1.00 0.00 C ATOM 320 OD1 ASN A 24 8.337 1.984 7.938 1.00 0.00 O ATOM 321 ND2 ASN A 24 8.155 -0.123 8.711 1.00 0.00 N ATOM 0 H ASN A 24 3.799 2.225 7.015 1.00 0.00 H new ATOM 0 HA ASN A 24 6.441 1.261 6.144 1.00 0.00 H new ATOM 0 HB2 ASN A 24 5.779 1.942 8.839 1.00 0.00 H new ATOM 0 HB3 ASN A 24 5.725 0.192 8.751 1.00 0.00 H new ATOM 0 HD21 ASN A 24 9.165 -0.255 8.760 1.00 0.00 H new ATOM 0 HD22 ASN A 24 7.528 -0.878 8.988 1.00 0.00 H new ATOM 328 N ILE A 25 5.511 -1.183 6.315 1.00 0.00 N ATOM 329 CA ILE A 25 4.875 -2.457 6.030 1.00 0.00 C ATOM 330 C ILE A 25 5.439 -3.525 6.970 1.00 0.00 C ATOM 331 O ILE A 25 6.520 -3.355 7.531 1.00 0.00 O ATOM 332 CB ILE A 25 5.015 -2.807 4.548 1.00 0.00 C ATOM 333 CG1 ILE A 25 6.360 -2.330 3.996 1.00 0.00 C ATOM 334 CG2 ILE A 25 3.837 -2.257 3.741 1.00 0.00 C ATOM 335 CD1 ILE A 25 6.649 -2.960 2.633 1.00 0.00 C ATOM 0 H ILE A 25 6.531 -1.207 6.318 1.00 0.00 H new ATOM 0 HA ILE A 25 3.803 -2.398 6.219 1.00 0.00 H new ATOM 0 HB ILE A 25 4.994 -3.892 4.450 1.00 0.00 H new ATOM 0 HG12 ILE A 25 6.355 -1.244 3.905 1.00 0.00 H new ATOM 0 HG13 ILE A 25 7.156 -2.587 4.695 1.00 0.00 H new ATOM 0 HG21 ILE A 25 3.961 -2.520 2.691 1.00 0.00 H new ATOM 0 HG22 ILE A 25 2.908 -2.686 4.115 1.00 0.00 H new ATOM 0 HG23 ILE A 25 3.802 -1.172 3.842 1.00 0.00 H new ATOM 0 HD11 ILE A 25 7.611 -2.604 2.264 1.00 0.00 H new ATOM 0 HD12 ILE A 25 6.678 -4.045 2.732 1.00 0.00 H new ATOM 0 HD13 ILE A 25 5.865 -2.681 1.929 1.00 0.00 H new ATOM 347 N ILE A 26 4.680 -4.602 7.113 1.00 0.00 N ATOM 348 CA ILE A 26 5.091 -5.697 7.975 1.00 0.00 C ATOM 349 C ILE A 26 5.064 -7.004 7.180 1.00 0.00 C ATOM 350 O ILE A 26 4.463 -7.071 6.109 1.00 0.00 O ATOM 351 CB ILE A 26 4.235 -5.731 9.243 1.00 0.00 C ATOM 352 CG1 ILE A 26 2.928 -6.489 9.002 1.00 0.00 C ATOM 353 CG2 ILE A 26 3.988 -4.318 9.776 1.00 0.00 C ATOM 354 CD1 ILE A 26 2.188 -6.739 10.318 1.00 0.00 C ATOM 0 H ILE A 26 3.783 -4.739 6.647 1.00 0.00 H new ATOM 0 HA ILE A 26 6.117 -5.551 8.314 1.00 0.00 H new ATOM 0 HB ILE A 26 4.785 -6.274 10.012 1.00 0.00 H new ATOM 0 HG12 ILE A 26 2.292 -5.918 8.326 1.00 0.00 H new ATOM 0 HG13 ILE A 26 3.140 -7.440 8.513 1.00 0.00 H new ATOM 0 HG21 ILE A 26 3.377 -4.371 10.677 1.00 0.00 H new ATOM 0 HG22 ILE A 26 4.942 -3.846 10.011 1.00 0.00 H new ATOM 0 HG23 ILE A 26 3.469 -3.729 9.020 1.00 0.00 H new ATOM 0 HD11 ILE A 26 1.263 -7.279 10.118 1.00 0.00 H new ATOM 0 HD12 ILE A 26 2.817 -7.331 10.983 1.00 0.00 H new ATOM 0 HD13 ILE A 26 1.956 -5.785 10.792 1.00 0.00 H new ATOM 366 N GLY A 27 5.723 -8.011 7.735 1.00 0.00 N ATOM 367 CA GLY A 27 5.783 -9.312 7.091 1.00 0.00 C ATOM 368 C GLY A 27 7.212 -9.645 6.660 1.00 0.00 C ATOM 369 O GLY A 27 8.173 -9.151 7.248 1.00 0.00 O ATOM 0 H GLY A 27 6.220 -7.952 8.624 1.00 0.00 H new ATOM 0 HA2 GLY A 27 5.418 -10.078 7.776 1.00 0.00 H new ATOM 0 HA3 GLY A 27 5.126 -9.322 6.222 1.00 0.00 H new ATOM 373 N GLY A 28 7.307 -10.481 5.636 1.00 0.00 N ATOM 374 CA GLY A 28 8.603 -10.886 5.119 1.00 0.00 C ATOM 375 C GLY A 28 9.354 -11.748 6.136 1.00 0.00 C ATOM 376 O GLY A 28 8.815 -12.733 6.639 1.00 0.00 O ATOM 0 H GLY A 28 6.508 -10.889 5.151 1.00 0.00 H new ATOM 0 HA2 GLY A 28 8.471 -11.443 4.192 1.00 0.00 H new ATOM 0 HA3 GLY A 28 9.195 -10.003 4.878 1.00 0.00 H new ATOM 380 N ARG A 29 10.587 -11.347 6.409 1.00 0.00 N ATOM 381 CA ARG A 29 11.418 -12.070 7.357 1.00 0.00 C ATOM 382 C ARG A 29 11.636 -13.508 6.882 1.00 0.00 C ATOM 383 O ARG A 29 10.918 -13.993 6.009 1.00 0.00 O ATOM 384 CB ARG A 29 10.777 -12.090 8.746 1.00 0.00 C ATOM 385 CG ARG A 29 11.660 -11.371 9.768 1.00 0.00 C ATOM 386 CD ARG A 29 11.089 -9.995 10.114 1.00 0.00 C ATOM 387 NE ARG A 29 11.285 -9.712 11.553 1.00 0.00 N ATOM 388 CZ ARG A 29 10.771 -10.457 12.542 1.00 0.00 C ATOM 389 NH1 ARG A 29 10.028 -11.534 12.252 1.00 0.00 N ATOM 390 NH2 ARG A 29 11.002 -10.126 13.819 1.00 0.00 N ATOM 0 H ARG A 29 11.031 -10.530 5.990 1.00 0.00 H new ATOM 0 HA ARG A 29 12.377 -11.555 7.419 1.00 0.00 H new ATOM 0 HB2 ARG A 29 9.798 -11.612 8.706 1.00 0.00 H new ATOM 0 HB3 ARG A 29 10.615 -13.121 9.061 1.00 0.00 H new ATOM 0 HG2 ARG A 29 11.740 -11.974 10.673 1.00 0.00 H new ATOM 0 HG3 ARG A 29 12.668 -11.260 9.369 1.00 0.00 H new ATOM 0 HD2 ARG A 29 11.579 -9.228 9.514 1.00 0.00 H new ATOM 0 HD3 ARG A 29 10.027 -9.961 9.870 1.00 0.00 H new ATOM 0 HE ARG A 29 11.846 -8.899 11.808 1.00 0.00 H new ATOM 0 HH11 ARG A 29 9.854 -11.787 11.279 1.00 0.00 H new ATOM 0 HH12 ARG A 29 9.637 -12.101 13.004 1.00 0.00 H new ATOM 0 HH21 ARG A 29 11.569 -9.307 14.039 1.00 0.00 H new ATOM 0 HH22 ARG A 29 10.611 -10.693 14.572 1.00 0.00 H new ATOM 404 N PRO A 30 12.657 -14.166 7.493 1.00 0.00 N ATOM 405 CA PRO A 30 12.979 -15.539 7.142 1.00 0.00 C ATOM 406 C PRO A 30 11.954 -16.510 7.731 1.00 0.00 C ATOM 407 O PRO A 30 11.222 -16.160 8.655 1.00 0.00 O ATOM 408 CB PRO A 30 14.385 -15.762 7.677 1.00 0.00 C ATOM 409 CG PRO A 30 14.617 -14.669 8.707 1.00 0.00 C ATOM 410 CD PRO A 30 13.529 -13.623 8.531 1.00 0.00 C ATOM 0 HA PRO A 30 12.943 -15.718 6.067 1.00 0.00 H new ATOM 0 HB2 PRO A 30 14.479 -16.750 8.128 1.00 0.00 H new ATOM 0 HB3 PRO A 30 15.121 -15.706 6.875 1.00 0.00 H new ATOM 0 HG2 PRO A 30 14.589 -15.083 9.715 1.00 0.00 H new ATOM 0 HG3 PRO A 30 15.602 -14.221 8.573 1.00 0.00 H new ATOM 0 HD2 PRO A 30 12.984 -13.459 9.460 1.00 0.00 H new ATOM 0 HD3 PRO A 30 13.948 -12.662 8.233 1.00 0.00 H new ATOM 418 N SER A 31 11.936 -17.711 7.172 1.00 0.00 N ATOM 419 CA SER A 31 11.013 -18.736 7.630 1.00 0.00 C ATOM 420 C SER A 31 11.606 -20.124 7.381 1.00 0.00 C ATOM 421 O SER A 31 11.619 -20.967 8.276 1.00 0.00 O ATOM 422 CB SER A 31 9.656 -18.606 6.934 1.00 0.00 C ATOM 423 OG SER A 31 8.575 -18.908 7.811 1.00 0.00 O ATOM 0 H SER A 31 12.546 -17.997 6.406 1.00 0.00 H new ATOM 0 HA SER A 31 10.857 -18.602 8.700 1.00 0.00 H new ATOM 0 HB2 SER A 31 9.540 -17.592 6.552 1.00 0.00 H new ATOM 0 HB3 SER A 31 9.624 -19.276 6.075 1.00 0.00 H new ATOM 0 HG SER A 31 7.727 -18.812 7.330 1.00 0.00 H new ATOM 429 N VAL A 32 12.084 -20.318 6.160 1.00 0.00 N ATOM 430 CA VAL A 32 12.678 -21.589 5.783 1.00 0.00 C ATOM 431 C VAL A 32 11.596 -22.671 5.780 1.00 0.00 C ATOM 432 O VAL A 32 11.135 -23.091 4.720 1.00 0.00 O ATOM 433 CB VAL A 32 13.849 -21.916 6.712 1.00 0.00 C ATOM 434 CG1 VAL A 32 14.571 -23.186 6.257 1.00 0.00 C ATOM 435 CG2 VAL A 32 14.819 -20.738 6.806 1.00 0.00 C ATOM 0 H VAL A 32 12.072 -19.616 5.420 1.00 0.00 H new ATOM 0 HA VAL A 32 13.087 -21.535 4.774 1.00 0.00 H new ATOM 0 HB VAL A 32 13.446 -22.098 7.708 1.00 0.00 H new ATOM 0 HG11 VAL A 32 15.399 -23.396 6.934 1.00 0.00 H new ATOM 0 HG12 VAL A 32 13.874 -24.024 6.265 1.00 0.00 H new ATOM 0 HG13 VAL A 32 14.955 -23.044 5.247 1.00 0.00 H new ATOM 0 HG21 VAL A 32 15.642 -20.997 7.472 1.00 0.00 H new ATOM 0 HG22 VAL A 32 15.212 -20.510 5.815 1.00 0.00 H new ATOM 0 HG23 VAL A 32 14.295 -19.866 7.198 1.00 0.00 H new ATOM 445 N ASP A 33 11.222 -23.093 6.980 1.00 0.00 N ATOM 446 CA ASP A 33 10.204 -24.118 7.129 1.00 0.00 C ATOM 447 C ASP A 33 9.077 -23.861 6.126 1.00 0.00 C ATOM 448 O ASP A 33 8.821 -22.717 5.754 1.00 0.00 O ATOM 449 CB ASP A 33 9.600 -24.094 8.534 1.00 0.00 C ATOM 450 CG ASP A 33 9.654 -25.426 9.284 1.00 0.00 C ATOM 451 OD1 ASP A 33 8.892 -26.333 8.886 1.00 0.00 O ATOM 452 OD2 ASP A 33 10.457 -25.508 10.239 1.00 0.00 O ATOM 0 H ASP A 33 11.606 -22.743 7.858 1.00 0.00 H new ATOM 0 HA ASP A 33 10.673 -25.086 6.954 1.00 0.00 H new ATOM 0 HB2 ASP A 33 10.121 -23.341 9.124 1.00 0.00 H new ATOM 0 HB3 ASP A 33 8.560 -23.778 8.460 1.00 0.00 H new ATOM 457 N ASN A 34 8.434 -24.945 5.717 1.00 0.00 N ATOM 458 CA ASN A 34 7.341 -24.852 4.764 1.00 0.00 C ATOM 459 C ASN A 34 7.906 -24.562 3.372 1.00 0.00 C ATOM 460 O ASN A 34 8.465 -23.492 3.136 1.00 0.00 O ATOM 461 CB ASN A 34 6.385 -23.715 5.132 1.00 0.00 C ATOM 462 CG ASN A 34 5.025 -23.902 4.457 1.00 0.00 C ATOM 463 OD1 ASN A 34 4.264 -24.800 4.774 1.00 0.00 O ATOM 464 ND2 ASN A 34 4.764 -23.005 3.510 1.00 0.00 N ATOM 0 H ASN A 34 8.649 -25.892 6.028 1.00 0.00 H new ATOM 0 HA ASN A 34 6.800 -25.798 4.779 1.00 0.00 H new ATOM 0 HB2 ASN A 34 6.256 -23.679 6.214 1.00 0.00 H new ATOM 0 HB3 ASN A 34 6.816 -22.760 4.831 1.00 0.00 H new ATOM 0 HD21 ASN A 34 3.882 -23.044 3.000 1.00 0.00 H new ATOM 0 HD22 ASN A 34 5.446 -22.278 3.294 1.00 0.00 H new ATOM 471 N HIS A 35 7.741 -25.535 2.488 1.00 0.00 N ATOM 472 CA HIS A 35 8.228 -25.398 1.126 1.00 0.00 C ATOM 473 C HIS A 35 7.053 -25.125 0.185 1.00 0.00 C ATOM 474 O HIS A 35 5.965 -25.669 0.371 1.00 0.00 O ATOM 475 CB HIS A 35 9.044 -26.625 0.714 1.00 0.00 C ATOM 476 CG HIS A 35 10.157 -26.972 1.674 1.00 0.00 C ATOM 477 ND1 HIS A 35 9.928 -27.543 2.914 1.00 0.00 N ATOM 478 CD2 HIS A 35 11.509 -26.825 1.562 1.00 0.00 C ATOM 479 CE1 HIS A 35 11.095 -27.725 3.513 1.00 0.00 C ATOM 480 NE2 HIS A 35 12.074 -27.279 2.674 1.00 0.00 N ATOM 0 H HIS A 35 7.277 -26.421 2.688 1.00 0.00 H new ATOM 0 HA HIS A 35 8.905 -24.546 1.063 1.00 0.00 H new ATOM 0 HB2 HIS A 35 8.375 -27.481 0.625 1.00 0.00 H new ATOM 0 HB3 HIS A 35 9.471 -26.450 -0.274 1.00 0.00 H new ATOM 0 HD2 HIS A 35 12.031 -26.410 0.713 1.00 0.00 H new ATOM 0 HE1 HIS A 35 11.245 -28.152 4.494 1.00 0.00 H new ATOM 0 HE2 HIS A 35 13.075 -27.292 2.869 1.00 0.00 H new ATOM 488 N ASP A 36 7.311 -24.282 -0.804 1.00 0.00 N ATOM 489 CA ASP A 36 6.288 -23.931 -1.774 1.00 0.00 C ATOM 490 C ASP A 36 6.872 -22.948 -2.791 1.00 0.00 C ATOM 491 O ASP A 36 7.717 -22.123 -2.448 1.00 0.00 O ATOM 492 CB ASP A 36 5.095 -23.255 -1.095 1.00 0.00 C ATOM 493 CG ASP A 36 3.787 -24.048 -1.148 1.00 0.00 C ATOM 494 OD1 ASP A 36 3.639 -24.835 -2.108 1.00 0.00 O ATOM 495 OD2 ASP A 36 2.966 -23.850 -0.227 1.00 0.00 O ATOM 0 H ASP A 36 8.214 -23.832 -0.954 1.00 0.00 H new ATOM 0 HA ASP A 36 5.955 -24.848 -2.260 1.00 0.00 H new ATOM 0 HB2 ASP A 36 5.348 -23.069 -0.051 1.00 0.00 H new ATOM 0 HB3 ASP A 36 4.933 -22.284 -1.562 1.00 0.00 H new ATOM 500 N GLY A 37 6.397 -23.068 -4.022 1.00 0.00 N ATOM 501 CA GLY A 37 6.861 -22.200 -5.091 1.00 0.00 C ATOM 502 C GLY A 37 5.728 -21.312 -5.608 1.00 0.00 C ATOM 503 O GLY A 37 5.231 -21.514 -6.714 1.00 0.00 O ATOM 0 H GLY A 37 5.696 -23.753 -4.303 1.00 0.00 H new ATOM 0 HA2 GLY A 37 7.679 -21.577 -4.729 1.00 0.00 H new ATOM 0 HA3 GLY A 37 7.257 -22.803 -5.908 1.00 0.00 H new ATOM 507 N SER A 38 5.352 -20.347 -4.781 1.00 0.00 N ATOM 508 CA SER A 38 4.287 -19.427 -5.140 1.00 0.00 C ATOM 509 C SER A 38 4.139 -18.351 -4.062 1.00 0.00 C ATOM 510 O SER A 38 4.454 -17.185 -4.297 1.00 0.00 O ATOM 511 CB SER A 38 2.962 -20.167 -5.335 1.00 0.00 C ATOM 512 OG SER A 38 2.627 -20.969 -4.206 1.00 0.00 O ATOM 0 H SER A 38 5.766 -20.183 -3.864 1.00 0.00 H new ATOM 0 HA SER A 38 4.550 -18.952 -6.085 1.00 0.00 H new ATOM 0 HB2 SER A 38 2.166 -19.444 -5.515 1.00 0.00 H new ATOM 0 HB3 SER A 38 3.026 -20.798 -6.222 1.00 0.00 H new ATOM 0 HG SER A 38 1.774 -21.423 -4.369 1.00 0.00 H new ATOM 518 N SER A 39 3.661 -18.780 -2.904 1.00 0.00 N ATOM 519 CA SER A 39 3.468 -17.868 -1.790 1.00 0.00 C ATOM 520 C SER A 39 4.715 -17.854 -0.903 1.00 0.00 C ATOM 521 O SER A 39 5.556 -18.746 -0.994 1.00 0.00 O ATOM 522 CB SER A 39 2.237 -18.255 -0.968 1.00 0.00 C ATOM 523 OG SER A 39 1.576 -17.114 -0.426 1.00 0.00 O ATOM 0 H SER A 39 3.401 -19.748 -2.713 1.00 0.00 H new ATOM 0 HA SER A 39 3.304 -16.868 -2.191 1.00 0.00 H new ATOM 0 HB2 SER A 39 1.542 -18.812 -1.596 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.537 -18.919 -0.157 1.00 0.00 H new ATOM 0 HG SER A 39 0.795 -17.403 0.090 1.00 0.00 H new ATOM 529 N SER A 40 4.795 -16.830 -0.065 1.00 0.00 N ATOM 530 CA SER A 40 5.925 -16.688 0.837 1.00 0.00 C ATOM 531 C SER A 40 5.479 -16.003 2.130 1.00 0.00 C ATOM 532 O SER A 40 5.344 -16.653 3.166 1.00 0.00 O ATOM 533 CB SER A 40 7.057 -15.896 0.180 1.00 0.00 C ATOM 534 OG SER A 40 8.322 -16.529 0.354 1.00 0.00 O ATOM 0 H SER A 40 4.096 -16.091 0.008 1.00 0.00 H new ATOM 0 HA SER A 40 6.303 -17.683 1.072 1.00 0.00 H new ATOM 0 HB2 SER A 40 6.851 -15.784 -0.884 1.00 0.00 H new ATOM 0 HB3 SER A 40 7.092 -14.893 0.605 1.00 0.00 H new ATOM 0 HG SER A 40 9.018 -15.994 -0.081 1.00 0.00 H new ATOM 540 N GLU A 41 5.262 -14.700 2.028 1.00 0.00 N ATOM 541 CA GLU A 41 4.834 -13.921 3.178 1.00 0.00 C ATOM 542 C GLU A 41 3.668 -13.008 2.795 1.00 0.00 C ATOM 543 O GLU A 41 3.161 -13.078 1.676 1.00 0.00 O ATOM 544 CB GLU A 41 5.997 -13.112 3.755 1.00 0.00 C ATOM 545 CG GLU A 41 7.151 -14.028 4.169 1.00 0.00 C ATOM 546 CD GLU A 41 6.899 -14.636 5.550 1.00 0.00 C ATOM 547 OE1 GLU A 41 5.999 -14.116 6.244 1.00 0.00 O ATOM 548 OE2 GLU A 41 7.613 -15.607 5.881 1.00 0.00 O ATOM 0 H GLU A 41 5.374 -14.164 1.167 1.00 0.00 H new ATOM 0 HA GLU A 41 4.493 -14.608 3.952 1.00 0.00 H new ATOM 0 HB2 GLU A 41 6.347 -12.393 3.015 1.00 0.00 H new ATOM 0 HB3 GLU A 41 5.654 -12.540 4.618 1.00 0.00 H new ATOM 0 HG2 GLU A 41 7.270 -14.824 3.434 1.00 0.00 H new ATOM 0 HG3 GLU A 41 8.083 -13.463 4.181 1.00 0.00 H new ATOM 555 N GLY A 42 3.275 -12.173 3.745 1.00 0.00 N ATOM 556 CA GLY A 42 2.177 -11.247 3.522 1.00 0.00 C ATOM 557 C GLY A 42 2.612 -9.805 3.792 1.00 0.00 C ATOM 558 O GLY A 42 3.292 -9.533 4.780 1.00 0.00 O ATOM 0 H GLY A 42 3.697 -12.118 4.672 1.00 0.00 H new ATOM 0 HA2 GLY A 42 1.823 -11.338 2.495 1.00 0.00 H new ATOM 0 HA3 GLY A 42 1.341 -11.506 4.171 1.00 0.00 H new ATOM 562 N ILE A 43 2.203 -8.919 2.896 1.00 0.00 N ATOM 563 CA ILE A 43 2.541 -7.512 3.025 1.00 0.00 C ATOM 564 C ILE A 43 1.341 -6.753 3.595 1.00 0.00 C ATOM 565 O ILE A 43 0.272 -6.731 2.987 1.00 0.00 O ATOM 566 CB ILE A 43 3.044 -6.957 1.691 1.00 0.00 C ATOM 567 CG1 ILE A 43 4.153 -7.838 1.114 1.00 0.00 C ATOM 568 CG2 ILE A 43 3.485 -5.500 1.835 1.00 0.00 C ATOM 569 CD1 ILE A 43 5.150 -8.248 2.200 1.00 0.00 C ATOM 0 H ILE A 43 1.640 -9.149 2.077 1.00 0.00 H new ATOM 0 HA ILE A 43 3.364 -7.381 3.728 1.00 0.00 H new ATOM 0 HB ILE A 43 2.218 -6.974 0.980 1.00 0.00 H new ATOM 0 HG12 ILE A 43 3.716 -8.728 0.662 1.00 0.00 H new ATOM 0 HG13 ILE A 43 4.674 -7.301 0.322 1.00 0.00 H new ATOM 0 HG21 ILE A 43 3.838 -5.130 0.872 1.00 0.00 H new ATOM 0 HG22 ILE A 43 2.641 -4.896 2.169 1.00 0.00 H new ATOM 0 HG23 ILE A 43 4.290 -5.434 2.567 1.00 0.00 H new ATOM 0 HD11 ILE A 43 5.928 -8.874 1.762 1.00 0.00 H new ATOM 0 HD12 ILE A 43 5.603 -7.356 2.634 1.00 0.00 H new ATOM 0 HD13 ILE A 43 4.631 -8.806 2.979 1.00 0.00 H new ATOM 581 N PHE A 44 1.558 -6.150 4.754 1.00 0.00 N ATOM 582 CA PHE A 44 0.508 -5.392 5.412 1.00 0.00 C ATOM 583 C PHE A 44 1.053 -4.082 5.984 1.00 0.00 C ATOM 584 O PHE A 44 2.253 -3.957 6.224 1.00 0.00 O ATOM 585 CB PHE A 44 -0.016 -6.258 6.560 1.00 0.00 C ATOM 586 CG PHE A 44 -0.793 -7.494 6.102 1.00 0.00 C ATOM 587 CD1 PHE A 44 -0.123 -8.589 5.652 1.00 0.00 C ATOM 588 CD2 PHE A 44 -2.152 -7.499 6.146 1.00 0.00 C ATOM 589 CE1 PHE A 44 -0.844 -9.737 5.228 1.00 0.00 C ATOM 590 CE2 PHE A 44 -2.872 -8.646 5.722 1.00 0.00 C ATOM 591 CZ PHE A 44 -2.203 -9.741 5.272 1.00 0.00 C ATOM 0 H PHE A 44 2.446 -6.171 5.255 1.00 0.00 H new ATOM 0 HA PHE A 44 -0.277 -5.146 4.697 1.00 0.00 H new ATOM 0 HB2 PHE A 44 0.826 -6.578 7.174 1.00 0.00 H new ATOM 0 HB3 PHE A 44 -0.661 -5.650 7.195 1.00 0.00 H new ATOM 0 HD1 PHE A 44 0.956 -8.585 5.617 1.00 0.00 H new ATOM 0 HD2 PHE A 44 -2.684 -6.630 6.504 1.00 0.00 H new ATOM 0 HE1 PHE A 44 -0.313 -10.607 4.871 1.00 0.00 H new ATOM 0 HE2 PHE A 44 -3.951 -8.649 5.757 1.00 0.00 H new ATOM 0 HZ PHE A 44 -2.751 -10.614 4.950 1.00 0.00 H new ATOM 601 N VAL A 45 0.145 -3.139 6.187 1.00 0.00 N ATOM 602 CA VAL A 45 0.520 -1.843 6.727 1.00 0.00 C ATOM 603 C VAL A 45 0.214 -1.812 8.226 1.00 0.00 C ATOM 604 O VAL A 45 -0.929 -2.013 8.634 1.00 0.00 O ATOM 605 CB VAL A 45 -0.185 -0.729 5.950 1.00 0.00 C ATOM 606 CG1 VAL A 45 0.110 0.640 6.566 1.00 0.00 C ATOM 607 CG2 VAL A 45 0.205 -0.761 4.471 1.00 0.00 C ATOM 0 H VAL A 45 -0.849 -3.246 5.987 1.00 0.00 H new ATOM 0 HA VAL A 45 1.591 -1.676 6.610 1.00 0.00 H new ATOM 0 HB VAL A 45 -1.259 -0.902 6.017 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -0.403 1.414 5.995 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -0.241 0.658 7.598 1.00 0.00 H new ATOM 0 HG13 VAL A 45 1.184 0.825 6.545 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -0.310 0.041 3.942 1.00 0.00 H new ATOM 0 HG22 VAL A 45 1.282 -0.626 4.376 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -0.079 -1.721 4.040 1.00 0.00 H new ATOM 617 N SER A 46 1.256 -1.559 9.004 1.00 0.00 N ATOM 618 CA SER A 46 1.113 -1.499 10.449 1.00 0.00 C ATOM 619 C SER A 46 1.432 -0.089 10.948 1.00 0.00 C ATOM 620 O SER A 46 1.339 0.186 12.144 1.00 0.00 O ATOM 621 CB SER A 46 2.020 -2.523 11.135 1.00 0.00 C ATOM 622 OG SER A 46 1.887 -2.488 12.553 1.00 0.00 O ATOM 0 H SER A 46 2.202 -1.393 8.661 1.00 0.00 H new ATOM 0 HA SER A 46 0.081 -1.742 10.701 1.00 0.00 H new ATOM 0 HB2 SER A 46 1.778 -3.522 10.773 1.00 0.00 H new ATOM 0 HB3 SER A 46 3.057 -2.328 10.863 1.00 0.00 H new ATOM 0 HG SER A 46 1.649 -1.581 12.837 1.00 0.00 H new ATOM 628 N LYS A 47 1.802 0.768 10.008 1.00 0.00 N ATOM 629 CA LYS A 47 2.135 2.143 10.337 1.00 0.00 C ATOM 630 C LYS A 47 1.829 3.040 9.136 1.00 0.00 C ATOM 631 O LYS A 47 1.817 2.575 7.997 1.00 0.00 O ATOM 632 CB LYS A 47 3.582 2.242 10.825 1.00 0.00 C ATOM 633 CG LYS A 47 3.726 3.319 11.902 1.00 0.00 C ATOM 634 CD LYS A 47 4.755 4.374 11.488 1.00 0.00 C ATOM 635 CE LYS A 47 5.039 5.343 12.638 1.00 0.00 C ATOM 636 NZ LYS A 47 6.492 5.419 12.905 1.00 0.00 N ATOM 0 H LYS A 47 1.879 0.536 9.018 1.00 0.00 H new ATOM 0 HA LYS A 47 1.519 2.496 11.164 1.00 0.00 H new ATOM 0 HB2 LYS A 47 3.902 1.279 11.224 1.00 0.00 H new ATOM 0 HB3 LYS A 47 4.238 2.473 9.985 1.00 0.00 H new ATOM 0 HG2 LYS A 47 2.761 3.795 12.076 1.00 0.00 H new ATOM 0 HG3 LYS A 47 4.029 2.859 12.843 1.00 0.00 H new ATOM 0 HD2 LYS A 47 5.680 3.885 11.183 1.00 0.00 H new ATOM 0 HD3 LYS A 47 4.387 4.927 10.624 1.00 0.00 H new ATOM 0 HE2 LYS A 47 4.657 6.333 12.390 1.00 0.00 H new ATOM 0 HE3 LYS A 47 4.515 5.015 13.536 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 6.667 6.081 13.688 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 6.847 4.476 13.163 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 6.985 5.754 12.052 1.00 0.00 H new ATOM 650 N ILE A 48 1.588 4.309 9.431 1.00 0.00 N ATOM 651 CA ILE A 48 1.282 5.274 8.389 1.00 0.00 C ATOM 652 C ILE A 48 1.644 6.678 8.879 1.00 0.00 C ATOM 653 O ILE A 48 1.440 7.003 10.048 1.00 0.00 O ATOM 654 CB ILE A 48 -0.174 5.136 7.941 1.00 0.00 C ATOM 655 CG1 ILE A 48 -0.404 3.800 7.230 1.00 0.00 C ATOM 656 CG2 ILE A 48 -0.597 6.325 7.076 1.00 0.00 C ATOM 657 CD1 ILE A 48 -1.726 3.809 6.461 1.00 0.00 C ATOM 0 H ILE A 48 1.598 4.691 10.377 1.00 0.00 H new ATOM 0 HA ILE A 48 1.884 5.080 7.501 1.00 0.00 H new ATOM 0 HB ILE A 48 -0.807 5.143 8.829 1.00 0.00 H new ATOM 0 HG12 ILE A 48 0.419 3.603 6.543 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -0.410 2.991 7.961 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -1.636 6.202 6.771 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -0.494 7.247 7.649 1.00 0.00 H new ATOM 0 HG23 ILE A 48 0.037 6.375 6.191 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -1.865 2.848 5.965 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -2.549 3.982 7.154 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -1.707 4.603 5.715 1.00 0.00 H new ATOM 669 N VAL A 49 2.174 7.472 7.961 1.00 0.00 N ATOM 670 CA VAL A 49 2.566 8.834 8.284 1.00 0.00 C ATOM 671 C VAL A 49 1.413 9.784 7.954 1.00 0.00 C ATOM 672 O VAL A 49 0.893 9.771 6.839 1.00 0.00 O ATOM 673 CB VAL A 49 3.863 9.192 7.557 1.00 0.00 C ATOM 674 CG1 VAL A 49 4.277 10.635 7.853 1.00 0.00 C ATOM 675 CG2 VAL A 49 4.983 8.215 7.919 1.00 0.00 C ATOM 0 H VAL A 49 2.341 7.199 6.993 1.00 0.00 H new ATOM 0 HA VAL A 49 2.771 8.930 9.350 1.00 0.00 H new ATOM 0 HB VAL A 49 3.680 9.109 6.486 1.00 0.00 H new ATOM 0 HG11 VAL A 49 5.202 10.864 7.324 1.00 0.00 H new ATOM 0 HG12 VAL A 49 3.492 11.314 7.521 1.00 0.00 H new ATOM 0 HG13 VAL A 49 4.433 10.756 8.925 1.00 0.00 H new ATOM 0 HG21 VAL A 49 5.894 8.493 7.388 1.00 0.00 H new ATOM 0 HG22 VAL A 49 5.164 8.251 8.993 1.00 0.00 H new ATOM 0 HG23 VAL A 49 4.691 7.204 7.634 1.00 0.00 H new ATOM 685 N ASP A 50 1.046 10.585 8.944 1.00 0.00 N ATOM 686 CA ASP A 50 -0.035 11.540 8.772 1.00 0.00 C ATOM 687 C ASP A 50 0.325 12.516 7.651 1.00 0.00 C ATOM 688 O ASP A 50 -0.288 12.496 6.585 1.00 0.00 O ATOM 689 CB ASP A 50 -0.263 12.350 10.050 1.00 0.00 C ATOM 690 CG ASP A 50 -1.725 12.481 10.481 1.00 0.00 C ATOM 691 OD1 ASP A 50 -2.279 11.452 10.925 1.00 0.00 O ATOM 692 OD2 ASP A 50 -2.255 13.606 10.357 1.00 0.00 O ATOM 0 H ASP A 50 1.478 10.592 9.868 1.00 0.00 H new ATOM 0 HA ASP A 50 -0.941 10.984 8.531 1.00 0.00 H new ATOM 0 HB2 ASP A 50 0.299 11.887 10.861 1.00 0.00 H new ATOM 0 HB3 ASP A 50 0.149 13.349 9.907 1.00 0.00 H new ATOM 697 N SER A 51 1.318 13.347 7.930 1.00 0.00 N ATOM 698 CA SER A 51 1.768 14.330 6.958 1.00 0.00 C ATOM 699 C SER A 51 2.259 13.626 5.691 1.00 0.00 C ATOM 700 O SER A 51 2.427 14.259 4.650 1.00 0.00 O ATOM 701 CB SER A 51 2.874 15.212 7.538 1.00 0.00 C ATOM 702 OG SER A 51 2.494 16.585 7.582 1.00 0.00 O ATOM 0 H SER A 51 1.824 13.360 8.815 1.00 0.00 H new ATOM 0 HA SER A 51 0.924 14.972 6.705 1.00 0.00 H new ATOM 0 HB2 SER A 51 3.119 14.871 8.544 1.00 0.00 H new ATOM 0 HB3 SER A 51 3.776 15.105 6.936 1.00 0.00 H new ATOM 0 HG SER A 51 3.226 17.115 7.960 1.00 0.00 H new ATOM 708 N GLY A 52 2.477 12.325 5.822 1.00 0.00 N ATOM 709 CA GLY A 52 2.946 11.529 4.701 1.00 0.00 C ATOM 710 C GLY A 52 1.911 11.505 3.574 1.00 0.00 C ATOM 711 O GLY A 52 0.723 11.716 3.812 1.00 0.00 O ATOM 0 H GLY A 52 2.337 11.803 6.687 1.00 0.00 H new ATOM 0 HA2 GLY A 52 3.885 11.937 4.328 1.00 0.00 H new ATOM 0 HA3 GLY A 52 3.151 10.511 5.033 1.00 0.00 H new ATOM 715 N PRO A 53 2.414 11.241 2.338 1.00 0.00 N ATOM 716 CA PRO A 53 1.547 11.187 1.173 1.00 0.00 C ATOM 717 C PRO A 53 0.731 9.893 1.156 1.00 0.00 C ATOM 718 O PRO A 53 -0.090 9.685 0.264 1.00 0.00 O ATOM 719 CB PRO A 53 2.481 11.316 -0.019 1.00 0.00 C ATOM 720 CG PRO A 53 3.868 10.970 0.499 1.00 0.00 C ATOM 721 CD PRO A 53 3.816 10.986 2.018 1.00 0.00 C ATOM 0 HA PRO A 53 0.802 11.983 1.166 1.00 0.00 H new ATOM 0 HB2 PRO A 53 2.185 10.641 -0.822 1.00 0.00 H new ATOM 0 HB3 PRO A 53 2.457 12.327 -0.426 1.00 0.00 H new ATOM 0 HG2 PRO A 53 4.176 9.989 0.138 1.00 0.00 H new ATOM 0 HG3 PRO A 53 4.602 11.689 0.135 1.00 0.00 H new ATOM 0 HD2 PRO A 53 4.151 10.037 2.436 1.00 0.00 H new ATOM 0 HD3 PRO A 53 4.463 11.761 2.428 1.00 0.00 H new ATOM 729 N ALA A 54 0.984 9.058 2.153 1.00 0.00 N ATOM 730 CA ALA A 54 0.283 7.791 2.264 1.00 0.00 C ATOM 731 C ALA A 54 -1.063 8.016 2.956 1.00 0.00 C ATOM 732 O ALA A 54 -2.068 7.416 2.578 1.00 0.00 O ATOM 733 CB ALA A 54 1.161 6.785 3.011 1.00 0.00 C ATOM 0 H ALA A 54 1.665 9.235 2.891 1.00 0.00 H new ATOM 0 HA ALA A 54 0.081 7.377 1.276 1.00 0.00 H new ATOM 0 HB1 ALA A 54 0.635 5.834 3.094 1.00 0.00 H new ATOM 0 HB2 ALA A 54 2.092 6.638 2.464 1.00 0.00 H new ATOM 0 HB3 ALA A 54 1.383 7.165 4.008 1.00 0.00 H new ATOM 739 N ALA A 55 -1.039 8.882 3.958 1.00 0.00 N ATOM 740 CA ALA A 55 -2.245 9.194 4.706 1.00 0.00 C ATOM 741 C ALA A 55 -2.928 10.412 4.080 1.00 0.00 C ATOM 742 O ALA A 55 -4.122 10.375 3.786 1.00 0.00 O ATOM 743 CB ALA A 55 -1.890 9.418 6.178 1.00 0.00 C ATOM 0 H ALA A 55 -0.204 9.377 4.269 1.00 0.00 H new ATOM 0 HA ALA A 55 -2.949 8.363 4.663 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -2.795 9.652 6.739 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -1.435 8.515 6.584 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.187 10.247 6.261 1.00 0.00 H new ATOM 749 N LYS A 56 -2.141 11.462 3.895 1.00 0.00 N ATOM 750 CA LYS A 56 -2.655 12.688 3.310 1.00 0.00 C ATOM 751 C LYS A 56 -3.588 12.341 2.147 1.00 0.00 C ATOM 752 O LYS A 56 -4.805 12.295 2.316 1.00 0.00 O ATOM 753 CB LYS A 56 -1.505 13.618 2.919 1.00 0.00 C ATOM 754 CG LYS A 56 -1.097 14.510 4.094 1.00 0.00 C ATOM 755 CD LYS A 56 -1.686 15.914 3.947 1.00 0.00 C ATOM 756 CE LYS A 56 -2.086 16.486 5.308 1.00 0.00 C ATOM 757 NZ LYS A 56 -2.187 17.961 5.242 1.00 0.00 N ATOM 0 H LYS A 56 -1.151 11.489 4.140 1.00 0.00 H new ATOM 0 HA LYS A 56 -3.247 13.240 4.040 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -0.649 13.027 2.592 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -1.805 14.238 2.074 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -1.438 14.065 5.029 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -0.010 14.572 4.148 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -0.956 16.570 3.473 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -2.557 15.880 3.293 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -3.041 16.064 5.620 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -1.351 16.199 6.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -2.459 18.332 6.174 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -1.267 18.360 4.966 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -2.906 18.229 4.539 1.00 0.00 H new ATOM 771 N GLU A 57 -2.980 12.107 0.993 1.00 0.00 N ATOM 772 CA GLU A 57 -3.741 11.765 -0.197 1.00 0.00 C ATOM 773 C GLU A 57 -3.676 10.259 -0.455 1.00 0.00 C ATOM 774 O GLU A 57 -4.615 9.676 -0.995 1.00 0.00 O ATOM 775 CB GLU A 57 -3.242 12.552 -1.411 1.00 0.00 C ATOM 776 CG GLU A 57 -3.476 14.052 -1.226 1.00 0.00 C ATOM 777 CD GLU A 57 -3.237 14.809 -2.534 1.00 0.00 C ATOM 778 OE1 GLU A 57 -2.049 14.972 -2.887 1.00 0.00 O ATOM 779 OE2 GLU A 57 -4.248 15.208 -3.151 1.00 0.00 O ATOM 0 H GLU A 57 -1.970 12.147 0.857 1.00 0.00 H new ATOM 0 HA GLU A 57 -4.783 12.040 -0.030 1.00 0.00 H new ATOM 0 HB2 GLU A 57 -2.179 12.362 -1.560 1.00 0.00 H new ATOM 0 HB3 GLU A 57 -3.756 12.208 -2.308 1.00 0.00 H new ATOM 0 HG2 GLU A 57 -4.496 14.225 -0.883 1.00 0.00 H new ATOM 0 HG3 GLU A 57 -2.810 14.435 -0.453 1.00 0.00 H new ATOM 786 N GLY A 58 -2.557 9.670 -0.056 1.00 0.00 N ATOM 787 CA GLY A 58 -2.357 8.243 -0.237 1.00 0.00 C ATOM 788 C GLY A 58 -3.683 7.486 -0.136 1.00 0.00 C ATOM 789 O GLY A 58 -4.108 6.841 -1.094 1.00 0.00 O ATOM 0 H GLY A 58 -1.780 10.156 0.392 1.00 0.00 H new ATOM 0 HA2 GLY A 58 -1.901 8.057 -1.209 1.00 0.00 H new ATOM 0 HA3 GLY A 58 -1.663 7.871 0.517 1.00 0.00 H new ATOM 793 N GLY A 59 -4.300 7.590 1.031 1.00 0.00 N ATOM 794 CA GLY A 59 -5.569 6.924 1.269 1.00 0.00 C ATOM 795 C GLY A 59 -5.368 5.625 2.052 1.00 0.00 C ATOM 796 O GLY A 59 -6.330 5.038 2.546 1.00 0.00 O ATOM 0 H GLY A 59 -3.945 8.126 1.823 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -6.234 7.587 1.822 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -6.054 6.708 0.317 1.00 0.00 H new ATOM 800 N LEU A 60 -4.112 5.214 2.141 1.00 0.00 N ATOM 801 CA LEU A 60 -3.772 3.995 2.856 1.00 0.00 C ATOM 802 C LEU A 60 -4.420 4.023 4.241 1.00 0.00 C ATOM 803 O LEU A 60 -4.984 5.039 4.646 1.00 0.00 O ATOM 804 CB LEU A 60 -2.255 3.799 2.890 1.00 0.00 C ATOM 805 CG LEU A 60 -1.767 2.351 2.977 1.00 0.00 C ATOM 806 CD1 LEU A 60 -2.522 1.458 1.990 1.00 0.00 C ATOM 807 CD2 LEU A 60 -0.252 2.271 2.780 1.00 0.00 C ATOM 0 H LEU A 60 -3.317 5.703 1.730 1.00 0.00 H new ATOM 0 HA LEU A 60 -4.171 3.124 2.335 1.00 0.00 H new ATOM 0 HB2 LEU A 60 -1.830 4.251 1.994 1.00 0.00 H new ATOM 0 HB3 LEU A 60 -1.857 4.348 3.744 1.00 0.00 H new ATOM 0 HG LEU A 60 -1.982 1.977 3.978 1.00 0.00 H new ATOM 0 HD11 LEU A 60 -2.156 0.435 2.072 1.00 0.00 H new ATOM 0 HD12 LEU A 60 -3.587 1.482 2.219 1.00 0.00 H new ATOM 0 HD13 LEU A 60 -2.361 1.821 0.975 1.00 0.00 H new ATOM 0 HD21 LEU A 60 0.069 1.232 2.846 1.00 0.00 H new ATOM 0 HD22 LEU A 60 0.009 2.669 1.800 1.00 0.00 H new ATOM 0 HD23 LEU A 60 0.247 2.855 3.553 1.00 0.00 H new ATOM 819 N GLN A 61 -4.319 2.896 4.930 1.00 0.00 N ATOM 820 CA GLN A 61 -4.888 2.779 6.262 1.00 0.00 C ATOM 821 C GLN A 61 -4.294 1.571 6.989 1.00 0.00 C ATOM 822 O GLN A 61 -4.334 0.454 6.477 1.00 0.00 O ATOM 823 CB GLN A 61 -6.414 2.686 6.200 1.00 0.00 C ATOM 824 CG GLN A 61 -7.060 3.504 7.320 1.00 0.00 C ATOM 825 CD GLN A 61 -8.352 2.844 7.806 1.00 0.00 C ATOM 826 OE1 GLN A 61 -8.572 2.646 8.989 1.00 0.00 O ATOM 827 NE2 GLN A 61 -9.192 2.516 6.828 1.00 0.00 N ATOM 0 H GLN A 61 -3.851 2.055 4.591 1.00 0.00 H new ATOM 0 HA GLN A 61 -4.634 3.677 6.824 1.00 0.00 H new ATOM 0 HB2 GLN A 61 -6.765 3.047 5.233 1.00 0.00 H new ATOM 0 HB3 GLN A 61 -6.722 1.644 6.282 1.00 0.00 H new ATOM 0 HG2 GLN A 61 -6.363 3.603 8.152 1.00 0.00 H new ATOM 0 HG3 GLN A 61 -7.274 4.511 6.963 1.00 0.00 H new ATOM 0 HE21 GLN A 61 -8.946 2.710 5.857 1.00 0.00 H new ATOM 0 HE22 GLN A 61 -10.083 2.070 7.049 1.00 0.00 H new ATOM 836 N ILE A 62 -3.758 1.837 8.171 1.00 0.00 N ATOM 837 CA ILE A 62 -3.157 0.786 8.974 1.00 0.00 C ATOM 838 C ILE A 62 -4.008 -0.481 8.867 1.00 0.00 C ATOM 839 O ILE A 62 -5.198 -0.410 8.564 1.00 0.00 O ATOM 840 CB ILE A 62 -2.944 1.264 10.411 1.00 0.00 C ATOM 841 CG1 ILE A 62 -2.253 2.629 10.438 1.00 0.00 C ATOM 842 CG2 ILE A 62 -2.183 0.220 11.230 1.00 0.00 C ATOM 843 CD1 ILE A 62 -1.392 2.783 11.694 1.00 0.00 C ATOM 0 H ILE A 62 -3.727 2.766 8.592 1.00 0.00 H new ATOM 0 HA ILE A 62 -2.165 0.538 8.596 1.00 0.00 H new ATOM 0 HB ILE A 62 -3.921 1.388 10.878 1.00 0.00 H new ATOM 0 HG12 ILE A 62 -1.631 2.743 9.550 1.00 0.00 H new ATOM 0 HG13 ILE A 62 -3.002 3.420 10.407 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -2.045 0.586 12.248 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -2.751 -0.710 11.252 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -1.209 0.039 10.775 1.00 0.00 H new ATOM 0 HD11 ILE A 62 -0.912 3.762 11.688 1.00 0.00 H new ATOM 0 HD12 ILE A 62 -2.021 2.692 12.580 1.00 0.00 H new ATOM 0 HD13 ILE A 62 -0.629 2.005 11.710 1.00 0.00 H new ATOM 855 N HIS A 63 -3.365 -1.611 9.122 1.00 0.00 N ATOM 856 CA HIS A 63 -4.048 -2.892 9.058 1.00 0.00 C ATOM 857 C HIS A 63 -4.646 -3.086 7.663 1.00 0.00 C ATOM 858 O HIS A 63 -5.819 -3.431 7.530 1.00 0.00 O ATOM 859 CB HIS A 63 -5.090 -3.008 10.172 1.00 0.00 C ATOM 860 CG HIS A 63 -4.619 -2.490 11.510 1.00 0.00 C ATOM 861 ND1 HIS A 63 -5.404 -1.689 12.322 1.00 0.00 N ATOM 862 CD2 HIS A 63 -3.438 -2.667 12.169 1.00 0.00 C ATOM 863 CE1 HIS A 63 -4.715 -1.403 13.417 1.00 0.00 C ATOM 864 NE2 HIS A 63 -3.497 -2.009 13.320 1.00 0.00 N ATOM 0 H HIS A 63 -2.378 -1.666 9.373 1.00 0.00 H new ATOM 0 HA HIS A 63 -3.333 -3.698 9.224 1.00 0.00 H new ATOM 0 HB2 HIS A 63 -5.985 -2.461 9.877 1.00 0.00 H new ATOM 0 HB3 HIS A 63 -5.377 -4.054 10.279 1.00 0.00 H new ATOM 0 HD2 HIS A 63 -2.597 -3.245 11.814 1.00 0.00 H new ATOM 0 HE1 HIS A 63 -5.058 -0.796 14.242 1.00 0.00 H new ATOM 0 HE2 HIS A 63 -2.754 -1.964 14.017 1.00 0.00 H new ATOM 872 N ASP A 64 -3.813 -2.855 6.659 1.00 0.00 N ATOM 873 CA ASP A 64 -4.245 -3.000 5.280 1.00 0.00 C ATOM 874 C ASP A 64 -3.215 -3.831 4.512 1.00 0.00 C ATOM 875 O ASP A 64 -2.015 -3.578 4.603 1.00 0.00 O ATOM 876 CB ASP A 64 -4.360 -1.638 4.593 1.00 0.00 C ATOM 877 CG ASP A 64 -5.709 -0.938 4.766 1.00 0.00 C ATOM 878 OD1 ASP A 64 -6.394 -1.263 5.760 1.00 0.00 O ATOM 879 OD2 ASP A 64 -6.026 -0.094 3.900 1.00 0.00 O ATOM 0 H ASP A 64 -2.841 -2.568 6.773 1.00 0.00 H new ATOM 0 HA ASP A 64 -5.220 -3.487 5.282 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -3.577 -0.986 4.980 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -4.169 -1.768 3.528 1.00 0.00 H new ATOM 884 N ARG A 65 -3.722 -4.807 3.773 1.00 0.00 N ATOM 885 CA ARG A 65 -2.862 -5.677 2.990 1.00 0.00 C ATOM 886 C ARG A 65 -2.760 -5.168 1.550 1.00 0.00 C ATOM 887 O ARG A 65 -3.763 -5.091 0.843 1.00 0.00 O ATOM 888 CB ARG A 65 -3.392 -7.112 2.979 1.00 0.00 C ATOM 889 CG ARG A 65 -2.294 -8.100 2.578 1.00 0.00 C ATOM 890 CD ARG A 65 -2.896 -9.420 2.091 1.00 0.00 C ATOM 891 NE ARG A 65 -1.838 -10.271 1.502 1.00 0.00 N ATOM 892 CZ ARG A 65 -1.965 -11.588 1.289 1.00 0.00 C ATOM 893 NH1 ARG A 65 -3.105 -12.212 1.614 1.00 0.00 N ATOM 894 NH2 ARG A 65 -0.953 -12.280 0.750 1.00 0.00 N ATOM 0 H ARG A 65 -4.718 -5.014 3.700 1.00 0.00 H new ATOM 0 HA ARG A 65 -1.875 -5.670 3.453 1.00 0.00 H new ATOM 0 HB2 ARG A 65 -3.775 -7.370 3.967 1.00 0.00 H new ATOM 0 HB3 ARG A 65 -4.227 -7.189 2.283 1.00 0.00 H new ATOM 0 HG2 ARG A 65 -1.678 -7.665 1.791 1.00 0.00 H new ATOM 0 HG3 ARG A 65 -1.639 -8.287 3.429 1.00 0.00 H new ATOM 0 HD2 ARG A 65 -3.373 -9.940 2.922 1.00 0.00 H new ATOM 0 HD3 ARG A 65 -3.671 -9.224 1.350 1.00 0.00 H new ATOM 0 HE ARG A 65 -0.957 -9.827 1.242 1.00 0.00 H new ATOM 0 HH11 ARG A 65 -3.876 -11.685 2.023 1.00 0.00 H new ATOM 0 HH12 ARG A 65 -3.202 -13.214 1.452 1.00 0.00 H new ATOM 0 HH21 ARG A 65 -0.085 -11.805 0.502 1.00 0.00 H new ATOM 0 HH22 ARG A 65 -1.050 -13.282 0.588 1.00 0.00 H new ATOM 908 N ILE A 66 -1.539 -4.833 1.160 1.00 0.00 N ATOM 909 CA ILE A 66 -1.294 -4.333 -0.182 1.00 0.00 C ATOM 910 C ILE A 66 -1.481 -5.471 -1.188 1.00 0.00 C ATOM 911 O ILE A 66 -1.044 -6.596 -0.947 1.00 0.00 O ATOM 912 CB ILE A 66 0.079 -3.663 -0.262 1.00 0.00 C ATOM 913 CG1 ILE A 66 0.407 -2.928 1.040 1.00 0.00 C ATOM 914 CG2 ILE A 66 0.170 -2.740 -1.479 1.00 0.00 C ATOM 915 CD1 ILE A 66 1.450 -1.835 0.805 1.00 0.00 C ATOM 0 H ILE A 66 -0.709 -4.898 1.749 1.00 0.00 H new ATOM 0 HA ILE A 66 -2.017 -3.558 -0.437 1.00 0.00 H new ATOM 0 HB ILE A 66 0.831 -4.441 -0.392 1.00 0.00 H new ATOM 0 HG12 ILE A 66 -0.501 -2.487 1.451 1.00 0.00 H new ATOM 0 HG13 ILE A 66 0.779 -3.638 1.779 1.00 0.00 H new ATOM 0 HG21 ILE A 66 1.156 -2.277 -1.511 1.00 0.00 H new ATOM 0 HG22 ILE A 66 0.011 -3.320 -2.388 1.00 0.00 H new ATOM 0 HG23 ILE A 66 -0.593 -1.965 -1.406 1.00 0.00 H new ATOM 0 HD11 ILE A 66 1.665 -1.329 1.746 1.00 0.00 H new ATOM 0 HD12 ILE A 66 2.365 -2.283 0.417 1.00 0.00 H new ATOM 0 HD13 ILE A 66 1.065 -1.114 0.084 1.00 0.00 H new ATOM 927 N ILE A 67 -2.132 -5.140 -2.294 1.00 0.00 N ATOM 928 CA ILE A 67 -2.382 -6.120 -3.337 1.00 0.00 C ATOM 929 C ILE A 67 -1.449 -5.850 -4.519 1.00 0.00 C ATOM 930 O ILE A 67 -0.808 -6.767 -5.030 1.00 0.00 O ATOM 931 CB ILE A 67 -3.865 -6.133 -3.714 1.00 0.00 C ATOM 932 CG1 ILE A 67 -4.731 -5.636 -2.554 1.00 0.00 C ATOM 933 CG2 ILE A 67 -4.295 -7.520 -4.197 1.00 0.00 C ATOM 934 CD1 ILE A 67 -4.676 -6.608 -1.374 1.00 0.00 C ATOM 0 H ILE A 67 -2.494 -4.207 -2.490 1.00 0.00 H new ATOM 0 HA ILE A 67 -2.159 -7.125 -2.978 1.00 0.00 H new ATOM 0 HB ILE A 67 -4.012 -5.442 -4.544 1.00 0.00 H new ATOM 0 HG12 ILE A 67 -4.388 -4.652 -2.235 1.00 0.00 H new ATOM 0 HG13 ILE A 67 -5.762 -5.522 -2.888 1.00 0.00 H new ATOM 0 HG21 ILE A 67 -5.353 -7.502 -4.459 1.00 0.00 H new ATOM 0 HG22 ILE A 67 -3.709 -7.798 -5.073 1.00 0.00 H new ATOM 0 HG23 ILE A 67 -4.130 -8.249 -3.404 1.00 0.00 H new ATOM 0 HD11 ILE A 67 -5.300 -6.232 -0.563 1.00 0.00 H new ATOM 0 HD12 ILE A 67 -5.042 -7.585 -1.690 1.00 0.00 H new ATOM 0 HD13 ILE A 67 -3.647 -6.701 -1.027 1.00 0.00 H new ATOM 946 N GLU A 68 -1.402 -4.588 -4.919 1.00 0.00 N ATOM 947 CA GLU A 68 -0.558 -4.186 -6.031 1.00 0.00 C ATOM 948 C GLU A 68 -0.002 -2.781 -5.795 1.00 0.00 C ATOM 949 O GLU A 68 -0.623 -1.971 -5.109 1.00 0.00 O ATOM 950 CB GLU A 68 -1.324 -4.258 -7.354 1.00 0.00 C ATOM 951 CG GLU A 68 -0.627 -5.197 -8.340 1.00 0.00 C ATOM 952 CD GLU A 68 -1.429 -6.487 -8.529 1.00 0.00 C ATOM 953 OE1 GLU A 68 -2.268 -6.767 -7.646 1.00 0.00 O ATOM 954 OE2 GLU A 68 -1.184 -7.163 -9.551 1.00 0.00 O ATOM 0 H GLU A 68 -1.935 -3.830 -4.493 1.00 0.00 H new ATOM 0 HA GLU A 68 0.280 -4.880 -6.096 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -2.341 -4.606 -7.171 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -1.402 -3.261 -7.788 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -0.505 -4.696 -9.300 1.00 0.00 H new ATOM 0 HG3 GLU A 68 0.372 -5.436 -7.976 1.00 0.00 H new ATOM 961 N VAL A 69 1.162 -2.534 -6.377 1.00 0.00 N ATOM 962 CA VAL A 69 1.809 -1.241 -6.238 1.00 0.00 C ATOM 963 C VAL A 69 2.437 -0.843 -7.575 1.00 0.00 C ATOM 964 O VAL A 69 3.351 -1.510 -8.059 1.00 0.00 O ATOM 965 CB VAL A 69 2.821 -1.282 -5.091 1.00 0.00 C ATOM 966 CG1 VAL A 69 4.232 -1.558 -5.615 1.00 0.00 C ATOM 967 CG2 VAL A 69 2.782 0.014 -4.278 1.00 0.00 C ATOM 0 H VAL A 69 1.674 -3.208 -6.946 1.00 0.00 H new ATOM 0 HA VAL A 69 1.078 -0.474 -5.981 1.00 0.00 H new ATOM 0 HB VAL A 69 2.543 -2.101 -4.428 1.00 0.00 H new ATOM 0 HG11 VAL A 69 4.932 -1.582 -4.780 1.00 0.00 H new ATOM 0 HG12 VAL A 69 4.248 -2.519 -6.129 1.00 0.00 H new ATOM 0 HG13 VAL A 69 4.523 -0.770 -6.310 1.00 0.00 H new ATOM 0 HG21 VAL A 69 3.511 -0.042 -3.469 1.00 0.00 H new ATOM 0 HG22 VAL A 69 3.022 0.857 -4.926 1.00 0.00 H new ATOM 0 HG23 VAL A 69 1.785 0.151 -3.859 1.00 0.00 H new ATOM 977 N ASN A 70 1.922 0.241 -8.136 1.00 0.00 N ATOM 978 CA ASN A 70 2.420 0.735 -9.408 1.00 0.00 C ATOM 979 C ASN A 70 2.266 -0.355 -10.470 1.00 0.00 C ATOM 980 O ASN A 70 2.888 -0.288 -11.528 1.00 0.00 O ATOM 981 CB ASN A 70 3.904 1.098 -9.314 1.00 0.00 C ATOM 982 CG ASN A 70 4.255 2.226 -10.287 1.00 0.00 C ATOM 983 OD1 ASN A 70 4.431 2.022 -11.477 1.00 0.00 O ATOM 984 ND2 ASN A 70 4.347 3.423 -9.716 1.00 0.00 N ATOM 0 H ASN A 70 1.164 0.791 -7.732 1.00 0.00 H new ATOM 0 HA ASN A 70 1.847 1.624 -9.673 1.00 0.00 H new ATOM 0 HB2 ASN A 70 4.144 1.404 -8.296 1.00 0.00 H new ATOM 0 HB3 ASN A 70 4.512 0.220 -9.535 1.00 0.00 H new ATOM 0 HD21 ASN A 70 4.577 4.241 -10.280 1.00 0.00 H new ATOM 0 HD22 ASN A 70 4.187 3.524 -8.714 1.00 0.00 H new ATOM 991 N GLY A 71 1.433 -1.335 -10.149 1.00 0.00 N ATOM 992 CA GLY A 71 1.189 -2.438 -11.063 1.00 0.00 C ATOM 993 C GLY A 71 2.009 -3.668 -10.667 1.00 0.00 C ATOM 994 O GLY A 71 2.018 -4.668 -11.384 1.00 0.00 O ATOM 0 H GLY A 71 0.919 -1.388 -9.269 1.00 0.00 H new ATOM 0 HA2 GLY A 71 0.128 -2.688 -11.062 1.00 0.00 H new ATOM 0 HA3 GLY A 71 1.445 -2.137 -12.079 1.00 0.00 H new ATOM 998 N ARG A 72 2.677 -3.554 -9.529 1.00 0.00 N ATOM 999 CA ARG A 72 3.497 -4.644 -9.030 1.00 0.00 C ATOM 1000 C ARG A 72 2.767 -5.388 -7.910 1.00 0.00 C ATOM 1001 O ARG A 72 2.299 -4.773 -6.954 1.00 0.00 O ATOM 1002 CB ARG A 72 4.837 -4.128 -8.502 1.00 0.00 C ATOM 1003 CG ARG A 72 6.006 -4.752 -9.267 1.00 0.00 C ATOM 1004 CD ARG A 72 7.221 -4.936 -8.357 1.00 0.00 C ATOM 1005 NE ARG A 72 8.251 -5.746 -9.045 1.00 0.00 N ATOM 1006 CZ ARG A 72 9.484 -5.959 -8.565 1.00 0.00 C ATOM 1007 NH1 ARG A 72 9.848 -5.424 -7.392 1.00 0.00 N ATOM 1008 NH2 ARG A 72 10.353 -6.708 -9.259 1.00 0.00 N ATOM 0 H ARG A 72 2.667 -2.723 -8.938 1.00 0.00 H new ATOM 0 HA ARG A 72 3.685 -5.325 -9.860 1.00 0.00 H new ATOM 0 HB2 ARG A 72 4.875 -3.043 -8.595 1.00 0.00 H new ATOM 0 HB3 ARG A 72 4.927 -4.360 -7.441 1.00 0.00 H new ATOM 0 HG2 ARG A 72 5.704 -5.716 -9.676 1.00 0.00 H new ATOM 0 HG3 ARG A 72 6.273 -4.117 -10.112 1.00 0.00 H new ATOM 0 HD2 ARG A 72 7.633 -3.964 -8.085 1.00 0.00 H new ATOM 0 HD3 ARG A 72 6.921 -5.425 -7.430 1.00 0.00 H new ATOM 0 HE ARG A 72 8.007 -6.169 -9.941 1.00 0.00 H new ATOM 0 HH11 ARG A 72 9.187 -4.854 -6.864 1.00 0.00 H new ATOM 0 HH12 ARG A 72 10.786 -5.586 -7.027 1.00 0.00 H new ATOM 0 HH21 ARG A 72 10.076 -7.115 -10.152 1.00 0.00 H new ATOM 0 HH22 ARG A 72 11.292 -6.870 -8.894 1.00 0.00 H new ATOM 1022 N ASP A 73 2.694 -6.702 -8.066 1.00 0.00 N ATOM 1023 CA ASP A 73 2.029 -7.537 -7.079 1.00 0.00 C ATOM 1024 C ASP A 73 2.958 -7.741 -5.881 1.00 0.00 C ATOM 1025 O ASP A 73 4.129 -8.080 -6.049 1.00 0.00 O ATOM 1026 CB ASP A 73 1.694 -8.913 -7.658 1.00 0.00 C ATOM 1027 CG ASP A 73 0.704 -9.738 -6.833 1.00 0.00 C ATOM 1028 OD1 ASP A 73 1.098 -10.151 -5.721 1.00 0.00 O ATOM 1029 OD2 ASP A 73 -0.424 -9.936 -7.333 1.00 0.00 O ATOM 0 H ASP A 73 3.084 -7.209 -8.861 1.00 0.00 H new ATOM 0 HA ASP A 73 1.107 -7.038 -6.780 1.00 0.00 H new ATOM 0 HB2 ASP A 73 1.286 -8.779 -8.660 1.00 0.00 H new ATOM 0 HB3 ASP A 73 2.618 -9.481 -7.763 1.00 0.00 H new ATOM 1034 N LEU A 74 2.402 -7.526 -4.698 1.00 0.00 N ATOM 1035 CA LEU A 74 3.166 -7.683 -3.472 1.00 0.00 C ATOM 1036 C LEU A 74 2.378 -8.555 -2.492 1.00 0.00 C ATOM 1037 O LEU A 74 2.773 -8.711 -1.338 1.00 0.00 O ATOM 1038 CB LEU A 74 3.554 -6.316 -2.904 1.00 0.00 C ATOM 1039 CG LEU A 74 3.956 -5.254 -3.929 1.00 0.00 C ATOM 1040 CD1 LEU A 74 4.298 -3.930 -3.241 1.00 0.00 C ATOM 1041 CD2 LEU A 74 5.100 -5.752 -4.814 1.00 0.00 C ATOM 0 H LEU A 74 1.431 -7.244 -4.562 1.00 0.00 H new ATOM 0 HA LEU A 74 4.106 -8.198 -3.672 1.00 0.00 H new ATOM 0 HB2 LEU A 74 2.714 -5.934 -2.324 1.00 0.00 H new ATOM 0 HB3 LEU A 74 4.383 -6.455 -2.210 1.00 0.00 H new ATOM 0 HG LEU A 74 3.102 -5.067 -4.581 1.00 0.00 H new ATOM 0 HD11 LEU A 74 4.580 -3.192 -3.992 1.00 0.00 H new ATOM 0 HD12 LEU A 74 3.429 -3.572 -2.689 1.00 0.00 H new ATOM 0 HD13 LEU A 74 5.128 -4.082 -2.551 1.00 0.00 H new ATOM 0 HD21 LEU A 74 5.367 -4.978 -5.534 1.00 0.00 H new ATOM 0 HD22 LEU A 74 5.966 -5.984 -4.193 1.00 0.00 H new ATOM 0 HD23 LEU A 74 4.784 -6.649 -5.346 1.00 0.00 H new ATOM 1053 N SER A 75 1.277 -9.100 -2.989 1.00 0.00 N ATOM 1054 CA SER A 75 0.430 -9.952 -2.172 1.00 0.00 C ATOM 1055 C SER A 75 1.217 -11.176 -1.702 1.00 0.00 C ATOM 1056 O SER A 75 1.063 -11.619 -0.564 1.00 0.00 O ATOM 1057 CB SER A 75 -0.819 -10.387 -2.941 1.00 0.00 C ATOM 1058 OG SER A 75 -0.492 -11.088 -4.138 1.00 0.00 O ATOM 0 H SER A 75 0.952 -8.968 -3.947 1.00 0.00 H new ATOM 0 HA SER A 75 0.107 -9.380 -1.302 1.00 0.00 H new ATOM 0 HB2 SER A 75 -1.433 -11.024 -2.304 1.00 0.00 H new ATOM 0 HB3 SER A 75 -1.417 -9.510 -3.187 1.00 0.00 H new ATOM 0 HG SER A 75 0.416 -10.849 -4.420 1.00 0.00 H new ATOM 1064 N ARG A 76 2.045 -11.689 -2.601 1.00 0.00 N ATOM 1065 CA ARG A 76 2.857 -12.854 -2.292 1.00 0.00 C ATOM 1066 C ARG A 76 4.337 -12.471 -2.242 1.00 0.00 C ATOM 1067 O ARG A 76 5.209 -13.333 -2.342 1.00 0.00 O ATOM 1068 CB ARG A 76 2.657 -13.956 -3.334 1.00 0.00 C ATOM 1069 CG ARG A 76 2.860 -13.414 -4.751 1.00 0.00 C ATOM 1070 CD ARG A 76 3.139 -14.550 -5.737 1.00 0.00 C ATOM 1071 NE ARG A 76 4.212 -14.154 -6.676 1.00 0.00 N ATOM 1072 CZ ARG A 76 4.087 -13.184 -7.593 1.00 0.00 C ATOM 1073 NH1 ARG A 76 2.936 -12.507 -7.700 1.00 0.00 N ATOM 1074 NH2 ARG A 76 5.114 -12.892 -8.403 1.00 0.00 N ATOM 0 H ARG A 76 2.171 -11.319 -3.543 1.00 0.00 H new ATOM 0 HA ARG A 76 2.542 -13.229 -1.318 1.00 0.00 H new ATOM 0 HB2 ARG A 76 3.359 -14.769 -3.148 1.00 0.00 H new ATOM 0 HB3 ARG A 76 1.654 -14.372 -3.240 1.00 0.00 H new ATOM 0 HG2 ARG A 76 1.972 -12.865 -5.065 1.00 0.00 H new ATOM 0 HG3 ARG A 76 3.691 -12.708 -4.759 1.00 0.00 H new ATOM 0 HD2 ARG A 76 3.432 -15.449 -5.195 1.00 0.00 H new ATOM 0 HD3 ARG A 76 2.232 -14.793 -6.290 1.00 0.00 H new ATOM 0 HE ARG A 76 5.102 -14.650 -6.622 1.00 0.00 H new ATOM 0 HH11 ARG A 76 2.154 -12.729 -7.084 1.00 0.00 H new ATOM 0 HH12 ARG A 76 2.841 -11.769 -8.398 1.00 0.00 H new ATOM 0 HH21 ARG A 76 5.990 -13.408 -8.322 1.00 0.00 H new ATOM 0 HH22 ARG A 76 5.019 -12.154 -9.101 1.00 0.00 H new ATOM 1088 N ALA A 77 4.576 -11.177 -2.087 1.00 0.00 N ATOM 1089 CA ALA A 77 5.935 -10.669 -2.022 1.00 0.00 C ATOM 1090 C ALA A 77 6.345 -10.506 -0.557 1.00 0.00 C ATOM 1091 O ALA A 77 5.531 -10.699 0.344 1.00 0.00 O ATOM 1092 CB ALA A 77 6.028 -9.356 -2.802 1.00 0.00 C ATOM 0 H ALA A 77 3.850 -10.465 -2.005 1.00 0.00 H new ATOM 0 HA ALA A 77 6.629 -11.372 -2.483 1.00 0.00 H new ATOM 0 HB1 ALA A 77 7.048 -8.975 -2.753 1.00 0.00 H new ATOM 0 HB2 ALA A 77 5.756 -9.531 -3.843 1.00 0.00 H new ATOM 0 HB3 ALA A 77 5.347 -8.625 -2.367 1.00 0.00 H new ATOM 1098 N THR A 78 7.608 -10.153 -0.365 1.00 0.00 N ATOM 1099 CA THR A 78 8.136 -9.962 0.975 1.00 0.00 C ATOM 1100 C THR A 78 8.436 -8.483 1.225 1.00 0.00 C ATOM 1101 O THR A 78 8.317 -7.660 0.318 1.00 0.00 O ATOM 1102 CB THR A 78 9.360 -10.866 1.134 1.00 0.00 C ATOM 1103 OG1 THR A 78 9.816 -10.603 2.459 1.00 0.00 O ATOM 1104 CG2 THR A 78 10.527 -10.433 0.245 1.00 0.00 C ATOM 0 H THR A 78 8.281 -9.994 -1.115 1.00 0.00 H new ATOM 0 HA THR A 78 7.405 -10.245 1.732 1.00 0.00 H new ATOM 0 HB THR A 78 9.085 -11.894 0.897 1.00 0.00 H new ATOM 0 HG1 THR A 78 10.574 -9.983 2.427 1.00 0.00 H new ATOM 0 HG21 THR A 78 11.370 -11.108 0.397 1.00 0.00 H new ATOM 0 HG22 THR A 78 10.220 -10.465 -0.800 1.00 0.00 H new ATOM 0 HG23 THR A 78 10.825 -9.417 0.504 1.00 0.00 H new ATOM 1112 N HIS A 79 8.820 -8.190 2.459 1.00 0.00 N ATOM 1113 CA HIS A 79 9.138 -6.824 2.839 1.00 0.00 C ATOM 1114 C HIS A 79 10.242 -6.282 1.929 1.00 0.00 C ATOM 1115 O HIS A 79 10.216 -5.115 1.542 1.00 0.00 O ATOM 1116 CB HIS A 79 9.500 -6.744 4.323 1.00 0.00 C ATOM 1117 CG HIS A 79 9.671 -5.335 4.838 1.00 0.00 C ATOM 1118 ND1 HIS A 79 10.908 -4.723 4.952 1.00 0.00 N ATOM 1119 CD2 HIS A 79 8.750 -4.424 5.267 1.00 0.00 C ATOM 1120 CE1 HIS A 79 10.727 -3.500 5.430 1.00 0.00 C ATOM 1121 NE2 HIS A 79 9.389 -3.318 5.625 1.00 0.00 N ATOM 0 H HIS A 79 8.918 -8.875 3.208 1.00 0.00 H new ATOM 0 HA HIS A 79 8.261 -6.191 2.704 1.00 0.00 H new ATOM 0 HB2 HIS A 79 8.722 -7.240 4.903 1.00 0.00 H new ATOM 0 HB3 HIS A 79 10.425 -7.296 4.491 1.00 0.00 H new ATOM 0 HD2 HIS A 79 7.682 -4.577 5.308 1.00 0.00 H new ATOM 0 HE1 HIS A 79 11.502 -2.775 5.630 1.00 0.00 H new ATOM 0 HE2 HIS A 79 8.952 -2.470 5.987 1.00 0.00 H new ATOM 1129 N ASP A 80 11.187 -7.156 1.614 1.00 0.00 N ATOM 1130 CA ASP A 80 12.298 -6.780 0.757 1.00 0.00 C ATOM 1131 C ASP A 80 11.763 -6.383 -0.621 1.00 0.00 C ATOM 1132 O ASP A 80 12.083 -5.310 -1.129 1.00 0.00 O ATOM 1133 CB ASP A 80 13.268 -7.948 0.568 1.00 0.00 C ATOM 1134 CG ASP A 80 14.704 -7.677 1.023 1.00 0.00 C ATOM 1135 OD1 ASP A 80 14.904 -6.630 1.677 1.00 0.00 O ATOM 1136 OD2 ASP A 80 15.569 -8.521 0.707 1.00 0.00 O ATOM 0 H ASP A 80 11.206 -8.123 1.937 1.00 0.00 H new ATOM 0 HA ASP A 80 12.821 -5.949 1.230 1.00 0.00 H new ATOM 0 HB2 ASP A 80 12.886 -8.810 1.115 1.00 0.00 H new ATOM 0 HB3 ASP A 80 13.283 -8.221 -0.487 1.00 0.00 H new ATOM 1141 N GLN A 81 10.958 -7.271 -1.185 1.00 0.00 N ATOM 1142 CA GLN A 81 10.375 -7.027 -2.494 1.00 0.00 C ATOM 1143 C GLN A 81 9.407 -5.843 -2.431 1.00 0.00 C ATOM 1144 O GLN A 81 9.465 -4.945 -3.270 1.00 0.00 O ATOM 1145 CB GLN A 81 9.675 -8.280 -3.025 1.00 0.00 C ATOM 1146 CG GLN A 81 10.684 -9.398 -3.295 1.00 0.00 C ATOM 1147 CD GLN A 81 9.971 -10.713 -3.617 1.00 0.00 C ATOM 1148 OE1 GLN A 81 9.830 -11.593 -2.784 1.00 0.00 O ATOM 1149 NE2 GLN A 81 9.530 -10.797 -4.869 1.00 0.00 N ATOM 0 H GLN A 81 10.696 -8.160 -0.760 1.00 0.00 H new ATOM 0 HA GLN A 81 11.178 -6.778 -3.188 1.00 0.00 H new ATOM 0 HB2 GLN A 81 8.934 -8.621 -2.302 1.00 0.00 H new ATOM 0 HB3 GLN A 81 9.138 -8.040 -3.943 1.00 0.00 H new ATOM 0 HG2 GLN A 81 11.330 -9.117 -4.127 1.00 0.00 H new ATOM 0 HG3 GLN A 81 11.326 -9.532 -2.424 1.00 0.00 H new ATOM 0 HE21 GLN A 81 9.681 -10.023 -5.516 1.00 0.00 H new ATOM 0 HE22 GLN A 81 9.040 -11.635 -5.182 1.00 0.00 H new ATOM 1158 N ALA A 82 8.541 -5.880 -1.430 1.00 0.00 N ATOM 1159 CA ALA A 82 7.562 -4.822 -1.247 1.00 0.00 C ATOM 1160 C ALA A 82 8.281 -3.472 -1.201 1.00 0.00 C ATOM 1161 O ALA A 82 7.941 -2.558 -1.951 1.00 0.00 O ATOM 1162 CB ALA A 82 6.748 -5.093 0.019 1.00 0.00 C ATOM 0 H ALA A 82 8.497 -6.627 -0.736 1.00 0.00 H new ATOM 0 HA ALA A 82 6.863 -4.796 -2.083 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.014 -4.299 0.156 1.00 0.00 H new ATOM 0 HB2 ALA A 82 6.235 -6.050 -0.076 1.00 0.00 H new ATOM 0 HB3 ALA A 82 7.415 -5.123 0.881 1.00 0.00 H new ATOM 1168 N VAL A 83 9.260 -3.389 -0.313 1.00 0.00 N ATOM 1169 CA VAL A 83 10.029 -2.166 -0.159 1.00 0.00 C ATOM 1170 C VAL A 83 10.615 -1.763 -1.514 1.00 0.00 C ATOM 1171 O VAL A 83 10.395 -0.647 -1.982 1.00 0.00 O ATOM 1172 CB VAL A 83 11.096 -2.351 0.923 1.00 0.00 C ATOM 1173 CG1 VAL A 83 12.105 -1.201 0.900 1.00 0.00 C ATOM 1174 CG2 VAL A 83 10.456 -2.492 2.305 1.00 0.00 C ATOM 0 H VAL A 83 9.539 -4.149 0.308 1.00 0.00 H new ATOM 0 HA VAL A 83 9.387 -1.350 0.173 1.00 0.00 H new ATOM 0 HB VAL A 83 11.635 -3.274 0.708 1.00 0.00 H new ATOM 0 HG11 VAL A 83 12.852 -1.357 1.678 1.00 0.00 H new ATOM 0 HG12 VAL A 83 12.596 -1.167 -0.073 1.00 0.00 H new ATOM 0 HG13 VAL A 83 11.587 -0.259 1.078 1.00 0.00 H new ATOM 0 HG21 VAL A 83 11.236 -2.622 3.055 1.00 0.00 H new ATOM 0 HG22 VAL A 83 9.880 -1.595 2.532 1.00 0.00 H new ATOM 0 HG23 VAL A 83 9.796 -3.359 2.313 1.00 0.00 H new ATOM 1184 N GLU A 84 11.351 -2.693 -2.104 1.00 0.00 N ATOM 1185 CA GLU A 84 11.970 -2.449 -3.396 1.00 0.00 C ATOM 1186 C GLU A 84 10.934 -1.923 -4.391 1.00 0.00 C ATOM 1187 O GLU A 84 11.178 -0.937 -5.085 1.00 0.00 O ATOM 1188 CB GLU A 84 12.648 -3.714 -3.927 1.00 0.00 C ATOM 1189 CG GLU A 84 13.377 -3.434 -5.243 1.00 0.00 C ATOM 1190 CD GLU A 84 14.672 -4.243 -5.334 1.00 0.00 C ATOM 1191 OE1 GLU A 84 15.682 -3.764 -4.776 1.00 0.00 O ATOM 1192 OE2 GLU A 84 14.622 -5.324 -5.961 1.00 0.00 O ATOM 0 H GLU A 84 11.533 -3.617 -1.711 1.00 0.00 H new ATOM 0 HA GLU A 84 12.741 -1.689 -3.269 1.00 0.00 H new ATOM 0 HB2 GLU A 84 13.356 -4.089 -3.188 1.00 0.00 H new ATOM 0 HB3 GLU A 84 11.902 -4.494 -4.079 1.00 0.00 H new ATOM 0 HG2 GLU A 84 12.728 -3.683 -6.083 1.00 0.00 H new ATOM 0 HG3 GLU A 84 13.602 -2.370 -5.319 1.00 0.00 H new ATOM 1199 N ALA A 85 9.798 -2.605 -4.429 1.00 0.00 N ATOM 1200 CA ALA A 85 8.723 -2.218 -5.327 1.00 0.00 C ATOM 1201 C ALA A 85 8.405 -0.735 -5.127 1.00 0.00 C ATOM 1202 O ALA A 85 8.389 0.035 -6.086 1.00 0.00 O ATOM 1203 CB ALA A 85 7.507 -3.114 -5.083 1.00 0.00 C ATOM 0 H ALA A 85 9.599 -3.423 -3.853 1.00 0.00 H new ATOM 0 HA ALA A 85 9.024 -2.352 -6.366 1.00 0.00 H new ATOM 0 HB1 ALA A 85 6.700 -2.824 -5.756 1.00 0.00 H new ATOM 0 HB2 ALA A 85 7.778 -4.153 -5.268 1.00 0.00 H new ATOM 0 HB3 ALA A 85 7.175 -3.004 -4.051 1.00 0.00 H new ATOM 1209 N PHE A 86 8.158 -0.380 -3.874 1.00 0.00 N ATOM 1210 CA PHE A 86 7.841 0.997 -3.536 1.00 0.00 C ATOM 1211 C PHE A 86 9.027 1.920 -3.824 1.00 0.00 C ATOM 1212 O PHE A 86 8.846 3.113 -4.063 1.00 0.00 O ATOM 1213 CB PHE A 86 7.536 1.030 -2.037 1.00 0.00 C ATOM 1214 CG PHE A 86 6.092 0.667 -1.687 1.00 0.00 C ATOM 1215 CD1 PHE A 86 5.081 1.523 -1.997 1.00 0.00 C ATOM 1216 CD2 PHE A 86 5.818 -0.511 -1.066 1.00 0.00 C ATOM 1217 CE1 PHE A 86 3.741 1.186 -1.672 1.00 0.00 C ATOM 1218 CE2 PHE A 86 4.477 -0.848 -0.741 1.00 0.00 C ATOM 1219 CZ PHE A 86 3.467 0.008 -1.051 1.00 0.00 C ATOM 0 H PHE A 86 8.171 -1.022 -3.081 1.00 0.00 H new ATOM 0 HA PHE A 86 6.995 1.341 -4.131 1.00 0.00 H new ATOM 0 HB2 PHE A 86 8.207 0.341 -1.525 1.00 0.00 H new ATOM 0 HB3 PHE A 86 7.752 2.028 -1.655 1.00 0.00 H new ATOM 0 HD1 PHE A 86 5.298 2.459 -2.490 1.00 0.00 H new ATOM 0 HD2 PHE A 86 6.620 -1.191 -0.820 1.00 0.00 H new ATOM 0 HE1 PHE A 86 2.939 1.866 -1.918 1.00 0.00 H new ATOM 0 HE2 PHE A 86 4.260 -1.784 -0.248 1.00 0.00 H new ATOM 0 HZ PHE A 86 2.447 -0.248 -0.804 1.00 0.00 H new ATOM 1229 N LYS A 87 10.214 1.332 -3.791 1.00 0.00 N ATOM 1230 CA LYS A 87 11.429 2.087 -4.046 1.00 0.00 C ATOM 1231 C LYS A 87 11.566 2.333 -5.550 1.00 0.00 C ATOM 1232 O LYS A 87 11.803 3.461 -5.979 1.00 0.00 O ATOM 1233 CB LYS A 87 12.637 1.382 -3.426 1.00 0.00 C ATOM 1234 CG LYS A 87 13.945 1.910 -4.019 1.00 0.00 C ATOM 1235 CD LYS A 87 15.155 1.325 -3.288 1.00 0.00 C ATOM 1236 CE LYS A 87 15.373 2.022 -1.944 1.00 0.00 C ATOM 1237 NZ LYS A 87 15.956 3.367 -2.145 1.00 0.00 N ATOM 0 H LYS A 87 10.360 0.342 -3.592 1.00 0.00 H new ATOM 0 HA LYS A 87 11.378 3.064 -3.566 1.00 0.00 H new ATOM 0 HB2 LYS A 87 12.636 1.533 -2.347 1.00 0.00 H new ATOM 0 HB3 LYS A 87 12.563 0.308 -3.598 1.00 0.00 H new ATOM 0 HG2 LYS A 87 13.997 1.655 -5.078 1.00 0.00 H new ATOM 0 HG3 LYS A 87 13.966 2.998 -3.951 1.00 0.00 H new ATOM 0 HD2 LYS A 87 15.006 0.257 -3.128 1.00 0.00 H new ATOM 0 HD3 LYS A 87 16.046 1.434 -3.907 1.00 0.00 H new ATOM 0 HE2 LYS A 87 14.425 2.106 -1.413 1.00 0.00 H new ATOM 0 HE3 LYS A 87 16.035 1.422 -1.320 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 16.300 3.736 -1.235 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 16.749 3.305 -2.815 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 15.230 4.007 -2.526 1.00 0.00 H new ATOM 1251 N THR A 88 11.410 1.258 -6.310 1.00 0.00 N ATOM 1252 CA THR A 88 11.514 1.344 -7.756 1.00 0.00 C ATOM 1253 C THR A 88 10.213 1.885 -8.353 1.00 0.00 C ATOM 1254 O THR A 88 10.119 2.091 -9.562 1.00 0.00 O ATOM 1255 CB THR A 88 11.895 -0.040 -8.286 1.00 0.00 C ATOM 1256 OG1 THR A 88 10.684 -0.788 -8.205 1.00 0.00 O ATOM 1257 CG2 THR A 88 12.853 -0.781 -7.351 1.00 0.00 C ATOM 0 H THR A 88 11.213 0.324 -5.951 1.00 0.00 H new ATOM 0 HA THR A 88 12.290 2.048 -8.055 1.00 0.00 H new ATOM 0 HB THR A 88 12.353 0.061 -9.270 1.00 0.00 H new ATOM 0 HG1 THR A 88 10.494 -1.002 -7.268 1.00 0.00 H new ATOM 0 HG21 THR A 88 13.092 -1.757 -7.774 1.00 0.00 H new ATOM 0 HG22 THR A 88 13.769 -0.202 -7.235 1.00 0.00 H new ATOM 0 HG23 THR A 88 12.382 -0.913 -6.377 1.00 0.00 H new ATOM 1265 N ALA A 89 9.242 2.101 -7.477 1.00 0.00 N ATOM 1266 CA ALA A 89 7.951 2.614 -7.902 1.00 0.00 C ATOM 1267 C ALA A 89 8.095 4.088 -8.286 1.00 0.00 C ATOM 1268 O ALA A 89 8.945 4.794 -7.745 1.00 0.00 O ATOM 1269 CB ALA A 89 6.925 2.399 -6.788 1.00 0.00 C ATOM 0 H ALA A 89 9.324 1.930 -6.475 1.00 0.00 H new ATOM 0 HA ALA A 89 7.595 2.077 -8.781 1.00 0.00 H new ATOM 0 HB1 ALA A 89 5.956 2.784 -7.106 1.00 0.00 H new ATOM 0 HB2 ALA A 89 6.839 1.334 -6.573 1.00 0.00 H new ATOM 0 HB3 ALA A 89 7.247 2.926 -5.890 1.00 0.00 H new ATOM 1275 N LYS A 90 7.251 4.509 -9.216 1.00 0.00 N ATOM 1276 CA LYS A 90 7.273 5.887 -9.679 1.00 0.00 C ATOM 1277 C LYS A 90 5.907 6.527 -9.428 1.00 0.00 C ATOM 1278 O LYS A 90 4.886 5.840 -9.430 1.00 0.00 O ATOM 1279 CB LYS A 90 7.725 5.954 -11.139 1.00 0.00 C ATOM 1280 CG LYS A 90 9.241 6.138 -11.236 1.00 0.00 C ATOM 1281 CD LYS A 90 9.659 7.520 -10.728 1.00 0.00 C ATOM 1282 CE LYS A 90 10.020 8.445 -11.892 1.00 0.00 C ATOM 1283 NZ LYS A 90 10.392 9.787 -11.390 1.00 0.00 N ATOM 0 H LYS A 90 6.547 3.921 -9.662 1.00 0.00 H new ATOM 0 HA LYS A 90 8.005 6.466 -9.116 1.00 0.00 H new ATOM 0 HB2 LYS A 90 7.432 5.040 -11.656 1.00 0.00 H new ATOM 0 HB3 LYS A 90 7.222 6.780 -11.642 1.00 0.00 H new ATOM 0 HG2 LYS A 90 9.743 5.365 -10.653 1.00 0.00 H new ATOM 0 HG3 LYS A 90 9.560 6.015 -12.271 1.00 0.00 H new ATOM 0 HD2 LYS A 90 8.847 7.959 -10.148 1.00 0.00 H new ATOM 0 HD3 LYS A 90 10.513 7.422 -10.058 1.00 0.00 H new ATOM 0 HE2 LYS A 90 10.848 8.020 -12.459 1.00 0.00 H new ATOM 0 HE3 LYS A 90 9.175 8.527 -12.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 10.634 10.403 -12.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 9.591 10.197 -10.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 11.212 9.705 -10.756 1.00 0.00 H new ATOM 1297 N GLU A 91 5.931 7.835 -9.217 1.00 0.00 N ATOM 1298 CA GLU A 91 4.706 8.575 -8.965 1.00 0.00 C ATOM 1299 C GLU A 91 4.071 9.015 -10.285 1.00 0.00 C ATOM 1300 O GLU A 91 4.774 9.386 -11.224 1.00 0.00 O ATOM 1301 CB GLU A 91 4.969 9.777 -8.056 1.00 0.00 C ATOM 1302 CG GLU A 91 5.850 9.383 -6.868 1.00 0.00 C ATOM 1303 CD GLU A 91 7.326 9.654 -7.167 1.00 0.00 C ATOM 1304 OE1 GLU A 91 7.602 10.736 -7.729 1.00 0.00 O ATOM 1305 OE2 GLU A 91 8.145 8.773 -6.827 1.00 0.00 O ATOM 0 H GLU A 91 6.779 8.401 -9.215 1.00 0.00 H new ATOM 0 HA GLU A 91 4.007 7.917 -8.449 1.00 0.00 H new ATOM 0 HB2 GLU A 91 5.454 10.569 -8.626 1.00 0.00 H new ATOM 0 HB3 GLU A 91 4.022 10.178 -7.694 1.00 0.00 H new ATOM 0 HG2 GLU A 91 5.546 9.943 -5.983 1.00 0.00 H new ATOM 0 HG3 GLU A 91 5.709 8.326 -6.641 1.00 0.00 H new ATOM 1312 N PRO A 92 2.712 8.958 -10.317 1.00 0.00 N ATOM 1313 CA PRO A 92 1.955 8.506 -9.161 1.00 0.00 C ATOM 1314 C PRO A 92 2.050 6.988 -9.003 1.00 0.00 C ATOM 1315 O PRO A 92 2.083 6.258 -9.992 1.00 0.00 O ATOM 1316 CB PRO A 92 0.536 8.991 -9.408 1.00 0.00 C ATOM 1317 CG PRO A 92 0.448 9.286 -10.896 1.00 0.00 C ATOM 1318 CD PRO A 92 1.864 9.320 -11.449 1.00 0.00 C ATOM 0 HA PRO A 92 2.340 8.904 -8.222 1.00 0.00 H new ATOM 0 HB2 PRO A 92 -0.192 8.234 -9.117 1.00 0.00 H new ATOM 0 HB3 PRO A 92 0.320 9.883 -8.820 1.00 0.00 H new ATOM 0 HG2 PRO A 92 -0.141 8.522 -11.402 1.00 0.00 H new ATOM 0 HG3 PRO A 92 -0.052 10.239 -11.067 1.00 0.00 H new ATOM 0 HD2 PRO A 92 1.984 8.618 -12.274 1.00 0.00 H new ATOM 0 HD3 PRO A 92 2.116 10.309 -11.832 1.00 0.00 H new ATOM 1326 N ILE A 93 2.091 6.557 -7.751 1.00 0.00 N ATOM 1327 CA ILE A 93 2.181 5.138 -7.450 1.00 0.00 C ATOM 1328 C ILE A 93 0.783 4.595 -7.151 1.00 0.00 C ATOM 1329 O ILE A 93 0.178 4.948 -6.140 1.00 0.00 O ATOM 1330 CB ILE A 93 3.190 4.892 -6.326 1.00 0.00 C ATOM 1331 CG1 ILE A 93 4.567 5.449 -6.693 1.00 0.00 C ATOM 1332 CG2 ILE A 93 3.251 3.408 -5.960 1.00 0.00 C ATOM 1333 CD1 ILE A 93 5.367 5.805 -5.439 1.00 0.00 C ATOM 0 H ILE A 93 2.064 7.166 -6.933 1.00 0.00 H new ATOM 0 HA ILE A 93 2.559 4.589 -8.312 1.00 0.00 H new ATOM 0 HB ILE A 93 2.852 5.429 -5.440 1.00 0.00 H new ATOM 0 HG12 ILE A 93 5.115 4.714 -7.282 1.00 0.00 H new ATOM 0 HG13 ILE A 93 4.450 6.335 -7.318 1.00 0.00 H new ATOM 0 HG21 ILE A 93 3.975 3.260 -5.159 1.00 0.00 H new ATOM 0 HG22 ILE A 93 2.268 3.075 -5.627 1.00 0.00 H new ATOM 0 HG23 ILE A 93 3.553 2.830 -6.833 1.00 0.00 H new ATOM 0 HD11 ILE A 93 6.341 6.198 -5.729 1.00 0.00 H new ATOM 0 HD12 ILE A 93 4.827 6.558 -4.865 1.00 0.00 H new ATOM 0 HD13 ILE A 93 5.503 4.912 -4.829 1.00 0.00 H new ATOM 1345 N VAL A 94 0.309 3.744 -8.049 1.00 0.00 N ATOM 1346 CA VAL A 94 -1.007 3.148 -7.894 1.00 0.00 C ATOM 1347 C VAL A 94 -0.906 1.931 -6.972 1.00 0.00 C ATOM 1348 O VAL A 94 -0.328 0.911 -7.346 1.00 0.00 O ATOM 1349 CB VAL A 94 -1.594 2.811 -9.267 1.00 0.00 C ATOM 1350 CG1 VAL A 94 -3.020 2.271 -9.136 1.00 0.00 C ATOM 1351 CG2 VAL A 94 -1.551 4.027 -10.194 1.00 0.00 C ATOM 0 H VAL A 94 0.813 3.453 -8.887 1.00 0.00 H new ATOM 0 HA VAL A 94 -1.693 3.854 -7.426 1.00 0.00 H new ATOM 0 HB VAL A 94 -0.979 2.028 -9.712 1.00 0.00 H new ATOM 0 HG11 VAL A 94 -3.414 2.039 -10.126 1.00 0.00 H new ATOM 0 HG12 VAL A 94 -3.012 1.366 -8.528 1.00 0.00 H new ATOM 0 HG13 VAL A 94 -3.651 3.022 -8.661 1.00 0.00 H new ATOM 0 HG21 VAL A 94 -1.974 3.761 -11.163 1.00 0.00 H new ATOM 0 HG22 VAL A 94 -2.131 4.839 -9.756 1.00 0.00 H new ATOM 0 HG23 VAL A 94 -0.518 4.348 -10.325 1.00 0.00 H new ATOM 1361 N VAL A 95 -1.478 2.078 -5.786 1.00 0.00 N ATOM 1362 CA VAL A 95 -1.459 1.003 -4.808 1.00 0.00 C ATOM 1363 C VAL A 95 -2.893 0.549 -4.529 1.00 0.00 C ATOM 1364 O VAL A 95 -3.830 1.339 -4.634 1.00 0.00 O ATOM 1365 CB VAL A 95 -0.719 1.455 -3.548 1.00 0.00 C ATOM 1366 CG1 VAL A 95 0.161 0.332 -2.996 1.00 0.00 C ATOM 1367 CG2 VAL A 95 0.106 2.715 -3.819 1.00 0.00 C ATOM 0 H VAL A 95 -1.957 2.925 -5.480 1.00 0.00 H new ATOM 0 HA VAL A 95 -0.915 0.142 -5.197 1.00 0.00 H new ATOM 0 HB VAL A 95 -1.465 1.699 -2.791 1.00 0.00 H new ATOM 0 HG11 VAL A 95 0.676 0.680 -2.100 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -0.461 -0.528 -2.746 1.00 0.00 H new ATOM 0 HG13 VAL A 95 0.896 0.043 -3.747 1.00 0.00 H new ATOM 0 HG21 VAL A 95 0.622 3.015 -2.907 1.00 0.00 H new ATOM 0 HG22 VAL A 95 0.839 2.509 -4.600 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -0.554 3.519 -4.144 1.00 0.00 H new ATOM 1377 N GLN A 96 -3.020 -0.722 -4.178 1.00 0.00 N ATOM 1378 CA GLN A 96 -4.324 -1.291 -3.882 1.00 0.00 C ATOM 1379 C GLN A 96 -4.265 -2.111 -2.592 1.00 0.00 C ATOM 1380 O GLN A 96 -3.269 -2.781 -2.323 1.00 0.00 O ATOM 1381 CB GLN A 96 -4.829 -2.140 -5.050 1.00 0.00 C ATOM 1382 CG GLN A 96 -6.094 -2.909 -4.662 1.00 0.00 C ATOM 1383 CD GLN A 96 -7.143 -2.835 -5.773 1.00 0.00 C ATOM 1384 OE1 GLN A 96 -6.953 -3.320 -6.876 1.00 0.00 O ATOM 1385 NE2 GLN A 96 -8.259 -2.202 -5.421 1.00 0.00 N ATOM 0 H GLN A 96 -2.241 -1.375 -4.092 1.00 0.00 H new ATOM 0 HA GLN A 96 -5.031 -0.474 -3.737 1.00 0.00 H new ATOM 0 HB2 GLN A 96 -5.037 -1.499 -5.907 1.00 0.00 H new ATOM 0 HB3 GLN A 96 -4.053 -2.841 -5.357 1.00 0.00 H new ATOM 0 HG2 GLN A 96 -5.844 -3.951 -4.462 1.00 0.00 H new ATOM 0 HG3 GLN A 96 -6.506 -2.498 -3.740 1.00 0.00 H new ATOM 0 HE21 GLN A 96 -8.353 -1.819 -4.480 1.00 0.00 H new ATOM 0 HE22 GLN A 96 -9.020 -2.100 -6.092 1.00 0.00 H new ATOM 1394 N VAL A 97 -5.345 -2.032 -1.828 1.00 0.00 N ATOM 1395 CA VAL A 97 -5.429 -2.760 -0.573 1.00 0.00 C ATOM 1396 C VAL A 97 -6.718 -3.583 -0.551 1.00 0.00 C ATOM 1397 O VAL A 97 -7.614 -3.363 -1.365 1.00 0.00 O ATOM 1398 CB VAL A 97 -5.320 -1.787 0.603 1.00 0.00 C ATOM 1399 CG1 VAL A 97 -3.931 -1.147 0.659 1.00 0.00 C ATOM 1400 CG2 VAL A 97 -6.413 -0.719 0.535 1.00 0.00 C ATOM 0 H VAL A 97 -6.169 -1.475 -2.054 1.00 0.00 H new ATOM 0 HA VAL A 97 -4.597 -3.458 -0.479 1.00 0.00 H new ATOM 0 HB VAL A 97 -5.464 -2.356 1.522 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -3.881 -0.460 1.504 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -3.177 -1.925 0.778 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -3.745 -0.600 -0.265 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -6.312 -0.041 1.382 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -6.315 -0.157 -0.394 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -7.392 -1.198 0.568 1.00 0.00 H new ATOM 1410 N LEU A 98 -6.771 -4.515 0.390 1.00 0.00 N ATOM 1411 CA LEU A 98 -7.936 -5.372 0.529 1.00 0.00 C ATOM 1412 C LEU A 98 -8.628 -5.073 1.860 1.00 0.00 C ATOM 1413 O LEU A 98 -8.027 -5.223 2.923 1.00 0.00 O ATOM 1414 CB LEU A 98 -7.544 -6.841 0.355 1.00 0.00 C ATOM 1415 CG LEU A 98 -7.684 -7.410 -1.058 1.00 0.00 C ATOM 1416 CD1 LEU A 98 -7.143 -8.840 -1.129 1.00 0.00 C ATOM 1417 CD2 LEU A 98 -9.131 -7.320 -1.544 1.00 0.00 C ATOM 0 H LEU A 98 -6.026 -4.695 1.063 1.00 0.00 H new ATOM 0 HA LEU A 98 -8.659 -5.164 -0.260 1.00 0.00 H new ATOM 0 HB2 LEU A 98 -6.508 -6.960 0.672 1.00 0.00 H new ATOM 0 HB3 LEU A 98 -8.155 -7.442 1.029 1.00 0.00 H new ATOM 0 HG LEU A 98 -7.080 -6.803 -1.732 1.00 0.00 H new ATOM 0 HD11 LEU A 98 -7.254 -9.221 -2.144 1.00 0.00 H new ATOM 0 HD12 LEU A 98 -6.088 -8.844 -0.854 1.00 0.00 H new ATOM 0 HD13 LEU A 98 -7.700 -9.475 -0.440 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -9.203 -7.731 -2.551 1.00 0.00 H new ATOM 0 HD22 LEU A 98 -9.776 -7.888 -0.873 1.00 0.00 H new ATOM 0 HD23 LEU A 98 -9.447 -6.277 -1.555 1.00 0.00 H new ATOM 1429 N ARG A 99 -9.881 -4.657 1.759 1.00 0.00 N ATOM 1430 CA ARG A 99 -10.661 -4.336 2.942 1.00 0.00 C ATOM 1431 C ARG A 99 -11.961 -5.143 2.956 1.00 0.00 C ATOM 1432 O ARG A 99 -12.612 -5.297 1.924 1.00 0.00 O ATOM 1433 CB ARG A 99 -10.996 -2.843 2.993 1.00 0.00 C ATOM 1434 CG ARG A 99 -9.811 -2.034 3.523 1.00 0.00 C ATOM 1435 CD ARG A 99 -10.262 -0.652 4.001 1.00 0.00 C ATOM 1436 NE ARG A 99 -9.285 0.375 3.574 1.00 0.00 N ATOM 1437 CZ ARG A 99 -9.533 1.692 3.570 1.00 0.00 C ATOM 1438 NH1 ARG A 99 -10.727 2.150 3.970 1.00 0.00 N ATOM 1439 NH2 ARG A 99 -8.587 2.550 3.165 1.00 0.00 N ATOM 0 H ARG A 99 -10.376 -4.535 0.876 1.00 0.00 H new ATOM 0 HA ARG A 99 -10.060 -4.592 3.814 1.00 0.00 H new ATOM 0 HB2 ARG A 99 -11.264 -2.492 1.996 1.00 0.00 H new ATOM 0 HB3 ARG A 99 -11.865 -2.683 3.631 1.00 0.00 H new ATOM 0 HG2 ARG A 99 -9.338 -2.571 4.345 1.00 0.00 H new ATOM 0 HG3 ARG A 99 -9.061 -1.925 2.740 1.00 0.00 H new ATOM 0 HD2 ARG A 99 -11.246 -0.421 3.594 1.00 0.00 H new ATOM 0 HD3 ARG A 99 -10.357 -0.647 5.087 1.00 0.00 H new ATOM 0 HE ARG A 99 -8.366 0.061 3.263 1.00 0.00 H new ATOM 0 HH11 ARG A 99 -11.447 1.496 4.278 1.00 0.00 H new ATOM 0 HH12 ARG A 99 -10.916 3.152 3.967 1.00 0.00 H new ATOM 0 HH21 ARG A 99 -7.679 2.201 2.860 1.00 0.00 H new ATOM 0 HH22 ARG A 99 -8.775 3.552 3.162 1.00 0.00 H new ATOM 1453 N ARG A 100 -12.299 -5.638 4.138 1.00 0.00 N ATOM 1454 CA ARG A 100 -13.509 -6.427 4.300 1.00 0.00 C ATOM 1455 C ARG A 100 -14.718 -5.661 3.758 1.00 0.00 C ATOM 1456 O ARG A 100 -14.566 -4.599 3.157 1.00 0.00 O ATOM 1457 CB ARG A 100 -13.749 -6.770 5.772 1.00 0.00 C ATOM 1458 CG ARG A 100 -14.052 -5.511 6.586 1.00 0.00 C ATOM 1459 CD ARG A 100 -12.920 -5.208 7.569 1.00 0.00 C ATOM 1460 NE ARG A 100 -12.136 -4.045 7.096 1.00 0.00 N ATOM 1461 CZ ARG A 100 -11.002 -3.620 7.670 1.00 0.00 C ATOM 1462 NH1 ARG A 100 -10.512 -4.259 8.740 1.00 0.00 N ATOM 1463 NH2 ARG A 100 -10.358 -2.555 7.172 1.00 0.00 N ATOM 0 H ARG A 100 -11.757 -5.508 4.992 1.00 0.00 H new ATOM 0 HA ARG A 100 -13.380 -7.353 3.739 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -14.580 -7.470 5.855 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -12.870 -7.269 6.181 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -14.191 -4.664 5.914 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -14.987 -5.642 7.131 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -13.331 -5.002 8.557 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -12.271 -6.078 7.669 1.00 0.00 H new ATOM 0 HE ARG A 100 -12.480 -3.535 6.282 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -11.002 -5.070 9.119 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -9.649 -3.935 9.176 1.00 0.00 H new ATOM 0 HH21 ARG A 100 -10.731 -2.069 6.357 1.00 0.00 H new ATOM 0 HH22 ARG A 100 -9.495 -2.231 7.608 1.00 0.00 H new ATOM 1477 N THR A 101 -15.891 -6.231 3.990 1.00 0.00 N ATOM 1478 CA THR A 101 -17.125 -5.616 3.533 1.00 0.00 C ATOM 1479 C THR A 101 -17.755 -4.787 4.654 1.00 0.00 C ATOM 1480 O THR A 101 -17.975 -5.290 5.755 1.00 0.00 O ATOM 1481 CB THR A 101 -18.041 -6.724 3.009 1.00 0.00 C ATOM 1482 OG1 THR A 101 -19.166 -6.026 2.484 1.00 0.00 O ATOM 1483 CG2 THR A 101 -18.625 -7.581 4.134 1.00 0.00 C ATOM 0 H THR A 101 -16.013 -7.112 4.489 1.00 0.00 H new ATOM 0 HA THR A 101 -16.939 -4.916 2.718 1.00 0.00 H new ATOM 0 HB THR A 101 -17.484 -7.359 2.320 1.00 0.00 H new ATOM 0 HG1 THR A 101 -19.810 -6.669 2.121 1.00 0.00 H new ATOM 0 HG21 THR A 101 -19.267 -8.352 3.708 1.00 0.00 H new ATOM 0 HG22 THR A 101 -17.815 -8.051 4.691 1.00 0.00 H new ATOM 0 HG23 THR A 101 -19.210 -6.952 4.805 1.00 0.00 H new ATOM 1491 N SER A 102 -18.028 -3.530 4.335 1.00 0.00 N ATOM 1492 CA SER A 102 -18.629 -2.626 5.302 1.00 0.00 C ATOM 1493 C SER A 102 -17.750 -2.537 6.551 1.00 0.00 C ATOM 1494 O SER A 102 -17.930 -3.301 7.497 1.00 0.00 O ATOM 1495 CB SER A 102 -20.040 -3.080 5.677 1.00 0.00 C ATOM 1496 OG SER A 102 -21.019 -2.596 4.761 1.00 0.00 O ATOM 0 H SER A 102 -17.844 -3.116 3.421 1.00 0.00 H new ATOM 0 HA SER A 102 -18.704 -1.638 4.847 1.00 0.00 H new ATOM 0 HB2 SER A 102 -20.075 -4.169 5.703 1.00 0.00 H new ATOM 0 HB3 SER A 102 -20.279 -2.729 6.681 1.00 0.00 H new ATOM 0 HG SER A 102 -21.906 -2.909 5.035 1.00 0.00 H new ATOM 1502 N GLY A 103 -16.817 -1.597 6.513 1.00 0.00 N ATOM 1503 CA GLY A 103 -15.909 -1.398 7.630 1.00 0.00 C ATOM 1504 C GLY A 103 -16.657 -0.872 8.857 1.00 0.00 C ATOM 1505 O GLY A 103 -17.886 -0.896 8.897 1.00 0.00 O ATOM 0 H GLY A 103 -16.670 -0.965 5.726 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -15.417 -2.339 7.875 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -15.127 -0.694 7.347 1.00 0.00 H new ATOM 1509 N PRO A 104 -15.863 -0.396 9.853 1.00 0.00 N ATOM 1510 CA PRO A 104 -16.437 0.135 11.078 1.00 0.00 C ATOM 1511 C PRO A 104 -17.037 1.524 10.846 1.00 0.00 C ATOM 1512 O PRO A 104 -16.646 2.224 9.913 1.00 0.00 O ATOM 1513 CB PRO A 104 -15.292 0.143 12.078 1.00 0.00 C ATOM 1514 CG PRO A 104 -14.018 0.056 11.254 1.00 0.00 C ATOM 1515 CD PRO A 104 -14.404 -0.351 9.841 1.00 0.00 C ATOM 0 HA PRO A 104 -17.268 -0.466 11.448 1.00 0.00 H new ATOM 0 HB2 PRO A 104 -15.306 1.051 12.680 1.00 0.00 H new ATOM 0 HB3 PRO A 104 -15.370 -0.698 12.767 1.00 0.00 H new ATOM 0 HG2 PRO A 104 -13.501 1.016 11.247 1.00 0.00 H new ATOM 0 HG3 PRO A 104 -13.332 -0.672 11.687 1.00 0.00 H new ATOM 0 HD2 PRO A 104 -14.036 0.367 9.108 1.00 0.00 H new ATOM 0 HD3 PRO A 104 -13.980 -1.320 9.579 1.00 0.00 H new ATOM 1523 N SER A 105 -17.976 1.880 11.710 1.00 0.00 N ATOM 1524 CA SER A 105 -18.633 3.171 11.610 1.00 0.00 C ATOM 1525 C SER A 105 -18.585 3.889 12.961 1.00 0.00 C ATOM 1526 O SER A 105 -17.989 4.959 13.078 1.00 0.00 O ATOM 1527 CB SER A 105 -20.082 3.018 11.143 1.00 0.00 C ATOM 1528 OG SER A 105 -20.247 3.399 9.780 1.00 0.00 O ATOM 0 H SER A 105 -18.297 1.296 12.482 1.00 0.00 H new ATOM 0 HA SER A 105 -18.102 3.768 10.869 1.00 0.00 H new ATOM 0 HB2 SER A 105 -20.396 1.982 11.270 1.00 0.00 H new ATOM 0 HB3 SER A 105 -20.732 3.628 11.771 1.00 0.00 H new ATOM 0 HG SER A 105 -21.185 3.285 9.520 1.00 0.00 H new ATOM 1534 N SER A 106 -19.219 3.271 13.946 1.00 0.00 N ATOM 1535 CA SER A 106 -19.255 3.837 15.284 1.00 0.00 C ATOM 1536 C SER A 106 -20.062 5.137 15.280 1.00 0.00 C ATOM 1537 O SER A 106 -20.353 5.688 14.220 1.00 0.00 O ATOM 1538 CB SER A 106 -17.843 4.091 15.813 1.00 0.00 C ATOM 1539 OG SER A 106 -17.770 3.953 17.230 1.00 0.00 O ATOM 0 H SER A 106 -19.712 2.384 13.845 1.00 0.00 H new ATOM 0 HA SER A 106 -19.738 3.119 15.946 1.00 0.00 H new ATOM 0 HB2 SER A 106 -17.149 3.393 15.345 1.00 0.00 H new ATOM 0 HB3 SER A 106 -17.525 5.094 15.530 1.00 0.00 H new ATOM 0 HG SER A 106 -16.852 4.121 17.528 1.00 0.00 H new ATOM 1545 N GLY A 107 -20.402 5.589 16.479 1.00 0.00 N ATOM 1546 CA GLY A 107 -21.169 6.813 16.627 1.00 0.00 C ATOM 1547 C GLY A 107 -22.623 6.508 16.992 1.00 0.00 C ATOM 1548 O GLY A 107 -23.523 6.689 16.173 1.00 0.00 O ATOM 0 H GLY A 107 -20.160 5.129 17.356 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -20.720 7.437 17.400 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -21.135 7.382 15.698 1.00 0.00 H new TER 1552 GLY A 107