USER MOD reduce.3.24.130724 H: found=0, std=0, add=798, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 795 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 180:sc= 0 USER MOD Single : A 6 SER OG : rot 35:sc= 0.713 USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 GLN :FLIP amide:sc= -0.125 F(o=-1.4,f=-0.13) USER MOD Single : A 17 ASN : amide:sc= -1.11 K(o=-1.1,f=-2.3) USER MOD Single : A 18 THR OG1 : rot 98:sc= -0.422 USER MOD Single : A 20 TYR OH : rot 180:sc= -0.959 USER MOD Single : A 22 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0 USER MOD Single : A 31 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 TYR OH : rot 180:sc= -0.0163 USER MOD Single : A 35 SER OG : rot 180:sc= 0.0712 USER MOD Single : A 36 LYS NZ :NH3+ -166:sc= -1.37 (180deg=-1.52) USER MOD Single : A 39 MET CE :methyl -148:sc= 0 (180deg=-0.192) USER MOD Single : A 40 HIS :FLIP no HD1:sc= -6.3! C(o=-7.5!,f=-6.3!) USER MOD Single : A 54 SER OG : rot 180:sc= 0 USER MOD Single : A 59 ASN :FLIP amide:sc= -0.185 F(o=-1.2,f=-0.18) USER MOD Single : A 60 CYS SG : rot 180:sc= 0 USER MOD Single : A 65 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 73 SER OG : rot 180:sc= -1.32 USER MOD Single : A 74 ASN : amide:sc= -0.178 K(o=-0.18,f=-2.3!) USER MOD Single : A 75 SER OG : rot 180:sc= 0 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.053) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 THR OG1 : rot 16:sc= 0.741 USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 94 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 98 SER OG : rot 17:sc= 1.47 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -2.516 19.991 -11.645 1.00 0.00 N ATOM 2 CA GLY A 1 -1.472 19.782 -10.655 1.00 0.00 C ATOM 3 C GLY A 1 -0.639 18.543 -10.990 1.00 0.00 C ATOM 4 O GLY A 1 -0.850 17.475 -10.416 1.00 0.00 O ATOM 0 H1 GLY A 1 -3.067 20.837 -11.395 1.00 0.00 H new ATOM 0 H2 GLY A 1 -2.084 20.123 -12.582 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.145 19.163 -11.667 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.826 20.659 -10.612 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -1.920 19.668 -9.668 1.00 0.00 H new ATOM 8 N SER A 2 0.289 18.726 -11.917 1.00 0.00 N ATOM 9 CA SER A 2 1.155 17.637 -12.335 1.00 0.00 C ATOM 10 C SER A 2 2.453 18.195 -12.921 1.00 0.00 C ATOM 11 O SER A 2 2.461 19.283 -13.496 1.00 0.00 O ATOM 12 CB SER A 2 0.455 16.737 -13.355 1.00 0.00 C ATOM 13 OG SER A 2 0.990 15.417 -13.359 1.00 0.00 O ATOM 0 H SER A 2 0.460 19.613 -12.391 1.00 0.00 H new ATOM 0 HA SER A 2 1.391 17.032 -11.459 1.00 0.00 H new ATOM 0 HB2 SER A 2 -0.611 16.695 -13.130 1.00 0.00 H new ATOM 0 HB3 SER A 2 0.554 17.171 -14.350 1.00 0.00 H new ATOM 0 HG SER A 2 0.515 14.874 -14.022 1.00 0.00 H new ATOM 19 N SER A 3 3.519 17.425 -12.757 1.00 0.00 N ATOM 20 CA SER A 3 4.819 17.829 -13.263 1.00 0.00 C ATOM 21 C SER A 3 5.386 16.742 -14.178 1.00 0.00 C ATOM 22 O SER A 3 6.158 15.893 -13.735 1.00 0.00 O ATOM 23 CB SER A 3 5.791 18.118 -12.117 1.00 0.00 C ATOM 24 OG SER A 3 6.017 19.515 -11.947 1.00 0.00 O ATOM 0 H SER A 3 3.508 16.523 -12.281 1.00 0.00 H new ATOM 0 HA SER A 3 4.692 18.747 -13.836 1.00 0.00 H new ATOM 0 HB2 SER A 3 5.395 17.700 -11.192 1.00 0.00 H new ATOM 0 HB3 SER A 3 6.740 17.618 -12.312 1.00 0.00 H new ATOM 0 HG SER A 3 6.641 19.657 -11.205 1.00 0.00 H new ATOM 30 N GLY A 4 4.980 16.803 -15.438 1.00 0.00 N ATOM 31 CA GLY A 4 5.437 15.834 -16.419 1.00 0.00 C ATOM 32 C GLY A 4 4.646 14.529 -16.311 1.00 0.00 C ATOM 33 O GLY A 4 3.731 14.419 -15.496 1.00 0.00 O ATOM 0 H GLY A 4 4.340 17.509 -15.802 1.00 0.00 H new ATOM 0 HA2 GLY A 4 5.328 16.247 -17.422 1.00 0.00 H new ATOM 0 HA3 GLY A 4 6.498 15.634 -16.270 1.00 0.00 H new ATOM 37 N SER A 5 5.028 13.572 -17.144 1.00 0.00 N ATOM 38 CA SER A 5 4.366 12.278 -17.152 1.00 0.00 C ATOM 39 C SER A 5 4.441 11.643 -15.762 1.00 0.00 C ATOM 40 O SER A 5 5.467 11.731 -15.090 1.00 0.00 O ATOM 41 CB SER A 5 4.987 11.348 -18.195 1.00 0.00 C ATOM 42 OG SER A 5 4.394 10.052 -18.176 1.00 0.00 O ATOM 0 H SER A 5 5.788 13.667 -17.818 1.00 0.00 H new ATOM 0 HA SER A 5 3.320 12.431 -17.418 1.00 0.00 H new ATOM 0 HB2 SER A 5 4.870 11.786 -19.186 1.00 0.00 H new ATOM 0 HB3 SER A 5 6.058 11.260 -18.010 1.00 0.00 H new ATOM 0 HG SER A 5 4.817 9.489 -18.857 1.00 0.00 H new ATOM 48 N SER A 6 3.340 11.017 -15.372 1.00 0.00 N ATOM 49 CA SER A 6 3.269 10.367 -14.074 1.00 0.00 C ATOM 50 C SER A 6 4.239 9.185 -14.027 1.00 0.00 C ATOM 51 O SER A 6 3.819 8.031 -14.093 1.00 0.00 O ATOM 52 CB SER A 6 1.844 9.898 -13.771 1.00 0.00 C ATOM 53 OG SER A 6 1.516 8.702 -14.472 1.00 0.00 O ATOM 0 H SER A 6 2.490 10.946 -15.932 1.00 0.00 H new ATOM 0 HA SER A 6 3.554 11.092 -13.312 1.00 0.00 H new ATOM 0 HB2 SER A 6 1.737 9.731 -12.699 1.00 0.00 H new ATOM 0 HB3 SER A 6 1.138 10.683 -14.043 1.00 0.00 H new ATOM 0 HG SER A 6 2.313 8.137 -14.547 1.00 0.00 H new ATOM 59 N GLY A 7 5.517 9.514 -13.913 1.00 0.00 N ATOM 60 CA GLY A 7 6.550 8.493 -13.856 1.00 0.00 C ATOM 61 C GLY A 7 6.522 7.759 -12.514 1.00 0.00 C ATOM 62 O GLY A 7 7.281 6.814 -12.304 1.00 0.00 O ATOM 0 H GLY A 7 5.861 10.473 -13.859 1.00 0.00 H new ATOM 0 HA2 GLY A 7 6.407 7.780 -14.668 1.00 0.00 H new ATOM 0 HA3 GLY A 7 7.528 8.951 -14.004 1.00 0.00 H new ATOM 66 N LEU A 8 5.638 8.221 -11.642 1.00 0.00 N ATOM 67 CA LEU A 8 5.501 7.619 -10.326 1.00 0.00 C ATOM 68 C LEU A 8 5.115 6.147 -10.481 1.00 0.00 C ATOM 69 O LEU A 8 5.633 5.288 -9.769 1.00 0.00 O ATOM 70 CB LEU A 8 4.522 8.424 -9.469 1.00 0.00 C ATOM 71 CG LEU A 8 4.744 9.938 -9.439 1.00 0.00 C ATOM 72 CD1 LEU A 8 3.593 10.647 -8.723 1.00 0.00 C ATOM 73 CD2 LEU A 8 6.102 10.281 -8.822 1.00 0.00 C ATOM 0 H LEU A 8 5.010 9.005 -11.820 1.00 0.00 H new ATOM 0 HA LEU A 8 6.452 7.645 -9.794 1.00 0.00 H new ATOM 0 HB2 LEU A 8 3.512 8.232 -9.830 1.00 0.00 H new ATOM 0 HB3 LEU A 8 4.572 8.049 -8.447 1.00 0.00 H new ATOM 0 HG LEU A 8 4.756 10.302 -10.466 1.00 0.00 H new ATOM 0 HD11 LEU A 8 3.776 11.722 -8.716 1.00 0.00 H new ATOM 0 HD12 LEU A 8 2.658 10.441 -9.245 1.00 0.00 H new ATOM 0 HD13 LEU A 8 3.524 10.284 -7.698 1.00 0.00 H new ATOM 0 HD21 LEU A 8 6.235 11.363 -8.813 1.00 0.00 H new ATOM 0 HD22 LEU A 8 6.144 9.901 -7.801 1.00 0.00 H new ATOM 0 HD23 LEU A 8 6.896 9.823 -9.412 1.00 0.00 H new ATOM 85 N ARG A 9 4.209 5.901 -11.416 1.00 0.00 N ATOM 86 CA ARG A 9 3.748 4.547 -11.673 1.00 0.00 C ATOM 87 C ARG A 9 4.911 3.559 -11.558 1.00 0.00 C ATOM 88 O ARG A 9 4.883 2.656 -10.724 1.00 0.00 O ATOM 89 CB ARG A 9 3.126 4.432 -13.066 1.00 0.00 C ATOM 90 CG ARG A 9 1.929 5.374 -13.211 1.00 0.00 C ATOM 91 CD ARG A 9 0.886 4.791 -14.167 1.00 0.00 C ATOM 92 NE ARG A 9 1.036 5.396 -15.510 1.00 0.00 N ATOM 93 CZ ARG A 9 1.918 4.977 -16.428 1.00 0.00 C ATOM 94 NH1 ARG A 9 2.733 3.950 -16.154 1.00 0.00 N ATOM 95 NH2 ARG A 9 1.984 5.586 -17.620 1.00 0.00 N ATOM 0 H ARG A 9 3.782 6.616 -12.005 1.00 0.00 H new ATOM 0 HA ARG A 9 2.989 4.308 -10.928 1.00 0.00 H new ATOM 0 HB2 ARG A 9 3.874 4.669 -13.823 1.00 0.00 H new ATOM 0 HB3 ARG A 9 2.808 3.404 -13.243 1.00 0.00 H new ATOM 0 HG2 ARG A 9 1.477 5.546 -12.234 1.00 0.00 H new ATOM 0 HG3 ARG A 9 2.266 6.342 -13.581 1.00 0.00 H new ATOM 0 HD2 ARG A 9 1.004 3.709 -14.231 1.00 0.00 H new ATOM 0 HD3 ARG A 9 -0.117 4.980 -13.784 1.00 0.00 H new ATOM 0 HE ARG A 9 0.430 6.180 -15.752 1.00 0.00 H new ATOM 0 HH11 ARG A 9 2.682 3.487 -15.247 1.00 0.00 H new ATOM 0 HH12 ARG A 9 3.404 3.631 -16.853 1.00 0.00 H new ATOM 0 HH21 ARG A 9 1.363 6.368 -17.828 1.00 0.00 H new ATOM 0 HH22 ARG A 9 2.655 5.267 -18.319 1.00 0.00 H new ATOM 109 N LYS A 10 5.906 3.765 -12.409 1.00 0.00 N ATOM 110 CA LYS A 10 7.077 2.904 -12.413 1.00 0.00 C ATOM 111 C LYS A 10 7.659 2.834 -11.000 1.00 0.00 C ATOM 112 O LYS A 10 7.886 1.747 -10.472 1.00 0.00 O ATOM 113 CB LYS A 10 8.081 3.371 -13.469 1.00 0.00 C ATOM 114 CG LYS A 10 7.481 3.280 -14.874 1.00 0.00 C ATOM 115 CD LYS A 10 7.405 1.826 -15.345 1.00 0.00 C ATOM 116 CE LYS A 10 7.766 1.710 -16.827 1.00 0.00 C ATOM 117 NZ LYS A 10 6.559 1.873 -17.668 1.00 0.00 N ATOM 0 H LYS A 10 5.925 4.515 -13.100 1.00 0.00 H new ATOM 0 HA LYS A 10 6.801 1.888 -12.695 1.00 0.00 H new ATOM 0 HB2 LYS A 10 8.379 4.399 -13.263 1.00 0.00 H new ATOM 0 HB3 LYS A 10 8.982 2.760 -13.414 1.00 0.00 H new ATOM 0 HG2 LYS A 10 6.483 3.719 -14.876 1.00 0.00 H new ATOM 0 HG3 LYS A 10 8.087 3.860 -15.570 1.00 0.00 H new ATOM 0 HD2 LYS A 10 8.084 1.212 -14.753 1.00 0.00 H new ATOM 0 HD3 LYS A 10 6.399 1.439 -15.181 1.00 0.00 H new ATOM 0 HE2 LYS A 10 8.504 2.469 -17.088 1.00 0.00 H new ATOM 0 HE3 LYS A 10 8.224 0.740 -17.021 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 6.821 1.792 -18.671 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 5.867 1.134 -17.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 6.139 2.809 -17.495 1.00 0.00 H new ATOM 131 N GLN A 11 7.883 4.008 -10.428 1.00 0.00 N ATOM 132 CA GLN A 11 8.434 4.094 -9.086 1.00 0.00 C ATOM 133 C GLN A 11 7.638 3.205 -8.128 1.00 0.00 C ATOM 134 O GLN A 11 8.213 2.380 -7.420 1.00 0.00 O ATOM 135 CB GLN A 11 8.461 5.543 -8.596 1.00 0.00 C ATOM 136 CG GLN A 11 9.007 6.477 -9.677 1.00 0.00 C ATOM 137 CD GLN A 11 9.727 7.675 -9.054 1.00 0.00 C ATOM 138 OE1 GLN A 11 9.159 8.847 -9.322 1.00 0.00 O flip ATOM 139 NE2 GLN A 11 10.732 7.543 -8.375 1.00 0.00 N flip ATOM 0 H GLN A 11 7.693 4.908 -10.869 1.00 0.00 H new ATOM 0 HA GLN A 11 9.463 3.736 -9.113 1.00 0.00 H new ATOM 0 HB2 GLN A 11 7.455 5.855 -8.315 1.00 0.00 H new ATOM 0 HB3 GLN A 11 9.079 5.617 -7.701 1.00 0.00 H new ATOM 0 HG2 GLN A 11 9.695 5.930 -10.322 1.00 0.00 H new ATOM 0 HG3 GLN A 11 8.189 6.827 -10.307 1.00 0.00 H new ATOM 0 HE21 GLN A 11 11.116 6.613 -8.208 1.00 0.00 H new ATOM 0 HE22 GLN A 11 11.188 8.363 -7.974 1.00 0.00 H new ATOM 148 N VAL A 12 6.329 3.404 -8.137 1.00 0.00 N ATOM 149 CA VAL A 12 5.448 2.631 -7.278 1.00 0.00 C ATOM 150 C VAL A 12 5.745 1.141 -7.459 1.00 0.00 C ATOM 151 O VAL A 12 5.970 0.426 -6.484 1.00 0.00 O ATOM 152 CB VAL A 12 3.989 2.990 -7.565 1.00 0.00 C ATOM 153 CG1 VAL A 12 3.038 2.116 -6.744 1.00 0.00 C ATOM 154 CG2 VAL A 12 3.729 4.475 -7.309 1.00 0.00 C ATOM 0 H VAL A 12 5.856 4.090 -8.726 1.00 0.00 H new ATOM 0 HA VAL A 12 5.627 2.873 -6.230 1.00 0.00 H new ATOM 0 HB VAL A 12 3.797 2.794 -8.620 1.00 0.00 H new ATOM 0 HG11 VAL A 12 2.007 2.391 -6.967 1.00 0.00 H new ATOM 0 HG12 VAL A 12 3.196 1.068 -6.998 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.232 2.265 -5.682 1.00 0.00 H new ATOM 0 HG21 VAL A 12 2.684 4.703 -7.521 1.00 0.00 H new ATOM 0 HG22 VAL A 12 3.947 4.708 -6.267 1.00 0.00 H new ATOM 0 HG23 VAL A 12 4.370 5.073 -7.957 1.00 0.00 H new ATOM 164 N GLU A 13 5.735 0.717 -8.714 1.00 0.00 N ATOM 165 CA GLU A 13 6.000 -0.675 -9.036 1.00 0.00 C ATOM 166 C GLU A 13 7.212 -1.180 -8.251 1.00 0.00 C ATOM 167 O GLU A 13 7.128 -2.190 -7.554 1.00 0.00 O ATOM 168 CB GLU A 13 6.205 -0.860 -10.541 1.00 0.00 C ATOM 169 CG GLU A 13 4.969 -0.412 -11.322 1.00 0.00 C ATOM 170 CD GLU A 13 4.789 -1.248 -12.591 1.00 0.00 C ATOM 171 OE1 GLU A 13 5.093 -2.458 -12.521 1.00 0.00 O ATOM 172 OE2 GLU A 13 4.352 -0.657 -13.602 1.00 0.00 O ATOM 0 H GLU A 13 5.548 1.313 -9.520 1.00 0.00 H new ATOM 0 HA GLU A 13 5.132 -1.267 -8.746 1.00 0.00 H new ATOM 0 HB2 GLU A 13 7.073 -0.286 -10.867 1.00 0.00 H new ATOM 0 HB3 GLU A 13 6.416 -1.907 -10.757 1.00 0.00 H new ATOM 0 HG2 GLU A 13 4.084 -0.504 -10.693 1.00 0.00 H new ATOM 0 HG3 GLU A 13 5.064 0.641 -11.586 1.00 0.00 H new ATOM 179 N LEU A 14 8.311 -0.453 -8.390 1.00 0.00 N ATOM 180 CA LEU A 14 9.539 -0.815 -7.702 1.00 0.00 C ATOM 181 C LEU A 14 9.264 -0.926 -6.201 1.00 0.00 C ATOM 182 O LEU A 14 9.673 -1.894 -5.562 1.00 0.00 O ATOM 183 CB LEU A 14 10.658 0.169 -8.051 1.00 0.00 C ATOM 184 CG LEU A 14 12.048 -0.177 -7.511 1.00 0.00 C ATOM 185 CD1 LEU A 14 12.493 -1.560 -7.989 1.00 0.00 C ATOM 186 CD2 LEU A 14 13.063 0.909 -7.874 1.00 0.00 C ATOM 0 H LEU A 14 8.377 0.385 -8.968 1.00 0.00 H new ATOM 0 HA LEU A 14 9.889 -1.792 -8.035 1.00 0.00 H new ATOM 0 HB2 LEU A 14 10.721 0.247 -9.136 1.00 0.00 H new ATOM 0 HB3 LEU A 14 10.379 1.154 -7.676 1.00 0.00 H new ATOM 0 HG LEU A 14 11.992 -0.215 -6.423 1.00 0.00 H new ATOM 0 HD11 LEU A 14 13.483 -1.781 -7.591 1.00 0.00 H new ATOM 0 HD12 LEU A 14 11.785 -2.311 -7.639 1.00 0.00 H new ATOM 0 HD13 LEU A 14 12.528 -1.575 -9.078 1.00 0.00 H new ATOM 0 HD21 LEU A 14 14.042 0.639 -7.479 1.00 0.00 H new ATOM 0 HD22 LEU A 14 13.123 1.003 -8.958 1.00 0.00 H new ATOM 0 HD23 LEU A 14 12.748 1.860 -7.444 1.00 0.00 H new ATOM 198 N LEU A 15 8.574 0.079 -5.682 1.00 0.00 N ATOM 199 CA LEU A 15 8.239 0.106 -4.268 1.00 0.00 C ATOM 200 C LEU A 15 7.501 -1.183 -3.898 1.00 0.00 C ATOM 201 O LEU A 15 7.997 -1.980 -3.104 1.00 0.00 O ATOM 202 CB LEU A 15 7.463 1.379 -3.926 1.00 0.00 C ATOM 203 CG LEU A 15 6.821 1.420 -2.537 1.00 0.00 C ATOM 204 CD1 LEU A 15 7.878 1.285 -1.440 1.00 0.00 C ATOM 205 CD2 LEU A 15 5.972 2.681 -2.363 1.00 0.00 C ATOM 0 H LEU A 15 8.238 0.881 -6.215 1.00 0.00 H new ATOM 0 HA LEU A 15 9.145 0.140 -3.662 1.00 0.00 H new ATOM 0 HB2 LEU A 15 8.139 2.229 -4.017 1.00 0.00 H new ATOM 0 HB3 LEU A 15 6.679 1.514 -4.671 1.00 0.00 H new ATOM 0 HG LEU A 15 6.151 0.565 -2.445 1.00 0.00 H new ATOM 0 HD11 LEU A 15 7.395 1.317 -0.463 1.00 0.00 H new ATOM 0 HD12 LEU A 15 8.402 0.336 -1.554 1.00 0.00 H new ATOM 0 HD13 LEU A 15 8.591 2.105 -1.519 1.00 0.00 H new ATOM 0 HD21 LEU A 15 5.527 2.686 -1.368 1.00 0.00 H new ATOM 0 HD22 LEU A 15 6.601 3.563 -2.483 1.00 0.00 H new ATOM 0 HD23 LEU A 15 5.182 2.694 -3.114 1.00 0.00 H new ATOM 217 N PHE A 16 6.328 -1.346 -4.493 1.00 0.00 N ATOM 218 CA PHE A 16 5.517 -2.524 -4.236 1.00 0.00 C ATOM 219 C PHE A 16 6.330 -3.804 -4.440 1.00 0.00 C ATOM 220 O PHE A 16 6.445 -4.623 -3.529 1.00 0.00 O ATOM 221 CB PHE A 16 4.363 -2.500 -5.240 1.00 0.00 C ATOM 222 CG PHE A 16 3.311 -1.428 -4.953 1.00 0.00 C ATOM 223 CD1 PHE A 16 3.500 -0.543 -3.937 1.00 0.00 C ATOM 224 CD2 PHE A 16 2.185 -1.359 -5.713 1.00 0.00 C ATOM 225 CE1 PHE A 16 2.523 0.452 -3.671 1.00 0.00 C ATOM 226 CE2 PHE A 16 1.208 -0.363 -5.447 1.00 0.00 C ATOM 227 CZ PHE A 16 1.398 0.521 -4.431 1.00 0.00 C ATOM 0 H PHE A 16 5.920 -0.682 -5.152 1.00 0.00 H new ATOM 0 HA PHE A 16 5.160 -2.513 -3.206 1.00 0.00 H new ATOM 0 HB2 PHE A 16 4.768 -2.339 -6.239 1.00 0.00 H new ATOM 0 HB3 PHE A 16 3.879 -3.477 -5.245 1.00 0.00 H new ATOM 0 HD1 PHE A 16 4.393 -0.597 -3.333 1.00 0.00 H new ATOM 0 HD2 PHE A 16 2.034 -2.062 -6.519 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.674 1.154 -2.865 1.00 0.00 H new ATOM 0 HE2 PHE A 16 0.315 -0.308 -6.051 1.00 0.00 H new ATOM 0 HZ PHE A 16 0.655 1.278 -4.228 1.00 0.00 H new ATOM 237 N ASN A 17 6.871 -3.938 -5.642 1.00 0.00 N ATOM 238 CA ASN A 17 7.669 -5.105 -5.978 1.00 0.00 C ATOM 239 C ASN A 17 8.769 -5.284 -4.929 1.00 0.00 C ATOM 240 O ASN A 17 8.894 -6.353 -4.333 1.00 0.00 O ATOM 241 CB ASN A 17 8.341 -4.939 -7.342 1.00 0.00 C ATOM 242 CG ASN A 17 7.327 -5.108 -8.476 1.00 0.00 C ATOM 243 OD1 ASN A 17 6.262 -4.513 -8.485 1.00 0.00 O ATOM 244 ND2 ASN A 17 7.717 -5.950 -9.429 1.00 0.00 N ATOM 0 H ASN A 17 6.772 -3.258 -6.395 1.00 0.00 H new ATOM 0 HA ASN A 17 7.006 -5.970 -6.005 1.00 0.00 H new ATOM 0 HB2 ASN A 17 8.803 -3.954 -7.406 1.00 0.00 H new ATOM 0 HB3 ASN A 17 9.139 -5.673 -7.450 1.00 0.00 H new ATOM 0 HD21 ASN A 17 7.111 -6.130 -10.229 1.00 0.00 H new ATOM 0 HD22 ASN A 17 8.622 -6.415 -9.359 1.00 0.00 H new ATOM 251 N THR A 18 9.537 -4.222 -4.735 1.00 0.00 N ATOM 252 CA THR A 18 10.621 -4.249 -3.768 1.00 0.00 C ATOM 253 C THR A 18 10.106 -4.704 -2.401 1.00 0.00 C ATOM 254 O THR A 18 10.721 -5.547 -1.751 1.00 0.00 O ATOM 255 CB THR A 18 11.267 -2.863 -3.744 1.00 0.00 C ATOM 256 OG1 THR A 18 11.851 -2.729 -5.037 1.00 0.00 O ATOM 257 CG2 THR A 18 12.460 -2.789 -2.788 1.00 0.00 C ATOM 0 H THR A 18 9.430 -3.337 -5.231 1.00 0.00 H new ATOM 0 HA THR A 18 11.384 -4.974 -4.050 1.00 0.00 H new ATOM 0 HB THR A 18 10.523 -2.121 -3.454 1.00 0.00 H new ATOM 0 HG1 THR A 18 11.248 -2.218 -5.617 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.882 -1.784 -2.809 1.00 0.00 H new ATOM 0 HG22 THR A 18 12.130 -3.023 -1.776 1.00 0.00 H new ATOM 0 HG23 THR A 18 13.219 -3.507 -3.097 1.00 0.00 H new ATOM 265 N ARG A 19 8.982 -4.124 -2.006 1.00 0.00 N ATOM 266 CA ARG A 19 8.377 -4.459 -0.728 1.00 0.00 C ATOM 267 C ARG A 19 8.060 -5.955 -0.666 1.00 0.00 C ATOM 268 O ARG A 19 8.379 -6.620 0.318 1.00 0.00 O ATOM 269 CB ARG A 19 7.090 -3.663 -0.503 1.00 0.00 C ATOM 270 CG ARG A 19 7.397 -2.188 -0.237 1.00 0.00 C ATOM 271 CD ARG A 19 7.865 -1.976 1.204 1.00 0.00 C ATOM 272 NE ARG A 19 8.502 -0.647 1.339 1.00 0.00 N ATOM 273 CZ ARG A 19 9.733 -0.355 0.895 1.00 0.00 C ATOM 274 NH1 ARG A 19 10.466 -1.297 0.286 1.00 0.00 N ATOM 275 NH2 ARG A 19 10.230 0.878 1.062 1.00 0.00 N ATOM 0 H ARG A 19 8.475 -3.425 -2.548 1.00 0.00 H new ATOM 0 HA ARG A 19 9.092 -4.203 0.054 1.00 0.00 H new ATOM 0 HB2 ARG A 19 6.446 -3.752 -1.378 1.00 0.00 H new ATOM 0 HB3 ARG A 19 6.542 -4.082 0.341 1.00 0.00 H new ATOM 0 HG2 ARG A 19 8.167 -1.843 -0.927 1.00 0.00 H new ATOM 0 HG3 ARG A 19 6.507 -1.588 -0.426 1.00 0.00 H new ATOM 0 HD2 ARG A 19 7.018 -2.053 1.885 1.00 0.00 H new ATOM 0 HD3 ARG A 19 8.572 -2.757 1.484 1.00 0.00 H new ATOM 0 HE ARG A 19 7.971 0.093 1.799 1.00 0.00 H new ATOM 0 HH11 ARG A 19 10.087 -2.236 0.160 1.00 0.00 H new ATOM 0 HH12 ARG A 19 11.403 -1.075 -0.052 1.00 0.00 H new ATOM 0 HH21 ARG A 19 9.672 1.594 1.527 1.00 0.00 H new ATOM 0 HH22 ARG A 19 11.166 1.100 0.724 1.00 0.00 H new ATOM 289 N TYR A 20 7.437 -6.440 -1.730 1.00 0.00 N ATOM 290 CA TYR A 20 7.075 -7.845 -1.809 1.00 0.00 C ATOM 291 C TYR A 20 8.278 -8.740 -1.506 1.00 0.00 C ATOM 292 O TYR A 20 8.164 -9.706 -0.753 1.00 0.00 O ATOM 293 CB TYR A 20 6.626 -8.084 -3.252 1.00 0.00 C ATOM 294 CG TYR A 20 5.987 -9.454 -3.485 1.00 0.00 C ATOM 295 CD1 TYR A 20 4.948 -9.877 -2.681 1.00 0.00 C ATOM 296 CD2 TYR A 20 6.448 -10.267 -4.501 1.00 0.00 C ATOM 297 CE1 TYR A 20 4.346 -11.167 -2.901 1.00 0.00 C ATOM 298 CE2 TYR A 20 5.846 -11.557 -4.721 1.00 0.00 C ATOM 299 CZ TYR A 20 4.825 -11.943 -3.910 1.00 0.00 C ATOM 300 OH TYR A 20 4.256 -13.161 -4.118 1.00 0.00 O ATOM 0 H TYR A 20 7.174 -5.885 -2.544 1.00 0.00 H new ATOM 0 HA TYR A 20 6.296 -8.082 -1.084 1.00 0.00 H new ATOM 0 HB2 TYR A 20 5.913 -7.309 -3.533 1.00 0.00 H new ATOM 0 HB3 TYR A 20 7.487 -7.979 -3.912 1.00 0.00 H new ATOM 0 HD1 TYR A 20 4.586 -9.241 -1.887 1.00 0.00 H new ATOM 0 HD2 TYR A 20 7.260 -9.936 -5.131 1.00 0.00 H new ATOM 0 HE1 TYR A 20 3.533 -11.510 -2.279 1.00 0.00 H new ATOM 0 HE2 TYR A 20 6.198 -12.203 -5.512 1.00 0.00 H new ATOM 0 HH TYR A 20 4.698 -13.604 -4.872 1.00 0.00 H new ATOM 310 N ALA A 21 9.404 -8.387 -2.109 1.00 0.00 N ATOM 311 CA ALA A 21 10.627 -9.146 -1.913 1.00 0.00 C ATOM 312 C ALA A 21 10.846 -9.375 -0.416 1.00 0.00 C ATOM 313 O ALA A 21 11.099 -10.500 0.012 1.00 0.00 O ATOM 314 CB ALA A 21 11.797 -8.407 -2.567 1.00 0.00 C ATOM 0 H ALA A 21 9.495 -7.586 -2.733 1.00 0.00 H new ATOM 0 HA ALA A 21 10.552 -10.124 -2.389 1.00 0.00 H new ATOM 0 HB1 ALA A 21 12.715 -8.976 -2.420 1.00 0.00 H new ATOM 0 HB2 ALA A 21 11.606 -8.296 -3.634 1.00 0.00 H new ATOM 0 HB3 ALA A 21 11.905 -7.422 -2.113 1.00 0.00 H new ATOM 320 N LYS A 22 10.742 -8.291 0.337 1.00 0.00 N ATOM 321 CA LYS A 22 10.925 -8.359 1.777 1.00 0.00 C ATOM 322 C LYS A 22 9.925 -9.355 2.367 1.00 0.00 C ATOM 323 O LYS A 22 10.200 -9.987 3.386 1.00 0.00 O ATOM 324 CB LYS A 22 10.841 -6.962 2.395 1.00 0.00 C ATOM 325 CG LYS A 22 11.350 -6.970 3.838 1.00 0.00 C ATOM 326 CD LYS A 22 11.394 -5.552 4.411 1.00 0.00 C ATOM 327 CE LYS A 22 11.965 -5.551 5.831 1.00 0.00 C ATOM 328 NZ LYS A 22 13.435 -5.387 5.798 1.00 0.00 N ATOM 0 H LYS A 22 10.533 -7.360 -0.023 1.00 0.00 H new ATOM 0 HA LYS A 22 11.922 -8.728 2.018 1.00 0.00 H new ATOM 0 HB2 LYS A 22 11.429 -6.262 1.802 1.00 0.00 H new ATOM 0 HB3 LYS A 22 9.809 -6.611 2.371 1.00 0.00 H new ATOM 0 HG2 LYS A 22 10.702 -7.595 4.453 1.00 0.00 H new ATOM 0 HG3 LYS A 22 12.346 -7.412 3.874 1.00 0.00 H new ATOM 0 HD2 LYS A 22 12.004 -4.916 3.770 1.00 0.00 H new ATOM 0 HD3 LYS A 22 10.390 -5.128 4.419 1.00 0.00 H new ATOM 0 HE2 LYS A 22 11.516 -4.744 6.409 1.00 0.00 H new ATOM 0 HE3 LYS A 22 11.708 -6.484 6.333 1.00 0.00 H new ATOM 0 HZ1 LYS A 22 13.806 -5.388 6.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 22 13.860 -6.172 5.264 1.00 0.00 H new ATOM 0 HZ3 LYS A 22 13.673 -4.485 5.338 1.00 0.00 H new ATOM 342 N ALA A 23 8.784 -9.463 1.702 1.00 0.00 N ATOM 343 CA ALA A 23 7.741 -10.371 2.148 1.00 0.00 C ATOM 344 C ALA A 23 8.150 -11.809 1.826 1.00 0.00 C ATOM 345 O ALA A 23 7.581 -12.757 2.366 1.00 0.00 O ATOM 346 CB ALA A 23 6.412 -9.982 1.496 1.00 0.00 C ATOM 0 H ALA A 23 8.559 -8.937 0.858 1.00 0.00 H new ATOM 0 HA ALA A 23 7.607 -10.301 3.227 1.00 0.00 H new ATOM 0 HB1 ALA A 23 5.630 -10.663 1.830 1.00 0.00 H new ATOM 0 HB2 ALA A 23 6.152 -8.963 1.781 1.00 0.00 H new ATOM 0 HB3 ALA A 23 6.507 -10.043 0.412 1.00 0.00 H new ATOM 352 N ILE A 24 9.133 -11.928 0.946 1.00 0.00 N ATOM 353 CA ILE A 24 9.625 -13.235 0.544 1.00 0.00 C ATOM 354 C ILE A 24 11.109 -13.347 0.899 1.00 0.00 C ATOM 355 O ILE A 24 11.781 -14.290 0.483 1.00 0.00 O ATOM 356 CB ILE A 24 9.326 -13.489 -0.934 1.00 0.00 C ATOM 357 CG1 ILE A 24 9.823 -12.331 -1.802 1.00 0.00 C ATOM 358 CG2 ILE A 24 7.838 -13.771 -1.152 1.00 0.00 C ATOM 359 CD1 ILE A 24 9.801 -12.707 -3.285 1.00 0.00 C ATOM 0 H ILE A 24 9.603 -11.140 0.500 1.00 0.00 H new ATOM 0 HA ILE A 24 9.105 -14.022 1.090 1.00 0.00 H new ATOM 0 HB ILE A 24 9.872 -14.380 -1.244 1.00 0.00 H new ATOM 0 HG12 ILE A 24 9.198 -11.454 -1.637 1.00 0.00 H new ATOM 0 HG13 ILE A 24 10.837 -12.060 -1.507 1.00 0.00 H new ATOM 0 HG21 ILE A 24 7.653 -13.948 -2.211 1.00 0.00 H new ATOM 0 HG22 ILE A 24 7.547 -14.652 -0.580 1.00 0.00 H new ATOM 0 HG23 ILE A 24 7.253 -12.914 -0.820 1.00 0.00 H new ATOM 0 HD11 ILE A 24 10.159 -11.866 -3.879 1.00 0.00 H new ATOM 0 HD12 ILE A 24 10.446 -13.570 -3.451 1.00 0.00 H new ATOM 0 HD13 ILE A 24 8.782 -12.954 -3.583 1.00 0.00 H new ATOM 371 N GLY A 25 11.577 -12.372 1.665 1.00 0.00 N ATOM 372 CA GLY A 25 12.969 -12.350 2.081 1.00 0.00 C ATOM 373 C GLY A 25 13.898 -12.169 0.878 1.00 0.00 C ATOM 374 O GLY A 25 15.017 -12.681 0.871 1.00 0.00 O ATOM 0 H GLY A 25 11.017 -11.592 2.008 1.00 0.00 H new ATOM 0 HA2 GLY A 25 13.127 -11.539 2.792 1.00 0.00 H new ATOM 0 HA3 GLY A 25 13.213 -13.279 2.597 1.00 0.00 H new ATOM 378 N ILE A 26 13.400 -11.440 -0.110 1.00 0.00 N ATOM 379 CA ILE A 26 14.171 -11.186 -1.315 1.00 0.00 C ATOM 380 C ILE A 26 14.692 -9.748 -1.287 1.00 0.00 C ATOM 381 O ILE A 26 14.000 -8.841 -0.827 1.00 0.00 O ATOM 382 CB ILE A 26 13.344 -11.516 -2.559 1.00 0.00 C ATOM 383 CG1 ILE A 26 13.133 -13.026 -2.692 1.00 0.00 C ATOM 384 CG2 ILE A 26 13.978 -10.913 -3.814 1.00 0.00 C ATOM 385 CD1 ILE A 26 12.985 -13.431 -4.160 1.00 0.00 C ATOM 0 H ILE A 26 12.472 -11.017 -0.101 1.00 0.00 H new ATOM 0 HA ILE A 26 15.042 -11.841 -1.356 1.00 0.00 H new ATOM 0 HB ILE A 26 12.360 -11.062 -2.446 1.00 0.00 H new ATOM 0 HG12 ILE A 26 13.976 -13.555 -2.248 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.243 -13.323 -2.137 1.00 0.00 H new ATOM 0 HG21 ILE A 26 13.371 -11.162 -4.684 1.00 0.00 H new ATOM 0 HG22 ILE A 26 14.034 -9.830 -3.709 1.00 0.00 H new ATOM 0 HG23 ILE A 26 14.982 -11.317 -3.945 1.00 0.00 H new ATOM 0 HD11 ILE A 26 12.836 -14.509 -4.227 1.00 0.00 H new ATOM 0 HD12 ILE A 26 12.126 -12.919 -4.594 1.00 0.00 H new ATOM 0 HD13 ILE A 26 13.887 -13.155 -4.706 1.00 0.00 H new ATOM 397 N SER A 27 15.909 -9.584 -1.784 1.00 0.00 N ATOM 398 CA SER A 27 16.532 -8.272 -1.822 1.00 0.00 C ATOM 399 C SER A 27 16.080 -7.514 -3.072 1.00 0.00 C ATOM 400 O SER A 27 15.885 -6.300 -3.030 1.00 0.00 O ATOM 401 CB SER A 27 18.057 -8.385 -1.792 1.00 0.00 C ATOM 402 OG SER A 27 18.605 -7.893 -0.572 1.00 0.00 O ATOM 0 H SER A 27 16.481 -10.338 -2.164 1.00 0.00 H new ATOM 0 HA SER A 27 16.219 -7.719 -0.936 1.00 0.00 H new ATOM 0 HB2 SER A 27 18.346 -9.428 -1.925 1.00 0.00 H new ATOM 0 HB3 SER A 27 18.478 -7.828 -2.629 1.00 0.00 H new ATOM 0 HG SER A 27 19.581 -7.984 -0.591 1.00 0.00 H new ATOM 408 N GLU A 28 15.926 -8.262 -4.155 1.00 0.00 N ATOM 409 CA GLU A 28 15.501 -7.676 -5.415 1.00 0.00 C ATOM 410 C GLU A 28 13.977 -7.552 -5.455 1.00 0.00 C ATOM 411 O GLU A 28 13.275 -8.236 -4.711 1.00 0.00 O ATOM 412 CB GLU A 28 16.017 -8.493 -6.601 1.00 0.00 C ATOM 413 CG GLU A 28 15.317 -9.851 -6.677 1.00 0.00 C ATOM 414 CD GLU A 28 15.118 -10.285 -8.131 1.00 0.00 C ATOM 415 OE1 GLU A 28 14.150 -9.787 -8.744 1.00 0.00 O ATOM 416 OE2 GLU A 28 15.939 -11.106 -8.595 1.00 0.00 O ATOM 0 H GLU A 28 16.088 -9.269 -4.186 1.00 0.00 H new ATOM 0 HA GLU A 28 15.929 -6.676 -5.492 1.00 0.00 H new ATOM 0 HB2 GLU A 28 15.851 -7.942 -7.527 1.00 0.00 H new ATOM 0 HB3 GLU A 28 17.093 -8.639 -6.506 1.00 0.00 H new ATOM 0 HG2 GLU A 28 15.908 -10.599 -6.148 1.00 0.00 H new ATOM 0 HG3 GLU A 28 14.351 -9.795 -6.175 1.00 0.00 H new ATOM 423 N PRO A 29 13.496 -6.652 -6.355 1.00 0.00 N ATOM 424 CA PRO A 29 12.068 -6.431 -6.502 1.00 0.00 C ATOM 425 C PRO A 29 11.408 -7.587 -7.255 1.00 0.00 C ATOM 426 O PRO A 29 11.919 -8.037 -8.280 1.00 0.00 O ATOM 427 CB PRO A 29 11.949 -5.102 -7.231 1.00 0.00 C ATOM 428 CG PRO A 29 13.304 -4.857 -7.874 1.00 0.00 C ATOM 429 CD PRO A 29 14.297 -5.825 -7.252 1.00 0.00 C ATOM 0 HA PRO A 29 11.548 -6.394 -5.545 1.00 0.00 H new ATOM 0 HB2 PRO A 29 11.161 -5.138 -7.983 1.00 0.00 H new ATOM 0 HB3 PRO A 29 11.694 -4.299 -6.540 1.00 0.00 H new ATOM 0 HG2 PRO A 29 13.248 -5.008 -8.952 1.00 0.00 H new ATOM 0 HG3 PRO A 29 13.623 -3.827 -7.713 1.00 0.00 H new ATOM 0 HD2 PRO A 29 14.790 -6.430 -8.013 1.00 0.00 H new ATOM 0 HD3 PRO A 29 15.080 -5.295 -6.709 1.00 0.00 H new ATOM 437 N VAL A 30 10.284 -8.036 -6.717 1.00 0.00 N ATOM 438 CA VAL A 30 9.549 -9.132 -7.326 1.00 0.00 C ATOM 439 C VAL A 30 8.134 -8.663 -7.671 1.00 0.00 C ATOM 440 O VAL A 30 7.694 -7.612 -7.207 1.00 0.00 O ATOM 441 CB VAL A 30 9.565 -10.351 -6.401 1.00 0.00 C ATOM 442 CG1 VAL A 30 8.586 -11.422 -6.888 1.00 0.00 C ATOM 443 CG2 VAL A 30 10.979 -10.920 -6.268 1.00 0.00 C ATOM 0 H VAL A 30 9.864 -7.661 -5.866 1.00 0.00 H new ATOM 0 HA VAL A 30 10.026 -9.440 -8.257 1.00 0.00 H new ATOM 0 HB VAL A 30 9.241 -10.026 -5.413 1.00 0.00 H new ATOM 0 HG11 VAL A 30 8.617 -12.277 -6.213 1.00 0.00 H new ATOM 0 HG12 VAL A 30 7.577 -11.011 -6.907 1.00 0.00 H new ATOM 0 HG13 VAL A 30 8.866 -11.742 -7.892 1.00 0.00 H new ATOM 0 HG21 VAL A 30 10.962 -11.785 -5.605 1.00 0.00 H new ATOM 0 HG22 VAL A 30 11.344 -11.222 -7.250 1.00 0.00 H new ATOM 0 HG23 VAL A 30 11.640 -10.159 -5.854 1.00 0.00 H new ATOM 453 N LYS A 31 7.460 -9.464 -8.483 1.00 0.00 N ATOM 454 CA LYS A 31 6.105 -9.143 -8.896 1.00 0.00 C ATOM 455 C LYS A 31 5.164 -9.285 -7.698 1.00 0.00 C ATOM 456 O LYS A 31 5.397 -10.110 -6.815 1.00 0.00 O ATOM 457 CB LYS A 31 5.697 -9.993 -10.102 1.00 0.00 C ATOM 458 CG LYS A 31 6.519 -9.622 -11.337 1.00 0.00 C ATOM 459 CD LYS A 31 6.002 -10.351 -12.579 1.00 0.00 C ATOM 460 CE LYS A 31 6.936 -11.498 -12.969 1.00 0.00 C ATOM 461 NZ LYS A 31 6.160 -12.638 -13.507 1.00 0.00 N ATOM 0 H LYS A 31 7.827 -10.335 -8.866 1.00 0.00 H new ATOM 0 HA LYS A 31 6.044 -8.107 -9.229 1.00 0.00 H new ATOM 0 HB2 LYS A 31 5.837 -11.049 -9.871 1.00 0.00 H new ATOM 0 HB3 LYS A 31 4.637 -9.850 -10.310 1.00 0.00 H new ATOM 0 HG2 LYS A 31 6.474 -8.545 -11.498 1.00 0.00 H new ATOM 0 HG3 LYS A 31 7.566 -9.876 -11.171 1.00 0.00 H new ATOM 0 HD2 LYS A 31 5.002 -10.741 -12.387 1.00 0.00 H new ATOM 0 HD3 LYS A 31 5.917 -9.649 -13.408 1.00 0.00 H new ATOM 0 HE2 LYS A 31 7.653 -11.154 -13.715 1.00 0.00 H new ATOM 0 HE3 LYS A 31 7.510 -11.819 -12.100 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 6.809 -13.408 -13.767 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 5.493 -12.976 -12.784 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 5.632 -12.332 -14.349 1.00 0.00 H new ATOM 475 N VAL A 32 4.122 -8.468 -7.704 1.00 0.00 N ATOM 476 CA VAL A 32 3.145 -8.491 -6.629 1.00 0.00 C ATOM 477 C VAL A 32 1.833 -9.081 -7.150 1.00 0.00 C ATOM 478 O VAL A 32 1.207 -8.518 -8.046 1.00 0.00 O ATOM 479 CB VAL A 32 2.978 -7.088 -6.042 1.00 0.00 C ATOM 480 CG1 VAL A 32 1.609 -6.931 -5.378 1.00 0.00 C ATOM 481 CG2 VAL A 32 4.105 -6.768 -5.058 1.00 0.00 C ATOM 0 H VAL A 32 3.933 -7.785 -8.437 1.00 0.00 H new ATOM 0 HA VAL A 32 3.488 -9.130 -5.815 1.00 0.00 H new ATOM 0 HB VAL A 32 3.036 -6.372 -6.862 1.00 0.00 H new ATOM 0 HG11 VAL A 32 1.516 -5.925 -4.969 1.00 0.00 H new ATOM 0 HG12 VAL A 32 0.825 -7.096 -6.117 1.00 0.00 H new ATOM 0 HG13 VAL A 32 1.509 -7.660 -4.574 1.00 0.00 H new ATOM 0 HG21 VAL A 32 3.963 -5.765 -4.655 1.00 0.00 H new ATOM 0 HG22 VAL A 32 4.093 -7.492 -4.243 1.00 0.00 H new ATOM 0 HG23 VAL A 32 5.064 -6.819 -5.574 1.00 0.00 H new ATOM 491 N PRO A 33 1.445 -10.239 -6.550 1.00 0.00 N ATOM 492 CA PRO A 33 0.219 -10.911 -6.944 1.00 0.00 C ATOM 493 C PRO A 33 -1.008 -10.178 -6.399 1.00 0.00 C ATOM 494 O PRO A 33 -1.718 -10.700 -5.542 1.00 0.00 O ATOM 495 CB PRO A 33 0.355 -12.325 -6.403 1.00 0.00 C ATOM 496 CG PRO A 33 1.433 -12.261 -5.333 1.00 0.00 C ATOM 497 CD PRO A 33 2.161 -10.935 -5.485 1.00 0.00 C ATOM 0 HA PRO A 33 0.075 -10.924 -8.024 1.00 0.00 H new ATOM 0 HB2 PRO A 33 -0.589 -12.676 -5.986 1.00 0.00 H new ATOM 0 HB3 PRO A 33 0.632 -13.021 -7.195 1.00 0.00 H new ATOM 0 HG2 PRO A 33 0.991 -12.342 -4.340 1.00 0.00 H new ATOM 0 HG3 PRO A 33 2.129 -13.093 -5.441 1.00 0.00 H new ATOM 0 HD2 PRO A 33 2.142 -10.364 -4.557 1.00 0.00 H new ATOM 0 HD3 PRO A 33 3.209 -11.086 -5.745 1.00 0.00 H new ATOM 505 N TYR A 34 -1.220 -8.978 -6.920 1.00 0.00 N ATOM 506 CA TYR A 34 -2.349 -8.167 -6.497 1.00 0.00 C ATOM 507 C TYR A 34 -3.576 -9.038 -6.219 1.00 0.00 C ATOM 508 O TYR A 34 -4.121 -9.016 -5.117 1.00 0.00 O ATOM 509 CB TYR A 34 -2.657 -7.230 -7.666 1.00 0.00 C ATOM 510 CG TYR A 34 -1.569 -6.187 -7.931 1.00 0.00 C ATOM 511 CD1 TYR A 34 -0.880 -5.626 -6.876 1.00 0.00 C ATOM 512 CD2 TYR A 34 -1.278 -5.808 -9.226 1.00 0.00 C ATOM 513 CE1 TYR A 34 0.144 -4.644 -7.125 1.00 0.00 C ATOM 514 CE2 TYR A 34 -0.254 -4.827 -9.475 1.00 0.00 C ATOM 515 CZ TYR A 34 0.406 -4.293 -8.413 1.00 0.00 C ATOM 516 OH TYR A 34 1.373 -3.366 -8.648 1.00 0.00 O ATOM 0 H TYR A 34 -0.629 -8.548 -7.631 1.00 0.00 H new ATOM 0 HA TYR A 34 -2.112 -7.627 -5.580 1.00 0.00 H new ATOM 0 HB2 TYR A 34 -2.802 -7.826 -8.567 1.00 0.00 H new ATOM 0 HB3 TYR A 34 -3.598 -6.716 -7.468 1.00 0.00 H new ATOM 0 HD1 TYR A 34 -1.108 -5.923 -5.863 1.00 0.00 H new ATOM 0 HD2 TYR A 34 -1.818 -6.247 -10.052 1.00 0.00 H new ATOM 0 HE1 TYR A 34 0.691 -4.197 -6.308 1.00 0.00 H new ATOM 0 HE2 TYR A 34 -0.015 -4.522 -10.483 1.00 0.00 H new ATOM 0 HH TYR A 34 1.453 -3.214 -9.613 1.00 0.00 H new ATOM 526 N SER A 35 -3.975 -9.784 -7.239 1.00 0.00 N ATOM 527 CA SER A 35 -5.127 -10.661 -7.119 1.00 0.00 C ATOM 528 C SER A 35 -5.103 -11.376 -5.767 1.00 0.00 C ATOM 529 O SER A 35 -6.060 -11.293 -4.999 1.00 0.00 O ATOM 530 CB SER A 35 -5.164 -11.681 -8.258 1.00 0.00 C ATOM 531 OG SER A 35 -4.524 -11.192 -9.434 1.00 0.00 O ATOM 0 H SER A 35 -3.521 -9.799 -8.152 1.00 0.00 H new ATOM 0 HA SER A 35 -6.028 -10.051 -7.184 1.00 0.00 H new ATOM 0 HB2 SER A 35 -4.677 -12.601 -7.936 1.00 0.00 H new ATOM 0 HB3 SER A 35 -6.200 -11.932 -8.487 1.00 0.00 H new ATOM 0 HG SER A 35 -4.567 -11.873 -10.137 1.00 0.00 H new ATOM 537 N LYS A 36 -3.997 -12.062 -5.516 1.00 0.00 N ATOM 538 CA LYS A 36 -3.835 -12.790 -4.269 1.00 0.00 C ATOM 539 C LYS A 36 -4.205 -11.878 -3.098 1.00 0.00 C ATOM 540 O LYS A 36 -4.866 -12.310 -2.155 1.00 0.00 O ATOM 541 CB LYS A 36 -2.425 -13.376 -4.171 1.00 0.00 C ATOM 542 CG LYS A 36 -2.150 -14.341 -5.326 1.00 0.00 C ATOM 543 CD LYS A 36 -2.952 -15.634 -5.165 1.00 0.00 C ATOM 544 CE LYS A 36 -2.890 -16.480 -6.438 1.00 0.00 C ATOM 545 NZ LYS A 36 -4.076 -16.227 -7.286 1.00 0.00 N ATOM 0 H LYS A 36 -3.205 -12.129 -6.155 1.00 0.00 H new ATOM 0 HA LYS A 36 -4.513 -13.643 -4.235 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -1.691 -12.570 -4.183 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -2.310 -13.898 -3.221 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -2.408 -13.864 -6.272 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -1.085 -14.572 -5.366 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -2.560 -16.207 -4.324 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -3.990 -15.396 -4.933 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -1.982 -16.246 -6.993 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -2.841 -17.537 -6.177 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -4.145 -16.965 -8.016 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -4.933 -16.242 -6.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -3.985 -15.297 -7.742 1.00 0.00 H new ATOM 559 N PHE A 37 -3.764 -10.633 -3.197 1.00 0.00 N ATOM 560 CA PHE A 37 -4.040 -9.656 -2.158 1.00 0.00 C ATOM 561 C PHE A 37 -5.462 -9.106 -2.287 1.00 0.00 C ATOM 562 O PHE A 37 -6.030 -8.608 -1.316 1.00 0.00 O ATOM 563 CB PHE A 37 -3.044 -8.510 -2.345 1.00 0.00 C ATOM 564 CG PHE A 37 -1.646 -8.806 -1.798 1.00 0.00 C ATOM 565 CD1 PHE A 37 -0.819 -9.652 -2.468 1.00 0.00 C ATOM 566 CD2 PHE A 37 -1.230 -8.222 -0.642 1.00 0.00 C ATOM 567 CE1 PHE A 37 0.479 -9.927 -1.961 1.00 0.00 C ATOM 568 CE2 PHE A 37 0.067 -8.496 -0.135 1.00 0.00 C ATOM 569 CZ PHE A 37 0.894 -9.343 -0.805 1.00 0.00 C ATOM 0 H PHE A 37 -3.217 -10.278 -3.981 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.946 -10.120 -1.176 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -2.966 -8.280 -3.408 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -3.434 -7.619 -1.853 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.149 -10.115 -3.386 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -1.887 -7.550 -0.110 1.00 0.00 H new ATOM 0 HE1 PHE A 37 1.136 -10.599 -2.493 1.00 0.00 H new ATOM 0 HE2 PHE A 37 0.397 -8.032 0.783 1.00 0.00 H new ATOM 0 HZ PHE A 37 1.881 -9.552 -0.419 1.00 0.00 H new ATOM 579 N LEU A 38 -5.997 -9.214 -3.495 1.00 0.00 N ATOM 580 CA LEU A 38 -7.342 -8.733 -3.763 1.00 0.00 C ATOM 581 C LEU A 38 -8.357 -9.746 -3.229 1.00 0.00 C ATOM 582 O LEU A 38 -9.201 -9.406 -2.401 1.00 0.00 O ATOM 583 CB LEU A 38 -7.511 -8.419 -5.251 1.00 0.00 C ATOM 584 CG LEU A 38 -6.652 -7.277 -5.798 1.00 0.00 C ATOM 585 CD1 LEU A 38 -6.769 -7.184 -7.320 1.00 0.00 C ATOM 586 CD2 LEU A 38 -6.999 -5.954 -5.113 1.00 0.00 C ATOM 0 H LEU A 38 -5.524 -9.627 -4.298 1.00 0.00 H new ATOM 0 HA LEU A 38 -7.523 -7.794 -3.240 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -7.286 -9.321 -5.820 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -8.558 -8.179 -5.435 1.00 0.00 H new ATOM 0 HG LEU A 38 -5.609 -7.493 -5.569 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -6.149 -6.364 -7.683 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -6.434 -8.119 -7.769 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -7.808 -7.002 -7.595 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -6.374 -5.159 -5.520 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -8.048 -5.717 -5.289 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -6.822 -6.042 -4.041 1.00 0.00 H new ATOM 598 N MET A 39 -8.241 -10.969 -3.724 1.00 0.00 N ATOM 599 CA MET A 39 -9.138 -12.033 -3.307 1.00 0.00 C ATOM 600 C MET A 39 -8.888 -12.421 -1.848 1.00 0.00 C ATOM 601 O MET A 39 -9.771 -12.965 -1.187 1.00 0.00 O ATOM 602 CB MET A 39 -8.931 -13.256 -4.203 1.00 0.00 C ATOM 603 CG MET A 39 -9.094 -12.889 -5.679 1.00 0.00 C ATOM 604 SD MET A 39 -9.066 -14.365 -6.682 1.00 0.00 S ATOM 605 CE MET A 39 -7.323 -14.749 -6.619 1.00 0.00 C ATOM 0 H MET A 39 -7.539 -11.247 -4.410 1.00 0.00 H new ATOM 0 HA MET A 39 -10.163 -11.674 -3.397 1.00 0.00 H new ATOM 0 HB2 MET A 39 -7.937 -13.670 -4.035 1.00 0.00 H new ATOM 0 HB3 MET A 39 -9.648 -14.032 -3.936 1.00 0.00 H new ATOM 0 HG2 MET A 39 -10.033 -12.356 -5.828 1.00 0.00 H new ATOM 0 HG3 MET A 39 -8.293 -12.216 -5.985 1.00 0.00 H new ATOM 0 HE1 MET A 39 -7.021 -15.222 -7.553 1.00 0.00 H new ATOM 0 HE2 MET A 39 -6.753 -13.831 -6.476 1.00 0.00 H new ATOM 0 HE3 MET A 39 -7.130 -15.429 -5.789 1.00 0.00 H new ATOM 615 N HIS A 40 -7.681 -12.125 -1.389 1.00 0.00 N ATOM 616 CA HIS A 40 -7.304 -12.435 -0.021 1.00 0.00 C ATOM 617 C HIS A 40 -6.692 -11.196 0.637 1.00 0.00 C ATOM 618 O HIS A 40 -5.495 -11.166 0.919 1.00 0.00 O ATOM 619 CB HIS A 40 -6.375 -13.650 0.025 1.00 0.00 C ATOM 620 CG HIS A 40 -6.777 -14.765 -0.911 1.00 0.00 C ATOM 621 ND1 HIS A 40 -6.431 -15.009 -2.207 1.00 0.00 N flip ATOM 622 CD2 HIS A 40 -7.633 -15.786 -0.536 1.00 0.00 C flip ATOM 623 CE1 HIS A 40 -7.043 -16.119 -2.603 1.00 0.00 C flip ATOM 624 NE2 HIS A 40 -7.789 -16.601 -1.568 1.00 0.00 N flip ATOM 0 H HIS A 40 -6.951 -11.674 -1.941 1.00 0.00 H new ATOM 0 HA HIS A 40 -8.191 -12.707 0.551 1.00 0.00 H new ATOM 0 HB2 HIS A 40 -5.362 -13.330 -0.221 1.00 0.00 H new ATOM 0 HB3 HIS A 40 -6.349 -14.036 1.044 1.00 0.00 H new ATOM 0 HD2 HIS A 40 -8.095 -15.899 0.434 1.00 0.00 H new ATOM 0 HE1 HIS A 40 -6.963 -16.566 -3.583 1.00 0.00 H new ATOM 0 HE2 HIS A 40 -8.366 -17.442 -1.586 1.00 0.00 H new ATOM 632 N PRO A 41 -7.564 -10.178 0.868 1.00 0.00 N ATOM 633 CA PRO A 41 -7.122 -8.940 1.486 1.00 0.00 C ATOM 634 C PRO A 41 -6.891 -9.129 2.987 1.00 0.00 C ATOM 635 O PRO A 41 -6.158 -8.361 3.608 1.00 0.00 O ATOM 636 CB PRO A 41 -8.217 -7.933 1.176 1.00 0.00 C ATOM 637 CG PRO A 41 -9.442 -8.751 0.799 1.00 0.00 C ATOM 638 CD PRO A 41 -8.988 -10.179 0.547 1.00 0.00 C ATOM 0 HA PRO A 41 -6.162 -8.596 1.100 1.00 0.00 H new ATOM 0 HB2 PRO A 41 -8.421 -7.300 2.039 1.00 0.00 H new ATOM 0 HB3 PRO A 41 -7.921 -7.274 0.360 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -10.182 -8.721 1.599 1.00 0.00 H new ATOM 0 HG3 PRO A 41 -9.917 -8.339 -0.091 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -9.534 -10.884 1.173 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -9.160 -10.472 -0.489 1.00 0.00 H new ATOM 646 N GLU A 42 -7.532 -10.156 3.527 1.00 0.00 N ATOM 647 CA GLU A 42 -7.405 -10.455 4.943 1.00 0.00 C ATOM 648 C GLU A 42 -6.126 -11.252 5.205 1.00 0.00 C ATOM 649 O GLU A 42 -5.502 -11.104 6.255 1.00 0.00 O ATOM 650 CB GLU A 42 -8.635 -11.208 5.456 1.00 0.00 C ATOM 651 CG GLU A 42 -9.628 -10.250 6.118 1.00 0.00 C ATOM 652 CD GLU A 42 -10.027 -10.749 7.508 1.00 0.00 C ATOM 653 OE1 GLU A 42 -10.599 -11.859 7.570 1.00 0.00 O ATOM 654 OE2 GLU A 42 -9.752 -10.009 8.477 1.00 0.00 O ATOM 0 H GLU A 42 -8.140 -10.791 3.010 1.00 0.00 H new ATOM 0 HA GLU A 42 -7.341 -9.514 5.489 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -9.120 -11.726 4.629 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -8.327 -11.970 6.172 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -9.184 -9.258 6.197 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -10.516 -10.153 5.494 1.00 0.00 H new ATOM 661 N GLU A 43 -5.773 -12.080 4.233 1.00 0.00 N ATOM 662 CA GLU A 43 -4.579 -12.900 4.345 1.00 0.00 C ATOM 663 C GLU A 43 -3.354 -12.126 3.853 1.00 0.00 C ATOM 664 O GLU A 43 -2.358 -12.014 4.566 1.00 0.00 O ATOM 665 CB GLU A 43 -4.742 -14.214 3.578 1.00 0.00 C ATOM 666 CG GLU A 43 -5.781 -15.115 4.248 1.00 0.00 C ATOM 667 CD GLU A 43 -7.155 -14.441 4.274 1.00 0.00 C ATOM 668 OE1 GLU A 43 -7.712 -14.246 3.172 1.00 0.00 O ATOM 669 OE2 GLU A 43 -7.617 -14.137 5.395 1.00 0.00 O ATOM 0 H GLU A 43 -6.293 -12.201 3.364 1.00 0.00 H new ATOM 0 HA GLU A 43 -4.430 -13.147 5.396 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -5.044 -14.005 2.552 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -3.784 -14.732 3.529 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -5.846 -16.062 3.712 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -5.466 -15.346 5.266 1.00 0.00 H new ATOM 676 N LEU A 44 -3.469 -11.612 2.637 1.00 0.00 N ATOM 677 CA LEU A 44 -2.384 -10.851 2.041 1.00 0.00 C ATOM 678 C LEU A 44 -2.808 -9.387 1.904 1.00 0.00 C ATOM 679 O LEU A 44 -3.765 -9.078 1.197 1.00 0.00 O ATOM 680 CB LEU A 44 -1.943 -11.490 0.723 1.00 0.00 C ATOM 681 CG LEU A 44 -2.053 -13.014 0.646 1.00 0.00 C ATOM 682 CD1 LEU A 44 -1.989 -13.496 -0.805 1.00 0.00 C ATOM 683 CD2 LEU A 44 -0.991 -13.685 1.520 1.00 0.00 C ATOM 0 H LEU A 44 -4.297 -11.708 2.049 1.00 0.00 H new ATOM 0 HA LEU A 44 -1.506 -10.869 2.687 1.00 0.00 H new ATOM 0 HB2 LEU A 44 -2.539 -11.062 -0.083 1.00 0.00 H new ATOM 0 HB3 LEU A 44 -0.906 -11.211 0.536 1.00 0.00 H new ATOM 0 HG LEU A 44 -3.026 -13.307 1.040 1.00 0.00 H new ATOM 0 HD11 LEU A 44 -2.069 -14.583 -0.831 1.00 0.00 H new ATOM 0 HD12 LEU A 44 -2.811 -13.058 -1.371 1.00 0.00 H new ATOM 0 HD13 LEU A 44 -1.041 -13.192 -1.248 1.00 0.00 H new ATOM 0 HD21 LEU A 44 -1.091 -14.768 1.447 1.00 0.00 H new ATOM 0 HD22 LEU A 44 0.001 -13.389 1.179 1.00 0.00 H new ATOM 0 HD23 LEU A 44 -1.125 -13.377 2.557 1.00 0.00 H new ATOM 695 N PHE A 45 -2.074 -8.525 2.592 1.00 0.00 N ATOM 696 CA PHE A 45 -2.362 -7.101 2.556 1.00 0.00 C ATOM 697 C PHE A 45 -1.081 -6.279 2.707 1.00 0.00 C ATOM 698 O PHE A 45 0.011 -6.836 2.806 1.00 0.00 O ATOM 699 CB PHE A 45 -3.288 -6.802 3.737 1.00 0.00 C ATOM 700 CG PHE A 45 -2.716 -7.213 5.095 1.00 0.00 C ATOM 701 CD1 PHE A 45 -1.826 -6.404 5.731 1.00 0.00 C ATOM 702 CD2 PHE A 45 -3.098 -8.386 5.668 1.00 0.00 C ATOM 703 CE1 PHE A 45 -1.296 -6.785 6.992 1.00 0.00 C ATOM 704 CE2 PHE A 45 -2.568 -8.767 6.929 1.00 0.00 C ATOM 705 CZ PHE A 45 -1.678 -7.958 7.564 1.00 0.00 C ATOM 0 H PHE A 45 -1.280 -8.785 3.178 1.00 0.00 H new ATOM 0 HA PHE A 45 -2.820 -6.838 1.603 1.00 0.00 H new ATOM 0 HB2 PHE A 45 -3.505 -5.734 3.754 1.00 0.00 H new ATOM 0 HB3 PHE A 45 -4.236 -7.318 3.582 1.00 0.00 H new ATOM 0 HD1 PHE A 45 -1.523 -5.472 5.277 1.00 0.00 H new ATOM 0 HD2 PHE A 45 -3.805 -9.028 5.163 1.00 0.00 H new ATOM 0 HE1 PHE A 45 -0.589 -6.143 7.497 1.00 0.00 H new ATOM 0 HE2 PHE A 45 -2.871 -9.699 7.384 1.00 0.00 H new ATOM 0 HZ PHE A 45 -1.274 -8.247 8.523 1.00 0.00 H new ATOM 715 N VAL A 46 -1.257 -4.966 2.720 1.00 0.00 N ATOM 716 CA VAL A 46 -0.128 -4.061 2.857 1.00 0.00 C ATOM 717 C VAL A 46 -0.399 -3.084 4.004 1.00 0.00 C ATOM 718 O VAL A 46 -1.525 -2.619 4.174 1.00 0.00 O ATOM 719 CB VAL A 46 0.144 -3.358 1.526 1.00 0.00 C ATOM 720 CG1 VAL A 46 1.254 -2.315 1.673 1.00 0.00 C ATOM 721 CG2 VAL A 46 0.486 -4.372 0.431 1.00 0.00 C ATOM 0 H VAL A 46 -2.164 -4.507 2.638 1.00 0.00 H new ATOM 0 HA VAL A 46 0.777 -4.615 3.108 1.00 0.00 H new ATOM 0 HB VAL A 46 -0.767 -2.838 1.229 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.427 -1.830 0.712 1.00 0.00 H new ATOM 0 HG12 VAL A 46 0.956 -1.567 2.408 1.00 0.00 H new ATOM 0 HG13 VAL A 46 2.171 -2.803 2.004 1.00 0.00 H new ATOM 0 HG21 VAL A 46 0.675 -3.847 -0.505 1.00 0.00 H new ATOM 0 HG22 VAL A 46 1.376 -4.932 0.719 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -0.349 -5.060 0.299 1.00 0.00 H new ATOM 731 N VAL A 47 0.651 -2.803 4.760 1.00 0.00 N ATOM 732 CA VAL A 47 0.541 -1.890 5.885 1.00 0.00 C ATOM 733 C VAL A 47 1.512 -0.725 5.689 1.00 0.00 C ATOM 734 O VAL A 47 2.553 -0.880 5.053 1.00 0.00 O ATOM 735 CB VAL A 47 0.770 -2.645 7.196 1.00 0.00 C ATOM 736 CG1 VAL A 47 -0.399 -3.583 7.501 1.00 0.00 C ATOM 737 CG2 VAL A 47 2.094 -3.412 7.163 1.00 0.00 C ATOM 0 H VAL A 47 1.583 -3.192 4.616 1.00 0.00 H new ATOM 0 HA VAL A 47 -0.463 -1.470 5.938 1.00 0.00 H new ATOM 0 HB VAL A 47 0.828 -1.910 7.999 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -0.210 -4.107 8.438 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -1.318 -3.003 7.588 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -0.503 -4.309 6.694 1.00 0.00 H new ATOM 0 HG21 VAL A 47 2.232 -3.940 8.107 1.00 0.00 H new ATOM 0 HG22 VAL A 47 2.078 -4.131 6.344 1.00 0.00 H new ATOM 0 HG23 VAL A 47 2.916 -2.712 7.015 1.00 0.00 H new ATOM 747 N GLY A 48 1.137 0.417 6.246 1.00 0.00 N ATOM 748 CA GLY A 48 1.962 1.608 6.140 1.00 0.00 C ATOM 749 C GLY A 48 1.388 2.583 5.110 1.00 0.00 C ATOM 750 O GLY A 48 1.592 3.792 5.213 1.00 0.00 O ATOM 0 H GLY A 48 0.272 0.543 6.772 1.00 0.00 H new ATOM 0 HA2 GLY A 48 2.027 2.097 7.112 1.00 0.00 H new ATOM 0 HA3 GLY A 48 2.976 1.328 5.855 1.00 0.00 H new ATOM 754 N LEU A 49 0.681 2.021 4.141 1.00 0.00 N ATOM 755 CA LEU A 49 0.076 2.825 3.093 1.00 0.00 C ATOM 756 C LEU A 49 -0.537 4.083 3.711 1.00 0.00 C ATOM 757 O LEU A 49 -0.908 4.085 4.884 1.00 0.00 O ATOM 758 CB LEU A 49 -0.918 1.991 2.283 1.00 0.00 C ATOM 759 CG LEU A 49 -0.316 1.099 1.195 1.00 0.00 C ATOM 760 CD1 LEU A 49 -1.327 0.052 0.724 1.00 0.00 C ATOM 761 CD2 LEU A 49 0.223 1.938 0.035 1.00 0.00 C ATOM 0 H LEU A 49 0.514 1.018 4.060 1.00 0.00 H new ATOM 0 HA LEU A 49 0.833 3.155 2.382 1.00 0.00 H new ATOM 0 HB2 LEU A 49 -1.479 1.360 2.972 1.00 0.00 H new ATOM 0 HB3 LEU A 49 -1.633 2.668 1.816 1.00 0.00 H new ATOM 0 HG LEU A 49 0.530 0.561 1.623 1.00 0.00 H new ATOM 0 HD11 LEU A 49 -0.874 -0.569 -0.049 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -1.621 -0.574 1.566 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -2.207 0.552 0.319 1.00 0.00 H new ATOM 0 HD21 LEU A 49 0.645 1.280 -0.724 1.00 0.00 H new ATOM 0 HD22 LEU A 49 -0.589 2.521 -0.400 1.00 0.00 H new ATOM 0 HD23 LEU A 49 0.997 2.612 0.402 1.00 0.00 H new ATOM 773 N PRO A 50 -0.626 5.151 2.873 1.00 0.00 N ATOM 774 CA PRO A 50 -1.188 6.412 3.325 1.00 0.00 C ATOM 775 C PRO A 50 -2.711 6.327 3.434 1.00 0.00 C ATOM 776 O PRO A 50 -3.301 5.289 3.137 1.00 0.00 O ATOM 777 CB PRO A 50 -0.722 7.439 2.305 1.00 0.00 C ATOM 778 CG PRO A 50 -0.310 6.646 1.075 1.00 0.00 C ATOM 779 CD PRO A 50 -0.196 5.185 1.478 1.00 0.00 C ATOM 0 HA PRO A 50 -0.855 6.685 4.326 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.519 8.143 2.067 1.00 0.00 H new ATOM 0 HB3 PRO A 50 0.114 8.023 2.692 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.045 6.766 0.280 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.641 7.010 0.687 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -0.826 4.552 0.854 1.00 0.00 H new ATOM 0 HD3 PRO A 50 0.826 4.823 1.370 1.00 0.00 H new ATOM 787 N GLU A 51 -3.306 7.431 3.861 1.00 0.00 N ATOM 788 CA GLU A 51 -4.749 7.494 4.012 1.00 0.00 C ATOM 789 C GLU A 51 -5.420 7.654 2.646 1.00 0.00 C ATOM 790 O GLU A 51 -4.874 8.303 1.755 1.00 0.00 O ATOM 791 CB GLU A 51 -5.153 8.628 4.957 1.00 0.00 C ATOM 792 CG GLU A 51 -4.861 9.993 4.332 1.00 0.00 C ATOM 793 CD GLU A 51 -4.848 11.092 5.396 1.00 0.00 C ATOM 794 OE1 GLU A 51 -4.149 10.890 6.412 1.00 0.00 O ATOM 795 OE2 GLU A 51 -5.537 12.110 5.169 1.00 0.00 O ATOM 0 H GLU A 51 -2.814 8.290 4.107 1.00 0.00 H new ATOM 0 HA GLU A 51 -5.089 6.558 4.455 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -6.215 8.551 5.190 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -4.612 8.532 5.898 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.898 9.965 3.822 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -5.615 10.221 3.578 1.00 0.00 H new ATOM 802 N GLY A 52 -6.593 7.051 2.525 1.00 0.00 N ATOM 803 CA GLY A 52 -7.344 7.118 1.283 1.00 0.00 C ATOM 804 C GLY A 52 -6.593 6.418 0.149 1.00 0.00 C ATOM 805 O GLY A 52 -6.727 6.793 -1.015 1.00 0.00 O ATOM 0 H GLY A 52 -7.042 6.514 3.267 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -8.320 6.653 1.419 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -7.522 8.160 1.017 1.00 0.00 H new ATOM 809 N ILE A 53 -5.818 5.412 0.528 1.00 0.00 N ATOM 810 CA ILE A 53 -5.045 4.656 -0.442 1.00 0.00 C ATOM 811 C ILE A 53 -4.959 3.196 0.008 1.00 0.00 C ATOM 812 O ILE A 53 -4.795 2.916 1.194 1.00 0.00 O ATOM 813 CB ILE A 53 -3.680 5.310 -0.668 1.00 0.00 C ATOM 814 CG1 ILE A 53 -3.836 6.785 -1.044 1.00 0.00 C ATOM 815 CG2 ILE A 53 -2.866 4.536 -1.706 1.00 0.00 C ATOM 816 CD1 ILE A 53 -2.501 7.377 -1.503 1.00 0.00 C ATOM 0 H ILE A 53 -5.709 5.103 1.494 1.00 0.00 H new ATOM 0 HA ILE A 53 -5.541 4.664 -1.413 1.00 0.00 H new ATOM 0 HB ILE A 53 -3.123 5.273 0.268 1.00 0.00 H new ATOM 0 HG12 ILE A 53 -4.575 6.885 -1.839 1.00 0.00 H new ATOM 0 HG13 ILE A 53 -4.211 7.345 -0.187 1.00 0.00 H new ATOM 0 HG21 ILE A 53 -1.901 5.022 -1.848 1.00 0.00 H new ATOM 0 HG22 ILE A 53 -2.710 3.515 -1.359 1.00 0.00 H new ATOM 0 HG23 ILE A 53 -3.406 4.519 -2.653 1.00 0.00 H new ATOM 0 HD11 ILE A 53 -2.639 8.426 -1.765 1.00 0.00 H new ATOM 0 HD12 ILE A 53 -1.771 7.297 -0.697 1.00 0.00 H new ATOM 0 HD13 ILE A 53 -2.141 6.830 -2.374 1.00 0.00 H new ATOM 828 N SER A 54 -5.075 2.303 -0.965 1.00 0.00 N ATOM 829 CA SER A 54 -5.013 0.879 -0.684 1.00 0.00 C ATOM 830 C SER A 54 -3.964 0.214 -1.578 1.00 0.00 C ATOM 831 O SER A 54 -3.011 0.862 -2.010 1.00 0.00 O ATOM 832 CB SER A 54 -6.378 0.217 -0.886 1.00 0.00 C ATOM 833 OG SER A 54 -6.687 -0.700 0.160 1.00 0.00 O ATOM 0 H SER A 54 -5.211 2.538 -1.948 1.00 0.00 H new ATOM 0 HA SER A 54 -4.727 0.749 0.360 1.00 0.00 H new ATOM 0 HB2 SER A 54 -7.150 0.985 -0.934 1.00 0.00 H new ATOM 0 HB3 SER A 54 -6.389 -0.307 -1.842 1.00 0.00 H new ATOM 0 HG SER A 54 -7.566 -1.100 -0.005 1.00 0.00 H new ATOM 839 N LEU A 55 -4.174 -1.070 -1.829 1.00 0.00 N ATOM 840 CA LEU A 55 -3.258 -1.828 -2.664 1.00 0.00 C ATOM 841 C LEU A 55 -3.900 -2.067 -4.032 1.00 0.00 C ATOM 842 O LEU A 55 -4.831 -2.862 -4.154 1.00 0.00 O ATOM 843 CB LEU A 55 -2.826 -3.113 -1.954 1.00 0.00 C ATOM 844 CG LEU A 55 -1.824 -3.991 -2.707 1.00 0.00 C ATOM 845 CD1 LEU A 55 -0.567 -3.198 -3.072 1.00 0.00 C ATOM 846 CD2 LEU A 55 -1.494 -5.254 -1.909 1.00 0.00 C ATOM 0 H LEU A 55 -4.965 -1.604 -1.469 1.00 0.00 H new ATOM 0 HA LEU A 55 -2.342 -1.262 -2.836 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -2.392 -2.844 -0.991 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -3.716 -3.707 -1.747 1.00 0.00 H new ATOM 0 HG LEU A 55 -2.285 -4.312 -3.641 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.129 -3.845 -3.606 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -0.840 -2.355 -3.707 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -0.093 -2.828 -2.163 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -0.780 -5.860 -2.466 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -1.061 -4.975 -0.948 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -2.406 -5.828 -1.743 1.00 0.00 H new ATOM 858 N ARG A 56 -3.378 -1.365 -5.026 1.00 0.00 N ATOM 859 CA ARG A 56 -3.889 -1.491 -6.381 1.00 0.00 C ATOM 860 C ARG A 56 -2.829 -1.046 -7.391 1.00 0.00 C ATOM 861 O ARG A 56 -1.904 -0.314 -7.044 1.00 0.00 O ATOM 862 CB ARG A 56 -5.152 -0.649 -6.573 1.00 0.00 C ATOM 863 CG ARG A 56 -6.355 -1.302 -5.889 1.00 0.00 C ATOM 864 CD ARG A 56 -7.650 -0.988 -6.641 1.00 0.00 C ATOM 865 NE ARG A 56 -8.655 -2.042 -6.381 1.00 0.00 N ATOM 866 CZ ARG A 56 -8.665 -3.237 -6.988 1.00 0.00 C ATOM 867 NH1 ARG A 56 -7.724 -3.536 -7.894 1.00 0.00 N ATOM 868 NH2 ARG A 56 -9.616 -4.133 -6.689 1.00 0.00 N ATOM 0 H ARG A 56 -2.606 -0.707 -4.921 1.00 0.00 H new ATOM 0 HA ARG A 56 -4.136 -2.540 -6.547 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -4.994 0.349 -6.164 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -5.355 -0.529 -7.637 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -6.210 -2.381 -5.842 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.431 -0.946 -4.862 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -8.037 -0.019 -6.326 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -7.452 -0.919 -7.711 1.00 0.00 H new ATOM 0 HE ARG A 56 -9.386 -1.847 -5.697 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -7.000 -2.854 -8.122 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -7.731 -4.445 -8.356 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -10.332 -3.906 -5.999 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -9.623 -5.042 -7.151 1.00 0.00 H new ATOM 882 N ARG A 57 -3.000 -1.508 -8.621 1.00 0.00 N ATOM 883 CA ARG A 57 -2.070 -1.167 -9.684 1.00 0.00 C ATOM 884 C ARG A 57 -1.756 0.330 -9.655 1.00 0.00 C ATOM 885 O ARG A 57 -2.640 1.148 -9.406 1.00 0.00 O ATOM 886 CB ARG A 57 -2.641 -1.535 -11.055 1.00 0.00 C ATOM 887 CG ARG A 57 -1.850 -2.682 -11.688 1.00 0.00 C ATOM 888 CD ARG A 57 -2.605 -3.277 -12.879 1.00 0.00 C ATOM 889 NE ARG A 57 -1.700 -3.399 -14.043 1.00 0.00 N ATOM 890 CZ ARG A 57 -1.262 -2.359 -14.766 1.00 0.00 C ATOM 891 NH1 ARG A 57 -1.644 -1.115 -14.449 1.00 0.00 N ATOM 892 NH2 ARG A 57 -0.442 -2.565 -15.806 1.00 0.00 N ATOM 0 H ARG A 57 -3.769 -2.115 -8.905 1.00 0.00 H new ATOM 0 HA ARG A 57 -1.155 -1.737 -9.519 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -3.687 -1.823 -10.952 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -2.613 -0.664 -11.710 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -0.875 -2.319 -12.015 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -1.668 -3.457 -10.944 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -3.004 -4.256 -12.614 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -3.455 -2.644 -13.134 1.00 0.00 H new ATOM 0 HE ARG A 57 -1.390 -4.333 -14.312 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -2.268 -0.959 -13.657 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -1.311 -0.323 -14.999 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -0.152 -3.513 -16.047 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -0.108 -1.774 -16.357 1.00 0.00 H new ATOM 906 N PRO A 58 -0.462 0.652 -9.920 1.00 0.00 N ATOM 907 CA PRO A 58 -0.020 2.036 -9.927 1.00 0.00 C ATOM 908 C PRO A 58 -0.494 2.756 -11.191 1.00 0.00 C ATOM 909 O PRO A 58 0.311 3.332 -11.921 1.00 0.00 O ATOM 910 CB PRO A 58 1.494 1.967 -9.815 1.00 0.00 C ATOM 911 CG PRO A 58 1.877 0.552 -10.217 1.00 0.00 C ATOM 912 CD PRO A 58 0.613 -0.291 -10.219 1.00 0.00 C ATOM 0 HA PRO A 58 -0.440 2.616 -9.105 1.00 0.00 H new ATOM 0 HB2 PRO A 58 1.968 2.700 -10.468 1.00 0.00 H new ATOM 0 HB3 PRO A 58 1.821 2.186 -8.799 1.00 0.00 H new ATOM 0 HG2 PRO A 58 2.340 0.548 -11.204 1.00 0.00 H new ATOM 0 HG3 PRO A 58 2.608 0.142 -9.520 1.00 0.00 H new ATOM 0 HD2 PRO A 58 0.460 -0.773 -11.185 1.00 0.00 H new ATOM 0 HD3 PRO A 58 0.664 -1.083 -9.472 1.00 0.00 H new ATOM 920 N ASN A 59 -1.800 2.700 -11.412 1.00 0.00 N ATOM 921 CA ASN A 59 -2.390 3.340 -12.575 1.00 0.00 C ATOM 922 C ASN A 59 -3.728 3.969 -12.181 1.00 0.00 C ATOM 923 O ASN A 59 -4.008 5.113 -12.535 1.00 0.00 O ATOM 924 CB ASN A 59 -2.655 2.323 -13.687 1.00 0.00 C ATOM 925 CG ASN A 59 -1.520 2.324 -14.713 1.00 0.00 C ATOM 926 OD1 ASN A 59 -0.406 1.733 -14.287 1.00 0.00 O flip ATOM 927 ND2 ASN A 59 -1.646 2.827 -15.817 1.00 0.00 N flip ATOM 0 H ASN A 59 -2.465 2.221 -10.805 1.00 0.00 H new ATOM 0 HA ASN A 59 -1.692 4.095 -12.936 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -2.760 1.327 -13.256 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -3.598 2.557 -14.182 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -2.529 3.265 -16.080 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -0.868 2.810 -16.477 1.00 0.00 H new ATOM 934 N CYS A 60 -4.519 3.194 -11.454 1.00 0.00 N ATOM 935 CA CYS A 60 -5.821 3.661 -11.008 1.00 0.00 C ATOM 936 C CYS A 60 -5.623 4.501 -9.745 1.00 0.00 C ATOM 937 O CYS A 60 -6.256 4.247 -8.721 1.00 0.00 O ATOM 938 CB CYS A 60 -6.789 2.500 -10.775 1.00 0.00 C ATOM 939 SG CYS A 60 -8.501 3.029 -11.147 1.00 0.00 S ATOM 0 H CYS A 60 -4.283 2.245 -11.162 1.00 0.00 H new ATOM 0 HA CYS A 60 -6.275 4.276 -11.785 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -6.515 1.655 -11.407 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -6.721 2.161 -9.741 1.00 0.00 H new ATOM 0 HG CYS A 60 -9.315 2.035 -10.948 1.00 0.00 H new ATOM 945 N PHE A 61 -4.742 5.484 -9.858 1.00 0.00 N ATOM 946 CA PHE A 61 -4.453 6.363 -8.737 1.00 0.00 C ATOM 947 C PHE A 61 -4.188 7.792 -9.216 1.00 0.00 C ATOM 948 O PHE A 61 -4.169 8.055 -10.417 1.00 0.00 O ATOM 949 CB PHE A 61 -3.192 5.823 -8.059 1.00 0.00 C ATOM 950 CG PHE A 61 -3.441 4.613 -7.156 1.00 0.00 C ATOM 951 CD1 PHE A 61 -3.398 3.357 -7.676 1.00 0.00 C ATOM 952 CD2 PHE A 61 -3.705 4.794 -5.834 1.00 0.00 C ATOM 953 CE1 PHE A 61 -3.629 2.234 -6.838 1.00 0.00 C ATOM 954 CE2 PHE A 61 -3.936 3.671 -4.997 1.00 0.00 C ATOM 955 CZ PHE A 61 -3.893 2.415 -5.516 1.00 0.00 C ATOM 0 H PHE A 61 -4.219 5.691 -10.709 1.00 0.00 H new ATOM 0 HA PHE A 61 -5.303 6.388 -8.055 1.00 0.00 H new ATOM 0 HB2 PHE A 61 -2.469 5.548 -8.827 1.00 0.00 H new ATOM 0 HB3 PHE A 61 -2.741 6.619 -7.466 1.00 0.00 H new ATOM 0 HD1 PHE A 61 -3.188 3.214 -8.726 1.00 0.00 H new ATOM 0 HD2 PHE A 61 -3.739 5.791 -5.421 1.00 0.00 H new ATOM 0 HE1 PHE A 61 -3.595 1.236 -7.250 1.00 0.00 H new ATOM 0 HE2 PHE A 61 -4.146 3.814 -3.947 1.00 0.00 H new ATOM 0 HZ PHE A 61 -4.068 1.561 -4.879 1.00 0.00 H new ATOM 965 N GLY A 62 -3.990 8.678 -8.250 1.00 0.00 N ATOM 966 CA GLY A 62 -3.727 10.073 -8.558 1.00 0.00 C ATOM 967 C GLY A 62 -2.267 10.432 -8.272 1.00 0.00 C ATOM 968 O GLY A 62 -1.650 9.867 -7.370 1.00 0.00 O ATOM 0 H GLY A 62 -4.007 8.456 -7.254 1.00 0.00 H new ATOM 0 HA2 GLY A 62 -3.954 10.267 -9.606 1.00 0.00 H new ATOM 0 HA3 GLY A 62 -4.384 10.710 -7.966 1.00 0.00 H new ATOM 972 N ILE A 63 -1.757 11.369 -9.057 1.00 0.00 N ATOM 973 CA ILE A 63 -0.382 11.810 -8.900 1.00 0.00 C ATOM 974 C ILE A 63 -0.051 11.914 -7.410 1.00 0.00 C ATOM 975 O ILE A 63 0.876 11.264 -6.929 1.00 0.00 O ATOM 976 CB ILE A 63 -0.143 13.108 -9.675 1.00 0.00 C ATOM 977 CG1 ILE A 63 0.146 12.821 -11.150 1.00 0.00 C ATOM 978 CG2 ILE A 63 0.965 13.938 -9.025 1.00 0.00 C ATOM 979 CD1 ILE A 63 -1.062 13.167 -12.023 1.00 0.00 C ATOM 0 H ILE A 63 -2.272 11.835 -9.804 1.00 0.00 H new ATOM 0 HA ILE A 63 0.303 11.079 -9.329 1.00 0.00 H new ATOM 0 HB ILE A 63 -1.056 13.702 -9.636 1.00 0.00 H new ATOM 0 HG12 ILE A 63 1.011 13.400 -11.474 1.00 0.00 H new ATOM 0 HG13 ILE A 63 0.401 11.769 -11.276 1.00 0.00 H new ATOM 0 HG21 ILE A 63 1.115 14.855 -9.595 1.00 0.00 H new ATOM 0 HG22 ILE A 63 0.680 14.189 -8.003 1.00 0.00 H new ATOM 0 HG23 ILE A 63 1.891 13.363 -9.013 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -0.830 12.954 -13.066 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -1.919 12.569 -11.712 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -1.299 14.225 -11.913 1.00 0.00 H new ATOM 991 N ALA A 64 -0.827 12.737 -6.720 1.00 0.00 N ATOM 992 CA ALA A 64 -0.628 12.934 -5.294 1.00 0.00 C ATOM 993 C ALA A 64 -0.521 11.572 -4.605 1.00 0.00 C ATOM 994 O ALA A 64 0.369 11.356 -3.785 1.00 0.00 O ATOM 995 CB ALA A 64 -1.770 13.784 -4.732 1.00 0.00 C ATOM 0 H ALA A 64 -1.595 13.275 -7.122 1.00 0.00 H new ATOM 0 HA ALA A 64 0.302 13.472 -5.107 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -1.621 13.932 -3.662 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -1.784 14.752 -5.234 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -2.719 13.275 -4.899 1.00 0.00 H new ATOM 1001 N LYS A 65 -1.442 10.689 -4.964 1.00 0.00 N ATOM 1002 CA LYS A 65 -1.462 9.354 -4.391 1.00 0.00 C ATOM 1003 C LYS A 65 -0.112 8.678 -4.636 1.00 0.00 C ATOM 1004 O LYS A 65 0.599 8.343 -3.690 1.00 0.00 O ATOM 1005 CB LYS A 65 -2.655 8.559 -4.927 1.00 0.00 C ATOM 1006 CG LYS A 65 -3.970 9.290 -4.650 1.00 0.00 C ATOM 1007 CD LYS A 65 -5.169 8.372 -4.892 1.00 0.00 C ATOM 1008 CE LYS A 65 -6.317 8.705 -3.937 1.00 0.00 C ATOM 1009 NZ LYS A 65 -7.488 7.844 -4.214 1.00 0.00 N ATOM 0 H LYS A 65 -2.179 10.872 -5.644 1.00 0.00 H new ATOM 0 HA LYS A 65 -1.602 9.405 -3.311 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -2.540 8.403 -6.000 1.00 0.00 H new ATOM 0 HB3 LYS A 65 -2.678 7.573 -4.462 1.00 0.00 H new ATOM 0 HG2 LYS A 65 -3.982 9.646 -3.620 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -4.044 10.168 -5.292 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -5.508 8.475 -5.923 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -4.869 7.333 -4.757 1.00 0.00 H new ATOM 0 HE2 LYS A 65 -5.992 8.566 -2.906 1.00 0.00 H new ATOM 0 HE3 LYS A 65 -6.595 9.753 -4.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 -8.258 8.083 -3.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 -7.807 7.996 -5.192 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 -7.223 6.846 -4.088 1.00 0.00 H new ATOM 1023 N LEU A 66 0.201 8.498 -5.911 1.00 0.00 N ATOM 1024 CA LEU A 66 1.453 7.868 -6.293 1.00 0.00 C ATOM 1025 C LEU A 66 2.576 8.387 -5.392 1.00 0.00 C ATOM 1026 O LEU A 66 3.327 7.603 -4.815 1.00 0.00 O ATOM 1027 CB LEU A 66 1.720 8.067 -7.786 1.00 0.00 C ATOM 1028 CG LEU A 66 0.688 7.460 -8.739 1.00 0.00 C ATOM 1029 CD1 LEU A 66 0.905 7.955 -10.170 1.00 0.00 C ATOM 1030 CD2 LEU A 66 0.694 5.933 -8.653 1.00 0.00 C ATOM 0 H LEU A 66 -0.391 8.778 -6.693 1.00 0.00 H new ATOM 0 HA LEU A 66 1.397 6.790 -6.144 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.783 9.137 -7.984 1.00 0.00 H new ATOM 0 HB3 LEU A 66 2.696 7.642 -8.020 1.00 0.00 H new ATOM 0 HG LEU A 66 -0.302 7.796 -8.429 1.00 0.00 H new ATOM 0 HD11 LEU A 66 0.158 7.508 -10.827 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.810 9.040 -10.198 1.00 0.00 H new ATOM 0 HD13 LEU A 66 1.902 7.669 -10.507 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.048 5.527 -9.340 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.681 5.557 -8.922 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.453 5.625 -7.635 1.00 0.00 H new ATOM 1042 N ARG A 67 2.654 9.707 -5.301 1.00 0.00 N ATOM 1043 CA ARG A 67 3.673 10.341 -4.481 1.00 0.00 C ATOM 1044 C ARG A 67 3.547 9.880 -3.027 1.00 0.00 C ATOM 1045 O ARG A 67 4.493 9.336 -2.460 1.00 0.00 O ATOM 1046 CB ARG A 67 3.555 11.865 -4.537 1.00 0.00 C ATOM 1047 CG ARG A 67 3.899 12.390 -5.932 1.00 0.00 C ATOM 1048 CD ARG A 67 4.104 13.907 -5.912 1.00 0.00 C ATOM 1049 NE ARG A 67 4.747 14.347 -7.170 1.00 0.00 N ATOM 1050 CZ ARG A 67 6.015 14.070 -7.504 1.00 0.00 C ATOM 1051 NH1 ARG A 67 6.784 13.352 -6.674 1.00 0.00 N ATOM 1052 NH2 ARG A 67 6.514 14.511 -8.666 1.00 0.00 N ATOM 0 H ARG A 67 2.029 10.354 -5.781 1.00 0.00 H new ATOM 0 HA ARG A 67 4.646 10.048 -4.876 1.00 0.00 H new ATOM 0 HB2 ARG A 67 2.541 12.165 -4.271 1.00 0.00 H new ATOM 0 HB3 ARG A 67 4.223 12.312 -3.801 1.00 0.00 H new ATOM 0 HG2 ARG A 67 4.803 11.902 -6.295 1.00 0.00 H new ATOM 0 HG3 ARG A 67 3.099 12.137 -6.627 1.00 0.00 H new ATOM 0 HD2 ARG A 67 3.145 14.410 -5.789 1.00 0.00 H new ATOM 0 HD3 ARG A 67 4.723 14.187 -5.060 1.00 0.00 H new ATOM 0 HE ARG A 67 4.190 14.896 -7.825 1.00 0.00 H new ATOM 0 HH11 ARG A 67 6.404 13.017 -5.789 1.00 0.00 H new ATOM 0 HH12 ARG A 67 7.749 13.141 -6.928 1.00 0.00 H new ATOM 0 HH21 ARG A 67 5.929 15.058 -9.297 1.00 0.00 H new ATOM 0 HH22 ARG A 67 7.479 14.300 -8.919 1.00 0.00 H new ATOM 1066 N LYS A 68 2.369 10.114 -2.466 1.00 0.00 N ATOM 1067 CA LYS A 68 2.107 9.729 -1.089 1.00 0.00 C ATOM 1068 C LYS A 68 2.704 8.345 -0.828 1.00 0.00 C ATOM 1069 O LYS A 68 3.615 8.201 -0.014 1.00 0.00 O ATOM 1070 CB LYS A 68 0.611 9.821 -0.783 1.00 0.00 C ATOM 1071 CG LYS A 68 0.296 11.071 0.041 1.00 0.00 C ATOM 1072 CD LYS A 68 -0.570 12.049 -0.755 1.00 0.00 C ATOM 1073 CE LYS A 68 -2.032 11.975 -0.309 1.00 0.00 C ATOM 1074 NZ LYS A 68 -2.852 12.955 -1.055 1.00 0.00 N ATOM 0 H LYS A 68 1.586 10.565 -2.940 1.00 0.00 H new ATOM 0 HA LYS A 68 2.593 10.421 -0.401 1.00 0.00 H new ATOM 0 HB2 LYS A 68 0.046 9.844 -1.715 1.00 0.00 H new ATOM 0 HB3 LYS A 68 0.292 8.932 -0.239 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -0.220 10.786 0.958 1.00 0.00 H new ATOM 0 HG3 LYS A 68 1.224 11.559 0.337 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -0.196 13.064 -0.621 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -0.498 11.821 -1.819 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -2.418 10.969 -0.474 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -2.102 12.172 0.761 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -3.841 12.891 -0.740 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -2.493 13.915 -0.877 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -2.799 12.749 -2.073 1.00 0.00 H new ATOM 1088 N ILE A 69 2.167 7.361 -1.535 1.00 0.00 N ATOM 1089 CA ILE A 69 2.636 5.994 -1.390 1.00 0.00 C ATOM 1090 C ILE A 69 4.166 5.980 -1.394 1.00 0.00 C ATOM 1091 O ILE A 69 4.787 5.404 -0.503 1.00 0.00 O ATOM 1092 CB ILE A 69 2.010 5.097 -2.460 1.00 0.00 C ATOM 1093 CG1 ILE A 69 0.501 4.962 -2.249 1.00 0.00 C ATOM 1094 CG2 ILE A 69 2.706 3.735 -2.510 1.00 0.00 C ATOM 1095 CD1 ILE A 69 -0.190 4.470 -3.522 1.00 0.00 C ATOM 0 H ILE A 69 1.412 7.484 -2.210 1.00 0.00 H new ATOM 0 HA ILE A 69 2.316 5.581 -0.433 1.00 0.00 H new ATOM 0 HB ILE A 69 2.158 5.570 -3.431 1.00 0.00 H new ATOM 0 HG12 ILE A 69 0.305 4.266 -1.433 1.00 0.00 H new ATOM 0 HG13 ILE A 69 0.084 5.925 -1.954 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.242 3.117 -3.279 1.00 0.00 H new ATOM 0 HG22 ILE A 69 3.761 3.874 -2.745 1.00 0.00 H new ATOM 0 HG23 ILE A 69 2.611 3.242 -1.542 1.00 0.00 H new ATOM 0 HD11 ILE A 69 -1.262 4.383 -3.344 1.00 0.00 H new ATOM 0 HD12 ILE A 69 -0.013 5.180 -4.330 1.00 0.00 H new ATOM 0 HD13 ILE A 69 0.212 3.496 -3.801 1.00 0.00 H new ATOM 1107 N LEU A 70 4.729 6.621 -2.408 1.00 0.00 N ATOM 1108 CA LEU A 70 6.174 6.690 -2.539 1.00 0.00 C ATOM 1109 C LEU A 70 6.766 7.340 -1.287 1.00 0.00 C ATOM 1110 O LEU A 70 7.830 6.939 -0.819 1.00 0.00 O ATOM 1111 CB LEU A 70 6.561 7.397 -3.840 1.00 0.00 C ATOM 1112 CG LEU A 70 6.297 6.619 -5.130 1.00 0.00 C ATOM 1113 CD1 LEU A 70 6.470 7.516 -6.357 1.00 0.00 C ATOM 1114 CD2 LEU A 70 7.177 5.369 -5.206 1.00 0.00 C ATOM 0 H LEU A 70 4.210 7.097 -3.146 1.00 0.00 H new ATOM 0 HA LEU A 70 6.598 5.688 -2.609 1.00 0.00 H new ATOM 0 HB2 LEU A 70 6.020 8.342 -3.892 1.00 0.00 H new ATOM 0 HB3 LEU A 70 7.623 7.640 -3.796 1.00 0.00 H new ATOM 0 HG LEU A 70 5.260 6.284 -5.120 1.00 0.00 H new ATOM 0 HD11 LEU A 70 6.277 6.938 -7.261 1.00 0.00 H new ATOM 0 HD12 LEU A 70 5.768 8.348 -6.301 1.00 0.00 H new ATOM 0 HD13 LEU A 70 7.489 7.902 -6.385 1.00 0.00 H new ATOM 0 HD21 LEU A 70 6.970 4.834 -6.133 1.00 0.00 H new ATOM 0 HD22 LEU A 70 8.227 5.661 -5.183 1.00 0.00 H new ATOM 0 HD23 LEU A 70 6.962 4.721 -4.357 1.00 0.00 H new ATOM 1126 N GLU A 71 6.050 8.333 -0.780 1.00 0.00 N ATOM 1127 CA GLU A 71 6.490 9.042 0.409 1.00 0.00 C ATOM 1128 C GLU A 71 6.312 8.163 1.649 1.00 0.00 C ATOM 1129 O GLU A 71 6.980 8.368 2.661 1.00 0.00 O ATOM 1130 CB GLU A 71 5.743 10.368 0.565 1.00 0.00 C ATOM 1131 CG GLU A 71 5.879 11.226 -0.694 1.00 0.00 C ATOM 1132 CD GLU A 71 6.114 12.694 -0.335 1.00 0.00 C ATOM 1133 OE1 GLU A 71 5.531 13.130 0.681 1.00 0.00 O ATOM 1134 OE2 GLU A 71 6.871 13.348 -1.084 1.00 0.00 O ATOM 0 H GLU A 71 5.168 8.663 -1.171 1.00 0.00 H new ATOM 0 HA GLU A 71 7.550 9.271 0.300 1.00 0.00 H new ATOM 0 HB2 GLU A 71 4.689 10.174 0.765 1.00 0.00 H new ATOM 0 HB3 GLU A 71 6.136 10.912 1.424 1.00 0.00 H new ATOM 0 HG2 GLU A 71 6.707 10.859 -1.300 1.00 0.00 H new ATOM 0 HG3 GLU A 71 4.977 11.136 -1.299 1.00 0.00 H new ATOM 1141 N ALA A 72 5.408 7.202 1.528 1.00 0.00 N ATOM 1142 CA ALA A 72 5.133 6.291 2.626 1.00 0.00 C ATOM 1143 C ALA A 72 5.726 4.918 2.304 1.00 0.00 C ATOM 1144 O ALA A 72 5.270 3.903 2.827 1.00 0.00 O ATOM 1145 CB ALA A 72 3.624 6.231 2.875 1.00 0.00 C ATOM 0 H ALA A 72 4.857 7.034 0.686 1.00 0.00 H new ATOM 0 HA ALA A 72 5.601 6.645 3.545 1.00 0.00 H new ATOM 0 HB1 ALA A 72 3.418 5.547 3.699 1.00 0.00 H new ATOM 0 HB2 ALA A 72 3.257 7.226 3.128 1.00 0.00 H new ATOM 0 HB3 ALA A 72 3.121 5.877 1.975 1.00 0.00 H new ATOM 1151 N SER A 73 6.734 4.931 1.444 1.00 0.00 N ATOM 1152 CA SER A 73 7.394 3.699 1.046 1.00 0.00 C ATOM 1153 C SER A 73 7.969 2.993 2.276 1.00 0.00 C ATOM 1154 O SER A 73 7.498 1.923 2.658 1.00 0.00 O ATOM 1155 CB SER A 73 8.501 3.973 0.025 1.00 0.00 C ATOM 1156 OG SER A 73 9.729 3.349 0.390 1.00 0.00 O ATOM 0 H SER A 73 7.110 5.775 1.012 1.00 0.00 H new ATOM 0 HA SER A 73 6.655 3.051 0.575 1.00 0.00 H new ATOM 0 HB2 SER A 73 8.188 3.612 -0.955 1.00 0.00 H new ATOM 0 HB3 SER A 73 8.653 5.049 -0.065 1.00 0.00 H new ATOM 0 HG SER A 73 10.410 3.546 -0.287 1.00 0.00 H new ATOM 1162 N ASN A 74 8.979 3.620 2.861 1.00 0.00 N ATOM 1163 CA ASN A 74 9.623 3.065 4.039 1.00 0.00 C ATOM 1164 C ASN A 74 8.553 2.549 5.004 1.00 0.00 C ATOM 1165 O ASN A 74 8.744 1.524 5.657 1.00 0.00 O ATOM 1166 CB ASN A 74 10.445 4.128 4.770 1.00 0.00 C ATOM 1167 CG ASN A 74 11.868 4.199 4.211 1.00 0.00 C ATOM 1168 OD1 ASN A 74 12.313 3.344 3.464 1.00 0.00 O ATOM 1169 ND2 ASN A 74 12.554 5.265 4.615 1.00 0.00 N ATOM 0 H ASN A 74 9.367 4.507 2.541 1.00 0.00 H new ATOM 0 HA ASN A 74 10.282 2.259 3.715 1.00 0.00 H new ATOM 0 HB2 ASN A 74 9.962 5.100 4.669 1.00 0.00 H new ATOM 0 HB3 ASN A 74 10.480 3.898 5.835 1.00 0.00 H new ATOM 0 HD21 ASN A 74 13.513 5.404 4.298 1.00 0.00 H new ATOM 0 HD22 ASN A 74 12.120 5.943 5.242 1.00 0.00 H new ATOM 1176 N SER A 75 7.452 3.282 5.063 1.00 0.00 N ATOM 1177 CA SER A 75 6.352 2.911 5.937 1.00 0.00 C ATOM 1178 C SER A 75 5.627 1.686 5.376 1.00 0.00 C ATOM 1179 O SER A 75 5.348 0.737 6.107 1.00 0.00 O ATOM 1180 CB SER A 75 5.372 4.073 6.112 1.00 0.00 C ATOM 1181 OG SER A 75 6.011 5.239 6.626 1.00 0.00 O ATOM 0 H SER A 75 7.297 4.131 4.520 1.00 0.00 H new ATOM 0 HA SER A 75 6.762 2.665 6.917 1.00 0.00 H new ATOM 0 HB2 SER A 75 4.911 4.306 5.152 1.00 0.00 H new ATOM 0 HB3 SER A 75 4.570 3.772 6.786 1.00 0.00 H new ATOM 0 HG SER A 75 5.352 5.958 6.721 1.00 0.00 H new ATOM 1187 N ILE A 76 5.344 1.746 4.083 1.00 0.00 N ATOM 1188 CA ILE A 76 4.657 0.653 3.416 1.00 0.00 C ATOM 1189 C ILE A 76 5.334 -0.669 3.785 1.00 0.00 C ATOM 1190 O ILE A 76 6.516 -0.692 4.123 1.00 0.00 O ATOM 1191 CB ILE A 76 4.584 0.907 1.909 1.00 0.00 C ATOM 1192 CG1 ILE A 76 3.422 1.842 1.566 1.00 0.00 C ATOM 1193 CG2 ILE A 76 4.508 -0.410 1.134 1.00 0.00 C ATOM 1194 CD1 ILE A 76 3.382 2.139 0.066 1.00 0.00 C ATOM 0 H ILE A 76 5.578 2.534 3.480 1.00 0.00 H new ATOM 0 HA ILE A 76 3.623 0.588 3.755 1.00 0.00 H new ATOM 0 HB ILE A 76 5.502 1.408 1.602 1.00 0.00 H new ATOM 0 HG12 ILE A 76 2.481 1.387 1.876 1.00 0.00 H new ATOM 0 HG13 ILE A 76 3.524 2.774 2.122 1.00 0.00 H new ATOM 0 HG21 ILE A 76 4.457 -0.201 0.065 1.00 0.00 H new ATOM 0 HG22 ILE A 76 5.395 -1.008 1.345 1.00 0.00 H new ATOM 0 HG23 ILE A 76 3.618 -0.961 1.439 1.00 0.00 H new ATOM 0 HD11 ILE A 76 2.547 2.805 -0.151 1.00 0.00 H new ATOM 0 HD12 ILE A 76 4.315 2.616 -0.236 1.00 0.00 H new ATOM 0 HD13 ILE A 76 3.256 1.208 -0.486 1.00 0.00 H new ATOM 1206 N GLN A 77 4.554 -1.737 3.707 1.00 0.00 N ATOM 1207 CA GLN A 77 5.063 -3.060 4.029 1.00 0.00 C ATOM 1208 C GLN A 77 4.045 -4.131 3.632 1.00 0.00 C ATOM 1209 O GLN A 77 2.869 -4.035 3.983 1.00 0.00 O ATOM 1210 CB GLN A 77 5.419 -3.164 5.513 1.00 0.00 C ATOM 1211 CG GLN A 77 6.338 -4.359 5.774 1.00 0.00 C ATOM 1212 CD GLN A 77 7.100 -4.189 7.090 1.00 0.00 C ATOM 1213 OE1 GLN A 77 6.563 -3.754 8.095 1.00 0.00 O ATOM 1214 NE2 GLN A 77 8.377 -4.554 7.027 1.00 0.00 N ATOM 0 H GLN A 77 3.574 -1.714 3.426 1.00 0.00 H new ATOM 0 HA GLN A 77 5.977 -3.226 3.458 1.00 0.00 H new ATOM 0 HB2 GLN A 77 5.909 -2.246 5.838 1.00 0.00 H new ATOM 0 HB3 GLN A 77 4.508 -3.266 6.103 1.00 0.00 H new ATOM 0 HG2 GLN A 77 5.748 -5.275 5.807 1.00 0.00 H new ATOM 0 HG3 GLN A 77 7.045 -4.465 4.951 1.00 0.00 H new ATOM 0 HE21 GLN A 77 8.763 -4.910 6.153 1.00 0.00 H new ATOM 0 HE22 GLN A 77 8.971 -4.478 7.853 1.00 0.00 H new ATOM 1223 N PHE A 78 4.533 -5.126 2.907 1.00 0.00 N ATOM 1224 CA PHE A 78 3.680 -6.214 2.460 1.00 0.00 C ATOM 1225 C PHE A 78 3.679 -7.362 3.471 1.00 0.00 C ATOM 1226 O PHE A 78 4.575 -8.205 3.461 1.00 0.00 O ATOM 1227 CB PHE A 78 4.257 -6.718 1.135 1.00 0.00 C ATOM 1228 CG PHE A 78 3.835 -5.892 -0.082 1.00 0.00 C ATOM 1229 CD1 PHE A 78 4.047 -4.549 -0.098 1.00 0.00 C ATOM 1230 CD2 PHE A 78 3.249 -6.501 -1.147 1.00 0.00 C ATOM 1231 CE1 PHE A 78 3.656 -3.782 -1.227 1.00 0.00 C ATOM 1232 CE2 PHE A 78 2.857 -5.734 -2.276 1.00 0.00 C ATOM 1233 CZ PHE A 78 3.069 -4.390 -2.292 1.00 0.00 C ATOM 0 H PHE A 78 5.508 -5.202 2.618 1.00 0.00 H new ATOM 0 HA PHE A 78 2.654 -5.862 2.351 1.00 0.00 H new ATOM 0 HB2 PHE A 78 5.345 -6.719 1.201 1.00 0.00 H new ATOM 0 HB3 PHE A 78 3.946 -7.752 0.985 1.00 0.00 H new ATOM 0 HD1 PHE A 78 4.513 -4.066 0.748 1.00 0.00 H new ATOM 0 HD2 PHE A 78 3.082 -7.568 -1.134 1.00 0.00 H new ATOM 0 HE1 PHE A 78 3.825 -2.715 -1.240 1.00 0.00 H new ATOM 0 HE2 PHE A 78 2.391 -6.217 -3.122 1.00 0.00 H new ATOM 0 HZ PHE A 78 2.771 -3.806 -3.150 1.00 0.00 H new ATOM 1243 N VAL A 79 2.663 -7.358 4.322 1.00 0.00 N ATOM 1244 CA VAL A 79 2.533 -8.389 5.338 1.00 0.00 C ATOM 1245 C VAL A 79 1.900 -9.635 4.716 1.00 0.00 C ATOM 1246 O VAL A 79 0.875 -9.545 4.043 1.00 0.00 O ATOM 1247 CB VAL A 79 1.743 -7.849 6.532 1.00 0.00 C ATOM 1248 CG1 VAL A 79 1.460 -8.958 7.548 1.00 0.00 C ATOM 1249 CG2 VAL A 79 2.475 -6.677 7.189 1.00 0.00 C ATOM 0 H VAL A 79 1.922 -6.657 4.329 1.00 0.00 H new ATOM 0 HA VAL A 79 3.513 -8.678 5.717 1.00 0.00 H new ATOM 0 HB VAL A 79 0.786 -7.481 6.162 1.00 0.00 H new ATOM 0 HG11 VAL A 79 0.897 -8.548 8.387 1.00 0.00 H new ATOM 0 HG12 VAL A 79 0.878 -9.748 7.072 1.00 0.00 H new ATOM 0 HG13 VAL A 79 2.402 -9.369 7.910 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.892 -6.312 8.035 1.00 0.00 H new ATOM 0 HG22 VAL A 79 3.453 -7.009 7.538 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.602 -5.874 6.463 1.00 0.00 H new ATOM 1259 N ILE A 80 2.539 -10.770 4.964 1.00 0.00 N ATOM 1260 CA ILE A 80 2.051 -12.033 4.437 1.00 0.00 C ATOM 1261 C ILE A 80 1.486 -12.874 5.582 1.00 0.00 C ATOM 1262 O ILE A 80 2.133 -13.037 6.616 1.00 0.00 O ATOM 1263 CB ILE A 80 3.148 -12.739 3.638 1.00 0.00 C ATOM 1264 CG1 ILE A 80 3.904 -11.749 2.750 1.00 0.00 C ATOM 1265 CG2 ILE A 80 2.575 -13.908 2.834 1.00 0.00 C ATOM 1266 CD1 ILE A 80 3.003 -11.212 1.636 1.00 0.00 C ATOM 0 H ILE A 80 3.390 -10.841 5.522 1.00 0.00 H new ATOM 0 HA ILE A 80 1.236 -11.863 3.734 1.00 0.00 H new ATOM 0 HB ILE A 80 3.869 -13.155 4.342 1.00 0.00 H new ATOM 0 HG12 ILE A 80 4.273 -10.921 3.355 1.00 0.00 H new ATOM 0 HG13 ILE A 80 4.775 -12.238 2.314 1.00 0.00 H new ATOM 0 HG21 ILE A 80 3.376 -14.392 2.275 1.00 0.00 H new ATOM 0 HG22 ILE A 80 2.119 -14.628 3.514 1.00 0.00 H new ATOM 0 HG23 ILE A 80 1.821 -13.537 2.140 1.00 0.00 H new ATOM 0 HD11 ILE A 80 3.565 -10.511 1.020 1.00 0.00 H new ATOM 0 HD12 ILE A 80 2.655 -12.040 1.018 1.00 0.00 H new ATOM 0 HD13 ILE A 80 2.146 -10.702 2.075 1.00 0.00 H new ATOM 1278 N LYS A 81 0.284 -13.387 5.361 1.00 0.00 N ATOM 1279 CA LYS A 81 -0.376 -14.208 6.362 1.00 0.00 C ATOM 1280 C LYS A 81 -0.527 -15.633 5.828 1.00 0.00 C ATOM 1281 O LYS A 81 -0.344 -16.599 6.566 1.00 0.00 O ATOM 1282 CB LYS A 81 -1.697 -13.568 6.793 1.00 0.00 C ATOM 1283 CG LYS A 81 -1.508 -12.086 7.123 1.00 0.00 C ATOM 1284 CD LYS A 81 -1.421 -11.868 8.634 1.00 0.00 C ATOM 1285 CE LYS A 81 -2.756 -11.375 9.195 1.00 0.00 C ATOM 1286 NZ LYS A 81 -3.135 -12.158 10.393 1.00 0.00 N ATOM 0 H LYS A 81 -0.250 -13.250 4.503 1.00 0.00 H new ATOM 0 HA LYS A 81 0.231 -14.270 7.265 1.00 0.00 H new ATOM 0 HB2 LYS A 81 -2.434 -13.676 5.997 1.00 0.00 H new ATOM 0 HB3 LYS A 81 -2.091 -14.091 7.665 1.00 0.00 H new ATOM 0 HG2 LYS A 81 -0.600 -11.716 6.646 1.00 0.00 H new ATOM 0 HG3 LYS A 81 -2.339 -11.510 6.716 1.00 0.00 H new ATOM 0 HD2 LYS A 81 -1.139 -12.800 9.124 1.00 0.00 H new ATOM 0 HD3 LYS A 81 -0.639 -11.142 8.856 1.00 0.00 H new ATOM 0 HE2 LYS A 81 -2.681 -10.318 9.452 1.00 0.00 H new ATOM 0 HE3 LYS A 81 -3.532 -11.464 8.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 -4.043 -11.811 10.762 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 -3.226 -13.162 10.137 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 -2.402 -12.052 11.123 1.00 0.00 H new ATOM 1300 N ARG A 82 -0.860 -15.719 4.548 1.00 0.00 N ATOM 1301 CA ARG A 82 -1.039 -17.010 3.906 1.00 0.00 C ATOM 1302 C ARG A 82 -0.455 -16.985 2.492 1.00 0.00 C ATOM 1303 O ARG A 82 -1.127 -16.576 1.547 1.00 0.00 O ATOM 1304 CB ARG A 82 -2.519 -17.389 3.833 1.00 0.00 C ATOM 1305 CG ARG A 82 -3.091 -17.638 5.230 1.00 0.00 C ATOM 1306 CD ARG A 82 -4.437 -18.363 5.150 1.00 0.00 C ATOM 1307 NE ARG A 82 -5.092 -18.362 6.477 1.00 0.00 N ATOM 1308 CZ ARG A 82 -6.377 -18.680 6.680 1.00 0.00 C ATOM 1309 NH1 ARG A 82 -7.153 -19.027 5.645 1.00 0.00 N ATOM 1310 NH2 ARG A 82 -6.887 -18.651 7.919 1.00 0.00 N ATOM 0 H ARG A 82 -1.010 -14.915 3.938 1.00 0.00 H new ATOM 0 HA ARG A 82 -0.515 -17.754 4.506 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.079 -16.592 3.344 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.639 -18.284 3.222 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -2.388 -18.232 5.814 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -3.216 -16.688 5.751 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -5.080 -17.874 4.418 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -4.288 -19.388 4.810 1.00 0.00 H new ATOM 0 HE ARG A 82 -4.530 -18.103 7.288 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -6.765 -19.049 4.702 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -8.132 -19.269 5.800 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -6.296 -18.387 8.708 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -7.866 -18.893 8.073 1.00 0.00 H new ATOM 1324 N PRO A 83 0.823 -17.439 2.390 1.00 0.00 N ATOM 1325 CA PRO A 83 1.505 -17.473 1.108 1.00 0.00 C ATOM 1326 C PRO A 83 0.990 -18.625 0.242 1.00 0.00 C ATOM 1327 O PRO A 83 1.210 -18.644 -0.968 1.00 0.00 O ATOM 1328 CB PRO A 83 2.980 -17.601 1.449 1.00 0.00 C ATOM 1329 CG PRO A 83 3.034 -18.101 2.884 1.00 0.00 C ATOM 1330 CD PRO A 83 1.650 -17.931 3.489 1.00 0.00 C ATOM 0 HA PRO A 83 1.324 -16.578 0.513 1.00 0.00 H new ATOM 0 HB2 PRO A 83 3.478 -18.297 0.774 1.00 0.00 H new ATOM 0 HB3 PRO A 83 3.488 -16.642 1.350 1.00 0.00 H new ATOM 0 HG2 PRO A 83 3.337 -19.148 2.912 1.00 0.00 H new ATOM 0 HG3 PRO A 83 3.772 -17.540 3.456 1.00 0.00 H new ATOM 0 HD2 PRO A 83 1.270 -18.875 3.879 1.00 0.00 H new ATOM 0 HD3 PRO A 83 1.665 -17.226 4.320 1.00 0.00 H new ATOM 1338 N GLU A 84 0.313 -19.557 0.897 1.00 0.00 N ATOM 1339 CA GLU A 84 -0.236 -20.710 0.203 1.00 0.00 C ATOM 1340 C GLU A 84 -1.213 -20.259 -0.885 1.00 0.00 C ATOM 1341 O GLU A 84 -1.456 -20.986 -1.846 1.00 0.00 O ATOM 1342 CB GLU A 84 -0.912 -21.670 1.184 1.00 0.00 C ATOM 1343 CG GLU A 84 -2.214 -21.075 1.724 1.00 0.00 C ATOM 1344 CD GLU A 84 -3.016 -22.124 2.497 1.00 0.00 C ATOM 1345 OE1 GLU A 84 -2.441 -22.687 3.454 1.00 0.00 O ATOM 1346 OE2 GLU A 84 -4.186 -22.339 2.115 1.00 0.00 O ATOM 0 H GLU A 84 0.132 -19.537 1.901 1.00 0.00 H new ATOM 0 HA GLU A 84 0.584 -21.248 -0.273 1.00 0.00 H new ATOM 0 HB2 GLU A 84 -1.120 -22.617 0.687 1.00 0.00 H new ATOM 0 HB3 GLU A 84 -0.236 -21.886 2.011 1.00 0.00 H new ATOM 0 HG2 GLU A 84 -1.990 -20.231 2.376 1.00 0.00 H new ATOM 0 HG3 GLU A 84 -2.812 -20.690 0.898 1.00 0.00 H new ATOM 1353 N LEU A 85 -1.748 -19.061 -0.695 1.00 0.00 N ATOM 1354 CA LEU A 85 -2.694 -18.505 -1.648 1.00 0.00 C ATOM 1355 C LEU A 85 -1.956 -18.137 -2.937 1.00 0.00 C ATOM 1356 O LEU A 85 -2.450 -18.393 -4.034 1.00 0.00 O ATOM 1357 CB LEU A 85 -3.459 -17.337 -1.023 1.00 0.00 C ATOM 1358 CG LEU A 85 -4.311 -17.672 0.203 1.00 0.00 C ATOM 1359 CD1 LEU A 85 -4.830 -16.400 0.875 1.00 0.00 C ATOM 1360 CD2 LEU A 85 -5.445 -18.631 -0.163 1.00 0.00 C ATOM 0 H LEU A 85 -1.544 -18.461 0.104 1.00 0.00 H new ATOM 0 HA LEU A 85 -3.449 -19.246 -1.913 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -2.741 -16.567 -0.742 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -4.108 -16.905 -1.785 1.00 0.00 H new ATOM 0 HG LEU A 85 -3.679 -18.183 0.929 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -5.432 -16.667 1.743 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -3.987 -15.787 1.193 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -5.441 -15.839 0.168 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -6.035 -18.853 0.726 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -6.083 -18.169 -0.916 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -5.026 -19.555 -0.560 1.00 0.00 H new ATOM 1372 N LEU A 86 -0.785 -17.543 -2.762 1.00 0.00 N ATOM 1373 CA LEU A 86 0.026 -17.138 -3.897 1.00 0.00 C ATOM 1374 C LEU A 86 0.106 -18.291 -4.899 1.00 0.00 C ATOM 1375 O LEU A 86 -0.147 -18.104 -6.088 1.00 0.00 O ATOM 1376 CB LEU A 86 1.393 -16.636 -3.428 1.00 0.00 C ATOM 1377 CG LEU A 86 1.375 -15.534 -2.367 1.00 0.00 C ATOM 1378 CD1 LEU A 86 2.796 -15.133 -1.967 1.00 0.00 C ATOM 1379 CD2 LEU A 86 0.552 -14.333 -2.838 1.00 0.00 C ATOM 0 H LEU A 86 -0.378 -17.332 -1.851 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.437 -16.297 -4.414 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.953 -17.484 -3.033 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.940 -16.268 -4.296 1.00 0.00 H new ATOM 0 HG LEU A 86 0.889 -15.928 -1.474 1.00 0.00 H new ATOM 0 HD11 LEU A 86 2.754 -14.348 -1.212 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.318 -16.000 -1.561 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.330 -14.765 -2.843 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.555 -13.564 -2.065 1.00 0.00 H new ATOM 0 HD22 LEU A 86 0.987 -13.930 -3.753 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -0.473 -14.648 -3.032 1.00 0.00 H new ATOM 1391 N THR A 87 0.459 -19.459 -4.382 1.00 0.00 N ATOM 1392 CA THR A 87 0.575 -20.643 -5.217 1.00 0.00 C ATOM 1393 C THR A 87 -0.809 -21.116 -5.666 1.00 0.00 C ATOM 1394 O THR A 87 -1.423 -21.958 -5.012 1.00 0.00 O ATOM 1395 CB THR A 87 1.354 -21.700 -4.432 1.00 0.00 C ATOM 1396 OG1 THR A 87 0.623 -21.838 -3.216 1.00 0.00 O ATOM 1397 CG2 THR A 87 2.730 -21.202 -3.986 1.00 0.00 C ATOM 0 H THR A 87 0.668 -19.611 -3.395 1.00 0.00 H new ATOM 0 HA THR A 87 1.124 -20.429 -6.134 1.00 0.00 H new ATOM 0 HB THR A 87 1.473 -22.593 -5.045 1.00 0.00 H new ATOM 0 HG1 THR A 87 -0.267 -21.441 -3.322 1.00 0.00 H new ATOM 0 HG21 THR A 87 3.241 -21.991 -3.433 1.00 0.00 H new ATOM 0 HG22 THR A 87 3.320 -20.932 -4.861 1.00 0.00 H new ATOM 0 HG23 THR A 87 2.611 -20.329 -3.345 1.00 0.00 H new ATOM 1405 N GLU A 88 -1.259 -20.555 -6.778 1.00 0.00 N ATOM 1406 CA GLU A 88 -2.559 -20.909 -7.322 1.00 0.00 C ATOM 1407 C GLU A 88 -2.396 -21.857 -8.512 1.00 0.00 C ATOM 1408 O GLU A 88 -3.001 -22.927 -8.546 1.00 0.00 O ATOM 1409 CB GLU A 88 -3.346 -19.659 -7.721 1.00 0.00 C ATOM 1410 CG GLU A 88 -4.514 -19.418 -6.763 1.00 0.00 C ATOM 1411 CD GLU A 88 -5.688 -20.345 -7.086 1.00 0.00 C ATOM 1412 OE1 GLU A 88 -5.556 -21.552 -6.793 1.00 0.00 O ATOM 1413 OE2 GLU A 88 -6.692 -19.824 -7.618 1.00 0.00 O ATOM 0 H GLU A 88 -0.747 -19.857 -7.318 1.00 0.00 H new ATOM 0 HA GLU A 88 -3.127 -21.424 -6.547 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -2.685 -18.793 -7.719 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -3.722 -19.771 -8.738 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.187 -19.583 -5.736 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -4.837 -18.379 -6.831 1.00 0.00 H new ATOM 1420 N GLY A 89 -1.575 -21.430 -9.460 1.00 0.00 N ATOM 1421 CA GLY A 89 -1.324 -22.227 -10.649 1.00 0.00 C ATOM 1422 C GLY A 89 -0.949 -21.338 -11.836 1.00 0.00 C ATOM 1423 O GLY A 89 0.115 -20.721 -11.843 1.00 0.00 O ATOM 0 H GLY A 89 -1.075 -20.542 -9.429 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -0.520 -22.936 -10.453 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -2.211 -22.811 -10.894 1.00 0.00 H new ATOM 1427 N VAL A 90 -1.844 -21.300 -12.812 1.00 0.00 N ATOM 1428 CA VAL A 90 -1.620 -20.496 -14.002 1.00 0.00 C ATOM 1429 C VAL A 90 -0.177 -20.682 -14.474 1.00 0.00 C ATOM 1430 O VAL A 90 0.560 -19.710 -14.628 1.00 0.00 O ATOM 1431 CB VAL A 90 -1.973 -19.034 -13.721 1.00 0.00 C ATOM 1432 CG1 VAL A 90 -1.175 -18.497 -12.531 1.00 0.00 C ATOM 1433 CG2 VAL A 90 -1.756 -18.169 -14.963 1.00 0.00 C ATOM 0 H VAL A 90 -2.726 -21.813 -12.803 1.00 0.00 H new ATOM 0 HA VAL A 90 -2.272 -20.824 -14.812 1.00 0.00 H new ATOM 0 HB VAL A 90 -3.031 -18.988 -13.463 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -1.444 -17.456 -12.352 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -1.402 -19.088 -11.644 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.109 -18.564 -12.748 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -2.014 -17.135 -14.736 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -0.710 -18.224 -15.266 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -2.388 -18.531 -15.774 1.00 0.00 H new ATOM 1443 N LYS A 91 0.184 -21.939 -14.690 1.00 0.00 N ATOM 1444 CA LYS A 91 1.526 -22.265 -15.141 1.00 0.00 C ATOM 1445 C LYS A 91 1.456 -23.415 -16.148 1.00 0.00 C ATOM 1446 O LYS A 91 0.610 -24.301 -16.026 1.00 0.00 O ATOM 1447 CB LYS A 91 2.439 -22.548 -13.947 1.00 0.00 C ATOM 1448 CG LYS A 91 3.905 -22.298 -14.306 1.00 0.00 C ATOM 1449 CD LYS A 91 4.839 -22.978 -13.302 1.00 0.00 C ATOM 1450 CE LYS A 91 6.184 -23.316 -13.946 1.00 0.00 C ATOM 1451 NZ LYS A 91 7.299 -22.933 -13.052 1.00 0.00 N ATOM 0 H LYS A 91 -0.430 -22.743 -14.561 1.00 0.00 H new ATOM 0 HA LYS A 91 1.971 -21.415 -15.658 1.00 0.00 H new ATOM 0 HB2 LYS A 91 2.153 -21.914 -13.108 1.00 0.00 H new ATOM 0 HB3 LYS A 91 2.311 -23.581 -13.624 1.00 0.00 H new ATOM 0 HG2 LYS A 91 4.107 -22.675 -15.309 1.00 0.00 H new ATOM 0 HG3 LYS A 91 4.101 -21.226 -14.323 1.00 0.00 H new ATOM 0 HD2 LYS A 91 4.997 -22.323 -12.445 1.00 0.00 H new ATOM 0 HD3 LYS A 91 4.373 -23.889 -12.926 1.00 0.00 H new ATOM 0 HE2 LYS A 91 6.233 -24.384 -14.161 1.00 0.00 H new ATOM 0 HE3 LYS A 91 6.279 -22.795 -14.899 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 8.205 -23.170 -13.505 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 7.261 -21.910 -12.868 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 7.216 -23.450 -12.153 1.00 0.00 H new ATOM 1465 N GLU A 92 2.356 -23.366 -17.119 1.00 0.00 N ATOM 1466 CA GLU A 92 2.406 -24.393 -18.145 1.00 0.00 C ATOM 1467 C GLU A 92 3.280 -25.561 -17.685 1.00 0.00 C ATOM 1468 O GLU A 92 4.430 -25.365 -17.294 1.00 0.00 O ATOM 1469 CB GLU A 92 2.912 -23.819 -19.470 1.00 0.00 C ATOM 1470 CG GLU A 92 1.800 -23.065 -20.202 1.00 0.00 C ATOM 1471 CD GLU A 92 2.367 -22.233 -21.354 1.00 0.00 C ATOM 1472 OE1 GLU A 92 3.342 -21.495 -21.095 1.00 0.00 O ATOM 1473 OE2 GLU A 92 1.812 -22.354 -22.468 1.00 0.00 O ATOM 0 H GLU A 92 3.056 -22.631 -17.217 1.00 0.00 H new ATOM 0 HA GLU A 92 1.395 -24.764 -18.309 1.00 0.00 H new ATOM 0 HB2 GLU A 92 3.750 -23.147 -19.283 1.00 0.00 H new ATOM 0 HB3 GLU A 92 3.285 -24.626 -20.101 1.00 0.00 H new ATOM 0 HG2 GLU A 92 1.068 -23.774 -20.587 1.00 0.00 H new ATOM 0 HG3 GLU A 92 1.276 -22.414 -19.502 1.00 0.00 H new ATOM 1480 N PRO A 93 2.686 -26.783 -17.747 1.00 0.00 N ATOM 1481 CA PRO A 93 3.397 -27.983 -17.341 1.00 0.00 C ATOM 1482 C PRO A 93 4.428 -28.392 -18.395 1.00 0.00 C ATOM 1483 O PRO A 93 4.127 -29.182 -19.289 1.00 0.00 O ATOM 1484 CB PRO A 93 2.315 -29.029 -17.130 1.00 0.00 C ATOM 1485 CG PRO A 93 1.090 -28.517 -17.869 1.00 0.00 C ATOM 1486 CD PRO A 93 1.326 -27.053 -18.204 1.00 0.00 C ATOM 0 HA PRO A 93 3.977 -27.841 -16.429 1.00 0.00 H new ATOM 0 HB2 PRO A 93 2.628 -29.998 -17.518 1.00 0.00 H new ATOM 0 HB3 PRO A 93 2.103 -29.163 -16.069 1.00 0.00 H new ATOM 0 HG2 PRO A 93 0.924 -29.095 -18.778 1.00 0.00 H new ATOM 0 HG3 PRO A 93 0.198 -28.629 -17.253 1.00 0.00 H new ATOM 0 HD2 PRO A 93 1.224 -26.870 -19.274 1.00 0.00 H new ATOM 0 HD3 PRO A 93 0.604 -26.410 -17.700 1.00 0.00 H new ATOM 1494 N SER A 94 5.623 -27.837 -18.255 1.00 0.00 N ATOM 1495 CA SER A 94 6.700 -28.135 -19.184 1.00 0.00 C ATOM 1496 C SER A 94 8.037 -28.170 -18.441 1.00 0.00 C ATOM 1497 O SER A 94 8.508 -27.144 -17.954 1.00 0.00 O ATOM 1498 CB SER A 94 6.749 -27.108 -20.317 1.00 0.00 C ATOM 1499 OG SER A 94 6.488 -27.701 -21.586 1.00 0.00 O ATOM 0 H SER A 94 5.869 -27.183 -17.512 1.00 0.00 H new ATOM 0 HA SER A 94 6.511 -29.114 -19.625 1.00 0.00 H new ATOM 0 HB2 SER A 94 6.018 -26.323 -20.126 1.00 0.00 H new ATOM 0 HB3 SER A 94 7.730 -26.633 -20.334 1.00 0.00 H new ATOM 0 HG SER A 94 6.527 -27.013 -22.283 1.00 0.00 H new ATOM 1505 N GLY A 95 8.610 -29.363 -18.377 1.00 0.00 N ATOM 1506 CA GLY A 95 9.884 -29.546 -17.702 1.00 0.00 C ATOM 1507 C GLY A 95 10.760 -30.555 -18.446 1.00 0.00 C ATOM 1508 O GLY A 95 11.599 -30.173 -19.260 1.00 0.00 O ATOM 0 H GLY A 95 8.216 -30.212 -18.781 1.00 0.00 H new ATOM 0 HA2 GLY A 95 10.403 -28.590 -17.633 1.00 0.00 H new ATOM 0 HA3 GLY A 95 9.713 -29.890 -16.682 1.00 0.00 H new ATOM 1512 N PRO A 96 10.528 -31.858 -18.133 1.00 0.00 N ATOM 1513 CA PRO A 96 11.285 -32.926 -18.763 1.00 0.00 C ATOM 1514 C PRO A 96 10.820 -33.153 -20.203 1.00 0.00 C ATOM 1515 O PRO A 96 9.790 -33.786 -20.434 1.00 0.00 O ATOM 1516 CB PRO A 96 11.073 -34.138 -17.872 1.00 0.00 C ATOM 1517 CG PRO A 96 9.838 -33.832 -17.039 1.00 0.00 C ATOM 1518 CD PRO A 96 9.542 -32.348 -17.174 1.00 0.00 C ATOM 0 HA PRO A 96 12.346 -32.694 -18.850 1.00 0.00 H new ATOM 0 HB2 PRO A 96 10.929 -35.040 -18.467 1.00 0.00 H new ATOM 0 HB3 PRO A 96 11.941 -34.311 -17.235 1.00 0.00 H new ATOM 0 HG2 PRO A 96 8.989 -34.423 -17.383 1.00 0.00 H new ATOM 0 HG3 PRO A 96 10.007 -34.094 -15.995 1.00 0.00 H new ATOM 0 HD2 PRO A 96 8.526 -32.178 -17.529 1.00 0.00 H new ATOM 0 HD3 PRO A 96 9.634 -31.837 -16.216 1.00 0.00 H new ATOM 1526 N SER A 97 11.600 -32.624 -21.134 1.00 0.00 N ATOM 1527 CA SER A 97 11.280 -32.761 -22.545 1.00 0.00 C ATOM 1528 C SER A 97 11.976 -33.996 -23.121 1.00 0.00 C ATOM 1529 O SER A 97 13.128 -33.923 -23.545 1.00 0.00 O ATOM 1530 CB SER A 97 11.687 -31.510 -23.326 1.00 0.00 C ATOM 1531 OG SER A 97 11.268 -31.571 -24.687 1.00 0.00 O ATOM 0 H SER A 97 12.453 -32.100 -20.939 1.00 0.00 H new ATOM 0 HA SER A 97 10.201 -32.881 -22.641 1.00 0.00 H new ATOM 0 HB2 SER A 97 11.253 -30.630 -22.852 1.00 0.00 H new ATOM 0 HB3 SER A 97 12.770 -31.393 -23.285 1.00 0.00 H new ATOM 0 HG SER A 97 11.545 -30.754 -25.152 1.00 0.00 H new ATOM 1537 N SER A 98 11.246 -35.102 -23.119 1.00 0.00 N ATOM 1538 CA SER A 98 11.778 -36.351 -23.636 1.00 0.00 C ATOM 1539 C SER A 98 13.215 -36.550 -23.149 1.00 0.00 C ATOM 1540 O SER A 98 14.160 -36.084 -23.784 1.00 0.00 O ATOM 1541 CB SER A 98 11.728 -36.380 -25.165 1.00 0.00 C ATOM 1542 OG SER A 98 12.587 -35.402 -25.746 1.00 0.00 O ATOM 0 H SER A 98 10.290 -35.159 -22.767 1.00 0.00 H new ATOM 0 HA SER A 98 11.158 -37.166 -23.263 1.00 0.00 H new ATOM 0 HB2 SER A 98 12.015 -37.370 -25.518 1.00 0.00 H new ATOM 0 HB3 SER A 98 10.704 -36.207 -25.498 1.00 0.00 H new ATOM 0 HG SER A 98 13.235 -35.097 -25.077 1.00 0.00 H new ATOM 1548 N GLY A 99 13.334 -37.241 -22.025 1.00 0.00 N ATOM 1549 CA GLY A 99 14.639 -37.507 -21.444 1.00 0.00 C ATOM 1550 C GLY A 99 14.623 -37.283 -19.931 1.00 0.00 C ATOM 1551 O GLY A 99 14.803 -36.159 -19.465 1.00 0.00 O ATOM 0 H GLY A 99 12.548 -37.625 -21.501 1.00 0.00 H new ATOM 0 HA2 GLY A 99 14.934 -38.534 -21.660 1.00 0.00 H new ATOM 0 HA3 GLY A 99 15.384 -36.858 -21.903 1.00 0.00 H new TER 1555 GLY A 99