USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 908 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 48 GLN : amide:sc= 0.814 K(o=1.8,f=-2.8) USER MOD Set 1.2: A 61 SER OG : rot -106:sc= 0.948 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 180:sc= 0 USER MOD Single : A 9 ASN : amide:sc= -1.19! C(o=-1.2!,f=-10!) USER MOD Single : A 15 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0166) USER MOD Single : A 18 SER OG : rot -125:sc= -0.426 USER MOD Single : A 21 SER OG : rot 81:sc= 0.513 USER MOD Single : A 23 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 TYR OH : rot 180:sc= -0.0998 USER MOD Single : A 35 SER OG : rot 180:sc= 0 USER MOD Single : A 37 SER OG : rot 180:sc= 0 USER MOD Single : A 38 CYS SG : rot 180:sc= 0 USER MOD Single : A 39 ASN : amide:sc= -3.53! C(o=-3.5!,f=-3.9!) USER MOD Single : A 43 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 LYS NZ :NH3+ 148:sc= -0.206 (180deg=-1.25!) USER MOD Single : A 49 CYS SG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 74:sc= 1.79 USER MOD Single : A 57 SER OG : rot 170:sc= 0.0964 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 TYR OH : 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+ -126:sc= -3.49! (180deg=-6.14!) USER MOD Single : A 74 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 78 SER OG : rot 180:sc= 0 USER MOD Single : A 81 SER OG : rot 180:sc= 0 USER MOD Single : A 82 THR OG1 : rot -20:sc= -0.0893 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 GLN : amide:sc= -1.08 K(o=-1.1,f=-0.45) USER MOD Single : A 88 LYS NZ :NH3+ -148:sc= -0.104 (180deg=-1.45!) USER MOD Single : A 90 SER OG : rot 180:sc= -3.35! USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 THR OG1 : rot -81:sc= -0.0983! USER MOD Single : A 101 ASN : amide:sc= 0 K(o=0,f=-0.64) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 MET CE :methyl -150:sc= -2.92 (180deg=-4.9!) USER MOD Single : A 107 SER OG : rot 180:sc= 0 USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 SER OG : rot 180:sc= 0 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -0.561 20.267 -5.342 1.00 0.00 N ATOM 2 CA GLY A 1 -0.135 20.214 -6.730 1.00 0.00 C ATOM 3 C GLY A 1 1.349 20.559 -6.863 1.00 0.00 C ATOM 4 O GLY A 1 1.704 21.720 -7.070 1.00 0.00 O ATOM 0 H1 GLY A 1 -1.571 20.029 -5.280 1.00 0.00 H new ATOM 0 H2 GLY A 1 -0.009 19.585 -4.783 1.00 0.00 H new ATOM 0 H3 GLY A 1 -0.407 21.225 -4.968 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -0.317 19.217 -7.132 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -0.728 20.910 -7.323 1.00 0.00 H new ATOM 8 N SER A 2 2.177 19.533 -6.738 1.00 0.00 N ATOM 9 CA SER A 2 3.614 19.714 -6.841 1.00 0.00 C ATOM 10 C SER A 2 4.201 18.696 -7.821 1.00 0.00 C ATOM 11 O SER A 2 3.591 17.661 -8.087 1.00 0.00 O ATOM 12 CB SER A 2 4.286 19.580 -5.473 1.00 0.00 C ATOM 13 OG SER A 2 4.426 20.840 -4.822 1.00 0.00 O ATOM 0 H SER A 2 1.880 18.573 -6.566 1.00 0.00 H new ATOM 0 HA SER A 2 3.805 20.720 -7.213 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.699 18.910 -4.845 1.00 0.00 H new ATOM 0 HB3 SER A 2 5.268 19.123 -5.595 1.00 0.00 H new ATOM 0 HG SER A 2 4.857 20.712 -3.951 1.00 0.00 H new ATOM 19 N SER A 3 5.378 19.025 -8.333 1.00 0.00 N ATOM 20 CA SER A 3 6.054 18.152 -9.279 1.00 0.00 C ATOM 21 C SER A 3 7.462 18.678 -9.563 1.00 0.00 C ATOM 22 O SER A 3 7.703 19.882 -9.498 1.00 0.00 O ATOM 23 CB SER A 3 5.259 18.031 -10.581 1.00 0.00 C ATOM 24 OG SER A 3 5.845 17.090 -11.477 1.00 0.00 O ATOM 0 H SER A 3 5.881 19.884 -8.111 1.00 0.00 H new ATOM 0 HA SER A 3 6.127 17.159 -8.836 1.00 0.00 H new ATOM 0 HB2 SER A 3 4.236 17.729 -10.355 1.00 0.00 H new ATOM 0 HB3 SER A 3 5.204 19.006 -11.064 1.00 0.00 H new ATOM 0 HG SER A 3 5.308 17.040 -12.295 1.00 0.00 H new ATOM 30 N GLY A 4 8.356 17.750 -9.871 1.00 0.00 N ATOM 31 CA GLY A 4 9.733 18.106 -10.165 1.00 0.00 C ATOM 32 C GLY A 4 10.570 16.859 -10.460 1.00 0.00 C ATOM 33 O GLY A 4 10.331 16.165 -11.448 1.00 0.00 O ATOM 0 H GLY A 4 8.153 16.752 -9.923 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.763 18.780 -11.021 1.00 0.00 H new ATOM 0 HA3 GLY A 4 10.162 18.645 -9.320 1.00 0.00 H new ATOM 37 N SER A 5 11.533 16.611 -9.585 1.00 0.00 N ATOM 38 CA SER A 5 12.406 15.461 -9.738 1.00 0.00 C ATOM 39 C SER A 5 11.667 14.184 -9.332 1.00 0.00 C ATOM 40 O SER A 5 10.540 14.245 -8.843 1.00 0.00 O ATOM 41 CB SER A 5 13.682 15.623 -8.909 1.00 0.00 C ATOM 42 OG SER A 5 14.368 16.833 -9.216 1.00 0.00 O ATOM 0 H SER A 5 11.728 17.188 -8.767 1.00 0.00 H new ATOM 0 HA SER A 5 12.694 15.388 -10.787 1.00 0.00 H new ATOM 0 HB2 SER A 5 13.430 15.608 -7.849 1.00 0.00 H new ATOM 0 HB3 SER A 5 14.343 14.775 -9.091 1.00 0.00 H new ATOM 0 HG SER A 5 15.176 16.900 -8.665 1.00 0.00 H new ATOM 48 N SER A 6 12.332 13.058 -9.548 1.00 0.00 N ATOM 49 CA SER A 6 11.752 11.770 -9.210 1.00 0.00 C ATOM 50 C SER A 6 12.764 10.930 -8.428 1.00 0.00 C ATOM 51 O SER A 6 12.626 10.751 -7.219 1.00 0.00 O ATOM 52 CB SER A 6 11.300 11.023 -10.465 1.00 0.00 C ATOM 53 OG SER A 6 10.682 9.777 -10.153 1.00 0.00 O ATOM 0 H SER A 6 13.267 13.012 -9.953 1.00 0.00 H new ATOM 0 HA SER A 6 10.874 11.943 -8.587 1.00 0.00 H new ATOM 0 HB2 SER A 6 10.600 11.644 -11.024 1.00 0.00 H new ATOM 0 HB3 SER A 6 12.160 10.849 -11.112 1.00 0.00 H new ATOM 0 HG SER A 6 10.406 9.332 -10.981 1.00 0.00 H new ATOM 59 N GLY A 7 13.760 10.437 -9.151 1.00 0.00 N ATOM 60 CA GLY A 7 14.795 9.620 -8.540 1.00 0.00 C ATOM 61 C GLY A 7 14.993 8.316 -9.317 1.00 0.00 C ATOM 62 O GLY A 7 14.415 8.133 -10.386 1.00 0.00 O ATOM 0 H GLY A 7 13.872 10.588 -10.154 1.00 0.00 H new ATOM 0 HA2 GLY A 7 15.732 10.176 -8.510 1.00 0.00 H new ATOM 0 HA3 GLY A 7 14.525 9.395 -7.508 1.00 0.00 H new ATOM 66 N LEU A 8 15.813 7.445 -8.746 1.00 0.00 N ATOM 67 CA LEU A 8 16.095 6.164 -9.372 1.00 0.00 C ATOM 68 C LEU A 8 16.072 5.065 -8.307 1.00 0.00 C ATOM 69 O LEU A 8 16.557 5.265 -7.194 1.00 0.00 O ATOM 70 CB LEU A 8 17.404 6.229 -10.160 1.00 0.00 C ATOM 71 CG LEU A 8 17.435 7.213 -11.331 1.00 0.00 C ATOM 72 CD1 LEU A 8 18.863 7.414 -11.842 1.00 0.00 C ATOM 73 CD2 LEU A 8 16.484 6.771 -12.444 1.00 0.00 C ATOM 0 H LEU A 8 16.290 7.601 -7.858 1.00 0.00 H new ATOM 0 HA LEU A 8 15.323 5.918 -10.101 1.00 0.00 H new ATOM 0 HB2 LEU A 8 18.207 6.490 -9.471 1.00 0.00 H new ATOM 0 HB3 LEU A 8 17.624 5.233 -10.543 1.00 0.00 H new ATOM 0 HG LEU A 8 17.083 8.181 -10.973 1.00 0.00 H new ATOM 0 HD11 LEU A 8 18.856 8.118 -12.674 1.00 0.00 H new ATOM 0 HD12 LEU A 8 19.485 7.808 -11.038 1.00 0.00 H new ATOM 0 HD13 LEU A 8 19.267 6.459 -12.178 1.00 0.00 H new ATOM 0 HD21 LEU A 8 16.525 7.488 -13.264 1.00 0.00 H new ATOM 0 HD22 LEU A 8 16.781 5.787 -12.807 1.00 0.00 H new ATOM 0 HD23 LEU A 8 15.467 6.723 -12.055 1.00 0.00 H new ATOM 85 N ASN A 9 15.504 3.930 -8.686 1.00 0.00 N ATOM 86 CA ASN A 9 15.412 2.800 -7.777 1.00 0.00 C ATOM 87 C ASN A 9 14.534 1.716 -8.405 1.00 0.00 C ATOM 88 O ASN A 9 14.956 0.568 -8.536 1.00 0.00 O ATOM 89 CB ASN A 9 14.775 3.212 -6.448 1.00 0.00 C ATOM 90 CG ASN A 9 13.758 4.337 -6.653 1.00 0.00 C ATOM 91 OD1 ASN A 9 13.135 4.464 -7.693 1.00 0.00 O ATOM 92 ND2 ASN A 9 13.628 5.145 -5.604 1.00 0.00 N ATOM 0 H ASN A 9 15.103 3.768 -9.610 1.00 0.00 H new ATOM 0 HA ASN A 9 16.421 2.432 -7.594 1.00 0.00 H new ATOM 0 HB2 ASN A 9 14.284 2.351 -5.994 1.00 0.00 H new ATOM 0 HB3 ASN A 9 15.550 3.539 -5.755 1.00 0.00 H new ATOM 0 HD21 ASN A 9 12.975 5.928 -5.641 1.00 0.00 H new ATOM 0 HD22 ASN A 9 14.181 4.982 -4.763 1.00 0.00 H new ATOM 99 N ASP A 10 13.327 2.119 -8.777 1.00 0.00 N ATOM 100 CA ASP A 10 12.386 1.196 -9.389 1.00 0.00 C ATOM 101 C ASP A 10 11.055 1.913 -9.623 1.00 0.00 C ATOM 102 O ASP A 10 10.726 2.866 -8.918 1.00 0.00 O ATOM 103 CB ASP A 10 12.122 -0.006 -8.479 1.00 0.00 C ATOM 104 CG ASP A 10 12.097 -1.361 -9.189 1.00 0.00 C ATOM 105 OD1 ASP A 10 13.202 -1.874 -9.471 1.00 0.00 O ATOM 106 OD2 ASP A 10 10.974 -1.852 -9.433 1.00 0.00 O ATOM 0 H ASP A 10 12.980 3.072 -8.666 1.00 0.00 H new ATOM 0 HA ASP A 10 12.816 0.849 -10.329 1.00 0.00 H new ATOM 0 HB2 ASP A 10 12.889 -0.032 -7.705 1.00 0.00 H new ATOM 0 HB3 ASP A 10 11.166 0.141 -7.976 1.00 0.00 H new ATOM 111 N GLU A 11 10.324 1.428 -10.616 1.00 0.00 N ATOM 112 CA GLU A 11 9.036 2.010 -10.952 1.00 0.00 C ATOM 113 C GLU A 11 7.947 1.456 -10.031 1.00 0.00 C ATOM 114 O GLU A 11 7.139 2.213 -9.495 1.00 0.00 O ATOM 115 CB GLU A 11 8.689 1.764 -12.422 1.00 0.00 C ATOM 116 CG GLU A 11 8.315 0.300 -12.659 1.00 0.00 C ATOM 117 CD GLU A 11 8.211 -0.005 -14.155 1.00 0.00 C ATOM 118 OE1 GLU A 11 7.441 0.713 -14.828 1.00 0.00 O ATOM 119 OE2 GLU A 11 8.904 -0.949 -14.591 1.00 0.00 O ATOM 0 H GLU A 11 10.600 0.638 -11.199 1.00 0.00 H new ATOM 0 HA GLU A 11 9.097 3.088 -10.803 1.00 0.00 H new ATOM 0 HB2 GLU A 11 7.860 2.407 -12.716 1.00 0.00 H new ATOM 0 HB3 GLU A 11 9.539 2.032 -13.050 1.00 0.00 H new ATOM 0 HG2 GLU A 11 9.063 -0.348 -12.203 1.00 0.00 H new ATOM 0 HG3 GLU A 11 7.364 0.081 -12.173 1.00 0.00 H new ATOM 126 N LEU A 12 7.961 0.141 -9.876 1.00 0.00 N ATOM 127 CA LEU A 12 6.984 -0.523 -9.029 1.00 0.00 C ATOM 128 C LEU A 12 7.459 -0.476 -7.576 1.00 0.00 C ATOM 129 O LEU A 12 6.656 -0.297 -6.662 1.00 0.00 O ATOM 130 CB LEU A 12 6.707 -1.939 -9.540 1.00 0.00 C ATOM 131 CG LEU A 12 6.261 -2.050 -10.999 1.00 0.00 C ATOM 132 CD1 LEU A 12 5.820 -3.477 -11.330 1.00 0.00 C ATOM 133 CD2 LEU A 12 5.173 -1.025 -11.320 1.00 0.00 C ATOM 0 H LEU A 12 8.633 -0.483 -10.322 1.00 0.00 H new ATOM 0 HA LEU A 12 6.028 -0.001 -9.069 1.00 0.00 H new ATOM 0 HB2 LEU A 12 7.611 -2.534 -9.411 1.00 0.00 H new ATOM 0 HB3 LEU A 12 5.938 -2.387 -8.911 1.00 0.00 H new ATOM 0 HG LEU A 12 7.116 -1.821 -11.635 1.00 0.00 H new ATOM 0 HD11 LEU A 12 5.508 -3.529 -12.373 1.00 0.00 H new ATOM 0 HD12 LEU A 12 6.652 -4.162 -11.166 1.00 0.00 H new ATOM 0 HD13 LEU A 12 4.986 -3.758 -10.687 1.00 0.00 H new ATOM 0 HD21 LEU A 12 4.874 -1.126 -12.363 1.00 0.00 H new ATOM 0 HD22 LEU A 12 4.310 -1.197 -10.677 1.00 0.00 H new ATOM 0 HD23 LEU A 12 5.558 -0.020 -11.148 1.00 0.00 H new ATOM 145 N LEU A 13 8.764 -0.640 -7.407 1.00 0.00 N ATOM 146 CA LEU A 13 9.355 -0.618 -6.081 1.00 0.00 C ATOM 147 C LEU A 13 9.414 0.825 -5.577 1.00 0.00 C ATOM 148 O LEU A 13 9.599 1.754 -6.362 1.00 0.00 O ATOM 149 CB LEU A 13 10.714 -1.322 -6.088 1.00 0.00 C ATOM 150 CG LEU A 13 10.840 -2.545 -5.176 1.00 0.00 C ATOM 151 CD1 LEU A 13 12.242 -3.149 -5.261 1.00 0.00 C ATOM 152 CD2 LEU A 13 10.452 -2.198 -3.738 1.00 0.00 C ATOM 0 H LEU A 13 9.428 -0.789 -8.167 1.00 0.00 H new ATOM 0 HA LEU A 13 8.735 -1.176 -5.379 1.00 0.00 H new ATOM 0 HB2 LEU A 13 10.936 -1.631 -7.110 1.00 0.00 H new ATOM 0 HB3 LEU A 13 11.477 -0.599 -5.801 1.00 0.00 H new ATOM 0 HG LEU A 13 10.140 -3.305 -5.524 1.00 0.00 H new ATOM 0 HD11 LEU A 13 12.305 -4.016 -4.604 1.00 0.00 H new ATOM 0 HD12 LEU A 13 12.444 -3.456 -6.287 1.00 0.00 H new ATOM 0 HD13 LEU A 13 12.978 -2.406 -4.953 1.00 0.00 H new ATOM 0 HD21 LEU A 13 10.550 -3.084 -3.111 1.00 0.00 H new ATOM 0 HD22 LEU A 13 11.109 -1.413 -3.363 1.00 0.00 H new ATOM 0 HD23 LEU A 13 9.420 -1.849 -3.714 1.00 0.00 H new ATOM 164 N GLY A 14 9.253 0.970 -4.269 1.00 0.00 N ATOM 165 CA GLY A 14 9.285 2.284 -3.652 1.00 0.00 C ATOM 166 C GLY A 14 8.040 3.094 -4.019 1.00 0.00 C ATOM 167 O GLY A 14 8.003 4.308 -3.824 1.00 0.00 O ATOM 0 H GLY A 14 9.100 0.198 -3.620 1.00 0.00 H new ATOM 0 HA2 GLY A 14 9.349 2.179 -2.569 1.00 0.00 H new ATOM 0 HA3 GLY A 14 10.179 2.819 -3.974 1.00 0.00 H new ATOM 171 N LYS A 15 7.048 2.389 -4.544 1.00 0.00 N ATOM 172 CA LYS A 15 5.804 3.026 -4.941 1.00 0.00 C ATOM 173 C LYS A 15 4.627 2.245 -4.353 1.00 0.00 C ATOM 174 O LYS A 15 4.764 1.071 -4.011 1.00 0.00 O ATOM 175 CB LYS A 15 5.743 3.182 -6.462 1.00 0.00 C ATOM 176 CG LYS A 15 5.098 1.955 -7.112 1.00 0.00 C ATOM 177 CD LYS A 15 3.700 2.285 -7.637 1.00 0.00 C ATOM 178 CE LYS A 15 3.764 2.828 -9.065 1.00 0.00 C ATOM 179 NZ LYS A 15 3.531 4.290 -9.075 1.00 0.00 N ATOM 0 H LYS A 15 7.081 1.382 -4.704 1.00 0.00 H new ATOM 0 HA LYS A 15 5.748 4.038 -4.539 1.00 0.00 H new ATOM 0 HB2 LYS A 15 5.173 4.075 -6.717 1.00 0.00 H new ATOM 0 HB3 LYS A 15 6.749 3.322 -6.858 1.00 0.00 H new ATOM 0 HG2 LYS A 15 5.724 1.602 -7.931 1.00 0.00 H new ATOM 0 HG3 LYS A 15 5.036 1.145 -6.386 1.00 0.00 H new ATOM 0 HD2 LYS A 15 3.078 1.390 -7.612 1.00 0.00 H new ATOM 0 HD3 LYS A 15 3.227 3.020 -6.986 1.00 0.00 H new ATOM 0 HE2 LYS A 15 4.738 2.606 -9.501 1.00 0.00 H new ATOM 0 HE3 LYS A 15 3.017 2.331 -9.683 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 3.477 4.626 -10.058 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 2.638 4.503 -8.586 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 4.315 4.770 -8.588 1.00 0.00 H new ATOM 193 N VAL A 16 3.496 2.929 -4.255 1.00 0.00 N ATOM 194 CA VAL A 16 2.295 2.313 -3.716 1.00 0.00 C ATOM 195 C VAL A 16 1.647 1.439 -4.791 1.00 0.00 C ATOM 196 O VAL A 16 1.681 1.776 -5.974 1.00 0.00 O ATOM 197 CB VAL A 16 1.353 3.390 -3.175 1.00 0.00 C ATOM 198 CG1 VAL A 16 0.152 2.762 -2.465 1.00 0.00 C ATOM 199 CG2 VAL A 16 2.097 4.353 -2.247 1.00 0.00 C ATOM 0 H VAL A 16 3.386 3.902 -4.539 1.00 0.00 H new ATOM 0 HA VAL A 16 2.544 1.664 -2.876 1.00 0.00 H new ATOM 0 HB VAL A 16 0.978 3.964 -4.023 1.00 0.00 H new ATOM 0 HG11 VAL A 16 -0.502 3.550 -2.090 1.00 0.00 H new ATOM 0 HG12 VAL A 16 -0.399 2.136 -3.167 1.00 0.00 H new ATOM 0 HG13 VAL A 16 0.500 2.152 -1.631 1.00 0.00 H new ATOM 0 HG21 VAL A 16 1.405 5.109 -1.876 1.00 0.00 H new ATOM 0 HG22 VAL A 16 2.514 3.799 -1.406 1.00 0.00 H new ATOM 0 HG23 VAL A 16 2.903 4.838 -2.797 1.00 0.00 H new ATOM 209 N VAL A 17 1.075 0.331 -4.342 1.00 0.00 N ATOM 210 CA VAL A 17 0.421 -0.594 -5.252 1.00 0.00 C ATOM 211 C VAL A 17 -0.862 -1.120 -4.604 1.00 0.00 C ATOM 212 O VAL A 17 -1.083 -0.924 -3.410 1.00 0.00 O ATOM 213 CB VAL A 17 1.390 -1.710 -5.649 1.00 0.00 C ATOM 214 CG1 VAL A 17 2.571 -1.152 -6.445 1.00 0.00 C ATOM 215 CG2 VAL A 17 1.872 -2.482 -4.419 1.00 0.00 C ATOM 0 H VAL A 17 1.051 0.053 -3.361 1.00 0.00 H new ATOM 0 HA VAL A 17 0.135 -0.086 -6.173 1.00 0.00 H new ATOM 0 HB VAL A 17 0.853 -2.408 -6.291 1.00 0.00 H new ATOM 0 HG11 VAL A 17 3.245 -1.965 -6.715 1.00 0.00 H new ATOM 0 HG12 VAL A 17 2.204 -0.669 -7.351 1.00 0.00 H new ATOM 0 HG13 VAL A 17 3.107 -0.423 -5.837 1.00 0.00 H new ATOM 0 HG21 VAL A 17 2.559 -3.269 -4.730 1.00 0.00 H new ATOM 0 HG22 VAL A 17 2.384 -1.801 -3.739 1.00 0.00 H new ATOM 0 HG23 VAL A 17 1.017 -2.927 -3.911 1.00 0.00 H new ATOM 225 N SER A 18 -1.673 -1.776 -5.419 1.00 0.00 N ATOM 226 CA SER A 18 -2.928 -2.330 -4.941 1.00 0.00 C ATOM 227 C SER A 18 -2.761 -3.821 -4.639 1.00 0.00 C ATOM 228 O SER A 18 -2.521 -4.618 -5.545 1.00 0.00 O ATOM 229 CB SER A 18 -4.049 -2.118 -5.960 1.00 0.00 C ATOM 230 OG SER A 18 -3.568 -2.165 -7.300 1.00 0.00 O ATOM 0 H SER A 18 -1.486 -1.937 -6.409 1.00 0.00 H new ATOM 0 HA SER A 18 -3.204 -1.808 -4.025 1.00 0.00 H new ATOM 0 HB2 SER A 18 -4.814 -2.883 -5.822 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.526 -1.154 -5.779 1.00 0.00 H new ATOM 0 HG SER A 18 -3.832 -1.347 -7.771 1.00 0.00 H new ATOM 236 N VAL A 19 -2.895 -4.153 -3.364 1.00 0.00 N ATOM 237 CA VAL A 19 -2.761 -5.533 -2.932 1.00 0.00 C ATOM 238 C VAL A 19 -4.139 -6.199 -2.930 1.00 0.00 C ATOM 239 O VAL A 19 -5.003 -5.845 -2.129 1.00 0.00 O ATOM 240 CB VAL A 19 -2.068 -5.591 -1.568 1.00 0.00 C ATOM 241 CG1 VAL A 19 -2.036 -7.022 -1.030 1.00 0.00 C ATOM 242 CG2 VAL A 19 -0.658 -5.001 -1.645 1.00 0.00 C ATOM 0 H VAL A 19 -3.095 -3.489 -2.616 1.00 0.00 H new ATOM 0 HA VAL A 19 -2.131 -6.090 -3.626 1.00 0.00 H new ATOM 0 HB VAL A 19 -2.647 -4.985 -0.871 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -1.538 -7.035 -0.060 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -3.055 -7.392 -0.920 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -1.491 -7.660 -1.726 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -0.187 -5.054 -0.663 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -0.065 -5.568 -2.363 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -0.716 -3.960 -1.964 1.00 0.00 H new ATOM 252 N VAL A 20 -4.301 -7.151 -3.837 1.00 0.00 N ATOM 253 CA VAL A 20 -5.560 -7.869 -3.952 1.00 0.00 C ATOM 254 C VAL A 20 -5.646 -8.916 -2.839 1.00 0.00 C ATOM 255 O VAL A 20 -4.810 -9.815 -2.761 1.00 0.00 O ATOM 256 CB VAL A 20 -5.695 -8.471 -5.351 1.00 0.00 C ATOM 257 CG1 VAL A 20 -7.090 -9.062 -5.562 1.00 0.00 C ATOM 258 CG2 VAL A 20 -5.371 -7.432 -6.427 1.00 0.00 C ATOM 0 H VAL A 20 -3.582 -7.442 -4.499 1.00 0.00 H new ATOM 0 HA VAL A 20 -6.401 -7.188 -3.825 1.00 0.00 H new ATOM 0 HB VAL A 20 -4.972 -9.282 -5.438 1.00 0.00 H new ATOM 0 HG11 VAL A 20 -7.159 -9.483 -6.565 1.00 0.00 H new ATOM 0 HG12 VAL A 20 -7.268 -9.846 -4.826 1.00 0.00 H new ATOM 0 HG13 VAL A 20 -7.839 -8.278 -5.446 1.00 0.00 H new ATOM 0 HG21 VAL A 20 -5.474 -7.885 -7.413 1.00 0.00 H new ATOM 0 HG22 VAL A 20 -6.059 -6.591 -6.340 1.00 0.00 H new ATOM 0 HG23 VAL A 20 -4.348 -7.079 -6.295 1.00 0.00 H new ATOM 268 N SER A 21 -6.667 -8.767 -2.007 1.00 0.00 N ATOM 269 CA SER A 21 -6.874 -9.689 -0.903 1.00 0.00 C ATOM 270 C SER A 21 -7.242 -11.074 -1.441 1.00 0.00 C ATOM 271 O SER A 21 -8.185 -11.211 -2.218 1.00 0.00 O ATOM 272 CB SER A 21 -7.962 -9.180 0.043 1.00 0.00 C ATOM 273 OG SER A 21 -8.101 -7.763 -0.016 1.00 0.00 O ATOM 0 H SER A 21 -7.360 -8.021 -2.076 1.00 0.00 H new ATOM 0 HA SER A 21 -5.945 -9.761 -0.338 1.00 0.00 H new ATOM 0 HB2 SER A 21 -8.913 -9.648 -0.212 1.00 0.00 H new ATOM 0 HB3 SER A 21 -7.724 -9.479 1.064 1.00 0.00 H new ATOM 0 HG SER A 21 -8.649 -7.520 -0.791 1.00 0.00 H new ATOM 279 N ALA A 22 -6.479 -12.065 -1.004 1.00 0.00 N ATOM 280 CA ALA A 22 -6.714 -13.434 -1.432 1.00 0.00 C ATOM 281 C ALA A 22 -8.051 -13.918 -0.866 1.00 0.00 C ATOM 282 O ALA A 22 -8.720 -14.753 -1.473 1.00 0.00 O ATOM 283 CB ALA A 22 -5.542 -14.314 -0.992 1.00 0.00 C ATOM 0 H ALA A 22 -5.698 -11.948 -0.358 1.00 0.00 H new ATOM 0 HA ALA A 22 -6.776 -13.492 -2.519 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -5.718 -15.341 -1.313 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -4.621 -13.945 -1.443 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -5.452 -14.283 0.094 1.00 0.00 H new ATOM 289 N THR A 23 -8.401 -13.372 0.289 1.00 0.00 N ATOM 290 CA THR A 23 -9.646 -13.738 0.943 1.00 0.00 C ATOM 291 C THR A 23 -10.818 -12.976 0.322 1.00 0.00 C ATOM 292 O THR A 23 -11.976 -13.337 0.527 1.00 0.00 O ATOM 293 CB THR A 23 -9.484 -13.485 2.443 1.00 0.00 C ATOM 294 OG1 THR A 23 -8.648 -14.551 2.886 1.00 0.00 O ATOM 295 CG2 THR A 23 -10.789 -13.688 3.215 1.00 0.00 C ATOM 0 H THR A 23 -7.844 -12.679 0.789 1.00 0.00 H new ATOM 0 HA THR A 23 -9.873 -14.794 0.799 1.00 0.00 H new ATOM 0 HB THR A 23 -9.122 -12.469 2.603 1.00 0.00 H new ATOM 0 HG1 THR A 23 -8.490 -14.464 3.849 1.00 0.00 H new ATOM 0 HG21 THR A 23 -10.619 -13.496 4.274 1.00 0.00 H new ATOM 0 HG22 THR A 23 -11.545 -12.999 2.838 1.00 0.00 H new ATOM 0 HG23 THR A 23 -11.134 -14.714 3.083 1.00 0.00 H new ATOM 303 N GLU A 24 -10.477 -11.936 -0.425 1.00 0.00 N ATOM 304 CA GLU A 24 -11.486 -11.120 -1.078 1.00 0.00 C ATOM 305 C GLU A 24 -10.862 -10.313 -2.217 1.00 0.00 C ATOM 306 O GLU A 24 -10.405 -9.190 -2.010 1.00 0.00 O ATOM 307 CB GLU A 24 -12.182 -10.200 -0.072 1.00 0.00 C ATOM 308 CG GLU A 24 -13.178 -9.275 -0.773 1.00 0.00 C ATOM 309 CD GLU A 24 -14.613 -9.775 -0.592 1.00 0.00 C ATOM 310 OE1 GLU A 24 -15.168 -9.524 0.500 1.00 0.00 O ATOM 311 OE2 GLU A 24 -15.123 -10.397 -1.549 1.00 0.00 O ATOM 0 H GLU A 24 -9.515 -11.640 -0.592 1.00 0.00 H new ATOM 0 HA GLU A 24 -12.242 -11.782 -1.500 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -12.701 -10.800 0.676 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -11.438 -9.605 0.457 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -13.087 -8.266 -0.371 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -12.941 -9.217 -1.835 1.00 0.00 H new ATOM 318 N ARG A 25 -10.863 -10.917 -3.396 1.00 0.00 N ATOM 319 CA ARG A 25 -10.302 -10.269 -4.570 1.00 0.00 C ATOM 320 C ARG A 25 -10.671 -8.784 -4.583 1.00 0.00 C ATOM 321 O ARG A 25 -9.793 -7.922 -4.614 1.00 0.00 O ATOM 322 CB ARG A 25 -10.806 -10.925 -5.857 1.00 0.00 C ATOM 323 CG ARG A 25 -10.205 -12.321 -6.033 1.00 0.00 C ATOM 324 CD ARG A 25 -9.783 -12.556 -7.484 1.00 0.00 C ATOM 325 NE ARG A 25 -10.761 -13.437 -8.160 1.00 0.00 N ATOM 326 CZ ARG A 25 -10.938 -13.487 -9.487 1.00 0.00 C ATOM 327 NH1 ARG A 25 -10.202 -12.705 -10.289 1.00 0.00 N ATOM 328 NH2 ARG A 25 -11.850 -14.316 -10.012 1.00 0.00 N ATOM 0 H ARG A 25 -11.243 -11.848 -3.564 1.00 0.00 H new ATOM 0 HA ARG A 25 -9.218 -10.378 -4.522 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -11.894 -10.994 -5.832 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -10.545 -10.302 -6.713 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -9.342 -12.435 -5.376 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -10.934 -13.075 -5.736 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -9.715 -11.604 -8.010 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -8.792 -13.009 -7.514 1.00 0.00 H new ATOM 0 HE ARG A 25 -11.337 -14.045 -7.578 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -9.508 -12.073 -9.889 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -10.335 -12.742 -11.300 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -12.411 -14.910 -9.401 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -11.984 -14.353 -11.023 1.00 0.00 H new ATOM 342 N THR A 26 -11.971 -8.531 -4.560 1.00 0.00 N ATOM 343 CA THR A 26 -12.467 -7.165 -4.569 1.00 0.00 C ATOM 344 C THR A 26 -11.643 -6.292 -3.623 1.00 0.00 C ATOM 345 O THR A 26 -10.892 -5.426 -4.068 1.00 0.00 O ATOM 346 CB THR A 26 -13.957 -7.201 -4.220 1.00 0.00 C ATOM 347 OG1 THR A 26 -14.599 -7.446 -5.468 1.00 0.00 O ATOM 348 CG2 THR A 26 -14.490 -5.833 -3.789 1.00 0.00 C ATOM 0 H THR A 26 -12.696 -9.248 -4.535 1.00 0.00 H new ATOM 0 HA THR A 26 -12.360 -6.712 -5.555 1.00 0.00 H new ATOM 0 HB THR A 26 -14.126 -7.924 -3.422 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.569 -7.487 -5.334 1.00 0.00 H new ATOM 0 HG21 THR A 26 -15.551 -5.914 -3.553 1.00 0.00 H new ATOM 0 HG22 THR A 26 -13.947 -5.492 -2.908 1.00 0.00 H new ATOM 0 HG23 THR A 26 -14.352 -5.117 -4.599 1.00 0.00 H new ATOM 356 N GLU A 27 -11.811 -6.549 -2.334 1.00 0.00 N ATOM 357 CA GLU A 27 -11.091 -5.797 -1.320 1.00 0.00 C ATOM 358 C GLU A 27 -9.611 -5.689 -1.691 1.00 0.00 C ATOM 359 O GLU A 27 -8.964 -6.694 -1.980 1.00 0.00 O ATOM 360 CB GLU A 27 -11.265 -6.432 0.060 1.00 0.00 C ATOM 361 CG GLU A 27 -12.573 -5.979 0.712 1.00 0.00 C ATOM 362 CD GLU A 27 -12.518 -4.495 1.081 1.00 0.00 C ATOM 363 OE1 GLU A 27 -11.502 -4.102 1.696 1.00 0.00 O ATOM 364 OE2 GLU A 27 -13.490 -3.788 0.742 1.00 0.00 O ATOM 0 H GLU A 27 -12.436 -7.268 -1.968 1.00 0.00 H new ATOM 0 HA GLU A 27 -11.509 -4.791 -1.276 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -11.258 -7.518 -0.032 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -10.424 -6.161 0.698 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -13.404 -6.157 0.030 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -12.762 -6.573 1.606 1.00 0.00 H new ATOM 371 N TRP A 28 -9.117 -4.459 -1.671 1.00 0.00 N ATOM 372 CA TRP A 28 -7.725 -4.206 -2.001 1.00 0.00 C ATOM 373 C TRP A 28 -7.221 -3.078 -1.098 1.00 0.00 C ATOM 374 O TRP A 28 -7.972 -2.161 -0.767 1.00 0.00 O ATOM 375 CB TRP A 28 -7.561 -3.897 -3.490 1.00 0.00 C ATOM 376 CG TRP A 28 -8.065 -2.511 -3.897 1.00 0.00 C ATOM 377 CD1 TRP A 28 -9.260 -2.183 -4.406 1.00 0.00 C ATOM 378 CD2 TRP A 28 -7.333 -1.270 -3.807 1.00 0.00 C ATOM 379 NE1 TRP A 28 -9.352 -0.828 -4.650 1.00 0.00 N ATOM 380 CE2 TRP A 28 -8.143 -0.254 -4.273 1.00 0.00 C ATOM 381 CE3 TRP A 28 -6.030 -1.013 -3.344 1.00 0.00 C ATOM 382 CZ2 TRP A 28 -7.740 1.086 -4.324 1.00 0.00 C ATOM 383 CZ3 TRP A 28 -5.643 0.331 -3.402 1.00 0.00 C ATOM 384 CH2 TRP A 28 -6.446 1.364 -3.870 1.00 0.00 C ATOM 0 H TRP A 28 -9.656 -3.627 -1.431 1.00 0.00 H new ATOM 0 HA TRP A 28 -7.120 -5.094 -1.820 1.00 0.00 H new ATOM 0 HB2 TRP A 28 -6.507 -3.981 -3.754 1.00 0.00 H new ATOM 0 HB3 TRP A 28 -8.095 -4.651 -4.068 1.00 0.00 H new ATOM 0 HD1 TRP A 28 -10.052 -2.891 -4.601 1.00 0.00 H new ATOM 0 HE1 TRP A 28 -10.159 -0.338 -5.036 1.00 0.00 H new ATOM 0 HE3 TRP A 28 -5.379 -1.791 -2.973 1.00 0.00 H new ATOM 0 HZ2 TRP A 28 -8.393 1.863 -4.694 1.00 0.00 H new ATOM 0 HZ3 TRP A 28 -4.650 0.583 -3.059 1.00 0.00 H new ATOM 0 HH2 TRP A 28 -6.073 2.377 -3.883 1.00 0.00 H new ATOM 395 N TYR A 29 -5.955 -3.182 -0.724 1.00 0.00 N ATOM 396 CA TYR A 29 -5.343 -2.183 0.134 1.00 0.00 C ATOM 397 C TYR A 29 -3.990 -1.737 -0.422 1.00 0.00 C ATOM 398 O TYR A 29 -3.267 -2.532 -1.020 1.00 0.00 O ATOM 399 CB TYR A 29 -5.125 -2.864 1.487 1.00 0.00 C ATOM 400 CG TYR A 29 -3.713 -3.420 1.683 1.00 0.00 C ATOM 401 CD1 TYR A 29 -2.725 -2.619 2.220 1.00 0.00 C ATOM 402 CD2 TYR A 29 -3.427 -4.722 1.324 1.00 0.00 C ATOM 403 CE1 TYR A 29 -1.396 -3.142 2.404 1.00 0.00 C ATOM 404 CE2 TYR A 29 -2.098 -5.244 1.509 1.00 0.00 C ATOM 405 CZ TYR A 29 -1.148 -4.429 2.040 1.00 0.00 C ATOM 406 OH TYR A 29 0.106 -4.923 2.215 1.00 0.00 O ATOM 0 H TYR A 29 -5.336 -3.944 -1.000 1.00 0.00 H new ATOM 0 HA TYR A 29 -5.978 -1.300 0.208 1.00 0.00 H new ATOM 0 HB2 TYR A 29 -5.336 -2.148 2.281 1.00 0.00 H new ATOM 0 HB3 TYR A 29 -5.843 -3.677 1.593 1.00 0.00 H new ATOM 0 HD1 TYR A 29 -2.949 -1.601 2.502 1.00 0.00 H new ATOM 0 HD2 TYR A 29 -4.200 -5.349 0.904 1.00 0.00 H new ATOM 0 HE1 TYR A 29 -0.613 -2.526 2.822 1.00 0.00 H new ATOM 0 HE2 TYR A 29 -1.861 -6.261 1.232 1.00 0.00 H new ATOM 0 HH TYR A 29 0.136 -5.855 1.912 1.00 0.00 H new ATOM 416 N PRO A 30 -3.679 -0.431 -0.200 1.00 0.00 N ATOM 417 CA PRO A 30 -2.426 0.131 -0.672 1.00 0.00 C ATOM 418 C PRO A 30 -1.256 -0.331 0.197 1.00 0.00 C ATOM 419 O PRO A 30 -1.404 -0.495 1.407 1.00 0.00 O ATOM 420 CB PRO A 30 -2.633 1.636 -0.641 1.00 0.00 C ATOM 421 CG PRO A 30 -3.817 1.875 0.282 1.00 0.00 C ATOM 422 CD PRO A 30 -4.511 0.541 0.504 1.00 0.00 C ATOM 0 HA PRO A 30 -2.169 -0.201 -1.678 1.00 0.00 H new ATOM 0 HB2 PRO A 30 -1.742 2.145 -0.273 1.00 0.00 H new ATOM 0 HB3 PRO A 30 -2.832 2.024 -1.640 1.00 0.00 H new ATOM 0 HG2 PRO A 30 -3.483 2.294 1.231 1.00 0.00 H new ATOM 0 HG3 PRO A 30 -4.506 2.595 -0.159 1.00 0.00 H new ATOM 0 HD2 PRO A 30 -4.584 0.304 1.566 1.00 0.00 H new ATOM 0 HD3 PRO A 30 -5.527 0.552 0.109 1.00 0.00 H new ATOM 430 N ALA A 31 -0.118 -0.526 -0.453 1.00 0.00 N ATOM 431 CA ALA A 31 1.078 -0.966 0.248 1.00 0.00 C ATOM 432 C ALA A 31 2.314 -0.552 -0.555 1.00 0.00 C ATOM 433 O ALA A 31 2.309 -0.607 -1.783 1.00 0.00 O ATOM 434 CB ALA A 31 1.010 -2.478 0.474 1.00 0.00 C ATOM 0 H ALA A 31 0.002 -0.388 -1.456 1.00 0.00 H new ATOM 0 HA ALA A 31 1.146 -0.493 1.227 1.00 0.00 H new ATOM 0 HB1 ALA A 31 1.906 -2.808 0.999 1.00 0.00 H new ATOM 0 HB2 ALA A 31 0.130 -2.717 1.071 1.00 0.00 H new ATOM 0 HB3 ALA A 31 0.945 -2.987 -0.488 1.00 0.00 H new ATOM 440 N LEU A 32 3.344 -0.146 0.174 1.00 0.00 N ATOM 441 CA LEU A 32 4.584 0.277 -0.453 1.00 0.00 C ATOM 442 C LEU A 32 5.520 -0.927 -0.586 1.00 0.00 C ATOM 443 O LEU A 32 5.872 -1.557 0.411 1.00 0.00 O ATOM 444 CB LEU A 32 5.197 1.452 0.312 1.00 0.00 C ATOM 445 CG LEU A 32 6.291 2.231 -0.421 1.00 0.00 C ATOM 446 CD1 LEU A 32 5.830 2.636 -1.823 1.00 0.00 C ATOM 447 CD2 LEU A 32 6.752 3.435 0.402 1.00 0.00 C ATOM 0 H LEU A 32 3.344 -0.101 1.193 1.00 0.00 H new ATOM 0 HA LEU A 32 4.395 0.647 -1.461 1.00 0.00 H new ATOM 0 HB2 LEU A 32 4.398 2.146 0.574 1.00 0.00 H new ATOM 0 HB3 LEU A 32 5.611 1.075 1.247 1.00 0.00 H new ATOM 0 HG LEU A 32 7.154 1.576 -0.543 1.00 0.00 H new ATOM 0 HD11 LEU A 32 6.626 3.188 -2.322 1.00 0.00 H new ATOM 0 HD12 LEU A 32 5.591 1.742 -2.400 1.00 0.00 H new ATOM 0 HD13 LEU A 32 4.944 3.266 -1.747 1.00 0.00 H new ATOM 0 HD21 LEU A 32 7.530 3.971 -0.142 1.00 0.00 H new ATOM 0 HD22 LEU A 32 5.907 4.101 0.577 1.00 0.00 H new ATOM 0 HD23 LEU A 32 7.148 3.092 1.358 1.00 0.00 H new ATOM 459 N VAL A 33 5.896 -1.210 -1.825 1.00 0.00 N ATOM 460 CA VAL A 33 6.784 -2.326 -2.101 1.00 0.00 C ATOM 461 C VAL A 33 8.195 -1.979 -1.622 1.00 0.00 C ATOM 462 O VAL A 33 8.631 -0.835 -1.741 1.00 0.00 O ATOM 463 CB VAL A 33 6.727 -2.684 -3.586 1.00 0.00 C ATOM 464 CG1 VAL A 33 7.609 -3.897 -3.892 1.00 0.00 C ATOM 465 CG2 VAL A 33 5.285 -2.928 -4.037 1.00 0.00 C ATOM 0 H VAL A 33 5.602 -0.685 -2.649 1.00 0.00 H new ATOM 0 HA VAL A 33 6.465 -3.214 -1.555 1.00 0.00 H new ATOM 0 HB VAL A 33 7.115 -1.836 -4.150 1.00 0.00 H new ATOM 0 HG11 VAL A 33 7.550 -4.131 -4.955 1.00 0.00 H new ATOM 0 HG12 VAL A 33 8.642 -3.672 -3.626 1.00 0.00 H new ATOM 0 HG13 VAL A 33 7.264 -4.753 -3.313 1.00 0.00 H new ATOM 0 HG21 VAL A 33 5.273 -3.181 -5.097 1.00 0.00 H new ATOM 0 HG22 VAL A 33 4.859 -3.751 -3.463 1.00 0.00 H new ATOM 0 HG23 VAL A 33 4.695 -2.026 -3.872 1.00 0.00 H new ATOM 475 N ILE A 34 8.871 -2.989 -1.093 1.00 0.00 N ATOM 476 CA ILE A 34 10.224 -2.806 -0.597 1.00 0.00 C ATOM 477 C ILE A 34 10.967 -4.142 -0.646 1.00 0.00 C ATOM 478 O ILE A 34 10.446 -5.126 -1.171 1.00 0.00 O ATOM 479 CB ILE A 34 10.203 -2.165 0.792 1.00 0.00 C ATOM 480 CG1 ILE A 34 9.164 -2.838 1.690 1.00 0.00 C ATOM 481 CG2 ILE A 34 9.985 -0.653 0.697 1.00 0.00 C ATOM 482 CD1 ILE A 34 9.304 -2.366 3.139 1.00 0.00 C ATOM 0 H ILE A 34 8.506 -3.937 -0.997 1.00 0.00 H new ATOM 0 HA ILE A 34 10.772 -2.113 -1.235 1.00 0.00 H new ATOM 0 HB ILE A 34 11.178 -2.320 1.254 1.00 0.00 H new ATOM 0 HG12 ILE A 34 8.162 -2.612 1.325 1.00 0.00 H new ATOM 0 HG13 ILE A 34 9.284 -3.920 1.643 1.00 0.00 H new ATOM 0 HG21 ILE A 34 9.974 -0.223 1.699 1.00 0.00 H new ATOM 0 HG22 ILE A 34 10.793 -0.205 0.118 1.00 0.00 H new ATOM 0 HG23 ILE A 34 9.033 -0.453 0.206 1.00 0.00 H new ATOM 0 HD11 ILE A 34 8.554 -2.860 3.757 1.00 0.00 H new ATOM 0 HD12 ILE A 34 10.299 -2.615 3.508 1.00 0.00 H new ATOM 0 HD13 ILE A 34 9.159 -1.287 3.186 1.00 0.00 H new ATOM 494 N SER A 35 12.171 -4.135 -0.094 1.00 0.00 N ATOM 495 CA SER A 35 12.990 -5.334 -0.068 1.00 0.00 C ATOM 496 C SER A 35 13.445 -5.627 1.363 1.00 0.00 C ATOM 497 O SER A 35 13.694 -4.706 2.140 1.00 0.00 O ATOM 498 CB SER A 35 14.201 -5.194 -0.993 1.00 0.00 C ATOM 499 OG SER A 35 15.297 -4.557 -0.343 1.00 0.00 O ATOM 0 H SER A 35 12.599 -3.317 0.339 1.00 0.00 H new ATOM 0 HA SER A 35 12.387 -6.168 -0.428 1.00 0.00 H new ATOM 0 HB2 SER A 35 14.509 -6.181 -1.340 1.00 0.00 H new ATOM 0 HB3 SER A 35 13.919 -4.620 -1.875 1.00 0.00 H new ATOM 0 HG SER A 35 16.051 -4.488 -0.965 1.00 0.00 H new ATOM 505 N PRO A 36 13.544 -6.947 1.677 1.00 0.00 N ATOM 506 CA PRO A 36 13.964 -7.372 3.000 1.00 0.00 C ATOM 507 C PRO A 36 15.471 -7.181 3.184 1.00 0.00 C ATOM 508 O PRO A 36 16.261 -8.040 2.796 1.00 0.00 O ATOM 509 CB PRO A 36 13.533 -8.826 3.103 1.00 0.00 C ATOM 510 CG PRO A 36 13.306 -9.294 1.674 1.00 0.00 C ATOM 511 CD PRO A 36 13.256 -8.065 0.782 1.00 0.00 C ATOM 0 HA PRO A 36 13.511 -6.780 3.795 1.00 0.00 H new ATOM 0 HB2 PRO A 36 14.299 -9.427 3.594 1.00 0.00 H new ATOM 0 HB3 PRO A 36 12.623 -8.923 3.695 1.00 0.00 H new ATOM 0 HG2 PRO A 36 14.108 -9.961 1.359 1.00 0.00 H new ATOM 0 HG3 PRO A 36 12.376 -9.857 1.600 1.00 0.00 H new ATOM 0 HD2 PRO A 36 13.990 -8.128 -0.022 1.00 0.00 H new ATOM 0 HD3 PRO A 36 12.278 -7.955 0.313 1.00 0.00 H new ATOM 519 N SER A 37 15.824 -6.050 3.776 1.00 0.00 N ATOM 520 CA SER A 37 17.223 -5.734 4.015 1.00 0.00 C ATOM 521 C SER A 37 17.553 -5.916 5.498 1.00 0.00 C ATOM 522 O SER A 37 18.407 -6.726 5.853 1.00 0.00 O ATOM 523 CB SER A 37 17.550 -4.309 3.568 1.00 0.00 C ATOM 524 OG SER A 37 18.954 -4.065 3.549 1.00 0.00 O ATOM 0 H SER A 37 15.166 -5.340 4.098 1.00 0.00 H new ATOM 0 HA SER A 37 17.835 -6.418 3.427 1.00 0.00 H new ATOM 0 HB2 SER A 37 17.139 -4.138 2.573 1.00 0.00 H new ATOM 0 HB3 SER A 37 17.067 -3.599 4.239 1.00 0.00 H new ATOM 0 HG SER A 37 19.122 -3.145 3.257 1.00 0.00 H new ATOM 530 N CYS A 38 16.859 -5.146 6.324 1.00 0.00 N ATOM 531 CA CYS A 38 17.068 -5.211 7.760 1.00 0.00 C ATOM 532 C CYS A 38 16.343 -6.447 8.296 1.00 0.00 C ATOM 533 O CYS A 38 16.959 -7.311 8.918 1.00 0.00 O ATOM 534 CB CYS A 38 16.605 -3.931 8.458 1.00 0.00 C ATOM 535 SG CYS A 38 17.288 -3.860 10.154 1.00 0.00 S ATOM 0 H CYS A 38 16.152 -4.474 6.026 1.00 0.00 H new ATOM 0 HA CYS A 38 18.134 -5.296 7.971 1.00 0.00 H new ATOM 0 HB2 CYS A 38 16.930 -3.059 7.890 1.00 0.00 H new ATOM 0 HB3 CYS A 38 15.516 -3.900 8.494 1.00 0.00 H new ATOM 0 HG CYS A 38 16.890 -2.768 10.737 1.00 0.00 H new ATOM 541 N ASN A 39 15.045 -6.493 8.034 1.00 0.00 N ATOM 542 CA ASN A 39 14.231 -7.609 8.482 1.00 0.00 C ATOM 543 C ASN A 39 14.839 -8.917 7.971 1.00 0.00 C ATOM 544 O ASN A 39 15.667 -8.906 7.063 1.00 0.00 O ATOM 545 CB ASN A 39 12.805 -7.505 7.935 1.00 0.00 C ATOM 546 CG ASN A 39 11.993 -8.754 8.282 1.00 0.00 C ATOM 547 OD1 ASN A 39 11.371 -8.851 9.328 1.00 0.00 O ATOM 548 ND2 ASN A 39 12.031 -9.701 7.349 1.00 0.00 N ATOM 0 H ASN A 39 14.537 -5.775 7.517 1.00 0.00 H new ATOM 0 HA ASN A 39 14.202 -7.589 9.571 1.00 0.00 H new ATOM 0 HB2 ASN A 39 12.316 -6.623 8.348 1.00 0.00 H new ATOM 0 HB3 ASN A 39 12.835 -7.375 6.853 1.00 0.00 H new ATOM 0 HD21 ASN A 39 11.520 -10.573 7.486 1.00 0.00 H new ATOM 0 HD22 ASN A 39 12.571 -9.555 6.496 1.00 0.00 H new ATOM 555 N ASP A 40 14.404 -10.011 8.577 1.00 0.00 N ATOM 556 CA ASP A 40 14.896 -11.324 8.196 1.00 0.00 C ATOM 557 C ASP A 40 13.873 -12.386 8.605 1.00 0.00 C ATOM 558 O ASP A 40 13.502 -13.238 7.798 1.00 0.00 O ATOM 559 CB ASP A 40 16.216 -11.644 8.899 1.00 0.00 C ATOM 560 CG ASP A 40 17.438 -10.910 8.345 1.00 0.00 C ATOM 561 OD1 ASP A 40 17.883 -11.300 7.243 1.00 0.00 O ATOM 562 OD2 ASP A 40 17.902 -9.976 9.036 1.00 0.00 O ATOM 0 H ASP A 40 13.716 -10.016 9.330 1.00 0.00 H new ATOM 0 HA ASP A 40 15.053 -11.324 7.117 1.00 0.00 H new ATOM 0 HB2 ASP A 40 16.115 -11.402 9.957 1.00 0.00 H new ATOM 0 HB3 ASP A 40 16.395 -12.717 8.833 1.00 0.00 H new ATOM 567 N ASP A 41 13.446 -12.300 9.856 1.00 0.00 N ATOM 568 CA ASP A 41 12.473 -13.243 10.381 1.00 0.00 C ATOM 569 C ASP A 41 11.330 -13.403 9.376 1.00 0.00 C ATOM 570 O ASP A 41 11.066 -14.506 8.901 1.00 0.00 O ATOM 571 CB ASP A 41 11.878 -12.743 11.699 1.00 0.00 C ATOM 572 CG ASP A 41 12.652 -13.151 12.954 1.00 0.00 C ATOM 573 OD1 ASP A 41 13.785 -12.647 13.111 1.00 0.00 O ATOM 574 OD2 ASP A 41 12.093 -13.957 13.729 1.00 0.00 O ATOM 0 H ASP A 41 13.756 -11.592 10.522 1.00 0.00 H new ATOM 0 HA ASP A 41 12.981 -14.192 10.552 1.00 0.00 H new ATOM 0 HB2 ASP A 41 11.819 -11.655 11.664 1.00 0.00 H new ATOM 0 HB3 ASP A 41 10.857 -13.115 11.783 1.00 0.00 H new ATOM 579 N ILE A 42 10.682 -12.284 9.082 1.00 0.00 N ATOM 580 CA ILE A 42 9.575 -12.287 8.142 1.00 0.00 C ATOM 581 C ILE A 42 10.107 -12.556 6.734 1.00 0.00 C ATOM 582 O ILE A 42 9.984 -11.711 5.848 1.00 0.00 O ATOM 583 CB ILE A 42 8.770 -10.990 8.260 1.00 0.00 C ATOM 584 CG1 ILE A 42 8.287 -10.772 9.694 1.00 0.00 C ATOM 585 CG2 ILE A 42 7.615 -10.970 7.257 1.00 0.00 C ATOM 586 CD1 ILE A 42 8.124 -9.281 9.997 1.00 0.00 C ATOM 0 H ILE A 42 10.903 -11.371 9.478 1.00 0.00 H new ATOM 0 HA ILE A 42 8.877 -13.091 8.377 1.00 0.00 H new ATOM 0 HB ILE A 42 9.427 -10.156 8.012 1.00 0.00 H new ATOM 0 HG12 ILE A 42 7.336 -11.283 9.843 1.00 0.00 H new ATOM 0 HG13 ILE A 42 8.998 -11.213 10.392 1.00 0.00 H new ATOM 0 HG21 ILE A 42 7.059 -10.038 7.361 1.00 0.00 H new ATOM 0 HG22 ILE A 42 8.011 -11.045 6.244 1.00 0.00 H new ATOM 0 HG23 ILE A 42 6.951 -11.813 7.450 1.00 0.00 H new ATOM 0 HD11 ILE A 42 7.780 -9.154 11.023 1.00 0.00 H new ATOM 0 HD12 ILE A 42 9.082 -8.777 9.871 1.00 0.00 H new ATOM 0 HD13 ILE A 42 7.394 -8.848 9.313 1.00 0.00 H new ATOM 598 N THR A 43 10.687 -13.736 6.570 1.00 0.00 N ATOM 599 CA THR A 43 11.238 -14.127 5.283 1.00 0.00 C ATOM 600 C THR A 43 10.193 -13.951 4.180 1.00 0.00 C ATOM 601 O THR A 43 8.999 -14.123 4.418 1.00 0.00 O ATOM 602 CB THR A 43 11.756 -15.561 5.407 1.00 0.00 C ATOM 603 OG1 THR A 43 12.494 -15.768 4.206 1.00 0.00 O ATOM 604 CG2 THR A 43 10.633 -16.598 5.337 1.00 0.00 C ATOM 0 H THR A 43 10.787 -14.434 7.307 1.00 0.00 H new ATOM 0 HA THR A 43 12.074 -13.488 5.000 1.00 0.00 H new ATOM 0 HB THR A 43 12.294 -15.672 6.348 1.00 0.00 H new ATOM 0 HG1 THR A 43 12.867 -16.674 4.204 1.00 0.00 H new ATOM 0 HG21 THR A 43 11.055 -17.599 5.430 1.00 0.00 H new ATOM 0 HG22 THR A 43 9.927 -16.425 6.149 1.00 0.00 H new ATOM 0 HG23 THR A 43 10.116 -16.510 4.382 1.00 0.00 H new ATOM 612 N VAL A 44 10.681 -13.611 2.996 1.00 0.00 N ATOM 613 CA VAL A 44 9.804 -13.410 1.855 1.00 0.00 C ATOM 614 C VAL A 44 10.072 -14.499 0.814 1.00 0.00 C ATOM 615 O VAL A 44 11.210 -14.689 0.389 1.00 0.00 O ATOM 616 CB VAL A 44 9.981 -11.996 1.300 1.00 0.00 C ATOM 617 CG1 VAL A 44 9.124 -11.785 0.052 1.00 0.00 C ATOM 618 CG2 VAL A 44 9.667 -10.945 2.367 1.00 0.00 C ATOM 0 H VAL A 44 11.672 -13.470 2.802 1.00 0.00 H new ATOM 0 HA VAL A 44 8.760 -13.497 2.156 1.00 0.00 H new ATOM 0 HB VAL A 44 11.025 -11.878 1.011 1.00 0.00 H new ATOM 0 HG11 VAL A 44 9.269 -10.771 -0.322 1.00 0.00 H new ATOM 0 HG12 VAL A 44 9.417 -12.501 -0.716 1.00 0.00 H new ATOM 0 HG13 VAL A 44 8.074 -11.932 0.303 1.00 0.00 H new ATOM 0 HG21 VAL A 44 9.801 -9.948 1.946 1.00 0.00 H new ATOM 0 HG22 VAL A 44 8.636 -11.063 2.701 1.00 0.00 H new ATOM 0 HG23 VAL A 44 10.340 -11.074 3.214 1.00 0.00 H new ATOM 628 N LYS A 45 9.004 -15.186 0.433 1.00 0.00 N ATOM 629 CA LYS A 45 9.110 -16.250 -0.550 1.00 0.00 C ATOM 630 C LYS A 45 9.566 -15.660 -1.886 1.00 0.00 C ATOM 631 O LYS A 45 9.657 -14.443 -2.033 1.00 0.00 O ATOM 632 CB LYS A 45 7.797 -17.030 -0.638 1.00 0.00 C ATOM 633 CG LYS A 45 7.801 -18.220 0.323 1.00 0.00 C ATOM 634 CD LYS A 45 7.863 -17.750 1.777 1.00 0.00 C ATOM 635 CE LYS A 45 7.421 -18.861 2.733 1.00 0.00 C ATOM 636 NZ LYS A 45 6.806 -18.285 3.949 1.00 0.00 N ATOM 0 H LYS A 45 8.061 -15.026 0.788 1.00 0.00 H new ATOM 0 HA LYS A 45 9.865 -16.975 -0.247 1.00 0.00 H new ATOM 0 HB2 LYS A 45 6.962 -16.371 -0.402 1.00 0.00 H new ATOM 0 HB3 LYS A 45 7.647 -17.383 -1.658 1.00 0.00 H new ATOM 0 HG2 LYS A 45 6.904 -18.820 0.169 1.00 0.00 H new ATOM 0 HG3 LYS A 45 8.655 -18.863 0.108 1.00 0.00 H new ATOM 0 HD2 LYS A 45 8.879 -17.440 2.019 1.00 0.00 H new ATOM 0 HD3 LYS A 45 7.224 -16.877 1.908 1.00 0.00 H new ATOM 0 HE2 LYS A 45 6.708 -19.516 2.233 1.00 0.00 H new ATOM 0 HE3 LYS A 45 8.279 -19.475 3.008 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 6.512 -19.053 4.586 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 7.498 -17.678 4.434 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 5.975 -17.719 3.683 1.00 0.00 H new ATOM 650 N LYS A 46 9.840 -16.552 -2.827 1.00 0.00 N ATOM 651 CA LYS A 46 10.284 -16.135 -4.146 1.00 0.00 C ATOM 652 C LYS A 46 9.114 -15.492 -4.894 1.00 0.00 C ATOM 653 O LYS A 46 9.312 -14.584 -5.699 1.00 0.00 O ATOM 654 CB LYS A 46 10.919 -17.309 -4.894 1.00 0.00 C ATOM 655 CG LYS A 46 12.031 -16.828 -5.827 1.00 0.00 C ATOM 656 CD LYS A 46 11.686 -17.122 -7.289 1.00 0.00 C ATOM 657 CE LYS A 46 11.268 -15.845 -8.020 1.00 0.00 C ATOM 658 NZ LYS A 46 12.342 -14.830 -7.947 1.00 0.00 N ATOM 0 H LYS A 46 9.763 -17.561 -2.702 1.00 0.00 H new ATOM 0 HA LYS A 46 11.065 -15.379 -4.063 1.00 0.00 H new ATOM 0 HB2 LYS A 46 11.324 -18.024 -4.178 1.00 0.00 H new ATOM 0 HB3 LYS A 46 10.156 -17.832 -5.471 1.00 0.00 H new ATOM 0 HG2 LYS A 46 12.184 -15.757 -5.694 1.00 0.00 H new ATOM 0 HG3 LYS A 46 12.968 -17.319 -5.565 1.00 0.00 H new ATOM 0 HD2 LYS A 46 12.548 -17.566 -7.788 1.00 0.00 H new ATOM 0 HD3 LYS A 46 10.879 -17.853 -7.336 1.00 0.00 H new ATOM 0 HE2 LYS A 46 11.045 -16.072 -9.062 1.00 0.00 H new ATOM 0 HE3 LYS A 46 10.354 -15.448 -7.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 12.330 -14.249 -8.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 12.189 -14.221 -7.118 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 13.263 -15.305 -7.862 1.00 0.00 H new ATOM 672 N ASP A 47 7.921 -15.988 -4.601 1.00 0.00 N ATOM 673 CA ASP A 47 6.720 -15.473 -5.235 1.00 0.00 C ATOM 674 C ASP A 47 6.031 -14.487 -4.289 1.00 0.00 C ATOM 675 O ASP A 47 4.823 -14.277 -4.377 1.00 0.00 O ATOM 676 CB ASP A 47 5.732 -16.600 -5.542 1.00 0.00 C ATOM 677 CG ASP A 47 5.519 -16.885 -7.030 1.00 0.00 C ATOM 678 OD1 ASP A 47 6.349 -17.633 -7.589 1.00 0.00 O ATOM 679 OD2 ASP A 47 4.530 -16.349 -7.575 1.00 0.00 O ATOM 0 H ASP A 47 7.761 -16.742 -3.933 1.00 0.00 H new ATOM 0 HA ASP A 47 7.013 -14.986 -6.165 1.00 0.00 H new ATOM 0 HB2 ASP A 47 6.083 -17.512 -5.059 1.00 0.00 H new ATOM 0 HB3 ASP A 47 4.770 -16.352 -5.094 1.00 0.00 H new ATOM 684 N GLN A 48 6.831 -13.907 -3.405 1.00 0.00 N ATOM 685 CA GLN A 48 6.314 -12.948 -2.444 1.00 0.00 C ATOM 686 C GLN A 48 7.233 -11.728 -2.366 1.00 0.00 C ATOM 687 O GLN A 48 8.384 -11.784 -2.797 1.00 0.00 O ATOM 688 CB GLN A 48 6.139 -13.593 -1.067 1.00 0.00 C ATOM 689 CG GLN A 48 4.844 -14.404 -1.002 1.00 0.00 C ATOM 690 CD GLN A 48 4.551 -14.855 0.430 1.00 0.00 C ATOM 691 OE1 GLN A 48 5.183 -14.431 1.384 1.00 0.00 O ATOM 692 NE2 GLN A 48 3.560 -15.736 0.528 1.00 0.00 N ATOM 0 H GLN A 48 7.833 -14.083 -3.335 1.00 0.00 H new ATOM 0 HA GLN A 48 5.332 -12.617 -2.781 1.00 0.00 H new ATOM 0 HB2 GLN A 48 6.989 -14.241 -0.854 1.00 0.00 H new ATOM 0 HB3 GLN A 48 6.127 -12.820 -0.298 1.00 0.00 H new ATOM 0 HG2 GLN A 48 4.015 -13.802 -1.374 1.00 0.00 H new ATOM 0 HG3 GLN A 48 4.923 -15.275 -1.652 1.00 0.00 H new ATOM 0 HE21 GLN A 48 3.072 -16.050 -0.311 1.00 0.00 H new ATOM 0 HE22 GLN A 48 3.288 -16.098 1.442 1.00 0.00 H new ATOM 701 N CYS A 49 6.691 -10.653 -1.811 1.00 0.00 N ATOM 702 CA CYS A 49 7.448 -9.422 -1.670 1.00 0.00 C ATOM 703 C CYS A 49 6.961 -8.699 -0.413 1.00 0.00 C ATOM 704 O CYS A 49 5.776 -8.744 -0.087 1.00 0.00 O ATOM 705 CB CYS A 49 7.332 -8.541 -2.916 1.00 0.00 C ATOM 706 SG CYS A 49 8.996 -8.015 -3.468 1.00 0.00 S ATOM 0 H CYS A 49 5.736 -10.610 -1.454 1.00 0.00 H new ATOM 0 HA CYS A 49 8.508 -9.654 -1.566 1.00 0.00 H new ATOM 0 HB2 CYS A 49 6.832 -9.090 -3.714 1.00 0.00 H new ATOM 0 HB3 CYS A 49 6.719 -7.667 -2.697 1.00 0.00 H new ATOM 0 HG CYS A 49 8.886 -7.270 -4.527 1.00 0.00 H new ATOM 712 N LEU A 50 7.900 -8.049 0.259 1.00 0.00 N ATOM 713 CA LEU A 50 7.580 -7.318 1.474 1.00 0.00 C ATOM 714 C LEU A 50 7.097 -5.913 1.106 1.00 0.00 C ATOM 715 O LEU A 50 7.814 -5.157 0.453 1.00 0.00 O ATOM 716 CB LEU A 50 8.771 -7.326 2.434 1.00 0.00 C ATOM 717 CG LEU A 50 8.527 -6.710 3.813 1.00 0.00 C ATOM 718 CD1 LEU A 50 7.684 -7.640 4.688 1.00 0.00 C ATOM 719 CD2 LEU A 50 9.847 -6.330 4.485 1.00 0.00 C ATOM 0 H LEU A 50 8.882 -8.013 -0.014 1.00 0.00 H new ATOM 0 HA LEU A 50 6.766 -7.807 2.009 1.00 0.00 H new ATOM 0 HB2 LEU A 50 9.094 -8.358 2.571 1.00 0.00 H new ATOM 0 HB3 LEU A 50 9.596 -6.794 1.961 1.00 0.00 H new ATOM 0 HG LEU A 50 7.957 -5.790 3.680 1.00 0.00 H new ATOM 0 HD11 LEU A 50 7.525 -7.178 5.662 1.00 0.00 H new ATOM 0 HD12 LEU A 50 6.721 -7.816 4.209 1.00 0.00 H new ATOM 0 HD13 LEU A 50 8.204 -8.589 4.817 1.00 0.00 H new ATOM 0 HD21 LEU A 50 9.645 -5.894 5.464 1.00 0.00 H new ATOM 0 HD22 LEU A 50 10.464 -7.221 4.605 1.00 0.00 H new ATOM 0 HD23 LEU A 50 10.374 -5.604 3.866 1.00 0.00 H new ATOM 731 N VAL A 51 5.883 -5.607 1.542 1.00 0.00 N ATOM 732 CA VAL A 51 5.296 -4.307 1.267 1.00 0.00 C ATOM 733 C VAL A 51 5.029 -3.582 2.588 1.00 0.00 C ATOM 734 O VAL A 51 5.148 -4.174 3.660 1.00 0.00 O ATOM 735 CB VAL A 51 4.039 -4.471 0.411 1.00 0.00 C ATOM 736 CG1 VAL A 51 4.349 -5.235 -0.878 1.00 0.00 C ATOM 737 CG2 VAL A 51 2.923 -5.159 1.201 1.00 0.00 C ATOM 0 H VAL A 51 5.291 -6.237 2.083 1.00 0.00 H new ATOM 0 HA VAL A 51 5.987 -3.691 0.692 1.00 0.00 H new ATOM 0 HB VAL A 51 3.690 -3.476 0.135 1.00 0.00 H new ATOM 0 HG11 VAL A 51 3.438 -5.338 -1.468 1.00 0.00 H new ATOM 0 HG12 VAL A 51 5.095 -4.688 -1.455 1.00 0.00 H new ATOM 0 HG13 VAL A 51 4.735 -6.224 -0.631 1.00 0.00 H new ATOM 0 HG21 VAL A 51 2.041 -5.263 0.569 1.00 0.00 H new ATOM 0 HG22 VAL A 51 3.259 -6.145 1.521 1.00 0.00 H new ATOM 0 HG23 VAL A 51 2.674 -4.559 2.076 1.00 0.00 H new ATOM 747 N ARG A 52 4.674 -2.312 2.468 1.00 0.00 N ATOM 748 CA ARG A 52 4.390 -1.500 3.639 1.00 0.00 C ATOM 749 C ARG A 52 3.030 -0.814 3.492 1.00 0.00 C ATOM 750 O ARG A 52 2.876 0.096 2.680 1.00 0.00 O ATOM 751 CB ARG A 52 5.470 -0.438 3.849 1.00 0.00 C ATOM 752 CG ARG A 52 5.346 0.205 5.233 1.00 0.00 C ATOM 753 CD ARG A 52 6.724 0.462 5.843 1.00 0.00 C ATOM 754 NE ARG A 52 6.585 1.218 7.108 1.00 0.00 N ATOM 755 CZ ARG A 52 6.144 0.687 8.256 1.00 0.00 C ATOM 756 NH1 ARG A 52 5.796 -0.606 8.306 1.00 0.00 N ATOM 757 NH2 ARG A 52 6.049 1.449 9.354 1.00 0.00 N ATOM 0 H ARG A 52 4.576 -1.825 1.577 1.00 0.00 H new ATOM 0 HA ARG A 52 4.375 -2.161 4.505 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.456 -0.891 3.741 1.00 0.00 H new ATOM 0 HB3 ARG A 52 5.386 0.329 3.079 1.00 0.00 H new ATOM 0 HG2 ARG A 52 4.798 1.144 5.154 1.00 0.00 H new ATOM 0 HG3 ARG A 52 4.769 -0.446 5.890 1.00 0.00 H new ATOM 0 HD2 ARG A 52 7.231 -0.485 6.030 1.00 0.00 H new ATOM 0 HD3 ARG A 52 7.343 1.022 5.141 1.00 0.00 H new ATOM 0 HE ARG A 52 6.841 2.205 7.105 1.00 0.00 H new ATOM 0 HH11 ARG A 52 5.867 -1.186 7.470 1.00 0.00 H new ATOM 0 HH12 ARG A 52 5.460 -1.010 9.180 1.00 0.00 H new ATOM 0 HH21 ARG A 52 6.312 2.434 9.316 1.00 0.00 H new ATOM 0 HH22 ARG A 52 5.713 1.044 10.228 1.00 0.00 H new ATOM 771 N SER A 53 2.079 -1.276 4.292 1.00 0.00 N ATOM 772 CA SER A 53 0.739 -0.717 4.260 1.00 0.00 C ATOM 773 C SER A 53 0.778 0.762 4.648 1.00 0.00 C ATOM 774 O SER A 53 1.673 1.193 5.374 1.00 0.00 O ATOM 775 CB SER A 53 -0.199 -1.486 5.193 1.00 0.00 C ATOM 776 OG SER A 53 -1.570 -1.277 4.862 1.00 0.00 O ATOM 0 H SER A 53 2.211 -2.031 4.965 1.00 0.00 H new ATOM 0 HA SER A 53 0.354 -0.808 3.244 1.00 0.00 H new ATOM 0 HB2 SER A 53 0.029 -2.551 5.139 1.00 0.00 H new ATOM 0 HB3 SER A 53 -0.023 -1.174 6.222 1.00 0.00 H new ATOM 0 HG SER A 53 -1.786 -1.766 4.041 1.00 0.00 H new ATOM 782 N PHE A 54 -0.201 1.499 4.148 1.00 0.00 N ATOM 783 CA PHE A 54 -0.290 2.921 4.433 1.00 0.00 C ATOM 784 C PHE A 54 -1.465 3.221 5.365 1.00 0.00 C ATOM 785 O PHE A 54 -1.841 4.379 5.542 1.00 0.00 O ATOM 786 CB PHE A 54 -0.519 3.631 3.097 1.00 0.00 C ATOM 787 CG PHE A 54 0.746 3.788 2.250 1.00 0.00 C ATOM 788 CD1 PHE A 54 1.710 4.673 2.625 1.00 0.00 C ATOM 789 CD2 PHE A 54 0.907 3.045 1.124 1.00 0.00 C ATOM 790 CE1 PHE A 54 2.884 4.817 1.840 1.00 0.00 C ATOM 791 CE2 PHE A 54 2.081 3.190 0.338 1.00 0.00 C ATOM 792 CZ PHE A 54 3.045 4.074 0.713 1.00 0.00 C ATOM 0 H PHE A 54 -0.941 1.138 3.546 1.00 0.00 H new ATOM 0 HA PHE A 54 0.623 3.260 4.923 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -1.261 3.074 2.524 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -0.940 4.618 3.289 1.00 0.00 H new ATOM 0 HD1 PHE A 54 1.582 5.265 3.519 1.00 0.00 H new ATOM 0 HD2 PHE A 54 0.142 2.344 0.826 1.00 0.00 H new ATOM 0 HE1 PHE A 54 3.650 5.517 2.138 1.00 0.00 H new ATOM 0 HE2 PHE A 54 2.209 2.599 -0.557 1.00 0.00 H new ATOM 0 HZ PHE A 54 3.938 4.185 0.116 1.00 0.00 H new ATOM 802 N ILE A 55 -2.013 2.158 5.936 1.00 0.00 N ATOM 803 CA ILE A 55 -3.138 2.293 6.846 1.00 0.00 C ATOM 804 C ILE A 55 -2.623 2.315 8.286 1.00 0.00 C ATOM 805 O ILE A 55 -2.797 3.304 8.996 1.00 0.00 O ATOM 806 CB ILE A 55 -4.177 1.203 6.579 1.00 0.00 C ATOM 807 CG1 ILE A 55 -4.747 1.323 5.165 1.00 0.00 C ATOM 808 CG2 ILE A 55 -5.275 1.219 7.644 1.00 0.00 C ATOM 809 CD1 ILE A 55 -5.620 0.114 4.822 1.00 0.00 C ATOM 0 H ILE A 55 -1.699 1.199 5.786 1.00 0.00 H new ATOM 0 HA ILE A 55 -3.654 3.239 6.678 1.00 0.00 H new ATOM 0 HB ILE A 55 -3.680 0.235 6.644 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -5.336 2.237 5.083 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -3.932 1.403 4.446 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -6.001 0.434 7.430 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -4.833 1.047 8.625 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -5.775 2.187 7.636 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -6.013 0.224 3.811 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -5.022 -0.795 4.882 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -6.448 0.051 5.528 1.00 0.00 H new ATOM 821 N ASP A 56 -2.001 1.211 8.675 1.00 0.00 N ATOM 822 CA ASP A 56 -1.461 1.091 10.018 1.00 0.00 C ATOM 823 C ASP A 56 0.057 1.278 9.972 1.00 0.00 C ATOM 824 O ASP A 56 0.701 1.417 11.010 1.00 0.00 O ATOM 825 CB ASP A 56 -1.748 -0.292 10.606 1.00 0.00 C ATOM 826 CG ASP A 56 -1.242 -0.507 12.033 1.00 0.00 C ATOM 827 OD1 ASP A 56 -0.925 0.514 12.682 1.00 0.00 O ATOM 828 OD2 ASP A 56 -1.183 -1.686 12.444 1.00 0.00 O ATOM 0 H ASP A 56 -1.859 0.392 8.083 1.00 0.00 H new ATOM 0 HA ASP A 56 -1.932 1.853 10.639 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -2.825 -0.461 10.589 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -1.297 -1.045 9.960 1.00 0.00 H new ATOM 833 N SER A 57 0.584 1.275 8.755 1.00 0.00 N ATOM 834 CA SER A 57 2.014 1.443 8.559 1.00 0.00 C ATOM 835 C SER A 57 2.762 0.214 9.083 1.00 0.00 C ATOM 836 O SER A 57 3.735 0.345 9.823 1.00 0.00 O ATOM 837 CB SER A 57 2.521 2.708 9.254 1.00 0.00 C ATOM 838 OG SER A 57 1.676 3.829 9.005 1.00 0.00 O ATOM 0 H SER A 57 0.046 1.159 7.896 1.00 0.00 H new ATOM 0 HA SER A 57 2.202 1.548 7.491 1.00 0.00 H new ATOM 0 HB2 SER A 57 2.583 2.532 10.328 1.00 0.00 H new ATOM 0 HB3 SER A 57 3.531 2.931 8.909 1.00 0.00 H new ATOM 0 HG SER A 57 1.937 4.572 9.589 1.00 0.00 H new ATOM 844 N LYS A 58 2.278 -0.951 8.678 1.00 0.00 N ATOM 845 CA LYS A 58 2.888 -2.200 9.097 1.00 0.00 C ATOM 846 C LYS A 58 3.505 -2.895 7.881 1.00 0.00 C ATOM 847 O LYS A 58 3.128 -2.613 6.744 1.00 0.00 O ATOM 848 CB LYS A 58 1.875 -3.065 9.851 1.00 0.00 C ATOM 849 CG LYS A 58 1.713 -2.585 11.295 1.00 0.00 C ATOM 850 CD LYS A 58 1.821 -3.754 12.276 1.00 0.00 C ATOM 851 CE LYS A 58 2.151 -3.257 13.685 1.00 0.00 C ATOM 852 NZ LYS A 58 1.196 -3.814 14.668 1.00 0.00 N ATOM 0 H LYS A 58 1.470 -1.056 8.064 1.00 0.00 H new ATOM 0 HA LYS A 58 3.698 -2.010 9.801 1.00 0.00 H new ATOM 0 HB2 LYS A 58 0.912 -3.031 9.342 1.00 0.00 H new ATOM 0 HB3 LYS A 58 2.202 -4.105 9.844 1.00 0.00 H new ATOM 0 HG2 LYS A 58 2.477 -1.842 11.523 1.00 0.00 H new ATOM 0 HG3 LYS A 58 0.747 -2.095 11.413 1.00 0.00 H new ATOM 0 HD2 LYS A 58 0.882 -4.308 12.292 1.00 0.00 H new ATOM 0 HD3 LYS A 58 2.594 -4.446 11.940 1.00 0.00 H new ATOM 0 HE2 LYS A 58 3.167 -3.548 13.951 1.00 0.00 H new ATOM 0 HE3 LYS A 58 2.115 -2.168 13.711 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 1.434 -3.467 15.619 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 0.231 -3.515 14.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 1.251 -4.852 14.655 1.00 0.00 H new ATOM 866 N PHE A 59 4.441 -3.789 8.161 1.00 0.00 N ATOM 867 CA PHE A 59 5.112 -4.527 7.104 1.00 0.00 C ATOM 868 C PHE A 59 4.404 -5.854 6.825 1.00 0.00 C ATOM 869 O PHE A 59 4.101 -6.606 7.749 1.00 0.00 O ATOM 870 CB PHE A 59 6.533 -4.814 7.593 1.00 0.00 C ATOM 871 CG PHE A 59 7.421 -3.571 7.690 1.00 0.00 C ATOM 872 CD1 PHE A 59 8.100 -3.133 6.597 1.00 0.00 C ATOM 873 CD2 PHE A 59 7.530 -2.905 8.871 1.00 0.00 C ATOM 874 CE1 PHE A 59 8.923 -1.980 6.687 1.00 0.00 C ATOM 875 CE2 PHE A 59 8.354 -1.751 8.962 1.00 0.00 C ATOM 876 CZ PHE A 59 9.033 -1.313 7.867 1.00 0.00 C ATOM 0 H PHE A 59 4.751 -4.019 9.105 1.00 0.00 H new ATOM 0 HA PHE A 59 5.107 -3.944 6.183 1.00 0.00 H new ATOM 0 HB2 PHE A 59 6.480 -5.288 8.573 1.00 0.00 H new ATOM 0 HB3 PHE A 59 7.001 -5.530 6.918 1.00 0.00 H new ATOM 0 HD1 PHE A 59 8.013 -3.662 5.660 1.00 0.00 H new ATOM 0 HD2 PHE A 59 6.990 -3.253 9.739 1.00 0.00 H new ATOM 0 HE1 PHE A 59 9.462 -1.632 5.818 1.00 0.00 H new ATOM 0 HE2 PHE A 59 8.441 -1.222 9.899 1.00 0.00 H new ATOM 0 HZ PHE A 59 9.659 -0.436 7.935 1.00 0.00 H new ATOM 886 N TYR A 60 4.159 -6.100 5.546 1.00 0.00 N ATOM 887 CA TYR A 60 3.492 -7.322 5.134 1.00 0.00 C ATOM 888 C TYR A 60 4.155 -7.917 3.890 1.00 0.00 C ATOM 889 O TYR A 60 4.799 -7.201 3.124 1.00 0.00 O ATOM 890 CB TYR A 60 2.055 -6.924 4.790 1.00 0.00 C ATOM 891 CG TYR A 60 1.225 -6.484 5.998 1.00 0.00 C ATOM 892 CD1 TYR A 60 0.675 -7.429 6.838 1.00 0.00 C ATOM 893 CD2 TYR A 60 1.028 -5.140 6.246 1.00 0.00 C ATOM 894 CE1 TYR A 60 -0.107 -7.015 7.975 1.00 0.00 C ATOM 895 CE2 TYR A 60 0.248 -4.726 7.382 1.00 0.00 C ATOM 896 CZ TYR A 60 -0.282 -5.683 8.190 1.00 0.00 C ATOM 897 OH TYR A 60 -1.019 -5.292 9.265 1.00 0.00 O ATOM 0 H TYR A 60 4.411 -5.473 4.782 1.00 0.00 H new ATOM 0 HA TYR A 60 3.541 -8.070 5.925 1.00 0.00 H new ATOM 0 HB2 TYR A 60 2.078 -6.112 4.063 1.00 0.00 H new ATOM 0 HB3 TYR A 60 1.560 -7.768 4.310 1.00 0.00 H new ATOM 0 HD1 TYR A 60 0.830 -8.480 6.644 1.00 0.00 H new ATOM 0 HD2 TYR A 60 1.459 -4.400 5.588 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -0.544 -7.745 8.641 1.00 0.00 H new ATOM 0 HE2 TYR A 60 0.087 -3.678 7.589 1.00 0.00 H new ATOM 0 HH TYR A 60 -1.060 -4.313 9.295 1.00 0.00 H new ATOM 907 N SER A 61 3.976 -9.220 3.729 1.00 0.00 N ATOM 908 CA SER A 61 4.549 -9.918 2.590 1.00 0.00 C ATOM 909 C SER A 61 3.436 -10.522 1.731 1.00 0.00 C ATOM 910 O SER A 61 2.800 -11.497 2.129 1.00 0.00 O ATOM 911 CB SER A 61 5.519 -11.010 3.046 1.00 0.00 C ATOM 912 OG SER A 61 5.758 -11.973 2.023 1.00 0.00 O ATOM 0 H SER A 61 3.443 -9.810 4.367 1.00 0.00 H new ATOM 0 HA SER A 61 5.108 -9.197 1.993 1.00 0.00 H new ATOM 0 HB2 SER A 61 6.464 -10.555 3.343 1.00 0.00 H new ATOM 0 HB3 SER A 61 5.115 -11.509 3.927 1.00 0.00 H new ATOM 0 HG SER A 61 5.285 -12.804 2.239 1.00 0.00 H new ATOM 918 N ILE A 62 3.234 -9.917 0.569 1.00 0.00 N ATOM 919 CA ILE A 62 2.209 -10.382 -0.348 1.00 0.00 C ATOM 920 C ILE A 62 2.873 -10.916 -1.620 1.00 0.00 C ATOM 921 O ILE A 62 4.095 -10.877 -1.748 1.00 0.00 O ATOM 922 CB ILE A 62 1.180 -9.279 -0.608 1.00 0.00 C ATOM 923 CG1 ILE A 62 1.509 -8.023 0.201 1.00 0.00 C ATOM 924 CG2 ILE A 62 -0.240 -9.779 -0.338 1.00 0.00 C ATOM 925 CD1 ILE A 62 1.421 -8.298 1.703 1.00 0.00 C ATOM 0 H ILE A 62 3.763 -9.109 0.242 1.00 0.00 H new ATOM 0 HA ILE A 62 1.651 -11.208 0.093 1.00 0.00 H new ATOM 0 HB ILE A 62 1.230 -9.006 -1.662 1.00 0.00 H new ATOM 0 HG12 ILE A 62 2.511 -7.677 -0.051 1.00 0.00 H new ATOM 0 HG13 ILE A 62 0.819 -7.223 -0.067 1.00 0.00 H new ATOM 0 HG21 ILE A 62 -0.951 -8.976 -0.530 1.00 0.00 H new ATOM 0 HG22 ILE A 62 -0.459 -10.622 -0.993 1.00 0.00 H new ATOM 0 HG23 ILE A 62 -0.323 -10.096 0.702 1.00 0.00 H new ATOM 0 HD11 ILE A 62 1.660 -7.388 2.254 1.00 0.00 H new ATOM 0 HD12 ILE A 62 0.411 -8.621 1.955 1.00 0.00 H new ATOM 0 HD13 ILE A 62 2.130 -9.081 1.972 1.00 0.00 H new ATOM 937 N ALA A 63 2.037 -11.401 -2.526 1.00 0.00 N ATOM 938 CA ALA A 63 2.528 -11.942 -3.783 1.00 0.00 C ATOM 939 C ALA A 63 2.386 -10.882 -4.878 1.00 0.00 C ATOM 940 O ALA A 63 1.348 -10.232 -4.987 1.00 0.00 O ATOM 941 CB ALA A 63 1.771 -13.229 -4.115 1.00 0.00 C ATOM 0 H ALA A 63 1.023 -11.431 -2.415 1.00 0.00 H new ATOM 0 HA ALA A 63 3.585 -12.197 -3.705 1.00 0.00 H new ATOM 0 HB1 ALA A 63 2.139 -13.635 -5.057 1.00 0.00 H new ATOM 0 HB2 ALA A 63 1.927 -13.958 -3.320 1.00 0.00 H new ATOM 0 HB3 ALA A 63 0.707 -13.012 -4.204 1.00 0.00 H new ATOM 947 N ARG A 64 3.445 -10.744 -5.661 1.00 0.00 N ATOM 948 CA ARG A 64 3.453 -9.774 -6.744 1.00 0.00 C ATOM 949 C ARG A 64 2.211 -9.950 -7.621 1.00 0.00 C ATOM 950 O ARG A 64 1.770 -9.005 -8.273 1.00 0.00 O ATOM 951 CB ARG A 64 4.706 -9.925 -7.610 1.00 0.00 C ATOM 952 CG ARG A 64 5.173 -8.568 -8.137 1.00 0.00 C ATOM 953 CD ARG A 64 6.557 -8.213 -7.587 1.00 0.00 C ATOM 954 NE ARG A 64 7.601 -8.567 -8.575 1.00 0.00 N ATOM 955 CZ ARG A 64 8.900 -8.703 -8.277 1.00 0.00 C ATOM 956 NH1 ARG A 64 9.323 -8.516 -7.020 1.00 0.00 N ATOM 957 NH2 ARG A 64 9.777 -9.026 -9.238 1.00 0.00 N ATOM 0 H ARG A 64 4.303 -11.287 -5.568 1.00 0.00 H new ATOM 0 HA ARG A 64 3.451 -8.779 -6.299 1.00 0.00 H new ATOM 0 HB2 ARG A 64 5.503 -10.386 -7.026 1.00 0.00 H new ATOM 0 HB3 ARG A 64 4.496 -10.592 -8.446 1.00 0.00 H new ATOM 0 HG2 ARG A 64 5.205 -8.588 -9.226 1.00 0.00 H new ATOM 0 HG3 ARG A 64 4.456 -7.797 -7.853 1.00 0.00 H new ATOM 0 HD2 ARG A 64 6.605 -7.148 -7.361 1.00 0.00 H new ATOM 0 HD3 ARG A 64 6.734 -8.746 -6.653 1.00 0.00 H new ATOM 0 HE ARG A 64 7.314 -8.717 -9.542 1.00 0.00 H new ATOM 0 HH11 ARG A 64 8.656 -8.270 -6.289 1.00 0.00 H new ATOM 0 HH12 ARG A 64 10.312 -8.620 -6.794 1.00 0.00 H new ATOM 0 HH21 ARG A 64 9.455 -9.168 -10.195 1.00 0.00 H new ATOM 0 HH22 ARG A 64 10.766 -9.130 -9.012 1.00 0.00 H new ATOM 971 N LYS A 65 1.683 -11.165 -7.608 1.00 0.00 N ATOM 972 CA LYS A 65 0.501 -11.475 -8.393 1.00 0.00 C ATOM 973 C LYS A 65 -0.694 -10.699 -7.838 1.00 0.00 C ATOM 974 O LYS A 65 -1.559 -10.256 -8.594 1.00 0.00 O ATOM 975 CB LYS A 65 0.278 -12.988 -8.451 1.00 0.00 C ATOM 976 CG LYS A 65 0.016 -13.557 -7.056 1.00 0.00 C ATOM 977 CD LYS A 65 -0.221 -15.067 -7.115 1.00 0.00 C ATOM 978 CE LYS A 65 1.101 -15.834 -7.034 1.00 0.00 C ATOM 979 NZ LYS A 65 0.975 -16.985 -6.112 1.00 0.00 N ATOM 0 H LYS A 65 2.052 -11.946 -7.066 1.00 0.00 H new ATOM 0 HA LYS A 65 0.636 -11.155 -9.426 1.00 0.00 H new ATOM 0 HB2 LYS A 65 -0.567 -13.210 -9.103 1.00 0.00 H new ATOM 0 HB3 LYS A 65 1.152 -13.472 -8.887 1.00 0.00 H new ATOM 0 HG2 LYS A 65 0.865 -13.344 -6.407 1.00 0.00 H new ATOM 0 HG3 LYS A 65 -0.852 -13.066 -6.616 1.00 0.00 H new ATOM 0 HD2 LYS A 65 -0.871 -15.369 -6.294 1.00 0.00 H new ATOM 0 HD3 LYS A 65 -0.737 -15.322 -8.041 1.00 0.00 H new ATOM 0 HE2 LYS A 65 1.387 -16.184 -8.026 1.00 0.00 H new ATOM 0 HE3 LYS A 65 1.894 -15.170 -6.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 65 1.880 -17.495 -6.068 1.00 0.00 H new ATOM 0 HZ2 LYS A 65 0.724 -16.643 -5.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 65 0.233 -17.626 -6.457 1.00 0.00 H new ATOM 993 N ASP A 66 -0.706 -10.555 -6.521 1.00 0.00 N ATOM 994 CA ASP A 66 -1.780 -9.840 -5.854 1.00 0.00 C ATOM 995 C ASP A 66 -1.691 -8.353 -6.206 1.00 0.00 C ATOM 996 O ASP A 66 -2.680 -7.627 -6.104 1.00 0.00 O ATOM 997 CB ASP A 66 -1.673 -9.974 -4.335 1.00 0.00 C ATOM 998 CG ASP A 66 -1.135 -11.319 -3.841 1.00 0.00 C ATOM 999 OD1 ASP A 66 -1.419 -12.328 -4.521 1.00 0.00 O ATOM 1000 OD2 ASP A 66 -0.451 -11.307 -2.795 1.00 0.00 O ATOM 0 H ASP A 66 0.013 -10.922 -5.897 1.00 0.00 H new ATOM 0 HA ASP A 66 -2.726 -10.267 -6.186 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -1.026 -9.181 -3.960 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -2.660 -9.813 -3.901 1.00 0.00 H new ATOM 1005 N ILE A 67 -0.498 -7.944 -6.610 1.00 0.00 N ATOM 1006 CA ILE A 67 -0.267 -6.557 -6.976 1.00 0.00 C ATOM 1007 C ILE A 67 -0.671 -6.345 -8.437 1.00 0.00 C ATOM 1008 O ILE A 67 -0.564 -7.259 -9.253 1.00 0.00 O ATOM 1009 CB ILE A 67 1.178 -6.156 -6.675 1.00 0.00 C ATOM 1010 CG1 ILE A 67 1.548 -6.486 -5.226 1.00 0.00 C ATOM 1011 CG2 ILE A 67 1.420 -4.683 -7.006 1.00 0.00 C ATOM 1012 CD1 ILE A 67 3.066 -6.520 -5.042 1.00 0.00 C ATOM 0 H ILE A 67 0.319 -8.549 -6.692 1.00 0.00 H new ATOM 0 HA ILE A 67 -0.889 -5.896 -6.373 1.00 0.00 H new ATOM 0 HB ILE A 67 1.835 -6.742 -7.318 1.00 0.00 H new ATOM 0 HG12 ILE A 67 1.114 -5.742 -4.558 1.00 0.00 H new ATOM 0 HG13 ILE A 67 1.123 -7.451 -4.949 1.00 0.00 H new ATOM 0 HG21 ILE A 67 2.455 -4.425 -6.782 1.00 0.00 H new ATOM 0 HG22 ILE A 67 1.224 -4.511 -8.064 1.00 0.00 H new ATOM 0 HG23 ILE A 67 0.754 -4.061 -6.408 1.00 0.00 H new ATOM 0 HD11 ILE A 67 3.302 -6.756 -4.004 1.00 0.00 H new ATOM 0 HD12 ILE A 67 3.495 -7.281 -5.694 1.00 0.00 H new ATOM 0 HD13 ILE A 67 3.485 -5.547 -5.296 1.00 0.00 H new ATOM 1024 N LYS A 68 -1.128 -5.135 -8.721 1.00 0.00 N ATOM 1025 CA LYS A 68 -1.549 -4.790 -10.068 1.00 0.00 C ATOM 1026 C LYS A 68 -1.511 -3.270 -10.238 1.00 0.00 C ATOM 1027 O LYS A 68 -2.265 -2.712 -11.034 1.00 0.00 O ATOM 1028 CB LYS A 68 -2.913 -5.411 -10.378 1.00 0.00 C ATOM 1029 CG LYS A 68 -4.039 -4.621 -9.706 1.00 0.00 C ATOM 1030 CD LYS A 68 -4.628 -5.401 -8.529 1.00 0.00 C ATOM 1031 CE LYS A 68 -6.157 -5.394 -8.578 1.00 0.00 C ATOM 1032 NZ LYS A 68 -6.714 -4.892 -7.302 1.00 0.00 N ATOM 0 H LYS A 68 -1.216 -4.380 -8.041 1.00 0.00 H new ATOM 0 HA LYS A 68 -0.860 -5.209 -10.801 1.00 0.00 H new ATOM 0 HB2 LYS A 68 -3.071 -5.431 -11.456 1.00 0.00 H new ATOM 0 HB3 LYS A 68 -2.933 -6.445 -10.033 1.00 0.00 H new ATOM 0 HG2 LYS A 68 -3.657 -3.662 -9.357 1.00 0.00 H new ATOM 0 HG3 LYS A 68 -4.822 -4.407 -10.433 1.00 0.00 H new ATOM 0 HD2 LYS A 68 -4.264 -6.428 -8.550 1.00 0.00 H new ATOM 0 HD3 LYS A 68 -4.288 -4.962 -7.591 1.00 0.00 H new ATOM 0 HE2 LYS A 68 -6.497 -4.767 -9.402 1.00 0.00 H new ATOM 0 HE3 LYS A 68 -6.525 -6.402 -8.771 1.00 0.00 H new ATOM 0 HZ1 LYS A 68 -7.391 -5.584 -6.922 1.00 0.00 H new ATOM 0 HZ2 LYS A 68 -5.943 -4.751 -6.618 1.00 0.00 H new ATOM 0 HZ3 LYS A 68 -7.200 -3.988 -7.467 1.00 0.00 H new ATOM 1046 N GLU A 69 -0.628 -2.643 -9.475 1.00 0.00 N ATOM 1047 CA GLU A 69 -0.483 -1.199 -9.531 1.00 0.00 C ATOM 1048 C GLU A 69 -1.787 -0.518 -9.111 1.00 0.00 C ATOM 1049 O GLU A 69 -2.870 -1.066 -9.311 1.00 0.00 O ATOM 1050 CB GLU A 69 -0.051 -0.745 -10.927 1.00 0.00 C ATOM 1051 CG GLU A 69 0.748 0.558 -10.857 1.00 0.00 C ATOM 1052 CD GLU A 69 -0.183 1.767 -10.742 1.00 0.00 C ATOM 1053 OE1 GLU A 69 -1.265 1.710 -11.366 1.00 0.00 O ATOM 1054 OE2 GLU A 69 0.209 2.720 -10.035 1.00 0.00 O ATOM 0 H GLU A 69 -0.006 -3.109 -8.815 1.00 0.00 H new ATOM 0 HA GLU A 69 0.299 -0.904 -8.831 1.00 0.00 H new ATOM 0 HB2 GLU A 69 0.554 -1.522 -11.395 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -0.930 -0.603 -11.556 1.00 0.00 H new ATOM 0 HG2 GLU A 69 1.421 0.530 -10.000 1.00 0.00 H new ATOM 0 HG3 GLU A 69 1.369 0.656 -11.747 1.00 0.00 H new ATOM 1061 N VAL A 70 -1.641 0.668 -8.538 1.00 0.00 N ATOM 1062 CA VAL A 70 -2.793 1.430 -8.089 1.00 0.00 C ATOM 1063 C VAL A 70 -2.524 2.923 -8.291 1.00 0.00 C ATOM 1064 O VAL A 70 -1.380 3.367 -8.201 1.00 0.00 O ATOM 1065 CB VAL A 70 -3.124 1.072 -6.638 1.00 0.00 C ATOM 1066 CG1 VAL A 70 -2.100 1.680 -5.678 1.00 0.00 C ATOM 1067 CG2 VAL A 70 -4.544 1.511 -6.276 1.00 0.00 C ATOM 0 H VAL A 70 -0.741 1.120 -8.375 1.00 0.00 H new ATOM 0 HA VAL A 70 -3.672 1.176 -8.681 1.00 0.00 H new ATOM 0 HB VAL A 70 -3.074 -0.012 -6.539 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -2.357 1.411 -4.653 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -1.107 1.298 -5.915 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -2.105 2.765 -5.780 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -4.754 1.245 -5.240 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -4.634 2.590 -6.399 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -5.258 1.011 -6.931 1.00 0.00 H new ATOM 1077 N ASP A 71 -3.595 3.653 -8.560 1.00 0.00 N ATOM 1078 CA ASP A 71 -3.487 5.087 -8.774 1.00 0.00 C ATOM 1079 C ASP A 71 -4.123 5.824 -7.594 1.00 0.00 C ATOM 1080 O ASP A 71 -5.304 6.168 -7.635 1.00 0.00 O ATOM 1081 CB ASP A 71 -4.224 5.509 -10.047 1.00 0.00 C ATOM 1082 CG ASP A 71 -4.610 4.361 -10.983 1.00 0.00 C ATOM 1083 OD1 ASP A 71 -5.602 3.674 -10.658 1.00 0.00 O ATOM 1084 OD2 ASP A 71 -3.904 4.197 -12.000 1.00 0.00 O ATOM 0 H ASP A 71 -4.541 3.280 -8.635 1.00 0.00 H new ATOM 0 HA ASP A 71 -2.430 5.336 -8.868 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -5.129 6.046 -9.763 1.00 0.00 H new ATOM 0 HB3 ASP A 71 -3.596 6.210 -10.597 1.00 0.00 H new ATOM 1089 N ILE A 72 -3.313 6.046 -6.570 1.00 0.00 N ATOM 1090 CA ILE A 72 -3.781 6.736 -5.380 1.00 0.00 C ATOM 1091 C ILE A 72 -3.915 8.230 -5.683 1.00 0.00 C ATOM 1092 O ILE A 72 -4.890 8.862 -5.280 1.00 0.00 O ATOM 1093 CB ILE A 72 -2.870 6.430 -4.190 1.00 0.00 C ATOM 1094 CG1 ILE A 72 -2.608 4.926 -4.072 1.00 0.00 C ATOM 1095 CG2 ILE A 72 -3.442 7.014 -2.897 1.00 0.00 C ATOM 1096 CD1 ILE A 72 -3.859 4.123 -4.435 1.00 0.00 C ATOM 0 H ILE A 72 -2.334 5.760 -6.540 1.00 0.00 H new ATOM 0 HA ILE A 72 -4.770 6.377 -5.095 1.00 0.00 H new ATOM 0 HB ILE A 72 -1.908 6.912 -4.364 1.00 0.00 H new ATOM 0 HG12 ILE A 72 -1.786 4.643 -4.730 1.00 0.00 H new ATOM 0 HG13 ILE A 72 -2.299 4.685 -3.055 1.00 0.00 H new ATOM 0 HG21 ILE A 72 -2.775 6.782 -2.067 1.00 0.00 H new ATOM 0 HG22 ILE A 72 -3.535 8.095 -2.996 1.00 0.00 H new ATOM 0 HG23 ILE A 72 -4.424 6.581 -2.705 1.00 0.00 H new ATOM 0 HD11 ILE A 72 -3.647 3.058 -4.343 1.00 0.00 H new ATOM 0 HD12 ILE A 72 -4.672 4.391 -3.760 1.00 0.00 H new ATOM 0 HD13 ILE A 72 -4.151 4.348 -5.461 1.00 0.00 H new ATOM 1108 N LEU A 73 -2.923 8.750 -6.390 1.00 0.00 N ATOM 1109 CA LEU A 73 -2.919 10.158 -6.751 1.00 0.00 C ATOM 1110 C LEU A 73 -4.022 10.420 -7.778 1.00 0.00 C ATOM 1111 O LEU A 73 -4.292 11.568 -8.124 1.00 0.00 O ATOM 1112 CB LEU A 73 -1.527 10.586 -7.221 1.00 0.00 C ATOM 1113 CG LEU A 73 -0.603 11.160 -6.144 1.00 0.00 C ATOM 1114 CD1 LEU A 73 0.634 11.806 -6.771 1.00 0.00 C ATOM 1115 CD2 LEU A 73 -1.358 12.131 -5.234 1.00 0.00 C ATOM 0 H LEU A 73 -2.116 8.222 -6.723 1.00 0.00 H new ATOM 0 HA LEU A 73 -3.141 10.775 -5.880 1.00 0.00 H new ATOM 0 HB2 LEU A 73 -1.036 9.723 -7.671 1.00 0.00 H new ATOM 0 HB3 LEU A 73 -1.644 11.332 -8.007 1.00 0.00 H new ATOM 0 HG LEU A 73 -0.255 10.338 -5.519 1.00 0.00 H new ATOM 0 HD11 LEU A 73 1.274 12.206 -5.984 1.00 0.00 H new ATOM 0 HD12 LEU A 73 1.185 11.059 -7.342 1.00 0.00 H new ATOM 0 HD13 LEU A 73 0.326 12.614 -7.434 1.00 0.00 H new ATOM 0 HD21 LEU A 73 -0.678 12.524 -4.478 1.00 0.00 H new ATOM 0 HD22 LEU A 73 -1.754 12.954 -5.829 1.00 0.00 H new ATOM 0 HD23 LEU A 73 -2.180 11.608 -4.746 1.00 0.00 H new ATOM 1127 N ASN A 74 -4.630 9.335 -8.236 1.00 0.00 N ATOM 1128 CA ASN A 74 -5.697 9.433 -9.217 1.00 0.00 C ATOM 1129 C ASN A 74 -7.040 9.180 -8.529 1.00 0.00 C ATOM 1130 O ASN A 74 -8.057 8.992 -9.195 1.00 0.00 O ATOM 1131 CB ASN A 74 -5.527 8.388 -10.322 1.00 0.00 C ATOM 1132 CG ASN A 74 -5.631 9.033 -11.706 1.00 0.00 C ATOM 1133 OD1 ASN A 74 -6.583 8.833 -12.443 1.00 0.00 O ATOM 1134 ND2 ASN A 74 -4.601 9.815 -12.016 1.00 0.00 N ATOM 0 H ASN A 74 -4.404 8.384 -7.946 1.00 0.00 H new ATOM 0 HA ASN A 74 -5.662 10.430 -9.656 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -4.560 7.897 -10.217 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -6.289 7.616 -10.218 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -4.575 10.291 -12.918 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -3.837 9.939 -11.352 1.00 0.00 H new ATOM 1141 N LEU A 75 -7.000 9.182 -7.205 1.00 0.00 N ATOM 1142 CA LEU A 75 -8.202 8.955 -6.419 1.00 0.00 C ATOM 1143 C LEU A 75 -8.848 10.301 -6.084 1.00 0.00 C ATOM 1144 O LEU A 75 -8.173 11.328 -6.055 1.00 0.00 O ATOM 1145 CB LEU A 75 -7.884 8.103 -5.189 1.00 0.00 C ATOM 1146 CG LEU A 75 -7.706 6.604 -5.440 1.00 0.00 C ATOM 1147 CD1 LEU A 75 -7.314 5.875 -4.153 1.00 0.00 C ATOM 1148 CD2 LEU A 75 -8.958 6.002 -6.081 1.00 0.00 C ATOM 0 H LEU A 75 -6.154 9.337 -6.656 1.00 0.00 H new ATOM 0 HA LEU A 75 -8.932 8.385 -6.994 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -6.971 8.486 -4.732 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -8.685 8.237 -4.462 1.00 0.00 H new ATOM 0 HG LEU A 75 -6.887 6.472 -6.147 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -7.194 4.811 -4.359 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -6.374 6.280 -3.777 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -8.094 6.013 -3.404 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -8.804 4.936 -6.248 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -9.811 6.146 -5.418 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -9.152 6.495 -7.034 1.00 0.00 H new ATOM 1160 N PRO A 76 -10.184 10.249 -5.834 1.00 0.00 N ATOM 1161 CA PRO A 76 -10.930 11.451 -5.502 1.00 0.00 C ATOM 1162 C PRO A 76 -10.643 11.896 -4.067 1.00 0.00 C ATOM 1163 O PRO A 76 -10.535 11.066 -3.166 1.00 0.00 O ATOM 1164 CB PRO A 76 -12.388 11.086 -5.730 1.00 0.00 C ATOM 1165 CG PRO A 76 -12.440 9.566 -5.731 1.00 0.00 C ATOM 1166 CD PRO A 76 -11.017 9.050 -5.859 1.00 0.00 C ATOM 0 HA PRO A 76 -10.646 12.305 -6.117 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -13.022 11.498 -4.945 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -12.749 11.490 -6.676 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -12.898 9.199 -4.812 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -13.052 9.206 -6.558 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -10.765 8.376 -5.040 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.880 8.492 -6.785 1.00 0.00 H new ATOM 1174 N GLU A 77 -10.527 13.206 -3.900 1.00 0.00 N ATOM 1175 CA GLU A 77 -10.255 13.771 -2.589 1.00 0.00 C ATOM 1176 C GLU A 77 -11.163 13.134 -1.536 1.00 0.00 C ATOM 1177 O GLU A 77 -10.791 13.035 -0.368 1.00 0.00 O ATOM 1178 CB GLU A 77 -10.415 15.292 -2.604 1.00 0.00 C ATOM 1179 CG GLU A 77 -9.193 15.968 -3.228 1.00 0.00 C ATOM 1180 CD GLU A 77 -9.612 17.004 -4.271 1.00 0.00 C ATOM 1181 OE1 GLU A 77 -10.602 17.716 -4.000 1.00 0.00 O ATOM 1182 OE2 GLU A 77 -8.931 17.063 -5.319 1.00 0.00 O ATOM 0 H GLU A 77 -10.616 13.891 -4.650 1.00 0.00 H new ATOM 0 HA GLU A 77 -9.220 13.550 -2.328 1.00 0.00 H new ATOM 0 HB2 GLU A 77 -11.310 15.561 -3.165 1.00 0.00 H new ATOM 0 HB3 GLU A 77 -10.556 15.656 -1.586 1.00 0.00 H new ATOM 0 HG2 GLU A 77 -8.602 16.450 -2.449 1.00 0.00 H new ATOM 0 HG3 GLU A 77 -8.555 15.216 -3.693 1.00 0.00 H new ATOM 1189 N SER A 78 -12.337 12.717 -1.988 1.00 0.00 N ATOM 1190 CA SER A 78 -13.302 12.092 -1.099 1.00 0.00 C ATOM 1191 C SER A 78 -12.667 10.885 -0.405 1.00 0.00 C ATOM 1192 O SER A 78 -12.667 10.800 0.822 1.00 0.00 O ATOM 1193 CB SER A 78 -14.558 11.666 -1.862 1.00 0.00 C ATOM 1194 OG SER A 78 -15.725 12.327 -1.379 1.00 0.00 O ATOM 0 H SER A 78 -12.642 12.800 -2.958 1.00 0.00 H new ATOM 0 HA SER A 78 -13.598 12.822 -0.346 1.00 0.00 H new ATOM 0 HB2 SER A 78 -14.430 11.885 -2.922 1.00 0.00 H new ATOM 0 HB3 SER A 78 -14.689 10.588 -1.772 1.00 0.00 H new ATOM 0 HG SER A 78 -16.505 12.030 -1.892 1.00 0.00 H new ATOM 1200 N GLU A 79 -12.143 9.982 -1.221 1.00 0.00 N ATOM 1201 CA GLU A 79 -11.507 8.784 -0.700 1.00 0.00 C ATOM 1202 C GLU A 79 -10.328 9.156 0.201 1.00 0.00 C ATOM 1203 O GLU A 79 -10.285 8.767 1.367 1.00 0.00 O ATOM 1204 CB GLU A 79 -11.059 7.863 -1.837 1.00 0.00 C ATOM 1205 CG GLU A 79 -12.257 7.151 -2.470 1.00 0.00 C ATOM 1206 CD GLU A 79 -11.878 5.740 -2.925 1.00 0.00 C ATOM 1207 OE1 GLU A 79 -11.822 4.856 -2.043 1.00 0.00 O ATOM 1208 OE2 GLU A 79 -11.653 5.578 -4.144 1.00 0.00 O ATOM 0 H GLU A 79 -12.146 10.056 -2.238 1.00 0.00 H new ATOM 0 HA GLU A 79 -12.238 8.240 -0.101 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -10.534 8.444 -2.595 1.00 0.00 H new ATOM 0 HB3 GLU A 79 -10.353 7.125 -1.456 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -13.075 7.098 -1.751 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -12.619 7.727 -3.322 1.00 0.00 H new ATOM 1215 N LEU A 80 -9.399 9.906 -0.373 1.00 0.00 N ATOM 1216 CA LEU A 80 -8.223 10.336 0.362 1.00 0.00 C ATOM 1217 C LEU A 80 -8.645 10.824 1.750 1.00 0.00 C ATOM 1218 O LEU A 80 -8.175 10.307 2.762 1.00 0.00 O ATOM 1219 CB LEU A 80 -7.438 11.375 -0.441 1.00 0.00 C ATOM 1220 CG LEU A 80 -7.052 10.968 -1.865 1.00 0.00 C ATOM 1221 CD1 LEU A 80 -6.278 12.088 -2.565 1.00 0.00 C ATOM 1222 CD2 LEU A 80 -6.277 9.649 -1.868 1.00 0.00 C ATOM 0 H LEU A 80 -9.438 10.227 -1.340 1.00 0.00 H new ATOM 0 HA LEU A 80 -7.540 9.499 0.510 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -8.030 12.289 -0.493 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -6.527 11.616 0.107 1.00 0.00 H new ATOM 0 HG LEU A 80 -7.968 10.805 -2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -6.016 11.773 -3.575 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.898 12.983 -2.614 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -5.368 12.306 -2.006 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -6.015 9.383 -2.892 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -5.367 9.760 -1.278 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -6.896 8.862 -1.436 1.00 0.00 H new ATOM 1234 N SER A 81 -9.527 11.813 1.752 1.00 0.00 N ATOM 1235 CA SER A 81 -10.017 12.375 2.998 1.00 0.00 C ATOM 1236 C SER A 81 -10.420 11.253 3.956 1.00 0.00 C ATOM 1237 O SER A 81 -10.096 11.298 5.142 1.00 0.00 O ATOM 1238 CB SER A 81 -11.201 13.313 2.751 1.00 0.00 C ATOM 1239 OG SER A 81 -11.176 14.444 3.617 1.00 0.00 O ATOM 0 H SER A 81 -9.915 12.239 0.910 1.00 0.00 H new ATOM 0 HA SER A 81 -9.214 12.958 3.449 1.00 0.00 H new ATOM 0 HB2 SER A 81 -11.187 13.650 1.714 1.00 0.00 H new ATOM 0 HB3 SER A 81 -12.133 12.766 2.896 1.00 0.00 H new ATOM 0 HG SER A 81 -11.947 15.019 3.427 1.00 0.00 H new ATOM 1245 N THR A 82 -11.120 10.272 3.408 1.00 0.00 N ATOM 1246 CA THR A 82 -11.570 9.140 4.199 1.00 0.00 C ATOM 1247 C THR A 82 -10.480 8.070 4.268 1.00 0.00 C ATOM 1248 O THR A 82 -9.663 8.068 5.189 1.00 0.00 O ATOM 1249 CB THR A 82 -12.882 8.633 3.596 1.00 0.00 C ATOM 1250 OG1 THR A 82 -12.529 8.254 2.268 1.00 0.00 O ATOM 1251 CG2 THR A 82 -13.909 9.750 3.404 1.00 0.00 C ATOM 0 H THR A 82 -11.387 10.237 2.424 1.00 0.00 H new ATOM 0 HA THR A 82 -11.761 9.431 5.232 1.00 0.00 H new ATOM 0 HB THR A 82 -13.303 7.861 4.240 1.00 0.00 H new ATOM 0 HG1 THR A 82 -11.693 8.696 2.013 1.00 0.00 H new ATOM 0 HG21 THR A 82 -14.821 9.336 2.974 1.00 0.00 H new ATOM 0 HG22 THR A 82 -14.137 10.204 4.368 1.00 0.00 H new ATOM 0 HG23 THR A 82 -13.502 10.507 2.733 1.00 0.00 H new ATOM 1259 N LYS A 83 -10.500 7.185 3.282 1.00 0.00 N ATOM 1260 CA LYS A 83 -9.522 6.112 3.220 1.00 0.00 C ATOM 1261 C LYS A 83 -8.151 6.652 3.632 1.00 0.00 C ATOM 1262 O LYS A 83 -7.578 7.493 2.940 1.00 0.00 O ATOM 1263 CB LYS A 83 -9.534 5.456 1.838 1.00 0.00 C ATOM 1264 CG LYS A 83 -10.386 4.184 1.841 1.00 0.00 C ATOM 1265 CD LYS A 83 -11.850 4.505 2.145 1.00 0.00 C ATOM 1266 CE LYS A 83 -12.783 3.501 1.467 1.00 0.00 C ATOM 1267 NZ LYS A 83 -14.025 4.169 1.017 1.00 0.00 N ATOM 0 H LYS A 83 -11.178 7.189 2.520 1.00 0.00 H new ATOM 0 HA LYS A 83 -9.779 5.322 3.925 1.00 0.00 H new ATOM 0 HB2 LYS A 83 -9.925 6.158 1.102 1.00 0.00 H new ATOM 0 HB3 LYS A 83 -8.514 5.214 1.538 1.00 0.00 H new ATOM 0 HG2 LYS A 83 -10.312 3.690 0.872 1.00 0.00 H new ATOM 0 HG3 LYS A 83 -10.001 3.486 2.585 1.00 0.00 H new ATOM 0 HD2 LYS A 83 -12.013 4.489 3.223 1.00 0.00 H new ATOM 0 HD3 LYS A 83 -12.084 5.513 1.802 1.00 0.00 H new ATOM 0 HE2 LYS A 83 -12.279 3.045 0.615 1.00 0.00 H new ATOM 0 HE3 LYS A 83 -13.027 2.696 2.161 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 -14.647 3.473 0.559 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 -14.513 4.583 1.837 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 -13.789 4.921 0.339 1.00 0.00 H new ATOM 1281 N PRO A 84 -7.652 6.133 4.785 1.00 0.00 N ATOM 1282 CA PRO A 84 -6.359 6.555 5.298 1.00 0.00 C ATOM 1283 C PRO A 84 -5.219 5.936 4.486 1.00 0.00 C ATOM 1284 O PRO A 84 -4.290 6.634 4.083 1.00 0.00 O ATOM 1285 CB PRO A 84 -6.353 6.121 6.754 1.00 0.00 C ATOM 1286 CG PRO A 84 -7.442 5.069 6.881 1.00 0.00 C ATOM 1287 CD PRO A 84 -8.302 5.135 5.629 1.00 0.00 C ATOM 0 HA PRO A 84 -6.205 7.631 5.216 1.00 0.00 H new ATOM 0 HB2 PRO A 84 -5.382 5.714 7.036 1.00 0.00 H new ATOM 0 HB3 PRO A 84 -6.548 6.966 7.414 1.00 0.00 H new ATOM 0 HG2 PRO A 84 -7.004 4.077 6.991 1.00 0.00 H new ATOM 0 HG3 PRO A 84 -8.047 5.251 7.770 1.00 0.00 H new ATOM 0 HD2 PRO A 84 -8.351 4.167 5.131 1.00 0.00 H new ATOM 0 HD3 PRO A 84 -9.326 5.424 5.867 1.00 0.00 H new ATOM 1295 N GLY A 85 -5.328 4.634 4.269 1.00 0.00 N ATOM 1296 CA GLY A 85 -4.319 3.913 3.513 1.00 0.00 C ATOM 1297 C GLY A 85 -4.028 4.611 2.183 1.00 0.00 C ATOM 1298 O GLY A 85 -2.874 4.702 1.764 1.00 0.00 O ATOM 0 H GLY A 85 -6.101 4.059 4.604 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -3.402 3.842 4.099 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.658 2.894 3.327 1.00 0.00 H new ATOM 1302 N LEU A 86 -5.093 5.088 1.556 1.00 0.00 N ATOM 1303 CA LEU A 86 -4.967 5.777 0.282 1.00 0.00 C ATOM 1304 C LEU A 86 -4.206 7.088 0.489 1.00 0.00 C ATOM 1305 O LEU A 86 -3.088 7.245 0.001 1.00 0.00 O ATOM 1306 CB LEU A 86 -6.341 5.958 -0.367 1.00 0.00 C ATOM 1307 CG LEU A 86 -7.080 4.672 -0.742 1.00 0.00 C ATOM 1308 CD1 LEU A 86 -8.498 4.977 -1.228 1.00 0.00 C ATOM 1309 CD2 LEU A 86 -6.285 3.860 -1.766 1.00 0.00 C ATOM 0 H LEU A 86 -6.048 5.011 1.906 1.00 0.00 H new ATOM 0 HA LEU A 86 -4.385 5.179 -0.419 1.00 0.00 H new ATOM 0 HB2 LEU A 86 -6.970 6.530 0.315 1.00 0.00 H new ATOM 0 HB3 LEU A 86 -6.219 6.559 -1.268 1.00 0.00 H new ATOM 0 HG LEU A 86 -7.171 4.057 0.154 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -9.002 4.046 -1.488 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -9.053 5.481 -0.437 1.00 0.00 H new ATOM 0 HD13 LEU A 86 -8.451 5.622 -2.106 1.00 0.00 H new ATOM 0 HD21 LEU A 86 -6.833 2.951 -2.015 1.00 0.00 H new ATOM 0 HD22 LEU A 86 -6.140 4.454 -2.668 1.00 0.00 H new ATOM 0 HD23 LEU A 86 -5.315 3.595 -1.346 1.00 0.00 H new ATOM 1321 N GLN A 87 -4.843 7.996 1.213 1.00 0.00 N ATOM 1322 CA GLN A 87 -4.240 9.289 1.491 1.00 0.00 C ATOM 1323 C GLN A 87 -2.740 9.132 1.742 1.00 0.00 C ATOM 1324 O GLN A 87 -1.922 9.548 0.922 1.00 0.00 O ATOM 1325 CB GLN A 87 -4.927 9.971 2.677 1.00 0.00 C ATOM 1326 CG GLN A 87 -4.462 11.421 2.819 1.00 0.00 C ATOM 1327 CD GLN A 87 -5.657 12.377 2.871 1.00 0.00 C ATOM 1328 OE1 GLN A 87 -6.404 12.426 3.833 1.00 0.00 O ATOM 1329 NE2 GLN A 87 -5.795 13.130 1.782 1.00 0.00 N ATOM 0 H GLN A 87 -5.771 7.862 1.616 1.00 0.00 H new ATOM 0 HA GLN A 87 -4.377 9.927 0.618 1.00 0.00 H new ATOM 0 HB2 GLN A 87 -6.008 9.944 2.541 1.00 0.00 H new ATOM 0 HB3 GLN A 87 -4.707 9.423 3.593 1.00 0.00 H new ATOM 0 HG2 GLN A 87 -3.866 11.529 3.725 1.00 0.00 H new ATOM 0 HG3 GLN A 87 -3.817 11.684 1.980 1.00 0.00 H new ATOM 0 HE21 GLN A 87 -5.133 13.038 1.011 1.00 0.00 H new ATOM 0 HE22 GLN A 87 -6.563 13.799 1.718 1.00 0.00 H new ATOM 1338 N LYS A 88 -2.422 8.531 2.879 1.00 0.00 N ATOM 1339 CA LYS A 88 -1.034 8.314 3.249 1.00 0.00 C ATOM 1340 C LYS A 88 -0.239 7.901 2.008 1.00 0.00 C ATOM 1341 O LYS A 88 0.818 8.465 1.727 1.00 0.00 O ATOM 1342 CB LYS A 88 -0.937 7.313 4.403 1.00 0.00 C ATOM 1343 CG LYS A 88 -0.579 8.019 5.712 1.00 0.00 C ATOM 1344 CD LYS A 88 0.938 8.167 5.858 1.00 0.00 C ATOM 1345 CE LYS A 88 1.402 9.546 5.386 1.00 0.00 C ATOM 1346 NZ LYS A 88 2.255 10.186 6.413 1.00 0.00 N ATOM 0 H LYS A 88 -3.102 8.187 3.557 1.00 0.00 H new ATOM 0 HA LYS A 88 -0.590 9.237 3.621 1.00 0.00 H new ATOM 0 HB2 LYS A 88 -1.886 6.789 4.516 1.00 0.00 H new ATOM 0 HB3 LYS A 88 -0.183 6.560 4.174 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -1.048 9.002 5.739 1.00 0.00 H new ATOM 0 HG3 LYS A 88 -0.976 7.453 6.555 1.00 0.00 H new ATOM 0 HD2 LYS A 88 1.223 8.020 6.900 1.00 0.00 H new ATOM 0 HD3 LYS A 88 1.440 7.392 5.278 1.00 0.00 H new ATOM 0 HE2 LYS A 88 1.957 9.450 4.453 1.00 0.00 H new ATOM 0 HE3 LYS A 88 0.537 10.176 5.179 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 2.124 11.217 6.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 1.989 9.834 7.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 3.252 9.957 6.227 1.00 0.00 H new ATOM 1360 N ALA A 89 -0.777 6.920 1.299 1.00 0.00 N ATOM 1361 CA ALA A 89 -0.130 6.426 0.095 1.00 0.00 C ATOM 1362 C ALA A 89 0.063 7.584 -0.887 1.00 0.00 C ATOM 1363 O ALA A 89 1.157 7.779 -1.413 1.00 0.00 O ATOM 1364 CB ALA A 89 -0.963 5.289 -0.501 1.00 0.00 C ATOM 0 H ALA A 89 -1.653 6.454 1.535 1.00 0.00 H new ATOM 0 HA ALA A 89 0.856 6.022 0.326 1.00 0.00 H new ATOM 0 HB1 ALA A 89 -0.479 4.918 -1.404 1.00 0.00 H new ATOM 0 HB2 ALA A 89 -1.046 4.480 0.225 1.00 0.00 H new ATOM 0 HB3 ALA A 89 -1.958 5.658 -0.749 1.00 0.00 H new ATOM 1370 N SER A 90 -1.017 8.320 -1.104 1.00 0.00 N ATOM 1371 CA SER A 90 -0.979 9.453 -2.013 1.00 0.00 C ATOM 1372 C SER A 90 0.065 10.468 -1.542 1.00 0.00 C ATOM 1373 O SER A 90 0.870 10.950 -2.336 1.00 0.00 O ATOM 1374 CB SER A 90 -2.354 10.117 -2.123 1.00 0.00 C ATOM 1375 OG SER A 90 -2.922 9.955 -3.419 1.00 0.00 O ATOM 0 H SER A 90 -1.923 8.154 -0.666 1.00 0.00 H new ATOM 0 HA SER A 90 -0.701 9.089 -3.002 1.00 0.00 H new ATOM 0 HB2 SER A 90 -3.024 9.689 -1.377 1.00 0.00 H new ATOM 0 HB3 SER A 90 -2.263 11.179 -1.897 1.00 0.00 H new ATOM 0 HG SER A 90 -3.799 10.391 -3.448 1.00 0.00 H new ATOM 1381 N ILE A 91 0.016 10.763 -0.251 1.00 0.00 N ATOM 1382 CA ILE A 91 0.947 11.712 0.336 1.00 0.00 C ATOM 1383 C ILE A 91 2.365 11.387 -0.138 1.00 0.00 C ATOM 1384 O ILE A 91 3.077 12.264 -0.623 1.00 0.00 O ATOM 1385 CB ILE A 91 0.798 11.738 1.859 1.00 0.00 C ATOM 1386 CG1 ILE A 91 -0.509 12.418 2.269 1.00 0.00 C ATOM 1387 CG2 ILE A 91 2.015 12.389 2.517 1.00 0.00 C ATOM 1388 CD1 ILE A 91 -0.527 12.709 3.771 1.00 0.00 C ATOM 0 H ILE A 91 -0.654 10.361 0.405 1.00 0.00 H new ATOM 0 HA ILE A 91 0.722 12.724 0.000 1.00 0.00 H new ATOM 0 HB ILE A 91 0.751 10.709 2.217 1.00 0.00 H new ATOM 0 HG12 ILE A 91 -0.629 13.348 1.713 1.00 0.00 H new ATOM 0 HG13 ILE A 91 -1.353 11.779 2.008 1.00 0.00 H new ATOM 0 HG21 ILE A 91 1.884 12.395 3.599 1.00 0.00 H new ATOM 0 HG22 ILE A 91 2.912 11.824 2.263 1.00 0.00 H new ATOM 0 HG23 ILE A 91 2.118 13.413 2.158 1.00 0.00 H new ATOM 0 HD11 ILE A 91 -1.467 13.193 4.037 1.00 0.00 H new ATOM 0 HD12 ILE A 91 -0.431 11.775 4.324 1.00 0.00 H new ATOM 0 HD13 ILE A 91 0.304 13.367 4.024 1.00 0.00 H new ATOM 1400 N PHE A 92 2.732 10.124 0.019 1.00 0.00 N ATOM 1401 CA PHE A 92 4.052 9.672 -0.386 1.00 0.00 C ATOM 1402 C PHE A 92 4.221 9.762 -1.904 1.00 0.00 C ATOM 1403 O PHE A 92 5.338 9.693 -2.413 1.00 0.00 O ATOM 1404 CB PHE A 92 4.176 8.208 0.042 1.00 0.00 C ATOM 1405 CG PHE A 92 5.380 7.483 -0.561 1.00 0.00 C ATOM 1406 CD1 PHE A 92 6.616 7.650 -0.019 1.00 0.00 C ATOM 1407 CD2 PHE A 92 5.213 6.670 -1.638 1.00 0.00 C ATOM 1408 CE1 PHE A 92 7.734 6.976 -0.581 1.00 0.00 C ATOM 1409 CE2 PHE A 92 6.331 5.997 -2.200 1.00 0.00 C ATOM 1410 CZ PHE A 92 7.568 6.164 -1.658 1.00 0.00 C ATOM 0 H PHE A 92 2.138 9.399 0.421 1.00 0.00 H new ATOM 0 HA PHE A 92 4.816 10.297 0.076 1.00 0.00 H new ATOM 0 HB2 PHE A 92 4.245 8.163 1.129 1.00 0.00 H new ATOM 0 HB3 PHE A 92 3.267 7.679 -0.242 1.00 0.00 H new ATOM 0 HD1 PHE A 92 6.748 8.294 0.838 1.00 0.00 H new ATOM 0 HD2 PHE A 92 4.231 6.536 -2.066 1.00 0.00 H new ATOM 0 HE1 PHE A 92 8.716 7.109 -0.152 1.00 0.00 H new ATOM 0 HE2 PHE A 92 6.199 5.353 -3.057 1.00 0.00 H new ATOM 0 HZ PHE A 92 8.418 5.651 -2.084 1.00 0.00 H new ATOM 1420 N LEU A 93 3.094 9.916 -2.584 1.00 0.00 N ATOM 1421 CA LEU A 93 3.103 10.016 -4.034 1.00 0.00 C ATOM 1422 C LEU A 93 3.253 11.485 -4.438 1.00 0.00 C ATOM 1423 O LEU A 93 3.481 11.790 -5.608 1.00 0.00 O ATOM 1424 CB LEU A 93 1.865 9.339 -4.625 1.00 0.00 C ATOM 1425 CG LEU A 93 1.835 7.812 -4.547 1.00 0.00 C ATOM 1426 CD1 LEU A 93 0.924 7.226 -5.628 1.00 0.00 C ATOM 1427 CD2 LEU A 93 3.248 7.231 -4.613 1.00 0.00 C ATOM 0 H LEU A 93 2.169 9.974 -2.158 1.00 0.00 H new ATOM 0 HA LEU A 93 3.958 9.482 -4.448 1.00 0.00 H new ATOM 0 HB2 LEU A 93 0.984 9.727 -4.113 1.00 0.00 H new ATOM 0 HB3 LEU A 93 1.780 9.631 -5.672 1.00 0.00 H new ATOM 0 HG LEU A 93 1.415 7.528 -3.582 1.00 0.00 H new ATOM 0 HD11 LEU A 93 0.920 6.139 -5.551 1.00 0.00 H new ATOM 0 HD12 LEU A 93 -0.090 7.603 -5.493 1.00 0.00 H new ATOM 0 HD13 LEU A 93 1.292 7.518 -6.612 1.00 0.00 H new ATOM 0 HD21 LEU A 93 3.197 6.144 -4.555 1.00 0.00 H new ATOM 0 HD22 LEU A 93 3.718 7.523 -5.552 1.00 0.00 H new ATOM 0 HD23 LEU A 93 3.837 7.611 -3.779 1.00 0.00 H new ATOM 1439 N LYS A 94 3.118 12.354 -3.448 1.00 0.00 N ATOM 1440 CA LYS A 94 3.236 13.783 -3.685 1.00 0.00 C ATOM 1441 C LYS A 94 4.460 14.321 -2.939 1.00 0.00 C ATOM 1442 O LYS A 94 5.220 15.121 -3.483 1.00 0.00 O ATOM 1443 CB LYS A 94 1.932 14.496 -3.322 1.00 0.00 C ATOM 1444 CG LYS A 94 0.935 13.526 -2.686 1.00 0.00 C ATOM 1445 CD LYS A 94 -0.299 14.267 -2.169 1.00 0.00 C ATOM 1446 CE LYS A 94 -0.815 15.264 -3.208 1.00 0.00 C ATOM 1447 NZ LYS A 94 -1.999 15.985 -2.692 1.00 0.00 N ATOM 0 H LYS A 94 2.928 12.097 -2.479 1.00 0.00 H new ATOM 0 HA LYS A 94 3.396 13.981 -4.745 1.00 0.00 H new ATOM 0 HB2 LYS A 94 2.140 15.313 -2.632 1.00 0.00 H new ATOM 0 HB3 LYS A 94 1.494 14.938 -4.217 1.00 0.00 H new ATOM 0 HG2 LYS A 94 0.633 12.777 -3.418 1.00 0.00 H new ATOM 0 HG3 LYS A 94 1.414 12.993 -1.865 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -1.083 13.550 -1.927 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -0.052 14.793 -1.247 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -0.029 15.976 -3.459 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -1.074 14.739 -4.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -2.336 16.658 -3.410 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -2.754 15.303 -2.475 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -1.741 16.502 -1.827 1.00 0.00 H new ATOM 1461 N THR A 95 4.612 13.859 -1.707 1.00 0.00 N ATOM 1462 CA THR A 95 5.729 14.283 -0.882 1.00 0.00 C ATOM 1463 C THR A 95 6.970 13.445 -1.192 1.00 0.00 C ATOM 1464 O THR A 95 8.086 13.960 -1.202 1.00 0.00 O ATOM 1465 CB THR A 95 5.293 14.205 0.583 1.00 0.00 C ATOM 1466 OG1 THR A 95 4.995 12.825 0.782 1.00 0.00 O ATOM 1467 CG2 THR A 95 3.960 14.914 0.836 1.00 0.00 C ATOM 0 H THR A 95 3.980 13.195 -1.260 1.00 0.00 H new ATOM 0 HA THR A 95 6.010 15.314 -1.098 1.00 0.00 H new ATOM 0 HB THR A 95 6.064 14.645 1.216 1.00 0.00 H new ATOM 0 HG1 THR A 95 4.096 12.632 0.443 1.00 0.00 H new ATOM 0 HG21 THR A 95 3.697 14.829 1.890 1.00 0.00 H new ATOM 0 HG22 THR A 95 4.051 15.967 0.569 1.00 0.00 H new ATOM 0 HG23 THR A 95 3.181 14.452 0.229 1.00 0.00 H new ATOM 1475 N ARG A 96 6.733 12.164 -1.437 1.00 0.00 N ATOM 1476 CA ARG A 96 7.818 11.248 -1.746 1.00 0.00 C ATOM 1477 C ARG A 96 8.769 11.131 -0.554 1.00 0.00 C ATOM 1478 O ARG A 96 9.988 11.192 -0.720 1.00 0.00 O ATOM 1479 CB ARG A 96 8.602 11.717 -2.973 1.00 0.00 C ATOM 1480 CG ARG A 96 7.662 12.017 -4.143 1.00 0.00 C ATOM 1481 CD ARG A 96 7.104 10.726 -4.743 1.00 0.00 C ATOM 1482 NE ARG A 96 8.080 10.145 -5.691 1.00 0.00 N ATOM 1483 CZ ARG A 96 8.094 8.857 -6.061 1.00 0.00 C ATOM 1484 NH1 ARG A 96 7.183 8.008 -5.564 1.00 0.00 N ATOM 1485 NH2 ARG A 96 9.017 8.417 -6.927 1.00 0.00 N ATOM 0 H ARG A 96 5.806 11.739 -1.428 1.00 0.00 H new ATOM 0 HA ARG A 96 7.379 10.274 -1.961 1.00 0.00 H new ATOM 0 HB2 ARG A 96 9.174 12.610 -2.724 1.00 0.00 H new ATOM 0 HB3 ARG A 96 9.319 10.950 -3.266 1.00 0.00 H new ATOM 0 HG2 ARG A 96 6.841 12.648 -3.802 1.00 0.00 H new ATOM 0 HG3 ARG A 96 8.197 12.577 -4.910 1.00 0.00 H new ATOM 0 HD2 ARG A 96 6.886 10.011 -3.950 1.00 0.00 H new ATOM 0 HD3 ARG A 96 6.164 10.930 -5.256 1.00 0.00 H new ATOM 0 HE ARG A 96 8.787 10.764 -6.088 1.00 0.00 H new ATOM 0 HH11 ARG A 96 6.480 8.343 -4.905 1.00 0.00 H new ATOM 0 HH12 ARG A 96 7.193 7.028 -5.845 1.00 0.00 H new ATOM 0 HH21 ARG A 96 9.710 9.063 -7.305 1.00 0.00 H new ATOM 0 HH22 ARG A 96 9.027 7.436 -7.208 1.00 0.00 H new ATOM 1499 N VAL A 97 8.179 10.965 0.620 1.00 0.00 N ATOM 1500 CA VAL A 97 8.960 10.838 1.839 1.00 0.00 C ATOM 1501 C VAL A 97 8.072 10.282 2.953 1.00 0.00 C ATOM 1502 O VAL A 97 7.218 10.990 3.484 1.00 0.00 O ATOM 1503 CB VAL A 97 9.594 12.184 2.196 1.00 0.00 C ATOM 1504 CG1 VAL A 97 8.522 13.225 2.526 1.00 0.00 C ATOM 1505 CG2 VAL A 97 10.586 12.034 3.352 1.00 0.00 C ATOM 0 H VAL A 97 7.169 10.915 0.753 1.00 0.00 H new ATOM 0 HA VAL A 97 9.780 10.135 1.696 1.00 0.00 H new ATOM 0 HB VAL A 97 10.146 12.536 1.324 1.00 0.00 H new ATOM 0 HG11 VAL A 97 9.000 14.172 2.776 1.00 0.00 H new ATOM 0 HG12 VAL A 97 7.871 13.364 1.663 1.00 0.00 H new ATOM 0 HG13 VAL A 97 7.930 12.882 3.375 1.00 0.00 H new ATOM 0 HG21 VAL A 97 11.022 13.005 3.586 1.00 0.00 H new ATOM 0 HG22 VAL A 97 10.067 11.649 4.230 1.00 0.00 H new ATOM 0 HG23 VAL A 97 11.377 11.341 3.065 1.00 0.00 H new ATOM 1515 N VAL A 98 8.303 9.017 3.274 1.00 0.00 N ATOM 1516 CA VAL A 98 7.534 8.357 4.315 1.00 0.00 C ATOM 1517 C VAL A 98 7.777 9.065 5.650 1.00 0.00 C ATOM 1518 O VAL A 98 8.738 9.820 5.789 1.00 0.00 O ATOM 1519 CB VAL A 98 7.880 6.867 4.357 1.00 0.00 C ATOM 1520 CG1 VAL A 98 7.000 6.072 3.391 1.00 0.00 C ATOM 1521 CG2 VAL A 98 9.364 6.641 4.060 1.00 0.00 C ATOM 0 H VAL A 98 9.012 8.432 2.831 1.00 0.00 H new ATOM 0 HA VAL A 98 6.467 8.423 4.101 1.00 0.00 H new ATOM 0 HB VAL A 98 7.681 6.505 5.366 1.00 0.00 H new ATOM 0 HG11 VAL A 98 7.267 5.016 3.441 1.00 0.00 H new ATOM 0 HG12 VAL A 98 5.953 6.195 3.667 1.00 0.00 H new ATOM 0 HG13 VAL A 98 7.152 6.437 2.375 1.00 0.00 H new ATOM 0 HG21 VAL A 98 9.584 5.574 4.096 1.00 0.00 H new ATOM 0 HG22 VAL A 98 9.599 7.027 3.068 1.00 0.00 H new ATOM 0 HG23 VAL A 98 9.967 7.161 4.804 1.00 0.00 H new ATOM 1531 N PRO A 99 6.867 8.788 6.622 1.00 0.00 N ATOM 1532 CA PRO A 99 6.973 9.390 7.940 1.00 0.00 C ATOM 1533 C PRO A 99 8.093 8.735 8.753 1.00 0.00 C ATOM 1534 O PRO A 99 8.360 7.544 8.600 1.00 0.00 O ATOM 1535 CB PRO A 99 5.601 9.209 8.567 1.00 0.00 C ATOM 1536 CG PRO A 99 4.919 8.111 7.768 1.00 0.00 C ATOM 1537 CD PRO A 99 5.717 7.898 6.492 1.00 0.00 C ATOM 0 HA PRO A 99 7.242 10.446 7.900 1.00 0.00 H new ATOM 0 HB2 PRO A 99 5.685 8.932 9.618 1.00 0.00 H new ATOM 0 HB3 PRO A 99 5.028 10.135 8.526 1.00 0.00 H new ATOM 0 HG2 PRO A 99 4.873 7.189 8.348 1.00 0.00 H new ATOM 0 HG3 PRO A 99 3.892 8.391 7.534 1.00 0.00 H new ATOM 0 HD2 PRO A 99 6.030 6.859 6.389 1.00 0.00 H new ATOM 0 HD3 PRO A 99 5.125 8.141 5.609 1.00 0.00 H new ATOM 1545 N ASP A 100 8.715 9.541 9.599 1.00 0.00 N ATOM 1546 CA ASP A 100 9.799 9.056 10.436 1.00 0.00 C ATOM 1547 C ASP A 100 9.378 7.741 11.096 1.00 0.00 C ATOM 1548 O ASP A 100 10.224 6.919 11.445 1.00 0.00 O ATOM 1549 CB ASP A 100 10.130 10.056 11.545 1.00 0.00 C ATOM 1550 CG ASP A 100 11.405 10.871 11.322 1.00 0.00 C ATOM 1551 OD1 ASP A 100 12.488 10.324 11.624 1.00 0.00 O ATOM 1552 OD2 ASP A 100 11.269 12.022 10.855 1.00 0.00 O ATOM 0 H ASP A 100 8.489 10.528 9.723 1.00 0.00 H new ATOM 0 HA ASP A 100 10.676 8.916 9.804 1.00 0.00 H new ATOM 0 HB2 ASP A 100 9.292 10.744 11.655 1.00 0.00 H new ATOM 0 HB3 ASP A 100 10.223 9.514 12.486 1.00 0.00 H new ATOM 1557 N ASN A 101 8.071 7.584 11.246 1.00 0.00 N ATOM 1558 CA ASN A 101 7.528 6.383 11.859 1.00 0.00 C ATOM 1559 C ASN A 101 7.970 5.160 11.053 1.00 0.00 C ATOM 1560 O ASN A 101 8.201 4.091 11.616 1.00 0.00 O ATOM 1561 CB ASN A 101 5.998 6.414 11.868 1.00 0.00 C ATOM 1562 CG ASN A 101 5.429 5.203 12.610 1.00 0.00 C ATOM 1563 OD1 ASN A 101 6.016 4.685 13.546 1.00 0.00 O ATOM 1564 ND2 ASN A 101 4.259 4.781 12.141 1.00 0.00 N ATOM 0 H ASN A 101 7.373 8.268 10.954 1.00 0.00 H new ATOM 0 HA ASN A 101 7.895 6.332 12.884 1.00 0.00 H new ATOM 0 HB2 ASN A 101 5.652 7.332 12.344 1.00 0.00 H new ATOM 0 HB3 ASN A 101 5.625 6.426 10.844 1.00 0.00 H new ATOM 0 HD21 ASN A 101 3.798 3.978 12.568 1.00 0.00 H new ATOM 0 HD22 ASN A 101 3.822 5.261 11.354 1.00 0.00 H new ATOM 1571 N TRP A 102 8.076 5.358 9.747 1.00 0.00 N ATOM 1572 CA TRP A 102 8.487 4.285 8.858 1.00 0.00 C ATOM 1573 C TRP A 102 10.006 4.139 8.965 1.00 0.00 C ATOM 1574 O TRP A 102 10.507 3.074 9.322 1.00 0.00 O ATOM 1575 CB TRP A 102 8.010 4.543 7.428 1.00 0.00 C ATOM 1576 CG TRP A 102 6.489 4.501 7.262 1.00 0.00 C ATOM 1577 CD1 TRP A 102 5.552 4.889 8.138 1.00 0.00 C ATOM 1578 CD2 TRP A 102 5.763 4.025 6.108 1.00 0.00 C ATOM 1579 NE1 TRP A 102 4.280 4.700 7.635 1.00 0.00 N ATOM 1580 CE2 TRP A 102 4.413 4.158 6.363 1.00 0.00 C ATOM 1581 CE3 TRP A 102 6.232 3.501 4.891 1.00 0.00 C ATOM 1582 CZ2 TRP A 102 3.421 3.787 5.447 1.00 0.00 C ATOM 1583 CZ3 TRP A 102 5.228 3.135 3.987 1.00 0.00 C ATOM 1584 CH2 TRP A 102 3.864 3.262 4.227 1.00 0.00 C ATOM 0 H TRP A 102 7.884 6.246 9.283 1.00 0.00 H new ATOM 0 HA TRP A 102 8.025 3.343 9.152 1.00 0.00 H new ATOM 0 HB2 TRP A 102 8.374 5.518 7.105 1.00 0.00 H new ATOM 0 HB3 TRP A 102 8.458 3.801 6.767 1.00 0.00 H new ATOM 0 HD1 TRP A 102 5.765 5.298 9.115 1.00 0.00 H new ATOM 0 HE1 TRP A 102 3.404 4.918 8.110 1.00 0.00 H new ATOM 0 HE3 TRP A 102 7.283 3.390 4.671 1.00 0.00 H new ATOM 0 HZ2 TRP A 102 2.370 3.900 5.670 1.00 0.00 H new ATOM 0 HZ3 TRP A 102 5.534 2.725 3.036 1.00 0.00 H new ATOM 0 HH2 TRP A 102 3.150 2.957 3.476 1.00 0.00 H new ATOM 1595 N LYS A 103 10.696 5.225 8.647 1.00 0.00 N ATOM 1596 CA LYS A 103 12.149 5.231 8.703 1.00 0.00 C ATOM 1597 C LYS A 103 12.700 4.306 7.616 1.00 0.00 C ATOM 1598 O LYS A 103 13.324 3.290 7.919 1.00 0.00 O ATOM 1599 CB LYS A 103 12.632 4.882 10.112 1.00 0.00 C ATOM 1600 CG LYS A 103 13.839 5.736 10.504 1.00 0.00 C ATOM 1601 CD LYS A 103 15.097 4.878 10.646 1.00 0.00 C ATOM 1602 CE LYS A 103 16.354 5.748 10.679 1.00 0.00 C ATOM 1603 NZ LYS A 103 16.758 6.129 9.306 1.00 0.00 N ATOM 0 H LYS A 103 10.277 6.106 8.350 1.00 0.00 H new ATOM 0 HA LYS A 103 12.535 6.230 8.498 1.00 0.00 H new ATOM 0 HB2 LYS A 103 11.824 5.038 10.827 1.00 0.00 H new ATOM 0 HB3 LYS A 103 12.899 3.826 10.158 1.00 0.00 H new ATOM 0 HG2 LYS A 103 14.003 6.506 9.751 1.00 0.00 H new ATOM 0 HG3 LYS A 103 13.636 6.248 11.445 1.00 0.00 H new ATOM 0 HD2 LYS A 103 15.036 4.286 11.559 1.00 0.00 H new ATOM 0 HD3 LYS A 103 15.158 4.176 9.814 1.00 0.00 H new ATOM 0 HE2 LYS A 103 16.168 6.644 11.271 1.00 0.00 H new ATOM 0 HE3 LYS A 103 17.165 5.207 11.166 1.00 0.00 H new ATOM 0 HZ1 LYS A 103 17.613 6.719 9.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 103 16.956 5.271 8.752 1.00 0.00 H new ATOM 0 HZ3 LYS A 103 15.989 6.664 8.854 1.00 0.00 H new ATOM 1617 N MET A 104 12.448 4.690 6.374 1.00 0.00 N ATOM 1618 CA MET A 104 12.912 3.908 5.240 1.00 0.00 C ATOM 1619 C MET A 104 14.424 4.051 5.056 1.00 0.00 C ATOM 1620 O MET A 104 15.188 3.178 5.466 1.00 0.00 O ATOM 1621 CB MET A 104 12.197 4.375 3.971 1.00 0.00 C ATOM 1622 CG MET A 104 10.911 3.580 3.740 1.00 0.00 C ATOM 1623 SD MET A 104 11.297 1.855 3.484 1.00 0.00 S ATOM 1624 CE MET A 104 9.744 1.116 3.956 1.00 0.00 C ATOM 0 H MET A 104 11.928 5.532 6.127 1.00 0.00 H new ATOM 0 HA MET A 104 12.686 2.859 5.430 1.00 0.00 H new ATOM 0 HB2 MET A 104 11.963 5.436 4.052 1.00 0.00 H new ATOM 0 HB3 MET A 104 12.859 4.259 3.113 1.00 0.00 H new ATOM 0 HG2 MET A 104 10.247 3.689 4.598 1.00 0.00 H new ATOM 0 HG3 MET A 104 10.380 3.975 2.874 1.00 0.00 H new ATOM 0 HE1 MET A 104 9.924 0.122 4.367 1.00 0.00 H new ATOM 0 HE2 MET A 104 9.259 1.738 4.709 1.00 0.00 H new ATOM 0 HE3 MET A 104 9.099 1.036 3.081 1.00 0.00 H new ATOM 1634 N ASP A 105 14.811 5.158 4.441 1.00 0.00 N ATOM 1635 CA ASP A 105 16.219 5.426 4.199 1.00 0.00 C ATOM 1636 C ASP A 105 16.763 4.407 3.196 1.00 0.00 C ATOM 1637 O ASP A 105 17.932 4.032 3.260 1.00 0.00 O ATOM 1638 CB ASP A 105 17.033 5.302 5.488 1.00 0.00 C ATOM 1639 CG ASP A 105 18.277 6.192 5.556 1.00 0.00 C ATOM 1640 OD1 ASP A 105 18.152 7.372 5.163 1.00 0.00 O ATOM 1641 OD2 ASP A 105 19.323 5.672 5.999 1.00 0.00 O ATOM 0 H ASP A 105 14.175 5.880 4.103 1.00 0.00 H new ATOM 0 HA ASP A 105 16.307 6.442 3.813 1.00 0.00 H new ATOM 0 HB2 ASP A 105 16.387 5.542 6.332 1.00 0.00 H new ATOM 0 HB3 ASP A 105 17.341 4.263 5.607 1.00 0.00 H new ATOM 1646 N ILE A 106 15.888 3.988 2.294 1.00 0.00 N ATOM 1647 CA ILE A 106 16.266 3.018 1.279 1.00 0.00 C ATOM 1648 C ILE A 106 16.983 3.738 0.135 1.00 0.00 C ATOM 1649 O ILE A 106 17.779 3.133 -0.582 1.00 0.00 O ATOM 1650 CB ILE A 106 15.047 2.210 0.829 1.00 0.00 C ATOM 1651 CG1 ILE A 106 15.447 1.127 -0.175 1.00 0.00 C ATOM 1652 CG2 ILE A 106 13.954 3.128 0.278 1.00 0.00 C ATOM 1653 CD1 ILE A 106 14.770 -0.205 0.156 1.00 0.00 C ATOM 0 H ILE A 106 14.919 4.302 2.244 1.00 0.00 H new ATOM 0 HA ILE A 106 16.967 2.291 1.689 1.00 0.00 H new ATOM 0 HB ILE A 106 14.632 1.703 1.700 1.00 0.00 H new ATOM 0 HG12 ILE A 106 15.170 1.439 -1.182 1.00 0.00 H new ATOM 0 HG13 ILE A 106 16.530 1.001 -0.167 1.00 0.00 H new ATOM 0 HG21 ILE A 106 13.099 2.529 -0.035 1.00 0.00 H new ATOM 0 HG22 ILE A 106 13.642 3.828 1.053 1.00 0.00 H new ATOM 0 HG23 ILE A 106 14.341 3.682 -0.577 1.00 0.00 H new ATOM 0 HD11 ILE A 106 15.071 -0.957 -0.573 1.00 0.00 H new ATOM 0 HD12 ILE A 106 15.068 -0.527 1.154 1.00 0.00 H new ATOM 0 HD13 ILE A 106 13.688 -0.081 0.123 1.00 0.00 H new ATOM 1665 N SER A 107 16.674 5.019 -0.002 1.00 0.00 N ATOM 1666 CA SER A 107 17.279 5.828 -1.047 1.00 0.00 C ATOM 1667 C SER A 107 18.794 5.896 -0.844 1.00 0.00 C ATOM 1668 O SER A 107 19.533 6.227 -1.771 1.00 0.00 O ATOM 1669 CB SER A 107 16.682 7.236 -1.068 1.00 0.00 C ATOM 1670 OG SER A 107 15.269 7.214 -1.249 1.00 0.00 O ATOM 0 H SER A 107 16.012 5.517 0.593 1.00 0.00 H new ATOM 0 HA SER A 107 17.068 5.359 -2.008 1.00 0.00 H new ATOM 0 HB2 SER A 107 16.920 7.745 -0.134 1.00 0.00 H new ATOM 0 HB3 SER A 107 17.141 7.813 -1.871 1.00 0.00 H new ATOM 0 HG SER A 107 14.926 8.132 -1.255 1.00 0.00 H new ATOM 1676 N GLU A 108 19.211 5.578 0.372 1.00 0.00 N ATOM 1677 CA GLU A 108 20.625 5.599 0.708 1.00 0.00 C ATOM 1678 C GLU A 108 21.265 4.245 0.392 1.00 0.00 C ATOM 1679 O GLU A 108 22.471 4.163 0.165 1.00 0.00 O ATOM 1680 CB GLU A 108 20.835 5.976 2.176 1.00 0.00 C ATOM 1681 CG GLU A 108 20.391 7.416 2.440 1.00 0.00 C ATOM 1682 CD GLU A 108 21.451 8.413 1.965 1.00 0.00 C ATOM 1683 OE1 GLU A 108 22.647 8.101 2.152 1.00 0.00 O ATOM 1684 OE2 GLU A 108 21.040 9.464 1.427 1.00 0.00 O ATOM 0 H GLU A 108 18.595 5.304 1.137 1.00 0.00 H new ATOM 0 HA GLU A 108 21.112 6.361 0.099 1.00 0.00 H new ATOM 0 HB2 GLU A 108 20.272 5.295 2.814 1.00 0.00 H new ATOM 0 HB3 GLU A 108 21.887 5.862 2.438 1.00 0.00 H new ATOM 0 HG2 GLU A 108 19.449 7.610 1.927 1.00 0.00 H new ATOM 0 HG3 GLU A 108 20.208 7.554 3.506 1.00 0.00 H new ATOM 1691 N ILE A 109 20.429 3.218 0.389 1.00 0.00 N ATOM 1692 CA ILE A 109 20.900 1.872 0.105 1.00 0.00 C ATOM 1693 C ILE A 109 21.412 1.808 -1.335 1.00 0.00 C ATOM 1694 O ILE A 109 22.251 0.971 -1.663 1.00 0.00 O ATOM 1695 CB ILE A 109 19.807 0.847 0.415 1.00 0.00 C ATOM 1696 CG1 ILE A 109 19.423 0.885 1.897 1.00 0.00 C ATOM 1697 CG2 ILE A 109 20.228 -0.555 -0.031 1.00 0.00 C ATOM 1698 CD1 ILE A 109 18.221 -0.019 2.175 1.00 0.00 C ATOM 0 H ILE A 109 19.429 3.290 0.578 1.00 0.00 H new ATOM 0 HA ILE A 109 21.739 1.617 0.753 1.00 0.00 H new ATOM 0 HB ILE A 109 18.917 1.114 -0.156 1.00 0.00 H new ATOM 0 HG12 ILE A 109 20.270 0.566 2.504 1.00 0.00 H new ATOM 0 HG13 ILE A 109 19.188 1.908 2.189 1.00 0.00 H new ATOM 0 HG21 ILE A 109 19.434 -1.264 0.201 1.00 0.00 H new ATOM 0 HG22 ILE A 109 20.412 -0.555 -1.105 1.00 0.00 H new ATOM 0 HG23 ILE A 109 21.138 -0.846 0.493 1.00 0.00 H new ATOM 0 HD11 ILE A 109 17.969 0.026 3.235 1.00 0.00 H new ATOM 0 HD12 ILE A 109 17.369 0.317 1.585 1.00 0.00 H new ATOM 0 HD13 ILE A 109 18.468 -1.046 1.904 1.00 0.00 H new ATOM 1710 N LEU A 110 20.885 2.704 -2.157 1.00 0.00 N ATOM 1711 CA LEU A 110 21.277 2.759 -3.555 1.00 0.00 C ATOM 1712 C LEU A 110 21.951 4.104 -3.837 1.00 0.00 C ATOM 1713 O LEU A 110 23.166 4.167 -4.017 1.00 0.00 O ATOM 1714 CB LEU A 110 20.078 2.470 -4.460 1.00 0.00 C ATOM 1715 CG LEU A 110 19.558 1.031 -4.446 1.00 0.00 C ATOM 1716 CD1 LEU A 110 18.037 0.997 -4.603 1.00 0.00 C ATOM 1717 CD2 LEU A 110 20.263 0.182 -5.505 1.00 0.00 C ATOM 0 H LEU A 110 20.190 3.398 -1.881 1.00 0.00 H new ATOM 0 HA LEU A 110 22.008 1.982 -3.777 1.00 0.00 H new ATOM 0 HB2 LEU A 110 19.262 3.133 -4.171 1.00 0.00 H new ATOM 0 HB3 LEU A 110 20.351 2.727 -5.484 1.00 0.00 H new ATOM 0 HG LEU A 110 19.792 0.593 -3.476 1.00 0.00 H new ATOM 0 HD11 LEU A 110 17.693 -0.037 -4.590 1.00 0.00 H new ATOM 0 HD12 LEU A 110 17.574 1.544 -3.782 1.00 0.00 H new ATOM 0 HD13 LEU A 110 17.758 1.460 -5.550 1.00 0.00 H new ATOM 0 HD21 LEU A 110 19.874 -0.836 -5.473 1.00 0.00 H new ATOM 0 HD22 LEU A 110 20.083 0.608 -6.492 1.00 0.00 H new ATOM 0 HD23 LEU A 110 21.335 0.168 -5.306 1.00 0.00 H new ATOM 1729 N GLU A 111 21.132 5.145 -3.868 1.00 0.00 N ATOM 1730 CA GLU A 111 21.634 6.484 -4.126 1.00 0.00 C ATOM 1731 C GLU A 111 22.305 6.545 -5.499 1.00 0.00 C ATOM 1732 O GLU A 111 23.530 6.507 -5.597 1.00 0.00 O ATOM 1733 CB GLU A 111 22.597 6.930 -3.024 1.00 0.00 C ATOM 1734 CG GLU A 111 23.070 8.366 -3.258 1.00 0.00 C ATOM 1735 CD GLU A 111 24.575 8.496 -3.010 1.00 0.00 C ATOM 1736 OE1 GLU A 111 24.987 8.211 -1.864 1.00 0.00 O ATOM 1737 OE2 GLU A 111 25.278 8.874 -3.971 1.00 0.00 O ATOM 0 H GLU A 111 20.125 5.088 -3.719 1.00 0.00 H new ATOM 0 HA GLU A 111 20.790 7.173 -4.126 1.00 0.00 H new ATOM 0 HB2 GLU A 111 22.104 6.859 -2.054 1.00 0.00 H new ATOM 0 HB3 GLU A 111 23.457 6.260 -2.994 1.00 0.00 H new ATOM 0 HG2 GLU A 111 22.839 8.667 -4.280 1.00 0.00 H new ATOM 0 HG3 GLU A 111 22.529 9.043 -2.597 1.00 0.00 H new ATOM 1744 N SER A 112 21.473 6.637 -6.526 1.00 0.00 N ATOM 1745 CA SER A 112 21.970 6.703 -7.890 1.00 0.00 C ATOM 1746 C SER A 112 22.715 5.413 -8.238 1.00 0.00 C ATOM 1747 O SER A 112 23.659 5.031 -7.548 1.00 0.00 O ATOM 1748 CB SER A 112 22.886 7.912 -8.084 1.00 0.00 C ATOM 1749 OG SER A 112 22.158 9.137 -8.094 1.00 0.00 O ATOM 0 H SER A 112 20.457 6.667 -6.441 1.00 0.00 H new ATOM 0 HA SER A 112 21.117 6.815 -8.560 1.00 0.00 H new ATOM 0 HB2 SER A 112 23.627 7.937 -7.285 1.00 0.00 H new ATOM 0 HB3 SER A 112 23.432 7.807 -9.022 1.00 0.00 H new ATOM 0 HG SER A 112 22.778 9.885 -8.218 1.00 0.00 H new ATOM 1755 N GLY A 113 22.261 4.775 -9.307 1.00 0.00 N ATOM 1756 CA GLY A 113 22.872 3.535 -9.755 1.00 0.00 C ATOM 1757 C GLY A 113 22.073 2.913 -10.901 1.00 0.00 C ATOM 1758 O GLY A 113 21.361 3.613 -11.619 1.00 0.00 O ATOM 0 H GLY A 113 21.477 5.094 -9.876 1.00 0.00 H new ATOM 0 HA2 GLY A 113 23.894 3.726 -10.082 1.00 0.00 H new ATOM 0 HA3 GLY A 113 22.929 2.832 -8.924 1.00 0.00 H new ATOM 1762 N PRO A 114 22.220 1.567 -11.041 1.00 0.00 N ATOM 1763 CA PRO A 114 21.520 0.842 -12.087 1.00 0.00 C ATOM 1764 C PRO A 114 20.039 0.679 -11.744 1.00 0.00 C ATOM 1765 O PRO A 114 19.585 1.142 -10.698 1.00 0.00 O ATOM 1766 CB PRO A 114 22.252 -0.485 -12.204 1.00 0.00 C ATOM 1767 CG PRO A 114 23.037 -0.642 -10.912 1.00 0.00 C ATOM 1768 CD PRO A 114 23.055 0.705 -10.209 1.00 0.00 C ATOM 0 HA PRO A 114 21.526 1.370 -13.040 1.00 0.00 H new ATOM 0 HB2 PRO A 114 21.550 -1.308 -12.337 1.00 0.00 H new ATOM 0 HB3 PRO A 114 22.916 -0.490 -13.068 1.00 0.00 H new ATOM 0 HG2 PRO A 114 22.577 -1.398 -10.276 1.00 0.00 H new ATOM 0 HG3 PRO A 114 24.053 -0.977 -11.121 1.00 0.00 H new ATOM 0 HD2 PRO A 114 22.660 0.629 -9.196 1.00 0.00 H new ATOM 0 HD3 PRO A 114 24.069 1.096 -10.127 1.00 0.00 H new ATOM 1776 N SER A 115 19.324 0.019 -12.643 1.00 0.00 N ATOM 1777 CA SER A 115 17.902 -0.211 -12.449 1.00 0.00 C ATOM 1778 C SER A 115 17.565 -1.674 -12.746 1.00 0.00 C ATOM 1779 O SER A 115 18.122 -2.269 -13.665 1.00 0.00 O ATOM 1780 CB SER A 115 17.068 0.717 -13.334 1.00 0.00 C ATOM 1781 OG SER A 115 15.672 0.584 -13.080 1.00 0.00 O ATOM 0 H SER A 115 19.703 -0.364 -13.509 1.00 0.00 H new ATOM 0 HA SER A 115 17.658 0.008 -11.410 1.00 0.00 H new ATOM 0 HB2 SER A 115 17.371 1.750 -13.163 1.00 0.00 H new ATOM 0 HB3 SER A 115 17.269 0.495 -14.382 1.00 0.00 H new ATOM 0 HG SER A 115 15.174 1.194 -13.663 1.00 0.00 H new ATOM 1787 N SER A 116 16.651 -2.210 -11.948 1.00 0.00 N ATOM 1788 CA SER A 116 16.231 -3.591 -12.114 1.00 0.00 C ATOM 1789 C SER A 116 15.031 -3.664 -13.059 1.00 0.00 C ATOM 1790 O SER A 116 14.218 -2.741 -13.107 1.00 0.00 O ATOM 1791 CB SER A 116 15.886 -4.226 -10.766 1.00 0.00 C ATOM 1792 OG SER A 116 15.481 -5.586 -10.905 1.00 0.00 O ATOM 0 H SER A 116 16.191 -1.713 -11.186 1.00 0.00 H new ATOM 0 HA SER A 116 17.059 -4.151 -12.548 1.00 0.00 H new ATOM 0 HB2 SER A 116 16.752 -4.171 -10.107 1.00 0.00 H new ATOM 0 HB3 SER A 116 15.087 -3.657 -10.291 1.00 0.00 H new ATOM 0 HG SER A 116 15.271 -5.957 -10.022 1.00 0.00 H new ATOM 1798 N GLY A 117 14.956 -4.768 -13.787 1.00 0.00 N ATOM 1799 CA GLY A 117 13.868 -4.973 -14.727 1.00 0.00 C ATOM 1800 C GLY A 117 14.100 -6.229 -15.569 1.00 0.00 C ATOM 1801 O GLY A 117 13.375 -6.479 -16.530 1.00 0.00 O ATOM 0 H GLY A 117 15.632 -5.531 -13.745 1.00 0.00 H new ATOM 0 HA2 GLY A 117 12.927 -5.063 -14.185 1.00 0.00 H new ATOM 0 HA3 GLY A 117 13.778 -4.105 -15.380 1.00 0.00 H new TER 1805 GLY A 117