USER MOD reduce.3.24.130724 H: found=0, std=0, add=771, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 764 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 14 HIS : no HE2:sc= -0.097 K(o=-0.045,f=-0.55) USER MOD Set 1.2: A 87 GLN : amide:sc= -0.0124 X(o=-0.045,f=-0.021) USER MOD Set 1.3: A 89 ASN : amide:sc= 0.0647 X(o=-0.045,f=-0.26) USER MOD Single : A 1 GLY N :NH3+ 130:sc= 0.0285 (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 8 TYR OH : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 34 GLN : amide:sc= -0.574 K(o=-0.57,f=-1.7) USER MOD Single : A 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 54 HIS : no HD1:sc= -0.107 X(o=-0.11,f=-0.004) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 70 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0.0148 USER MOD Single : A 72 HIS : no HD1:sc= -0.771 X(o=-0.77,f=-1) USER MOD Single : A 74 TYR OH : rot -37:sc= 0.877 USER MOD Single : A 79 MET CE :methyl -154:sc= -0.521 (180deg=-1.28) USER MOD Single : A 80 HIS : no HD1:sc= -0.0132 X(o=-0.013,f=-0.15) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 85 ASN : amide:sc= 0.0615 K(o=0.062,f=-0.74) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 SER OG : rot 180:sc=0.000236 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -4.738 -2.472 19.191 1.00 0.00 N ATOM 2 CA GLY A 1 -5.902 -3.273 19.565 1.00 0.00 C ATOM 3 C GLY A 1 -5.527 -4.735 19.646 1.00 0.00 C ATOM 4 O GLY A 1 -4.736 -5.225 18.840 1.00 0.00 O ATOM 0 H1 GLY A 1 -4.988 -1.844 18.400 1.00 0.00 H new ATOM 0 H2 GLY A 1 -4.435 -1.900 20.005 1.00 0.00 H new ATOM 0 H3 GLY A 1 -3.962 -3.101 18.902 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -6.290 -2.936 20.526 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -6.698 -3.134 18.833 1.00 0.00 H new ATOM 8 N SER A 2 -6.092 -5.413 20.634 1.00 0.00 N ATOM 9 CA SER A 2 -6.042 -6.836 20.885 1.00 0.00 C ATOM 10 C SER A 2 -7.406 -7.092 21.529 1.00 0.00 C ATOM 11 O SER A 2 -7.718 -6.449 22.538 1.00 0.00 O ATOM 12 CB SER A 2 -4.836 -7.126 21.800 1.00 0.00 C ATOM 13 OG SER A 2 -4.463 -8.491 21.788 1.00 0.00 O ATOM 0 H SER A 2 -6.647 -4.932 21.342 1.00 0.00 H new ATOM 0 HA SER A 2 -5.894 -7.483 20.020 1.00 0.00 H new ATOM 0 HB2 SER A 2 -3.989 -6.518 21.483 1.00 0.00 H new ATOM 0 HB3 SER A 2 -5.078 -6.828 22.820 1.00 0.00 H new ATOM 0 HG SER A 2 -3.694 -8.625 22.381 1.00 0.00 H new ATOM 19 N SER A 3 -8.246 -7.940 20.931 1.00 0.00 N ATOM 20 CA SER A 3 -9.683 -8.059 21.207 1.00 0.00 C ATOM 21 C SER A 3 -10.449 -6.755 20.883 1.00 0.00 C ATOM 22 O SER A 3 -9.852 -5.712 20.595 1.00 0.00 O ATOM 23 CB SER A 3 -9.924 -8.520 22.659 1.00 0.00 C ATOM 24 OG SER A 3 -9.055 -9.577 23.055 1.00 0.00 O ATOM 0 H SER A 3 -7.932 -8.591 20.211 1.00 0.00 H new ATOM 0 HA SER A 3 -10.083 -8.824 20.542 1.00 0.00 H new ATOM 0 HB2 SER A 3 -9.788 -7.673 23.331 1.00 0.00 H new ATOM 0 HB3 SER A 3 -10.958 -8.848 22.764 1.00 0.00 H new ATOM 0 HG SER A 3 -9.248 -9.829 23.982 1.00 0.00 H new ATOM 30 N GLY A 4 -11.785 -6.792 20.950 1.00 0.00 N ATOM 31 CA GLY A 4 -12.656 -5.620 20.841 1.00 0.00 C ATOM 32 C GLY A 4 -13.639 -5.783 19.687 1.00 0.00 C ATOM 33 O GLY A 4 -14.608 -6.539 19.812 1.00 0.00 O ATOM 0 H GLY A 4 -12.302 -7.661 21.085 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -13.203 -5.479 21.773 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -12.052 -4.725 20.687 1.00 0.00 H new ATOM 37 N SER A 5 -13.395 -5.119 18.554 1.00 0.00 N ATOM 38 CA SER A 5 -14.124 -5.331 17.301 1.00 0.00 C ATOM 39 C SER A 5 -13.613 -6.582 16.575 1.00 0.00 C ATOM 40 O SER A 5 -13.279 -6.548 15.392 1.00 0.00 O ATOM 41 CB SER A 5 -14.036 -4.084 16.415 1.00 0.00 C ATOM 42 OG SER A 5 -14.971 -3.128 16.871 1.00 0.00 O ATOM 0 H SER A 5 -12.671 -4.405 18.481 1.00 0.00 H new ATOM 0 HA SER A 5 -15.175 -5.500 17.533 1.00 0.00 H new ATOM 0 HB2 SER A 5 -13.028 -3.670 16.447 1.00 0.00 H new ATOM 0 HB3 SER A 5 -14.240 -4.345 15.377 1.00 0.00 H new ATOM 0 HG SER A 5 -14.919 -2.326 16.310 1.00 0.00 H new ATOM 48 N SER A 6 -13.573 -7.711 17.276 1.00 0.00 N ATOM 49 CA SER A 6 -13.378 -9.012 16.659 1.00 0.00 C ATOM 50 C SER A 6 -14.508 -9.254 15.650 1.00 0.00 C ATOM 51 O SER A 6 -15.650 -8.848 15.888 1.00 0.00 O ATOM 52 CB SER A 6 -13.313 -10.051 17.782 1.00 0.00 C ATOM 53 OG SER A 6 -12.216 -9.705 18.614 1.00 0.00 O ATOM 0 H SER A 6 -13.675 -7.746 18.290 1.00 0.00 H new ATOM 0 HA SER A 6 -12.447 -9.078 16.097 1.00 0.00 H new ATOM 0 HB2 SER A 6 -14.241 -10.058 18.353 1.00 0.00 H new ATOM 0 HB3 SER A 6 -13.183 -11.053 17.372 1.00 0.00 H new ATOM 0 HG SER A 6 -12.145 -10.351 19.348 1.00 0.00 H new ATOM 59 N GLY A 7 -14.196 -9.842 14.499 1.00 0.00 N ATOM 60 CA GLY A 7 -15.144 -10.087 13.424 1.00 0.00 C ATOM 61 C GLY A 7 -14.482 -9.939 12.072 1.00 0.00 C ATOM 62 O GLY A 7 -14.268 -10.949 11.404 1.00 0.00 O ATOM 0 H GLY A 7 -13.253 -10.168 14.286 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -15.559 -11.090 13.522 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -15.977 -9.389 13.503 1.00 0.00 H new ATOM 66 N TYR A 8 -14.157 -8.716 11.638 1.00 0.00 N ATOM 67 CA TYR A 8 -13.299 -8.571 10.463 1.00 0.00 C ATOM 68 C TYR A 8 -11.886 -9.001 10.797 1.00 0.00 C ATOM 69 O TYR A 8 -11.496 -9.050 11.966 1.00 0.00 O ATOM 70 CB TYR A 8 -13.319 -7.147 9.886 1.00 0.00 C ATOM 71 CG TYR A 8 -12.608 -6.091 10.670 1.00 0.00 C ATOM 72 CD1 TYR A 8 -13.300 -5.381 11.658 1.00 0.00 C ATOM 73 CD2 TYR A 8 -11.292 -5.759 10.318 1.00 0.00 C ATOM 74 CE1 TYR A 8 -12.631 -4.363 12.357 1.00 0.00 C ATOM 75 CE2 TYR A 8 -10.627 -4.715 10.978 1.00 0.00 C ATOM 76 CZ TYR A 8 -11.291 -4.028 12.029 1.00 0.00 C ATOM 77 OH TYR A 8 -10.676 -3.013 12.697 1.00 0.00 O ATOM 0 H TYR A 8 -14.463 -7.842 12.066 1.00 0.00 H new ATOM 0 HA TYR A 8 -13.698 -9.222 9.686 1.00 0.00 H new ATOM 0 HB2 TYR A 8 -12.884 -7.179 8.887 1.00 0.00 H new ATOM 0 HB3 TYR A 8 -14.359 -6.842 9.771 1.00 0.00 H new ATOM 0 HD1 TYR A 8 -14.332 -5.612 11.879 1.00 0.00 H new ATOM 0 HD2 TYR A 8 -10.789 -6.309 9.536 1.00 0.00 H new ATOM 0 HE1 TYR A 8 -13.139 -3.832 13.149 1.00 0.00 H new ATOM 0 HE2 TYR A 8 -9.624 -4.437 10.691 1.00 0.00 H new ATOM 0 HH TYR A 8 -9.762 -2.906 12.360 1.00 0.00 H new ATOM 87 N LYS A 9 -11.127 -9.277 9.742 1.00 0.00 N ATOM 88 CA LYS A 9 -9.699 -9.504 9.854 1.00 0.00 C ATOM 89 C LYS A 9 -8.968 -8.596 8.895 1.00 0.00 C ATOM 90 O LYS A 9 -9.394 -8.457 7.744 1.00 0.00 O ATOM 91 CB LYS A 9 -9.335 -10.985 9.683 1.00 0.00 C ATOM 92 CG LYS A 9 -9.511 -11.637 8.300 1.00 0.00 C ATOM 93 CD LYS A 9 -10.984 -11.924 7.991 1.00 0.00 C ATOM 94 CE LYS A 9 -11.163 -13.079 7.004 1.00 0.00 C ATOM 95 NZ LYS A 9 -11.035 -12.686 5.588 1.00 0.00 N ATOM 0 H LYS A 9 -11.487 -9.348 8.790 1.00 0.00 H new ATOM 0 HA LYS A 9 -9.376 -9.250 10.864 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -8.291 -11.104 9.973 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -9.931 -11.556 10.395 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -9.100 -10.980 7.533 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -8.943 -12.567 8.261 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -11.507 -12.159 8.918 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -11.447 -11.026 7.582 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -10.424 -13.849 7.224 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -12.145 -13.526 7.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -11.169 -13.521 4.983 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -11.757 -11.973 5.359 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -10.089 -12.286 5.423 1.00 0.00 H new ATOM 109 N GLU A 10 -7.878 -8.020 9.381 1.00 0.00 N ATOM 110 CA GLU A 10 -6.822 -7.443 8.576 1.00 0.00 C ATOM 111 C GLU A 10 -5.910 -8.601 8.172 1.00 0.00 C ATOM 112 O GLU A 10 -5.786 -9.615 8.871 1.00 0.00 O ATOM 113 CB GLU A 10 -6.046 -6.392 9.403 1.00 0.00 C ATOM 114 CG GLU A 10 -6.512 -4.950 9.160 1.00 0.00 C ATOM 115 CD GLU A 10 -6.139 -3.975 10.294 1.00 0.00 C ATOM 116 OE1 GLU A 10 -4.983 -3.951 10.778 1.00 0.00 O ATOM 117 OE2 GLU A 10 -7.060 -3.273 10.780 1.00 0.00 O ATOM 0 H GLU A 10 -7.703 -7.941 10.383 1.00 0.00 H new ATOM 0 HA GLU A 10 -7.215 -6.935 7.695 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -6.152 -6.625 10.462 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -4.985 -6.467 9.165 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -6.078 -4.590 8.227 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -7.594 -4.945 9.031 1.00 0.00 H new ATOM 124 N LEU A 11 -5.273 -8.437 7.024 1.00 0.00 N ATOM 125 CA LEU A 11 -4.227 -9.280 6.477 1.00 0.00 C ATOM 126 C LEU A 11 -3.147 -8.312 5.996 1.00 0.00 C ATOM 127 O LEU A 11 -3.453 -7.162 5.691 1.00 0.00 O ATOM 128 CB LEU A 11 -4.740 -10.139 5.299 1.00 0.00 C ATOM 129 CG LEU A 11 -5.998 -10.994 5.581 1.00 0.00 C ATOM 130 CD1 LEU A 11 -7.299 -10.330 5.082 1.00 0.00 C ATOM 131 CD2 LEU A 11 -5.875 -12.375 4.925 1.00 0.00 C ATOM 0 H LEU A 11 -5.491 -7.654 6.407 1.00 0.00 H new ATOM 0 HA LEU A 11 -3.858 -9.983 7.224 1.00 0.00 H new ATOM 0 HB2 LEU A 11 -4.955 -9.478 4.460 1.00 0.00 H new ATOM 0 HB3 LEU A 11 -3.936 -10.804 4.983 1.00 0.00 H new ATOM 0 HG LEU A 11 -6.057 -11.090 6.665 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -8.147 -10.976 5.308 1.00 0.00 H new ATOM 0 HD12 LEU A 11 -7.432 -9.370 5.580 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -7.238 -10.174 4.005 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -6.771 -12.959 5.136 1.00 0.00 H new ATOM 0 HD22 LEU A 11 -5.765 -12.257 3.847 1.00 0.00 H new ATOM 0 HD23 LEU A 11 -5.002 -12.891 5.325 1.00 0.00 H new ATOM 143 N ASP A 12 -1.897 -8.751 5.913 1.00 0.00 N ATOM 144 CA ASP A 12 -0.773 -7.955 5.514 1.00 0.00 C ATOM 145 C ASP A 12 0.017 -8.725 4.460 1.00 0.00 C ATOM 146 O ASP A 12 0.408 -9.882 4.669 1.00 0.00 O ATOM 147 CB ASP A 12 0.051 -7.577 6.746 1.00 0.00 C ATOM 148 CG ASP A 12 0.413 -8.692 7.725 1.00 0.00 C ATOM 149 OD1 ASP A 12 -0.482 -9.355 8.301 1.00 0.00 O ATOM 150 OD2 ASP A 12 1.619 -8.944 7.937 1.00 0.00 O ATOM 0 H ASP A 12 -1.642 -9.714 6.134 1.00 0.00 H new ATOM 0 HA ASP A 12 -1.088 -7.016 5.060 1.00 0.00 H new ATOM 0 HB2 ASP A 12 0.978 -7.118 6.402 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -0.498 -6.813 7.296 1.00 0.00 H new ATOM 155 N VAL A 13 0.192 -8.087 3.304 1.00 0.00 N ATOM 156 CA VAL A 13 0.969 -8.555 2.154 1.00 0.00 C ATOM 157 C VAL A 13 2.305 -7.793 2.199 1.00 0.00 C ATOM 158 O VAL A 13 2.343 -6.626 2.611 1.00 0.00 O ATOM 159 CB VAL A 13 0.207 -8.238 0.837 1.00 0.00 C ATOM 160 CG1 VAL A 13 0.950 -8.624 -0.450 1.00 0.00 C ATOM 161 CG2 VAL A 13 -1.181 -8.894 0.765 1.00 0.00 C ATOM 0 H VAL A 13 -0.230 -7.174 3.133 1.00 0.00 H new ATOM 0 HA VAL A 13 1.130 -9.632 2.189 1.00 0.00 H new ATOM 0 HB VAL A 13 0.120 -7.153 0.883 1.00 0.00 H new ATOM 0 HG11 VAL A 13 0.339 -8.364 -1.315 1.00 0.00 H new ATOM 0 HG12 VAL A 13 1.896 -8.085 -0.499 1.00 0.00 H new ATOM 0 HG13 VAL A 13 1.143 -9.697 -0.451 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -1.659 -8.632 -0.179 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.075 -9.977 0.830 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -1.795 -8.539 1.593 1.00 0.00 H new ATOM 171 N HIS A 14 3.381 -8.386 1.689 1.00 0.00 N ATOM 172 CA HIS A 14 4.650 -7.732 1.396 1.00 0.00 C ATOM 173 C HIS A 14 5.043 -8.053 -0.047 1.00 0.00 C ATOM 174 O HIS A 14 5.227 -9.222 -0.386 1.00 0.00 O ATOM 175 CB HIS A 14 5.713 -8.221 2.379 1.00 0.00 C ATOM 176 CG HIS A 14 7.113 -7.868 1.962 1.00 0.00 C ATOM 177 ND1 HIS A 14 7.781 -6.699 2.247 1.00 0.00 N ATOM 178 CD2 HIS A 14 7.937 -8.659 1.207 1.00 0.00 C ATOM 179 CE1 HIS A 14 8.998 -6.792 1.683 1.00 0.00 C ATOM 180 NE2 HIS A 14 9.140 -7.970 1.047 1.00 0.00 N ATOM 0 H HIS A 14 3.391 -9.380 1.459 1.00 0.00 H new ATOM 0 HA HIS A 14 4.560 -6.651 1.505 1.00 0.00 H new ATOM 0 HB2 HIS A 14 5.515 -7.792 3.361 1.00 0.00 H new ATOM 0 HB3 HIS A 14 5.633 -9.303 2.481 1.00 0.00 H new ATOM 0 HD1 HIS A 14 7.421 -5.911 2.785 1.00 0.00 H new ATOM 0 HD2 HIS A 14 7.700 -9.635 0.809 1.00 0.00 H new ATOM 0 HE1 HIS A 14 9.758 -6.026 1.733 1.00 0.00 H new ATOM 188 N LEU A 15 5.211 -7.040 -0.892 1.00 0.00 N ATOM 189 CA LEU A 15 5.693 -7.205 -2.258 1.00 0.00 C ATOM 190 C LEU A 15 6.989 -6.425 -2.370 1.00 0.00 C ATOM 191 O LEU A 15 6.980 -5.210 -2.175 1.00 0.00 O ATOM 192 CB LEU A 15 4.672 -6.649 -3.269 1.00 0.00 C ATOM 193 CG LEU A 15 3.488 -7.581 -3.566 1.00 0.00 C ATOM 194 CD1 LEU A 15 2.405 -6.806 -4.331 1.00 0.00 C ATOM 195 CD2 LEU A 15 3.922 -8.766 -4.433 1.00 0.00 C ATOM 0 H LEU A 15 5.014 -6.071 -0.644 1.00 0.00 H new ATOM 0 HA LEU A 15 5.841 -8.262 -2.479 1.00 0.00 H new ATOM 0 HB2 LEU A 15 4.285 -5.703 -2.891 1.00 0.00 H new ATOM 0 HB3 LEU A 15 5.189 -6.432 -4.204 1.00 0.00 H new ATOM 0 HG LEU A 15 3.106 -7.950 -2.614 1.00 0.00 H new ATOM 0 HD11 LEU A 15 1.565 -7.467 -4.542 1.00 0.00 H new ATOM 0 HD12 LEU A 15 2.063 -5.966 -3.726 1.00 0.00 H new ATOM 0 HD13 LEU A 15 2.818 -6.434 -5.269 1.00 0.00 H new ATOM 0 HD21 LEU A 15 3.063 -9.409 -4.627 1.00 0.00 H new ATOM 0 HD22 LEU A 15 4.321 -8.398 -5.378 1.00 0.00 H new ATOM 0 HD23 LEU A 15 4.691 -9.336 -3.912 1.00 0.00 H new ATOM 207 N ARG A 16 8.081 -7.082 -2.765 1.00 0.00 N ATOM 208 CA ARG A 16 9.294 -6.380 -3.185 1.00 0.00 C ATOM 209 C ARG A 16 9.261 -6.128 -4.688 1.00 0.00 C ATOM 210 O ARG A 16 8.603 -6.861 -5.437 1.00 0.00 O ATOM 211 CB ARG A 16 10.592 -7.025 -2.657 1.00 0.00 C ATOM 212 CG ARG A 16 11.010 -8.383 -3.235 1.00 0.00 C ATOM 213 CD ARG A 16 10.053 -9.513 -2.841 1.00 0.00 C ATOM 214 NE ARG A 16 10.690 -10.831 -2.927 1.00 0.00 N ATOM 215 CZ ARG A 16 10.941 -11.551 -4.023 1.00 0.00 C ATOM 216 NH1 ARG A 16 10.711 -11.053 -5.233 1.00 0.00 N ATOM 217 NH2 ARG A 16 11.420 -12.778 -3.883 1.00 0.00 N ATOM 0 H ARG A 16 8.150 -8.099 -2.803 1.00 0.00 H new ATOM 0 HA ARG A 16 9.306 -5.400 -2.708 1.00 0.00 H new ATOM 0 HB2 ARG A 16 11.408 -6.323 -2.831 1.00 0.00 H new ATOM 0 HB3 ARG A 16 10.493 -7.138 -1.577 1.00 0.00 H new ATOM 0 HG2 ARG A 16 11.055 -8.313 -4.322 1.00 0.00 H new ATOM 0 HG3 ARG A 16 12.015 -8.626 -2.890 1.00 0.00 H new ATOM 0 HD2 ARG A 16 9.698 -9.348 -1.824 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.179 -9.490 -3.492 1.00 0.00 H new ATOM 0 HE ARG A 16 10.976 -11.249 -2.042 1.00 0.00 H new ATOM 0 HH11 ARG A 16 10.338 -10.109 -5.334 1.00 0.00 H new ATOM 0 HH12 ARG A 16 10.908 -11.615 -6.061 1.00 0.00 H new ATOM 0 HH21 ARG A 16 11.590 -13.156 -2.951 1.00 0.00 H new ATOM 0 HH22 ARG A 16 11.619 -13.345 -4.707 1.00 0.00 H new ATOM 231 N ARG A 17 9.953 -5.075 -5.120 1.00 0.00 N ATOM 232 CA ARG A 17 10.063 -4.600 -6.486 1.00 0.00 C ATOM 233 C ARG A 17 11.541 -4.667 -6.827 1.00 0.00 C ATOM 234 O ARG A 17 12.270 -3.707 -6.574 1.00 0.00 O ATOM 235 CB ARG A 17 9.536 -3.164 -6.624 1.00 0.00 C ATOM 236 CG ARG A 17 9.764 -2.540 -8.016 1.00 0.00 C ATOM 237 CD ARG A 17 9.912 -1.030 -7.867 1.00 0.00 C ATOM 238 NE ARG A 17 10.005 -0.347 -9.168 1.00 0.00 N ATOM 239 CZ ARG A 17 10.842 0.655 -9.464 1.00 0.00 C ATOM 240 NH1 ARG A 17 11.636 1.194 -8.544 1.00 0.00 N ATOM 241 NH2 ARG A 17 10.885 1.129 -10.696 1.00 0.00 N ATOM 0 H ARG A 17 10.487 -4.495 -4.473 1.00 0.00 H new ATOM 0 HA ARG A 17 9.464 -5.208 -7.164 1.00 0.00 H new ATOM 0 HB2 ARG A 17 8.468 -3.158 -6.406 1.00 0.00 H new ATOM 0 HB3 ARG A 17 10.018 -2.538 -5.874 1.00 0.00 H new ATOM 0 HG2 ARG A 17 10.658 -2.962 -8.476 1.00 0.00 H new ATOM 0 HG3 ARG A 17 8.927 -2.773 -8.674 1.00 0.00 H new ATOM 0 HD2 ARG A 17 9.060 -0.637 -7.313 1.00 0.00 H new ATOM 0 HD3 ARG A 17 10.803 -0.811 -7.279 1.00 0.00 H new ATOM 0 HE ARG A 17 9.378 -0.664 -9.907 1.00 0.00 H new ATOM 0 HH11 ARG A 17 11.617 0.845 -7.586 1.00 0.00 H new ATOM 0 HH12 ARG A 17 12.265 1.957 -8.796 1.00 0.00 H new ATOM 0 HH21 ARG A 17 10.282 0.732 -11.417 1.00 0.00 H new ATOM 0 HH22 ARG A 17 11.521 1.892 -10.927 1.00 0.00 H new ATOM 255 N MET A 18 11.972 -5.765 -7.427 1.00 0.00 N ATOM 256 CA MET A 18 13.307 -5.886 -8.000 1.00 0.00 C ATOM 257 C MET A 18 13.228 -6.280 -9.475 1.00 0.00 C ATOM 258 O MET A 18 14.217 -6.123 -10.189 1.00 0.00 O ATOM 259 CB MET A 18 14.146 -6.871 -7.170 1.00 0.00 C ATOM 260 CG MET A 18 15.486 -6.277 -6.744 1.00 0.00 C ATOM 261 SD MET A 18 16.686 -6.021 -8.078 1.00 0.00 S ATOM 262 CE MET A 18 18.181 -5.996 -7.064 1.00 0.00 C ATOM 0 H MET A 18 11.403 -6.605 -7.532 1.00 0.00 H new ATOM 0 HA MET A 18 13.807 -4.918 -7.962 1.00 0.00 H new ATOM 0 HB2 MET A 18 13.584 -7.166 -6.284 1.00 0.00 H new ATOM 0 HB3 MET A 18 14.321 -7.776 -7.752 1.00 0.00 H new ATOM 0 HG2 MET A 18 15.301 -5.320 -6.257 1.00 0.00 H new ATOM 0 HG3 MET A 18 15.933 -6.933 -5.997 1.00 0.00 H new ATOM 0 HE1 MET A 18 19.051 -5.846 -7.703 1.00 0.00 H new ATOM 0 HE2 MET A 18 18.117 -5.182 -6.341 1.00 0.00 H new ATOM 0 HE3 MET A 18 18.278 -6.944 -6.535 1.00 0.00 H new ATOM 272 N GLU A 19 12.060 -6.724 -9.950 1.00 0.00 N ATOM 273 CA GLU A 19 11.838 -7.218 -11.298 1.00 0.00 C ATOM 274 C GLU A 19 10.524 -6.590 -11.768 1.00 0.00 C ATOM 275 O GLU A 19 10.455 -5.368 -11.882 1.00 0.00 O ATOM 276 CB GLU A 19 11.865 -8.759 -11.262 1.00 0.00 C ATOM 277 CG GLU A 19 13.263 -9.288 -10.879 1.00 0.00 C ATOM 278 CD GLU A 19 13.316 -10.802 -10.717 1.00 0.00 C ATOM 279 OE1 GLU A 19 12.259 -11.451 -10.560 1.00 0.00 O ATOM 280 OE2 GLU A 19 14.431 -11.373 -10.702 1.00 0.00 O ATOM 0 H GLU A 19 11.216 -6.747 -9.378 1.00 0.00 H new ATOM 0 HA GLU A 19 12.607 -6.939 -12.018 1.00 0.00 H new ATOM 0 HB2 GLU A 19 11.128 -9.121 -10.545 1.00 0.00 H new ATOM 0 HB3 GLU A 19 11.580 -9.152 -12.238 1.00 0.00 H new ATOM 0 HG2 GLU A 19 13.979 -8.987 -11.644 1.00 0.00 H new ATOM 0 HG3 GLU A 19 13.577 -8.819 -9.946 1.00 0.00 H new ATOM 287 N SER A 20 9.458 -7.370 -11.962 1.00 0.00 N ATOM 288 CA SER A 20 8.216 -6.897 -12.566 1.00 0.00 C ATOM 289 C SER A 20 7.478 -5.843 -11.730 1.00 0.00 C ATOM 290 O SER A 20 6.639 -5.120 -12.274 1.00 0.00 O ATOM 291 CB SER A 20 7.289 -8.094 -12.775 1.00 0.00 C ATOM 292 OG SER A 20 7.963 -9.172 -13.403 1.00 0.00 O ATOM 0 H SER A 20 9.435 -8.356 -11.701 1.00 0.00 H new ATOM 0 HA SER A 20 8.487 -6.416 -13.506 1.00 0.00 H new ATOM 0 HB2 SER A 20 6.894 -8.422 -11.813 1.00 0.00 H new ATOM 0 HB3 SER A 20 6.436 -7.793 -13.384 1.00 0.00 H new ATOM 0 HG SER A 20 7.343 -9.922 -13.520 1.00 0.00 H new ATOM 298 N GLY A 21 7.778 -5.731 -10.433 1.00 0.00 N ATOM 299 CA GLY A 21 7.122 -4.779 -9.558 1.00 0.00 C ATOM 300 C GLY A 21 5.714 -5.222 -9.168 1.00 0.00 C ATOM 301 O GLY A 21 5.300 -6.360 -9.393 1.00 0.00 O ATOM 0 H GLY A 21 8.484 -6.302 -9.968 1.00 0.00 H new ATOM 0 HA2 GLY A 21 7.721 -4.645 -8.657 1.00 0.00 H new ATOM 0 HA3 GLY A 21 7.071 -3.809 -10.053 1.00 0.00 H new ATOM 305 N PHE A 22 5.003 -4.335 -8.473 1.00 0.00 N ATOM 306 CA PHE A 22 3.795 -4.677 -7.733 1.00 0.00 C ATOM 307 C PHE A 22 2.645 -4.964 -8.705 1.00 0.00 C ATOM 308 O PHE A 22 2.165 -4.052 -9.386 1.00 0.00 O ATOM 309 CB PHE A 22 3.449 -3.552 -6.742 1.00 0.00 C ATOM 310 CG PHE A 22 4.610 -2.960 -5.953 1.00 0.00 C ATOM 311 CD1 PHE A 22 5.647 -3.768 -5.444 1.00 0.00 C ATOM 312 CD2 PHE A 22 4.671 -1.568 -5.751 1.00 0.00 C ATOM 313 CE1 PHE A 22 6.705 -3.194 -4.722 1.00 0.00 C ATOM 314 CE2 PHE A 22 5.721 -0.992 -5.015 1.00 0.00 C ATOM 315 CZ PHE A 22 6.734 -1.807 -4.484 1.00 0.00 C ATOM 0 H PHE A 22 5.255 -3.349 -8.409 1.00 0.00 H new ATOM 0 HA PHE A 22 3.965 -5.584 -7.153 1.00 0.00 H new ATOM 0 HB2 PHE A 22 2.967 -2.746 -7.295 1.00 0.00 H new ATOM 0 HB3 PHE A 22 2.715 -3.936 -6.033 1.00 0.00 H new ATOM 0 HD1 PHE A 22 5.627 -4.835 -5.611 1.00 0.00 H new ATOM 0 HD2 PHE A 22 3.901 -0.935 -6.167 1.00 0.00 H new ATOM 0 HE1 PHE A 22 7.501 -3.820 -4.347 1.00 0.00 H new ATOM 0 HE2 PHE A 22 5.749 0.076 -4.858 1.00 0.00 H new ATOM 0 HZ PHE A 22 7.530 -1.373 -3.897 1.00 0.00 H new ATOM 325 N GLY A 23 2.200 -6.220 -8.800 1.00 0.00 N ATOM 326 CA GLY A 23 1.242 -6.684 -9.803 1.00 0.00 C ATOM 327 C GLY A 23 -0.221 -6.427 -9.440 1.00 0.00 C ATOM 328 O GLY A 23 -1.038 -7.338 -9.587 1.00 0.00 O ATOM 0 H GLY A 23 2.504 -6.959 -8.166 1.00 0.00 H new ATOM 0 HA2 GLY A 23 1.461 -6.194 -10.752 1.00 0.00 H new ATOM 0 HA3 GLY A 23 1.384 -7.754 -9.957 1.00 0.00 H new ATOM 332 N PHE A 24 -0.577 -5.225 -8.979 1.00 0.00 N ATOM 333 CA PHE A 24 -1.961 -4.853 -8.675 1.00 0.00 C ATOM 334 C PHE A 24 -2.273 -3.467 -9.232 1.00 0.00 C ATOM 335 O PHE A 24 -1.360 -2.680 -9.498 1.00 0.00 O ATOM 336 CB PHE A 24 -2.224 -4.924 -7.160 1.00 0.00 C ATOM 337 CG PHE A 24 -1.630 -3.793 -6.338 1.00 0.00 C ATOM 338 CD1 PHE A 24 -2.387 -2.628 -6.084 1.00 0.00 C ATOM 339 CD2 PHE A 24 -0.339 -3.919 -5.786 1.00 0.00 C ATOM 340 CE1 PHE A 24 -1.868 -1.608 -5.276 1.00 0.00 C ATOM 341 CE2 PHE A 24 0.180 -2.887 -4.979 1.00 0.00 C ATOM 342 CZ PHE A 24 -0.590 -1.742 -4.718 1.00 0.00 C ATOM 0 H PHE A 24 0.093 -4.476 -8.805 1.00 0.00 H new ATOM 0 HA PHE A 24 -2.629 -5.566 -9.158 1.00 0.00 H new ATOM 0 HB2 PHE A 24 -3.302 -4.941 -6.997 1.00 0.00 H new ATOM 0 HB3 PHE A 24 -1.830 -5.868 -6.785 1.00 0.00 H new ATOM 0 HD1 PHE A 24 -3.372 -2.523 -6.515 1.00 0.00 H new ATOM 0 HD2 PHE A 24 0.250 -4.803 -5.981 1.00 0.00 H new ATOM 0 HE1 PHE A 24 -2.452 -0.720 -5.084 1.00 0.00 H new ATOM 0 HE2 PHE A 24 1.172 -2.977 -4.561 1.00 0.00 H new ATOM 0 HZ PHE A 24 -0.195 -0.961 -4.084 1.00 0.00 H new ATOM 352 N ARG A 25 -3.564 -3.147 -9.333 1.00 0.00 N ATOM 353 CA ARG A 25 -4.106 -1.827 -9.650 1.00 0.00 C ATOM 354 C ARG A 25 -4.984 -1.389 -8.483 1.00 0.00 C ATOM 355 O ARG A 25 -5.457 -2.242 -7.735 1.00 0.00 O ATOM 356 CB ARG A 25 -4.882 -1.927 -10.971 1.00 0.00 C ATOM 357 CG ARG A 25 -5.297 -0.570 -11.567 1.00 0.00 C ATOM 358 CD ARG A 25 -5.491 -0.670 -13.087 1.00 0.00 C ATOM 359 NE ARG A 25 -4.188 -0.784 -13.765 1.00 0.00 N ATOM 360 CZ ARG A 25 -3.717 -1.807 -14.490 1.00 0.00 C ATOM 361 NH1 ARG A 25 -4.506 -2.802 -14.898 1.00 0.00 N ATOM 362 NH2 ARG A 25 -2.419 -1.828 -14.775 1.00 0.00 N ATOM 0 H ARG A 25 -4.298 -3.840 -9.188 1.00 0.00 H new ATOM 0 HA ARG A 25 -3.325 -1.079 -9.784 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -4.269 -2.458 -11.699 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -5.777 -2.528 -10.808 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -6.222 -0.232 -11.101 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -4.536 0.177 -11.343 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -6.109 -1.536 -13.325 1.00 0.00 H new ATOM 0 HD3 ARG A 25 -6.022 0.210 -13.451 1.00 0.00 H new ATOM 0 HE ARG A 25 -3.565 0.018 -13.670 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -5.498 -2.797 -14.659 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -4.118 -3.568 -15.449 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -1.812 -1.078 -14.443 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -2.030 -2.594 -15.325 1.00 0.00 H new ATOM 376 N ILE A 26 -5.209 -0.091 -8.317 1.00 0.00 N ATOM 377 CA ILE A 26 -5.885 0.502 -7.160 1.00 0.00 C ATOM 378 C ILE A 26 -7.077 1.279 -7.716 1.00 0.00 C ATOM 379 O ILE A 26 -6.916 1.939 -8.741 1.00 0.00 O ATOM 380 CB ILE A 26 -4.921 1.396 -6.317 1.00 0.00 C ATOM 381 CG1 ILE A 26 -3.486 1.533 -6.892 1.00 0.00 C ATOM 382 CG2 ILE A 26 -4.876 0.877 -4.869 1.00 0.00 C ATOM 383 CD1 ILE A 26 -2.611 2.558 -6.164 1.00 0.00 C ATOM 0 H ILE A 26 -4.918 0.604 -9.004 1.00 0.00 H new ATOM 0 HA ILE A 26 -6.223 -0.265 -6.464 1.00 0.00 H new ATOM 0 HB ILE A 26 -5.334 2.404 -6.355 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -2.996 0.560 -6.851 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -3.554 1.812 -7.944 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -4.203 1.500 -4.280 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -5.876 0.914 -4.438 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -4.516 -0.152 -4.862 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -1.626 2.591 -6.629 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -3.075 3.542 -6.227 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -2.509 2.271 -5.117 1.00 0.00 H new ATOM 395 N LEU A 27 -8.265 1.169 -7.117 1.00 0.00 N ATOM 396 CA LEU A 27 -9.494 1.837 -7.550 1.00 0.00 C ATOM 397 C LEU A 27 -10.266 2.244 -6.288 1.00 0.00 C ATOM 398 O LEU A 27 -9.795 2.020 -5.167 1.00 0.00 O ATOM 399 CB LEU A 27 -10.344 0.926 -8.474 1.00 0.00 C ATOM 400 CG LEU A 27 -9.676 0.491 -9.798 1.00 0.00 C ATOM 401 CD1 LEU A 27 -10.528 -0.529 -10.566 1.00 0.00 C ATOM 402 CD2 LEU A 27 -9.382 1.637 -10.759 1.00 0.00 C ATOM 0 H LEU A 27 -8.402 0.592 -6.287 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.254 2.720 -8.143 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -10.617 0.030 -7.916 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -11.271 1.448 -8.712 1.00 0.00 H new ATOM 0 HG LEU A 27 -8.732 0.053 -9.472 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -10.019 -0.806 -11.489 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -10.674 -1.417 -9.952 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -11.497 -0.089 -10.803 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -8.914 1.244 -11.662 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -10.313 2.139 -11.022 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -8.708 2.349 -10.281 1.00 0.00 H new ATOM 414 N GLY A 28 -11.438 2.852 -6.443 1.00 0.00 N ATOM 415 CA GLY A 28 -12.214 3.341 -5.315 1.00 0.00 C ATOM 416 C GLY A 28 -11.584 4.613 -4.756 1.00 0.00 C ATOM 417 O GLY A 28 -10.930 5.349 -5.501 1.00 0.00 O ATOM 0 H GLY A 28 -11.873 3.018 -7.351 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -13.239 3.541 -5.628 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -12.261 2.578 -4.538 1.00 0.00 H new ATOM 421 N GLY A 29 -11.816 4.897 -3.469 1.00 0.00 N ATOM 422 CA GLY A 29 -11.274 6.066 -2.771 1.00 0.00 C ATOM 423 C GLY A 29 -11.561 7.369 -3.510 1.00 0.00 C ATOM 424 O GLY A 29 -10.706 8.254 -3.558 1.00 0.00 O ATOM 0 H GLY A 29 -12.398 4.308 -2.873 1.00 0.00 H new ATOM 0 HA2 GLY A 29 -11.701 6.118 -1.769 1.00 0.00 H new ATOM 0 HA3 GLY A 29 -10.197 5.948 -2.653 1.00 0.00 H new ATOM 428 N ASP A 30 -12.718 7.444 -4.166 1.00 0.00 N ATOM 429 CA ASP A 30 -13.002 8.505 -5.120 1.00 0.00 C ATOM 430 C ASP A 30 -13.270 9.807 -4.376 1.00 0.00 C ATOM 431 O ASP A 30 -12.681 10.835 -4.706 1.00 0.00 O ATOM 432 CB ASP A 30 -14.168 8.103 -6.040 1.00 0.00 C ATOM 433 CG ASP A 30 -13.822 8.312 -7.516 1.00 0.00 C ATOM 434 OD1 ASP A 30 -12.734 7.867 -7.942 1.00 0.00 O ATOM 435 OD2 ASP A 30 -14.663 8.826 -8.283 1.00 0.00 O ATOM 0 H ASP A 30 -13.478 6.774 -4.050 1.00 0.00 H new ATOM 0 HA ASP A 30 -12.135 8.664 -5.761 1.00 0.00 H new ATOM 0 HB2 ASP A 30 -14.421 7.057 -5.870 1.00 0.00 H new ATOM 0 HB3 ASP A 30 -15.051 8.690 -5.786 1.00 0.00 H new ATOM 440 N GLU A 31 -14.098 9.741 -3.332 1.00 0.00 N ATOM 441 CA GLU A 31 -14.315 10.826 -2.382 1.00 0.00 C ATOM 442 C GLU A 31 -13.547 10.507 -1.094 1.00 0.00 C ATOM 443 O GLU A 31 -13.274 9.330 -0.816 1.00 0.00 O ATOM 444 CB GLU A 31 -15.817 10.972 -2.075 1.00 0.00 C ATOM 445 CG GLU A 31 -16.642 11.560 -3.223 1.00 0.00 C ATOM 446 CD GLU A 31 -16.426 13.065 -3.420 1.00 0.00 C ATOM 447 OE1 GLU A 31 -15.294 13.492 -3.738 1.00 0.00 O ATOM 448 OE2 GLU A 31 -17.406 13.829 -3.264 1.00 0.00 O ATOM 0 H GLU A 31 -14.649 8.909 -3.121 1.00 0.00 H new ATOM 0 HA GLU A 31 -13.959 11.764 -2.807 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -16.220 9.992 -1.819 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -15.936 11.606 -1.196 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -16.388 11.040 -4.147 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -17.699 11.374 -3.033 1.00 0.00 H new ATOM 455 N PRO A 32 -13.228 11.523 -0.274 1.00 0.00 N ATOM 456 CA PRO A 32 -12.512 11.355 0.973 1.00 0.00 C ATOM 457 C PRO A 32 -13.457 10.714 1.979 1.00 0.00 C ATOM 458 O PRO A 32 -14.297 11.372 2.602 1.00 0.00 O ATOM 459 CB PRO A 32 -12.010 12.748 1.351 1.00 0.00 C ATOM 460 CG PRO A 32 -12.957 13.725 0.649 1.00 0.00 C ATOM 461 CD PRO A 32 -13.687 12.898 -0.410 1.00 0.00 C ATOM 0 HA PRO A 32 -11.650 10.690 0.921 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -12.027 12.892 2.431 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -10.980 12.896 1.026 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -13.660 14.166 1.356 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -12.405 14.547 0.193 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -14.766 12.959 -0.269 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -13.474 13.278 -1.409 1.00 0.00 H new ATOM 469 N GLY A 33 -13.341 9.395 2.072 1.00 0.00 N ATOM 470 CA GLY A 33 -14.147 8.529 2.902 1.00 0.00 C ATOM 471 C GLY A 33 -14.412 7.190 2.219 1.00 0.00 C ATOM 472 O GLY A 33 -14.668 6.203 2.908 1.00 0.00 O ATOM 0 H GLY A 33 -12.641 8.879 1.538 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.641 8.360 3.853 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -15.095 9.018 3.127 1.00 0.00 H new ATOM 476 N GLN A 34 -14.365 7.113 0.885 1.00 0.00 N ATOM 477 CA GLN A 34 -14.784 5.913 0.176 1.00 0.00 C ATOM 478 C GLN A 34 -13.776 4.766 0.305 1.00 0.00 C ATOM 479 O GLN A 34 -12.575 5.015 0.437 1.00 0.00 O ATOM 480 CB GLN A 34 -15.079 6.260 -1.291 1.00 0.00 C ATOM 481 CG GLN A 34 -16.429 6.972 -1.424 1.00 0.00 C ATOM 482 CD GLN A 34 -17.597 6.238 -0.773 1.00 0.00 C ATOM 483 OE1 GLN A 34 -17.835 5.062 -1.013 1.00 0.00 O ATOM 484 NE2 GLN A 34 -18.313 6.885 0.124 1.00 0.00 N ATOM 0 H GLN A 34 -14.041 7.869 0.281 1.00 0.00 H new ATOM 0 HA GLN A 34 -15.699 5.547 0.642 1.00 0.00 H new ATOM 0 HB2 GLN A 34 -14.287 6.897 -1.684 1.00 0.00 H new ATOM 0 HB3 GLN A 34 -15.083 5.350 -1.890 1.00 0.00 H new ATOM 0 HG2 GLN A 34 -16.347 7.964 -0.981 1.00 0.00 H new ATOM 0 HG3 GLN A 34 -16.649 7.113 -2.482 1.00 0.00 H new ATOM 0 HE21 GLN A 34 -18.115 7.865 0.324 1.00 0.00 H new ATOM 0 HE22 GLN A 34 -19.066 6.406 0.618 1.00 0.00 H new ATOM 493 N PRO A 35 -14.251 3.512 0.251 1.00 0.00 N ATOM 494 CA PRO A 35 -13.424 2.331 0.429 1.00 0.00 C ATOM 495 C PRO A 35 -12.489 2.181 -0.771 1.00 0.00 C ATOM 496 O PRO A 35 -12.830 2.565 -1.895 1.00 0.00 O ATOM 497 CB PRO A 35 -14.407 1.168 0.576 1.00 0.00 C ATOM 498 CG PRO A 35 -15.669 1.623 -0.160 1.00 0.00 C ATOM 499 CD PRO A 35 -15.595 3.152 -0.172 1.00 0.00 C ATOM 0 HA PRO A 35 -12.776 2.380 1.304 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -14.004 0.253 0.141 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -14.616 0.957 1.625 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -15.701 1.222 -1.173 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.569 1.276 0.348 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -15.804 3.541 -1.169 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.339 3.580 0.500 1.00 0.00 H new ATOM 507 N ILE A 36 -11.313 1.607 -0.533 1.00 0.00 N ATOM 508 CA ILE A 36 -10.273 1.420 -1.530 1.00 0.00 C ATOM 509 C ILE A 36 -10.160 -0.081 -1.729 1.00 0.00 C ATOM 510 O ILE A 36 -9.428 -0.756 -1.018 1.00 0.00 O ATOM 511 CB ILE A 36 -8.977 2.146 -1.097 1.00 0.00 C ATOM 512 CG1 ILE A 36 -9.245 3.667 -1.161 1.00 0.00 C ATOM 513 CG2 ILE A 36 -7.809 1.748 -2.014 1.00 0.00 C ATOM 514 CD1 ILE A 36 -8.108 4.564 -0.669 1.00 0.00 C ATOM 0 H ILE A 36 -11.054 1.250 0.387 1.00 0.00 H new ATOM 0 HA ILE A 36 -10.500 1.872 -2.496 1.00 0.00 H new ATOM 0 HB ILE A 36 -8.699 1.863 -0.082 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -9.472 3.934 -2.193 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -10.136 3.885 -0.572 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -6.904 2.267 -1.697 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -7.650 0.671 -1.954 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -8.044 2.023 -3.042 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -8.404 5.609 -0.759 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -7.891 4.337 0.375 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -7.217 4.386 -1.272 1.00 0.00 H new ATOM 526 N LEU A 37 -10.954 -0.610 -2.651 1.00 0.00 N ATOM 527 CA LEU A 37 -11.036 -2.037 -2.941 1.00 0.00 C ATOM 528 C LEU A 37 -10.067 -2.314 -4.073 1.00 0.00 C ATOM 529 O LEU A 37 -10.137 -1.583 -5.067 1.00 0.00 O ATOM 530 CB LEU A 37 -12.462 -2.463 -3.328 1.00 0.00 C ATOM 531 CG LEU A 37 -13.581 -2.027 -2.364 1.00 0.00 C ATOM 532 CD1 LEU A 37 -14.873 -2.784 -2.660 1.00 0.00 C ATOM 533 CD2 LEU A 37 -13.199 -2.266 -0.907 1.00 0.00 C ATOM 0 H LEU A 37 -11.574 -0.046 -3.232 1.00 0.00 H new ATOM 0 HA LEU A 37 -10.778 -2.613 -2.052 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -12.684 -2.061 -4.317 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -12.485 -3.549 -3.413 1.00 0.00 H new ATOM 0 HG LEU A 37 -13.730 -0.958 -2.519 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -15.651 -2.461 -1.968 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -15.189 -2.578 -3.683 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -14.703 -3.854 -2.541 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -14.015 -1.945 -0.260 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -13.007 -3.328 -0.751 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -12.301 -1.696 -0.668 1.00 0.00 H new ATOM 545 N ILE A 38 -9.140 -3.270 -3.904 1.00 0.00 N ATOM 546 CA ILE A 38 -8.053 -3.604 -4.830 1.00 0.00 C ATOM 547 C ILE A 38 -8.651 -3.615 -6.226 1.00 0.00 C ATOM 548 O ILE A 38 -9.614 -4.346 -6.478 1.00 0.00 O ATOM 549 CB ILE A 38 -7.380 -4.951 -4.484 1.00 0.00 C ATOM 550 CG1 ILE A 38 -6.639 -4.907 -3.134 1.00 0.00 C ATOM 551 CG2 ILE A 38 -6.406 -5.419 -5.593 1.00 0.00 C ATOM 552 CD1 ILE A 38 -5.376 -4.044 -3.103 1.00 0.00 C ATOM 0 H ILE A 38 -9.131 -3.861 -3.072 1.00 0.00 H new ATOM 0 HA ILE A 38 -7.257 -2.863 -4.757 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.193 -5.672 -4.407 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -7.328 -4.539 -2.373 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -6.369 -5.925 -2.854 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -5.957 -6.370 -5.305 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -6.952 -5.544 -6.528 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -5.622 -4.674 -5.727 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -4.933 -4.083 -2.108 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -4.660 -4.420 -3.834 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -5.634 -3.013 -3.345 1.00 0.00 H new ATOM 564 N GLY A 39 -8.118 -2.751 -7.084 1.00 0.00 N ATOM 565 CA GLY A 39 -8.628 -2.479 -8.409 1.00 0.00 C ATOM 566 C GLY A 39 -8.639 -3.726 -9.273 1.00 0.00 C ATOM 567 O GLY A 39 -9.669 -4.110 -9.816 1.00 0.00 O ATOM 0 H GLY A 39 -7.287 -2.204 -6.860 1.00 0.00 H new ATOM 0 HA2 GLY A 39 -9.639 -2.079 -8.335 1.00 0.00 H new ATOM 0 HA3 GLY A 39 -8.016 -1.712 -8.884 1.00 0.00 H new ATOM 571 N ALA A 40 -7.466 -4.335 -9.412 1.00 0.00 N ATOM 572 CA ALA A 40 -7.257 -5.567 -10.143 1.00 0.00 C ATOM 573 C ALA A 40 -6.019 -6.242 -9.561 1.00 0.00 C ATOM 574 O ALA A 40 -5.128 -5.538 -9.073 1.00 0.00 O ATOM 575 CB ALA A 40 -7.055 -5.231 -11.621 1.00 0.00 C ATOM 0 H ALA A 40 -6.608 -3.966 -9.002 1.00 0.00 H new ATOM 0 HA ALA A 40 -8.111 -6.238 -10.057 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.896 -6.150 -12.185 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -7.939 -4.720 -12.002 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -6.185 -4.583 -11.731 1.00 0.00 H new ATOM 581 N VAL A 41 -5.921 -7.568 -9.660 1.00 0.00 N ATOM 582 CA VAL A 41 -4.672 -8.294 -9.445 1.00 0.00 C ATOM 583 C VAL A 41 -4.304 -8.866 -10.803 1.00 0.00 C ATOM 584 O VAL A 41 -5.037 -9.703 -11.334 1.00 0.00 O ATOM 585 CB VAL A 41 -4.807 -9.352 -8.333 1.00 0.00 C ATOM 586 CG1 VAL A 41 -3.543 -10.213 -8.180 1.00 0.00 C ATOM 587 CG2 VAL A 41 -5.081 -8.661 -6.987 1.00 0.00 C ATOM 0 H VAL A 41 -6.711 -8.170 -9.893 1.00 0.00 H new ATOM 0 HA VAL A 41 -3.873 -7.648 -9.080 1.00 0.00 H new ATOM 0 HB VAL A 41 -5.634 -10.002 -8.619 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -3.693 -10.941 -7.383 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -3.343 -10.735 -9.116 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -2.695 -9.574 -7.933 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.176 -9.414 -6.204 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -4.256 -7.990 -6.748 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -6.006 -8.089 -7.054 1.00 0.00 H new ATOM 597 N ILE A 42 -3.205 -8.350 -11.360 1.00 0.00 N ATOM 598 CA ILE A 42 -2.712 -8.633 -12.699 1.00 0.00 C ATOM 599 C ILE A 42 -2.517 -10.141 -12.831 1.00 0.00 C ATOM 600 O ILE A 42 -1.726 -10.717 -12.076 1.00 0.00 O ATOM 601 CB ILE A 42 -1.418 -7.830 -12.957 1.00 0.00 C ATOM 602 CG1 ILE A 42 -1.592 -6.307 -12.757 1.00 0.00 C ATOM 603 CG2 ILE A 42 -0.837 -8.117 -14.348 1.00 0.00 C ATOM 604 CD1 ILE A 42 -2.631 -5.618 -13.650 1.00 0.00 C ATOM 0 H ILE A 42 -2.609 -7.691 -10.859 1.00 0.00 H new ATOM 0 HA ILE A 42 -3.427 -8.321 -13.460 1.00 0.00 H new ATOM 0 HB ILE A 42 -0.711 -8.174 -12.202 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -1.863 -6.127 -11.716 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -0.627 -5.828 -12.923 1.00 0.00 H new ATOM 0 HG21 ILE A 42 0.072 -7.533 -14.490 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -0.603 -9.178 -14.433 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -1.567 -7.844 -15.110 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -2.662 -4.554 -13.417 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -2.358 -5.753 -14.697 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -3.613 -6.057 -13.472 1.00 0.00 H new ATOM 616 N ALA A 43 -3.241 -10.759 -13.766 1.00 0.00 N ATOM 617 CA ALA A 43 -3.233 -12.197 -13.986 1.00 0.00 C ATOM 618 C ALA A 43 -1.811 -12.705 -14.133 1.00 0.00 C ATOM 619 O ALA A 43 -1.087 -12.204 -14.998 1.00 0.00 O ATOM 620 CB ALA A 43 -4.004 -12.528 -15.257 1.00 0.00 C ATOM 0 H ALA A 43 -3.861 -10.258 -14.403 1.00 0.00 H new ATOM 0 HA ALA A 43 -3.701 -12.677 -13.127 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -3.995 -13.606 -15.418 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -5.034 -12.184 -15.158 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -3.536 -12.031 -16.107 1.00 0.00 H new ATOM 626 N MET A 44 -1.439 -13.683 -13.304 1.00 0.00 N ATOM 627 CA MET A 44 -0.144 -14.358 -13.242 1.00 0.00 C ATOM 628 C MET A 44 1.082 -13.430 -13.263 1.00 0.00 C ATOM 629 O MET A 44 2.203 -13.875 -13.542 1.00 0.00 O ATOM 630 CB MET A 44 -0.113 -15.524 -14.231 1.00 0.00 C ATOM 631 CG MET A 44 -0.316 -15.142 -15.693 1.00 0.00 C ATOM 632 SD MET A 44 -0.023 -16.523 -16.821 1.00 0.00 S ATOM 633 CE MET A 44 -1.593 -17.409 -16.689 1.00 0.00 C ATOM 0 H MET A 44 -2.086 -14.050 -12.606 1.00 0.00 H new ATOM 0 HA MET A 44 -0.047 -14.788 -12.245 1.00 0.00 H new ATOM 0 HB2 MET A 44 0.845 -16.035 -14.135 1.00 0.00 H new ATOM 0 HB3 MET A 44 -0.885 -16.239 -13.949 1.00 0.00 H new ATOM 0 HG2 MET A 44 -1.333 -14.775 -15.831 1.00 0.00 H new ATOM 0 HG3 MET A 44 0.356 -14.322 -15.947 1.00 0.00 H new ATOM 0 HE1 MET A 44 -1.568 -18.290 -17.330 1.00 0.00 H new ATOM 0 HE2 MET A 44 -1.752 -17.716 -15.655 1.00 0.00 H new ATOM 0 HE3 MET A 44 -2.407 -16.755 -17.002 1.00 0.00 H new ATOM 643 N GLY A 45 0.878 -12.157 -12.916 1.00 0.00 N ATOM 644 CA GLY A 45 1.915 -11.203 -12.592 1.00 0.00 C ATOM 645 C GLY A 45 2.403 -11.445 -11.166 1.00 0.00 C ATOM 646 O GLY A 45 2.044 -12.432 -10.521 1.00 0.00 O ATOM 0 H GLY A 45 -0.058 -11.756 -12.854 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.744 -11.300 -13.293 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.532 -10.187 -12.689 1.00 0.00 H new ATOM 650 N SER A 46 3.262 -10.559 -10.665 1.00 0.00 N ATOM 651 CA SER A 46 3.910 -10.784 -9.382 1.00 0.00 C ATOM 652 C SER A 46 2.940 -10.950 -8.209 1.00 0.00 C ATOM 653 O SER A 46 3.227 -11.786 -7.372 1.00 0.00 O ATOM 654 CB SER A 46 4.915 -9.674 -9.086 1.00 0.00 C ATOM 655 OG SER A 46 6.157 -9.956 -9.708 1.00 0.00 O ATOM 0 H SER A 46 3.521 -9.687 -11.126 1.00 0.00 H new ATOM 0 HA SER A 46 4.429 -11.738 -9.478 1.00 0.00 H new ATOM 0 HB2 SER A 46 4.529 -8.720 -9.445 1.00 0.00 H new ATOM 0 HB3 SER A 46 5.054 -9.577 -8.009 1.00 0.00 H new ATOM 0 HG SER A 46 6.792 -9.236 -9.512 1.00 0.00 H new ATOM 661 N ALA A 47 1.830 -10.212 -8.106 1.00 0.00 N ATOM 662 CA ALA A 47 0.943 -10.333 -6.942 1.00 0.00 C ATOM 663 C ALA A 47 0.102 -11.622 -6.990 1.00 0.00 C ATOM 664 O ALA A 47 -0.262 -12.175 -5.954 1.00 0.00 O ATOM 665 CB ALA A 47 0.051 -9.092 -6.841 1.00 0.00 C ATOM 0 H ALA A 47 1.526 -9.533 -8.804 1.00 0.00 H new ATOM 0 HA ALA A 47 1.562 -10.399 -6.047 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -0.606 -9.185 -5.976 1.00 0.00 H new ATOM 0 HB2 ALA A 47 0.674 -8.204 -6.730 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -0.551 -9.002 -7.745 1.00 0.00 H new ATOM 671 N ASP A 48 -0.191 -12.117 -8.193 1.00 0.00 N ATOM 672 CA ASP A 48 -0.841 -13.410 -8.411 1.00 0.00 C ATOM 673 C ASP A 48 0.114 -14.534 -7.987 1.00 0.00 C ATOM 674 O ASP A 48 -0.257 -15.417 -7.207 1.00 0.00 O ATOM 675 CB ASP A 48 -1.235 -13.495 -9.890 1.00 0.00 C ATOM 676 CG ASP A 48 -1.973 -14.770 -10.313 1.00 0.00 C ATOM 677 OD1 ASP A 48 -1.558 -15.893 -9.955 1.00 0.00 O ATOM 678 OD2 ASP A 48 -2.934 -14.607 -11.097 1.00 0.00 O ATOM 0 H ASP A 48 0.021 -11.622 -9.059 1.00 0.00 H new ATOM 0 HA ASP A 48 -1.744 -13.517 -7.809 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -1.865 -12.638 -10.128 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -0.331 -13.404 -10.493 1.00 0.00 H new ATOM 683 N ARG A 49 1.375 -14.464 -8.429 1.00 0.00 N ATOM 684 CA ARG A 49 2.432 -15.390 -8.010 1.00 0.00 C ATOM 685 C ARG A 49 2.660 -15.321 -6.500 1.00 0.00 C ATOM 686 O ARG A 49 2.816 -16.357 -5.859 1.00 0.00 O ATOM 687 CB ARG A 49 3.734 -15.064 -8.750 1.00 0.00 C ATOM 688 CG ARG A 49 3.686 -15.434 -10.240 1.00 0.00 C ATOM 689 CD ARG A 49 5.034 -15.061 -10.862 1.00 0.00 C ATOM 690 NE ARG A 49 5.183 -15.564 -12.237 1.00 0.00 N ATOM 691 CZ ARG A 49 5.942 -16.604 -12.611 1.00 0.00 C ATOM 692 NH1 ARG A 49 6.468 -17.432 -11.715 1.00 0.00 N ATOM 693 NH2 ARG A 49 6.184 -16.798 -13.898 1.00 0.00 N ATOM 0 H ARG A 49 1.692 -13.757 -9.093 1.00 0.00 H new ATOM 0 HA ARG A 49 2.116 -16.403 -8.260 1.00 0.00 H new ATOM 0 HB2 ARG A 49 3.944 -13.999 -8.652 1.00 0.00 H new ATOM 0 HB3 ARG A 49 4.558 -15.596 -8.275 1.00 0.00 H new ATOM 0 HG2 ARG A 49 3.491 -16.499 -10.362 1.00 0.00 H new ATOM 0 HG3 ARG A 49 2.876 -14.903 -10.739 1.00 0.00 H new ATOM 0 HD2 ARG A 49 5.142 -13.976 -10.863 1.00 0.00 H new ATOM 0 HD3 ARG A 49 5.838 -15.461 -10.244 1.00 0.00 H new ATOM 0 HE ARG A 49 4.664 -15.079 -12.969 1.00 0.00 H new ATOM 0 HH11 ARG A 49 6.297 -17.283 -10.721 1.00 0.00 H new ATOM 0 HH12 ARG A 49 7.043 -18.217 -12.022 1.00 0.00 H new ATOM 0 HH21 ARG A 49 5.795 -16.160 -14.592 1.00 0.00 H new ATOM 0 HH22 ARG A 49 6.760 -17.585 -14.196 1.00 0.00 H new ATOM 707 N ASP A 50 2.628 -14.124 -5.926 1.00 0.00 N ATOM 708 CA ASP A 50 2.755 -13.869 -4.492 1.00 0.00 C ATOM 709 C ASP A 50 1.589 -14.475 -3.696 1.00 0.00 C ATOM 710 O ASP A 50 1.725 -14.800 -2.513 1.00 0.00 O ATOM 711 CB ASP A 50 2.853 -12.355 -4.318 1.00 0.00 C ATOM 712 CG ASP A 50 3.384 -11.910 -2.974 1.00 0.00 C ATOM 713 OD1 ASP A 50 4.605 -12.078 -2.753 1.00 0.00 O ATOM 714 OD2 ASP A 50 2.610 -11.259 -2.236 1.00 0.00 O ATOM 0 H ASP A 50 2.508 -13.268 -6.467 1.00 0.00 H new ATOM 0 HA ASP A 50 3.648 -14.352 -4.094 1.00 0.00 H new ATOM 0 HB2 ASP A 50 3.498 -11.953 -5.100 1.00 0.00 H new ATOM 0 HB3 ASP A 50 1.864 -11.921 -4.466 1.00 0.00 H new ATOM 719 N GLY A 51 0.445 -14.690 -4.359 1.00 0.00 N ATOM 720 CA GLY A 51 -0.676 -15.483 -3.867 1.00 0.00 C ATOM 721 C GLY A 51 -1.375 -14.852 -2.665 1.00 0.00 C ATOM 722 O GLY A 51 -2.003 -15.561 -1.872 1.00 0.00 O ATOM 0 H GLY A 51 0.274 -14.300 -5.286 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -1.399 -15.617 -4.671 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -0.318 -16.475 -3.592 1.00 0.00 H new ATOM 726 N ARG A 52 -1.224 -13.538 -2.486 1.00 0.00 N ATOM 727 CA ARG A 52 -1.513 -12.840 -1.236 1.00 0.00 C ATOM 728 C ARG A 52 -2.537 -11.721 -1.397 1.00 0.00 C ATOM 729 O ARG A 52 -3.017 -11.232 -0.379 1.00 0.00 O ATOM 730 CB ARG A 52 -0.191 -12.287 -0.679 1.00 0.00 C ATOM 731 CG ARG A 52 0.606 -13.227 0.241 1.00 0.00 C ATOM 732 CD ARG A 52 0.395 -12.850 1.716 1.00 0.00 C ATOM 733 NE ARG A 52 -1.014 -12.994 2.126 1.00 0.00 N ATOM 734 CZ ARG A 52 -1.635 -14.161 2.347 1.00 0.00 C ATOM 735 NH1 ARG A 52 -0.934 -15.289 2.443 1.00 0.00 N ATOM 736 NH2 ARG A 52 -2.955 -14.212 2.447 1.00 0.00 N ATOM 0 H ARG A 52 -0.890 -12.918 -3.224 1.00 0.00 H new ATOM 0 HA ARG A 52 -1.960 -13.552 -0.543 1.00 0.00 H new ATOM 0 HB2 ARG A 52 0.445 -12.010 -1.520 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -0.408 -11.372 -0.128 1.00 0.00 H new ATOM 0 HG2 ARG A 52 0.293 -14.258 0.075 1.00 0.00 H new ATOM 0 HG3 ARG A 52 1.666 -13.173 -0.005 1.00 0.00 H new ATOM 0 HD2 ARG A 52 1.022 -13.482 2.345 1.00 0.00 H new ATOM 0 HD3 ARG A 52 0.716 -11.821 1.877 1.00 0.00 H new ATOM 0 HE ARG A 52 -1.558 -12.140 2.251 1.00 0.00 H new ATOM 0 HH11 ARG A 52 0.081 -15.268 2.348 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -1.412 -16.174 2.611 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -3.507 -13.359 2.356 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -3.420 -15.104 2.615 1.00 0.00 H new ATOM 750 N LEU A 53 -2.869 -11.295 -2.614 1.00 0.00 N ATOM 751 CA LEU A 53 -3.872 -10.263 -2.872 1.00 0.00 C ATOM 752 C LEU A 53 -4.964 -10.878 -3.730 1.00 0.00 C ATOM 753 O LEU A 53 -4.669 -11.727 -4.580 1.00 0.00 O ATOM 754 CB LEU A 53 -3.241 -9.083 -3.640 1.00 0.00 C ATOM 755 CG LEU A 53 -2.552 -8.043 -2.744 1.00 0.00 C ATOM 756 CD1 LEU A 53 -1.724 -7.086 -3.613 1.00 0.00 C ATOM 757 CD2 LEU A 53 -3.578 -7.217 -1.963 1.00 0.00 C ATOM 0 H LEU A 53 -2.441 -11.664 -3.463 1.00 0.00 H new ATOM 0 HA LEU A 53 -4.273 -9.894 -1.928 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -2.512 -9.475 -4.349 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.017 -8.587 -4.222 1.00 0.00 H new ATOM 0 HG LEU A 53 -1.914 -8.578 -2.040 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -1.235 -6.348 -2.977 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -0.969 -7.652 -4.159 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -2.379 -6.578 -4.321 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -3.060 -6.490 -1.338 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -4.232 -6.695 -2.661 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -4.173 -7.878 -1.333 1.00 0.00 H new ATOM 769 N HIS A 54 -6.183 -10.361 -3.594 1.00 0.00 N ATOM 770 CA HIS A 54 -7.272 -10.577 -4.535 1.00 0.00 C ATOM 771 C HIS A 54 -7.935 -9.240 -4.871 1.00 0.00 C ATOM 772 O HIS A 54 -7.961 -8.326 -4.043 1.00 0.00 O ATOM 773 CB HIS A 54 -8.276 -11.578 -3.953 1.00 0.00 C ATOM 774 CG HIS A 54 -7.738 -12.984 -3.927 1.00 0.00 C ATOM 775 ND1 HIS A 54 -7.723 -13.830 -2.845 1.00 0.00 N ATOM 776 CD2 HIS A 54 -7.149 -13.642 -4.973 1.00 0.00 C ATOM 777 CE1 HIS A 54 -7.149 -14.980 -3.232 1.00 0.00 C ATOM 778 NE2 HIS A 54 -6.784 -14.912 -4.523 1.00 0.00 N ATOM 0 H HIS A 54 -6.444 -9.767 -2.807 1.00 0.00 H new ATOM 0 HA HIS A 54 -6.882 -11.001 -5.460 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -8.541 -11.275 -2.940 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -9.192 -11.554 -4.543 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -6.995 -13.249 -5.967 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -7.001 -15.839 -2.595 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -6.329 -15.645 -5.068 1.00 0.00 H new ATOM 786 N PRO A 55 -8.475 -9.093 -6.093 1.00 0.00 N ATOM 787 CA PRO A 55 -9.235 -7.913 -6.452 1.00 0.00 C ATOM 788 C PRO A 55 -10.500 -7.884 -5.601 1.00 0.00 C ATOM 789 O PRO A 55 -11.168 -8.912 -5.434 1.00 0.00 O ATOM 790 CB PRO A 55 -9.493 -8.022 -7.952 1.00 0.00 C ATOM 791 CG PRO A 55 -9.369 -9.511 -8.266 1.00 0.00 C ATOM 792 CD PRO A 55 -8.489 -10.079 -7.161 1.00 0.00 C ATOM 0 HA PRO A 55 -8.720 -6.972 -6.260 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -10.482 -7.645 -8.211 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -8.770 -7.437 -8.521 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -10.346 -9.994 -8.279 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -8.922 -9.671 -9.247 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -8.881 -11.031 -6.804 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -7.480 -10.267 -7.528 1.00 0.00 H new ATOM 800 N GLY A 56 -10.817 -6.714 -5.054 1.00 0.00 N ATOM 801 CA GLY A 56 -11.939 -6.533 -4.151 1.00 0.00 C ATOM 802 C GLY A 56 -11.587 -6.736 -2.671 1.00 0.00 C ATOM 803 O GLY A 56 -12.486 -6.621 -1.837 1.00 0.00 O ATOM 0 H GLY A 56 -10.293 -5.857 -5.230 1.00 0.00 H new ATOM 0 HA2 GLY A 56 -12.341 -5.529 -4.284 1.00 0.00 H new ATOM 0 HA3 GLY A 56 -12.729 -7.232 -4.425 1.00 0.00 H new ATOM 807 N ASP A 57 -10.332 -7.031 -2.303 1.00 0.00 N ATOM 808 CA ASP A 57 -9.886 -6.842 -0.915 1.00 0.00 C ATOM 809 C ASP A 57 -9.931 -5.338 -0.621 1.00 0.00 C ATOM 810 O ASP A 57 -9.590 -4.553 -1.501 1.00 0.00 O ATOM 811 CB ASP A 57 -8.461 -7.372 -0.678 1.00 0.00 C ATOM 812 CG ASP A 57 -8.365 -8.881 -0.452 1.00 0.00 C ATOM 813 OD1 ASP A 57 -9.181 -9.418 0.339 1.00 0.00 O ATOM 814 OD2 ASP A 57 -7.422 -9.514 -0.981 1.00 0.00 O ATOM 0 H ASP A 57 -9.619 -7.395 -2.934 1.00 0.00 H new ATOM 0 HA ASP A 57 -10.543 -7.405 -0.252 1.00 0.00 H new ATOM 0 HB2 ASP A 57 -7.843 -7.108 -1.536 1.00 0.00 H new ATOM 0 HB3 ASP A 57 -8.039 -6.862 0.188 1.00 0.00 H new ATOM 819 N GLU A 58 -10.348 -4.891 0.565 1.00 0.00 N ATOM 820 CA GLU A 58 -10.276 -3.477 0.935 1.00 0.00 C ATOM 821 C GLU A 58 -8.892 -3.190 1.511 1.00 0.00 C ATOM 822 O GLU A 58 -8.465 -3.886 2.424 1.00 0.00 O ATOM 823 CB GLU A 58 -11.334 -3.154 1.989 1.00 0.00 C ATOM 824 CG GLU A 58 -11.643 -1.654 2.100 1.00 0.00 C ATOM 825 CD GLU A 58 -12.850 -1.459 3.015 1.00 0.00 C ATOM 826 OE1 GLU A 58 -13.954 -1.939 2.689 1.00 0.00 O ATOM 827 OE2 GLU A 58 -12.660 -0.933 4.137 1.00 0.00 O ATOM 0 H GLU A 58 -10.741 -5.492 1.289 1.00 0.00 H new ATOM 0 HA GLU A 58 -10.455 -2.863 0.053 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -12.252 -3.690 1.748 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -10.995 -3.521 2.958 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -10.780 -1.121 2.498 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -11.848 -1.238 1.113 1.00 0.00 H new ATOM 834 N LEU A 59 -8.189 -2.178 1.017 1.00 0.00 N ATOM 835 CA LEU A 59 -6.939 -1.711 1.607 1.00 0.00 C ATOM 836 C LEU A 59 -7.216 -0.981 2.916 1.00 0.00 C ATOM 837 O LEU A 59 -8.308 -0.444 3.125 1.00 0.00 O ATOM 838 CB LEU A 59 -6.178 -0.785 0.641 1.00 0.00 C ATOM 839 CG LEU A 59 -5.210 -1.543 -0.285 1.00 0.00 C ATOM 840 CD1 LEU A 59 -4.612 -0.590 -1.319 1.00 0.00 C ATOM 841 CD2 LEU A 59 -4.026 -2.134 0.494 1.00 0.00 C ATOM 0 H LEU A 59 -8.472 -1.654 0.189 1.00 0.00 H new ATOM 0 HA LEU A 59 -6.315 -2.583 1.805 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -6.896 -0.234 0.034 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -5.618 -0.049 1.218 1.00 0.00 H new ATOM 0 HG LEU A 59 -5.790 -2.338 -0.755 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.929 -1.139 -1.968 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -5.412 -0.156 -1.919 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -4.068 0.205 -0.809 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -3.365 -2.661 -0.194 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -3.475 -1.331 0.983 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -4.397 -2.830 1.247 1.00 0.00 H new ATOM 853 N VAL A 60 -6.188 -0.914 3.756 1.00 0.00 N ATOM 854 CA VAL A 60 -6.152 -0.201 5.028 1.00 0.00 C ATOM 855 C VAL A 60 -4.889 0.665 5.041 1.00 0.00 C ATOM 856 O VAL A 60 -4.975 1.882 5.231 1.00 0.00 O ATOM 857 CB VAL A 60 -6.161 -1.187 6.222 1.00 0.00 C ATOM 858 CG1 VAL A 60 -6.525 -0.457 7.521 1.00 0.00 C ATOM 859 CG2 VAL A 60 -7.142 -2.350 6.065 1.00 0.00 C ATOM 0 H VAL A 60 -5.305 -1.384 3.555 1.00 0.00 H new ATOM 0 HA VAL A 60 -7.039 0.424 5.131 1.00 0.00 H new ATOM 0 HB VAL A 60 -5.151 -1.595 6.253 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -6.526 -1.166 8.349 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -5.793 0.327 7.716 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -7.515 -0.012 7.423 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -7.087 -2.994 6.943 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -8.155 -1.960 5.964 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -6.884 -2.926 5.176 1.00 0.00 H new ATOM 869 N TYR A 61 -3.731 0.047 4.786 1.00 0.00 N ATOM 870 CA TYR A 61 -2.422 0.678 4.844 1.00 0.00 C ATOM 871 C TYR A 61 -1.646 0.316 3.591 1.00 0.00 C ATOM 872 O TYR A 61 -1.784 -0.793 3.071 1.00 0.00 O ATOM 873 CB TYR A 61 -1.638 0.187 6.067 1.00 0.00 C ATOM 874 CG TYR A 61 -2.236 0.555 7.407 1.00 0.00 C ATOM 875 CD1 TYR A 61 -1.956 1.810 7.968 1.00 0.00 C ATOM 876 CD2 TYR A 61 -3.053 -0.353 8.102 1.00 0.00 C ATOM 877 CE1 TYR A 61 -2.483 2.167 9.221 1.00 0.00 C ATOM 878 CE2 TYR A 61 -3.586 -0.013 9.354 1.00 0.00 C ATOM 879 CZ TYR A 61 -3.295 1.245 9.922 1.00 0.00 C ATOM 880 OH TYR A 61 -3.828 1.570 11.130 1.00 0.00 O ATOM 0 H TYR A 61 -3.685 -0.938 4.526 1.00 0.00 H new ATOM 0 HA TYR A 61 -2.555 1.757 4.918 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -1.552 -0.898 6.011 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -0.627 0.590 6.016 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -1.330 2.508 7.432 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -3.272 -1.318 7.670 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -2.270 3.137 9.645 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -4.217 -0.712 9.882 1.00 0.00 H new ATOM 0 HH TYR A 61 -4.359 0.818 11.466 1.00 0.00 H new ATOM 890 N VAL A 62 -0.790 1.233 3.156 1.00 0.00 N ATOM 891 CA VAL A 62 0.098 1.081 2.015 1.00 0.00 C ATOM 892 C VAL A 62 1.427 1.665 2.457 1.00 0.00 C ATOM 893 O VAL A 62 1.459 2.809 2.904 1.00 0.00 O ATOM 894 CB VAL A 62 -0.486 1.801 0.785 1.00 0.00 C ATOM 895 CG1 VAL A 62 0.543 1.892 -0.353 1.00 0.00 C ATOM 896 CG2 VAL A 62 -1.737 1.056 0.292 1.00 0.00 C ATOM 0 H VAL A 62 -0.693 2.141 3.610 1.00 0.00 H new ATOM 0 HA VAL A 62 0.222 0.041 1.713 1.00 0.00 H new ATOM 0 HB VAL A 62 -0.753 2.815 1.083 1.00 0.00 H new ATOM 0 HG11 VAL A 62 0.098 2.406 -1.205 1.00 0.00 H new ATOM 0 HG12 VAL A 62 1.416 2.447 -0.010 1.00 0.00 H new ATOM 0 HG13 VAL A 62 0.845 0.888 -0.652 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -2.147 1.569 -0.578 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -1.469 0.036 0.019 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -2.484 1.035 1.085 1.00 0.00 H new ATOM 906 N ASP A 63 2.490 0.861 2.413 1.00 0.00 N ATOM 907 CA ASP A 63 3.823 1.109 2.984 1.00 0.00 C ATOM 908 C ASP A 63 3.786 1.229 4.520 1.00 0.00 C ATOM 909 O ASP A 63 4.815 1.309 5.193 1.00 0.00 O ATOM 910 CB ASP A 63 4.475 2.315 2.288 1.00 0.00 C ATOM 911 CG ASP A 63 6.002 2.313 2.361 1.00 0.00 C ATOM 912 OD1 ASP A 63 6.632 1.289 2.011 1.00 0.00 O ATOM 913 OD2 ASP A 63 6.568 3.394 2.633 1.00 0.00 O ATOM 0 H ASP A 63 2.444 -0.045 1.946 1.00 0.00 H new ATOM 0 HA ASP A 63 4.455 0.243 2.789 1.00 0.00 H new ATOM 0 HB2 ASP A 63 4.170 2.328 1.242 1.00 0.00 H new ATOM 0 HB3 ASP A 63 4.099 3.232 2.741 1.00 0.00 H new ATOM 918 N GLY A 64 2.588 1.148 5.104 1.00 0.00 N ATOM 919 CA GLY A 64 2.272 1.377 6.504 1.00 0.00 C ATOM 920 C GLY A 64 1.491 2.672 6.712 1.00 0.00 C ATOM 921 O GLY A 64 1.092 2.964 7.836 1.00 0.00 O ATOM 0 H GLY A 64 1.757 0.902 4.566 1.00 0.00 H new ATOM 0 HA2 GLY A 64 1.690 0.538 6.886 1.00 0.00 H new ATOM 0 HA3 GLY A 64 3.195 1.414 7.082 1.00 0.00 H new ATOM 925 N ILE A 65 1.244 3.465 5.665 1.00 0.00 N ATOM 926 CA ILE A 65 0.596 4.750 5.785 1.00 0.00 C ATOM 927 C ILE A 65 -0.889 4.493 5.506 1.00 0.00 C ATOM 928 O ILE A 65 -1.230 3.860 4.500 1.00 0.00 O ATOM 929 CB ILE A 65 1.247 5.740 4.801 1.00 0.00 C ATOM 930 CG1 ILE A 65 2.758 5.508 4.547 1.00 0.00 C ATOM 931 CG2 ILE A 65 1.010 7.179 5.271 1.00 0.00 C ATOM 932 CD1 ILE A 65 3.733 5.388 5.720 1.00 0.00 C ATOM 0 H ILE A 65 1.495 3.220 4.707 1.00 0.00 H new ATOM 0 HA ILE A 65 0.702 5.202 6.771 1.00 0.00 H new ATOM 0 HB ILE A 65 0.760 5.560 3.843 1.00 0.00 H new ATOM 0 HG12 ILE A 65 2.849 4.595 3.958 1.00 0.00 H new ATOM 0 HG13 ILE A 65 3.108 6.328 3.920 1.00 0.00 H new ATOM 0 HG21 ILE A 65 1.474 7.872 4.569 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -0.061 7.374 5.319 1.00 0.00 H new ATOM 0 HG23 ILE A 65 1.449 7.316 6.259 1.00 0.00 H new ATOM 0 HD11 ILE A 65 4.742 5.228 5.340 1.00 0.00 H new ATOM 0 HD12 ILE A 65 3.708 6.305 6.309 1.00 0.00 H new ATOM 0 HD13 ILE A 65 3.445 4.545 6.348 1.00 0.00 H new ATOM 944 N PRO A 66 -1.783 4.887 6.422 1.00 0.00 N ATOM 945 CA PRO A 66 -3.198 4.586 6.329 1.00 0.00 C ATOM 946 C PRO A 66 -3.788 5.388 5.184 1.00 0.00 C ATOM 947 O PRO A 66 -3.640 6.615 5.127 1.00 0.00 O ATOM 948 CB PRO A 66 -3.826 4.949 7.674 1.00 0.00 C ATOM 949 CG PRO A 66 -2.784 5.842 8.340 1.00 0.00 C ATOM 950 CD PRO A 66 -1.468 5.570 7.653 1.00 0.00 C ATOM 0 HA PRO A 66 -3.389 3.533 6.124 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -4.774 5.471 7.544 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -4.031 4.061 8.272 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -3.059 6.893 8.245 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -2.715 5.625 9.406 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -0.934 6.499 7.455 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -0.821 4.958 8.282 1.00 0.00 H new ATOM 958 N VAL A 67 -4.468 4.690 4.281 1.00 0.00 N ATOM 959 CA VAL A 67 -5.176 5.289 3.158 1.00 0.00 C ATOM 960 C VAL A 67 -6.626 5.622 3.549 1.00 0.00 C ATOM 961 O VAL A 67 -7.375 6.190 2.757 1.00 0.00 O ATOM 962 CB VAL A 67 -5.052 4.370 1.920 1.00 0.00 C ATOM 963 CG1 VAL A 67 -3.572 4.098 1.585 1.00 0.00 C ATOM 964 CG2 VAL A 67 -5.741 3.004 2.061 1.00 0.00 C ATOM 0 H VAL A 67 -4.543 3.673 4.311 1.00 0.00 H new ATOM 0 HA VAL A 67 -4.722 6.242 2.886 1.00 0.00 H new ATOM 0 HB VAL A 67 -5.558 4.923 1.129 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -3.510 3.450 0.711 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -3.068 5.041 1.374 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -3.091 3.611 2.433 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -5.601 2.430 1.145 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -5.305 2.461 2.900 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -6.807 3.150 2.238 1.00 0.00 H new ATOM 974 N ALA A 68 -7.038 5.280 4.774 1.00 0.00 N ATOM 975 CA ALA A 68 -8.422 5.326 5.204 1.00 0.00 C ATOM 976 C ALA A 68 -8.913 6.772 5.291 1.00 0.00 C ATOM 977 O ALA A 68 -8.376 7.595 6.034 1.00 0.00 O ATOM 978 CB ALA A 68 -8.553 4.593 6.536 1.00 0.00 C ATOM 0 H ALA A 68 -6.399 4.959 5.502 1.00 0.00 H new ATOM 0 HA ALA A 68 -9.055 4.825 4.472 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -9.591 4.623 6.867 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -8.241 3.556 6.413 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -7.921 5.076 7.281 1.00 0.00 H new ATOM 984 N GLY A 69 -9.950 7.093 4.521 1.00 0.00 N ATOM 985 CA GLY A 69 -10.542 8.421 4.436 1.00 0.00 C ATOM 986 C GLY A 69 -9.767 9.353 3.516 1.00 0.00 C ATOM 987 O GLY A 69 -10.275 10.413 3.160 1.00 0.00 O ATOM 0 H GLY A 69 -10.415 6.412 3.920 1.00 0.00 H new ATOM 0 HA2 GLY A 69 -11.568 8.334 4.078 1.00 0.00 H new ATOM 0 HA3 GLY A 69 -10.588 8.858 5.434 1.00 0.00 H new ATOM 991 N LYS A 70 -8.558 8.981 3.106 1.00 0.00 N ATOM 992 CA LYS A 70 -7.818 9.600 2.023 1.00 0.00 C ATOM 993 C LYS A 70 -8.393 9.078 0.705 1.00 0.00 C ATOM 994 O LYS A 70 -9.306 8.243 0.696 1.00 0.00 O ATOM 995 CB LYS A 70 -6.334 9.251 2.195 1.00 0.00 C ATOM 996 CG LYS A 70 -5.824 9.491 3.632 1.00 0.00 C ATOM 997 CD LYS A 70 -5.817 10.981 3.978 1.00 0.00 C ATOM 998 CE LYS A 70 -5.032 11.272 5.259 1.00 0.00 C ATOM 999 NZ LYS A 70 -5.836 11.086 6.485 1.00 0.00 N ATOM 0 H LYS A 70 -8.051 8.209 3.539 1.00 0.00 H new ATOM 0 HA LYS A 70 -7.907 10.686 2.026 1.00 0.00 H new ATOM 0 HB2 LYS A 70 -6.179 8.205 1.929 1.00 0.00 H new ATOM 0 HB3 LYS A 70 -5.743 9.848 1.500 1.00 0.00 H new ATOM 0 HG2 LYS A 70 -6.457 8.954 4.339 1.00 0.00 H new ATOM 0 HG3 LYS A 70 -4.817 9.087 3.735 1.00 0.00 H new ATOM 0 HD2 LYS A 70 -5.382 11.542 3.151 1.00 0.00 H new ATOM 0 HD3 LYS A 70 -6.843 11.330 4.095 1.00 0.00 H new ATOM 0 HE2 LYS A 70 -4.160 10.619 5.300 1.00 0.00 H new ATOM 0 HE3 LYS A 70 -4.661 12.297 5.226 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 -5.252 11.297 7.319 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 -6.654 11.728 6.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 -6.169 10.102 6.536 1.00 0.00 H new ATOM 1013 N THR A 71 -7.875 9.577 -0.405 1.00 0.00 N ATOM 1014 CA THR A 71 -8.406 9.311 -1.731 1.00 0.00 C ATOM 1015 C THR A 71 -7.502 8.325 -2.482 1.00 0.00 C ATOM 1016 O THR A 71 -6.430 7.959 -2.000 1.00 0.00 O ATOM 1017 CB THR A 71 -8.563 10.665 -2.443 1.00 0.00 C ATOM 1018 OG1 THR A 71 -7.337 11.373 -2.350 1.00 0.00 O ATOM 1019 CG2 THR A 71 -9.701 11.494 -1.826 1.00 0.00 C ATOM 0 H THR A 71 -7.059 10.189 -0.410 1.00 0.00 H new ATOM 0 HA THR A 71 -9.383 8.829 -1.685 1.00 0.00 H new ATOM 0 HB THR A 71 -8.817 10.488 -3.488 1.00 0.00 H new ATOM 0 HG1 THR A 71 -7.424 12.238 -2.802 1.00 0.00 H new ATOM 0 HG21 THR A 71 -9.785 12.445 -2.352 1.00 0.00 H new ATOM 0 HG22 THR A 71 -10.639 10.946 -1.914 1.00 0.00 H new ATOM 0 HG23 THR A 71 -9.487 11.680 -0.774 1.00 0.00 H new ATOM 1027 N HIS A 72 -7.903 7.904 -3.681 1.00 0.00 N ATOM 1028 CA HIS A 72 -7.078 7.126 -4.599 1.00 0.00 C ATOM 1029 C HIS A 72 -5.723 7.808 -4.824 1.00 0.00 C ATOM 1030 O HIS A 72 -4.676 7.173 -4.678 1.00 0.00 O ATOM 1031 CB HIS A 72 -7.864 6.910 -5.901 1.00 0.00 C ATOM 1032 CG HIS A 72 -7.037 6.484 -7.081 1.00 0.00 C ATOM 1033 ND1 HIS A 72 -6.432 7.333 -7.979 1.00 0.00 N ATOM 1034 CD2 HIS A 72 -6.770 5.198 -7.466 1.00 0.00 C ATOM 1035 CE1 HIS A 72 -5.788 6.566 -8.869 1.00 0.00 C ATOM 1036 NE2 HIS A 72 -5.971 5.260 -8.609 1.00 0.00 N ATOM 0 H HIS A 72 -8.834 8.100 -4.048 1.00 0.00 H new ATOM 0 HA HIS A 72 -6.852 6.149 -4.173 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -8.631 6.156 -5.723 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -8.380 7.836 -6.154 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -7.114 4.300 -6.975 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -5.198 6.948 -9.689 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -5.600 4.472 -9.140 1.00 0.00 H new ATOM 1044 N ARG A 73 -5.723 9.114 -5.119 1.00 0.00 N ATOM 1045 CA ARG A 73 -4.497 9.878 -5.350 1.00 0.00 C ATOM 1046 C ARG A 73 -3.507 9.785 -4.185 1.00 0.00 C ATOM 1047 O ARG A 73 -2.296 9.797 -4.420 1.00 0.00 O ATOM 1048 CB ARG A 73 -4.851 11.325 -5.657 1.00 0.00 C ATOM 1049 CG ARG A 73 -3.535 12.072 -5.877 1.00 0.00 C ATOM 1050 CD ARG A 73 -3.684 13.281 -6.766 1.00 0.00 C ATOM 1051 NE ARG A 73 -2.611 14.235 -6.444 1.00 0.00 N ATOM 1052 CZ ARG A 73 -2.649 15.104 -5.425 1.00 0.00 C ATOM 1053 NH1 ARG A 73 -3.799 15.476 -4.860 1.00 0.00 N ATOM 1054 NH2 ARG A 73 -1.514 15.572 -4.925 1.00 0.00 N ATOM 0 H ARG A 73 -6.575 9.668 -5.204 1.00 0.00 H new ATOM 0 HA ARG A 73 -3.989 9.437 -6.208 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -5.482 11.388 -6.543 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -5.412 11.767 -4.834 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -3.136 12.385 -4.912 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -2.807 11.391 -6.318 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -3.628 12.989 -7.815 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -4.659 13.744 -6.615 1.00 0.00 H new ATOM 0 HE ARG A 73 -1.781 14.235 -7.037 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -4.682 15.097 -5.203 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -3.795 16.140 -4.085 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -0.622 15.270 -5.316 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -1.533 16.234 -4.149 1.00 0.00 H new ATOM 1068 N TYR A 74 -3.993 9.719 -2.945 1.00 0.00 N ATOM 1069 CA TYR A 74 -3.139 9.522 -1.773 1.00 0.00 C ATOM 1070 C TYR A 74 -2.254 8.295 -2.005 1.00 0.00 C ATOM 1071 O TYR A 74 -1.033 8.383 -1.905 1.00 0.00 O ATOM 1072 CB TYR A 74 -4.001 9.415 -0.518 1.00 0.00 C ATOM 1073 CG TYR A 74 -3.257 9.321 0.798 1.00 0.00 C ATOM 1074 CD1 TYR A 74 -2.927 8.052 1.301 1.00 0.00 C ATOM 1075 CD2 TYR A 74 -3.049 10.464 1.593 1.00 0.00 C ATOM 1076 CE1 TYR A 74 -2.431 7.910 2.605 1.00 0.00 C ATOM 1077 CE2 TYR A 74 -2.538 10.332 2.898 1.00 0.00 C ATOM 1078 CZ TYR A 74 -2.270 9.047 3.425 1.00 0.00 C ATOM 1079 OH TYR A 74 -2.002 8.882 4.749 1.00 0.00 O ATOM 0 H TYR A 74 -4.986 9.800 -2.725 1.00 0.00 H new ATOM 0 HA TYR A 74 -2.479 10.376 -1.622 1.00 0.00 H new ATOM 0 HB2 TYR A 74 -4.658 10.284 -0.479 1.00 0.00 H new ATOM 0 HB3 TYR A 74 -4.639 8.537 -0.614 1.00 0.00 H new ATOM 0 HD1 TYR A 74 -3.056 7.179 0.679 1.00 0.00 H new ATOM 0 HD2 TYR A 74 -3.282 11.443 1.201 1.00 0.00 H new ATOM 0 HE1 TYR A 74 -2.172 6.931 2.981 1.00 0.00 H new ATOM 0 HE2 TYR A 74 -2.351 11.211 3.496 1.00 0.00 H new ATOM 0 HH TYR A 74 -2.499 8.109 5.089 1.00 0.00 H new ATOM 1089 N VAL A 75 -2.858 7.174 -2.402 1.00 0.00 N ATOM 1090 CA VAL A 75 -2.169 5.915 -2.627 1.00 0.00 C ATOM 1091 C VAL A 75 -1.250 6.006 -3.846 1.00 0.00 C ATOM 1092 O VAL A 75 -0.139 5.502 -3.790 1.00 0.00 O ATOM 1093 CB VAL A 75 -3.188 4.773 -2.812 1.00 0.00 C ATOM 1094 CG1 VAL A 75 -2.462 3.466 -2.500 1.00 0.00 C ATOM 1095 CG2 VAL A 75 -4.427 4.895 -1.910 1.00 0.00 C ATOM 0 H VAL A 75 -3.861 7.121 -2.578 1.00 0.00 H new ATOM 0 HA VAL A 75 -1.555 5.702 -1.752 1.00 0.00 H new ATOM 0 HB VAL A 75 -3.559 4.813 -3.836 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -3.151 2.630 -2.620 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -1.622 3.345 -3.183 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -2.095 3.490 -1.474 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -5.097 4.056 -2.097 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -4.118 4.887 -0.865 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -4.945 5.829 -2.128 1.00 0.00 H new ATOM 1105 N ILE A 76 -1.664 6.654 -4.936 1.00 0.00 N ATOM 1106 CA ILE A 76 -0.825 6.840 -6.126 1.00 0.00 C ATOM 1107 C ILE A 76 0.546 7.407 -5.754 1.00 0.00 C ATOM 1108 O ILE A 76 1.568 6.956 -6.283 1.00 0.00 O ATOM 1109 CB ILE A 76 -1.577 7.730 -7.147 1.00 0.00 C ATOM 1110 CG1 ILE A 76 -2.797 7.007 -7.751 1.00 0.00 C ATOM 1111 CG2 ILE A 76 -0.699 8.296 -8.273 1.00 0.00 C ATOM 1112 CD1 ILE A 76 -2.499 5.614 -8.321 1.00 0.00 C ATOM 0 H ILE A 76 -2.593 7.067 -5.021 1.00 0.00 H new ATOM 0 HA ILE A 76 -0.635 5.873 -6.592 1.00 0.00 H new ATOM 0 HB ILE A 76 -1.913 8.583 -6.558 1.00 0.00 H new ATOM 0 HG12 ILE A 76 -3.564 6.914 -6.982 1.00 0.00 H new ATOM 0 HG13 ILE A 76 -3.214 7.628 -8.544 1.00 0.00 H new ATOM 0 HG21 ILE A 76 -1.310 8.906 -8.939 1.00 0.00 H new ATOM 0 HG22 ILE A 76 0.093 8.910 -7.843 1.00 0.00 H new ATOM 0 HG23 ILE A 76 -0.256 7.475 -8.837 1.00 0.00 H new ATOM 0 HD11 ILE A 76 -3.415 5.182 -8.724 1.00 0.00 H new ATOM 0 HD12 ILE A 76 -1.757 5.697 -9.115 1.00 0.00 H new ATOM 0 HD13 ILE A 76 -2.113 4.972 -7.529 1.00 0.00 H new ATOM 1124 N ASP A 77 0.566 8.379 -4.844 1.00 0.00 N ATOM 1125 CA ASP A 77 1.801 9.003 -4.385 1.00 0.00 C ATOM 1126 C ASP A 77 2.597 8.036 -3.502 1.00 0.00 C ATOM 1127 O ASP A 77 3.817 7.946 -3.649 1.00 0.00 O ATOM 1128 CB ASP A 77 1.465 10.310 -3.649 1.00 0.00 C ATOM 1129 CG ASP A 77 2.251 11.505 -4.192 1.00 0.00 C ATOM 1130 OD1 ASP A 77 2.211 11.734 -5.424 1.00 0.00 O ATOM 1131 OD2 ASP A 77 2.704 12.347 -3.387 1.00 0.00 O ATOM 0 H ASP A 77 -0.275 8.755 -4.405 1.00 0.00 H new ATOM 0 HA ASP A 77 2.432 9.244 -5.240 1.00 0.00 H new ATOM 0 HB2 ASP A 77 0.397 10.510 -3.739 1.00 0.00 H new ATOM 0 HB3 ASP A 77 1.679 10.191 -2.587 1.00 0.00 H new ATOM 1136 N LEU A 78 1.916 7.259 -2.642 1.00 0.00 N ATOM 1137 CA LEU A 78 2.547 6.193 -1.862 1.00 0.00 C ATOM 1138 C LEU A 78 3.234 5.192 -2.780 1.00 0.00 C ATOM 1139 O LEU A 78 4.382 4.840 -2.538 1.00 0.00 O ATOM 1140 CB LEU A 78 1.552 5.394 -0.993 1.00 0.00 C ATOM 1141 CG LEU A 78 1.234 5.826 0.438 1.00 0.00 C ATOM 1142 CD1 LEU A 78 2.427 6.444 1.167 1.00 0.00 C ATOM 1143 CD2 LEU A 78 0.053 6.755 0.657 1.00 0.00 C ATOM 0 H LEU A 78 0.915 7.356 -2.472 1.00 0.00 H new ATOM 0 HA LEU A 78 3.257 6.702 -1.210 1.00 0.00 H new ATOM 0 HB2 LEU A 78 0.607 5.364 -1.535 1.00 0.00 H new ATOM 0 HB3 LEU A 78 1.923 4.370 -0.943 1.00 0.00 H new ATOM 0 HG LEU A 78 0.956 4.858 0.854 1.00 0.00 H new ATOM 0 HD11 LEU A 78 2.129 6.727 2.177 1.00 0.00 H new ATOM 0 HD12 LEU A 78 3.238 5.718 1.218 1.00 0.00 H new ATOM 0 HD13 LEU A 78 2.765 7.328 0.627 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.047 6.972 1.720 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.215 7.684 0.111 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -0.858 6.277 0.297 1.00 0.00 H new ATOM 1155 N MET A 79 2.542 4.694 -3.801 1.00 0.00 N ATOM 1156 CA MET A 79 3.095 3.712 -4.714 1.00 0.00 C ATOM 1157 C MET A 79 4.342 4.253 -5.407 1.00 0.00 C ATOM 1158 O MET A 79 5.311 3.508 -5.564 1.00 0.00 O ATOM 1159 CB MET A 79 2.042 3.298 -5.746 1.00 0.00 C ATOM 1160 CG MET A 79 0.791 2.651 -5.149 1.00 0.00 C ATOM 1161 SD MET A 79 1.023 1.431 -3.835 1.00 0.00 S ATOM 1162 CE MET A 79 2.116 0.274 -4.682 1.00 0.00 C ATOM 0 H MET A 79 1.582 4.964 -4.014 1.00 0.00 H new ATOM 0 HA MET A 79 3.385 2.833 -4.138 1.00 0.00 H new ATOM 0 HB2 MET A 79 1.744 4.178 -6.316 1.00 0.00 H new ATOM 0 HB3 MET A 79 2.496 2.601 -6.450 1.00 0.00 H new ATOM 0 HG2 MET A 79 0.155 3.446 -4.760 1.00 0.00 H new ATOM 0 HG3 MET A 79 0.242 2.171 -5.959 1.00 0.00 H new ATOM 0 HE1 MET A 79 2.002 -0.719 -4.247 1.00 0.00 H new ATOM 0 HE2 MET A 79 1.858 0.238 -5.740 1.00 0.00 H new ATOM 0 HE3 MET A 79 3.149 0.603 -4.572 1.00 0.00 H new ATOM 1172 N HIS A 80 4.342 5.530 -5.804 1.00 0.00 N ATOM 1173 CA HIS A 80 5.497 6.134 -6.456 1.00 0.00 C ATOM 1174 C HIS A 80 6.695 6.219 -5.505 1.00 0.00 C ATOM 1175 O HIS A 80 7.827 6.107 -5.981 1.00 0.00 O ATOM 1176 CB HIS A 80 5.143 7.516 -7.035 1.00 0.00 C ATOM 1177 CG HIS A 80 5.172 7.567 -8.544 1.00 0.00 C ATOM 1178 ND1 HIS A 80 6.175 7.088 -9.363 1.00 0.00 N ATOM 1179 CD2 HIS A 80 4.217 8.134 -9.345 1.00 0.00 C ATOM 1180 CE1 HIS A 80 5.825 7.367 -10.629 1.00 0.00 C ATOM 1181 NE2 HIS A 80 4.642 8.004 -10.675 1.00 0.00 N ATOM 0 H HIS A 80 3.551 6.162 -5.682 1.00 0.00 H new ATOM 0 HA HIS A 80 5.785 5.488 -7.286 1.00 0.00 H new ATOM 0 HB2 HIS A 80 4.149 7.801 -6.690 1.00 0.00 H new ATOM 0 HB3 HIS A 80 5.841 8.255 -6.642 1.00 0.00 H new ATOM 0 HD2 HIS A 80 3.300 8.598 -9.012 1.00 0.00 H new ATOM 0 HE1 HIS A 80 6.416 7.113 -11.496 1.00 0.00 H new ATOM 0 HE2 HIS A 80 4.152 8.328 -11.509 1.00 0.00 H new ATOM 1189 N HIS A 81 6.462 6.403 -4.199 1.00 0.00 N ATOM 1190 CA HIS A 81 7.464 6.346 -3.145 1.00 0.00 C ATOM 1191 C HIS A 81 7.948 4.912 -2.921 1.00 0.00 C ATOM 1192 O HIS A 81 9.139 4.630 -3.010 1.00 0.00 O ATOM 1193 CB HIS A 81 6.855 6.882 -1.839 1.00 0.00 C ATOM 1194 CG HIS A 81 7.086 8.339 -1.588 1.00 0.00 C ATOM 1195 ND1 HIS A 81 8.268 8.880 -1.152 1.00 0.00 N ATOM 1196 CD2 HIS A 81 6.141 9.327 -1.583 1.00 0.00 C ATOM 1197 CE1 HIS A 81 8.047 10.171 -0.875 1.00 0.00 C ATOM 1198 NE2 HIS A 81 6.761 10.490 -1.110 1.00 0.00 N ATOM 0 H HIS A 81 5.528 6.604 -3.841 1.00 0.00 H new ATOM 0 HA HIS A 81 8.316 6.955 -3.446 1.00 0.00 H new ATOM 0 HB2 HIS A 81 5.781 6.696 -1.853 1.00 0.00 H new ATOM 0 HB3 HIS A 81 7.266 6.315 -1.004 1.00 0.00 H new ATOM 0 HD2 HIS A 81 5.109 9.229 -1.887 1.00 0.00 H new ATOM 0 HE1 HIS A 81 8.796 10.860 -0.514 1.00 0.00 H new ATOM 0 HE2 HIS A 81 6.323 11.401 -0.971 1.00 0.00 H new ATOM 1206 N ALA A 82 7.032 3.997 -2.613 1.00 0.00 N ATOM 1207 CA ALA A 82 7.343 2.634 -2.217 1.00 0.00 C ATOM 1208 C ALA A 82 8.032 1.867 -3.353 1.00 0.00 C ATOM 1209 O ALA A 82 8.872 1.001 -3.110 1.00 0.00 O ATOM 1210 CB ALA A 82 6.053 1.950 -1.765 1.00 0.00 C ATOM 0 H ALA A 82 6.031 4.191 -2.634 1.00 0.00 H new ATOM 0 HA ALA A 82 8.048 2.645 -1.386 1.00 0.00 H new ATOM 0 HB1 ALA A 82 6.271 0.925 -1.464 1.00 0.00 H new ATOM 0 HB2 ALA A 82 5.630 2.494 -0.921 1.00 0.00 H new ATOM 0 HB3 ALA A 82 5.338 1.943 -2.587 1.00 0.00 H new ATOM 1216 N ALA A 83 7.763 2.219 -4.615 1.00 0.00 N ATOM 1217 CA ALA A 83 8.546 1.695 -5.723 1.00 0.00 C ATOM 1218 C ALA A 83 10.038 2.025 -5.551 1.00 0.00 C ATOM 1219 O ALA A 83 10.880 1.187 -5.871 1.00 0.00 O ATOM 1220 CB ALA A 83 8.003 2.213 -7.058 1.00 0.00 C ATOM 0 H ALA A 83 7.016 2.858 -4.886 1.00 0.00 H new ATOM 0 HA ALA A 83 8.454 0.609 -5.725 1.00 0.00 H new ATOM 0 HB1 ALA A 83 8.602 1.810 -7.875 1.00 0.00 H new ATOM 0 HB2 ALA A 83 6.967 1.896 -7.177 1.00 0.00 H new ATOM 0 HB3 ALA A 83 8.054 3.302 -7.074 1.00 0.00 H new ATOM 1226 N ARG A 84 10.388 3.206 -5.028 1.00 0.00 N ATOM 1227 CA ARG A 84 11.774 3.579 -4.743 1.00 0.00 C ATOM 1228 C ARG A 84 12.313 2.851 -3.517 1.00 0.00 C ATOM 1229 O ARG A 84 13.473 2.449 -3.563 1.00 0.00 O ATOM 1230 CB ARG A 84 11.945 5.088 -4.527 1.00 0.00 C ATOM 1231 CG ARG A 84 11.204 5.965 -5.543 1.00 0.00 C ATOM 1232 CD ARG A 84 11.825 7.361 -5.582 1.00 0.00 C ATOM 1233 NE ARG A 84 11.266 8.180 -6.671 1.00 0.00 N ATOM 1234 CZ ARG A 84 11.959 8.980 -7.487 1.00 0.00 C ATOM 1235 NH1 ARG A 84 13.273 9.109 -7.371 1.00 0.00 N ATOM 1236 NH2 ARG A 84 11.339 9.666 -8.438 1.00 0.00 N ATOM 0 H ARG A 84 9.712 3.932 -4.790 1.00 0.00 H new ATOM 0 HA ARG A 84 12.341 3.283 -5.626 1.00 0.00 H new ATOM 0 HB2 ARG A 84 11.596 5.340 -3.526 1.00 0.00 H new ATOM 0 HB3 ARG A 84 13.007 5.329 -4.565 1.00 0.00 H new ATOM 0 HG2 ARG A 84 11.252 5.509 -6.532 1.00 0.00 H new ATOM 0 HG3 ARG A 84 10.150 6.035 -5.275 1.00 0.00 H new ATOM 0 HD2 ARG A 84 11.656 7.861 -4.628 1.00 0.00 H new ATOM 0 HD3 ARG A 84 12.904 7.275 -5.709 1.00 0.00 H new ATOM 0 HE ARG A 84 10.257 8.132 -6.816 1.00 0.00 H new ATOM 0 HH11 ARG A 84 13.774 8.592 -6.649 1.00 0.00 H new ATOM 0 HH12 ARG A 84 13.783 9.725 -8.004 1.00 0.00 H new ATOM 0 HH21 ARG A 84 10.328 9.584 -8.549 1.00 0.00 H new ATOM 0 HH22 ARG A 84 11.873 10.275 -9.058 1.00 0.00 H new ATOM 1250 N ASN A 85 11.487 2.611 -2.484 1.00 0.00 N ATOM 1251 CA ASN A 85 11.873 1.759 -1.345 1.00 0.00 C ATOM 1252 C ASN A 85 12.284 0.374 -1.843 1.00 0.00 C ATOM 1253 O ASN A 85 13.021 -0.333 -1.161 1.00 0.00 O ATOM 1254 CB ASN A 85 10.737 1.534 -0.316 1.00 0.00 C ATOM 1255 CG ASN A 85 10.415 2.696 0.609 1.00 0.00 C ATOM 1256 OD1 ASN A 85 11.206 3.620 0.788 1.00 0.00 O ATOM 1257 ND2 ASN A 85 9.256 2.676 1.242 1.00 0.00 N ATOM 0 H ASN A 85 10.545 2.996 -2.414 1.00 0.00 H new ATOM 0 HA ASN A 85 12.689 2.291 -0.857 1.00 0.00 H new ATOM 0 HB2 ASN A 85 9.830 1.272 -0.862 1.00 0.00 H new ATOM 0 HB3 ASN A 85 11.000 0.673 0.298 1.00 0.00 H new ATOM 0 HD21 ASN A 85 9.012 3.430 1.884 1.00 0.00 H new ATOM 0 HD22 ASN A 85 8.604 1.906 1.089 1.00 0.00 H new ATOM 1264 N GLY A 86 11.769 -0.041 -3.002 1.00 0.00 N ATOM 1265 CA GLY A 86 11.996 -1.355 -3.562 1.00 0.00 C ATOM 1266 C GLY A 86 11.092 -2.401 -2.921 1.00 0.00 C ATOM 1267 O GLY A 86 11.253 -3.588 -3.192 1.00 0.00 O ATOM 0 H GLY A 86 11.171 0.547 -3.582 1.00 0.00 H new ATOM 0 HA2 GLY A 86 11.818 -1.329 -4.637 1.00 0.00 H new ATOM 0 HA3 GLY A 86 13.039 -1.637 -3.418 1.00 0.00 H new ATOM 1271 N GLN A 87 10.113 -2.000 -2.107 1.00 0.00 N ATOM 1272 CA GLN A 87 9.063 -2.865 -1.601 1.00 0.00 C ATOM 1273 C GLN A 87 7.896 -2.016 -1.135 1.00 0.00 C ATOM 1274 O GLN A 87 8.034 -0.806 -0.955 1.00 0.00 O ATOM 1275 CB GLN A 87 9.582 -3.754 -0.456 1.00 0.00 C ATOM 1276 CG GLN A 87 10.087 -2.968 0.769 1.00 0.00 C ATOM 1277 CD GLN A 87 11.418 -3.533 1.247 1.00 0.00 C ATOM 1278 OE1 GLN A 87 12.440 -3.342 0.597 1.00 0.00 O ATOM 1279 NE2 GLN A 87 11.434 -4.260 2.349 1.00 0.00 N ATOM 0 H GLN A 87 10.033 -1.038 -1.777 1.00 0.00 H new ATOM 0 HA GLN A 87 8.731 -3.525 -2.402 1.00 0.00 H new ATOM 0 HB2 GLN A 87 8.783 -4.425 -0.140 1.00 0.00 H new ATOM 0 HB3 GLN A 87 10.392 -4.378 -0.833 1.00 0.00 H new ATOM 0 HG2 GLN A 87 10.202 -1.915 0.512 1.00 0.00 H new ATOM 0 HG3 GLN A 87 9.352 -3.021 1.572 1.00 0.00 H new ATOM 0 HE21 GLN A 87 10.573 -4.407 2.876 1.00 0.00 H new ATOM 0 HE22 GLN A 87 12.308 -4.675 2.674 1.00 0.00 H new ATOM 1288 N VAL A 88 6.758 -2.663 -0.926 1.00 0.00 N ATOM 1289 CA VAL A 88 5.599 -2.071 -0.310 1.00 0.00 C ATOM 1290 C VAL A 88 4.945 -3.161 0.524 1.00 0.00 C ATOM 1291 O VAL A 88 4.661 -4.259 0.033 1.00 0.00 O ATOM 1292 CB VAL A 88 4.689 -1.456 -1.395 1.00 0.00 C ATOM 1293 CG1 VAL A 88 4.045 -2.493 -2.329 1.00 0.00 C ATOM 1294 CG2 VAL A 88 3.614 -0.566 -0.761 1.00 0.00 C ATOM 0 H VAL A 88 6.621 -3.639 -1.190 1.00 0.00 H new ATOM 0 HA VAL A 88 5.843 -1.241 0.352 1.00 0.00 H new ATOM 0 HB VAL A 88 5.343 -0.849 -2.022 1.00 0.00 H new ATOM 0 HG11 VAL A 88 3.421 -1.983 -3.063 1.00 0.00 H new ATOM 0 HG12 VAL A 88 4.825 -3.054 -2.843 1.00 0.00 H new ATOM 0 HG13 VAL A 88 3.431 -3.178 -1.744 1.00 0.00 H new ATOM 0 HG21 VAL A 88 2.984 -0.143 -1.543 1.00 0.00 H new ATOM 0 HG22 VAL A 88 3.001 -1.162 -0.084 1.00 0.00 H new ATOM 0 HG23 VAL A 88 4.091 0.240 -0.204 1.00 0.00 H new ATOM 1304 N ASN A 89 4.701 -2.875 1.792 1.00 0.00 N ATOM 1305 CA ASN A 89 3.741 -3.616 2.595 1.00 0.00 C ATOM 1306 C ASN A 89 2.341 -3.076 2.273 1.00 0.00 C ATOM 1307 O ASN A 89 2.181 -1.869 2.108 1.00 0.00 O ATOM 1308 CB ASN A 89 4.116 -3.462 4.075 1.00 0.00 C ATOM 1309 CG ASN A 89 4.702 -4.766 4.614 1.00 0.00 C ATOM 1310 OD1 ASN A 89 5.715 -5.264 4.126 1.00 0.00 O ATOM 1311 ND2 ASN A 89 4.081 -5.367 5.613 1.00 0.00 N ATOM 0 H ASN A 89 5.165 -2.119 2.296 1.00 0.00 H new ATOM 0 HA ASN A 89 3.750 -4.683 2.370 1.00 0.00 H new ATOM 0 HB2 ASN A 89 4.840 -2.655 4.191 1.00 0.00 H new ATOM 0 HB3 ASN A 89 3.234 -3.186 4.653 1.00 0.00 H new ATOM 0 HD21 ASN A 89 4.441 -6.247 5.982 1.00 0.00 H new ATOM 0 HD22 ASN A 89 3.241 -4.951 6.015 1.00 0.00 H new ATOM 1318 N LEU A 90 1.324 -3.927 2.148 1.00 0.00 N ATOM 1319 CA LEU A 90 -0.046 -3.548 1.780 1.00 0.00 C ATOM 1320 C LEU A 90 -0.933 -4.306 2.754 1.00 0.00 C ATOM 1321 O LEU A 90 -1.031 -5.527 2.634 1.00 0.00 O ATOM 1322 CB LEU A 90 -0.404 -3.936 0.320 1.00 0.00 C ATOM 1323 CG LEU A 90 0.541 -3.390 -0.769 1.00 0.00 C ATOM 1324 CD1 LEU A 90 0.526 -4.282 -2.015 1.00 0.00 C ATOM 1325 CD2 LEU A 90 0.223 -1.939 -1.108 1.00 0.00 C ATOM 0 H LEU A 90 1.430 -4.929 2.304 1.00 0.00 H new ATOM 0 HA LEU A 90 -0.174 -2.467 1.833 1.00 0.00 H new ATOM 0 HB2 LEU A 90 -0.422 -5.023 0.247 1.00 0.00 H new ATOM 0 HB3 LEU A 90 -1.414 -3.585 0.108 1.00 0.00 H new ATOM 0 HG LEU A 90 1.554 -3.410 -0.368 1.00 0.00 H new ATOM 0 HD11 LEU A 90 1.202 -3.871 -2.765 1.00 0.00 H new ATOM 0 HD12 LEU A 90 0.850 -5.288 -1.747 1.00 0.00 H new ATOM 0 HD13 LEU A 90 -0.485 -4.323 -2.421 1.00 0.00 H new ATOM 0 HD21 LEU A 90 0.908 -1.587 -1.879 1.00 0.00 H new ATOM 0 HD22 LEU A 90 -0.802 -1.867 -1.473 1.00 0.00 H new ATOM 0 HD23 LEU A 90 0.334 -1.324 -0.215 1.00 0.00 H new ATOM 1337 N THR A 91 -1.513 -3.636 3.742 1.00 0.00 N ATOM 1338 CA THR A 91 -2.449 -4.258 4.670 1.00 0.00 C ATOM 1339 C THR A 91 -3.837 -4.077 4.080 1.00 0.00 C ATOM 1340 O THR A 91 -4.260 -2.943 3.836 1.00 0.00 O ATOM 1341 CB THR A 91 -2.342 -3.590 6.050 1.00 0.00 C ATOM 1342 OG1 THR A 91 -1.001 -3.612 6.501 1.00 0.00 O ATOM 1343 CG2 THR A 91 -3.235 -4.221 7.130 1.00 0.00 C ATOM 0 H THR A 91 -1.348 -2.646 3.923 1.00 0.00 H new ATOM 0 HA THR A 91 -2.231 -5.317 4.807 1.00 0.00 H new ATOM 0 HB THR A 91 -2.694 -2.569 5.903 1.00 0.00 H new ATOM 0 HG1 THR A 91 -0.944 -3.182 7.380 1.00 0.00 H new ATOM 0 HG21 THR A 91 -3.098 -3.689 8.072 1.00 0.00 H new ATOM 0 HG22 THR A 91 -4.279 -4.154 6.824 1.00 0.00 H new ATOM 0 HG23 THR A 91 -2.962 -5.268 7.261 1.00 0.00 H new ATOM 1351 N VAL A 92 -4.528 -5.182 3.835 1.00 0.00 N ATOM 1352 CA VAL A 92 -5.921 -5.203 3.426 1.00 0.00 C ATOM 1353 C VAL A 92 -6.753 -5.688 4.619 1.00 0.00 C ATOM 1354 O VAL A 92 -6.213 -6.160 5.620 1.00 0.00 O ATOM 1355 CB VAL A 92 -6.104 -6.055 2.145 1.00 0.00 C ATOM 1356 CG1 VAL A 92 -5.194 -5.602 0.985 1.00 0.00 C ATOM 1357 CG2 VAL A 92 -5.957 -7.558 2.408 1.00 0.00 C ATOM 0 H VAL A 92 -4.121 -6.114 3.918 1.00 0.00 H new ATOM 0 HA VAL A 92 -6.270 -4.207 3.154 1.00 0.00 H new ATOM 0 HB VAL A 92 -7.133 -5.880 1.830 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -5.368 -6.237 0.116 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -5.419 -4.567 0.729 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -4.150 -5.682 1.289 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -6.095 -8.106 1.476 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -4.963 -7.762 2.805 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -6.709 -7.876 3.130 1.00 0.00 H new ATOM 1367 N ARG A 93 -8.077 -5.602 4.549 1.00 0.00 N ATOM 1368 CA ARG A 93 -8.973 -6.255 5.494 1.00 0.00 C ATOM 1369 C ARG A 93 -10.273 -6.575 4.792 1.00 0.00 C ATOM 1370 O ARG A 93 -10.547 -6.033 3.722 1.00 0.00 O ATOM 1371 CB ARG A 93 -9.176 -5.376 6.745 1.00 0.00 C ATOM 1372 CG ARG A 93 -10.121 -4.186 6.591 1.00 0.00 C ATOM 1373 CD ARG A 93 -10.195 -3.353 7.867 1.00 0.00 C ATOM 1374 NE ARG A 93 -11.016 -2.159 7.655 1.00 0.00 N ATOM 1375 CZ ARG A 93 -11.052 -1.045 8.390 1.00 0.00 C ATOM 1376 NH1 ARG A 93 -10.262 -0.871 9.447 1.00 0.00 N ATOM 1377 NH2 ARG A 93 -11.921 -0.098 8.074 1.00 0.00 N ATOM 0 H ARG A 93 -8.563 -5.071 3.826 1.00 0.00 H new ATOM 0 HA ARG A 93 -8.536 -7.190 5.844 1.00 0.00 H new ATOM 0 HB2 ARG A 93 -9.551 -6.008 7.550 1.00 0.00 H new ATOM 0 HB3 ARG A 93 -8.203 -5.001 7.061 1.00 0.00 H new ATOM 0 HG2 ARG A 93 -9.784 -3.558 5.766 1.00 0.00 H new ATOM 0 HG3 ARG A 93 -11.117 -4.544 6.332 1.00 0.00 H new ATOM 0 HD2 ARG A 93 -10.616 -3.952 8.675 1.00 0.00 H new ATOM 0 HD3 ARG A 93 -9.191 -3.061 8.176 1.00 0.00 H new ATOM 0 HE ARG A 93 -11.637 -2.181 6.846 1.00 0.00 H new ATOM 0 HH11 ARG A 93 -9.603 -1.601 9.717 1.00 0.00 H new ATOM 0 HH12 ARG A 93 -10.315 -0.007 9.987 1.00 0.00 H new ATOM 0 HH21 ARG A 93 -12.549 -0.226 7.280 1.00 0.00 H new ATOM 0 HH22 ARG A 93 -11.963 0.760 8.624 1.00 0.00 H new ATOM 1391 N ARG A 94 -11.096 -7.417 5.412 1.00 0.00 N ATOM 1392 CA ARG A 94 -12.510 -7.543 5.075 1.00 0.00 C ATOM 1393 C ARG A 94 -13.253 -8.067 6.288 1.00 0.00 C ATOM 1394 O ARG A 94 -12.745 -8.913 7.031 1.00 0.00 O ATOM 1395 CB ARG A 94 -12.712 -8.497 3.882 1.00 0.00 C ATOM 1396 CG ARG A 94 -12.916 -7.785 2.531 1.00 0.00 C ATOM 1397 CD ARG A 94 -12.296 -8.605 1.400 1.00 0.00 C ATOM 1398 NE ARG A 94 -13.032 -9.858 1.184 1.00 0.00 N ATOM 1399 CZ ARG A 94 -12.501 -11.056 0.925 1.00 0.00 C ATOM 1400 NH1 ARG A 94 -11.201 -11.225 0.725 1.00 0.00 N ATOM 1401 NH2 ARG A 94 -13.301 -12.111 0.890 1.00 0.00 N ATOM 0 H ARG A 94 -10.798 -8.035 6.167 1.00 0.00 H new ATOM 0 HA ARG A 94 -12.897 -6.565 4.789 1.00 0.00 H new ATOM 0 HB2 ARG A 94 -11.846 -9.154 3.806 1.00 0.00 H new ATOM 0 HB3 ARG A 94 -13.577 -9.130 4.080 1.00 0.00 H new ATOM 0 HG2 ARG A 94 -13.980 -7.642 2.345 1.00 0.00 H new ATOM 0 HG3 ARG A 94 -12.462 -6.794 2.562 1.00 0.00 H new ATOM 0 HD2 ARG A 94 -12.295 -8.019 0.481 1.00 0.00 H new ATOM 0 HD3 ARG A 94 -11.256 -8.828 1.637 1.00 0.00 H new ATOM 0 HE ARG A 94 -14.049 -9.808 1.237 1.00 0.00 H new ATOM 0 HH11 ARG A 94 -10.570 -10.424 0.767 1.00 0.00 H new ATOM 0 HH12 ARG A 94 -10.832 -12.156 0.530 1.00 0.00 H new ATOM 0 HH21 ARG A 94 -14.301 -11.999 1.059 1.00 0.00 H new ATOM 0 HH22 ARG A 94 -12.917 -13.036 0.694 1.00 0.00 H new ATOM 1415 N LYS A 95 -14.496 -7.626 6.438 1.00 0.00 N ATOM 1416 CA LYS A 95 -15.464 -8.174 7.370 1.00 0.00 C ATOM 1417 C LYS A 95 -15.763 -9.640 7.057 1.00 0.00 C ATOM 1418 O LYS A 95 -15.454 -10.170 5.980 1.00 0.00 O ATOM 1419 CB LYS A 95 -16.704 -7.253 7.401 1.00 0.00 C ATOM 1420 CG LYS A 95 -17.185 -6.874 8.814 1.00 0.00 C ATOM 1421 CD LYS A 95 -18.053 -7.933 9.496 1.00 0.00 C ATOM 1422 CE LYS A 95 -18.949 -7.345 10.591 1.00 0.00 C ATOM 1423 NZ LYS A 95 -18.194 -6.799 11.735 1.00 0.00 N ATOM 0 H LYS A 95 -14.868 -6.848 5.892 1.00 0.00 H new ATOM 0 HA LYS A 95 -15.059 -8.192 8.382 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -16.476 -6.340 6.852 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -17.520 -7.747 6.874 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -16.314 -6.679 9.440 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -17.750 -5.944 8.754 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -18.675 -8.424 8.748 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -17.411 -8.699 9.930 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -19.565 -6.555 10.161 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -19.628 -8.119 10.949 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -18.858 -6.418 12.439 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -17.626 -7.555 12.169 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -17.565 -6.039 11.405 1.00 0.00 H new ATOM 1437 N VAL A 96 -16.353 -10.296 8.045 1.00 0.00 N ATOM 1438 CA VAL A 96 -16.724 -11.700 8.030 1.00 0.00 C ATOM 1439 C VAL A 96 -18.189 -11.846 8.437 1.00 0.00 C ATOM 1440 O VAL A 96 -18.853 -10.912 8.907 1.00 0.00 O ATOM 1441 CB VAL A 96 -15.734 -12.472 8.933 1.00 0.00 C ATOM 1442 CG1 VAL A 96 -15.917 -13.985 8.876 1.00 0.00 C ATOM 1443 CG2 VAL A 96 -14.267 -12.204 8.568 1.00 0.00 C ATOM 0 H VAL A 96 -16.598 -9.838 8.923 1.00 0.00 H new ATOM 0 HA VAL A 96 -16.650 -12.131 7.032 1.00 0.00 H new ATOM 0 HB VAL A 96 -15.961 -12.102 9.933 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -15.191 -14.464 9.533 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -16.925 -14.242 9.201 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -15.766 -14.332 7.854 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -13.617 -12.771 9.234 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -14.087 -12.510 7.537 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -14.054 -11.140 8.673 1.00 0.00 H new ATOM 1453 N LEU A 97 -18.706 -13.033 8.157 1.00 0.00 N ATOM 1454 CA LEU A 97 -20.062 -13.511 8.305 1.00 0.00 C ATOM 1455 C LEU A 97 -19.950 -15.044 8.120 1.00 0.00 C ATOM 1456 O LEU A 97 -18.836 -15.576 8.042 1.00 0.00 O ATOM 1457 CB LEU A 97 -20.893 -12.811 7.212 1.00 0.00 C ATOM 1458 CG LEU A 97 -22.424 -12.957 7.355 1.00 0.00 C ATOM 1459 CD1 LEU A 97 -22.960 -12.007 8.433 1.00 0.00 C ATOM 1460 CD2 LEU A 97 -23.107 -12.645 6.024 1.00 0.00 C ATOM 0 H LEU A 97 -18.109 -13.767 7.776 1.00 0.00 H new ATOM 0 HA LEU A 97 -20.545 -13.301 9.259 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -20.644 -11.750 7.212 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -20.595 -13.208 6.242 1.00 0.00 H new ATOM 0 HG LEU A 97 -22.642 -13.984 7.647 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -24.040 -12.126 8.518 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -22.493 -12.241 9.390 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -22.728 -10.978 8.159 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -24.186 -12.751 6.135 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -22.871 -11.624 5.725 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -22.751 -13.338 5.261 1.00 0.00 H new ATOM 1472 N SER A 98 -21.055 -15.773 7.987 1.00 0.00 N ATOM 1473 CA SER A 98 -21.051 -17.039 7.257 1.00 0.00 C ATOM 1474 C SER A 98 -20.700 -16.784 5.777 1.00 0.00 C ATOM 1475 O SER A 98 -20.608 -15.630 5.321 1.00 0.00 O ATOM 1476 CB SER A 98 -22.416 -17.735 7.401 1.00 0.00 C ATOM 1477 OG SER A 98 -22.905 -17.629 8.732 1.00 0.00 O ATOM 0 H SER A 98 -21.962 -15.511 8.373 1.00 0.00 H new ATOM 0 HA SER A 98 -20.294 -17.702 7.676 1.00 0.00 H new ATOM 0 HB2 SER A 98 -23.131 -17.287 6.711 1.00 0.00 H new ATOM 0 HB3 SER A 98 -22.323 -18.786 7.127 1.00 0.00 H new ATOM 0 HG SER A 98 -23.774 -18.077 8.798 1.00 0.00 H new ATOM 1483 N GLY A 99 -20.529 -17.851 5.000 1.00 0.00 N ATOM 1484 CA GLY A 99 -20.416 -17.760 3.550 1.00 0.00 C ATOM 1485 C GLY A 99 -21.758 -17.372 2.916 1.00 0.00 C ATOM 1486 O GLY A 99 -22.737 -17.124 3.631 1.00 0.00 O ATOM 0 H GLY A 99 -20.465 -18.803 5.360 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -19.659 -17.022 3.287 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -20.083 -18.716 3.147 1.00 0.00 H new ATOM 1490 N PRO A 100 -21.823 -17.276 1.582 1.00 0.00 N ATOM 1491 CA PRO A 100 -23.073 -17.088 0.858 1.00 0.00 C ATOM 1492 C PRO A 100 -23.935 -18.356 0.942 1.00 0.00 C ATOM 1493 O PRO A 100 -23.443 -19.420 1.326 1.00 0.00 O ATOM 1494 CB PRO A 100 -22.635 -16.786 -0.579 1.00 0.00 C ATOM 1495 CG PRO A 100 -21.347 -17.591 -0.725 1.00 0.00 C ATOM 1496 CD PRO A 100 -20.719 -17.493 0.661 1.00 0.00 C ATOM 0 HA PRO A 100 -23.689 -16.287 1.266 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -23.388 -17.096 -1.303 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -22.464 -15.721 -0.733 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -21.548 -18.625 -1.004 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -20.696 -17.174 -1.493 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -20.176 -18.405 0.910 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -20.003 -16.673 0.709 1.00 0.00 H new ATOM 1504 N SER A 101 -25.188 -18.241 0.499 1.00 0.00 N ATOM 1505 CA SER A 101 -26.197 -19.294 0.458 1.00 0.00 C ATOM 1506 C SER A 101 -26.691 -19.585 1.872 1.00 0.00 C ATOM 1507 O SER A 101 -26.241 -20.512 2.546 1.00 0.00 O ATOM 1508 CB SER A 101 -25.724 -20.522 -0.333 1.00 0.00 C ATOM 1509 OG SER A 101 -25.283 -20.095 -1.612 1.00 0.00 O ATOM 0 H SER A 101 -25.544 -17.356 0.138 1.00 0.00 H new ATOM 0 HA SER A 101 -27.064 -18.949 -0.106 1.00 0.00 H new ATOM 0 HB2 SER A 101 -24.915 -21.025 0.197 1.00 0.00 H new ATOM 0 HB3 SER A 101 -26.536 -21.242 -0.434 1.00 0.00 H new ATOM 0 HG SER A 101 -24.976 -20.870 -2.128 1.00 0.00 H new ATOM 1515 N SER A 102 -27.630 -18.747 2.303 1.00 0.00 N ATOM 1516 CA SER A 102 -28.360 -18.823 3.556 1.00 0.00 C ATOM 1517 C SER A 102 -29.845 -18.569 3.245 1.00 0.00 C ATOM 1518 O SER A 102 -30.198 -18.249 2.100 1.00 0.00 O ATOM 1519 CB SER A 102 -27.783 -17.777 4.520 1.00 0.00 C ATOM 1520 OG SER A 102 -26.385 -17.947 4.720 1.00 0.00 O ATOM 0 H SER A 102 -27.917 -17.943 1.744 1.00 0.00 H new ATOM 0 HA SER A 102 -28.266 -19.800 4.031 1.00 0.00 H new ATOM 0 HB2 SER A 102 -27.974 -16.778 4.127 1.00 0.00 H new ATOM 0 HB3 SER A 102 -28.297 -17.846 5.479 1.00 0.00 H new ATOM 0 HG SER A 102 -26.057 -17.261 5.338 1.00 0.00 H new ATOM 1526 N GLY A 103 -30.714 -18.692 4.246 1.00 0.00 N ATOM 1527 CA GLY A 103 -32.139 -18.891 4.016 1.00 0.00 C ATOM 1528 C GLY A 103 -32.311 -20.362 3.712 1.00 0.00 C ATOM 1529 O GLY A 103 -32.888 -20.676 2.653 1.00 0.00 O ATOM 0 H GLY A 103 -30.451 -18.657 5.231 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -32.720 -18.603 4.893 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -32.490 -18.278 3.186 1.00 0.00 H new TER 1533 GLY A 103