USER MOD reduce.3.24.130724 H: found=0, std=0, add=812, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 808 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 34 ASN : amide:sc= -2.67 X(o=-3.9,f=-4.2!) USER MOD Set 1.2: A 90 GLN : amide:sc= -1.26 K(o=-3.9,f=-1.9) USER MOD Set 2.1: A 18 THR OG1 : rot 97:sc= 1.12 USER MOD Set 2.2: A 19 ASN : amide:sc= -0.0634 K(o=1.1,f=-6.4!) USER MOD Single : A 1 GLY N :NH3+ 131:sc= 0.00826 (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 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 11 LYS NZ :NH3+ -163:sc= -0.007 (180deg=-0.21) USER MOD Single : A 13 GLN : amide:sc= -0.518 K(o=-0.52,f=-2.1!) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 16 ASN : amide:sc= 0.431 K(o=0.43,f=-4.7!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 ASN : amide:sc= -0.0405 K(o=-0.041,f=-5.5!) USER MOD Single : A 24 LYS NZ :NH3+ 162:sc= -0.0164 (180deg=-0.309) USER MOD Single : A 25 SER OG : rot -59:sc= 0.351 USER MOD Single : A 27 ASN : amide:sc= -0.291 K(o=-0.29,f=-1.4!) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 36 ASN : amide:sc= -0.359 K(o=-0.36,f=-2.3!) USER MOD Single : A 37 THR OG1 : rot -87:sc= -0.264! USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 TYR OH : rot 167:sc= -0.322 USER MOD Single : A 58 CYS SG : rot 34:sc= -0.764 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 61 HIS : no HD1:sc= -1.09 X(o=-1.1,f=-1.1) USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= -6! C(o=-6!,f=-8.3!) USER MOD Single : A 69 TYR OH : rot 18:sc= -0.255 USER MOD Single : A 70 SER OG : rot 180:sc= -0.0161 USER MOD Single : A 71 ASN : amide:sc= -0.0155 X(o=-0.016,f=0) USER MOD Single : A 74 HIS : no HD1:sc= -0.275 X(o=-0.27,f=-0.0087) USER MOD Single : A 83 ASN : amide:sc= -0.162 X(o=-0.16,f=0) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0 USER MOD Single : A 95 ASN : amide:sc= -1.69 K(o=-1.7,f=-4.3!) USER MOD Single : A 96 MET CE :methyl 149:sc= -0.665 (180deg=-1.43) USER MOD Single : A 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 SER OG : rot 180:sc= 0 USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 19.717 11.812 -11.294 1.00 0.00 N ATOM 2 CA GLY A 1 21.123 11.448 -11.292 1.00 0.00 C ATOM 3 C GLY A 1 21.296 9.928 -11.334 1.00 0.00 C ATOM 4 O GLY A 1 20.570 9.198 -10.660 1.00 0.00 O ATOM 0 H1 GLY A 1 19.535 12.500 -10.536 1.00 0.00 H new ATOM 0 H2 GLY A 1 19.469 12.234 -12.211 1.00 0.00 H new ATOM 0 H3 GLY A 1 19.138 10.962 -11.136 1.00 0.00 H new ATOM 0 HA2 GLY A 1 21.620 11.898 -12.151 1.00 0.00 H new ATOM 0 HA3 GLY A 1 21.605 11.848 -10.400 1.00 0.00 H new ATOM 8 N SER A 2 22.261 9.496 -12.131 1.00 0.00 N ATOM 9 CA SER A 2 22.538 8.076 -12.270 1.00 0.00 C ATOM 10 C SER A 2 23.521 7.627 -11.187 1.00 0.00 C ATOM 11 O SER A 2 24.720 7.883 -11.286 1.00 0.00 O ATOM 12 CB SER A 2 23.096 7.757 -13.658 1.00 0.00 C ATOM 13 OG SER A 2 22.249 8.238 -14.698 1.00 0.00 O ATOM 0 H SER A 2 22.862 10.104 -12.688 1.00 0.00 H new ATOM 0 HA SER A 2 21.601 7.531 -12.151 1.00 0.00 H new ATOM 0 HB2 SER A 2 24.086 8.202 -13.762 1.00 0.00 H new ATOM 0 HB3 SER A 2 23.219 6.679 -13.760 1.00 0.00 H new ATOM 0 HG SER A 2 22.641 8.016 -15.568 1.00 0.00 H new ATOM 19 N SER A 3 22.977 6.964 -10.177 1.00 0.00 N ATOM 20 CA SER A 3 23.791 6.477 -9.076 1.00 0.00 C ATOM 21 C SER A 3 23.566 4.976 -8.883 1.00 0.00 C ATOM 22 O SER A 3 22.642 4.404 -9.461 1.00 0.00 O ATOM 23 CB SER A 3 23.477 7.231 -7.783 1.00 0.00 C ATOM 24 OG SER A 3 23.661 8.637 -7.926 1.00 0.00 O ATOM 0 H SER A 3 21.982 6.753 -10.098 1.00 0.00 H new ATOM 0 HA SER A 3 24.838 6.653 -9.322 1.00 0.00 H new ATOM 0 HB2 SER A 3 22.448 7.029 -7.486 1.00 0.00 H new ATOM 0 HB3 SER A 3 24.118 6.861 -6.983 1.00 0.00 H new ATOM 0 HG SER A 3 23.449 9.082 -7.079 1.00 0.00 H new ATOM 30 N GLY A 4 24.425 4.381 -8.069 1.00 0.00 N ATOM 31 CA GLY A 4 24.331 2.957 -7.793 1.00 0.00 C ATOM 32 C GLY A 4 25.354 2.535 -6.736 1.00 0.00 C ATOM 33 O GLY A 4 25.498 3.196 -5.708 1.00 0.00 O ATOM 0 H GLY A 4 25.189 4.859 -7.592 1.00 0.00 H new ATOM 0 HA2 GLY A 4 23.326 2.715 -7.448 1.00 0.00 H new ATOM 0 HA3 GLY A 4 24.497 2.393 -8.711 1.00 0.00 H new ATOM 37 N SER A 5 26.037 1.437 -7.025 1.00 0.00 N ATOM 38 CA SER A 5 27.042 0.919 -6.112 1.00 0.00 C ATOM 39 C SER A 5 28.425 1.442 -6.505 1.00 0.00 C ATOM 40 O SER A 5 29.173 0.764 -7.207 1.00 0.00 O ATOM 41 CB SER A 5 27.037 -0.611 -6.098 1.00 0.00 C ATOM 42 OG SER A 5 27.821 -1.137 -5.031 1.00 0.00 O ATOM 0 H SER A 5 25.914 0.892 -7.878 1.00 0.00 H new ATOM 0 HA SER A 5 26.802 1.265 -5.107 1.00 0.00 H new ATOM 0 HB2 SER A 5 26.012 -0.969 -6.006 1.00 0.00 H new ATOM 0 HB3 SER A 5 27.421 -0.984 -7.048 1.00 0.00 H new ATOM 0 HG SER A 5 27.791 -2.116 -5.055 1.00 0.00 H new ATOM 48 N SER A 6 28.724 2.645 -6.035 1.00 0.00 N ATOM 49 CA SER A 6 30.004 3.266 -6.328 1.00 0.00 C ATOM 50 C SER A 6 30.276 4.397 -5.335 1.00 0.00 C ATOM 51 O SER A 6 29.406 5.230 -5.082 1.00 0.00 O ATOM 52 CB SER A 6 30.041 3.799 -7.762 1.00 0.00 C ATOM 53 OG SER A 6 31.265 4.469 -8.051 1.00 0.00 O ATOM 0 H SER A 6 28.101 3.206 -5.453 1.00 0.00 H new ATOM 0 HA SER A 6 30.782 2.509 -6.229 1.00 0.00 H new ATOM 0 HB2 SER A 6 29.907 2.972 -8.460 1.00 0.00 H new ATOM 0 HB3 SER A 6 29.207 4.484 -7.916 1.00 0.00 H new ATOM 0 HG SER A 6 31.250 4.793 -8.976 1.00 0.00 H new ATOM 59 N GLY A 7 31.487 4.392 -4.798 1.00 0.00 N ATOM 60 CA GLY A 7 31.885 5.407 -3.838 1.00 0.00 C ATOM 61 C GLY A 7 32.358 4.769 -2.530 1.00 0.00 C ATOM 62 O GLY A 7 32.337 3.548 -2.387 1.00 0.00 O ATOM 0 H GLY A 7 32.206 3.700 -5.010 1.00 0.00 H new ATOM 0 HA2 GLY A 7 32.684 6.017 -4.259 1.00 0.00 H new ATOM 0 HA3 GLY A 7 31.046 6.074 -3.639 1.00 0.00 H new ATOM 66 N MET A 8 32.775 5.625 -1.608 1.00 0.00 N ATOM 67 CA MET A 8 33.252 5.161 -0.317 1.00 0.00 C ATOM 68 C MET A 8 32.248 5.489 0.790 1.00 0.00 C ATOM 69 O MET A 8 31.787 4.596 1.499 1.00 0.00 O ATOM 70 CB MET A 8 34.595 5.823 -0.001 1.00 0.00 C ATOM 71 CG MET A 8 35.743 5.098 -0.707 1.00 0.00 C ATOM 72 SD MET A 8 37.208 6.118 -0.694 1.00 0.00 S ATOM 73 CE MET A 8 38.430 4.911 -1.181 1.00 0.00 C ATOM 0 H MET A 8 32.792 6.638 -1.730 1.00 0.00 H new ATOM 0 HA MET A 8 33.372 4.079 -0.363 1.00 0.00 H new ATOM 0 HB2 MET A 8 34.572 6.867 -0.314 1.00 0.00 H new ATOM 0 HB3 MET A 8 34.763 5.816 1.076 1.00 0.00 H new ATOM 0 HG2 MET A 8 35.946 4.149 -0.210 1.00 0.00 H new ATOM 0 HG3 MET A 8 35.461 4.866 -1.734 1.00 0.00 H new ATOM 0 HE1 MET A 8 39.411 5.383 -1.223 1.00 0.00 H new ATOM 0 HE2 MET A 8 38.449 4.099 -0.454 1.00 0.00 H new ATOM 0 HE3 MET A 8 38.177 4.513 -2.163 1.00 0.00 H new ATOM 83 N SER A 9 31.939 6.772 0.903 1.00 0.00 N ATOM 84 CA SER A 9 30.998 7.229 1.911 1.00 0.00 C ATOM 85 C SER A 9 30.005 8.215 1.292 1.00 0.00 C ATOM 86 O SER A 9 30.301 9.403 1.167 1.00 0.00 O ATOM 87 CB SER A 9 31.726 7.879 3.090 1.00 0.00 C ATOM 88 OG SER A 9 31.103 7.575 4.335 1.00 0.00 O ATOM 0 H SER A 9 32.324 7.510 0.313 1.00 0.00 H new ATOM 0 HA SER A 9 30.453 6.363 2.288 1.00 0.00 H new ATOM 0 HB2 SER A 9 32.761 7.538 3.110 1.00 0.00 H new ATOM 0 HB3 SER A 9 31.749 8.960 2.951 1.00 0.00 H new ATOM 0 HG SER A 9 31.598 8.006 5.062 1.00 0.00 H new ATOM 94 N LEU A 10 28.849 7.687 0.921 1.00 0.00 N ATOM 95 CA LEU A 10 27.811 8.505 0.318 1.00 0.00 C ATOM 96 C LEU A 10 26.589 8.533 1.238 1.00 0.00 C ATOM 97 O LEU A 10 26.223 7.512 1.819 1.00 0.00 O ATOM 98 CB LEU A 10 27.502 8.020 -1.100 1.00 0.00 C ATOM 99 CG LEU A 10 28.488 8.454 -2.187 1.00 0.00 C ATOM 100 CD1 LEU A 10 29.850 7.788 -1.989 1.00 0.00 C ATOM 101 CD2 LEU A 10 27.917 8.188 -3.582 1.00 0.00 C ATOM 0 H LEU A 10 28.608 6.702 1.026 1.00 0.00 H new ATOM 0 HA LEU A 10 28.153 9.534 0.211 1.00 0.00 H new ATOM 0 HB2 LEU A 10 27.460 6.931 -1.089 1.00 0.00 H new ATOM 0 HB3 LEU A 10 26.509 8.374 -1.376 1.00 0.00 H new ATOM 0 HG LEU A 10 28.640 9.530 -2.101 1.00 0.00 H new ATOM 0 HD11 LEU A 10 30.532 8.113 -2.775 1.00 0.00 H new ATOM 0 HD12 LEU A 10 30.255 8.070 -1.017 1.00 0.00 H new ATOM 0 HD13 LEU A 10 29.735 6.705 -2.034 1.00 0.00 H new ATOM 0 HD21 LEU A 10 28.637 8.505 -4.336 1.00 0.00 H new ATOM 0 HD22 LEU A 10 27.717 7.123 -3.696 1.00 0.00 H new ATOM 0 HD23 LEU A 10 26.990 8.747 -3.708 1.00 0.00 H new ATOM 113 N LYS A 11 25.993 9.711 1.342 1.00 0.00 N ATOM 114 CA LYS A 11 24.820 9.884 2.182 1.00 0.00 C ATOM 115 C LYS A 11 25.158 9.468 3.615 1.00 0.00 C ATOM 116 O LYS A 11 25.288 8.280 3.906 1.00 0.00 O ATOM 117 CB LYS A 11 23.622 9.138 1.591 1.00 0.00 C ATOM 118 CG LYS A 11 22.717 10.088 0.805 1.00 0.00 C ATOM 119 CD LYS A 11 21.776 9.312 -0.118 1.00 0.00 C ATOM 120 CE LYS A 11 22.490 8.900 -1.407 1.00 0.00 C ATOM 121 NZ LYS A 11 22.683 10.072 -2.290 1.00 0.00 N ATOM 0 H LYS A 11 26.300 10.555 0.859 1.00 0.00 H new ATOM 0 HA LYS A 11 24.527 10.933 2.215 1.00 0.00 H new ATOM 0 HB2 LYS A 11 23.973 8.340 0.937 1.00 0.00 H new ATOM 0 HB3 LYS A 11 23.052 8.666 2.391 1.00 0.00 H new ATOM 0 HG2 LYS A 11 22.134 10.696 1.497 1.00 0.00 H new ATOM 0 HG3 LYS A 11 23.327 10.773 0.216 1.00 0.00 H new ATOM 0 HD2 LYS A 11 21.406 8.425 0.396 1.00 0.00 H new ATOM 0 HD3 LYS A 11 20.908 9.926 -0.359 1.00 0.00 H new ATOM 0 HE2 LYS A 11 23.456 8.454 -1.168 1.00 0.00 H new ATOM 0 HE3 LYS A 11 21.907 8.139 -1.925 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 22.896 9.748 -3.255 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 21.815 10.645 -2.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 23.473 10.647 -1.935 1.00 0.00 H new ATOM 135 N LEU A 12 25.290 10.469 4.473 1.00 0.00 N ATOM 136 CA LEU A 12 25.611 10.221 5.868 1.00 0.00 C ATOM 137 C LEU A 12 24.406 10.589 6.737 1.00 0.00 C ATOM 138 O LEU A 12 23.485 11.261 6.275 1.00 0.00 O ATOM 139 CB LEU A 12 26.897 10.951 6.260 1.00 0.00 C ATOM 140 CG LEU A 12 28.182 10.122 6.206 1.00 0.00 C ATOM 141 CD1 LEU A 12 29.236 10.800 5.328 1.00 0.00 C ATOM 142 CD2 LEU A 12 28.708 9.833 7.613 1.00 0.00 C ATOM 0 H LEU A 12 25.180 11.453 4.229 1.00 0.00 H new ATOM 0 HA LEU A 12 25.811 9.162 6.030 1.00 0.00 H new ATOM 0 HB2 LEU A 12 27.016 11.813 5.604 1.00 0.00 H new ATOM 0 HB3 LEU A 12 26.779 11.336 7.273 1.00 0.00 H new ATOM 0 HG LEU A 12 27.949 9.162 5.746 1.00 0.00 H new ATOM 0 HD11 LEU A 12 30.139 10.190 5.307 1.00 0.00 H new ATOM 0 HD12 LEU A 12 28.849 10.911 4.315 1.00 0.00 H new ATOM 0 HD13 LEU A 12 29.472 11.783 5.736 1.00 0.00 H new ATOM 0 HD21 LEU A 12 29.622 9.242 7.546 1.00 0.00 H new ATOM 0 HD22 LEU A 12 28.920 10.773 8.122 1.00 0.00 H new ATOM 0 HD23 LEU A 12 27.957 9.277 8.175 1.00 0.00 H new ATOM 154 N GLN A 13 24.452 10.133 7.980 1.00 0.00 N ATOM 155 CA GLN A 13 23.376 10.406 8.917 1.00 0.00 C ATOM 156 C GLN A 13 23.295 11.905 9.211 1.00 0.00 C ATOM 157 O GLN A 13 24.241 12.490 9.736 1.00 0.00 O ATOM 158 CB GLN A 13 23.555 9.603 10.207 1.00 0.00 C ATOM 159 CG GLN A 13 23.346 8.108 9.957 1.00 0.00 C ATOM 160 CD GLN A 13 21.859 7.783 9.793 1.00 0.00 C ATOM 161 OE1 GLN A 13 21.230 8.118 8.803 1.00 0.00 O ATOM 162 NE2 GLN A 13 21.336 7.114 10.816 1.00 0.00 N ATOM 0 H GLN A 13 25.218 9.576 8.360 1.00 0.00 H new ATOM 0 HA GLN A 13 22.436 10.094 8.461 1.00 0.00 H new ATOM 0 HB2 GLN A 13 24.554 9.772 10.609 1.00 0.00 H new ATOM 0 HB3 GLN A 13 22.846 9.952 10.958 1.00 0.00 H new ATOM 0 HG2 GLN A 13 23.889 7.806 9.062 1.00 0.00 H new ATOM 0 HG3 GLN A 13 23.758 7.535 10.788 1.00 0.00 H new ATOM 0 HE21 GLN A 13 21.920 6.865 11.614 1.00 0.00 H new ATOM 0 HE22 GLN A 13 20.351 6.850 10.802 1.00 0.00 H new ATOM 171 N ALA A 14 22.156 12.484 8.859 1.00 0.00 N ATOM 172 CA ALA A 14 21.940 13.904 9.079 1.00 0.00 C ATOM 173 C ALA A 14 20.444 14.165 9.267 1.00 0.00 C ATOM 174 O ALA A 14 19.617 13.597 8.555 1.00 0.00 O ATOM 175 CB ALA A 14 22.527 14.697 7.909 1.00 0.00 C ATOM 0 H ALA A 14 21.374 11.996 8.423 1.00 0.00 H new ATOM 0 HA ALA A 14 22.449 14.234 9.985 1.00 0.00 H new ATOM 0 HB1 ALA A 14 22.365 15.762 8.074 1.00 0.00 H new ATOM 0 HB2 ALA A 14 23.596 14.500 7.836 1.00 0.00 H new ATOM 0 HB3 ALA A 14 22.038 14.395 6.983 1.00 0.00 H new ATOM 181 N SER A 15 20.142 15.023 10.230 1.00 0.00 N ATOM 182 CA SER A 15 18.760 15.365 10.521 1.00 0.00 C ATOM 183 C SER A 15 18.168 16.176 9.367 1.00 0.00 C ATOM 184 O SER A 15 18.790 17.120 8.883 1.00 0.00 O ATOM 185 CB SER A 15 18.651 16.148 11.831 1.00 0.00 C ATOM 186 OG SER A 15 18.867 17.544 11.638 1.00 0.00 O ATOM 0 H SER A 15 20.831 15.492 10.819 1.00 0.00 H new ATOM 0 HA SER A 15 18.195 14.440 10.634 1.00 0.00 H new ATOM 0 HB2 SER A 15 17.664 15.991 12.266 1.00 0.00 H new ATOM 0 HB3 SER A 15 19.380 15.764 12.545 1.00 0.00 H new ATOM 0 HG SER A 15 18.787 18.009 12.497 1.00 0.00 H new ATOM 192 N ASN A 16 16.972 15.778 8.959 1.00 0.00 N ATOM 193 CA ASN A 16 16.288 16.456 7.871 1.00 0.00 C ATOM 194 C ASN A 16 15.420 17.580 8.441 1.00 0.00 C ATOM 195 O ASN A 16 15.374 17.778 9.654 1.00 0.00 O ATOM 196 CB ASN A 16 15.375 15.493 7.109 1.00 0.00 C ATOM 197 CG ASN A 16 15.483 15.714 5.599 1.00 0.00 C ATOM 198 OD1 ASN A 16 15.368 16.820 5.098 1.00 0.00 O ATOM 199 ND2 ASN A 16 15.710 14.603 4.905 1.00 0.00 N ATOM 0 H ASN A 16 16.459 14.994 9.363 1.00 0.00 H new ATOM 0 HA ASN A 16 17.044 16.850 7.191 1.00 0.00 H new ATOM 0 HB2 ASN A 16 15.644 14.464 7.350 1.00 0.00 H new ATOM 0 HB3 ASN A 16 14.343 15.636 7.428 1.00 0.00 H new ATOM 0 HD21 ASN A 16 15.798 14.645 3.890 1.00 0.00 H new ATOM 0 HD22 ASN A 16 15.796 13.709 5.388 1.00 0.00 H new ATOM 206 N VAL A 17 14.755 18.286 7.539 1.00 0.00 N ATOM 207 CA VAL A 17 13.891 19.384 7.936 1.00 0.00 C ATOM 208 C VAL A 17 12.984 18.926 9.080 1.00 0.00 C ATOM 209 O VAL A 17 12.881 17.732 9.355 1.00 0.00 O ATOM 210 CB VAL A 17 13.112 19.902 6.726 1.00 0.00 C ATOM 211 CG1 VAL A 17 14.060 20.435 5.650 1.00 0.00 C ATOM 212 CG2 VAL A 17 12.195 18.817 6.159 1.00 0.00 C ATOM 0 H VAL A 17 14.797 18.119 6.534 1.00 0.00 H new ATOM 0 HA VAL A 17 14.483 20.221 8.306 1.00 0.00 H new ATOM 0 HB VAL A 17 12.486 20.729 7.060 1.00 0.00 H new ATOM 0 HG11 VAL A 17 13.480 20.797 4.801 1.00 0.00 H new ATOM 0 HG12 VAL A 17 14.653 21.253 6.060 1.00 0.00 H new ATOM 0 HG13 VAL A 17 14.724 19.635 5.321 1.00 0.00 H new ATOM 0 HG21 VAL A 17 11.653 19.211 5.300 1.00 0.00 H new ATOM 0 HG22 VAL A 17 12.793 17.961 5.849 1.00 0.00 H new ATOM 0 HG23 VAL A 17 11.484 18.505 6.924 1.00 0.00 H new ATOM 222 N THR A 18 12.349 19.900 9.716 1.00 0.00 N ATOM 223 CA THR A 18 11.454 19.611 10.823 1.00 0.00 C ATOM 224 C THR A 18 10.167 18.961 10.313 1.00 0.00 C ATOM 225 O THR A 18 9.686 17.988 10.893 1.00 0.00 O ATOM 226 CB THR A 18 11.214 20.914 11.589 1.00 0.00 C ATOM 227 OG1 THR A 18 10.614 21.777 10.627 1.00 0.00 O ATOM 228 CG2 THR A 18 12.518 21.622 11.962 1.00 0.00 C ATOM 0 H THR A 18 12.437 20.890 9.486 1.00 0.00 H new ATOM 0 HA THR A 18 11.895 18.889 11.510 1.00 0.00 H new ATOM 0 HB THR A 18 10.643 20.703 12.493 1.00 0.00 H new ATOM 0 HG1 THR A 18 9.640 21.761 10.735 1.00 0.00 H new ATOM 0 HG21 THR A 18 12.291 22.540 12.504 1.00 0.00 H new ATOM 0 HG22 THR A 18 13.120 20.968 12.593 1.00 0.00 H new ATOM 0 HG23 THR A 18 13.073 21.863 11.056 1.00 0.00 H new ATOM 236 N ASN A 19 9.644 19.524 9.233 1.00 0.00 N ATOM 237 CA ASN A 19 8.422 19.011 8.639 1.00 0.00 C ATOM 238 C ASN A 19 8.015 19.907 7.467 1.00 0.00 C ATOM 239 O ASN A 19 8.416 21.068 7.400 1.00 0.00 O ATOM 240 CB ASN A 19 7.276 19.007 9.652 1.00 0.00 C ATOM 241 CG ASN A 19 7.155 20.363 10.348 1.00 0.00 C ATOM 242 OD1 ASN A 19 8.048 21.193 10.307 1.00 0.00 O ATOM 243 ND2 ASN A 19 6.003 20.542 10.989 1.00 0.00 N ATOM 0 H ASN A 19 10.045 20.331 8.754 1.00 0.00 H new ATOM 0 HA ASN A 19 8.611 17.991 8.306 1.00 0.00 H new ATOM 0 HB2 ASN A 19 6.340 18.769 9.147 1.00 0.00 H new ATOM 0 HB3 ASN A 19 7.445 18.227 10.394 1.00 0.00 H new ATOM 0 HD21 ASN A 19 5.826 21.415 11.485 1.00 0.00 H new ATOM 0 HD22 ASN A 19 5.297 19.806 10.984 1.00 0.00 H new ATOM 250 N LYS A 20 7.222 19.334 6.574 1.00 0.00 N ATOM 251 CA LYS A 20 6.755 20.067 5.409 1.00 0.00 C ATOM 252 C LYS A 20 5.336 19.613 5.060 1.00 0.00 C ATOM 253 O LYS A 20 4.980 18.456 5.279 1.00 0.00 O ATOM 254 CB LYS A 20 7.748 19.924 4.253 1.00 0.00 C ATOM 255 CG LYS A 20 8.762 21.070 4.256 1.00 0.00 C ATOM 256 CD LYS A 20 8.360 22.160 3.261 1.00 0.00 C ATOM 257 CE LYS A 20 9.191 23.427 3.471 1.00 0.00 C ATOM 258 NZ LYS A 20 9.230 24.233 2.230 1.00 0.00 N ATOM 0 H LYS A 20 6.891 18.371 6.633 1.00 0.00 H new ATOM 0 HA LYS A 20 6.704 21.134 5.626 1.00 0.00 H new ATOM 0 HB2 LYS A 20 8.271 18.971 4.334 1.00 0.00 H new ATOM 0 HB3 LYS A 20 7.209 19.913 3.305 1.00 0.00 H new ATOM 0 HG2 LYS A 20 8.833 21.495 5.257 1.00 0.00 H new ATOM 0 HG3 LYS A 20 9.750 20.687 4.001 1.00 0.00 H new ATOM 0 HD2 LYS A 20 8.496 21.796 2.243 1.00 0.00 H new ATOM 0 HD3 LYS A 20 7.301 22.392 3.378 1.00 0.00 H new ATOM 0 HE2 LYS A 20 8.765 24.018 4.282 1.00 0.00 H new ATOM 0 HE3 LYS A 20 10.204 23.159 3.770 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 9.798 25.089 2.390 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 9.657 23.672 1.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 8.263 24.504 1.962 1.00 0.00 H new ATOM 272 N ASN A 21 4.565 20.547 4.524 1.00 0.00 N ATOM 273 CA ASN A 21 3.193 20.258 4.144 1.00 0.00 C ATOM 274 C ASN A 21 3.174 19.663 2.734 1.00 0.00 C ATOM 275 O ASN A 21 3.002 20.385 1.754 1.00 0.00 O ATOM 276 CB ASN A 21 2.345 21.531 4.130 1.00 0.00 C ATOM 277 CG ASN A 21 2.986 22.608 3.254 1.00 0.00 C ATOM 278 OD1 ASN A 21 4.154 22.937 3.384 1.00 0.00 O ATOM 279 ND2 ASN A 21 2.160 23.138 2.356 1.00 0.00 N ATOM 0 H ASN A 21 4.865 21.505 4.344 1.00 0.00 H new ATOM 0 HA ASN A 21 2.782 19.559 4.872 1.00 0.00 H new ATOM 0 HB2 ASN A 21 1.346 21.302 3.759 1.00 0.00 H new ATOM 0 HB3 ASN A 21 2.229 21.906 5.147 1.00 0.00 H new ATOM 0 HD21 ASN A 21 2.493 23.865 1.723 1.00 0.00 H new ATOM 0 HD22 ASN A 21 1.193 22.817 2.300 1.00 0.00 H new ATOM 286 N ASP A 22 3.354 18.351 2.678 1.00 0.00 N ATOM 287 CA ASP A 22 3.359 17.651 1.405 1.00 0.00 C ATOM 288 C ASP A 22 2.473 16.408 1.508 1.00 0.00 C ATOM 289 O ASP A 22 2.872 15.403 2.095 1.00 0.00 O ATOM 290 CB ASP A 22 4.772 17.194 1.033 1.00 0.00 C ATOM 291 CG ASP A 22 5.660 16.812 2.219 1.00 0.00 C ATOM 292 OD1 ASP A 22 5.366 15.765 2.835 1.00 0.00 O ATOM 293 OD2 ASP A 22 6.614 17.576 2.482 1.00 0.00 O ATOM 0 H ASP A 22 3.497 17.755 3.493 1.00 0.00 H new ATOM 0 HA ASP A 22 2.988 18.336 0.642 1.00 0.00 H new ATOM 0 HB2 ASP A 22 4.696 16.337 0.364 1.00 0.00 H new ATOM 0 HB3 ASP A 22 5.261 17.992 0.474 1.00 0.00 H new ATOM 298 N PRO A 23 1.255 16.519 0.912 1.00 0.00 N ATOM 299 CA PRO A 23 0.309 15.417 0.931 1.00 0.00 C ATOM 300 C PRO A 23 0.727 14.319 -0.050 1.00 0.00 C ATOM 301 O PRO A 23 0.247 13.190 0.036 1.00 0.00 O ATOM 302 CB PRO A 23 -1.032 16.043 0.585 1.00 0.00 C ATOM 303 CG PRO A 23 -0.712 17.379 -0.067 1.00 0.00 C ATOM 304 CD PRO A 23 0.749 17.693 0.207 1.00 0.00 C ATOM 0 HA PRO A 23 0.263 14.919 1.900 1.00 0.00 H new ATOM 0 HB2 PRO A 23 -1.599 15.404 -0.092 1.00 0.00 H new ATOM 0 HB3 PRO A 23 -1.641 16.180 1.478 1.00 0.00 H new ATOM 0 HG2 PRO A 23 -0.898 17.334 -1.140 1.00 0.00 H new ATOM 0 HG3 PRO A 23 -1.353 18.163 0.335 1.00 0.00 H new ATOM 0 HD2 PRO A 23 1.297 17.865 -0.719 1.00 0.00 H new ATOM 0 HD3 PRO A 23 0.854 18.594 0.812 1.00 0.00 H new ATOM 312 N LYS A 24 1.617 14.689 -0.959 1.00 0.00 N ATOM 313 CA LYS A 24 2.104 13.750 -1.955 1.00 0.00 C ATOM 314 C LYS A 24 2.520 12.450 -1.263 1.00 0.00 C ATOM 315 O LYS A 24 2.414 11.372 -1.845 1.00 0.00 O ATOM 316 CB LYS A 24 3.218 14.385 -2.790 1.00 0.00 C ATOM 317 CG LYS A 24 2.653 15.021 -4.063 1.00 0.00 C ATOM 318 CD LYS A 24 2.615 16.545 -3.944 1.00 0.00 C ATOM 319 CE LYS A 24 4.020 17.140 -4.066 1.00 0.00 C ATOM 320 NZ LYS A 24 4.523 17.000 -5.451 1.00 0.00 N ATOM 0 H LYS A 24 2.014 15.626 -1.027 1.00 0.00 H new ATOM 0 HA LYS A 24 1.312 13.498 -2.660 1.00 0.00 H new ATOM 0 HB2 LYS A 24 3.734 15.142 -2.199 1.00 0.00 H new ATOM 0 HB3 LYS A 24 3.956 13.628 -3.054 1.00 0.00 H new ATOM 0 HG2 LYS A 24 3.264 14.735 -4.919 1.00 0.00 H new ATOM 0 HG3 LYS A 24 1.648 14.642 -4.248 1.00 0.00 H new ATOM 0 HD2 LYS A 24 1.972 16.958 -4.722 1.00 0.00 H new ATOM 0 HD3 LYS A 24 2.178 16.828 -2.986 1.00 0.00 H new ATOM 0 HE2 LYS A 24 4.001 18.193 -3.784 1.00 0.00 H new ATOM 0 HE3 LYS A 24 4.696 16.637 -3.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 5.316 17.656 -5.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 4.847 16.024 -5.606 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 3.760 17.222 -6.122 1.00 0.00 H new ATOM 334 N SER A 25 2.986 12.596 -0.031 1.00 0.00 N ATOM 335 CA SER A 25 3.418 11.446 0.746 1.00 0.00 C ATOM 336 C SER A 25 2.218 10.808 1.448 1.00 0.00 C ATOM 337 O SER A 25 2.139 9.586 1.562 1.00 0.00 O ATOM 338 CB SER A 25 4.483 11.843 1.771 1.00 0.00 C ATOM 339 OG SER A 25 4.041 12.901 2.617 1.00 0.00 O ATOM 0 H SER A 25 3.074 13.492 0.448 1.00 0.00 H new ATOM 0 HA SER A 25 3.861 10.719 0.065 1.00 0.00 H new ATOM 0 HB2 SER A 25 4.742 10.976 2.379 1.00 0.00 H new ATOM 0 HB3 SER A 25 5.390 12.150 1.251 1.00 0.00 H new ATOM 0 HG SER A 25 3.817 13.684 2.072 1.00 0.00 H new ATOM 345 N ILE A 26 1.314 11.664 1.902 1.00 0.00 N ATOM 346 CA ILE A 26 0.122 11.199 2.590 1.00 0.00 C ATOM 347 C ILE A 26 -0.733 10.378 1.622 1.00 0.00 C ATOM 348 O ILE A 26 -1.333 9.379 2.013 1.00 0.00 O ATOM 349 CB ILE A 26 -0.624 12.375 3.224 1.00 0.00 C ATOM 350 CG1 ILE A 26 0.022 12.784 4.549 1.00 0.00 C ATOM 351 CG2 ILE A 26 -2.112 12.058 3.385 1.00 0.00 C ATOM 352 CD1 ILE A 26 -0.370 11.819 5.670 1.00 0.00 C ATOM 0 H ILE A 26 1.383 12.677 1.807 1.00 0.00 H new ATOM 0 HA ILE A 26 0.391 10.540 3.415 1.00 0.00 H new ATOM 0 HB ILE A 26 -0.548 13.230 2.552 1.00 0.00 H new ATOM 0 HG12 ILE A 26 1.106 12.799 4.440 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -0.286 13.796 4.811 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -2.619 12.910 3.838 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -2.548 11.854 2.407 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -2.231 11.184 4.025 1.00 0.00 H new ATOM 0 HD11 ILE A 26 0.102 12.132 6.601 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -1.453 11.825 5.793 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -0.039 10.812 5.416 1.00 0.00 H new ATOM 364 N ASN A 27 -0.761 10.831 0.377 1.00 0.00 N ATOM 365 CA ASN A 27 -1.532 10.151 -0.650 1.00 0.00 C ATOM 366 C ASN A 27 -1.366 8.639 -0.488 1.00 0.00 C ATOM 367 O ASN A 27 -2.342 7.924 -0.266 1.00 0.00 O ATOM 368 CB ASN A 27 -1.044 10.534 -2.048 1.00 0.00 C ATOM 369 CG ASN A 27 -2.193 11.080 -2.899 1.00 0.00 C ATOM 370 OD1 ASN A 27 -3.168 11.617 -2.401 1.00 0.00 O ATOM 371 ND2 ASN A 27 -2.024 10.912 -4.208 1.00 0.00 N ATOM 0 H ASN A 27 -0.262 11.661 0.056 1.00 0.00 H new ATOM 0 HA ASN A 27 -2.576 10.445 -0.540 1.00 0.00 H new ATOM 0 HB2 ASN A 27 -0.257 11.284 -1.970 1.00 0.00 H new ATOM 0 HB3 ASN A 27 -0.607 9.663 -2.536 1.00 0.00 H new ATOM 0 HD21 ASN A 27 -2.735 11.242 -4.861 1.00 0.00 H new ATOM 0 HD22 ASN A 27 -1.183 10.454 -4.559 1.00 0.00 H new ATOM 378 N SER A 28 -0.123 8.196 -0.606 1.00 0.00 N ATOM 379 CA SER A 28 0.183 6.782 -0.476 1.00 0.00 C ATOM 380 C SER A 28 1.458 6.596 0.349 1.00 0.00 C ATOM 381 O SER A 28 2.564 6.729 -0.173 1.00 0.00 O ATOM 382 CB SER A 28 0.338 6.123 -1.848 1.00 0.00 C ATOM 383 OG SER A 28 -0.100 6.976 -2.902 1.00 0.00 O ATOM 0 H SER A 28 0.684 8.792 -0.790 1.00 0.00 H new ATOM 0 HA SER A 28 -0.648 6.298 0.037 1.00 0.00 H new ATOM 0 HB2 SER A 28 1.383 5.858 -2.007 1.00 0.00 H new ATOM 0 HB3 SER A 28 -0.233 5.195 -1.871 1.00 0.00 H new ATOM 0 HG SER A 28 0.017 6.520 -3.762 1.00 0.00 H new ATOM 389 N ARG A 29 1.261 6.291 1.623 1.00 0.00 N ATOM 390 CA ARG A 29 2.382 6.086 2.525 1.00 0.00 C ATOM 391 C ARG A 29 2.007 5.082 3.617 1.00 0.00 C ATOM 392 O ARG A 29 0.829 4.904 3.924 1.00 0.00 O ATOM 393 CB ARG A 29 2.812 7.401 3.178 1.00 0.00 C ATOM 394 CG ARG A 29 3.655 7.143 4.428 1.00 0.00 C ATOM 395 CD ARG A 29 4.140 8.457 5.043 1.00 0.00 C ATOM 396 NE ARG A 29 5.451 8.832 4.468 1.00 0.00 N ATOM 397 CZ ARG A 29 6.113 9.956 4.776 1.00 0.00 C ATOM 398 NH1 ARG A 29 5.590 10.822 5.654 1.00 0.00 N ATOM 399 NH2 ARG A 29 7.297 10.215 4.204 1.00 0.00 N ATOM 0 H ARG A 29 0.342 6.181 2.052 1.00 0.00 H new ATOM 0 HA ARG A 29 3.213 5.697 1.937 1.00 0.00 H new ATOM 0 HB2 ARG A 29 3.384 7.995 2.465 1.00 0.00 H new ATOM 0 HB3 ARG A 29 1.930 7.984 3.444 1.00 0.00 H new ATOM 0 HG2 ARG A 29 3.066 6.590 5.160 1.00 0.00 H new ATOM 0 HG3 ARG A 29 4.511 6.520 4.171 1.00 0.00 H new ATOM 0 HD2 ARG A 29 3.412 9.246 4.855 1.00 0.00 H new ATOM 0 HD3 ARG A 29 4.225 8.352 6.125 1.00 0.00 H new ATOM 0 HE ARG A 29 5.878 8.195 3.795 1.00 0.00 H new ATOM 0 HH11 ARG A 29 4.688 10.626 6.088 1.00 0.00 H new ATOM 0 HH12 ARG A 29 6.094 11.677 5.888 1.00 0.00 H new ATOM 0 HH21 ARG A 29 7.695 9.557 3.534 1.00 0.00 H new ATOM 0 HH22 ARG A 29 7.800 11.070 4.439 1.00 0.00 H new ATOM 413 N VAL A 30 3.031 4.452 4.174 1.00 0.00 N ATOM 414 CA VAL A 30 2.824 3.470 5.225 1.00 0.00 C ATOM 415 C VAL A 30 3.824 3.720 6.355 1.00 0.00 C ATOM 416 O VAL A 30 4.970 4.090 6.104 1.00 0.00 O ATOM 417 CB VAL A 30 2.916 2.057 4.647 1.00 0.00 C ATOM 418 CG1 VAL A 30 2.974 1.011 5.762 1.00 0.00 C ATOM 419 CG2 VAL A 30 1.753 1.777 3.694 1.00 0.00 C ATOM 0 H VAL A 30 4.007 4.603 3.917 1.00 0.00 H new ATOM 0 HA VAL A 30 1.824 3.569 5.648 1.00 0.00 H new ATOM 0 HB VAL A 30 3.841 1.989 4.075 1.00 0.00 H new ATOM 0 HG11 VAL A 30 3.039 0.015 5.324 1.00 0.00 H new ATOM 0 HG12 VAL A 30 3.850 1.191 6.385 1.00 0.00 H new ATOM 0 HG13 VAL A 30 2.074 1.080 6.373 1.00 0.00 H new ATOM 0 HG21 VAL A 30 1.843 0.766 3.297 1.00 0.00 H new ATOM 0 HG22 VAL A 30 0.810 1.873 4.232 1.00 0.00 H new ATOM 0 HG23 VAL A 30 1.776 2.492 2.872 1.00 0.00 H new ATOM 429 N PHE A 31 3.355 3.510 7.576 1.00 0.00 N ATOM 430 CA PHE A 31 4.194 3.708 8.745 1.00 0.00 C ATOM 431 C PHE A 31 4.467 2.381 9.456 1.00 0.00 C ATOM 432 O PHE A 31 3.593 1.845 10.136 1.00 0.00 O ATOM 433 CB PHE A 31 3.428 4.633 9.694 1.00 0.00 C ATOM 434 CG PHE A 31 4.033 4.724 11.097 1.00 0.00 C ATOM 435 CD1 PHE A 31 5.056 5.585 11.342 1.00 0.00 C ATOM 436 CD2 PHE A 31 3.547 3.943 12.099 1.00 0.00 C ATOM 437 CE1 PHE A 31 5.617 5.670 12.643 1.00 0.00 C ATOM 438 CE2 PHE A 31 4.108 4.028 13.400 1.00 0.00 C ATOM 439 CZ PHE A 31 5.131 4.889 13.645 1.00 0.00 C ATOM 0 H PHE A 31 2.404 3.204 7.781 1.00 0.00 H new ATOM 0 HA PHE A 31 5.152 4.133 8.447 1.00 0.00 H new ATOM 0 HB2 PHE A 31 3.391 5.632 9.260 1.00 0.00 H new ATOM 0 HB3 PHE A 31 2.399 4.282 9.775 1.00 0.00 H new ATOM 0 HD1 PHE A 31 5.442 6.205 10.546 1.00 0.00 H new ATOM 0 HD2 PHE A 31 2.735 3.258 11.905 1.00 0.00 H new ATOM 0 HE1 PHE A 31 6.429 6.355 12.837 1.00 0.00 H new ATOM 0 HE2 PHE A 31 3.722 3.408 14.196 1.00 0.00 H new ATOM 0 HZ PHE A 31 5.558 4.953 14.635 1.00 0.00 H new ATOM 449 N ILE A 32 5.683 1.887 9.274 1.00 0.00 N ATOM 450 CA ILE A 32 6.082 0.633 9.889 1.00 0.00 C ATOM 451 C ILE A 32 6.658 0.912 11.278 1.00 0.00 C ATOM 452 O ILE A 32 7.693 1.563 11.406 1.00 0.00 O ATOM 453 CB ILE A 32 7.035 -0.135 8.971 1.00 0.00 C ATOM 454 CG1 ILE A 32 6.397 -0.382 7.602 1.00 0.00 C ATOM 455 CG2 ILE A 32 7.501 -1.435 9.628 1.00 0.00 C ATOM 456 CD1 ILE A 32 6.993 0.550 6.544 1.00 0.00 C ATOM 0 H ILE A 32 6.405 2.333 8.709 1.00 0.00 H new ATOM 0 HA ILE A 32 5.217 -0.016 10.026 1.00 0.00 H new ATOM 0 HB ILE A 32 7.921 0.479 8.808 1.00 0.00 H new ATOM 0 HG12 ILE A 32 6.552 -1.420 7.306 1.00 0.00 H new ATOM 0 HG13 ILE A 32 5.320 -0.225 7.665 1.00 0.00 H new ATOM 0 HG21 ILE A 32 8.177 -1.961 8.954 1.00 0.00 H new ATOM 0 HG22 ILE A 32 8.021 -1.206 10.558 1.00 0.00 H new ATOM 0 HG23 ILE A 32 6.637 -2.065 9.840 1.00 0.00 H new ATOM 0 HD11 ILE A 32 6.523 0.354 5.580 1.00 0.00 H new ATOM 0 HD12 ILE A 32 6.815 1.587 6.831 1.00 0.00 H new ATOM 0 HD13 ILE A 32 8.066 0.374 6.467 1.00 0.00 H new ATOM 468 N GLY A 33 5.962 0.404 12.285 1.00 0.00 N ATOM 469 CA GLY A 33 6.391 0.591 13.661 1.00 0.00 C ATOM 470 C GLY A 33 6.919 -0.718 14.252 1.00 0.00 C ATOM 471 O GLY A 33 7.116 -1.695 13.531 1.00 0.00 O ATOM 0 H GLY A 33 5.104 -0.137 12.175 1.00 0.00 H new ATOM 0 HA2 GLY A 33 7.169 1.353 13.703 1.00 0.00 H new ATOM 0 HA3 GLY A 33 5.556 0.954 14.260 1.00 0.00 H new ATOM 475 N ASN A 34 7.133 -0.695 15.560 1.00 0.00 N ATOM 476 CA ASN A 34 7.634 -1.868 16.257 1.00 0.00 C ATOM 477 C ASN A 34 8.704 -2.547 15.399 1.00 0.00 C ATOM 478 O ASN A 34 8.746 -3.773 15.309 1.00 0.00 O ATOM 479 CB ASN A 34 6.515 -2.880 16.506 1.00 0.00 C ATOM 480 CG ASN A 34 6.620 -3.480 17.909 1.00 0.00 C ATOM 481 OD1 ASN A 34 7.292 -2.961 18.785 1.00 0.00 O ATOM 482 ND2 ASN A 34 5.921 -4.599 18.073 1.00 0.00 N ATOM 0 H ASN A 34 6.969 0.117 16.155 1.00 0.00 H new ATOM 0 HA ASN A 34 8.045 -1.543 17.213 1.00 0.00 H new ATOM 0 HB2 ASN A 34 5.547 -2.394 16.386 1.00 0.00 H new ATOM 0 HB3 ASN A 34 6.567 -3.675 15.762 1.00 0.00 H new ATOM 0 HD21 ASN A 34 5.927 -5.076 18.974 1.00 0.00 H new ATOM 0 HD22 ASN A 34 5.379 -4.980 17.297 1.00 0.00 H new ATOM 489 N LEU A 35 9.542 -1.720 14.791 1.00 0.00 N ATOM 490 CA LEU A 35 10.609 -2.226 13.944 1.00 0.00 C ATOM 491 C LEU A 35 11.946 -2.081 14.674 1.00 0.00 C ATOM 492 O LEU A 35 12.366 -0.969 14.992 1.00 0.00 O ATOM 493 CB LEU A 35 10.577 -1.540 12.577 1.00 0.00 C ATOM 494 CG LEU A 35 11.399 -2.209 11.473 1.00 0.00 C ATOM 495 CD1 LEU A 35 10.992 -3.672 11.295 1.00 0.00 C ATOM 496 CD2 LEU A 35 11.300 -1.423 10.163 1.00 0.00 C ATOM 0 H LEU A 35 9.504 -0.704 14.868 1.00 0.00 H new ATOM 0 HA LEU A 35 10.468 -3.288 13.746 1.00 0.00 H new ATOM 0 HB2 LEU A 35 9.540 -1.481 12.246 1.00 0.00 H new ATOM 0 HB3 LEU A 35 10.932 -0.516 12.698 1.00 0.00 H new ATOM 0 HG LEU A 35 12.446 -2.201 11.775 1.00 0.00 H new ATOM 0 HD11 LEU A 35 11.592 -4.123 10.504 1.00 0.00 H new ATOM 0 HD12 LEU A 35 11.156 -4.211 12.228 1.00 0.00 H new ATOM 0 HD13 LEU A 35 9.937 -3.726 11.026 1.00 0.00 H new ATOM 0 HD21 LEU A 35 11.893 -1.920 9.395 1.00 0.00 H new ATOM 0 HD22 LEU A 35 10.259 -1.377 9.844 1.00 0.00 H new ATOM 0 HD23 LEU A 35 11.678 -0.412 10.316 1.00 0.00 H new ATOM 508 N ASN A 36 12.577 -3.220 14.918 1.00 0.00 N ATOM 509 CA ASN A 36 13.857 -3.234 15.605 1.00 0.00 C ATOM 510 C ASN A 36 14.830 -2.302 14.879 1.00 0.00 C ATOM 511 O ASN A 36 15.752 -1.763 15.490 1.00 0.00 O ATOM 512 CB ASN A 36 14.463 -4.638 15.612 1.00 0.00 C ATOM 513 CG ASN A 36 15.280 -4.877 16.883 1.00 0.00 C ATOM 514 OD1 ASN A 36 15.140 -4.188 17.880 1.00 0.00 O ATOM 515 ND2 ASN A 36 16.139 -5.888 16.793 1.00 0.00 N ATOM 0 H ASN A 36 12.226 -4.140 14.652 1.00 0.00 H new ATOM 0 HA ASN A 36 13.693 -2.908 16.632 1.00 0.00 H new ATOM 0 HB2 ASN A 36 13.669 -5.381 15.541 1.00 0.00 H new ATOM 0 HB3 ASN A 36 15.100 -4.767 14.737 1.00 0.00 H new ATOM 0 HD21 ASN A 36 16.731 -6.127 17.589 1.00 0.00 H new ATOM 0 HD22 ASN A 36 16.206 -6.425 15.928 1.00 0.00 H new ATOM 522 N THR A 37 14.593 -2.143 13.585 1.00 0.00 N ATOM 523 CA THR A 37 15.437 -1.286 12.770 1.00 0.00 C ATOM 524 C THR A 37 16.911 -1.509 13.111 1.00 0.00 C ATOM 525 O THR A 37 17.741 -0.625 12.904 1.00 0.00 O ATOM 526 CB THR A 37 14.978 0.160 12.971 1.00 0.00 C ATOM 527 OG1 THR A 37 14.584 0.211 14.340 1.00 0.00 O ATOM 528 CG2 THR A 37 13.695 0.480 12.202 1.00 0.00 C ATOM 0 H THR A 37 13.829 -2.593 13.081 1.00 0.00 H new ATOM 0 HA THR A 37 15.341 -1.528 11.712 1.00 0.00 H new ATOM 0 HB THR A 37 15.769 0.839 12.654 1.00 0.00 H new ATOM 0 HG1 THR A 37 13.647 -0.063 14.421 1.00 0.00 H new ATOM 0 HG21 THR A 37 13.414 1.518 12.380 1.00 0.00 H new ATOM 0 HG22 THR A 37 13.862 0.327 11.136 1.00 0.00 H new ATOM 0 HG23 THR A 37 12.894 -0.176 12.542 1.00 0.00 H new ATOM 536 N ALA A 38 17.193 -2.697 13.627 1.00 0.00 N ATOM 537 CA ALA A 38 18.553 -3.047 13.999 1.00 0.00 C ATOM 538 C ALA A 38 19.106 -4.060 12.994 1.00 0.00 C ATOM 539 O ALA A 38 20.288 -4.022 12.656 1.00 0.00 O ATOM 540 CB ALA A 38 18.569 -3.580 15.433 1.00 0.00 C ATOM 0 H ALA A 38 16.503 -3.429 13.796 1.00 0.00 H new ATOM 0 HA ALA A 38 19.197 -2.168 13.971 1.00 0.00 H new ATOM 0 HB1 ALA A 38 19.589 -3.843 15.712 1.00 0.00 H new ATOM 0 HB2 ALA A 38 18.193 -2.813 16.110 1.00 0.00 H new ATOM 0 HB3 ALA A 38 17.936 -4.465 15.499 1.00 0.00 H new ATOM 546 N LEU A 39 18.226 -4.943 12.546 1.00 0.00 N ATOM 547 CA LEU A 39 18.611 -5.964 11.587 1.00 0.00 C ATOM 548 C LEU A 39 17.914 -5.694 10.253 1.00 0.00 C ATOM 549 O LEU A 39 18.477 -5.952 9.190 1.00 0.00 O ATOM 550 CB LEU A 39 18.339 -7.359 12.152 1.00 0.00 C ATOM 551 CG LEU A 39 18.641 -7.551 13.640 1.00 0.00 C ATOM 552 CD1 LEU A 39 18.275 -8.965 14.096 1.00 0.00 C ATOM 553 CD2 LEU A 39 20.098 -7.206 13.953 1.00 0.00 C ATOM 0 H LEU A 39 17.247 -4.972 12.830 1.00 0.00 H new ATOM 0 HA LEU A 39 19.684 -5.925 11.399 1.00 0.00 H new ATOM 0 HB2 LEU A 39 17.290 -7.601 11.980 1.00 0.00 H new ATOM 0 HB3 LEU A 39 18.929 -8.080 11.586 1.00 0.00 H new ATOM 0 HG LEU A 39 18.018 -6.859 14.207 1.00 0.00 H new ATOM 0 HD11 LEU A 39 18.500 -9.075 15.157 1.00 0.00 H new ATOM 0 HD12 LEU A 39 17.211 -9.137 13.931 1.00 0.00 H new ATOM 0 HD13 LEU A 39 18.853 -9.692 13.526 1.00 0.00 H new ATOM 0 HD21 LEU A 39 20.286 -7.351 15.017 1.00 0.00 H new ATOM 0 HD22 LEU A 39 20.757 -7.855 13.376 1.00 0.00 H new ATOM 0 HD23 LEU A 39 20.290 -6.166 13.689 1.00 0.00 H new ATOM 565 N VAL A 40 16.697 -5.179 10.351 1.00 0.00 N ATOM 566 CA VAL A 40 15.916 -4.871 9.165 1.00 0.00 C ATOM 567 C VAL A 40 16.467 -3.602 8.512 1.00 0.00 C ATOM 568 O VAL A 40 16.557 -2.558 9.155 1.00 0.00 O ATOM 569 CB VAL A 40 14.434 -4.762 9.528 1.00 0.00 C ATOM 570 CG1 VAL A 40 13.549 -5.049 8.313 1.00 0.00 C ATOM 571 CG2 VAL A 40 14.085 -5.690 10.693 1.00 0.00 C ATOM 0 H VAL A 40 16.233 -4.967 11.234 1.00 0.00 H new ATOM 0 HA VAL A 40 15.999 -5.675 8.434 1.00 0.00 H new ATOM 0 HB VAL A 40 14.242 -3.738 9.847 1.00 0.00 H new ATOM 0 HG11 VAL A 40 12.500 -4.965 8.599 1.00 0.00 H new ATOM 0 HG12 VAL A 40 13.769 -4.329 7.524 1.00 0.00 H new ATOM 0 HG13 VAL A 40 13.746 -6.057 7.949 1.00 0.00 H new ATOM 0 HG21 VAL A 40 13.026 -5.593 10.931 1.00 0.00 H new ATOM 0 HG22 VAL A 40 14.301 -6.721 10.414 1.00 0.00 H new ATOM 0 HG23 VAL A 40 14.679 -5.418 11.565 1.00 0.00 H new ATOM 581 N LYS A 41 16.821 -3.734 7.242 1.00 0.00 N ATOM 582 CA LYS A 41 17.360 -2.611 6.495 1.00 0.00 C ATOM 583 C LYS A 41 16.248 -1.982 5.653 1.00 0.00 C ATOM 584 O LYS A 41 15.101 -2.424 5.704 1.00 0.00 O ATOM 585 CB LYS A 41 18.578 -3.046 5.678 1.00 0.00 C ATOM 586 CG LYS A 41 19.620 -3.729 6.567 1.00 0.00 C ATOM 587 CD LYS A 41 20.999 -3.716 5.905 1.00 0.00 C ATOM 588 CE LYS A 41 22.070 -4.248 6.859 1.00 0.00 C ATOM 589 NZ LYS A 41 22.610 -5.535 6.367 1.00 0.00 N ATOM 0 H LYS A 41 16.745 -4.602 6.712 1.00 0.00 H new ATOM 0 HA LYS A 41 17.720 -1.839 7.175 1.00 0.00 H new ATOM 0 HB2 LYS A 41 18.265 -3.729 4.888 1.00 0.00 H new ATOM 0 HB3 LYS A 41 19.023 -2.178 5.192 1.00 0.00 H new ATOM 0 HG2 LYS A 41 19.670 -3.221 7.530 1.00 0.00 H new ATOM 0 HG3 LYS A 41 19.317 -4.757 6.764 1.00 0.00 H new ATOM 0 HD2 LYS A 41 20.978 -4.324 5.001 1.00 0.00 H new ATOM 0 HD3 LYS A 41 21.251 -2.700 5.600 1.00 0.00 H new ATOM 0 HE2 LYS A 41 22.876 -3.520 6.952 1.00 0.00 H new ATOM 0 HE3 LYS A 41 21.645 -4.382 7.854 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 23.336 -5.882 7.026 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 21.841 -6.232 6.301 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 23.034 -5.397 5.427 1.00 0.00 H new ATOM 603 N LYS A 42 16.626 -0.961 4.899 1.00 0.00 N ATOM 604 CA LYS A 42 15.675 -0.267 4.047 1.00 0.00 C ATOM 605 C LYS A 42 15.506 -1.043 2.740 1.00 0.00 C ATOM 606 O LYS A 42 14.397 -1.161 2.222 1.00 0.00 O ATOM 607 CB LYS A 42 16.097 1.190 3.848 1.00 0.00 C ATOM 608 CG LYS A 42 15.022 1.974 3.093 1.00 0.00 C ATOM 609 CD LYS A 42 15.639 3.135 2.309 1.00 0.00 C ATOM 610 CE LYS A 42 15.177 3.118 0.851 1.00 0.00 C ATOM 611 NZ LYS A 42 15.677 4.314 0.135 1.00 0.00 N ATOM 0 H LYS A 42 17.578 -0.597 4.860 1.00 0.00 H new ATOM 0 HA LYS A 42 14.695 -0.228 4.523 1.00 0.00 H new ATOM 0 HB2 LYS A 42 16.278 1.655 4.817 1.00 0.00 H new ATOM 0 HB3 LYS A 42 17.036 1.228 3.295 1.00 0.00 H new ATOM 0 HG2 LYS A 42 14.494 1.309 2.410 1.00 0.00 H new ATOM 0 HG3 LYS A 42 14.284 2.358 3.798 1.00 0.00 H new ATOM 0 HD2 LYS A 42 15.359 4.081 2.772 1.00 0.00 H new ATOM 0 HD3 LYS A 42 16.726 3.070 2.351 1.00 0.00 H new ATOM 0 HE2 LYS A 42 15.538 2.215 0.359 1.00 0.00 H new ATOM 0 HE3 LYS A 42 14.088 3.090 0.809 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 15.354 4.287 -0.853 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 15.312 5.172 0.595 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 16.717 4.324 0.160 1.00 0.00 H new ATOM 625 N SER A 43 16.624 -1.552 2.243 1.00 0.00 N ATOM 626 CA SER A 43 16.615 -2.314 1.005 1.00 0.00 C ATOM 627 C SER A 43 15.868 -3.633 1.209 1.00 0.00 C ATOM 628 O SER A 43 15.220 -4.132 0.290 1.00 0.00 O ATOM 629 CB SER A 43 18.038 -2.579 0.511 1.00 0.00 C ATOM 630 OG SER A 43 18.316 -1.896 -0.708 1.00 0.00 O ATOM 0 H SER A 43 17.542 -1.452 2.675 1.00 0.00 H new ATOM 0 HA SER A 43 16.100 -1.727 0.245 1.00 0.00 H new ATOM 0 HB2 SER A 43 18.751 -2.265 1.273 1.00 0.00 H new ATOM 0 HB3 SER A 43 18.178 -3.650 0.366 1.00 0.00 H new ATOM 0 HG SER A 43 19.235 -2.090 -0.989 1.00 0.00 H new ATOM 636 N ASP A 44 15.984 -4.162 2.419 1.00 0.00 N ATOM 637 CA ASP A 44 15.329 -5.414 2.755 1.00 0.00 C ATOM 638 C ASP A 44 13.823 -5.176 2.890 1.00 0.00 C ATOM 639 O ASP A 44 13.028 -5.794 2.184 1.00 0.00 O ATOM 640 CB ASP A 44 15.842 -5.964 4.087 1.00 0.00 C ATOM 641 CG ASP A 44 17.185 -6.693 4.011 1.00 0.00 C ATOM 642 OD1 ASP A 44 18.185 -6.009 3.704 1.00 0.00 O ATOM 643 OD2 ASP A 44 17.182 -7.918 4.261 1.00 0.00 O ATOM 0 H ASP A 44 16.522 -3.745 3.179 1.00 0.00 H new ATOM 0 HA ASP A 44 15.544 -6.131 1.962 1.00 0.00 H new ATOM 0 HB2 ASP A 44 15.933 -5.138 4.793 1.00 0.00 H new ATOM 0 HB3 ASP A 44 15.096 -6.648 4.492 1.00 0.00 H new ATOM 648 N VAL A 45 13.478 -4.279 3.802 1.00 0.00 N ATOM 649 CA VAL A 45 12.082 -3.952 4.039 1.00 0.00 C ATOM 650 C VAL A 45 11.431 -3.530 2.720 1.00 0.00 C ATOM 651 O VAL A 45 10.233 -3.729 2.523 1.00 0.00 O ATOM 652 CB VAL A 45 11.972 -2.884 5.129 1.00 0.00 C ATOM 653 CG1 VAL A 45 12.421 -1.518 4.605 1.00 0.00 C ATOM 654 CG2 VAL A 45 10.550 -2.817 5.689 1.00 0.00 C ATOM 0 H VAL A 45 14.141 -3.769 4.386 1.00 0.00 H new ATOM 0 HA VAL A 45 11.542 -4.826 4.404 1.00 0.00 H new ATOM 0 HB VAL A 45 12.639 -3.166 5.943 1.00 0.00 H new ATOM 0 HG11 VAL A 45 12.333 -0.777 5.399 1.00 0.00 H new ATOM 0 HG12 VAL A 45 13.459 -1.577 4.277 1.00 0.00 H new ATOM 0 HG13 VAL A 45 11.791 -1.226 3.765 1.00 0.00 H new ATOM 0 HG21 VAL A 45 10.499 -2.050 6.462 1.00 0.00 H new ATOM 0 HG22 VAL A 45 9.854 -2.571 4.887 1.00 0.00 H new ATOM 0 HG23 VAL A 45 10.282 -3.783 6.118 1.00 0.00 H new ATOM 664 N GLU A 46 12.248 -2.954 1.851 1.00 0.00 N ATOM 665 CA GLU A 46 11.767 -2.501 0.557 1.00 0.00 C ATOM 666 C GLU A 46 11.210 -3.680 -0.244 1.00 0.00 C ATOM 667 O GLU A 46 10.048 -3.667 -0.647 1.00 0.00 O ATOM 668 CB GLU A 46 12.873 -1.785 -0.220 1.00 0.00 C ATOM 669 CG GLU A 46 12.938 -0.304 0.159 1.00 0.00 C ATOM 670 CD GLU A 46 12.418 0.576 -0.980 1.00 0.00 C ATOM 671 OE1 GLU A 46 11.645 0.041 -1.804 1.00 0.00 O ATOM 672 OE2 GLU A 46 12.804 1.765 -1.000 1.00 0.00 O ATOM 0 H GLU A 46 13.241 -2.790 2.018 1.00 0.00 H new ATOM 0 HA GLU A 46 10.962 -1.785 0.721 1.00 0.00 H new ATOM 0 HB2 GLU A 46 13.833 -2.259 -0.014 1.00 0.00 H new ATOM 0 HB3 GLU A 46 12.692 -1.883 -1.290 1.00 0.00 H new ATOM 0 HG2 GLU A 46 12.347 -0.129 1.058 1.00 0.00 H new ATOM 0 HG3 GLU A 46 13.966 -0.030 0.395 1.00 0.00 H new ATOM 679 N THR A 47 12.065 -4.670 -0.451 1.00 0.00 N ATOM 680 CA THR A 47 11.673 -5.854 -1.196 1.00 0.00 C ATOM 681 C THR A 47 10.550 -6.596 -0.467 1.00 0.00 C ATOM 682 O THR A 47 9.737 -7.271 -1.096 1.00 0.00 O ATOM 683 CB THR A 47 12.922 -6.709 -1.417 1.00 0.00 C ATOM 684 OG1 THR A 47 13.592 -6.072 -2.501 1.00 0.00 O ATOM 685 CG2 THR A 47 12.591 -8.104 -1.952 1.00 0.00 C ATOM 0 H THR A 47 13.028 -4.677 -0.116 1.00 0.00 H new ATOM 0 HA THR A 47 11.265 -5.590 -2.172 1.00 0.00 H new ATOM 0 HB THR A 47 13.469 -6.801 -0.478 1.00 0.00 H new ATOM 0 HG1 THR A 47 14.415 -6.561 -2.710 1.00 0.00 H new ATOM 0 HG21 THR A 47 13.513 -8.669 -2.091 1.00 0.00 H new ATOM 0 HG22 THR A 47 11.951 -8.624 -1.240 1.00 0.00 H new ATOM 0 HG23 THR A 47 12.073 -8.014 -2.907 1.00 0.00 H new ATOM 693 N ILE A 48 10.542 -6.444 0.849 1.00 0.00 N ATOM 694 CA ILE A 48 9.532 -7.091 1.670 1.00 0.00 C ATOM 695 C ILE A 48 8.155 -6.529 1.314 1.00 0.00 C ATOM 696 O ILE A 48 7.201 -7.283 1.129 1.00 0.00 O ATOM 697 CB ILE A 48 9.885 -6.963 3.153 1.00 0.00 C ATOM 698 CG1 ILE A 48 11.120 -7.797 3.497 1.00 0.00 C ATOM 699 CG2 ILE A 48 8.687 -7.321 4.035 1.00 0.00 C ATOM 700 CD1 ILE A 48 11.630 -7.469 4.902 1.00 0.00 C ATOM 0 H ILE A 48 11.218 -5.883 1.367 1.00 0.00 H new ATOM 0 HA ILE A 48 9.502 -8.161 1.465 1.00 0.00 H new ATOM 0 HB ILE A 48 10.134 -5.921 3.356 1.00 0.00 H new ATOM 0 HG12 ILE A 48 10.876 -8.857 3.433 1.00 0.00 H new ATOM 0 HG13 ILE A 48 11.907 -7.606 2.767 1.00 0.00 H new ATOM 0 HG21 ILE A 48 8.965 -7.222 5.084 1.00 0.00 H new ATOM 0 HG22 ILE A 48 7.858 -6.648 3.814 1.00 0.00 H new ATOM 0 HG23 ILE A 48 8.383 -8.349 3.836 1.00 0.00 H new ATOM 0 HD11 ILE A 48 12.508 -8.076 5.121 1.00 0.00 H new ATOM 0 HD12 ILE A 48 11.896 -6.413 4.955 1.00 0.00 H new ATOM 0 HD13 ILE A 48 10.849 -7.684 5.632 1.00 0.00 H new ATOM 712 N PHE A 49 8.094 -5.208 1.229 1.00 0.00 N ATOM 713 CA PHE A 49 6.849 -4.535 0.899 1.00 0.00 C ATOM 714 C PHE A 49 6.713 -4.345 -0.612 1.00 0.00 C ATOM 715 O PHE A 49 5.638 -4.005 -1.105 1.00 0.00 O ATOM 716 CB PHE A 49 6.890 -3.162 1.573 1.00 0.00 C ATOM 717 CG PHE A 49 6.650 -3.202 3.083 1.00 0.00 C ATOM 718 CD1 PHE A 49 7.462 -3.946 3.882 1.00 0.00 C ATOM 719 CD2 PHE A 49 5.624 -2.495 3.628 1.00 0.00 C ATOM 720 CE1 PHE A 49 7.239 -3.983 5.283 1.00 0.00 C ATOM 721 CE2 PHE A 49 5.401 -2.532 5.030 1.00 0.00 C ATOM 722 CZ PHE A 49 6.213 -3.275 5.828 1.00 0.00 C ATOM 0 H PHE A 49 8.887 -4.585 1.383 1.00 0.00 H new ATOM 0 HA PHE A 49 6.002 -5.130 1.241 1.00 0.00 H new ATOM 0 HB2 PHE A 49 7.860 -2.704 1.382 1.00 0.00 H new ATOM 0 HB3 PHE A 49 6.138 -2.520 1.113 1.00 0.00 H new ATOM 0 HD1 PHE A 49 8.276 -4.509 3.450 1.00 0.00 H new ATOM 0 HD2 PHE A 49 4.978 -1.905 2.994 1.00 0.00 H new ATOM 0 HE1 PHE A 49 7.884 -4.573 5.917 1.00 0.00 H new ATOM 0 HE2 PHE A 49 4.586 -1.970 5.462 1.00 0.00 H new ATOM 0 HZ PHE A 49 6.044 -3.303 6.894 1.00 0.00 H new ATOM 732 N SER A 50 7.818 -4.572 -1.307 1.00 0.00 N ATOM 733 CA SER A 50 7.836 -4.429 -2.753 1.00 0.00 C ATOM 734 C SER A 50 6.828 -5.391 -3.386 1.00 0.00 C ATOM 735 O SER A 50 6.349 -5.153 -4.493 1.00 0.00 O ATOM 736 CB SER A 50 9.236 -4.682 -3.315 1.00 0.00 C ATOM 737 OG SER A 50 9.298 -4.453 -4.720 1.00 0.00 O ATOM 0 H SER A 50 8.708 -4.854 -0.895 1.00 0.00 H new ATOM 0 HA SER A 50 7.556 -3.405 -2.999 1.00 0.00 H new ATOM 0 HB2 SER A 50 9.952 -4.033 -2.810 1.00 0.00 H new ATOM 0 HB3 SER A 50 9.532 -5.709 -3.102 1.00 0.00 H new ATOM 0 HG SER A 50 10.209 -4.624 -5.039 1.00 0.00 H new ATOM 743 N LYS A 51 6.537 -6.457 -2.655 1.00 0.00 N ATOM 744 CA LYS A 51 5.595 -7.456 -3.132 1.00 0.00 C ATOM 745 C LYS A 51 4.244 -6.790 -3.399 1.00 0.00 C ATOM 746 O LYS A 51 3.446 -7.293 -4.189 1.00 0.00 O ATOM 747 CB LYS A 51 5.519 -8.630 -2.153 1.00 0.00 C ATOM 748 CG LYS A 51 4.977 -8.178 -0.796 1.00 0.00 C ATOM 749 CD LYS A 51 5.047 -9.313 0.228 1.00 0.00 C ATOM 750 CE LYS A 51 6.491 -9.776 0.436 1.00 0.00 C ATOM 751 NZ LYS A 51 6.648 -11.187 0.019 1.00 0.00 N ATOM 0 H LYS A 51 6.936 -6.651 -1.737 1.00 0.00 H new ATOM 0 HA LYS A 51 5.934 -7.880 -4.077 1.00 0.00 H new ATOM 0 HB2 LYS A 51 4.877 -9.410 -2.564 1.00 0.00 H new ATOM 0 HB3 LYS A 51 6.510 -9.067 -2.026 1.00 0.00 H new ATOM 0 HG2 LYS A 51 5.551 -7.324 -0.437 1.00 0.00 H new ATOM 0 HG3 LYS A 51 3.945 -7.845 -0.905 1.00 0.00 H new ATOM 0 HD2 LYS A 51 4.629 -8.978 1.177 1.00 0.00 H new ATOM 0 HD3 LYS A 51 4.438 -10.151 -0.111 1.00 0.00 H new ATOM 0 HE2 LYS A 51 7.168 -9.144 -0.138 1.00 0.00 H new ATOM 0 HE3 LYS A 51 6.766 -9.668 1.485 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 7.633 -11.485 0.167 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 6.016 -11.789 0.585 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 6.405 -11.280 -0.988 1.00 0.00 H new ATOM 765 N TYR A 52 4.029 -5.669 -2.726 1.00 0.00 N ATOM 766 CA TYR A 52 2.788 -4.929 -2.881 1.00 0.00 C ATOM 767 C TYR A 52 2.930 -3.838 -3.944 1.00 0.00 C ATOM 768 O TYR A 52 2.005 -3.058 -4.165 1.00 0.00 O ATOM 769 CB TYR A 52 2.516 -4.273 -1.526 1.00 0.00 C ATOM 770 CG TYR A 52 2.442 -5.261 -0.360 1.00 0.00 C ATOM 771 CD1 TYR A 52 1.375 -6.130 -0.259 1.00 0.00 C ATOM 772 CD2 TYR A 52 3.443 -5.283 0.590 1.00 0.00 C ATOM 773 CE1 TYR A 52 1.305 -7.059 0.839 1.00 0.00 C ATOM 774 CE2 TYR A 52 3.373 -6.212 1.688 1.00 0.00 C ATOM 775 CZ TYR A 52 2.307 -7.055 1.758 1.00 0.00 C ATOM 776 OH TYR A 52 2.242 -7.933 2.794 1.00 0.00 O ATOM 0 H TYR A 52 4.693 -5.255 -2.072 1.00 0.00 H new ATOM 0 HA TYR A 52 1.982 -5.593 -3.193 1.00 0.00 H new ATOM 0 HB2 TYR A 52 3.301 -3.545 -1.322 1.00 0.00 H new ATOM 0 HB3 TYR A 52 1.577 -3.722 -1.582 1.00 0.00 H new ATOM 0 HD1 TYR A 52 0.593 -6.113 -1.003 1.00 0.00 H new ATOM 0 HD2 TYR A 52 4.279 -4.604 0.510 1.00 0.00 H new ATOM 0 HE1 TYR A 52 0.475 -7.744 0.930 1.00 0.00 H new ATOM 0 HE2 TYR A 52 4.149 -6.239 2.439 1.00 0.00 H new ATOM 0 HH TYR A 52 3.109 -7.966 3.250 1.00 0.00 H new ATOM 786 N GLY A 53 4.096 -3.817 -4.574 1.00 0.00 N ATOM 787 CA GLY A 53 4.371 -2.834 -5.608 1.00 0.00 C ATOM 788 C GLY A 53 5.602 -1.997 -5.255 1.00 0.00 C ATOM 789 O GLY A 53 6.001 -1.932 -4.093 1.00 0.00 O ATOM 0 H GLY A 53 4.861 -4.465 -4.388 1.00 0.00 H new ATOM 0 HA2 GLY A 53 4.531 -3.338 -6.561 1.00 0.00 H new ATOM 0 HA3 GLY A 53 3.507 -2.182 -5.734 1.00 0.00 H new ATOM 793 N ARG A 54 6.171 -1.379 -6.280 1.00 0.00 N ATOM 794 CA ARG A 54 7.349 -0.549 -6.093 1.00 0.00 C ATOM 795 C ARG A 54 7.030 0.624 -5.165 1.00 0.00 C ATOM 796 O ARG A 54 6.003 1.283 -5.322 1.00 0.00 O ATOM 797 CB ARG A 54 7.860 -0.009 -7.430 1.00 0.00 C ATOM 798 CG ARG A 54 9.382 -0.133 -7.526 1.00 0.00 C ATOM 799 CD ARG A 54 9.785 -1.051 -8.682 1.00 0.00 C ATOM 800 NE ARG A 54 10.535 -0.283 -9.701 1.00 0.00 N ATOM 801 CZ ARG A 54 10.802 -0.733 -10.934 1.00 0.00 C ATOM 802 NH1 ARG A 54 10.383 -1.949 -11.309 1.00 0.00 N ATOM 803 NH2 ARG A 54 11.489 0.033 -11.792 1.00 0.00 N ATOM 0 H ARG A 54 5.838 -1.437 -7.242 1.00 0.00 H new ATOM 0 HA ARG A 54 8.125 -1.170 -5.645 1.00 0.00 H new ATOM 0 HB2 ARG A 54 7.395 -0.557 -8.249 1.00 0.00 H new ATOM 0 HB3 ARG A 54 7.569 1.036 -7.539 1.00 0.00 H new ATOM 0 HG2 ARG A 54 9.823 0.854 -7.670 1.00 0.00 H new ATOM 0 HG3 ARG A 54 9.778 -0.526 -6.590 1.00 0.00 H new ATOM 0 HD2 ARG A 54 10.398 -1.871 -8.309 1.00 0.00 H new ATOM 0 HD3 ARG A 54 8.897 -1.496 -9.131 1.00 0.00 H new ATOM 0 HE ARG A 54 10.869 0.647 -9.449 1.00 0.00 H new ATOM 0 HH11 ARG A 54 9.861 -2.532 -10.655 1.00 0.00 H new ATOM 0 HH12 ARG A 54 10.586 -2.291 -12.248 1.00 0.00 H new ATOM 0 HH21 ARG A 54 11.809 0.959 -11.506 1.00 0.00 H new ATOM 0 HH22 ARG A 54 11.693 -0.309 -12.731 1.00 0.00 H new ATOM 817 N VAL A 55 7.929 0.850 -4.218 1.00 0.00 N ATOM 818 CA VAL A 55 7.755 1.933 -3.265 1.00 0.00 C ATOM 819 C VAL A 55 8.432 3.195 -3.805 1.00 0.00 C ATOM 820 O VAL A 55 9.601 3.162 -4.187 1.00 0.00 O ATOM 821 CB VAL A 55 8.284 1.512 -1.892 1.00 0.00 C ATOM 822 CG1 VAL A 55 8.089 0.011 -1.667 1.00 0.00 C ATOM 823 CG2 VAL A 55 9.753 1.905 -1.726 1.00 0.00 C ATOM 0 H VAL A 55 8.780 0.302 -4.090 1.00 0.00 H new ATOM 0 HA VAL A 55 6.697 2.161 -3.135 1.00 0.00 H new ATOM 0 HB VAL A 55 7.708 2.043 -1.134 1.00 0.00 H new ATOM 0 HG11 VAL A 55 8.473 -0.263 -0.684 1.00 0.00 H new ATOM 0 HG12 VAL A 55 7.027 -0.230 -1.722 1.00 0.00 H new ATOM 0 HG13 VAL A 55 8.627 -0.545 -2.435 1.00 0.00 H new ATOM 0 HG21 VAL A 55 10.104 1.594 -0.742 1.00 0.00 H new ATOM 0 HG22 VAL A 55 10.350 1.415 -2.495 1.00 0.00 H new ATOM 0 HG23 VAL A 55 9.854 2.986 -1.822 1.00 0.00 H new ATOM 833 N ALA A 56 7.669 4.278 -3.818 1.00 0.00 N ATOM 834 CA ALA A 56 8.180 5.548 -4.305 1.00 0.00 C ATOM 835 C ALA A 56 9.374 5.974 -3.448 1.00 0.00 C ATOM 836 O ALA A 56 10.348 6.522 -3.963 1.00 0.00 O ATOM 837 CB ALA A 56 7.057 6.587 -4.297 1.00 0.00 C ATOM 0 H ALA A 56 6.700 4.302 -3.499 1.00 0.00 H new ATOM 0 HA ALA A 56 8.529 5.453 -5.333 1.00 0.00 H new ATOM 0 HB1 ALA A 56 7.440 7.540 -4.662 1.00 0.00 H new ATOM 0 HB2 ALA A 56 6.246 6.251 -4.942 1.00 0.00 H new ATOM 0 HB3 ALA A 56 6.684 6.712 -3.280 1.00 0.00 H new ATOM 843 N GLY A 57 9.260 5.705 -2.156 1.00 0.00 N ATOM 844 CA GLY A 57 10.319 6.054 -1.223 1.00 0.00 C ATOM 845 C GLY A 57 10.091 5.391 0.137 1.00 0.00 C ATOM 846 O GLY A 57 9.071 5.627 0.784 1.00 0.00 O ATOM 0 H GLY A 57 8.451 5.250 -1.733 1.00 0.00 H new ATOM 0 HA2 GLY A 57 11.282 5.742 -1.627 1.00 0.00 H new ATOM 0 HA3 GLY A 57 10.360 7.136 -1.102 1.00 0.00 H new ATOM 850 N CYS A 58 11.057 4.574 0.531 1.00 0.00 N ATOM 851 CA CYS A 58 10.974 3.876 1.802 1.00 0.00 C ATOM 852 C CYS A 58 12.104 4.381 2.702 1.00 0.00 C ATOM 853 O CYS A 58 13.246 4.505 2.261 1.00 0.00 O ATOM 854 CB CYS A 58 11.027 2.358 1.618 1.00 0.00 C ATOM 855 SG CYS A 58 11.272 1.539 3.236 1.00 0.00 S ATOM 0 H CYS A 58 11.901 4.380 -0.008 1.00 0.00 H new ATOM 0 HA CYS A 58 10.014 4.086 2.273 1.00 0.00 H new ATOM 0 HB2 CYS A 58 10.103 2.007 1.160 1.00 0.00 H new ATOM 0 HB3 CYS A 58 11.839 2.094 0.941 1.00 0.00 H new ATOM 0 HG CYS A 58 10.663 2.218 4.163 1.00 0.00 H new ATOM 861 N SER A 59 11.747 4.658 3.948 1.00 0.00 N ATOM 862 CA SER A 59 12.716 5.147 4.913 1.00 0.00 C ATOM 863 C SER A 59 12.755 4.221 6.131 1.00 0.00 C ATOM 864 O SER A 59 11.744 3.616 6.487 1.00 0.00 O ATOM 865 CB SER A 59 12.390 6.578 5.345 1.00 0.00 C ATOM 866 OG SER A 59 12.597 7.514 4.291 1.00 0.00 O ATOM 0 H SER A 59 10.800 4.553 4.311 1.00 0.00 H new ATOM 0 HA SER A 59 13.697 5.154 4.438 1.00 0.00 H new ATOM 0 HB2 SER A 59 11.353 6.629 5.677 1.00 0.00 H new ATOM 0 HB3 SER A 59 13.011 6.850 6.198 1.00 0.00 H new ATOM 0 HG SER A 59 12.376 8.415 4.606 1.00 0.00 H new ATOM 872 N VAL A 60 13.931 4.139 6.735 1.00 0.00 N ATOM 873 CA VAL A 60 14.114 3.297 7.905 1.00 0.00 C ATOM 874 C VAL A 60 14.682 4.138 9.049 1.00 0.00 C ATOM 875 O VAL A 60 15.757 4.722 8.921 1.00 0.00 O ATOM 876 CB VAL A 60 14.994 2.095 7.552 1.00 0.00 C ATOM 877 CG1 VAL A 60 15.482 1.384 8.815 1.00 0.00 C ATOM 878 CG2 VAL A 60 14.253 1.126 6.628 1.00 0.00 C ATOM 0 H VAL A 60 14.767 4.642 6.436 1.00 0.00 H new ATOM 0 HA VAL A 60 13.158 2.896 8.240 1.00 0.00 H new ATOM 0 HB VAL A 60 15.869 2.465 7.017 1.00 0.00 H new ATOM 0 HG11 VAL A 60 16.105 0.534 8.536 1.00 0.00 H new ATOM 0 HG12 VAL A 60 16.065 2.078 9.421 1.00 0.00 H new ATOM 0 HG13 VAL A 60 14.625 1.033 9.389 1.00 0.00 H new ATOM 0 HG21 VAL A 60 14.900 0.281 6.392 1.00 0.00 H new ATOM 0 HG22 VAL A 60 13.352 0.766 7.125 1.00 0.00 H new ATOM 0 HG23 VAL A 60 13.978 1.640 5.707 1.00 0.00 H new ATOM 888 N HIS A 61 13.935 4.173 10.143 1.00 0.00 N ATOM 889 CA HIS A 61 14.351 4.933 11.309 1.00 0.00 C ATOM 890 C HIS A 61 14.536 3.988 12.498 1.00 0.00 C ATOM 891 O HIS A 61 13.788 3.024 12.652 1.00 0.00 O ATOM 892 CB HIS A 61 13.365 6.066 11.600 1.00 0.00 C ATOM 893 CG HIS A 61 13.108 6.974 10.422 1.00 0.00 C ATOM 894 ND1 HIS A 61 13.802 8.155 10.220 1.00 0.00 N ATOM 895 CD2 HIS A 61 12.229 6.863 9.385 1.00 0.00 C ATOM 896 CE1 HIS A 61 13.352 8.721 9.110 1.00 0.00 C ATOM 897 NE2 HIS A 61 12.377 7.919 8.594 1.00 0.00 N ATOM 0 H HIS A 61 13.044 3.687 10.246 1.00 0.00 H new ATOM 0 HA HIS A 61 15.312 5.408 11.114 1.00 0.00 H new ATOM 0 HB2 HIS A 61 12.419 5.635 11.927 1.00 0.00 H new ATOM 0 HB3 HIS A 61 13.747 6.662 12.429 1.00 0.00 H new ATOM 0 HD2 HIS A 61 11.531 6.053 9.233 1.00 0.00 H new ATOM 0 HE1 HIS A 61 13.697 9.653 8.688 1.00 0.00 H new ATOM 0 HE2 HIS A 61 11.848 8.101 7.741 1.00 0.00 H new ATOM 905 N LYS A 62 15.538 4.298 13.309 1.00 0.00 N ATOM 906 CA LYS A 62 15.831 3.488 14.479 1.00 0.00 C ATOM 907 C LYS A 62 14.608 3.467 15.399 1.00 0.00 C ATOM 908 O LYS A 62 14.528 4.246 16.348 1.00 0.00 O ATOM 909 CB LYS A 62 17.107 3.979 15.165 1.00 0.00 C ATOM 910 CG LYS A 62 17.782 2.848 15.943 1.00 0.00 C ATOM 911 CD LYS A 62 17.289 2.808 17.390 1.00 0.00 C ATOM 912 CE LYS A 62 16.407 1.582 17.635 1.00 0.00 C ATOM 913 NZ LYS A 62 15.493 1.821 18.774 1.00 0.00 N ATOM 0 H LYS A 62 16.156 5.099 13.178 1.00 0.00 H new ATOM 0 HA LYS A 62 16.030 2.457 14.188 1.00 0.00 H new ATOM 0 HB2 LYS A 62 17.796 4.374 14.419 1.00 0.00 H new ATOM 0 HB3 LYS A 62 16.867 4.799 15.842 1.00 0.00 H new ATOM 0 HG2 LYS A 62 17.575 1.894 15.458 1.00 0.00 H new ATOM 0 HG3 LYS A 62 18.863 2.986 15.927 1.00 0.00 H new ATOM 0 HD2 LYS A 62 18.142 2.788 18.068 1.00 0.00 H new ATOM 0 HD3 LYS A 62 16.727 3.715 17.612 1.00 0.00 H new ATOM 0 HE2 LYS A 62 15.829 1.357 16.738 1.00 0.00 H new ATOM 0 HE3 LYS A 62 17.031 0.712 17.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 62 14.901 0.979 18.927 1.00 0.00 H new ATOM 0 HZ2 LYS A 62 16.050 2.013 19.631 1.00 0.00 H new ATOM 0 HZ3 LYS A 62 14.885 2.638 18.565 1.00 0.00 H new ATOM 927 N GLY A 63 13.687 2.569 15.085 1.00 0.00 N ATOM 928 CA GLY A 63 12.472 2.436 15.871 1.00 0.00 C ATOM 929 C GLY A 63 11.259 2.193 14.970 1.00 0.00 C ATOM 930 O GLY A 63 10.248 1.655 15.417 1.00 0.00 O ATOM 0 H GLY A 63 13.757 1.926 14.297 1.00 0.00 H new ATOM 0 HA2 GLY A 63 12.578 1.610 16.574 1.00 0.00 H new ATOM 0 HA3 GLY A 63 12.316 3.339 16.461 1.00 0.00 H new ATOM 934 N TYR A 64 11.401 2.601 13.718 1.00 0.00 N ATOM 935 CA TYR A 64 10.331 2.434 12.750 1.00 0.00 C ATOM 936 C TYR A 64 10.851 2.606 11.321 1.00 0.00 C ATOM 937 O TYR A 64 12.026 2.904 11.117 1.00 0.00 O ATOM 938 CB TYR A 64 9.317 3.541 13.048 1.00 0.00 C ATOM 939 CG TYR A 64 9.927 4.943 13.109 1.00 0.00 C ATOM 940 CD1 TYR A 64 10.577 5.363 14.251 1.00 0.00 C ATOM 941 CD2 TYR A 64 9.826 5.788 12.022 1.00 0.00 C ATOM 942 CE1 TYR A 64 11.151 6.683 14.309 1.00 0.00 C ATOM 943 CE2 TYR A 64 10.400 7.107 12.080 1.00 0.00 C ATOM 944 CZ TYR A 64 11.034 7.490 13.221 1.00 0.00 C ATOM 945 OH TYR A 64 11.576 8.736 13.275 1.00 0.00 O ATOM 0 H TYR A 64 12.242 3.047 13.351 1.00 0.00 H new ATOM 0 HA TYR A 64 9.897 1.437 12.826 1.00 0.00 H new ATOM 0 HB2 TYR A 64 8.542 3.526 12.281 1.00 0.00 H new ATOM 0 HB3 TYR A 64 8.829 3.326 13.999 1.00 0.00 H new ATOM 0 HD1 TYR A 64 10.656 4.702 15.102 1.00 0.00 H new ATOM 0 HD2 TYR A 64 9.316 5.460 11.128 1.00 0.00 H new ATOM 0 HE1 TYR A 64 11.663 7.024 15.197 1.00 0.00 H new ATOM 0 HE2 TYR A 64 10.329 7.778 11.236 1.00 0.00 H new ATOM 0 HH TYR A 64 11.417 9.199 12.426 1.00 0.00 H new ATOM 955 N ALA A 65 9.949 2.411 10.370 1.00 0.00 N ATOM 956 CA ALA A 65 10.302 2.541 8.967 1.00 0.00 C ATOM 957 C ALA A 65 9.076 3.002 8.177 1.00 0.00 C ATOM 958 O ALA A 65 7.946 2.659 8.522 1.00 0.00 O ATOM 959 CB ALA A 65 10.859 1.211 8.455 1.00 0.00 C ATOM 0 H ALA A 65 8.975 2.164 10.544 1.00 0.00 H new ATOM 0 HA ALA A 65 11.080 3.293 8.836 1.00 0.00 H new ATOM 0 HB1 ALA A 65 11.124 1.309 7.402 1.00 0.00 H new ATOM 0 HB2 ALA A 65 11.746 0.943 9.029 1.00 0.00 H new ATOM 0 HB3 ALA A 65 10.104 0.433 8.569 1.00 0.00 H new ATOM 965 N PHE A 66 9.340 3.772 7.132 1.00 0.00 N ATOM 966 CA PHE A 66 8.271 4.284 6.290 1.00 0.00 C ATOM 967 C PHE A 66 8.360 3.703 4.878 1.00 0.00 C ATOM 968 O PHE A 66 9.446 3.366 4.408 1.00 0.00 O ATOM 969 CB PHE A 66 8.447 5.802 6.217 1.00 0.00 C ATOM 970 CG PHE A 66 7.834 6.557 7.398 1.00 0.00 C ATOM 971 CD1 PHE A 66 8.483 6.594 8.592 1.00 0.00 C ATOM 972 CD2 PHE A 66 6.640 7.191 7.253 1.00 0.00 C ATOM 973 CE1 PHE A 66 7.914 7.296 9.688 1.00 0.00 C ATOM 974 CE2 PHE A 66 6.070 7.892 8.349 1.00 0.00 C ATOM 975 CZ PHE A 66 6.720 7.930 9.543 1.00 0.00 C ATOM 0 H PHE A 66 10.278 4.054 6.849 1.00 0.00 H new ATOM 0 HA PHE A 66 7.303 4.007 6.707 1.00 0.00 H new ATOM 0 HB2 PHE A 66 9.511 6.032 6.165 1.00 0.00 H new ATOM 0 HB3 PHE A 66 7.997 6.166 5.293 1.00 0.00 H new ATOM 0 HD1 PHE A 66 9.431 6.090 8.707 1.00 0.00 H new ATOM 0 HD2 PHE A 66 6.125 7.162 6.304 1.00 0.00 H new ATOM 0 HE1 PHE A 66 8.430 7.326 10.636 1.00 0.00 H new ATOM 0 HE2 PHE A 66 5.121 8.395 8.234 1.00 0.00 H new ATOM 0 HZ PHE A 66 6.288 8.464 10.376 1.00 0.00 H new ATOM 985 N VAL A 67 7.203 3.604 4.239 1.00 0.00 N ATOM 986 CA VAL A 67 7.137 3.069 2.890 1.00 0.00 C ATOM 987 C VAL A 67 6.158 3.905 2.063 1.00 0.00 C ATOM 988 O VAL A 67 4.973 3.980 2.385 1.00 0.00 O ATOM 989 CB VAL A 67 6.768 1.585 2.932 1.00 0.00 C ATOM 990 CG1 VAL A 67 6.483 1.051 1.527 1.00 0.00 C ATOM 991 CG2 VAL A 67 7.864 0.767 3.618 1.00 0.00 C ATOM 0 H VAL A 67 6.304 3.885 4.631 1.00 0.00 H new ATOM 0 HA VAL A 67 8.111 3.134 2.405 1.00 0.00 H new ATOM 0 HB VAL A 67 5.856 1.483 3.520 1.00 0.00 H new ATOM 0 HG11 VAL A 67 6.223 -0.006 1.585 1.00 0.00 H new ATOM 0 HG12 VAL A 67 5.653 1.605 1.089 1.00 0.00 H new ATOM 0 HG13 VAL A 67 7.370 1.173 0.905 1.00 0.00 H new ATOM 0 HG21 VAL A 67 7.577 -0.284 3.635 1.00 0.00 H new ATOM 0 HG22 VAL A 67 8.799 0.879 3.069 1.00 0.00 H new ATOM 0 HG23 VAL A 67 7.998 1.123 4.640 1.00 0.00 H new ATOM 1001 N GLN A 68 6.689 4.513 1.012 1.00 0.00 N ATOM 1002 CA GLN A 68 5.877 5.341 0.137 1.00 0.00 C ATOM 1003 C GLN A 68 5.570 4.596 -1.164 1.00 0.00 C ATOM 1004 O GLN A 68 6.421 3.881 -1.690 1.00 0.00 O ATOM 1005 CB GLN A 68 6.565 6.678 -0.147 1.00 0.00 C ATOM 1006 CG GLN A 68 5.750 7.515 -1.135 1.00 0.00 C ATOM 1007 CD GLN A 68 4.660 8.310 -0.413 1.00 0.00 C ATOM 1008 OE1 GLN A 68 4.703 8.521 0.788 1.00 0.00 O ATOM 1009 NE2 GLN A 68 3.685 8.737 -1.209 1.00 0.00 N ATOM 0 H GLN A 68 7.672 4.449 0.747 1.00 0.00 H new ATOM 0 HA GLN A 68 4.935 5.554 0.642 1.00 0.00 H new ATOM 0 HB2 GLN A 68 6.693 7.230 0.784 1.00 0.00 H new ATOM 0 HB3 GLN A 68 7.561 6.500 -0.551 1.00 0.00 H new ATOM 0 HG2 GLN A 68 6.410 8.199 -1.669 1.00 0.00 H new ATOM 0 HG3 GLN A 68 5.296 6.863 -1.881 1.00 0.00 H new ATOM 0 HE21 GLN A 68 3.711 8.525 -2.206 1.00 0.00 H new ATOM 0 HE22 GLN A 68 2.911 9.277 -0.823 1.00 0.00 H new ATOM 1018 N TYR A 69 4.350 4.788 -1.644 1.00 0.00 N ATOM 1019 CA TYR A 69 3.920 4.143 -2.873 1.00 0.00 C ATOM 1020 C TYR A 69 3.378 5.169 -3.870 1.00 0.00 C ATOM 1021 O TYR A 69 3.232 6.344 -3.540 1.00 0.00 O ATOM 1022 CB TYR A 69 2.790 3.190 -2.476 1.00 0.00 C ATOM 1023 CG TYR A 69 3.274 1.844 -1.931 1.00 0.00 C ATOM 1024 CD1 TYR A 69 3.549 0.807 -2.799 1.00 0.00 C ATOM 1025 CD2 TYR A 69 3.436 1.668 -0.572 1.00 0.00 C ATOM 1026 CE1 TYR A 69 4.004 -0.459 -2.287 1.00 0.00 C ATOM 1027 CE2 TYR A 69 3.891 0.401 -0.060 1.00 0.00 C ATOM 1028 CZ TYR A 69 4.153 -0.599 -0.942 1.00 0.00 C ATOM 1029 OH TYR A 69 4.583 -1.796 -0.458 1.00 0.00 O ATOM 0 H TYR A 69 3.646 5.381 -1.204 1.00 0.00 H new ATOM 0 HA TYR A 69 4.755 3.628 -3.348 1.00 0.00 H new ATOM 0 HB2 TYR A 69 2.169 3.673 -1.722 1.00 0.00 H new ATOM 0 HB3 TYR A 69 2.156 3.012 -3.345 1.00 0.00 H new ATOM 0 HD1 TYR A 69 3.423 0.945 -3.863 1.00 0.00 H new ATOM 0 HD2 TYR A 69 3.222 2.480 0.107 1.00 0.00 H new ATOM 0 HE1 TYR A 69 4.222 -1.279 -2.955 1.00 0.00 H new ATOM 0 HE2 TYR A 69 4.021 0.249 1.001 1.00 0.00 H new ATOM 0 HH TYR A 69 4.997 -2.312 -1.181 1.00 0.00 H new ATOM 1039 N SER A 70 3.095 4.686 -5.072 1.00 0.00 N ATOM 1040 CA SER A 70 2.572 5.547 -6.119 1.00 0.00 C ATOM 1041 C SER A 70 1.044 5.573 -6.061 1.00 0.00 C ATOM 1042 O SER A 70 0.428 6.613 -6.290 1.00 0.00 O ATOM 1043 CB SER A 70 3.043 5.083 -7.499 1.00 0.00 C ATOM 1044 OG SER A 70 2.113 4.191 -8.108 1.00 0.00 O ATOM 0 H SER A 70 3.218 3.710 -5.343 1.00 0.00 H new ATOM 0 HA SER A 70 2.952 6.555 -5.955 1.00 0.00 H new ATOM 0 HB2 SER A 70 3.189 5.950 -8.143 1.00 0.00 H new ATOM 0 HB3 SER A 70 4.010 4.590 -7.405 1.00 0.00 H new ATOM 0 HG SER A 70 2.449 3.919 -8.988 1.00 0.00 H new ATOM 1050 N ASN A 71 0.475 4.417 -5.754 1.00 0.00 N ATOM 1051 CA ASN A 71 -0.970 4.294 -5.663 1.00 0.00 C ATOM 1052 C ASN A 71 -1.376 4.180 -4.192 1.00 0.00 C ATOM 1053 O ASN A 71 -0.639 3.620 -3.382 1.00 0.00 O ATOM 1054 CB ASN A 71 -1.463 3.041 -6.388 1.00 0.00 C ATOM 1055 CG ASN A 71 -2.560 3.387 -7.397 1.00 0.00 C ATOM 1056 OD1 ASN A 71 -2.334 3.470 -8.594 1.00 0.00 O ATOM 1057 ND2 ASN A 71 -3.756 3.584 -6.850 1.00 0.00 N ATOM 0 H ASN A 71 0.989 3.556 -5.565 1.00 0.00 H new ATOM 0 HA ASN A 71 -1.413 5.176 -6.126 1.00 0.00 H new ATOM 0 HB2 ASN A 71 -0.629 2.562 -6.902 1.00 0.00 H new ATOM 0 HB3 ASN A 71 -1.845 2.323 -5.662 1.00 0.00 H new ATOM 0 HD21 ASN A 71 -4.554 3.820 -7.440 1.00 0.00 H new ATOM 0 HD22 ASN A 71 -3.875 3.499 -5.841 1.00 0.00 H new ATOM 1064 N GLU A 72 -2.548 4.720 -3.891 1.00 0.00 N ATOM 1065 CA GLU A 72 -3.061 4.686 -2.532 1.00 0.00 C ATOM 1066 C GLU A 72 -3.505 3.268 -2.168 1.00 0.00 C ATOM 1067 O GLU A 72 -3.765 2.975 -1.002 1.00 0.00 O ATOM 1068 CB GLU A 72 -4.208 5.682 -2.354 1.00 0.00 C ATOM 1069 CG GLU A 72 -5.312 5.438 -3.385 1.00 0.00 C ATOM 1070 CD GLU A 72 -6.602 6.159 -2.988 1.00 0.00 C ATOM 1071 OE1 GLU A 72 -6.978 6.038 -1.802 1.00 0.00 O ATOM 1072 OE2 GLU A 72 -7.183 6.814 -3.879 1.00 0.00 O ATOM 0 H GLU A 72 -3.157 5.184 -4.565 1.00 0.00 H new ATOM 0 HA GLU A 72 -2.260 4.980 -1.854 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -4.619 5.593 -1.348 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -3.830 6.699 -2.455 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -4.983 5.786 -4.364 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.502 4.368 -3.474 1.00 0.00 H new ATOM 1079 N ARG A 73 -3.578 2.425 -3.187 1.00 0.00 N ATOM 1080 CA ARG A 73 -3.986 1.044 -2.989 1.00 0.00 C ATOM 1081 C ARG A 73 -2.766 0.166 -2.704 1.00 0.00 C ATOM 1082 O ARG A 73 -2.832 -0.746 -1.881 1.00 0.00 O ATOM 1083 CB ARG A 73 -4.718 0.504 -4.219 1.00 0.00 C ATOM 1084 CG ARG A 73 -6.061 1.213 -4.413 1.00 0.00 C ATOM 1085 CD ARG A 73 -7.075 0.290 -5.092 1.00 0.00 C ATOM 1086 NE ARG A 73 -8.188 1.087 -5.654 1.00 0.00 N ATOM 1087 CZ ARG A 73 -9.119 0.596 -6.484 1.00 0.00 C ATOM 1088 NH1 ARG A 73 -9.077 -0.691 -6.852 1.00 0.00 N ATOM 1089 NH2 ARG A 73 -10.092 1.394 -6.945 1.00 0.00 N ATOM 0 H ARG A 73 -3.362 2.671 -4.153 1.00 0.00 H new ATOM 0 HA ARG A 73 -4.664 1.018 -2.136 1.00 0.00 H new ATOM 0 HB2 ARG A 73 -4.098 0.642 -5.105 1.00 0.00 H new ATOM 0 HB3 ARG A 73 -4.881 -0.568 -4.108 1.00 0.00 H new ATOM 0 HG2 ARG A 73 -6.448 1.537 -3.447 1.00 0.00 H new ATOM 0 HG3 ARG A 73 -5.919 2.110 -5.016 1.00 0.00 H new ATOM 0 HD2 ARG A 73 -6.588 -0.279 -5.884 1.00 0.00 H new ATOM 0 HD3 ARG A 73 -7.461 -0.432 -4.372 1.00 0.00 H new ATOM 0 HE ARG A 73 -8.251 2.071 -5.394 1.00 0.00 H new ATOM 0 HH11 ARG A 73 -8.336 -1.298 -6.501 1.00 0.00 H new ATOM 0 HH12 ARG A 73 -9.786 -1.064 -7.484 1.00 0.00 H new ATOM 0 HH21 ARG A 73 -10.124 2.374 -6.664 1.00 0.00 H new ATOM 0 HH22 ARG A 73 -10.801 1.021 -7.577 1.00 0.00 H new ATOM 1103 N HIS A 74 -1.681 0.471 -3.402 1.00 0.00 N ATOM 1104 CA HIS A 74 -0.449 -0.280 -3.234 1.00 0.00 C ATOM 1105 C HIS A 74 0.009 -0.196 -1.777 1.00 0.00 C ATOM 1106 O HIS A 74 0.808 -1.015 -1.325 1.00 0.00 O ATOM 1107 CB HIS A 74 0.618 0.201 -4.219 1.00 0.00 C ATOM 1108 CG HIS A 74 0.284 -0.070 -5.667 1.00 0.00 C ATOM 1109 ND1 HIS A 74 1.250 -0.171 -6.653 1.00 0.00 N ATOM 1110 CD2 HIS A 74 -0.917 -0.261 -6.284 1.00 0.00 C ATOM 1111 CE1 HIS A 74 0.646 -0.411 -7.807 1.00 0.00 C ATOM 1112 NE2 HIS A 74 -0.698 -0.466 -7.576 1.00 0.00 N ATOM 0 H HIS A 74 -1.630 1.227 -4.084 1.00 0.00 H new ATOM 0 HA HIS A 74 -0.625 -1.331 -3.463 1.00 0.00 H new ATOM 0 HB2 HIS A 74 0.765 1.273 -4.085 1.00 0.00 H new ATOM 0 HB3 HIS A 74 1.565 -0.283 -3.978 1.00 0.00 H new ATOM 0 HD2 HIS A 74 -1.883 -0.248 -5.802 1.00 0.00 H new ATOM 0 HE1 HIS A 74 1.132 -0.540 -8.763 1.00 0.00 H new ATOM 0 HE2 HIS A 74 -1.416 -0.637 -8.281 1.00 0.00 H new ATOM 1120 N ALA A 75 -0.516 0.802 -1.082 1.00 0.00 N ATOM 1121 CA ALA A 75 -0.171 1.004 0.315 1.00 0.00 C ATOM 1122 C ALA A 75 -1.033 0.088 1.187 1.00 0.00 C ATOM 1123 O ALA A 75 -0.516 -0.812 1.847 1.00 0.00 O ATOM 1124 CB ALA A 75 -0.343 2.482 0.675 1.00 0.00 C ATOM 0 H ALA A 75 -1.178 1.480 -1.460 1.00 0.00 H new ATOM 0 HA ALA A 75 0.872 0.744 0.494 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -0.084 2.634 1.723 1.00 0.00 H new ATOM 0 HB2 ALA A 75 0.312 3.088 0.048 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -1.379 2.778 0.510 1.00 0.00 H new ATOM 1130 N ARG A 76 -2.331 0.349 1.161 1.00 0.00 N ATOM 1131 CA ARG A 76 -3.269 -0.441 1.940 1.00 0.00 C ATOM 1132 C ARG A 76 -2.892 -1.923 1.881 1.00 0.00 C ATOM 1133 O ARG A 76 -2.944 -2.621 2.893 1.00 0.00 O ATOM 1134 CB ARG A 76 -4.699 -0.265 1.424 1.00 0.00 C ATOM 1135 CG ARG A 76 -5.414 0.866 2.166 1.00 0.00 C ATOM 1136 CD ARG A 76 -6.351 0.310 3.241 1.00 0.00 C ATOM 1137 NE ARG A 76 -7.759 0.450 2.807 1.00 0.00 N ATOM 1138 CZ ARG A 76 -8.814 0.272 3.613 1.00 0.00 C ATOM 1139 NH1 ARG A 76 -8.628 -0.053 4.900 1.00 0.00 N ATOM 1140 NH2 ARG A 76 -10.056 0.420 3.133 1.00 0.00 N ATOM 0 H ARG A 76 -2.756 1.097 0.613 1.00 0.00 H new ATOM 0 HA ARG A 76 -3.221 -0.091 2.971 1.00 0.00 H new ATOM 0 HB2 ARG A 76 -4.680 -0.049 0.356 1.00 0.00 H new ATOM 0 HB3 ARG A 76 -5.253 -1.195 1.551 1.00 0.00 H new ATOM 0 HG2 ARG A 76 -4.679 1.526 2.626 1.00 0.00 H new ATOM 0 HG3 ARG A 76 -5.984 1.467 1.458 1.00 0.00 H new ATOM 0 HD2 ARG A 76 -6.122 -0.739 3.427 1.00 0.00 H new ATOM 0 HD3 ARG A 76 -6.197 0.842 4.180 1.00 0.00 H new ATOM 0 HE ARG A 76 -7.937 0.697 1.834 1.00 0.00 H new ATOM 0 HH11 ARG A 76 -7.683 -0.165 5.266 1.00 0.00 H new ATOM 0 HH12 ARG A 76 -9.432 -0.188 5.513 1.00 0.00 H new ATOM 0 HH21 ARG A 76 -10.198 0.668 2.154 1.00 0.00 H new ATOM 0 HH22 ARG A 76 -10.859 0.284 3.747 1.00 0.00 H new ATOM 1154 N ALA A 77 -2.521 -2.359 0.687 1.00 0.00 N ATOM 1155 CA ALA A 77 -2.135 -3.745 0.483 1.00 0.00 C ATOM 1156 C ALA A 77 -0.944 -4.076 1.384 1.00 0.00 C ATOM 1157 O ALA A 77 -0.963 -5.074 2.103 1.00 0.00 O ATOM 1158 CB ALA A 77 -1.829 -3.978 -0.998 1.00 0.00 C ATOM 0 H ALA A 77 -2.479 -1.777 -0.150 1.00 0.00 H new ATOM 0 HA ALA A 77 -2.951 -4.414 0.756 1.00 0.00 H new ATOM 0 HB1 ALA A 77 -1.539 -5.018 -1.151 1.00 0.00 H new ATOM 0 HB2 ALA A 77 -2.716 -3.757 -1.592 1.00 0.00 H new ATOM 0 HB3 ALA A 77 -1.013 -3.325 -1.308 1.00 0.00 H new ATOM 1164 N ALA A 78 0.065 -3.220 1.315 1.00 0.00 N ATOM 1165 CA ALA A 78 1.263 -3.409 2.116 1.00 0.00 C ATOM 1166 C ALA A 78 0.939 -3.129 3.585 1.00 0.00 C ATOM 1167 O ALA A 78 1.601 -3.650 4.481 1.00 0.00 O ATOM 1168 CB ALA A 78 2.380 -2.509 1.584 1.00 0.00 C ATOM 0 H ALA A 78 0.078 -2.394 0.717 1.00 0.00 H new ATOM 0 HA ALA A 78 1.613 -4.439 2.046 1.00 0.00 H new ATOM 0 HB1 ALA A 78 3.279 -2.651 2.185 1.00 0.00 H new ATOM 0 HB2 ALA A 78 2.593 -2.767 0.547 1.00 0.00 H new ATOM 0 HB3 ALA A 78 2.066 -1.467 1.641 1.00 0.00 H new ATOM 1174 N VAL A 79 -0.080 -2.306 3.787 1.00 0.00 N ATOM 1175 CA VAL A 79 -0.500 -1.951 5.131 1.00 0.00 C ATOM 1176 C VAL A 79 -1.002 -3.204 5.852 1.00 0.00 C ATOM 1177 O VAL A 79 -0.352 -3.697 6.773 1.00 0.00 O ATOM 1178 CB VAL A 79 -1.545 -0.834 5.075 1.00 0.00 C ATOM 1179 CG1 VAL A 79 -2.121 -0.553 6.464 1.00 0.00 C ATOM 1180 CG2 VAL A 79 -0.957 0.436 4.458 1.00 0.00 C ATOM 0 H VAL A 79 -0.627 -1.875 3.042 1.00 0.00 H new ATOM 0 HA VAL A 79 0.342 -1.562 5.704 1.00 0.00 H new ATOM 0 HB VAL A 79 -2.361 -1.170 4.435 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -2.861 0.245 6.397 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -2.594 -1.455 6.851 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -1.319 -0.248 7.136 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -1.720 1.214 4.430 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -0.114 0.776 5.059 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -0.617 0.224 3.444 1.00 0.00 H new ATOM 1190 N LEU A 80 -2.154 -3.682 5.406 1.00 0.00 N ATOM 1191 CA LEU A 80 -2.751 -4.868 5.997 1.00 0.00 C ATOM 1192 C LEU A 80 -1.898 -6.090 5.650 1.00 0.00 C ATOM 1193 O LEU A 80 -1.683 -6.961 6.491 1.00 0.00 O ATOM 1194 CB LEU A 80 -4.215 -5.000 5.573 1.00 0.00 C ATOM 1195 CG LEU A 80 -5.035 -3.708 5.586 1.00 0.00 C ATOM 1196 CD1 LEU A 80 -6.467 -3.963 5.109 1.00 0.00 C ATOM 1197 CD2 LEU A 80 -5.000 -3.050 6.966 1.00 0.00 C ATOM 0 H LEU A 80 -2.690 -3.270 4.642 1.00 0.00 H new ATOM 0 HA LEU A 80 -2.764 -4.786 7.084 1.00 0.00 H new ATOM 0 HB2 LEU A 80 -4.245 -5.416 4.566 1.00 0.00 H new ATOM 0 HB3 LEU A 80 -4.700 -5.721 6.231 1.00 0.00 H new ATOM 0 HG LEU A 80 -4.581 -3.008 4.884 1.00 0.00 H new ATOM 0 HD11 LEU A 80 -7.029 -3.029 5.128 1.00 0.00 H new ATOM 0 HD12 LEU A 80 -6.447 -4.354 4.092 1.00 0.00 H new ATOM 0 HD13 LEU A 80 -6.946 -4.688 5.767 1.00 0.00 H new ATOM 0 HD21 LEU A 80 -5.590 -2.134 6.947 1.00 0.00 H new ATOM 0 HD22 LEU A 80 -5.415 -3.734 7.706 1.00 0.00 H new ATOM 0 HD23 LEU A 80 -3.969 -2.812 7.230 1.00 0.00 H new ATOM 1209 N GLY A 81 -1.435 -6.115 4.408 1.00 0.00 N ATOM 1210 CA GLY A 81 -0.611 -7.216 3.939 1.00 0.00 C ATOM 1211 C GLY A 81 0.555 -7.474 4.897 1.00 0.00 C ATOM 1212 O GLY A 81 0.956 -8.620 5.097 1.00 0.00 O ATOM 0 H GLY A 81 -1.615 -5.391 3.713 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -1.218 -8.117 3.848 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -0.226 -6.989 2.945 1.00 0.00 H new ATOM 1216 N GLU A 82 1.066 -6.391 5.463 1.00 0.00 N ATOM 1217 CA GLU A 82 2.177 -6.486 6.394 1.00 0.00 C ATOM 1218 C GLU A 82 1.668 -6.421 7.835 1.00 0.00 C ATOM 1219 O GLU A 82 1.944 -7.314 8.635 1.00 0.00 O ATOM 1220 CB GLU A 82 3.211 -5.391 6.127 1.00 0.00 C ATOM 1221 CG GLU A 82 3.836 -5.552 4.740 1.00 0.00 C ATOM 1222 CD GLU A 82 4.774 -6.760 4.698 1.00 0.00 C ATOM 1223 OE1 GLU A 82 4.242 -7.890 4.631 1.00 0.00 O ATOM 1224 OE2 GLU A 82 6.001 -6.527 4.735 1.00 0.00 O ATOM 0 H GLU A 82 0.731 -5.442 5.295 1.00 0.00 H new ATOM 0 HA GLU A 82 2.669 -7.447 6.246 1.00 0.00 H new ATOM 0 HB2 GLU A 82 2.738 -4.412 6.205 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.991 -5.429 6.888 1.00 0.00 H new ATOM 0 HG2 GLU A 82 3.050 -5.672 3.995 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.388 -4.649 4.479 1.00 0.00 H new ATOM 1231 N ASN A 83 0.936 -5.356 8.123 1.00 0.00 N ATOM 1232 CA ASN A 83 0.386 -5.162 9.454 1.00 0.00 C ATOM 1233 C ASN A 83 -0.086 -6.509 10.007 1.00 0.00 C ATOM 1234 O ASN A 83 -1.048 -7.087 9.503 1.00 0.00 O ATOM 1235 CB ASN A 83 -0.816 -4.216 9.422 1.00 0.00 C ATOM 1236 CG ASN A 83 -1.670 -4.372 10.682 1.00 0.00 C ATOM 1237 OD1 ASN A 83 -2.781 -4.874 10.652 1.00 0.00 O ATOM 1238 ND2 ASN A 83 -1.090 -3.914 11.788 1.00 0.00 N ATOM 0 H ASN A 83 0.710 -4.617 7.457 1.00 0.00 H new ATOM 0 HA ASN A 83 1.166 -4.731 10.082 1.00 0.00 H new ATOM 0 HB2 ASN A 83 -0.470 -3.186 9.338 1.00 0.00 H new ATOM 0 HB3 ASN A 83 -1.422 -4.422 8.540 1.00 0.00 H new ATOM 0 HD21 ASN A 83 -1.579 -3.972 12.682 1.00 0.00 H new ATOM 0 HD22 ASN A 83 -0.157 -3.505 11.743 1.00 0.00 H new ATOM 1245 N GLY A 84 0.612 -6.969 11.034 1.00 0.00 N ATOM 1246 CA GLY A 84 0.276 -8.236 11.660 1.00 0.00 C ATOM 1247 C GLY A 84 1.484 -9.175 11.680 1.00 0.00 C ATOM 1248 O GLY A 84 1.590 -10.036 12.552 1.00 0.00 O ATOM 0 H GLY A 84 1.409 -6.487 11.449 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -0.071 -8.062 12.679 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -0.546 -8.706 11.120 1.00 0.00 H new ATOM 1252 N ARG A 85 2.363 -8.977 10.709 1.00 0.00 N ATOM 1253 CA ARG A 85 3.559 -9.796 10.604 1.00 0.00 C ATOM 1254 C ARG A 85 4.497 -9.518 11.780 1.00 0.00 C ATOM 1255 O ARG A 85 4.507 -8.414 12.324 1.00 0.00 O ATOM 1256 CB ARG A 85 4.300 -9.523 9.293 1.00 0.00 C ATOM 1257 CG ARG A 85 5.161 -10.721 8.891 1.00 0.00 C ATOM 1258 CD ARG A 85 6.595 -10.286 8.580 1.00 0.00 C ATOM 1259 NE ARG A 85 7.170 -11.151 7.526 1.00 0.00 N ATOM 1260 CZ ARG A 85 7.768 -12.326 7.763 1.00 0.00 C ATOM 1261 NH1 ARG A 85 7.875 -12.784 9.018 1.00 0.00 N ATOM 1262 NH2 ARG A 85 8.261 -13.044 6.744 1.00 0.00 N ATOM 0 H ARG A 85 2.271 -8.262 9.988 1.00 0.00 H new ATOM 0 HA ARG A 85 3.249 -10.841 10.622 1.00 0.00 H new ATOM 0 HB2 ARG A 85 3.581 -9.306 8.503 1.00 0.00 H new ATOM 0 HB3 ARG A 85 4.929 -8.639 9.404 1.00 0.00 H new ATOM 0 HG2 ARG A 85 5.167 -11.456 9.696 1.00 0.00 H new ATOM 0 HG3 ARG A 85 4.727 -11.208 8.018 1.00 0.00 H new ATOM 0 HD2 ARG A 85 6.605 -9.246 8.254 1.00 0.00 H new ATOM 0 HD3 ARG A 85 7.205 -10.344 9.482 1.00 0.00 H new ATOM 0 HE ARG A 85 7.107 -10.833 6.559 1.00 0.00 H new ATOM 0 HH11 ARG A 85 7.501 -12.238 9.794 1.00 0.00 H new ATOM 0 HH12 ARG A 85 8.331 -13.679 9.197 1.00 0.00 H new ATOM 0 HH21 ARG A 85 8.181 -12.696 5.789 1.00 0.00 H new ATOM 0 HH22 ARG A 85 8.716 -13.939 6.924 1.00 0.00 H new ATOM 1276 N VAL A 86 5.264 -10.537 12.138 1.00 0.00 N ATOM 1277 CA VAL A 86 6.204 -10.416 13.239 1.00 0.00 C ATOM 1278 C VAL A 86 7.632 -10.480 12.694 1.00 0.00 C ATOM 1279 O VAL A 86 7.902 -11.199 11.734 1.00 0.00 O ATOM 1280 CB VAL A 86 5.917 -11.489 14.292 1.00 0.00 C ATOM 1281 CG1 VAL A 86 5.467 -12.796 13.634 1.00 0.00 C ATOM 1282 CG2 VAL A 86 7.136 -11.718 15.188 1.00 0.00 C ATOM 0 H VAL A 86 5.254 -11.451 11.685 1.00 0.00 H new ATOM 0 HA VAL A 86 6.089 -9.453 13.736 1.00 0.00 H new ATOM 0 HB VAL A 86 5.101 -11.132 14.921 1.00 0.00 H new ATOM 0 HG11 VAL A 86 5.270 -13.542 14.404 1.00 0.00 H new ATOM 0 HG12 VAL A 86 4.558 -12.620 13.058 1.00 0.00 H new ATOM 0 HG13 VAL A 86 6.252 -13.159 12.971 1.00 0.00 H new ATOM 0 HG21 VAL A 86 6.905 -12.485 15.927 1.00 0.00 H new ATOM 0 HG22 VAL A 86 7.979 -12.043 14.579 1.00 0.00 H new ATOM 0 HG23 VAL A 86 7.393 -10.789 15.697 1.00 0.00 H new ATOM 1292 N LEU A 87 8.509 -9.718 13.332 1.00 0.00 N ATOM 1293 CA LEU A 87 9.902 -9.678 12.923 1.00 0.00 C ATOM 1294 C LEU A 87 10.780 -9.404 14.146 1.00 0.00 C ATOM 1295 O LEU A 87 10.666 -8.352 14.773 1.00 0.00 O ATOM 1296 CB LEU A 87 10.099 -8.673 11.787 1.00 0.00 C ATOM 1297 CG LEU A 87 11.272 -8.949 10.843 1.00 0.00 C ATOM 1298 CD1 LEU A 87 11.215 -8.035 9.617 1.00 0.00 C ATOM 1299 CD2 LEU A 87 12.607 -8.836 11.581 1.00 0.00 C ATOM 0 H LEU A 87 8.281 -9.124 14.129 1.00 0.00 H new ATOM 0 HA LEU A 87 10.208 -10.643 12.519 1.00 0.00 H new ATOM 0 HB2 LEU A 87 9.184 -8.638 11.196 1.00 0.00 H new ATOM 0 HB3 LEU A 87 10.235 -7.683 12.223 1.00 0.00 H new ATOM 0 HG LEU A 87 11.189 -9.975 10.484 1.00 0.00 H new ATOM 0 HD11 LEU A 87 12.059 -8.251 8.962 1.00 0.00 H new ATOM 0 HD12 LEU A 87 10.284 -8.208 9.077 1.00 0.00 H new ATOM 0 HD13 LEU A 87 11.261 -6.994 9.937 1.00 0.00 H new ATOM 0 HD21 LEU A 87 13.424 -9.037 10.888 1.00 0.00 H new ATOM 0 HD22 LEU A 87 12.714 -7.830 11.987 1.00 0.00 H new ATOM 0 HD23 LEU A 87 12.635 -9.561 12.395 1.00 0.00 H new ATOM 1311 N ALA A 88 11.637 -10.369 14.448 1.00 0.00 N ATOM 1312 CA ALA A 88 12.533 -10.245 15.585 1.00 0.00 C ATOM 1313 C ALA A 88 11.833 -10.765 16.841 1.00 0.00 C ATOM 1314 O ALA A 88 12.475 -10.995 17.865 1.00 0.00 O ATOM 1315 CB ALA A 88 12.979 -8.788 15.727 1.00 0.00 C ATOM 0 H ALA A 88 11.730 -11.240 13.925 1.00 0.00 H new ATOM 0 HA ALA A 88 13.429 -10.847 15.434 1.00 0.00 H new ATOM 0 HB1 ALA A 88 13.651 -8.695 16.580 1.00 0.00 H new ATOM 0 HB2 ALA A 88 13.498 -8.476 14.820 1.00 0.00 H new ATOM 0 HB3 ALA A 88 12.106 -8.154 15.882 1.00 0.00 H new ATOM 1321 N GLY A 89 10.524 -10.937 16.722 1.00 0.00 N ATOM 1322 CA GLY A 89 9.730 -11.426 17.836 1.00 0.00 C ATOM 1323 C GLY A 89 8.540 -10.503 18.108 1.00 0.00 C ATOM 1324 O GLY A 89 7.592 -10.891 18.789 1.00 0.00 O ATOM 0 H GLY A 89 9.994 -10.746 15.871 1.00 0.00 H new ATOM 0 HA2 GLY A 89 9.372 -12.432 17.618 1.00 0.00 H new ATOM 0 HA3 GLY A 89 10.352 -11.495 18.728 1.00 0.00 H new ATOM 1328 N GLN A 90 8.628 -9.300 17.561 1.00 0.00 N ATOM 1329 CA GLN A 90 7.571 -8.319 17.736 1.00 0.00 C ATOM 1330 C GLN A 90 6.685 -8.265 16.489 1.00 0.00 C ATOM 1331 O GLN A 90 7.142 -8.559 15.386 1.00 0.00 O ATOM 1332 CB GLN A 90 8.150 -6.939 18.056 1.00 0.00 C ATOM 1333 CG GLN A 90 8.134 -6.674 19.563 1.00 0.00 C ATOM 1334 CD GLN A 90 9.234 -5.687 19.958 1.00 0.00 C ATOM 1335 OE1 GLN A 90 9.893 -5.826 20.975 1.00 0.00 O ATOM 1336 NE2 GLN A 90 9.394 -4.684 19.099 1.00 0.00 N ATOM 0 H GLN A 90 9.415 -8.982 16.996 1.00 0.00 H new ATOM 0 HA GLN A 90 6.956 -8.624 18.583 1.00 0.00 H new ATOM 0 HB2 GLN A 90 9.172 -6.874 17.682 1.00 0.00 H new ATOM 0 HB3 GLN A 90 7.573 -6.170 17.542 1.00 0.00 H new ATOM 0 HG2 GLN A 90 7.162 -6.277 19.856 1.00 0.00 H new ATOM 0 HG3 GLN A 90 8.271 -7.611 20.102 1.00 0.00 H new ATOM 0 HE21 GLN A 90 8.808 -4.627 18.266 1.00 0.00 H new ATOM 0 HE22 GLN A 90 10.103 -3.971 19.273 1.00 0.00 H new ATOM 1345 N THR A 91 5.434 -7.887 16.707 1.00 0.00 N ATOM 1346 CA THR A 91 4.480 -7.791 15.615 1.00 0.00 C ATOM 1347 C THR A 91 4.588 -6.427 14.931 1.00 0.00 C ATOM 1348 O THR A 91 4.243 -5.404 15.520 1.00 0.00 O ATOM 1349 CB THR A 91 3.087 -8.080 16.178 1.00 0.00 C ATOM 1350 OG1 THR A 91 3.228 -9.342 16.825 1.00 0.00 O ATOM 1351 CG2 THR A 91 2.054 -8.338 15.079 1.00 0.00 C ATOM 0 H THR A 91 5.059 -7.644 17.624 1.00 0.00 H new ATOM 0 HA THR A 91 4.692 -8.526 14.839 1.00 0.00 H new ATOM 0 HB THR A 91 2.762 -7.240 16.792 1.00 0.00 H new ATOM 0 HG1 THR A 91 2.370 -9.605 17.220 1.00 0.00 H new ATOM 0 HG21 THR A 91 1.083 -8.538 15.532 1.00 0.00 H new ATOM 0 HG22 THR A 91 1.981 -7.461 14.435 1.00 0.00 H new ATOM 0 HG23 THR A 91 2.361 -9.199 14.486 1.00 0.00 H new ATOM 1359 N LEU A 92 5.070 -6.456 13.697 1.00 0.00 N ATOM 1360 CA LEU A 92 5.228 -5.235 12.926 1.00 0.00 C ATOM 1361 C LEU A 92 3.910 -4.458 12.934 1.00 0.00 C ATOM 1362 O LEU A 92 2.935 -4.876 12.310 1.00 0.00 O ATOM 1363 CB LEU A 92 5.748 -5.551 11.522 1.00 0.00 C ATOM 1364 CG LEU A 92 7.046 -6.357 11.453 1.00 0.00 C ATOM 1365 CD1 LEU A 92 7.319 -6.836 10.026 1.00 0.00 C ATOM 1366 CD2 LEU A 92 8.219 -5.557 12.023 1.00 0.00 C ATOM 0 H LEU A 92 5.356 -7.306 13.212 1.00 0.00 H new ATOM 0 HA LEU A 92 5.981 -4.591 13.381 1.00 0.00 H new ATOM 0 HB2 LEU A 92 4.974 -6.099 10.984 1.00 0.00 H new ATOM 0 HB3 LEU A 92 5.899 -4.611 10.992 1.00 0.00 H new ATOM 0 HG LEU A 92 6.930 -7.245 12.074 1.00 0.00 H new ATOM 0 HD11 LEU A 92 8.248 -7.406 10.005 1.00 0.00 H new ATOM 0 HD12 LEU A 92 6.497 -7.469 9.691 1.00 0.00 H new ATOM 0 HD13 LEU A 92 7.407 -5.975 9.364 1.00 0.00 H new ATOM 0 HD21 LEU A 92 9.130 -6.153 11.962 1.00 0.00 H new ATOM 0 HD22 LEU A 92 8.347 -4.639 11.449 1.00 0.00 H new ATOM 0 HD23 LEU A 92 8.017 -5.308 13.065 1.00 0.00 H new ATOM 1378 N ASP A 93 3.922 -3.342 13.647 1.00 0.00 N ATOM 1379 CA ASP A 93 2.739 -2.503 13.743 1.00 0.00 C ATOM 1380 C ASP A 93 2.761 -1.467 12.617 1.00 0.00 C ATOM 1381 O ASP A 93 3.440 -0.447 12.720 1.00 0.00 O ATOM 1382 CB ASP A 93 2.705 -1.751 15.076 1.00 0.00 C ATOM 1383 CG ASP A 93 1.794 -2.366 16.141 1.00 0.00 C ATOM 1384 OD1 ASP A 93 2.177 -3.433 16.668 1.00 0.00 O ATOM 1385 OD2 ASP A 93 0.736 -1.755 16.404 1.00 0.00 O ATOM 0 H ASP A 93 4.732 -2.999 14.164 1.00 0.00 H new ATOM 0 HA ASP A 93 1.862 -3.146 13.668 1.00 0.00 H new ATOM 0 HB2 ASP A 93 3.719 -1.699 15.473 1.00 0.00 H new ATOM 0 HB3 ASP A 93 2.382 -0.727 14.890 1.00 0.00 H new ATOM 1390 N ILE A 94 2.008 -1.765 11.568 1.00 0.00 N ATOM 1391 CA ILE A 94 1.932 -0.873 10.424 1.00 0.00 C ATOM 1392 C ILE A 94 0.540 -0.242 10.367 1.00 0.00 C ATOM 1393 O ILE A 94 -0.422 -0.802 10.891 1.00 0.00 O ATOM 1394 CB ILE A 94 2.327 -1.610 9.142 1.00 0.00 C ATOM 1395 CG1 ILE A 94 3.576 -2.465 9.364 1.00 0.00 C ATOM 1396 CG2 ILE A 94 2.500 -0.632 7.979 1.00 0.00 C ATOM 1397 CD1 ILE A 94 3.789 -3.436 8.201 1.00 0.00 C ATOM 0 H ILE A 94 1.445 -2.612 11.487 1.00 0.00 H new ATOM 0 HA ILE A 94 2.648 -0.058 10.528 1.00 0.00 H new ATOM 0 HB ILE A 94 1.517 -2.288 8.874 1.00 0.00 H new ATOM 0 HG12 ILE A 94 4.449 -1.820 9.469 1.00 0.00 H new ATOM 0 HG13 ILE A 94 3.478 -3.023 10.295 1.00 0.00 H new ATOM 0 HG21 ILE A 94 2.781 -1.181 7.080 1.00 0.00 H new ATOM 0 HG22 ILE A 94 1.562 -0.105 7.804 1.00 0.00 H new ATOM 0 HG23 ILE A 94 3.281 0.088 8.223 1.00 0.00 H new ATOM 0 HD11 ILE A 94 4.683 -4.032 8.384 1.00 0.00 H new ATOM 0 HD12 ILE A 94 2.925 -4.095 8.114 1.00 0.00 H new ATOM 0 HD13 ILE A 94 3.911 -2.874 7.275 1.00 0.00 H new ATOM 1409 N ASN A 95 0.476 0.916 9.726 1.00 0.00 N ATOM 1410 CA ASN A 95 -0.783 1.629 9.593 1.00 0.00 C ATOM 1411 C ASN A 95 -0.659 2.673 8.481 1.00 0.00 C ATOM 1412 O ASN A 95 0.448 3.021 8.073 1.00 0.00 O ATOM 1413 CB ASN A 95 -1.142 2.360 10.889 1.00 0.00 C ATOM 1414 CG ASN A 95 -2.395 1.759 11.528 1.00 0.00 C ATOM 1415 OD1 ASN A 95 -3.000 0.831 11.017 1.00 0.00 O ATOM 1416 ND2 ASN A 95 -2.750 2.339 12.671 1.00 0.00 N ATOM 0 H ASN A 95 1.276 1.378 9.293 1.00 0.00 H new ATOM 0 HA ASN A 95 -1.560 0.900 9.362 1.00 0.00 H new ATOM 0 HB2 ASN A 95 -0.308 2.299 11.588 1.00 0.00 H new ATOM 0 HB3 ASN A 95 -1.307 3.417 10.681 1.00 0.00 H new ATOM 0 HD21 ASN A 95 -3.574 2.011 13.175 1.00 0.00 H new ATOM 0 HD22 ASN A 95 -2.199 3.112 13.043 1.00 0.00 H new ATOM 1423 N MET A 96 -1.810 3.142 8.022 1.00 0.00 N ATOM 1424 CA MET A 96 -1.843 4.139 6.966 1.00 0.00 C ATOM 1425 C MET A 96 -1.361 5.498 7.478 1.00 0.00 C ATOM 1426 O MET A 96 -1.657 5.879 8.609 1.00 0.00 O ATOM 1427 CB MET A 96 -3.272 4.271 6.434 1.00 0.00 C ATOM 1428 CG MET A 96 -3.476 3.404 5.190 1.00 0.00 C ATOM 1429 SD MET A 96 -3.672 4.440 3.749 1.00 0.00 S ATOM 1430 CE MET A 96 -1.964 4.613 3.257 1.00 0.00 C ATOM 0 H MET A 96 -2.726 2.850 8.362 1.00 0.00 H new ATOM 0 HA MET A 96 -1.176 3.816 6.167 1.00 0.00 H new ATOM 0 HB2 MET A 96 -3.981 3.976 7.208 1.00 0.00 H new ATOM 0 HB3 MET A 96 -3.479 5.314 6.193 1.00 0.00 H new ATOM 0 HG2 MET A 96 -2.623 2.739 5.056 1.00 0.00 H new ATOM 0 HG3 MET A 96 -4.356 2.773 5.317 1.00 0.00 H new ATOM 0 HE1 MET A 96 -1.907 4.721 2.174 1.00 0.00 H new ATOM 0 HE2 MET A 96 -1.536 5.495 3.733 1.00 0.00 H new ATOM 0 HE3 MET A 96 -1.406 3.728 3.563 1.00 0.00 H new ATOM 1440 N ALA A 97 -0.627 6.191 6.620 1.00 0.00 N ATOM 1441 CA ALA A 97 -0.101 7.499 6.972 1.00 0.00 C ATOM 1442 C ALA A 97 -1.264 8.459 7.233 1.00 0.00 C ATOM 1443 O ALA A 97 -1.342 9.071 8.297 1.00 0.00 O ATOM 1444 CB ALA A 97 0.824 7.994 5.858 1.00 0.00 C ATOM 0 H ALA A 97 -0.384 5.872 5.682 1.00 0.00 H new ATOM 0 HA ALA A 97 0.490 7.441 7.886 1.00 0.00 H new ATOM 0 HB1 ALA A 97 1.219 8.975 6.122 1.00 0.00 H new ATOM 0 HB2 ALA A 97 1.649 7.293 5.732 1.00 0.00 H new ATOM 0 HB3 ALA A 97 0.264 8.067 4.926 1.00 0.00 H new ATOM 1450 N GLY A 98 -2.140 8.559 6.243 1.00 0.00 N ATOM 1451 CA GLY A 98 -3.295 9.434 6.353 1.00 0.00 C ATOM 1452 C GLY A 98 -4.439 8.740 7.095 1.00 0.00 C ATOM 1453 O GLY A 98 -5.543 8.618 6.567 1.00 0.00 O ATOM 0 H GLY A 98 -2.073 8.049 5.362 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -3.016 10.347 6.880 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -3.628 9.729 5.358 1.00 0.00 H new ATOM 1457 N GLU A 99 -4.136 8.304 8.309 1.00 0.00 N ATOM 1458 CA GLU A 99 -5.125 7.625 9.129 1.00 0.00 C ATOM 1459 C GLU A 99 -5.422 8.444 10.387 1.00 0.00 C ATOM 1460 O GLU A 99 -4.504 8.893 11.071 1.00 0.00 O ATOM 1461 CB GLU A 99 -4.662 6.213 9.490 1.00 0.00 C ATOM 1462 CG GLU A 99 -5.700 5.502 10.362 1.00 0.00 C ATOM 1463 CD GLU A 99 -5.248 4.080 10.703 1.00 0.00 C ATOM 1464 OE1 GLU A 99 -4.017 3.879 10.778 1.00 0.00 O ATOM 1465 OE2 GLU A 99 -6.144 3.228 10.881 1.00 0.00 O ATOM 0 H GLU A 99 -3.220 8.408 8.745 1.00 0.00 H new ATOM 0 HA GLU A 99 -6.046 7.533 8.553 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -4.492 5.638 8.580 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -3.710 6.262 10.019 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -5.857 6.068 11.280 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -6.657 5.468 9.841 1.00 0.00 H new ATOM 1472 N PRO A 100 -6.743 8.616 10.662 1.00 0.00 N ATOM 1473 CA PRO A 100 -7.173 9.372 11.826 1.00 0.00 C ATOM 1474 C PRO A 100 -6.976 8.562 13.109 1.00 0.00 C ATOM 1475 O PRO A 100 -6.229 7.585 13.122 1.00 0.00 O ATOM 1476 CB PRO A 100 -8.629 9.715 11.557 1.00 0.00 C ATOM 1477 CG PRO A 100 -9.092 8.749 10.478 1.00 0.00 C ATOM 1478 CD PRO A 100 -7.858 8.098 9.875 1.00 0.00 C ATOM 0 HA PRO A 100 -6.587 10.278 11.979 1.00 0.00 H new ATOM 0 HB2 PRO A 100 -9.229 9.608 12.461 1.00 0.00 H new ATOM 0 HB3 PRO A 100 -8.732 10.749 11.226 1.00 0.00 H new ATOM 0 HG2 PRO A 100 -9.754 7.993 10.901 1.00 0.00 H new ATOM 0 HG3 PRO A 100 -9.659 9.277 9.711 1.00 0.00 H new ATOM 0 HD2 PRO A 100 -7.914 7.011 9.936 1.00 0.00 H new ATOM 0 HD3 PRO A 100 -7.751 8.353 8.821 1.00 0.00 H new ATOM 1486 N LYS A 101 -7.659 8.999 14.157 1.00 0.00 N ATOM 1487 CA LYS A 101 -7.569 8.327 15.442 1.00 0.00 C ATOM 1488 C LYS A 101 -7.556 6.813 15.221 1.00 0.00 C ATOM 1489 O LYS A 101 -8.539 6.242 14.751 1.00 0.00 O ATOM 1490 CB LYS A 101 -8.685 8.802 16.375 1.00 0.00 C ATOM 1491 CG LYS A 101 -10.005 8.954 15.618 1.00 0.00 C ATOM 1492 CD LYS A 101 -10.257 10.415 15.242 1.00 0.00 C ATOM 1493 CE LYS A 101 -11.445 10.985 16.020 1.00 0.00 C ATOM 1494 NZ LYS A 101 -12.721 10.531 15.424 1.00 0.00 N ATOM 0 H LYS A 101 -8.277 9.810 14.142 1.00 0.00 H new ATOM 0 HA LYS A 101 -6.635 8.585 15.942 1.00 0.00 H new ATOM 0 HB2 LYS A 101 -8.809 8.090 17.191 1.00 0.00 H new ATOM 0 HB3 LYS A 101 -8.407 9.756 16.824 1.00 0.00 H new ATOM 0 HG2 LYS A 101 -9.984 8.341 14.717 1.00 0.00 H new ATOM 0 HG3 LYS A 101 -10.826 8.587 16.234 1.00 0.00 H new ATOM 0 HD2 LYS A 101 -9.365 11.006 15.449 1.00 0.00 H new ATOM 0 HD3 LYS A 101 -10.449 10.491 14.172 1.00 0.00 H new ATOM 0 HE2 LYS A 101 -11.391 10.669 17.062 1.00 0.00 H new ATOM 0 HE3 LYS A 101 -11.402 12.074 16.015 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 -13.517 10.927 15.964 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 -12.778 10.854 14.437 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 -12.767 9.492 15.451 1.00 0.00 H new ATOM 1508 N PRO A 102 -6.402 6.189 15.580 1.00 0.00 N ATOM 1509 CA PRO A 102 -6.247 4.753 15.425 1.00 0.00 C ATOM 1510 C PRO A 102 -7.030 3.999 16.502 1.00 0.00 C ATOM 1511 O PRO A 102 -6.771 4.164 17.693 1.00 0.00 O ATOM 1512 CB PRO A 102 -4.749 4.508 15.498 1.00 0.00 C ATOM 1513 CG PRO A 102 -4.156 5.745 16.152 1.00 0.00 C ATOM 1514 CD PRO A 102 -5.217 6.834 16.139 1.00 0.00 C ATOM 0 HA PRO A 102 -6.651 4.385 14.482 1.00 0.00 H new ATOM 0 HB2 PRO A 102 -4.527 3.614 16.081 1.00 0.00 H new ATOM 0 HB3 PRO A 102 -4.330 4.353 14.504 1.00 0.00 H new ATOM 0 HG2 PRO A 102 -3.847 5.525 17.174 1.00 0.00 H new ATOM 0 HG3 PRO A 102 -3.267 6.072 15.613 1.00 0.00 H new ATOM 0 HD2 PRO A 102 -5.408 7.213 17.143 1.00 0.00 H new ATOM 0 HD3 PRO A 102 -4.905 7.684 15.532 1.00 0.00 H new ATOM 1522 N ASP A 103 -7.971 3.187 16.045 1.00 0.00 N ATOM 1523 CA ASP A 103 -8.793 2.406 16.954 1.00 0.00 C ATOM 1524 C ASP A 103 -9.281 1.145 16.239 1.00 0.00 C ATOM 1525 O ASP A 103 -9.990 1.229 15.238 1.00 0.00 O ATOM 1526 CB ASP A 103 -10.022 3.199 17.404 1.00 0.00 C ATOM 1527 CG ASP A 103 -10.485 2.917 18.835 1.00 0.00 C ATOM 1528 OD1 ASP A 103 -10.583 1.718 19.174 1.00 0.00 O ATOM 1529 OD2 ASP A 103 -10.731 3.908 19.557 1.00 0.00 O ATOM 0 H ASP A 103 -8.183 3.053 15.056 1.00 0.00 H new ATOM 0 HA ASP A 103 -8.187 2.154 17.824 1.00 0.00 H new ATOM 0 HB2 ASP A 103 -9.803 4.263 17.312 1.00 0.00 H new ATOM 0 HB3 ASP A 103 -10.845 2.983 16.723 1.00 0.00 H new ATOM 1534 N ARG A 104 -8.880 0.004 16.781 1.00 0.00 N ATOM 1535 CA ARG A 104 -9.267 -1.274 16.208 1.00 0.00 C ATOM 1536 C ARG A 104 -9.446 -2.319 17.311 1.00 0.00 C ATOM 1537 O ARG A 104 -8.813 -2.231 18.362 1.00 0.00 O ATOM 1538 CB ARG A 104 -8.219 -1.770 15.210 1.00 0.00 C ATOM 1539 CG ARG A 104 -8.822 -2.790 14.242 1.00 0.00 C ATOM 1540 CD ARG A 104 -8.208 -2.653 12.848 1.00 0.00 C ATOM 1541 NE ARG A 104 -9.276 -2.643 11.823 1.00 0.00 N ATOM 1542 CZ ARG A 104 -10.004 -3.717 11.486 1.00 0.00 C ATOM 1543 NH1 ARG A 104 -9.784 -4.892 12.091 1.00 0.00 N ATOM 1544 NH2 ARG A 104 -10.953 -3.615 10.545 1.00 0.00 N ATOM 0 H ARG A 104 -8.291 -0.062 17.611 1.00 0.00 H new ATOM 0 HA ARG A 104 -10.212 -1.129 15.684 1.00 0.00 H new ATOM 0 HB2 ARG A 104 -7.817 -0.926 14.650 1.00 0.00 H new ATOM 0 HB3 ARG A 104 -7.385 -2.222 15.747 1.00 0.00 H new ATOM 0 HG2 ARG A 104 -8.654 -3.799 14.620 1.00 0.00 H new ATOM 0 HG3 ARG A 104 -9.901 -2.647 14.184 1.00 0.00 H new ATOM 0 HD2 ARG A 104 -7.625 -1.734 12.787 1.00 0.00 H new ATOM 0 HD3 ARG A 104 -7.521 -3.479 12.661 1.00 0.00 H new ATOM 0 HE ARG A 104 -9.470 -1.764 11.343 1.00 0.00 H new ATOM 0 HH11 ARG A 104 -9.063 -4.969 12.808 1.00 0.00 H new ATOM 0 HH12 ARG A 104 -10.338 -5.709 11.835 1.00 0.00 H new ATOM 0 HH21 ARG A 104 -11.121 -2.720 10.085 1.00 0.00 H new ATOM 0 HH22 ARG A 104 -11.507 -4.432 10.289 1.00 0.00 H new ATOM 1558 N SER A 105 -10.312 -3.283 17.034 1.00 0.00 N ATOM 1559 CA SER A 105 -10.582 -4.344 17.990 1.00 0.00 C ATOM 1560 C SER A 105 -10.752 -5.677 17.258 1.00 0.00 C ATOM 1561 O SER A 105 -11.616 -5.808 16.393 1.00 0.00 O ATOM 1562 CB SER A 105 -11.827 -4.032 18.821 1.00 0.00 C ATOM 1563 OG SER A 105 -11.510 -3.306 20.006 1.00 0.00 O ATOM 0 H SER A 105 -10.836 -3.352 16.161 1.00 0.00 H new ATOM 0 HA SER A 105 -9.733 -4.416 18.670 1.00 0.00 H new ATOM 0 HB2 SER A 105 -12.529 -3.455 18.219 1.00 0.00 H new ATOM 0 HB3 SER A 105 -12.327 -4.963 19.089 1.00 0.00 H new ATOM 0 HG SER A 105 -12.332 -3.125 20.508 1.00 0.00 H new ATOM 1569 N GLY A 106 -9.914 -6.632 17.633 1.00 0.00 N ATOM 1570 CA GLY A 106 -9.960 -7.950 17.023 1.00 0.00 C ATOM 1571 C GLY A 106 -9.164 -8.964 17.847 1.00 0.00 C ATOM 1572 O GLY A 106 -8.492 -8.596 18.810 1.00 0.00 O ATOM 0 H GLY A 106 -9.199 -6.519 18.352 1.00 0.00 H new ATOM 0 HA2 GLY A 106 -10.996 -8.279 16.937 1.00 0.00 H new ATOM 0 HA3 GLY A 106 -9.556 -7.901 16.012 1.00 0.00 H new ATOM 1576 N PRO A 107 -9.268 -10.253 17.428 1.00 0.00 N ATOM 1577 CA PRO A 107 -8.565 -11.323 18.116 1.00 0.00 C ATOM 1578 C PRO A 107 -7.071 -11.299 17.785 1.00 0.00 C ATOM 1579 O PRO A 107 -6.691 -11.312 16.616 1.00 0.00 O ATOM 1580 CB PRO A 107 -9.254 -12.600 17.664 1.00 0.00 C ATOM 1581 CG PRO A 107 -10.005 -12.241 16.392 1.00 0.00 C ATOM 1582 CD PRO A 107 -10.054 -10.726 16.292 1.00 0.00 C ATOM 0 HA PRO A 107 -8.608 -11.226 19.201 1.00 0.00 H new ATOM 0 HB2 PRO A 107 -8.527 -13.391 17.478 1.00 0.00 H new ATOM 0 HB3 PRO A 107 -9.937 -12.968 18.430 1.00 0.00 H new ATOM 0 HG2 PRO A 107 -9.505 -12.665 15.521 1.00 0.00 H new ATOM 0 HG3 PRO A 107 -11.013 -12.655 16.414 1.00 0.00 H new ATOM 0 HD2 PRO A 107 -9.635 -10.378 15.348 1.00 0.00 H new ATOM 0 HD3 PRO A 107 -11.079 -10.359 16.340 1.00 0.00 H new ATOM 1590 N SER A 108 -6.266 -11.266 18.836 1.00 0.00 N ATOM 1591 CA SER A 108 -4.822 -11.240 18.672 1.00 0.00 C ATOM 1592 C SER A 108 -4.400 -9.961 17.946 1.00 0.00 C ATOM 1593 O SER A 108 -4.505 -9.874 16.724 1.00 0.00 O ATOM 1594 CB SER A 108 -4.333 -12.471 17.906 1.00 0.00 C ATOM 1595 OG SER A 108 -3.597 -13.362 18.740 1.00 0.00 O ATOM 0 H SER A 108 -6.586 -11.257 19.805 1.00 0.00 H new ATOM 0 HA SER A 108 -4.365 -11.256 19.662 1.00 0.00 H new ATOM 0 HB2 SER A 108 -5.188 -12.996 17.480 1.00 0.00 H new ATOM 0 HB3 SER A 108 -3.706 -12.154 17.072 1.00 0.00 H new ATOM 0 HG SER A 108 -3.304 -14.135 18.214 1.00 0.00 H new ATOM 1601 N SER A 109 -3.933 -9.001 18.730 1.00 0.00 N ATOM 1602 CA SER A 109 -3.495 -7.730 18.177 1.00 0.00 C ATOM 1603 C SER A 109 -2.646 -6.978 19.204 1.00 0.00 C ATOM 1604 O SER A 109 -2.887 -7.077 20.406 1.00 0.00 O ATOM 1605 CB SER A 109 -4.689 -6.876 17.747 1.00 0.00 C ATOM 1606 OG SER A 109 -5.406 -6.359 18.865 1.00 0.00 O ATOM 0 H SER A 109 -3.848 -9.077 19.744 1.00 0.00 H new ATOM 0 HA SER A 109 -2.890 -7.931 17.293 1.00 0.00 H new ATOM 0 HB2 SER A 109 -4.340 -6.050 17.127 1.00 0.00 H new ATOM 0 HB3 SER A 109 -5.360 -7.475 17.131 1.00 0.00 H new ATOM 0 HG SER A 109 -6.159 -5.818 18.549 1.00 0.00 H new ATOM 1612 N GLY A 110 -1.671 -6.241 18.692 1.00 0.00 N ATOM 1613 CA GLY A 110 -0.785 -5.472 19.549 1.00 0.00 C ATOM 1614 C GLY A 110 0.639 -6.028 19.505 1.00 0.00 C ATOM 1615 O GLY A 110 0.837 -7.242 19.521 1.00 0.00 O ATOM 0 H GLY A 110 -1.475 -6.160 17.694 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -0.782 -4.429 19.232 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -1.156 -5.493 20.574 1.00 0.00 H new TER 1619 GLY A 110