USER MOD reduce.3.24.130724 H: found=0, std=0, add=1056, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 1054 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: B 2 CYS SG : rot 180:sc= 0 USER MOD Set 1.2: B 3 MET CE :methyl 158:sc= -0.0752 (180deg=-1.35) USER MOD Single : A 0 SER OG : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl -177:sc= 0 (180deg=-0.00639) USER MOD Single : A 2 CYS SG : rot 180:sc= 0.255 USER MOD Single : A 3 MET CE :methyl 168:sc= 0 (180deg=-0.159) USER MOD Single : A 5 LYS NZ :NH3+ 179:sc= 1.27 (180deg=1.26) USER MOD Single : A 9 THR OG1 : rot 160:sc= 0.753 USER MOD Single : A -3 GLY N :NH3+ -129:sc= 0.0671 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot 180:sc= 0 USER MOD Single : A 41 HIS : no HD1:sc= 0.885 K(o=0.88,f=-2.8!) USER MOD Single : A 55 SER OG : rot 180:sc= 0 USER MOD Single : A 59 SER OG : rot 180:sc= 0 USER MOD Single : A 64 GLN : amide:sc= 2.15 K(o=2.2,f=-5.7!) USER MOD Single : A 65 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 0 SER OG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 175:sc= 0 (180deg=-0.037) USER MOD Single : B 5 LYS NZ :NH3+ 178:sc= 1.24 (180deg=1.24) USER MOD Single : B 9 THR OG1 : rot -176:sc= 0.671 USER MOD Single : B -3 GLY N :NH3+ -127:sc= 0.0607 (180deg=0) USER MOD Single : B 10 LYS NZ :NH3+ 169:sc= 1.17 (180deg=0.993) USER MOD Single : B 34 THR OG1 : rot -110:sc= 0.0107 USER MOD Single : B 35 THR OG1 : rot -54:sc= 0.045 USER MOD Single : B 41 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 55 SER OG : rot 180:sc= 0 USER MOD Single : B 59 SER OG : rot -140:sc= 0.443 USER MOD Single : B 64 GLN : amide:sc= 1.68 K(o=1.7,f=-6.5!) USER MOD Single : B 65 ASN : amide:sc= 0.988 K(o=0.99,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A -3 24.700 8.267 -1.644 1.00 0.00 N ATOM 2 CA GLY A -3 23.513 8.512 -0.802 1.00 0.00 C ATOM 3 C GLY A -3 22.417 7.471 -1.023 1.00 0.00 C ATOM 4 O GLY A -3 22.710 6.372 -1.508 1.00 0.00 O ATOM 0 H1 GLY A -3 25.554 8.273 -1.050 1.00 0.00 H new ATOM 0 H2 GLY A -3 24.609 7.342 -2.111 1.00 0.00 H new ATOM 0 H3 GLY A -3 24.774 9.013 -2.365 1.00 0.00 H new ATOM 0 HA2 GLY A -3 23.808 8.508 0.247 1.00 0.00 H new ATOM 0 HA3 GLY A -3 23.117 9.504 -1.018 1.00 0.00 H new ATOM 10 N PRO A -2 21.152 7.771 -0.661 1.00 0.00 N ATOM 11 CA PRO A -2 20.006 6.885 -0.879 1.00 0.00 C ATOM 12 C PRO A -2 19.638 6.733 -2.372 1.00 0.00 C ATOM 13 O PRO A -2 19.897 7.620 -3.193 1.00 0.00 O ATOM 14 CB PRO A -2 18.858 7.499 -0.071 1.00 0.00 C ATOM 15 CG PRO A -2 19.181 8.991 -0.069 1.00 0.00 C ATOM 16 CD PRO A -2 20.710 9.010 -0.023 1.00 0.00 C ATOM 0 HA PRO A -2 20.235 5.870 -0.554 1.00 0.00 H new ATOM 0 HB2 PRO A -2 17.891 7.298 -0.532 1.00 0.00 H new ATOM 0 HB3 PRO A -2 18.819 7.096 0.941 1.00 0.00 H new ATOM 0 HG2 PRO A -2 18.797 9.488 -0.960 1.00 0.00 H new ATOM 0 HG3 PRO A -2 18.745 9.498 0.792 1.00 0.00 H new ATOM 0 HD2 PRO A -2 21.105 9.880 -0.547 1.00 0.00 H new ATOM 0 HD3 PRO A -2 21.068 9.068 1.005 1.00 0.00 H new ATOM 24 N GLY A -1 19.020 5.600 -2.720 1.00 0.00 N ATOM 25 CA GLY A -1 18.508 5.291 -4.059 1.00 0.00 C ATOM 26 C GLY A -1 17.128 5.905 -4.350 1.00 0.00 C ATOM 27 O GLY A -1 16.812 7.015 -3.912 1.00 0.00 O ATOM 0 H GLY A -1 18.857 4.846 -2.053 1.00 0.00 H new ATOM 0 HA2 GLY A -1 19.220 5.650 -4.802 1.00 0.00 H new ATOM 0 HA3 GLY A -1 18.446 4.209 -4.174 1.00 0.00 H new ATOM 31 N SER A 0 16.302 5.172 -5.110 1.00 0.00 N ATOM 32 CA SER A 0 14.908 5.534 -5.419 1.00 0.00 C ATOM 33 C SER A 0 14.020 5.586 -4.159 1.00 0.00 C ATOM 34 O SER A 0 14.335 4.970 -3.134 1.00 0.00 O ATOM 35 CB SER A 0 14.347 4.550 -6.452 1.00 0.00 C ATOM 36 OG SER A 0 13.067 4.954 -6.907 1.00 0.00 O ATOM 0 H SER A 0 16.589 4.291 -5.537 1.00 0.00 H new ATOM 0 HA SER A 0 14.902 6.541 -5.835 1.00 0.00 H new ATOM 0 HB2 SER A 0 15.030 4.479 -7.298 1.00 0.00 H new ATOM 0 HB3 SER A 0 14.281 3.555 -6.011 1.00 0.00 H new ATOM 0 HG SER A 0 12.735 4.309 -7.566 1.00 0.00 H new ATOM 42 N MET A 1 12.901 6.313 -4.226 1.00 0.00 N ATOM 43 CA MET A 1 12.030 6.640 -3.086 1.00 0.00 C ATOM 44 C MET A 1 12.792 7.385 -1.970 1.00 0.00 C ATOM 45 O MET A 1 13.456 8.386 -2.259 1.00 0.00 O ATOM 46 CB MET A 1 11.205 5.413 -2.628 1.00 0.00 C ATOM 47 CG MET A 1 10.378 4.808 -3.771 1.00 0.00 C ATOM 48 SD MET A 1 9.223 3.490 -3.277 1.00 0.00 S ATOM 49 CE MET A 1 10.390 2.174 -2.821 1.00 0.00 C ATOM 0 H MET A 1 12.562 6.705 -5.105 1.00 0.00 H new ATOM 0 HA MET A 1 11.282 7.360 -3.417 1.00 0.00 H new ATOM 0 HB2 MET A 1 11.878 4.654 -2.228 1.00 0.00 H new ATOM 0 HB3 MET A 1 10.539 5.708 -1.817 1.00 0.00 H new ATOM 0 HG2 MET A 1 9.811 5.606 -4.250 1.00 0.00 H new ATOM 0 HG3 MET A 1 11.061 4.409 -4.521 1.00 0.00 H new ATOM 0 HE1 MET A 1 9.837 1.276 -2.546 1.00 0.00 H new ATOM 0 HE2 MET A 1 11.040 1.954 -3.668 1.00 0.00 H new ATOM 0 HE3 MET A 1 10.995 2.501 -1.975 1.00 0.00 H new ATOM 59 N CYS A 2 12.697 6.926 -0.718 1.00 0.00 N ATOM 60 CA CYS A 2 13.226 7.577 0.490 1.00 0.00 C ATOM 61 C CYS A 2 12.634 8.986 0.751 1.00 0.00 C ATOM 62 O CYS A 2 11.675 9.398 0.093 1.00 0.00 O ATOM 63 CB CYS A 2 14.770 7.517 0.481 1.00 0.00 C ATOM 64 SG CYS A 2 15.337 5.784 0.388 1.00 0.00 S ATOM 0 H CYS A 2 12.226 6.046 -0.507 1.00 0.00 H new ATOM 0 HA CYS A 2 12.886 7.013 1.359 1.00 0.00 H new ATOM 0 HB2 CYS A 2 15.158 8.079 -0.368 1.00 0.00 H new ATOM 0 HB3 CYS A 2 15.164 7.988 1.382 1.00 0.00 H new ATOM 0 HG CYS A 2 16.637 5.753 0.379 1.00 0.00 H new ATOM 70 N MET A 3 13.180 9.698 1.750 1.00 0.00 N ATOM 71 CA MET A 3 12.670 10.935 2.363 1.00 0.00 C ATOM 72 C MET A 3 11.323 10.785 3.094 1.00 0.00 C ATOM 73 O MET A 3 10.503 9.906 2.815 1.00 0.00 O ATOM 74 CB MET A 3 12.662 12.127 1.380 1.00 0.00 C ATOM 75 CG MET A 3 14.061 12.667 1.056 1.00 0.00 C ATOM 76 SD MET A 3 15.157 11.639 0.030 1.00 0.00 S ATOM 77 CE MET A 3 14.245 11.713 -1.538 1.00 0.00 C ATOM 0 H MET A 3 14.055 9.402 2.183 1.00 0.00 H new ATOM 0 HA MET A 3 13.393 11.161 3.147 1.00 0.00 H new ATOM 0 HB2 MET A 3 12.177 11.819 0.453 1.00 0.00 H new ATOM 0 HB3 MET A 3 12.060 12.932 1.803 1.00 0.00 H new ATOM 0 HG2 MET A 3 13.940 13.628 0.556 1.00 0.00 H new ATOM 0 HG3 MET A 3 14.571 12.860 2.000 1.00 0.00 H new ATOM 0 HE1 MET A 3 14.869 11.320 -2.341 1.00 0.00 H new ATOM 0 HE2 MET A 3 13.336 11.116 -1.459 1.00 0.00 H new ATOM 0 HE3 MET A 3 13.981 12.748 -1.757 1.00 0.00 H new ATOM 87 N ALA A 4 11.108 11.659 4.080 1.00 0.00 N ATOM 88 CA ALA A 4 9.885 11.770 4.877 1.00 0.00 C ATOM 89 C ALA A 4 8.809 12.633 4.175 1.00 0.00 C ATOM 90 O ALA A 4 9.046 13.206 3.099 1.00 0.00 O ATOM 91 CB ALA A 4 10.298 12.364 6.235 1.00 0.00 C ATOM 0 H ALA A 4 11.815 12.340 4.357 1.00 0.00 H new ATOM 0 HA ALA A 4 9.424 10.791 5.007 1.00 0.00 H new ATOM 0 HB1 ALA A 4 9.418 12.468 6.870 1.00 0.00 H new ATOM 0 HB2 ALA A 4 11.018 11.703 6.718 1.00 0.00 H new ATOM 0 HB3 ALA A 4 10.752 13.343 6.081 1.00 0.00 H new ATOM 97 N LYS A 5 7.648 12.775 4.818 1.00 0.00 N ATOM 98 CA LYS A 5 6.606 13.762 4.493 1.00 0.00 C ATOM 99 C LYS A 5 6.154 14.529 5.733 1.00 0.00 C ATOM 100 O LYS A 5 6.077 13.955 6.821 1.00 0.00 O ATOM 101 CB LYS A 5 5.440 13.092 3.745 1.00 0.00 C ATOM 102 CG LYS A 5 4.603 12.089 4.559 1.00 0.00 C ATOM 103 CD LYS A 5 3.467 11.549 3.675 1.00 0.00 C ATOM 104 CE LYS A 5 2.543 10.608 4.455 1.00 0.00 C ATOM 105 NZ LYS A 5 1.363 10.231 3.647 1.00 0.00 N1+ ATOM 0 H LYS A 5 7.394 12.185 5.610 1.00 0.00 H new ATOM 0 HA LYS A 5 7.032 14.505 3.819 1.00 0.00 H new ATOM 0 HB2 LYS A 5 4.776 13.873 3.375 1.00 0.00 H new ATOM 0 HB3 LYS A 5 5.842 12.576 2.873 1.00 0.00 H new ATOM 0 HG2 LYS A 5 5.232 11.269 4.906 1.00 0.00 H new ATOM 0 HG3 LYS A 5 4.192 12.573 5.445 1.00 0.00 H new ATOM 0 HD2 LYS A 5 2.887 12.382 3.278 1.00 0.00 H new ATOM 0 HD3 LYS A 5 3.890 11.019 2.821 1.00 0.00 H new ATOM 0 HE2 LYS A 5 3.092 9.711 4.744 1.00 0.00 H new ATOM 0 HE3 LYS A 5 2.218 11.093 5.375 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 0.762 9.580 4.192 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 0.820 11.085 3.407 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 1.676 9.763 2.773 1.00 0.00 H new ATOM 119 N VAL A 6 5.866 15.822 5.582 1.00 0.00 N ATOM 120 CA VAL A 6 5.414 16.712 6.671 1.00 0.00 C ATOM 121 C VAL A 6 3.898 16.880 6.606 1.00 0.00 C ATOM 122 O VAL A 6 3.342 16.983 5.510 1.00 0.00 O ATOM 123 CB VAL A 6 6.133 18.078 6.621 1.00 0.00 C ATOM 124 CG1 VAL A 6 5.786 18.962 7.828 1.00 0.00 C ATOM 125 CG2 VAL A 6 7.657 17.915 6.578 1.00 0.00 C ATOM 0 H VAL A 6 5.940 16.298 4.683 1.00 0.00 H new ATOM 0 HA VAL A 6 5.674 16.252 7.624 1.00 0.00 H new ATOM 0 HB VAL A 6 5.783 18.558 5.707 1.00 0.00 H new ATOM 0 HG11 VAL A 6 6.315 19.911 7.748 1.00 0.00 H new ATOM 0 HG12 VAL A 6 4.712 19.146 7.847 1.00 0.00 H new ATOM 0 HG13 VAL A 6 6.084 18.457 8.747 1.00 0.00 H new ATOM 0 HG21 VAL A 6 8.127 18.898 6.543 1.00 0.00 H new ATOM 0 HG22 VAL A 6 7.991 17.384 7.469 1.00 0.00 H new ATOM 0 HG23 VAL A 6 7.937 17.347 5.691 1.00 0.00 H new ATOM 135 N VAL A 7 3.219 16.926 7.756 1.00 0.00 N ATOM 136 CA VAL A 7 1.758 17.122 7.841 1.00 0.00 C ATOM 137 C VAL A 7 1.355 18.035 9.004 1.00 0.00 C ATOM 138 O VAL A 7 1.969 18.001 10.078 1.00 0.00 O ATOM 139 CB VAL A 7 1.048 15.754 7.860 1.00 0.00 C ATOM 140 CG1 VAL A 7 1.136 15.019 9.203 1.00 0.00 C ATOM 141 CG2 VAL A 7 -0.425 15.880 7.458 1.00 0.00 C ATOM 0 H VAL A 7 3.667 16.828 8.667 1.00 0.00 H new ATOM 0 HA VAL A 7 1.426 17.653 6.949 1.00 0.00 H new ATOM 0 HB VAL A 7 1.589 15.156 7.127 1.00 0.00 H new ATOM 0 HG11 VAL A 7 0.612 14.066 9.131 1.00 0.00 H new ATOM 0 HG12 VAL A 7 2.182 14.840 9.452 1.00 0.00 H new ATOM 0 HG13 VAL A 7 0.677 15.628 9.982 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -0.894 14.896 7.482 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -0.937 16.544 8.155 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -0.493 16.290 6.450 1.00 0.00 H new ATOM 151 N LEU A 8 0.336 18.870 8.790 1.00 0.00 N ATOM 152 CA LEU A 8 -0.105 19.920 9.719 1.00 0.00 C ATOM 153 C LEU A 8 -1.603 20.245 9.592 1.00 0.00 C ATOM 154 O LEU A 8 -2.218 20.013 8.549 1.00 0.00 O ATOM 155 CB LEU A 8 0.756 21.181 9.500 1.00 0.00 C ATOM 156 CG LEU A 8 0.561 21.898 8.143 1.00 0.00 C ATOM 157 CD1 LEU A 8 -0.440 23.055 8.218 1.00 0.00 C ATOM 158 CD2 LEU A 8 1.893 22.461 7.644 1.00 0.00 C ATOM 0 H LEU A 8 -0.225 18.835 7.939 1.00 0.00 H new ATOM 0 HA LEU A 8 0.032 19.547 10.734 1.00 0.00 H new ATOM 0 HB2 LEU A 8 0.539 21.890 10.299 1.00 0.00 H new ATOM 0 HB3 LEU A 8 1.806 20.903 9.596 1.00 0.00 H new ATOM 0 HG LEU A 8 0.169 21.145 7.459 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -0.534 23.519 7.236 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -1.411 22.676 8.535 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -0.087 23.795 8.936 1.00 0.00 H new ATOM 0 HD21 LEU A 8 1.741 22.963 6.688 1.00 0.00 H new ATOM 0 HD22 LEU A 8 2.281 23.175 8.371 1.00 0.00 H new ATOM 0 HD23 LEU A 8 2.607 21.647 7.517 1.00 0.00 H new ATOM 170 N THR A 9 -2.155 20.847 10.652 1.00 0.00 N ATOM 171 CA THR A 9 -3.525 21.400 10.688 1.00 0.00 C ATOM 172 C THR A 9 -3.476 22.924 10.854 1.00 0.00 C ATOM 173 O THR A 9 -2.753 23.443 11.708 1.00 0.00 O ATOM 174 CB THR A 9 -4.359 20.768 11.822 1.00 0.00 C ATOM 175 OG1 THR A 9 -4.226 19.360 11.815 1.00 0.00 O ATOM 176 CG2 THR A 9 -5.851 21.071 11.677 1.00 0.00 C ATOM 0 H THR A 9 -1.654 20.969 11.532 1.00 0.00 H new ATOM 0 HA THR A 9 -4.009 21.158 9.742 1.00 0.00 H new ATOM 0 HB THR A 9 -3.980 21.199 12.749 1.00 0.00 H new ATOM 0 HG1 THR A 9 -4.478 19.003 12.692 1.00 0.00 H new ATOM 0 HG21 THR A 9 -6.398 20.606 12.497 1.00 0.00 H new ATOM 0 HG22 THR A 9 -6.007 22.149 11.702 1.00 0.00 H new ATOM 0 HG23 THR A 9 -6.212 20.674 10.729 1.00 0.00 H new ATOM 184 N LYS A 10 -4.233 23.648 10.023 1.00 0.00 N ATOM 185 CA LYS A 10 -4.333 25.118 10.016 1.00 0.00 C ATOM 186 C LYS A 10 -5.354 25.637 11.040 1.00 0.00 C ATOM 187 O LYS A 10 -6.271 24.912 11.433 1.00 0.00 O ATOM 188 CB LYS A 10 -4.687 25.602 8.602 1.00 0.00 C ATOM 189 CG LYS A 10 -3.625 25.208 7.557 1.00 0.00 C ATOM 190 CD LYS A 10 -3.853 25.897 6.199 1.00 0.00 C ATOM 191 CE LYS A 10 -5.149 25.440 5.518 1.00 0.00 C ATOM 192 NZ LYS A 10 -5.337 26.109 4.207 1.00 0.00 N1+ ATOM 0 H LYS A 10 -4.816 23.213 9.308 1.00 0.00 H new ATOM 0 HA LYS A 10 -3.364 25.522 10.308 1.00 0.00 H new ATOM 0 HB2 LYS A 10 -5.651 25.185 8.310 1.00 0.00 H new ATOM 0 HB3 LYS A 10 -4.798 26.686 8.610 1.00 0.00 H new ATOM 0 HG2 LYS A 10 -2.636 25.469 7.932 1.00 0.00 H new ATOM 0 HG3 LYS A 10 -3.638 24.127 7.419 1.00 0.00 H new ATOM 0 HD2 LYS A 10 -3.884 26.977 6.344 1.00 0.00 H new ATOM 0 HD3 LYS A 10 -3.008 25.688 5.543 1.00 0.00 H new ATOM 0 HE2 LYS A 10 -5.126 24.359 5.377 1.00 0.00 H new ATOM 0 HE3 LYS A 10 -5.998 25.659 6.165 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 -6.222 25.778 3.772 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 -5.383 27.139 4.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 -4.538 25.879 3.582 1.00 0.00 H new ATOM 206 N ALA A 11 -5.262 26.921 11.382 1.00 0.00 N ATOM 207 CA ALA A 11 -6.242 27.616 12.229 1.00 0.00 C ATOM 208 C ALA A 11 -7.657 27.691 11.600 1.00 0.00 C ATOM 209 O ALA A 11 -8.651 27.815 12.319 1.00 0.00 O ATOM 210 CB ALA A 11 -5.694 29.016 12.536 1.00 0.00 C ATOM 0 H ALA A 11 -4.495 27.520 11.076 1.00 0.00 H new ATOM 0 HA ALA A 11 -6.372 27.043 13.147 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -6.403 29.555 13.164 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -4.741 28.927 13.058 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -5.548 29.562 11.604 1.00 0.00 H new ATOM 216 N ASP A 12 -7.758 27.575 10.268 1.00 0.00 N ATOM 217 CA ASP A 12 -9.023 27.461 9.517 1.00 0.00 C ATOM 218 C ASP A 12 -9.721 26.086 9.667 1.00 0.00 C ATOM 219 O ASP A 12 -10.844 25.904 9.187 1.00 0.00 O ATOM 220 CB ASP A 12 -8.760 27.751 8.028 1.00 0.00 C ATOM 221 CG ASP A 12 -8.178 29.144 7.714 1.00 0.00 C ATOM 222 OD1 ASP A 12 -7.579 29.301 6.624 1.00 0.00 O ATOM 223 OD2 ASP A 12 -8.336 30.098 8.513 1.00 0.00 O1- ATOM 0 H ASP A 12 -6.938 27.557 9.662 1.00 0.00 H new ATOM 0 HA ASP A 12 -9.706 28.196 9.944 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -8.074 26.995 7.645 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -9.697 27.637 7.483 1.00 0.00 H new ATOM 228 N GLY A 13 -9.070 25.103 10.303 1.00 0.00 N ATOM 229 CA GLY A 13 -9.544 23.720 10.455 1.00 0.00 C ATOM 230 C GLY A 13 -9.214 22.786 9.275 1.00 0.00 C ATOM 231 O GLY A 13 -9.446 21.578 9.365 1.00 0.00 O ATOM 0 H GLY A 13 -8.163 25.255 10.743 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -9.110 23.301 11.363 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -10.625 23.735 10.596 1.00 0.00 H new ATOM 235 N GLY A 14 -8.647 23.317 8.186 1.00 0.00 N ATOM 236 CA GLY A 14 -8.102 22.526 7.072 1.00 0.00 C ATOM 237 C GLY A 14 -6.727 21.912 7.385 1.00 0.00 C ATOM 238 O GLY A 14 -6.099 22.241 8.395 1.00 0.00 O ATOM 0 H GLY A 14 -8.551 24.323 8.050 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -8.802 21.728 6.824 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -8.018 23.161 6.190 1.00 0.00 H new ATOM 242 N ARG A 15 -6.239 21.030 6.507 1.00 0.00 N ATOM 243 CA ARG A 15 -4.929 20.353 6.623 1.00 0.00 C ATOM 244 C ARG A 15 -4.068 20.513 5.371 1.00 0.00 C ATOM 245 O ARG A 15 -4.582 20.708 4.268 1.00 0.00 O ATOM 246 CB ARG A 15 -5.118 18.868 6.990 1.00 0.00 C ATOM 247 CG ARG A 15 -5.491 18.706 8.475 1.00 0.00 C ATOM 248 CD ARG A 15 -5.527 17.243 8.923 1.00 0.00 C ATOM 249 NE ARG A 15 -5.478 17.176 10.393 1.00 0.00 N ATOM 250 CZ ARG A 15 -5.787 16.162 11.173 1.00 0.00 C ATOM 251 NH1 ARG A 15 -6.218 15.026 10.699 1.00 0.00 N1+ ATOM 252 NH2 ARG A 15 -5.665 16.288 12.460 1.00 0.00 N ATOM 0 H ARG A 15 -6.753 20.755 5.670 1.00 0.00 H new ATOM 0 HA ARG A 15 -4.385 20.844 7.430 1.00 0.00 H new ATOM 0 HB2 ARG A 15 -5.899 18.433 6.366 1.00 0.00 H new ATOM 0 HB3 ARG A 15 -4.200 18.319 6.781 1.00 0.00 H new ATOM 0 HG2 ARG A 15 -4.772 19.251 9.087 1.00 0.00 H new ATOM 0 HG3 ARG A 15 -6.467 19.159 8.651 1.00 0.00 H new ATOM 0 HD2 ARG A 15 -6.434 16.762 8.557 1.00 0.00 H new ATOM 0 HD3 ARG A 15 -4.684 16.700 8.496 1.00 0.00 H new ATOM 0 HE ARG A 15 -5.165 18.023 10.867 1.00 0.00 H new ATOM 0 HH11 ARG A 15 -6.325 14.901 9.692 1.00 0.00 H new ATOM 0 HH12 ARG A 15 -6.448 14.262 11.335 1.00 0.00 H new ATOM 0 HH21 ARG A 15 -5.332 17.167 12.857 1.00 0.00 H new ATOM 0 HH22 ARG A 15 -5.902 15.508 13.073 1.00 0.00 H new ATOM 266 N VAL A 16 -2.749 20.415 5.555 1.00 0.00 N ATOM 267 CA VAL A 16 -1.722 20.498 4.498 1.00 0.00 C ATOM 268 C VAL A 16 -0.715 19.360 4.685 1.00 0.00 C ATOM 269 O VAL A 16 -0.337 19.045 5.815 1.00 0.00 O ATOM 270 CB VAL A 16 -1.022 21.876 4.484 1.00 0.00 C ATOM 271 CG1 VAL A 16 0.021 21.990 3.360 1.00 0.00 C ATOM 272 CG2 VAL A 16 -2.033 23.019 4.318 1.00 0.00 C ATOM 0 H VAL A 16 -2.345 20.270 6.480 1.00 0.00 H new ATOM 0 HA VAL A 16 -2.207 20.390 3.528 1.00 0.00 H new ATOM 0 HB VAL A 16 -0.519 21.960 5.447 1.00 0.00 H new ATOM 0 HG11 VAL A 16 0.485 22.976 3.392 1.00 0.00 H new ATOM 0 HG12 VAL A 16 0.786 21.225 3.494 1.00 0.00 H new ATOM 0 HG13 VAL A 16 -0.467 21.850 2.395 1.00 0.00 H new ATOM 0 HG21 VAL A 16 -1.506 23.973 4.312 1.00 0.00 H new ATOM 0 HG22 VAL A 16 -2.570 22.896 3.378 1.00 0.00 H new ATOM 0 HG23 VAL A 16 -2.742 23.001 5.146 1.00 0.00 H new ATOM 282 N GLU A 17 -0.293 18.732 3.589 1.00 0.00 N ATOM 283 CA GLU A 17 0.573 17.548 3.573 1.00 0.00 C ATOM 284 C GLU A 17 1.596 17.646 2.421 1.00 0.00 C ATOM 285 O GLU A 17 1.223 17.922 1.276 1.00 0.00 O ATOM 286 CB GLU A 17 -0.327 16.309 3.467 1.00 0.00 C ATOM 287 CG GLU A 17 0.425 15.015 3.782 1.00 0.00 C ATOM 288 CD GLU A 17 -0.438 13.758 3.565 1.00 0.00 C ATOM 289 OE1 GLU A 17 -1.673 13.789 3.789 1.00 0.00 O ATOM 290 OE2 GLU A 17 0.126 12.706 3.174 1.00 0.00 O1- ATOM 0 H GLU A 17 -0.552 19.043 2.653 1.00 0.00 H new ATOM 0 HA GLU A 17 1.159 17.476 4.489 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -1.168 16.414 4.153 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -0.742 16.249 2.461 1.00 0.00 H new ATOM 0 HG2 GLU A 17 1.313 14.954 3.153 1.00 0.00 H new ATOM 0 HG3 GLU A 17 0.768 15.041 4.816 1.00 0.00 H new ATOM 297 N ILE A 18 2.887 17.464 2.719 1.00 0.00 N ATOM 298 CA ILE A 18 4.013 17.800 1.824 1.00 0.00 C ATOM 299 C ILE A 18 4.993 16.624 1.746 1.00 0.00 C ATOM 300 O ILE A 18 5.675 16.313 2.725 1.00 0.00 O ATOM 301 CB ILE A 18 4.719 19.099 2.301 1.00 0.00 C ATOM 302 CG1 ILE A 18 3.738 20.295 2.324 1.00 0.00 C ATOM 303 CG2 ILE A 18 5.941 19.416 1.419 1.00 0.00 C ATOM 304 CD1 ILE A 18 4.302 21.543 3.007 1.00 0.00 C ATOM 0 H ILE A 18 3.191 17.070 3.609 1.00 0.00 H new ATOM 0 HA ILE A 18 3.627 17.984 0.821 1.00 0.00 H new ATOM 0 HB ILE A 18 5.067 18.931 3.320 1.00 0.00 H new ATOM 0 HG12 ILE A 18 3.462 20.546 1.300 1.00 0.00 H new ATOM 0 HG13 ILE A 18 2.824 19.994 2.836 1.00 0.00 H new ATOM 0 HG21 ILE A 18 6.418 20.330 1.773 1.00 0.00 H new ATOM 0 HG22 ILE A 18 6.652 18.591 1.472 1.00 0.00 H new ATOM 0 HG23 ILE A 18 5.619 19.551 0.386 1.00 0.00 H new ATOM 0 HD11 ILE A 18 3.557 22.338 2.984 1.00 0.00 H new ATOM 0 HD12 ILE A 18 4.552 21.310 4.042 1.00 0.00 H new ATOM 0 HD13 ILE A 18 5.199 21.871 2.482 1.00 0.00 H new ATOM 316 N GLY A 19 5.043 15.962 0.588 1.00 0.00 N ATOM 317 CA GLY A 19 5.867 14.777 0.349 1.00 0.00 C ATOM 318 C GLY A 19 7.339 15.065 0.028 1.00 0.00 C ATOM 319 O GLY A 19 7.700 16.155 -0.420 1.00 0.00 O ATOM 0 H GLY A 19 4.499 16.242 -0.228 1.00 0.00 H new ATOM 0 HA2 GLY A 19 5.821 14.137 1.230 1.00 0.00 H new ATOM 0 HA3 GLY A 19 5.434 14.213 -0.477 1.00 0.00 H new ATOM 323 N ASP A 20 8.181 14.047 0.226 1.00 0.00 N ATOM 324 CA ASP A 20 9.587 13.983 -0.206 1.00 0.00 C ATOM 325 C ASP A 20 10.459 15.161 0.296 1.00 0.00 C ATOM 326 O ASP A 20 11.235 15.765 -0.455 1.00 0.00 O ATOM 327 CB ASP A 20 9.676 13.738 -1.729 1.00 0.00 C ATOM 328 CG ASP A 20 8.862 12.540 -2.260 1.00 0.00 C ATOM 329 OD1 ASP A 20 8.495 11.619 -1.489 1.00 0.00 O ATOM 330 OD2 ASP A 20 8.592 12.502 -3.487 1.00 0.00 O1- ATOM 0 H ASP A 20 7.890 13.201 0.716 1.00 0.00 H new ATOM 0 HA ASP A 20 10.035 13.120 0.287 1.00 0.00 H new ATOM 0 HB2 ASP A 20 9.341 14.639 -2.244 1.00 0.00 H new ATOM 0 HB3 ASP A 20 10.723 13.589 -1.994 1.00 0.00 H new ATOM 335 N VAL A 21 10.316 15.520 1.577 1.00 0.00 N ATOM 336 CA VAL A 21 11.042 16.634 2.209 1.00 0.00 C ATOM 337 C VAL A 21 12.528 16.280 2.401 1.00 0.00 C ATOM 338 O VAL A 21 12.859 15.194 2.877 1.00 0.00 O ATOM 339 CB VAL A 21 10.341 17.075 3.512 1.00 0.00 C ATOM 340 CG1 VAL A 21 10.488 16.083 4.670 1.00 0.00 C ATOM 341 CG2 VAL A 21 10.836 18.437 3.994 1.00 0.00 C ATOM 0 H VAL A 21 9.683 15.039 2.216 1.00 0.00 H new ATOM 0 HA VAL A 21 11.020 17.498 1.544 1.00 0.00 H new ATOM 0 HB VAL A 21 9.287 17.125 3.238 1.00 0.00 H new ATOM 0 HG11 VAL A 21 9.967 16.468 5.547 1.00 0.00 H new ATOM 0 HG12 VAL A 21 10.057 15.123 4.384 1.00 0.00 H new ATOM 0 HG13 VAL A 21 11.544 15.951 4.904 1.00 0.00 H new ATOM 0 HG21 VAL A 21 10.317 18.708 4.913 1.00 0.00 H new ATOM 0 HG22 VAL A 21 11.908 18.388 4.184 1.00 0.00 H new ATOM 0 HG23 VAL A 21 10.637 19.188 3.229 1.00 0.00 H new ATOM 351 N LEU A 22 13.433 17.193 2.031 1.00 0.00 N ATOM 352 CA LEU A 22 14.879 17.051 2.249 1.00 0.00 C ATOM 353 C LEU A 22 15.281 17.530 3.651 1.00 0.00 C ATOM 354 O LEU A 22 16.089 16.889 4.323 1.00 0.00 O ATOM 355 CB LEU A 22 15.650 17.852 1.184 1.00 0.00 C ATOM 356 CG LEU A 22 15.496 17.363 -0.267 1.00 0.00 C ATOM 357 CD1 LEU A 22 16.259 18.305 -1.198 1.00 0.00 C ATOM 358 CD2 LEU A 22 16.052 15.953 -0.480 1.00 0.00 C ATOM 0 H LEU A 22 13.179 18.064 1.565 1.00 0.00 H new ATOM 0 HA LEU A 22 15.131 15.994 2.166 1.00 0.00 H new ATOM 0 HB2 LEU A 22 15.325 18.891 1.233 1.00 0.00 H new ATOM 0 HB3 LEU A 22 16.709 17.837 1.442 1.00 0.00 H new ATOM 0 HG LEU A 22 14.428 17.349 -0.483 1.00 0.00 H new ATOM 0 HD11 LEU A 22 16.153 17.963 -2.228 1.00 0.00 H new ATOM 0 HD12 LEU A 22 15.854 19.313 -1.107 1.00 0.00 H new ATOM 0 HD13 LEU A 22 17.314 18.311 -0.924 1.00 0.00 H new ATOM 0 HD21 LEU A 22 15.916 15.662 -1.521 1.00 0.00 H new ATOM 0 HD22 LEU A 22 17.114 15.940 -0.236 1.00 0.00 H new ATOM 0 HD23 LEU A 22 15.523 15.252 0.165 1.00 0.00 H new ATOM 370 N GLU A 23 14.703 18.649 4.104 1.00 0.00 N ATOM 371 CA GLU A 23 14.951 19.235 5.422 1.00 0.00 C ATOM 372 C GLU A 23 13.741 20.058 5.898 1.00 0.00 C ATOM 373 O GLU A 23 13.086 20.744 5.105 1.00 0.00 O ATOM 374 CB GLU A 23 16.240 20.083 5.378 1.00 0.00 C ATOM 375 CG GLU A 23 16.672 20.626 6.750 1.00 0.00 C ATOM 376 CD GLU A 23 18.097 21.215 6.705 1.00 0.00 C ATOM 377 OE1 GLU A 23 18.425 22.001 5.781 1.00 0.00 O ATOM 378 OE2 GLU A 23 18.904 20.907 7.614 1.00 0.00 O1- ATOM 0 H GLU A 23 14.034 19.183 3.549 1.00 0.00 H new ATOM 0 HA GLU A 23 15.092 18.434 6.148 1.00 0.00 H new ATOM 0 HB2 GLU A 23 17.048 19.478 4.966 1.00 0.00 H new ATOM 0 HB3 GLU A 23 16.090 20.921 4.697 1.00 0.00 H new ATOM 0 HG2 GLU A 23 15.970 21.394 7.075 1.00 0.00 H new ATOM 0 HG3 GLU A 23 16.632 19.825 7.488 1.00 0.00 H new ATOM 385 N VAL A 24 13.470 20.009 7.203 1.00 0.00 N ATOM 386 CA VAL A 24 12.428 20.772 7.907 1.00 0.00 C ATOM 387 C VAL A 24 13.000 21.371 9.192 1.00 0.00 C ATOM 388 O VAL A 24 13.748 20.699 9.905 1.00 0.00 O ATOM 389 CB VAL A 24 11.173 19.913 8.160 1.00 0.00 C ATOM 390 CG1 VAL A 24 11.461 18.618 8.919 1.00 0.00 C ATOM 391 CG2 VAL A 24 10.087 20.655 8.947 1.00 0.00 C ATOM 0 H VAL A 24 13.997 19.405 7.834 1.00 0.00 H new ATOM 0 HA VAL A 24 12.104 21.597 7.273 1.00 0.00 H new ATOM 0 HB VAL A 24 10.823 19.682 7.154 1.00 0.00 H new ATOM 0 HG11 VAL A 24 10.532 18.065 9.061 1.00 0.00 H new ATOM 0 HG12 VAL A 24 12.162 18.009 8.347 1.00 0.00 H new ATOM 0 HG13 VAL A 24 11.895 18.855 9.891 1.00 0.00 H new ATOM 0 HG21 VAL A 24 9.230 19.998 9.093 1.00 0.00 H new ATOM 0 HG22 VAL A 24 10.482 20.956 9.917 1.00 0.00 H new ATOM 0 HG23 VAL A 24 9.775 21.540 8.392 1.00 0.00 H new ATOM 401 N ARG A 25 12.658 22.629 9.485 1.00 0.00 N ATOM 402 CA ARG A 25 13.203 23.427 10.600 1.00 0.00 C ATOM 403 C ARG A 25 12.095 24.171 11.350 1.00 0.00 C ATOM 404 O ARG A 25 11.219 24.760 10.718 1.00 0.00 O ATOM 405 CB ARG A 25 14.243 24.438 10.074 1.00 0.00 C ATOM 406 CG ARG A 25 15.450 23.765 9.405 1.00 0.00 C ATOM 407 CD ARG A 25 16.543 24.751 8.972 1.00 0.00 C ATOM 408 NE ARG A 25 17.232 25.345 10.138 1.00 0.00 N ATOM 409 CZ ARG A 25 17.090 26.568 10.618 1.00 0.00 C ATOM 410 NH1 ARG A 25 16.361 27.472 10.040 1.00 0.00 N1+ ATOM 411 NH2 ARG A 25 17.673 26.934 11.718 1.00 0.00 N ATOM 0 H ARG A 25 11.969 23.143 8.936 1.00 0.00 H new ATOM 0 HA ARG A 25 13.683 22.739 11.295 1.00 0.00 H new ATOM 0 HB2 ARG A 25 13.763 25.105 9.358 1.00 0.00 H new ATOM 0 HB3 ARG A 25 14.591 25.056 10.901 1.00 0.00 H new ATOM 0 HG2 ARG A 25 15.880 23.040 10.096 1.00 0.00 H new ATOM 0 HG3 ARG A 25 15.108 23.209 8.532 1.00 0.00 H new ATOM 0 HD2 ARG A 25 17.269 24.237 8.342 1.00 0.00 H new ATOM 0 HD3 ARG A 25 16.101 25.543 8.367 1.00 0.00 H new ATOM 0 HE ARG A 25 17.893 24.742 10.628 1.00 0.00 H new ATOM 0 HH11 ARG A 25 15.866 27.252 9.176 1.00 0.00 H new ATOM 0 HH12 ARG A 25 16.283 28.403 10.450 1.00 0.00 H new ATOM 0 HH21 ARG A 25 18.255 26.272 12.231 1.00 0.00 H new ATOM 0 HH22 ARG A 25 17.549 27.883 12.069 1.00 0.00 H new ATOM 425 N ALA A 26 12.164 24.184 12.676 1.00 0.00 N ATOM 426 CA ALA A 26 11.383 25.061 13.550 1.00 0.00 C ATOM 427 C ALA A 26 12.206 26.337 13.815 1.00 0.00 C ATOM 428 O ALA A 26 13.318 26.274 14.348 1.00 0.00 O ATOM 429 CB ALA A 26 11.034 24.303 14.837 1.00 0.00 C ATOM 0 H ALA A 26 12.786 23.563 13.194 1.00 0.00 H new ATOM 0 HA ALA A 26 10.442 25.358 13.086 1.00 0.00 H new ATOM 0 HB1 ALA A 26 10.452 24.950 15.494 1.00 0.00 H new ATOM 0 HB2 ALA A 26 10.450 23.416 14.590 1.00 0.00 H new ATOM 0 HB3 ALA A 26 11.952 24.003 15.343 1.00 0.00 H new ATOM 435 N GLU A 27 11.689 27.488 13.393 1.00 0.00 N ATOM 436 CA GLU A 27 12.469 28.718 13.207 1.00 0.00 C ATOM 437 C GLU A 27 11.579 29.978 13.233 1.00 0.00 C ATOM 438 O GLU A 27 10.609 30.079 12.479 1.00 0.00 O ATOM 439 CB GLU A 27 13.204 28.585 11.853 1.00 0.00 C ATOM 440 CG GLU A 27 14.096 29.763 11.464 1.00 0.00 C ATOM 441 CD GLU A 27 15.303 29.923 12.408 1.00 0.00 C ATOM 442 OE1 GLU A 27 15.158 30.533 13.493 1.00 0.00 O ATOM 443 OE2 GLU A 27 16.406 29.443 12.049 1.00 0.00 O1- ATOM 0 H GLU A 27 10.701 27.599 13.166 1.00 0.00 H new ATOM 0 HA GLU A 27 13.177 28.838 14.027 1.00 0.00 H new ATOM 0 HB2 GLU A 27 13.816 27.683 11.880 1.00 0.00 H new ATOM 0 HB3 GLU A 27 12.460 28.442 11.069 1.00 0.00 H new ATOM 0 HG2 GLU A 27 14.452 29.624 10.443 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.507 30.680 11.473 1.00 0.00 H new ATOM 450 N GLY A 28 11.908 30.959 14.081 1.00 0.00 N ATOM 451 CA GLY A 28 11.222 32.261 14.139 1.00 0.00 C ATOM 452 C GLY A 28 9.738 32.201 14.527 1.00 0.00 C ATOM 453 O GLY A 28 8.956 33.053 14.095 1.00 0.00 O ATOM 0 H GLY A 28 12.668 30.873 14.756 1.00 0.00 H new ATOM 0 HA2 GLY A 28 11.743 32.897 14.855 1.00 0.00 H new ATOM 0 HA3 GLY A 28 11.307 32.742 13.165 1.00 0.00 H new ATOM 457 N GLY A 29 9.325 31.183 15.291 1.00 0.00 N ATOM 458 CA GLY A 29 7.915 30.932 15.630 1.00 0.00 C ATOM 459 C GLY A 29 7.098 30.276 14.502 1.00 0.00 C ATOM 460 O GLY A 29 5.868 30.312 14.529 1.00 0.00 O ATOM 0 H GLY A 29 9.966 30.501 15.697 1.00 0.00 H new ATOM 0 HA2 GLY A 29 7.874 30.292 16.511 1.00 0.00 H new ATOM 0 HA3 GLY A 29 7.445 31.877 15.900 1.00 0.00 H new ATOM 464 N ALA A 30 7.772 29.690 13.509 1.00 0.00 N ATOM 465 CA ALA A 30 7.186 28.997 12.366 1.00 0.00 C ATOM 466 C ALA A 30 7.872 27.643 12.115 1.00 0.00 C ATOM 467 O ALA A 30 8.964 27.389 12.621 1.00 0.00 O ATOM 468 CB ALA A 30 7.325 29.912 11.137 1.00 0.00 C ATOM 0 H ALA A 30 8.792 29.688 13.482 1.00 0.00 H new ATOM 0 HA ALA A 30 6.136 28.785 12.566 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.894 29.419 10.266 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.800 30.849 11.320 1.00 0.00 H new ATOM 0 HB3 ALA A 30 8.380 30.117 10.954 1.00 0.00 H new ATOM 474 N VAL A 31 7.270 26.788 11.282 1.00 0.00 N ATOM 475 CA VAL A 31 7.985 25.667 10.634 1.00 0.00 C ATOM 476 C VAL A 31 8.234 25.974 9.156 1.00 0.00 C ATOM 477 O VAL A 31 7.371 26.532 8.480 1.00 0.00 O ATOM 478 CB VAL A 31 7.276 24.321 10.851 1.00 0.00 C ATOM 479 CG1 VAL A 31 7.947 23.180 10.077 1.00 0.00 C ATOM 480 CG2 VAL A 31 7.333 23.942 12.333 1.00 0.00 C ATOM 0 H VAL A 31 6.282 26.846 11.035 1.00 0.00 H new ATOM 0 HA VAL A 31 8.958 25.564 11.115 1.00 0.00 H new ATOM 0 HB VAL A 31 6.252 24.448 10.499 1.00 0.00 H new ATOM 0 HG11 VAL A 31 7.410 22.250 10.262 1.00 0.00 H new ATOM 0 HG12 VAL A 31 7.928 23.404 9.010 1.00 0.00 H new ATOM 0 HG13 VAL A 31 8.980 23.075 10.407 1.00 0.00 H new ATOM 0 HG21 VAL A 31 6.829 22.987 12.484 1.00 0.00 H new ATOM 0 HG22 VAL A 31 8.373 23.857 12.647 1.00 0.00 H new ATOM 0 HG23 VAL A 31 6.837 24.711 12.925 1.00 0.00 H new ATOM 490 N ARG A 32 9.423 25.622 8.657 1.00 0.00 N ATOM 491 CA ARG A 32 9.912 25.862 7.289 1.00 0.00 C ATOM 492 C ARG A 32 10.394 24.548 6.668 1.00 0.00 C ATOM 493 O ARG A 32 11.007 23.739 7.365 1.00 0.00 O ATOM 494 CB ARG A 32 11.042 26.913 7.302 1.00 0.00 C ATOM 495 CG ARG A 32 10.667 28.210 8.036 1.00 0.00 C ATOM 496 CD ARG A 32 11.802 29.237 7.980 1.00 0.00 C ATOM 497 NE ARG A 32 11.504 30.396 8.844 1.00 0.00 N ATOM 498 CZ ARG A 32 12.183 31.527 8.896 1.00 0.00 C ATOM 499 NH1 ARG A 32 11.810 32.472 9.709 1.00 0.00 N1+ ATOM 500 NH2 ARG A 32 13.236 31.739 8.158 1.00 0.00 N ATOM 0 H ARG A 32 10.113 25.133 9.228 1.00 0.00 H new ATOM 0 HA ARG A 32 9.095 26.251 6.681 1.00 0.00 H new ATOM 0 HB2 ARG A 32 11.924 26.480 7.774 1.00 0.00 H new ATOM 0 HB3 ARG A 32 11.316 27.153 6.275 1.00 0.00 H new ATOM 0 HG2 ARG A 32 9.768 28.635 7.589 1.00 0.00 H new ATOM 0 HG3 ARG A 32 10.430 27.985 9.076 1.00 0.00 H new ATOM 0 HD2 ARG A 32 12.735 28.772 8.297 1.00 0.00 H new ATOM 0 HD3 ARG A 32 11.946 29.571 6.952 1.00 0.00 H new ATOM 0 HE ARG A 32 10.695 30.315 9.460 1.00 0.00 H new ATOM 0 HH11 ARG A 32 10.993 32.339 10.306 1.00 0.00 H new ATOM 0 HH12 ARG A 32 12.334 33.346 9.750 1.00 0.00 H new ATOM 0 HH21 ARG A 32 13.560 31.018 7.513 1.00 0.00 H new ATOM 0 HH22 ARG A 32 13.736 32.626 8.225 1.00 0.00 H new ATOM 514 N VAL A 33 10.136 24.324 5.376 1.00 0.00 N ATOM 515 CA VAL A 33 10.440 23.061 4.657 1.00 0.00 C ATOM 516 C VAL A 33 11.116 23.302 3.302 1.00 0.00 C ATOM 517 O VAL A 33 10.863 24.326 2.657 1.00 0.00 O ATOM 518 CB VAL A 33 9.180 22.188 4.461 1.00 0.00 C ATOM 519 CG1 VAL A 33 8.567 21.726 5.783 1.00 0.00 C ATOM 520 CG2 VAL A 33 8.073 22.876 3.654 1.00 0.00 C ATOM 0 H VAL A 33 9.700 25.026 4.778 1.00 0.00 H new ATOM 0 HA VAL A 33 11.142 22.524 5.295 1.00 0.00 H new ATOM 0 HB VAL A 33 9.551 21.330 3.900 1.00 0.00 H new ATOM 0 HG11 VAL A 33 7.686 21.117 5.582 1.00 0.00 H new ATOM 0 HG12 VAL A 33 9.298 21.136 6.336 1.00 0.00 H new ATOM 0 HG13 VAL A 33 8.280 22.595 6.375 1.00 0.00 H new ATOM 0 HG21 VAL A 33 7.221 22.203 3.558 1.00 0.00 H new ATOM 0 HG22 VAL A 33 7.761 23.786 4.167 1.00 0.00 H new ATOM 0 HG23 VAL A 33 8.449 23.129 2.663 1.00 0.00 H new ATOM 530 N THR A 34 11.920 22.333 2.850 1.00 0.00 N ATOM 531 CA THR A 34 12.567 22.290 1.519 1.00 0.00 C ATOM 532 C THR A 34 12.415 20.904 0.889 1.00 0.00 C ATOM 533 O THR A 34 12.653 19.899 1.560 1.00 0.00 O ATOM 534 CB THR A 34 14.065 22.637 1.621 1.00 0.00 C ATOM 535 OG1 THR A 34 14.259 23.884 2.257 1.00 0.00 O ATOM 536 CG2 THR A 34 14.740 22.736 0.252 1.00 0.00 C ATOM 0 H THR A 34 12.152 21.520 3.420 1.00 0.00 H new ATOM 0 HA THR A 34 12.072 23.030 0.890 1.00 0.00 H new ATOM 0 HB THR A 34 14.508 21.824 2.196 1.00 0.00 H new ATOM 0 HG1 THR A 34 15.218 24.079 2.310 1.00 0.00 H new ATOM 0 HG21 THR A 34 15.794 22.982 0.383 1.00 0.00 H new ATOM 0 HG22 THR A 34 14.652 21.781 -0.267 1.00 0.00 H new ATOM 0 HG23 THR A 34 14.256 23.515 -0.337 1.00 0.00 H new ATOM 544 N THR A 35 12.055 20.822 -0.397 1.00 0.00 N ATOM 545 CA THR A 35 11.838 19.550 -1.129 1.00 0.00 C ATOM 546 C THR A 35 12.807 19.365 -2.304 1.00 0.00 C ATOM 547 O THR A 35 13.458 20.312 -2.751 1.00 0.00 O ATOM 548 CB THR A 35 10.385 19.425 -1.628 1.00 0.00 C ATOM 549 OG1 THR A 35 10.157 20.333 -2.683 1.00 0.00 O ATOM 550 CG2 THR A 35 9.338 19.677 -0.536 1.00 0.00 C ATOM 0 H THR A 35 11.901 21.647 -0.976 1.00 0.00 H new ATOM 0 HA THR A 35 12.037 18.757 -0.408 1.00 0.00 H new ATOM 0 HB THR A 35 10.271 18.394 -1.962 1.00 0.00 H new ATOM 0 HG1 THR A 35 9.232 20.246 -2.995 1.00 0.00 H new ATOM 0 HG21 THR A 35 8.339 19.572 -0.959 1.00 0.00 H new ATOM 0 HG22 THR A 35 9.469 18.953 0.268 1.00 0.00 H new ATOM 0 HG23 THR A 35 9.461 20.685 -0.140 1.00 0.00 H new ATOM 558 N LEU A 36 12.894 18.137 -2.835 1.00 0.00 N ATOM 559 CA LEU A 36 13.718 17.799 -4.008 1.00 0.00 C ATOM 560 C LEU A 36 13.264 18.452 -5.332 1.00 0.00 C ATOM 561 O LEU A 36 13.992 18.390 -6.323 1.00 0.00 O ATOM 562 CB LEU A 36 13.852 16.262 -4.118 1.00 0.00 C ATOM 563 CG LEU A 36 12.715 15.505 -4.843 1.00 0.00 C ATOM 564 CD1 LEU A 36 13.007 14.004 -4.837 1.00 0.00 C ATOM 565 CD2 LEU A 36 11.353 15.710 -4.184 1.00 0.00 C ATOM 0 H LEU A 36 12.386 17.337 -2.457 1.00 0.00 H new ATOM 0 HA LEU A 36 14.702 18.237 -3.839 1.00 0.00 H new ATOM 0 HB2 LEU A 36 14.787 16.040 -4.632 1.00 0.00 H new ATOM 0 HB3 LEU A 36 13.938 15.857 -3.110 1.00 0.00 H new ATOM 0 HG LEU A 36 12.677 15.906 -5.856 1.00 0.00 H new ATOM 0 HD11 LEU A 36 12.203 13.475 -5.349 1.00 0.00 H new ATOM 0 HD12 LEU A 36 13.950 13.815 -5.350 1.00 0.00 H new ATOM 0 HD13 LEU A 36 13.076 13.651 -3.808 1.00 0.00 H new ATOM 0 HD21 LEU A 36 10.594 15.155 -4.736 1.00 0.00 H new ATOM 0 HD22 LEU A 36 11.389 15.351 -3.156 1.00 0.00 H new ATOM 0 HD23 LEU A 36 11.102 16.771 -4.189 1.00 0.00 H new ATOM 577 N PHE A 37 12.088 19.090 -5.353 1.00 0.00 N ATOM 578 CA PHE A 37 11.597 19.911 -6.467 1.00 0.00 C ATOM 579 C PHE A 37 12.179 21.343 -6.467 1.00 0.00 C ATOM 580 O PHE A 37 11.774 22.183 -7.276 1.00 0.00 O ATOM 581 CB PHE A 37 10.059 19.921 -6.448 1.00 0.00 C ATOM 582 CG PHE A 37 9.419 18.544 -6.408 1.00 0.00 C ATOM 583 CD1 PHE A 37 8.666 18.134 -5.287 1.00 0.00 C ATOM 584 CD2 PHE A 37 9.576 17.664 -7.498 1.00 0.00 C ATOM 585 CE1 PHE A 37 8.085 16.852 -5.257 1.00 0.00 C ATOM 586 CE2 PHE A 37 8.997 16.386 -7.467 1.00 0.00 C ATOM 587 CZ PHE A 37 8.259 15.973 -6.342 1.00 0.00 C ATOM 0 H PHE A 37 11.432 19.048 -4.573 1.00 0.00 H new ATOM 0 HA PHE A 37 11.945 19.460 -7.396 1.00 0.00 H new ATOM 0 HB2 PHE A 37 9.723 20.489 -5.580 1.00 0.00 H new ATOM 0 HB3 PHE A 37 9.701 20.448 -7.332 1.00 0.00 H new ATOM 0 HD1 PHE A 37 8.535 18.805 -4.451 1.00 0.00 H new ATOM 0 HD2 PHE A 37 10.145 17.975 -8.362 1.00 0.00 H new ATOM 0 HE1 PHE A 37 7.505 16.543 -4.400 1.00 0.00 H new ATOM 0 HE2 PHE A 37 9.118 15.719 -8.307 1.00 0.00 H new ATOM 0 HZ PHE A 37 7.827 14.984 -6.312 1.00 0.00 H new ATOM 597 N ASP A 38 13.111 21.638 -5.548 1.00 0.00 N ATOM 598 CA ASP A 38 13.666 22.966 -5.235 1.00 0.00 C ATOM 599 C ASP A 38 12.625 23.986 -4.715 1.00 0.00 C ATOM 600 O ASP A 38 12.884 25.190 -4.675 1.00 0.00 O ATOM 601 CB ASP A 38 14.546 23.507 -6.376 1.00 0.00 C ATOM 602 CG ASP A 38 15.644 22.549 -6.871 1.00 0.00 C ATOM 603 OD1 ASP A 38 16.187 21.746 -6.069 1.00 0.00 O ATOM 604 OD2 ASP A 38 16.022 22.636 -8.068 1.00 0.00 O1- ATOM 0 H ASP A 38 13.524 20.910 -4.966 1.00 0.00 H new ATOM 0 HA ASP A 38 14.326 22.815 -4.381 1.00 0.00 H new ATOM 0 HB2 ASP A 38 13.903 23.763 -7.218 1.00 0.00 H new ATOM 0 HB3 ASP A 38 15.017 24.432 -6.042 1.00 0.00 H new ATOM 609 N GLU A 39 11.449 23.517 -4.292 1.00 0.00 N ATOM 610 CA GLU A 39 10.448 24.338 -3.604 1.00 0.00 C ATOM 611 C GLU A 39 10.786 24.567 -2.127 1.00 0.00 C ATOM 612 O GLU A 39 11.377 23.715 -1.453 1.00 0.00 O ATOM 613 CB GLU A 39 9.039 23.732 -3.709 1.00 0.00 C ATOM 614 CG GLU A 39 8.464 23.796 -5.129 1.00 0.00 C ATOM 615 CD GLU A 39 7.015 23.265 -5.208 1.00 0.00 C ATOM 616 OE1 GLU A 39 6.262 23.358 -4.202 1.00 0.00 O ATOM 617 OE2 GLU A 39 6.602 22.786 -6.294 1.00 0.00 O1- ATOM 0 H GLU A 39 11.161 22.547 -4.418 1.00 0.00 H new ATOM 0 HA GLU A 39 10.464 25.301 -4.114 1.00 0.00 H new ATOM 0 HB2 GLU A 39 9.071 22.693 -3.382 1.00 0.00 H new ATOM 0 HB3 GLU A 39 8.371 24.259 -3.028 1.00 0.00 H new ATOM 0 HG2 GLU A 39 8.489 24.827 -5.481 1.00 0.00 H new ATOM 0 HG3 GLU A 39 9.097 23.215 -5.800 1.00 0.00 H new ATOM 624 N GLU A 40 10.342 25.710 -1.612 1.00 0.00 N ATOM 625 CA GLU A 40 10.392 26.082 -0.194 1.00 0.00 C ATOM 626 C GLU A 40 9.051 26.682 0.255 1.00 0.00 C ATOM 627 O GLU A 40 8.428 27.466 -0.467 1.00 0.00 O ATOM 628 CB GLU A 40 11.527 27.082 0.087 1.00 0.00 C ATOM 629 CG GLU A 40 12.918 26.456 -0.077 1.00 0.00 C ATOM 630 CD GLU A 40 14.054 27.483 0.099 1.00 0.00 C ATOM 631 OE1 GLU A 40 13.922 28.436 0.905 1.00 0.00 O ATOM 632 OE2 GLU A 40 15.106 27.345 -0.571 1.00 0.00 O1- ATOM 0 H GLU A 40 9.919 26.435 -2.192 1.00 0.00 H new ATOM 0 HA GLU A 40 10.588 25.173 0.374 1.00 0.00 H new ATOM 0 HB2 GLU A 40 11.433 27.932 -0.589 1.00 0.00 H new ATOM 0 HB3 GLU A 40 11.423 27.468 1.101 1.00 0.00 H new ATOM 0 HG2 GLU A 40 13.041 25.655 0.653 1.00 0.00 H new ATOM 0 HG3 GLU A 40 12.994 26.001 -1.065 1.00 0.00 H new ATOM 639 N HIS A 41 8.631 26.331 1.473 1.00 0.00 N ATOM 640 CA HIS A 41 7.360 26.751 2.097 1.00 0.00 C ATOM 641 C HIS A 41 7.524 26.997 3.606 1.00 0.00 C ATOM 642 O HIS A 41 8.417 26.429 4.240 1.00 0.00 O ATOM 643 CB HIS A 41 6.259 25.712 1.822 1.00 0.00 C ATOM 644 CG HIS A 41 5.933 25.488 0.367 1.00 0.00 C ATOM 645 ND1 HIS A 41 5.105 26.305 -0.417 1.00 0.00 N ATOM 646 CD2 HIS A 41 6.401 24.474 -0.420 1.00 0.00 C ATOM 647 CE1 HIS A 41 5.100 25.772 -1.646 1.00 0.00 C ATOM 648 NE2 HIS A 41 5.865 24.668 -1.676 1.00 0.00 N ATOM 0 H HIS A 41 9.183 25.724 2.080 1.00 0.00 H new ATOM 0 HA HIS A 41 7.062 27.698 1.647 1.00 0.00 H new ATOM 0 HB2 HIS A 41 6.562 24.761 2.260 1.00 0.00 H new ATOM 0 HB3 HIS A 41 5.351 26.025 2.337 1.00 0.00 H new ATOM 0 HD2 HIS A 41 7.062 23.676 -0.117 1.00 0.00 H new ATOM 0 HE1 HIS A 41 4.559 26.172 -2.491 1.00 0.00 H new ATOM 0 HE2 HIS A 41 6.023 24.074 -2.490 1.00 0.00 H new ATOM 656 N ALA A 42 6.651 27.826 4.181 1.00 0.00 N ATOM 657 CA ALA A 42 6.645 28.193 5.601 1.00 0.00 C ATOM 658 C ALA A 42 5.222 28.268 6.191 1.00 0.00 C ATOM 659 O ALA A 42 4.273 28.677 5.514 1.00 0.00 O ATOM 660 CB ALA A 42 7.388 29.528 5.785 1.00 0.00 C ATOM 0 H ALA A 42 5.903 28.276 3.654 1.00 0.00 H new ATOM 0 HA ALA A 42 7.160 27.406 6.152 1.00 0.00 H new ATOM 0 HB1 ALA A 42 7.385 29.804 6.840 1.00 0.00 H new ATOM 0 HB2 ALA A 42 8.417 29.422 5.440 1.00 0.00 H new ATOM 0 HB3 ALA A 42 6.889 30.305 5.206 1.00 0.00 H new ATOM 666 N PHE A 43 5.096 27.897 7.467 1.00 0.00 N ATOM 667 CA PHE A 43 3.838 27.765 8.207 1.00 0.00 C ATOM 668 C PHE A 43 3.989 28.366 9.622 1.00 0.00 C ATOM 669 O PHE A 43 4.482 27.689 10.536 1.00 0.00 O ATOM 670 CB PHE A 43 3.425 26.287 8.223 1.00 0.00 C ATOM 671 CG PHE A 43 3.188 25.723 6.834 1.00 0.00 C ATOM 672 CD1 PHE A 43 1.954 25.927 6.193 1.00 0.00 C ATOM 673 CD2 PHE A 43 4.226 25.055 6.153 1.00 0.00 C ATOM 674 CE1 PHE A 43 1.753 25.469 4.877 1.00 0.00 C ATOM 675 CE2 PHE A 43 4.035 24.610 4.835 1.00 0.00 C ATOM 676 CZ PHE A 43 2.800 24.820 4.196 1.00 0.00 C ATOM 0 H PHE A 43 5.908 27.669 8.041 1.00 0.00 H new ATOM 0 HA PHE A 43 3.041 28.326 7.718 1.00 0.00 H new ATOM 0 HB2 PHE A 43 4.201 25.704 8.718 1.00 0.00 H new ATOM 0 HB3 PHE A 43 2.516 26.176 8.814 1.00 0.00 H new ATOM 0 HD1 PHE A 43 1.156 26.437 6.712 1.00 0.00 H new ATOM 0 HD2 PHE A 43 5.171 24.885 6.647 1.00 0.00 H new ATOM 0 HE1 PHE A 43 0.799 25.615 4.392 1.00 0.00 H new ATOM 0 HE2 PHE A 43 4.835 24.107 4.313 1.00 0.00 H new ATOM 0 HZ PHE A 43 2.655 24.483 3.180 1.00 0.00 H new ATOM 686 N PRO A 44 3.616 29.645 9.821 1.00 0.00 N ATOM 687 CA PRO A 44 3.748 30.324 11.109 1.00 0.00 C ATOM 688 C PRO A 44 2.778 29.804 12.177 1.00 0.00 C ATOM 689 O PRO A 44 1.671 29.350 11.880 1.00 0.00 O ATOM 690 CB PRO A 44 3.584 31.817 10.810 1.00 0.00 C ATOM 691 CG PRO A 44 2.738 31.853 9.538 1.00 0.00 C ATOM 692 CD PRO A 44 3.144 30.580 8.804 1.00 0.00 C ATOM 0 HA PRO A 44 4.722 30.123 11.555 1.00 0.00 H new ATOM 0 HB2 PRO A 44 3.090 32.336 11.632 1.00 0.00 H new ATOM 0 HB3 PRO A 44 4.549 32.302 10.661 1.00 0.00 H new ATOM 0 HG2 PRO A 44 1.672 31.863 9.765 1.00 0.00 H new ATOM 0 HG3 PRO A 44 2.945 32.743 8.943 1.00 0.00 H new ATOM 0 HD2 PRO A 44 2.299 30.163 8.256 1.00 0.00 H new ATOM 0 HD3 PRO A 44 3.927 30.786 8.074 1.00 0.00 H new ATOM 700 N GLY A 45 3.209 29.878 13.440 1.00 0.00 N ATOM 701 CA GLY A 45 2.482 29.391 14.620 1.00 0.00 C ATOM 702 C GLY A 45 2.693 27.909 14.941 1.00 0.00 C ATOM 703 O GLY A 45 2.021 27.381 15.831 1.00 0.00 O ATOM 0 H GLY A 45 4.109 30.295 13.679 1.00 0.00 H new ATOM 0 HA2 GLY A 45 2.785 29.982 15.485 1.00 0.00 H new ATOM 0 HA3 GLY A 45 1.417 29.567 14.471 1.00 0.00 H new ATOM 707 N LEU A 46 3.603 27.224 14.243 1.00 0.00 N ATOM 708 CA LEU A 46 3.887 25.791 14.407 1.00 0.00 C ATOM 709 C LEU A 46 5.290 25.496 14.966 1.00 0.00 C ATOM 710 O LEU A 46 6.212 26.311 14.875 1.00 0.00 O ATOM 711 CB LEU A 46 3.684 25.047 13.071 1.00 0.00 C ATOM 712 CG LEU A 46 2.284 25.158 12.446 1.00 0.00 C ATOM 713 CD1 LEU A 46 2.249 24.311 11.178 1.00 0.00 C ATOM 714 CD2 LEU A 46 1.169 24.660 13.370 1.00 0.00 C ATOM 0 H LEU A 46 4.181 27.662 13.526 1.00 0.00 H new ATOM 0 HA LEU A 46 3.177 25.427 15.150 1.00 0.00 H new ATOM 0 HB2 LEU A 46 4.412 25.425 12.353 1.00 0.00 H new ATOM 0 HB3 LEU A 46 3.908 23.992 13.227 1.00 0.00 H new ATOM 0 HG LEU A 46 2.107 26.215 12.248 1.00 0.00 H new ATOM 0 HD11 LEU A 46 1.261 24.379 10.722 1.00 0.00 H new ATOM 0 HD12 LEU A 46 2.999 24.676 10.476 1.00 0.00 H new ATOM 0 HD13 LEU A 46 2.462 23.272 11.429 1.00 0.00 H new ATOM 0 HD21 LEU A 46 0.207 24.766 12.869 1.00 0.00 H new ATOM 0 HD22 LEU A 46 1.339 23.611 13.612 1.00 0.00 H new ATOM 0 HD23 LEU A 46 1.167 25.248 14.288 1.00 0.00 H new ATOM 726 N ALA A 47 5.446 24.282 15.492 1.00 0.00 N ATOM 727 CA ALA A 47 6.696 23.615 15.850 1.00 0.00 C ATOM 728 C ALA A 47 6.594 22.110 15.510 1.00 0.00 C ATOM 729 O ALA A 47 5.492 21.572 15.353 1.00 0.00 O ATOM 730 CB ALA A 47 6.977 23.862 17.337 1.00 0.00 C ATOM 0 H ALA A 47 4.638 23.694 15.695 1.00 0.00 H new ATOM 0 HA ALA A 47 7.532 24.018 15.278 1.00 0.00 H new ATOM 0 HB1 ALA A 47 7.908 23.369 17.618 1.00 0.00 H new ATOM 0 HB2 ALA A 47 7.064 24.933 17.518 1.00 0.00 H new ATOM 0 HB3 ALA A 47 6.159 23.459 17.934 1.00 0.00 H new ATOM 736 N ILE A 48 7.725 21.408 15.393 1.00 0.00 N ATOM 737 CA ILE A 48 7.750 19.959 15.111 1.00 0.00 C ATOM 738 C ILE A 48 7.330 19.191 16.375 1.00 0.00 C ATOM 739 O ILE A 48 7.955 19.332 17.429 1.00 0.00 O ATOM 740 CB ILE A 48 9.127 19.502 14.570 1.00 0.00 C ATOM 741 CG1 ILE A 48 9.556 20.301 13.309 1.00 0.00 C ATOM 742 CG2 ILE A 48 9.085 18.000 14.245 1.00 0.00 C ATOM 743 CD1 ILE A 48 11.055 20.217 13.018 1.00 0.00 C ATOM 0 H ILE A 48 8.652 21.823 15.490 1.00 0.00 H new ATOM 0 HA ILE A 48 7.035 19.736 14.319 1.00 0.00 H new ATOM 0 HB ILE A 48 9.866 19.695 15.348 1.00 0.00 H new ATOM 0 HG12 ILE A 48 9.004 19.928 12.446 1.00 0.00 H new ATOM 0 HG13 ILE A 48 9.276 21.347 13.438 1.00 0.00 H new ATOM 0 HG21 ILE A 48 10.056 17.683 13.865 1.00 0.00 H new ATOM 0 HG22 ILE A 48 8.848 17.439 15.149 1.00 0.00 H new ATOM 0 HG23 ILE A 48 8.321 17.812 13.491 1.00 0.00 H new ATOM 0 HD11 ILE A 48 11.285 20.797 12.124 1.00 0.00 H new ATOM 0 HD12 ILE A 48 11.613 20.617 13.864 1.00 0.00 H new ATOM 0 HD13 ILE A 48 11.337 19.176 12.857 1.00 0.00 H new ATOM 755 N GLY A 49 6.266 18.389 16.280 1.00 0.00 N ATOM 756 CA GLY A 49 5.648 17.685 17.411 1.00 0.00 C ATOM 757 C GLY A 49 6.131 16.246 17.588 1.00 0.00 C ATOM 758 O GLY A 49 6.529 15.863 18.684 1.00 0.00 O ATOM 0 H GLY A 49 5.797 18.206 15.393 1.00 0.00 H new ATOM 0 HA2 GLY A 49 5.852 18.241 18.326 1.00 0.00 H new ATOM 0 HA3 GLY A 49 4.567 17.680 17.275 1.00 0.00 H new ATOM 762 N ARG A 50 6.124 15.445 16.513 1.00 0.00 N ATOM 763 CA ARG A 50 6.581 14.039 16.509 1.00 0.00 C ATOM 764 C ARG A 50 7.168 13.634 15.156 1.00 0.00 C ATOM 765 O ARG A 50 6.867 14.261 14.140 1.00 0.00 O ATOM 766 CB ARG A 50 5.434 13.055 16.837 1.00 0.00 C ATOM 767 CG ARG A 50 4.667 13.284 18.156 1.00 0.00 C ATOM 768 CD ARG A 50 3.759 12.092 18.511 1.00 0.00 C ATOM 769 NE ARG A 50 2.849 11.740 17.399 1.00 0.00 N ATOM 770 CZ ARG A 50 3.045 10.791 16.496 1.00 0.00 C ATOM 771 NH1 ARG A 50 3.935 9.855 16.626 1.00 0.00 N1+ ATOM 772 NH2 ARG A 50 2.360 10.778 15.390 1.00 0.00 N ATOM 0 H ARG A 50 5.794 15.759 15.600 1.00 0.00 H new ATOM 0 HA ARG A 50 7.349 13.982 17.280 1.00 0.00 H new ATOM 0 HB2 ARG A 50 4.716 13.088 16.018 1.00 0.00 H new ATOM 0 HB3 ARG A 50 5.848 12.047 16.857 1.00 0.00 H new ATOM 0 HG2 ARG A 50 5.379 13.451 18.965 1.00 0.00 H new ATOM 0 HG3 ARG A 50 4.063 14.187 18.072 1.00 0.00 H new ATOM 0 HD2 ARG A 50 4.375 11.229 18.763 1.00 0.00 H new ATOM 0 HD3 ARG A 50 3.172 12.334 19.397 1.00 0.00 H new ATOM 0 HE ARG A 50 1.987 12.280 17.320 1.00 0.00 H new ATOM 0 HH11 ARG A 50 4.527 9.826 17.456 1.00 0.00 H new ATOM 0 HH12 ARG A 50 4.043 9.149 15.898 1.00 0.00 H new ATOM 0 HH21 ARG A 50 1.665 11.503 15.212 1.00 0.00 H new ATOM 0 HH22 ARG A 50 2.518 10.043 14.701 1.00 0.00 H new ATOM 786 N VAL A 51 7.921 12.531 15.122 1.00 0.00 N ATOM 787 CA VAL A 51 8.261 11.812 13.881 1.00 0.00 C ATOM 788 C VAL A 51 7.980 10.313 14.034 1.00 0.00 C ATOM 789 O VAL A 51 8.506 9.667 14.942 1.00 0.00 O ATOM 790 CB VAL A 51 9.717 12.060 13.432 1.00 0.00 C ATOM 791 CG1 VAL A 51 9.909 11.558 11.999 1.00 0.00 C ATOM 792 CG2 VAL A 51 10.136 13.532 13.501 1.00 0.00 C ATOM 0 H VAL A 51 8.317 12.105 15.960 1.00 0.00 H new ATOM 0 HA VAL A 51 7.621 12.211 13.094 1.00 0.00 H new ATOM 0 HB VAL A 51 10.350 11.511 14.130 1.00 0.00 H new ATOM 0 HG11 VAL A 51 10.938 11.735 11.686 1.00 0.00 H new ATOM 0 HG12 VAL A 51 9.695 10.490 11.956 1.00 0.00 H new ATOM 0 HG13 VAL A 51 9.231 12.091 11.333 1.00 0.00 H new ATOM 0 HG21 VAL A 51 11.170 13.632 13.171 1.00 0.00 H new ATOM 0 HG22 VAL A 51 9.490 14.125 12.854 1.00 0.00 H new ATOM 0 HG23 VAL A 51 10.046 13.888 14.527 1.00 0.00 H new ATOM 802 N ASP A 52 7.182 9.754 13.125 1.00 0.00 N ATOM 803 CA ASP A 52 6.938 8.321 12.962 1.00 0.00 C ATOM 804 C ASP A 52 7.894 7.741 11.904 1.00 0.00 C ATOM 805 O ASP A 52 7.560 7.685 10.717 1.00 0.00 O ATOM 806 CB ASP A 52 5.472 8.082 12.547 1.00 0.00 C ATOM 807 CG ASP A 52 4.458 8.430 13.639 1.00 0.00 C ATOM 808 OD1 ASP A 52 4.594 7.918 14.772 1.00 0.00 O ATOM 809 OD2 ASP A 52 3.490 9.186 13.383 1.00 0.00 O1- ATOM 0 H ASP A 52 6.663 10.315 12.450 1.00 0.00 H new ATOM 0 HA ASP A 52 7.121 7.818 13.911 1.00 0.00 H new ATOM 0 HB2 ASP A 52 5.254 8.675 11.659 1.00 0.00 H new ATOM 0 HB3 ASP A 52 5.348 7.035 12.269 1.00 0.00 H new ATOM 814 N LEU A 53 9.073 7.253 12.310 1.00 0.00 N ATOM 815 CA LEU A 53 10.003 6.573 11.391 1.00 0.00 C ATOM 816 C LEU A 53 9.458 5.207 10.912 1.00 0.00 C ATOM 817 O LEU A 53 9.967 4.640 9.945 1.00 0.00 O ATOM 818 CB LEU A 53 11.413 6.436 12.005 1.00 0.00 C ATOM 819 CG LEU A 53 12.199 7.717 12.368 1.00 0.00 C ATOM 820 CD1 LEU A 53 12.261 8.708 11.205 1.00 0.00 C ATOM 821 CD2 LEU A 53 11.699 8.442 13.613 1.00 0.00 C ATOM 0 H LEU A 53 9.409 7.315 13.271 1.00 0.00 H new ATOM 0 HA LEU A 53 10.090 7.206 10.508 1.00 0.00 H new ATOM 0 HB2 LEU A 53 11.321 5.838 12.912 1.00 0.00 H new ATOM 0 HB3 LEU A 53 12.022 5.863 11.306 1.00 0.00 H new ATOM 0 HG LEU A 53 13.199 7.346 12.593 1.00 0.00 H new ATOM 0 HD11 LEU A 53 12.823 9.591 11.509 1.00 0.00 H new ATOM 0 HD12 LEU A 53 12.754 8.239 10.353 1.00 0.00 H new ATOM 0 HD13 LEU A 53 11.250 9.001 10.922 1.00 0.00 H new ATOM 0 HD21 LEU A 53 12.310 9.327 13.789 1.00 0.00 H new ATOM 0 HD22 LEU A 53 10.661 8.741 13.468 1.00 0.00 H new ATOM 0 HD23 LEU A 53 11.768 7.777 14.474 1.00 0.00 H new ATOM 833 N ARG A 54 8.368 4.720 11.531 1.00 0.00 N ATOM 834 CA ARG A 54 7.538 3.579 11.085 1.00 0.00 C ATOM 835 C ARG A 54 6.903 3.798 9.702 1.00 0.00 C ATOM 836 O ARG A 54 6.644 2.826 8.989 1.00 0.00 O ATOM 837 CB ARG A 54 6.406 3.352 12.104 1.00 0.00 C ATOM 838 CG ARG A 54 6.909 2.917 13.493 1.00 0.00 C ATOM 839 CD ARG A 54 5.766 2.802 14.507 1.00 0.00 C ATOM 840 NE ARG A 54 4.824 1.719 14.154 1.00 0.00 N ATOM 841 CZ ARG A 54 3.562 1.605 14.535 1.00 0.00 C ATOM 842 NH1 ARG A 54 2.985 2.479 15.313 1.00 0.00 N1+ ATOM 843 NH2 ARG A 54 2.842 0.593 14.137 1.00 0.00 N ATOM 0 H ARG A 54 8.022 5.129 12.399 1.00 0.00 H new ATOM 0 HA ARG A 54 8.200 2.716 11.013 1.00 0.00 H new ATOM 0 HB2 ARG A 54 5.830 4.272 12.206 1.00 0.00 H new ATOM 0 HB3 ARG A 54 5.727 2.592 11.718 1.00 0.00 H new ATOM 0 HG2 ARG A 54 7.418 1.957 13.410 1.00 0.00 H new ATOM 0 HG3 ARG A 54 7.643 3.637 13.855 1.00 0.00 H new ATOM 0 HD2 ARG A 54 6.178 2.616 15.499 1.00 0.00 H new ATOM 0 HD3 ARG A 54 5.228 3.749 14.557 1.00 0.00 H new ATOM 0 HE ARG A 54 5.186 0.980 13.552 1.00 0.00 H new ATOM 0 HH11 ARG A 54 3.509 3.286 15.650 1.00 0.00 H new ATOM 0 HH12 ARG A 54 2.010 2.355 15.584 1.00 0.00 H new ATOM 0 HH21 ARG A 54 3.251 -0.116 13.529 1.00 0.00 H new ATOM 0 HH22 ARG A 54 1.870 0.511 14.434 1.00 0.00 H new ATOM 857 N SER A 55 6.633 5.052 9.327 1.00 0.00 N ATOM 858 CA SER A 55 5.865 5.432 8.125 1.00 0.00 C ATOM 859 C SER A 55 6.430 6.652 7.376 1.00 0.00 C ATOM 860 O SER A 55 5.966 6.965 6.275 1.00 0.00 O ATOM 861 CB SER A 55 4.409 5.696 8.528 1.00 0.00 C ATOM 862 OG SER A 55 4.312 6.784 9.434 1.00 0.00 O ATOM 0 H SER A 55 6.950 5.859 9.864 1.00 0.00 H new ATOM 0 HA SER A 55 5.938 4.597 7.428 1.00 0.00 H new ATOM 0 HB2 SER A 55 3.816 5.908 7.638 1.00 0.00 H new ATOM 0 HB3 SER A 55 3.988 4.801 8.986 1.00 0.00 H new ATOM 0 HG SER A 55 3.372 6.929 9.671 1.00 0.00 H new ATOM 868 N GLY A 56 7.432 7.341 7.936 1.00 0.00 N ATOM 869 CA GLY A 56 8.030 8.554 7.379 1.00 0.00 C ATOM 870 C GLY A 56 7.221 9.837 7.611 1.00 0.00 C ATOM 871 O GLY A 56 7.452 10.822 6.908 1.00 0.00 O ATOM 0 H GLY A 56 7.860 7.058 8.817 1.00 0.00 H new ATOM 0 HA2 GLY A 56 9.022 8.684 7.811 1.00 0.00 H new ATOM 0 HA3 GLY A 56 8.165 8.416 6.306 1.00 0.00 H new ATOM 875 N VAL A 57 6.258 9.852 8.543 1.00 0.00 N ATOM 876 CA VAL A 57 5.429 11.037 8.836 1.00 0.00 C ATOM 877 C VAL A 57 6.069 11.929 9.901 1.00 0.00 C ATOM 878 O VAL A 57 6.287 11.507 11.037 1.00 0.00 O ATOM 879 CB VAL A 57 3.988 10.637 9.230 1.00 0.00 C ATOM 880 CG1 VAL A 57 3.135 11.854 9.619 1.00 0.00 C ATOM 881 CG2 VAL A 57 3.286 9.954 8.052 1.00 0.00 C ATOM 0 H VAL A 57 6.029 9.042 9.119 1.00 0.00 H new ATOM 0 HA VAL A 57 5.370 11.621 7.918 1.00 0.00 H new ATOM 0 HB VAL A 57 4.079 9.966 10.084 1.00 0.00 H new ATOM 0 HG11 VAL A 57 2.132 11.524 9.888 1.00 0.00 H new ATOM 0 HG12 VAL A 57 3.591 12.361 10.470 1.00 0.00 H new ATOM 0 HG13 VAL A 57 3.077 12.542 8.776 1.00 0.00 H new ATOM 0 HG21 VAL A 57 2.273 9.678 8.343 1.00 0.00 H new ATOM 0 HG22 VAL A 57 3.246 10.639 7.205 1.00 0.00 H new ATOM 0 HG23 VAL A 57 3.839 9.059 7.768 1.00 0.00 H new ATOM 891 N ILE A 58 6.310 13.187 9.540 1.00 0.00 N ATOM 892 CA ILE A 58 6.695 14.285 10.438 1.00 0.00 C ATOM 893 C ILE A 58 5.424 15.077 10.782 1.00 0.00 C ATOM 894 O ILE A 58 4.808 15.684 9.905 1.00 0.00 O ATOM 895 CB ILE A 58 7.784 15.155 9.764 1.00 0.00 C ATOM 896 CG1 ILE A 58 9.100 14.352 9.615 1.00 0.00 C ATOM 897 CG2 ILE A 58 8.028 16.464 10.538 1.00 0.00 C ATOM 898 CD1 ILE A 58 10.127 14.994 8.683 1.00 0.00 C ATOM 0 H ILE A 58 6.240 13.488 8.568 1.00 0.00 H new ATOM 0 HA ILE A 58 7.130 13.913 11.365 1.00 0.00 H new ATOM 0 HB ILE A 58 7.425 15.427 8.771 1.00 0.00 H new ATOM 0 HG12 ILE A 58 9.549 14.227 10.600 1.00 0.00 H new ATOM 0 HG13 ILE A 58 8.863 13.355 9.244 1.00 0.00 H new ATOM 0 HG21 ILE A 58 8.799 17.047 10.034 1.00 0.00 H new ATOM 0 HG22 ILE A 58 7.104 17.041 10.577 1.00 0.00 H new ATOM 0 HG23 ILE A 58 8.354 16.232 11.552 1.00 0.00 H new ATOM 0 HD11 ILE A 58 11.017 14.367 8.636 1.00 0.00 H new ATOM 0 HD12 ILE A 58 9.700 15.094 7.685 1.00 0.00 H new ATOM 0 HD13 ILE A 58 10.397 15.980 9.063 1.00 0.00 H new ATOM 910 N SER A 59 5.013 15.052 12.050 1.00 0.00 N ATOM 911 CA SER A 59 3.781 15.682 12.538 1.00 0.00 C ATOM 912 C SER A 59 4.074 17.020 13.220 1.00 0.00 C ATOM 913 O SER A 59 4.849 17.069 14.181 1.00 0.00 O ATOM 914 CB SER A 59 3.075 14.721 13.504 1.00 0.00 C ATOM 915 OG SER A 59 1.853 15.265 13.978 1.00 0.00 O ATOM 0 H SER A 59 5.539 14.582 12.786 1.00 0.00 H new ATOM 0 HA SER A 59 3.129 15.889 11.690 1.00 0.00 H new ATOM 0 HB2 SER A 59 2.882 13.774 13.000 1.00 0.00 H new ATOM 0 HB3 SER A 59 3.730 14.505 14.348 1.00 0.00 H new ATOM 0 HG SER A 59 1.427 14.629 14.589 1.00 0.00 H new ATOM 921 N LEU A 60 3.464 18.108 12.739 1.00 0.00 N ATOM 922 CA LEU A 60 3.564 19.448 13.334 1.00 0.00 C ATOM 923 C LEU A 60 2.427 19.745 14.325 1.00 0.00 C ATOM 924 O LEU A 60 1.309 19.239 14.188 1.00 0.00 O ATOM 925 CB LEU A 60 3.630 20.517 12.232 1.00 0.00 C ATOM 926 CG LEU A 60 4.670 20.293 11.117 1.00 0.00 C ATOM 927 CD1 LEU A 60 4.758 21.550 10.250 1.00 0.00 C ATOM 928 CD2 LEU A 60 6.077 19.995 11.647 1.00 0.00 C ATOM 0 H LEU A 60 2.874 18.083 11.907 1.00 0.00 H new ATOM 0 HA LEU A 60 4.488 19.476 13.911 1.00 0.00 H new ATOM 0 HB2 LEU A 60 2.646 20.592 11.770 1.00 0.00 H new ATOM 0 HB3 LEU A 60 3.836 21.479 12.702 1.00 0.00 H new ATOM 0 HG LEU A 60 4.332 19.424 10.552 1.00 0.00 H new ATOM 0 HD11 LEU A 60 5.493 21.396 9.460 1.00 0.00 H new ATOM 0 HD12 LEU A 60 3.784 21.754 9.805 1.00 0.00 H new ATOM 0 HD13 LEU A 60 5.060 22.397 10.866 1.00 0.00 H new ATOM 0 HD21 LEU A 60 6.758 19.848 10.809 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.423 20.833 12.253 1.00 0.00 H new ATOM 0 HD23 LEU A 60 6.052 19.092 12.257 1.00 0.00 H new ATOM 940 N ILE A 61 2.718 20.610 15.302 1.00 0.00 N ATOM 941 CA ILE A 61 1.813 21.057 16.374 1.00 0.00 C ATOM 942 C ILE A 61 1.932 22.571 16.596 1.00 0.00 C ATOM 943 O ILE A 61 2.903 23.189 16.159 1.00 0.00 O ATOM 944 CB ILE A 61 2.045 20.252 17.682 1.00 0.00 C ATOM 945 CG1 ILE A 61 3.487 20.272 18.239 1.00 0.00 C ATOM 946 CG2 ILE A 61 1.606 18.791 17.476 1.00 0.00 C ATOM 947 CD1 ILE A 61 3.860 21.513 19.054 1.00 0.00 C ATOM 0 H ILE A 61 3.639 21.042 15.373 1.00 0.00 H new ATOM 0 HA ILE A 61 0.789 20.857 16.059 1.00 0.00 H new ATOM 0 HB ILE A 61 1.439 20.761 18.431 1.00 0.00 H new ATOM 0 HG12 ILE A 61 3.629 19.391 18.865 1.00 0.00 H new ATOM 0 HG13 ILE A 61 4.182 20.184 17.404 1.00 0.00 H new ATOM 0 HG21 ILE A 61 1.770 18.229 18.395 1.00 0.00 H new ATOM 0 HG22 ILE A 61 0.548 18.762 17.217 1.00 0.00 H new ATOM 0 HG23 ILE A 61 2.189 18.346 16.670 1.00 0.00 H new ATOM 0 HD11 ILE A 61 4.891 21.426 19.397 1.00 0.00 H new ATOM 0 HD12 ILE A 61 3.759 22.402 18.431 1.00 0.00 H new ATOM 0 HD13 ILE A 61 3.197 21.596 19.915 1.00 0.00 H new ATOM 959 N GLU A 62 0.952 23.190 17.253 1.00 0.00 N ATOM 960 CA GLU A 62 0.963 24.628 17.556 1.00 0.00 C ATOM 961 C GLU A 62 2.045 24.982 18.593 1.00 0.00 C ATOM 962 O GLU A 62 2.161 24.335 19.636 1.00 0.00 O ATOM 963 CB GLU A 62 -0.416 25.103 18.045 1.00 0.00 C ATOM 964 CG GLU A 62 -1.565 24.877 17.049 1.00 0.00 C ATOM 965 CD GLU A 62 -2.199 23.462 17.070 1.00 0.00 C ATOM 966 OE1 GLU A 62 -1.745 22.558 17.818 1.00 0.00 O ATOM 967 OE2 GLU A 62 -3.195 23.255 16.332 1.00 0.00 O1- ATOM 0 H GLU A 62 0.120 22.708 17.594 1.00 0.00 H new ATOM 0 HA GLU A 62 1.201 25.148 16.628 1.00 0.00 H new ATOM 0 HB2 GLU A 62 -0.654 24.587 18.976 1.00 0.00 H new ATOM 0 HB3 GLU A 62 -0.358 26.167 18.276 1.00 0.00 H new ATOM 0 HG2 GLU A 62 -2.347 25.609 17.251 1.00 0.00 H new ATOM 0 HG3 GLU A 62 -1.195 25.075 16.043 1.00 0.00 H new ATOM 974 N GLU A 63 2.831 26.030 18.343 1.00 0.00 N ATOM 975 CA GLU A 63 3.991 26.396 19.180 1.00 0.00 C ATOM 976 C GLU A 63 3.629 26.986 20.560 1.00 0.00 C ATOM 977 O GLU A 63 4.462 26.972 21.470 1.00 0.00 O ATOM 978 CB GLU A 63 4.948 27.294 18.376 1.00 0.00 C ATOM 979 CG GLU A 63 4.392 28.680 17.989 1.00 0.00 C ATOM 980 CD GLU A 63 4.645 29.786 19.033 1.00 0.00 C ATOM 981 OE1 GLU A 63 5.765 29.888 19.590 1.00 0.00 O ATOM 982 OE2 GLU A 63 3.718 30.599 19.282 1.00 0.00 O1- ATOM 0 H GLU A 63 2.686 26.657 17.551 1.00 0.00 H new ATOM 0 HA GLU A 63 4.506 25.469 19.432 1.00 0.00 H new ATOM 0 HB2 GLU A 63 5.859 27.437 18.958 1.00 0.00 H new ATOM 0 HB3 GLU A 63 5.231 26.768 17.464 1.00 0.00 H new ATOM 0 HG2 GLU A 63 4.837 28.984 17.042 1.00 0.00 H new ATOM 0 HG3 GLU A 63 3.318 28.593 17.824 1.00 0.00 H new ATOM 989 N GLN A 64 2.382 27.433 20.746 1.00 0.00 N ATOM 990 CA GLN A 64 1.779 27.823 22.035 1.00 0.00 C ATOM 991 C GLN A 64 0.312 27.364 22.117 1.00 0.00 C ATOM 992 O GLN A 64 -0.389 27.320 21.103 1.00 0.00 O ATOM 993 CB GLN A 64 1.858 29.348 22.255 1.00 0.00 C ATOM 994 CG GLN A 64 3.262 29.843 22.628 1.00 0.00 C ATOM 995 CD GLN A 64 3.300 31.359 22.758 1.00 0.00 C ATOM 996 OE1 GLN A 64 3.205 31.918 23.847 1.00 0.00 O ATOM 997 NE2 GLN A 64 3.432 32.083 21.668 1.00 0.00 N ATOM 0 H GLN A 64 1.731 27.539 19.968 1.00 0.00 H new ATOM 0 HA GLN A 64 2.351 27.329 22.821 1.00 0.00 H new ATOM 0 HB2 GLN A 64 1.533 29.855 21.347 1.00 0.00 H new ATOM 0 HB3 GLN A 64 1.161 29.629 23.044 1.00 0.00 H new ATOM 0 HG2 GLN A 64 3.572 29.388 23.569 1.00 0.00 H new ATOM 0 HG3 GLN A 64 3.976 29.523 21.869 1.00 0.00 H new ATOM 0 HE21 GLN A 64 3.512 31.627 20.759 1.00 0.00 H new ATOM 0 HE22 GLN A 64 3.455 33.101 21.731 1.00 0.00 H new ATOM 1006 N ASN A 65 -0.162 27.057 23.335 1.00 0.00 N ATOM 1007 CA ASN A 65 -1.524 26.572 23.616 1.00 0.00 C ATOM 1008 C ASN A 65 -2.299 27.417 24.655 1.00 0.00 C ATOM 1009 O ASN A 65 -3.468 27.128 24.940 1.00 0.00 O ATOM 1010 CB ASN A 65 -1.452 25.087 24.029 1.00 0.00 C ATOM 1011 CG ASN A 65 -0.739 24.205 23.021 1.00 0.00 C ATOM 1012 OD1 ASN A 65 0.407 23.809 23.202 1.00 0.00 O ATOM 1013 ND2 ASN A 65 -1.383 23.881 21.919 1.00 0.00 N ATOM 0 H ASN A 65 0.408 27.142 24.177 1.00 0.00 H new ATOM 0 HA ASN A 65 -2.101 26.679 22.698 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -0.942 25.011 24.989 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -2.464 24.711 24.175 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -0.928 23.300 21.215 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -2.336 24.211 21.770 1.00 0.00 H new ATOM 1020 N ARG A 66 -1.667 28.457 25.222 1.00 0.00 N ATOM 1021 CA ARG A 66 -2.259 29.422 26.172 1.00 0.00 C ATOM 1022 C ARG A 66 -3.175 30.454 25.495 1.00 0.00 C ATOM 1023 O ARG A 66 -4.159 30.878 26.152 1.00 0.00 O ATOM 1024 CB ARG A 66 -1.164 30.076 27.035 1.00 0.00 C ATOM 1025 CG ARG A 66 -0.093 30.854 26.252 1.00 0.00 C ATOM 1026 CD ARG A 66 0.897 31.509 27.219 1.00 0.00 C ATOM 1027 NE ARG A 66 2.002 32.168 26.497 1.00 0.00 N ATOM 1028 CZ ARG A 66 2.884 33.019 26.976 1.00 0.00 C ATOM 1029 NH1 ARG A 66 2.860 33.440 28.209 1.00 0.00 N1+ ATOM 1030 NH2 ARG A 66 3.823 33.461 26.198 1.00 0.00 N ATOM 1031 OXT ARG A 66 -2.912 30.835 24.331 1.00 0.00 O1- ATOM 0 H ARG A 66 -0.687 28.660 25.025 1.00 0.00 H new ATOM 0 HA ARG A 66 -2.914 28.859 26.836 1.00 0.00 H new ATOM 0 HB2 ARG A 66 -1.639 30.755 27.743 1.00 0.00 H new ATOM 0 HB3 ARG A 66 -0.672 29.299 27.620 1.00 0.00 H new ATOM 0 HG2 ARG A 66 0.437 30.180 25.579 1.00 0.00 H new ATOM 0 HG3 ARG A 66 -0.566 31.616 25.633 1.00 0.00 H new ATOM 0 HD2 ARG A 66 0.375 32.242 27.835 1.00 0.00 H new ATOM 0 HD3 ARG A 66 1.301 30.755 27.894 1.00 0.00 H new ATOM 0 HE ARG A 66 2.093 31.936 25.508 1.00 0.00 H new ATOM 0 HH11 ARG A 66 2.136 33.109 28.847 1.00 0.00 H new ATOM 0 HH12 ARG A 66 3.565 34.100 28.536 1.00 0.00 H new ATOM 0 HH21 ARG A 66 3.871 33.149 25.228 1.00 0.00 H new ATOM 0 HH22 ARG A 66 4.513 34.121 26.556 1.00 0.00 H new TER 1045 ARG A 66 ATOM 1046 N GLY B -3 25.589 -0.945 -4.556 1.00 0.00 N ATOM 1047 CA GLY B -3 24.843 0.204 -5.115 1.00 0.00 C ATOM 1048 C GLY B -3 24.556 1.274 -4.065 1.00 0.00 C ATOM 1049 O GLY B -3 25.251 1.327 -3.041 1.00 0.00 O ATOM 0 H1 GLY B -3 26.438 -1.120 -5.130 1.00 0.00 H new ATOM 0 H2 GLY B -3 25.870 -0.733 -3.577 1.00 0.00 H new ATOM 0 H3 GLY B -3 24.983 -1.790 -4.567 1.00 0.00 H new ATOM 0 HA2 GLY B -3 25.416 0.644 -5.932 1.00 0.00 H new ATOM 0 HA3 GLY B -3 23.902 -0.148 -5.539 1.00 0.00 H new ATOM 1055 N PRO B -2 23.552 2.148 -4.292 1.00 0.00 N ATOM 1056 CA PRO B -2 23.148 3.189 -3.343 1.00 0.00 C ATOM 1057 C PRO B -2 22.466 2.620 -2.080 1.00 0.00 C ATOM 1058 O PRO B -2 22.043 1.463 -2.039 1.00 0.00 O ATOM 1059 CB PRO B -2 22.202 4.098 -4.130 1.00 0.00 C ATOM 1060 CG PRO B -2 21.549 3.142 -5.123 1.00 0.00 C ATOM 1061 CD PRO B -2 22.695 2.194 -5.477 1.00 0.00 C ATOM 0 HA PRO B -2 24.017 3.726 -2.962 1.00 0.00 H new ATOM 0 HB2 PRO B -2 21.465 4.571 -3.481 1.00 0.00 H new ATOM 0 HB3 PRO B -2 22.741 4.899 -4.636 1.00 0.00 H new ATOM 0 HG2 PRO B -2 20.706 2.611 -4.680 1.00 0.00 H new ATOM 0 HG3 PRO B -2 21.170 3.666 -6.001 1.00 0.00 H new ATOM 0 HD2 PRO B -2 22.319 1.202 -5.727 1.00 0.00 H new ATOM 0 HD3 PRO B -2 23.247 2.554 -6.345 1.00 0.00 H new ATOM 1069 N GLY B -1 22.352 3.453 -1.038 1.00 0.00 N ATOM 1070 CA GLY B -1 21.704 3.112 0.236 1.00 0.00 C ATOM 1071 C GLY B -1 20.170 3.180 0.204 1.00 0.00 C ATOM 1072 O GLY B -1 19.553 3.448 -0.833 1.00 0.00 O ATOM 0 H GLY B -1 22.716 4.406 -1.057 1.00 0.00 H new ATOM 0 HA2 GLY B -1 22.005 2.105 0.525 1.00 0.00 H new ATOM 0 HA3 GLY B -1 22.070 3.788 1.009 1.00 0.00 H new ATOM 1076 N SER B 0 19.544 2.975 1.363 1.00 0.00 N ATOM 1077 CA SER B 0 18.096 3.118 1.583 1.00 0.00 C ATOM 1078 C SER B 0 17.798 3.484 3.045 1.00 0.00 C ATOM 1079 O SER B 0 18.422 2.952 3.968 1.00 0.00 O ATOM 1080 CB SER B 0 17.368 1.823 1.187 1.00 0.00 C ATOM 1081 OG SER B 0 15.968 1.942 1.370 1.00 0.00 O ATOM 0 H SER B 0 20.044 2.695 2.207 1.00 0.00 H new ATOM 0 HA SER B 0 17.730 3.929 0.953 1.00 0.00 H new ATOM 0 HB2 SER B 0 17.582 1.588 0.144 1.00 0.00 H new ATOM 0 HB3 SER B 0 17.746 0.994 1.785 1.00 0.00 H new ATOM 0 HG SER B 0 15.532 1.104 1.109 1.00 0.00 H new ATOM 1087 N MET B 1 16.864 4.416 3.267 1.00 0.00 N ATOM 1088 CA MET B 1 16.487 4.886 4.605 1.00 0.00 C ATOM 1089 C MET B 1 15.622 3.868 5.368 1.00 0.00 C ATOM 1090 O MET B 1 14.602 3.398 4.856 1.00 0.00 O ATOM 1091 CB MET B 1 15.749 6.233 4.523 1.00 0.00 C ATOM 1092 CG MET B 1 16.613 7.366 3.945 1.00 0.00 C ATOM 1093 SD MET B 1 15.822 9.000 3.976 1.00 0.00 S ATOM 1094 CE MET B 1 16.025 9.415 5.733 1.00 0.00 C ATOM 0 H MET B 1 16.344 4.869 2.516 1.00 0.00 H new ATOM 0 HA MET B 1 17.416 5.012 5.160 1.00 0.00 H new ATOM 0 HB2 MET B 1 14.858 6.114 3.906 1.00 0.00 H new ATOM 0 HB3 MET B 1 15.411 6.516 5.520 1.00 0.00 H new ATOM 0 HG2 MET B 1 17.547 7.417 4.505 1.00 0.00 H new ATOM 0 HG3 MET B 1 16.872 7.120 2.915 1.00 0.00 H new ATOM 0 HE1 MET B 1 15.672 10.431 5.910 1.00 0.00 H new ATOM 0 HE2 MET B 1 15.447 8.719 6.340 1.00 0.00 H new ATOM 0 HE3 MET B 1 17.078 9.345 6.004 1.00 0.00 H new ATOM 1104 N CYS B 2 15.996 3.584 6.615 1.00 0.00 N ATOM 1105 CA CYS B 2 15.192 2.860 7.601 1.00 0.00 C ATOM 1106 C CYS B 2 15.637 3.252 9.022 1.00 0.00 C ATOM 1107 O CYS B 2 16.841 3.266 9.311 1.00 0.00 O ATOM 1108 CB CYS B 2 15.319 1.351 7.359 1.00 0.00 C ATOM 1109 SG CYS B 2 14.137 0.442 8.395 1.00 0.00 S ATOM 0 H CYS B 2 16.906 3.864 6.982 1.00 0.00 H new ATOM 0 HA CYS B 2 14.141 3.128 7.497 1.00 0.00 H new ATOM 0 HB2 CYS B 2 15.137 1.128 6.308 1.00 0.00 H new ATOM 0 HB3 CYS B 2 16.335 1.025 7.583 1.00 0.00 H new ATOM 0 HG CYS B 2 14.258 -0.833 8.175 1.00 0.00 H new ATOM 1115 N MET B 3 14.680 3.612 9.890 1.00 0.00 N ATOM 1116 CA MET B 3 14.908 4.392 11.123 1.00 0.00 C ATOM 1117 C MET B 3 15.684 5.714 10.881 1.00 0.00 C ATOM 1118 O MET B 3 15.998 6.093 9.749 1.00 0.00 O ATOM 1119 CB MET B 3 15.526 3.500 12.231 1.00 0.00 C ATOM 1120 CG MET B 3 14.489 2.634 12.961 1.00 0.00 C ATOM 1121 SD MET B 3 13.755 1.247 12.054 1.00 0.00 S ATOM 1122 CE MET B 3 15.237 0.237 11.810 1.00 0.00 C ATOM 0 H MET B 3 13.700 3.364 9.754 1.00 0.00 H new ATOM 0 HA MET B 3 13.934 4.721 11.485 1.00 0.00 H new ATOM 0 HB2 MET B 3 16.282 2.853 11.787 1.00 0.00 H new ATOM 0 HB3 MET B 3 16.035 4.134 12.957 1.00 0.00 H new ATOM 0 HG2 MET B 3 14.959 2.235 13.860 1.00 0.00 H new ATOM 0 HG3 MET B 3 13.679 3.286 13.288 1.00 0.00 H new ATOM 0 HE1 MET B 3 14.946 -0.798 11.632 1.00 0.00 H new ATOM 0 HE2 MET B 3 15.795 0.611 10.951 1.00 0.00 H new ATOM 0 HE3 MET B 3 15.864 0.290 12.700 1.00 0.00 H new ATOM 1132 N ALA B 4 15.978 6.447 11.954 1.00 0.00 N ATOM 1133 CA ALA B 4 16.779 7.678 11.964 1.00 0.00 C ATOM 1134 C ALA B 4 17.731 7.705 13.183 1.00 0.00 C ATOM 1135 O ALA B 4 17.756 6.756 13.971 1.00 0.00 O ATOM 1136 CB ALA B 4 15.803 8.862 11.956 1.00 0.00 C ATOM 0 H ALA B 4 15.651 6.190 12.885 1.00 0.00 H new ATOM 0 HA ALA B 4 17.421 7.734 11.085 1.00 0.00 H new ATOM 0 HB1 ALA B 4 16.364 9.796 11.963 1.00 0.00 H new ATOM 0 HB2 ALA B 4 15.184 8.817 11.060 1.00 0.00 H new ATOM 0 HB3 ALA B 4 15.166 8.815 12.839 1.00 0.00 H new ATOM 1142 N LYS B 5 18.486 8.794 13.374 1.00 0.00 N ATOM 1143 CA LYS B 5 19.215 9.075 14.627 1.00 0.00 C ATOM 1144 C LYS B 5 18.881 10.447 15.214 1.00 0.00 C ATOM 1145 O LYS B 5 18.715 11.423 14.483 1.00 0.00 O ATOM 1146 CB LYS B 5 20.730 8.822 14.477 1.00 0.00 C ATOM 1147 CG LYS B 5 21.486 9.839 13.606 1.00 0.00 C ATOM 1148 CD LYS B 5 22.994 9.582 13.706 1.00 0.00 C ATOM 1149 CE LYS B 5 23.786 10.617 12.902 1.00 0.00 C ATOM 1150 NZ LYS B 5 25.246 10.497 13.158 1.00 0.00 N1+ ATOM 0 H LYS B 5 18.612 9.513 12.661 1.00 0.00 H new ATOM 0 HA LYS B 5 18.860 8.359 15.368 1.00 0.00 H new ATOM 0 HB2 LYS B 5 21.180 8.814 15.470 1.00 0.00 H new ATOM 0 HB3 LYS B 5 20.875 7.828 14.054 1.00 0.00 H new ATOM 0 HG2 LYS B 5 21.161 9.757 12.569 1.00 0.00 H new ATOM 0 HG3 LYS B 5 21.257 10.854 13.933 1.00 0.00 H new ATOM 0 HD2 LYS B 5 23.303 9.615 14.751 1.00 0.00 H new ATOM 0 HD3 LYS B 5 23.220 8.581 13.338 1.00 0.00 H new ATOM 0 HE2 LYS B 5 23.589 10.483 11.838 1.00 0.00 H new ATOM 0 HE3 LYS B 5 23.450 11.620 13.165 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 25.759 11.188 12.574 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 25.439 10.682 14.163 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 25.563 9.537 12.916 1.00 0.00 H new ATOM 1164 N VAL B 6 18.801 10.525 16.541 1.00 0.00 N ATOM 1165 CA VAL B 6 18.557 11.753 17.321 1.00 0.00 C ATOM 1166 C VAL B 6 19.875 12.286 17.891 1.00 0.00 C ATOM 1167 O VAL B 6 20.728 11.503 18.311 1.00 0.00 O ATOM 1168 CB VAL B 6 17.496 11.470 18.411 1.00 0.00 C ATOM 1169 CG1 VAL B 6 17.425 12.526 19.513 1.00 0.00 C ATOM 1170 CG2 VAL B 6 16.103 11.365 17.785 1.00 0.00 C ATOM 0 H VAL B 6 18.908 9.702 17.135 1.00 0.00 H new ATOM 0 HA VAL B 6 18.157 12.537 16.678 1.00 0.00 H new ATOM 0 HB VAL B 6 17.811 10.532 18.868 1.00 0.00 H new ATOM 0 HG11 VAL B 6 16.656 12.249 20.234 1.00 0.00 H new ATOM 0 HG12 VAL B 6 18.389 12.591 20.018 1.00 0.00 H new ATOM 0 HG13 VAL B 6 17.179 13.493 19.075 1.00 0.00 H new ATOM 0 HG21 VAL B 6 15.368 11.166 18.565 1.00 0.00 H new ATOM 0 HG22 VAL B 6 15.857 12.302 17.285 1.00 0.00 H new ATOM 0 HG23 VAL B 6 16.091 10.552 17.059 1.00 0.00 H new ATOM 1180 N VAL B 7 20.040 13.612 17.933 1.00 0.00 N ATOM 1181 CA VAL B 7 21.203 14.304 18.524 1.00 0.00 C ATOM 1182 C VAL B 7 20.774 15.477 19.417 1.00 0.00 C ATOM 1183 O VAL B 7 19.844 16.221 19.076 1.00 0.00 O ATOM 1184 CB VAL B 7 22.230 14.692 17.441 1.00 0.00 C ATOM 1185 CG1 VAL B 7 21.691 15.693 16.415 1.00 0.00 C ATOM 1186 CG2 VAL B 7 23.505 15.283 18.062 1.00 0.00 C ATOM 0 H VAL B 7 19.351 14.257 17.547 1.00 0.00 H new ATOM 0 HA VAL B 7 21.714 13.607 19.188 1.00 0.00 H new ATOM 0 HB VAL B 7 22.453 13.759 16.923 1.00 0.00 H new ATOM 0 HG11 VAL B 7 22.468 15.919 15.685 1.00 0.00 H new ATOM 0 HG12 VAL B 7 20.828 15.263 15.906 1.00 0.00 H new ATOM 0 HG13 VAL B 7 21.393 16.610 16.923 1.00 0.00 H new ATOM 0 HG21 VAL B 7 24.207 15.545 17.271 1.00 0.00 H new ATOM 0 HG22 VAL B 7 23.251 16.176 18.633 1.00 0.00 H new ATOM 0 HG23 VAL B 7 23.962 14.547 18.724 1.00 0.00 H new ATOM 1196 N LEU B 8 21.438 15.633 20.571 1.00 0.00 N ATOM 1197 CA LEU B 8 21.110 16.618 21.612 1.00 0.00 C ATOM 1198 C LEU B 8 22.345 17.077 22.404 1.00 0.00 C ATOM 1199 O LEU B 8 23.359 16.373 22.471 1.00 0.00 O ATOM 1200 CB LEU B 8 20.018 16.035 22.534 1.00 0.00 C ATOM 1201 CG LEU B 8 20.430 14.810 23.389 1.00 0.00 C ATOM 1202 CD1 LEU B 8 20.929 15.199 24.787 1.00 0.00 C ATOM 1203 CD2 LEU B 8 19.228 13.878 23.571 1.00 0.00 C ATOM 0 H LEU B 8 22.245 15.058 20.814 1.00 0.00 H new ATOM 0 HA LEU B 8 20.728 17.516 21.127 1.00 0.00 H new ATOM 0 HB2 LEU B 8 19.679 16.824 23.206 1.00 0.00 H new ATOM 0 HB3 LEU B 8 19.164 15.752 21.918 1.00 0.00 H new ATOM 0 HG LEU B 8 21.244 14.321 22.853 1.00 0.00 H new ATOM 0 HD11 LEU B 8 21.203 14.300 25.339 1.00 0.00 H new ATOM 0 HD12 LEU B 8 21.800 15.848 24.695 1.00 0.00 H new ATOM 0 HD13 LEU B 8 20.139 15.726 25.322 1.00 0.00 H new ATOM 0 HD21 LEU B 8 19.522 13.018 24.173 1.00 0.00 H new ATOM 0 HD22 LEU B 8 18.424 14.415 24.074 1.00 0.00 H new ATOM 0 HD23 LEU B 8 18.881 13.537 22.596 1.00 0.00 H new ATOM 1215 N THR B 9 22.232 18.240 23.050 1.00 0.00 N ATOM 1216 CA THR B 9 23.254 18.818 23.947 1.00 0.00 C ATOM 1217 C THR B 9 22.791 18.765 25.406 1.00 0.00 C ATOM 1218 O THR B 9 21.659 19.156 25.719 1.00 0.00 O ATOM 1219 CB THR B 9 23.611 20.264 23.554 1.00 0.00 C ATOM 1220 OG1 THR B 9 23.857 20.372 22.164 1.00 0.00 O ATOM 1221 CG2 THR B 9 24.881 20.757 24.246 1.00 0.00 C ATOM 0 H THR B 9 21.404 18.829 22.965 1.00 0.00 H new ATOM 0 HA THR B 9 24.154 18.212 23.840 1.00 0.00 H new ATOM 0 HB THR B 9 22.753 20.863 23.858 1.00 0.00 H new ATOM 0 HG1 THR B 9 24.141 21.286 21.952 1.00 0.00 H new ATOM 0 HG21 THR B 9 25.090 21.781 23.936 1.00 0.00 H new ATOM 0 HG22 THR B 9 24.742 20.726 25.327 1.00 0.00 H new ATOM 0 HG23 THR B 9 25.718 20.116 23.969 1.00 0.00 H new ATOM 1229 N LYS B 10 23.661 18.294 26.306 1.00 0.00 N ATOM 1230 CA LYS B 10 23.419 18.182 27.757 1.00 0.00 C ATOM 1231 C LYS B 10 23.624 19.508 28.503 1.00 0.00 C ATOM 1232 O LYS B 10 24.346 20.393 28.031 1.00 0.00 O ATOM 1233 CB LYS B 10 24.348 17.108 28.354 1.00 0.00 C ATOM 1234 CG LYS B 10 24.094 15.699 27.795 1.00 0.00 C ATOM 1235 CD LYS B 10 24.817 14.628 28.623 1.00 0.00 C ATOM 1236 CE LYS B 10 26.348 14.719 28.512 1.00 0.00 C ATOM 1237 NZ LYS B 10 27.015 13.992 29.623 1.00 0.00 N1+ ATOM 0 H LYS B 10 24.589 17.967 26.038 1.00 0.00 H new ATOM 0 HA LYS B 10 22.374 17.901 27.885 1.00 0.00 H new ATOM 0 HB2 LYS B 10 25.384 17.386 28.160 1.00 0.00 H new ATOM 0 HB3 LYS B 10 24.221 17.089 29.436 1.00 0.00 H new ATOM 0 HG2 LYS B 10 23.023 15.496 27.790 1.00 0.00 H new ATOM 0 HG3 LYS B 10 24.432 15.650 26.760 1.00 0.00 H new ATOM 0 HD2 LYS B 10 24.527 14.727 29.669 1.00 0.00 H new ATOM 0 HD3 LYS B 10 24.492 13.641 28.294 1.00 0.00 H new ATOM 0 HE2 LYS B 10 26.671 14.303 27.557 1.00 0.00 H new ATOM 0 HE3 LYS B 10 26.654 15.765 28.524 1.00 0.00 H new ATOM 0 HZ1 LYS B 10 28.033 13.911 29.424 1.00 0.00 H new ATOM 0 HZ2 LYS B 10 26.877 14.514 30.512 1.00 0.00 H new ATOM 0 HZ3 LYS B 10 26.603 13.041 29.712 1.00 0.00 H new ATOM 1251 N ALA B 11 23.101 19.587 29.729 1.00 0.00 N ATOM 1252 CA ALA B 11 23.436 20.645 30.694 1.00 0.00 C ATOM 1253 C ALA B 11 24.936 20.647 31.088 1.00 0.00 C ATOM 1254 O ALA B 11 25.480 21.676 31.497 1.00 0.00 O ATOM 1255 CB ALA B 11 22.534 20.464 31.921 1.00 0.00 C ATOM 0 H ALA B 11 22.425 18.912 30.087 1.00 0.00 H new ATOM 0 HA ALA B 11 23.260 21.616 30.232 1.00 0.00 H new ATOM 0 HB1 ALA B 11 22.760 21.236 32.656 1.00 0.00 H new ATOM 0 HB2 ALA B 11 21.490 20.544 31.620 1.00 0.00 H new ATOM 0 HB3 ALA B 11 22.710 19.482 32.361 1.00 0.00 H new ATOM 1261 N ASP B 12 25.623 19.512 30.914 1.00 0.00 N ATOM 1262 CA ASP B 12 27.081 19.358 31.067 1.00 0.00 C ATOM 1263 C ASP B 12 27.895 20.078 29.965 1.00 0.00 C ATOM 1264 O ASP B 12 29.121 20.180 30.068 1.00 0.00 O ATOM 1265 CB ASP B 12 27.445 17.857 31.032 1.00 0.00 C ATOM 1266 CG ASP B 12 26.750 16.960 32.071 1.00 0.00 C ATOM 1267 OD1 ASP B 12 26.648 15.738 31.807 1.00 0.00 O ATOM 1268 OD2 ASP B 12 26.330 17.448 33.149 1.00 0.00 O1- ATOM 0 H ASP B 12 25.164 18.639 30.652 1.00 0.00 H new ATOM 0 HA ASP B 12 27.340 19.816 32.022 1.00 0.00 H new ATOM 0 HB2 ASP B 12 27.213 17.472 30.039 1.00 0.00 H new ATOM 0 HB3 ASP B 12 28.523 17.764 31.166 1.00 0.00 H new ATOM 1273 N GLY B 13 27.239 20.545 28.891 1.00 0.00 N ATOM 1274 CA GLY B 13 27.865 21.109 27.683 1.00 0.00 C ATOM 1275 C GLY B 13 28.362 20.069 26.661 1.00 0.00 C ATOM 1276 O GLY B 13 28.684 20.436 25.527 1.00 0.00 O ATOM 0 H GLY B 13 26.220 20.540 28.837 1.00 0.00 H new ATOM 0 HA2 GLY B 13 27.146 21.764 27.192 1.00 0.00 H new ATOM 0 HA3 GLY B 13 28.708 21.731 27.985 1.00 0.00 H new ATOM 1280 N GLY B 14 28.392 18.778 27.029 1.00 0.00 N ATOM 1281 CA GLY B 14 28.650 17.662 26.108 1.00 0.00 C ATOM 1282 C GLY B 14 27.439 17.322 25.233 1.00 0.00 C ATOM 1283 O GLY B 14 26.333 17.819 25.466 1.00 0.00 O ATOM 0 H GLY B 14 28.235 18.477 27.991 1.00 0.00 H new ATOM 0 HA2 GLY B 14 29.496 17.913 25.468 1.00 0.00 H new ATOM 0 HA3 GLY B 14 28.936 16.781 26.683 1.00 0.00 H new ATOM 1287 N ARG B 15 27.633 16.457 24.238 1.00 0.00 N ATOM 1288 CA ARG B 15 26.591 16.006 23.294 1.00 0.00 C ATOM 1289 C ARG B 15 26.402 14.488 23.283 1.00 0.00 C ATOM 1290 O ARG B 15 27.324 13.730 23.592 1.00 0.00 O ATOM 1291 CB ARG B 15 26.866 16.561 21.884 1.00 0.00 C ATOM 1292 CG ARG B 15 26.488 18.046 21.802 1.00 0.00 C ATOM 1293 CD ARG B 15 26.723 18.643 20.417 1.00 0.00 C ATOM 1294 NE ARG B 15 26.086 19.964 20.330 1.00 0.00 N ATOM 1295 CZ ARG B 15 26.257 20.889 19.406 1.00 0.00 C ATOM 1296 NH1 ARG B 15 27.085 20.737 18.407 1.00 0.00 N1+ ATOM 1297 NH2 ARG B 15 25.580 22.000 19.470 1.00 0.00 N ATOM 0 H ARG B 15 28.543 16.034 24.055 1.00 0.00 H new ATOM 0 HA ARG B 15 25.643 16.413 23.647 1.00 0.00 H new ATOM 0 HB2 ARG B 15 27.920 16.435 21.637 1.00 0.00 H new ATOM 0 HB3 ARG B 15 26.296 15.994 21.147 1.00 0.00 H new ATOM 0 HG2 ARG B 15 25.438 18.164 22.069 1.00 0.00 H new ATOM 0 HG3 ARG B 15 27.069 18.605 22.536 1.00 0.00 H new ATOM 0 HD2 ARG B 15 27.792 18.731 20.226 1.00 0.00 H new ATOM 0 HD3 ARG B 15 26.316 17.982 19.652 1.00 0.00 H new ATOM 0 HE ARG B 15 25.430 20.194 21.077 1.00 0.00 H new ATOM 0 HH11 ARG B 15 27.628 19.878 18.321 1.00 0.00 H new ATOM 0 HH12 ARG B 15 27.188 21.477 17.713 1.00 0.00 H new ATOM 0 HH21 ARG B 15 24.920 22.152 20.233 1.00 0.00 H new ATOM 0 HH22 ARG B 15 25.710 22.718 18.757 1.00 0.00 H new ATOM 1311 N VAL B 16 25.188 14.073 22.924 1.00 0.00 N ATOM 1312 CA VAL B 16 24.720 12.679 22.883 1.00 0.00 C ATOM 1313 C VAL B 16 24.041 12.394 21.542 1.00 0.00 C ATOM 1314 O VAL B 16 23.240 13.201 21.065 1.00 0.00 O ATOM 1315 CB VAL B 16 23.766 12.383 24.065 1.00 0.00 C ATOM 1316 CG1 VAL B 16 23.191 10.959 24.036 1.00 0.00 C ATOM 1317 CG2 VAL B 16 24.466 12.561 25.416 1.00 0.00 C ATOM 0 H VAL B 16 24.463 14.731 22.638 1.00 0.00 H new ATOM 0 HA VAL B 16 25.581 12.018 22.981 1.00 0.00 H new ATOM 0 HB VAL B 16 22.955 13.102 23.950 1.00 0.00 H new ATOM 0 HG11 VAL B 16 22.530 10.816 24.891 1.00 0.00 H new ATOM 0 HG12 VAL B 16 22.628 10.813 23.114 1.00 0.00 H new ATOM 0 HG13 VAL B 16 24.006 10.237 24.082 1.00 0.00 H new ATOM 0 HG21 VAL B 16 23.764 12.344 26.221 1.00 0.00 H new ATOM 0 HG22 VAL B 16 25.313 11.878 25.480 1.00 0.00 H new ATOM 0 HG23 VAL B 16 24.820 13.588 25.510 1.00 0.00 H new ATOM 1327 N GLU B 17 24.339 11.235 20.950 1.00 0.00 N ATOM 1328 CA GLU B 17 23.660 10.690 19.769 1.00 0.00 C ATOM 1329 C GLU B 17 22.956 9.361 20.109 1.00 0.00 C ATOM 1330 O GLU B 17 23.472 8.546 20.883 1.00 0.00 O ATOM 1331 CB GLU B 17 24.647 10.503 18.603 1.00 0.00 C ATOM 1332 CG GLU B 17 25.207 11.833 18.076 1.00 0.00 C ATOM 1333 CD GLU B 17 26.152 11.636 16.867 1.00 0.00 C ATOM 1334 OE1 GLU B 17 25.748 10.995 15.866 1.00 0.00 O ATOM 1335 OE2 GLU B 17 27.306 12.133 16.902 1.00 0.00 O1- ATOM 0 H GLU B 17 25.085 10.628 21.290 1.00 0.00 H new ATOM 0 HA GLU B 17 22.901 11.407 19.455 1.00 0.00 H new ATOM 0 HB2 GLU B 17 25.473 9.871 18.930 1.00 0.00 H new ATOM 0 HB3 GLU B 17 24.146 9.978 17.790 1.00 0.00 H new ATOM 0 HG2 GLU B 17 24.381 12.483 17.786 1.00 0.00 H new ATOM 0 HG3 GLU B 17 25.746 12.340 18.876 1.00 0.00 H new ATOM 1342 N ILE B 18 21.777 9.141 19.522 1.00 0.00 N ATOM 1343 CA ILE B 18 20.910 7.976 19.752 1.00 0.00 C ATOM 1344 C ILE B 18 20.552 7.369 18.390 1.00 0.00 C ATOM 1345 O ILE B 18 19.825 7.988 17.611 1.00 0.00 O ATOM 1346 CB ILE B 18 19.646 8.373 20.559 1.00 0.00 C ATOM 1347 CG1 ILE B 18 20.017 9.051 21.898 1.00 0.00 C ATOM 1348 CG2 ILE B 18 18.737 7.152 20.805 1.00 0.00 C ATOM 1349 CD1 ILE B 18 18.819 9.641 22.649 1.00 0.00 C ATOM 0 H ILE B 18 21.382 9.794 18.846 1.00 0.00 H new ATOM 0 HA ILE B 18 21.434 7.231 20.351 1.00 0.00 H new ATOM 0 HB ILE B 18 19.094 9.096 19.959 1.00 0.00 H new ATOM 0 HG12 ILE B 18 20.511 8.321 22.539 1.00 0.00 H new ATOM 0 HG13 ILE B 18 20.738 9.845 21.704 1.00 0.00 H new ATOM 0 HG21 ILE B 18 17.859 7.460 21.373 1.00 0.00 H new ATOM 0 HG22 ILE B 18 18.422 6.734 19.849 1.00 0.00 H new ATOM 0 HG23 ILE B 18 19.286 6.397 21.368 1.00 0.00 H new ATOM 0 HD11 ILE B 18 19.161 10.098 23.577 1.00 0.00 H new ATOM 0 HD12 ILE B 18 18.337 10.396 22.028 1.00 0.00 H new ATOM 0 HD13 ILE B 18 18.106 8.849 22.876 1.00 0.00 H new ATOM 1361 N GLY B 19 21.097 6.189 18.083 1.00 0.00 N ATOM 1362 CA GLY B 19 20.884 5.484 16.814 1.00 0.00 C ATOM 1363 C GLY B 19 19.604 4.632 16.769 1.00 0.00 C ATOM 1364 O GLY B 19 19.010 4.318 17.802 1.00 0.00 O ATOM 0 H GLY B 19 21.712 5.686 18.722 1.00 0.00 H new ATOM 0 HA2 GLY B 19 20.848 6.216 16.007 1.00 0.00 H new ATOM 0 HA3 GLY B 19 21.742 4.840 16.621 1.00 0.00 H new ATOM 1368 N ASP B 20 19.209 4.226 15.560 1.00 0.00 N ATOM 1369 CA ASP B 20 18.090 3.309 15.270 1.00 0.00 C ATOM 1370 C ASP B 20 16.745 3.734 15.904 1.00 0.00 C ATOM 1371 O ASP B 20 15.965 2.919 16.404 1.00 0.00 O ATOM 1372 CB ASP B 20 18.493 1.850 15.558 1.00 0.00 C ATOM 1373 CG ASP B 20 19.836 1.413 14.945 1.00 0.00 C ATOM 1374 OD1 ASP B 20 20.496 0.514 15.518 1.00 0.00 O ATOM 1375 OD2 ASP B 20 20.238 1.926 13.867 1.00 0.00 O1- ATOM 0 H ASP B 20 19.680 4.540 14.711 1.00 0.00 H new ATOM 0 HA ASP B 20 17.888 3.377 14.201 1.00 0.00 H new ATOM 0 HB2 ASP B 20 18.540 1.708 16.638 1.00 0.00 H new ATOM 0 HB3 ASP B 20 17.709 1.192 15.184 1.00 0.00 H new ATOM 1380 N VAL B 21 16.478 5.044 15.889 1.00 0.00 N ATOM 1381 CA VAL B 21 15.252 5.664 16.405 1.00 0.00 C ATOM 1382 C VAL B 21 14.069 5.336 15.498 1.00 0.00 C ATOM 1383 O VAL B 21 14.109 5.588 14.293 1.00 0.00 O ATOM 1384 CB VAL B 21 15.431 7.191 16.567 1.00 0.00 C ATOM 1385 CG1 VAL B 21 14.117 7.908 16.895 1.00 0.00 C ATOM 1386 CG2 VAL B 21 16.424 7.468 17.702 1.00 0.00 C ATOM 0 H VAL B 21 17.132 5.726 15.504 1.00 0.00 H new ATOM 0 HA VAL B 21 15.045 5.252 17.393 1.00 0.00 H new ATOM 0 HB VAL B 21 15.797 7.572 15.613 1.00 0.00 H new ATOM 0 HG11 VAL B 21 14.302 8.977 16.998 1.00 0.00 H new ATOM 0 HG12 VAL B 21 13.400 7.739 16.092 1.00 0.00 H new ATOM 0 HG13 VAL B 21 13.713 7.518 17.829 1.00 0.00 H new ATOM 0 HG21 VAL B 21 16.552 8.544 17.819 1.00 0.00 H new ATOM 0 HG22 VAL B 21 16.042 7.045 18.631 1.00 0.00 H new ATOM 0 HG23 VAL B 21 17.385 7.012 17.464 1.00 0.00 H new ATOM 1396 N LEU B 22 13.015 4.792 16.102 1.00 0.00 N ATOM 1397 CA LEU B 22 11.792 4.322 15.453 1.00 0.00 C ATOM 1398 C LEU B 22 10.593 5.272 15.679 1.00 0.00 C ATOM 1399 O LEU B 22 9.682 5.330 14.851 1.00 0.00 O ATOM 1400 CB LEU B 22 11.558 2.875 15.941 1.00 0.00 C ATOM 1401 CG LEU B 22 10.410 2.155 15.207 1.00 0.00 C ATOM 1402 CD1 LEU B 22 10.793 0.724 14.832 1.00 0.00 C ATOM 1403 CD2 LEU B 22 9.162 2.085 16.093 1.00 0.00 C ATOM 0 H LEU B 22 12.989 4.660 17.113 1.00 0.00 H new ATOM 0 HA LEU B 22 11.900 4.323 14.368 1.00 0.00 H new ATOM 0 HB2 LEU B 22 12.477 2.303 15.810 1.00 0.00 H new ATOM 0 HB3 LEU B 22 11.342 2.891 17.009 1.00 0.00 H new ATOM 0 HG LEU B 22 10.208 2.730 14.303 1.00 0.00 H new ATOM 0 HD11 LEU B 22 9.959 0.248 14.316 1.00 0.00 H new ATOM 0 HD12 LEU B 22 11.664 0.740 14.176 1.00 0.00 H new ATOM 0 HD13 LEU B 22 11.030 0.162 15.736 1.00 0.00 H new ATOM 0 HD21 LEU B 22 8.363 1.573 15.556 1.00 0.00 H new ATOM 0 HD22 LEU B 22 9.394 1.538 17.006 1.00 0.00 H new ATOM 0 HD23 LEU B 22 8.839 3.095 16.347 1.00 0.00 H new ATOM 1415 N GLU B 23 10.611 6.074 16.752 1.00 0.00 N ATOM 1416 CA GLU B 23 9.690 7.202 16.982 1.00 0.00 C ATOM 1417 C GLU B 23 10.339 8.261 17.897 1.00 0.00 C ATOM 1418 O GLU B 23 11.123 7.920 18.781 1.00 0.00 O ATOM 1419 CB GLU B 23 8.347 6.706 17.576 1.00 0.00 C ATOM 1420 CG GLU B 23 7.198 7.707 17.366 1.00 0.00 C ATOM 1421 CD GLU B 23 6.014 7.487 18.319 1.00 0.00 C ATOM 1422 OE1 GLU B 23 5.794 6.354 18.814 1.00 0.00 O ATOM 1423 OE2 GLU B 23 5.304 8.472 18.630 1.00 0.00 O1- ATOM 0 H GLU B 23 11.285 5.955 17.508 1.00 0.00 H new ATOM 0 HA GLU B 23 9.480 7.670 16.020 1.00 0.00 H new ATOM 0 HB2 GLU B 23 8.082 5.753 17.117 1.00 0.00 H new ATOM 0 HB3 GLU B 23 8.472 6.522 18.643 1.00 0.00 H new ATOM 0 HG2 GLU B 23 7.579 8.719 17.500 1.00 0.00 H new ATOM 0 HG3 GLU B 23 6.845 7.633 16.337 1.00 0.00 H new ATOM 1430 N VAL B 24 9.996 9.542 17.730 1.00 0.00 N ATOM 1431 CA VAL B 24 10.428 10.652 18.605 1.00 0.00 C ATOM 1432 C VAL B 24 9.283 11.645 18.823 1.00 0.00 C ATOM 1433 O VAL B 24 8.457 11.846 17.931 1.00 0.00 O ATOM 1434 CB VAL B 24 11.706 11.320 18.057 1.00 0.00 C ATOM 1435 CG1 VAL B 24 11.496 11.936 16.675 1.00 0.00 C ATOM 1436 CG2 VAL B 24 12.273 12.396 18.984 1.00 0.00 C ATOM 0 H VAL B 24 9.395 9.850 16.965 1.00 0.00 H new ATOM 0 HA VAL B 24 10.686 10.250 19.585 1.00 0.00 H new ATOM 0 HB VAL B 24 12.426 10.505 17.988 1.00 0.00 H new ATOM 0 HG11 VAL B 24 12.425 12.393 16.335 1.00 0.00 H new ATOM 0 HG12 VAL B 24 11.195 11.159 15.972 1.00 0.00 H new ATOM 0 HG13 VAL B 24 10.717 12.696 16.730 1.00 0.00 H new ATOM 0 HG21 VAL B 24 13.171 12.824 18.538 1.00 0.00 H new ATOM 0 HG22 VAL B 24 11.530 13.180 19.129 1.00 0.00 H new ATOM 0 HG23 VAL B 24 12.523 11.951 19.947 1.00 0.00 H new ATOM 1446 N ARG B 25 9.208 12.252 20.018 1.00 0.00 N ATOM 1447 CA ARG B 25 8.070 13.063 20.495 1.00 0.00 C ATOM 1448 C ARG B 25 8.529 14.254 21.339 1.00 0.00 C ATOM 1449 O ARG B 25 9.170 14.048 22.365 1.00 0.00 O ATOM 1450 CB ARG B 25 7.111 12.193 21.351 1.00 0.00 C ATOM 1451 CG ARG B 25 6.851 10.773 20.824 1.00 0.00 C ATOM 1452 CD ARG B 25 5.896 10.011 21.751 1.00 0.00 C ATOM 1453 NE ARG B 25 5.886 8.579 21.409 1.00 0.00 N ATOM 1454 CZ ARG B 25 6.521 7.597 22.028 1.00 0.00 C ATOM 1455 NH1 ARG B 25 7.123 7.756 23.174 1.00 0.00 N1+ ATOM 1456 NH2 ARG B 25 6.594 6.421 21.482 1.00 0.00 N ATOM 0 H ARG B 25 9.961 12.191 20.703 1.00 0.00 H new ATOM 0 HA ARG B 25 7.556 13.439 19.610 1.00 0.00 H new ATOM 0 HB2 ARG B 25 7.520 12.118 22.359 1.00 0.00 H new ATOM 0 HB3 ARG B 25 6.155 12.711 21.433 1.00 0.00 H new ATOM 0 HG2 ARG B 25 6.427 10.825 19.821 1.00 0.00 H new ATOM 0 HG3 ARG B 25 7.794 10.233 20.743 1.00 0.00 H new ATOM 0 HD2 ARG B 25 6.204 10.142 22.788 1.00 0.00 H new ATOM 0 HD3 ARG B 25 4.889 10.420 21.663 1.00 0.00 H new ATOM 0 HE ARG B 25 5.324 8.313 20.601 1.00 0.00 H new ATOM 0 HH11 ARG B 25 7.117 8.668 23.631 1.00 0.00 H new ATOM 0 HH12 ARG B 25 7.600 6.969 23.613 1.00 0.00 H new ATOM 0 HH21 ARG B 25 6.161 6.253 20.574 1.00 0.00 H new ATOM 0 HH22 ARG B 25 7.084 5.666 21.961 1.00 0.00 H new ATOM 1470 N ALA B 26 8.164 15.476 20.969 1.00 0.00 N ATOM 1471 CA ALA B 26 8.198 16.644 21.848 1.00 0.00 C ATOM 1472 C ALA B 26 6.885 16.686 22.659 1.00 0.00 C ATOM 1473 O ALA B 26 5.827 17.036 22.130 1.00 0.00 O ATOM 1474 CB ALA B 26 8.416 17.890 20.985 1.00 0.00 C ATOM 0 H ALA B 26 7.829 15.689 20.030 1.00 0.00 H new ATOM 0 HA ALA B 26 9.018 16.597 22.565 1.00 0.00 H new ATOM 0 HB1 ALA B 26 8.444 18.774 21.622 1.00 0.00 H new ATOM 0 HB2 ALA B 26 9.360 17.800 20.448 1.00 0.00 H new ATOM 0 HB3 ALA B 26 7.599 17.985 20.270 1.00 0.00 H new ATOM 1480 N GLU B 27 6.931 16.250 23.918 1.00 0.00 N ATOM 1481 CA GLU B 27 5.752 15.904 24.724 1.00 0.00 C ATOM 1482 C GLU B 27 6.040 16.001 26.238 1.00 0.00 C ATOM 1483 O GLU B 27 7.070 15.519 26.718 1.00 0.00 O ATOM 1484 CB GLU B 27 5.289 14.492 24.301 1.00 0.00 C ATOM 1485 CG GLU B 27 4.180 13.864 25.166 1.00 0.00 C ATOM 1486 CD GLU B 27 4.725 13.051 26.352 1.00 0.00 C ATOM 1487 OE1 GLU B 27 5.603 12.183 26.152 1.00 0.00 O ATOM 1488 OE2 GLU B 27 4.293 13.278 27.509 1.00 0.00 O1- ATOM 0 H GLU B 27 7.809 16.123 24.421 1.00 0.00 H new ATOM 0 HA GLU B 27 4.951 16.620 24.540 1.00 0.00 H new ATOM 0 HB2 GLU B 27 4.937 14.539 23.270 1.00 0.00 H new ATOM 0 HB3 GLU B 27 6.153 13.828 24.313 1.00 0.00 H new ATOM 0 HG2 GLU B 27 3.531 14.654 25.543 1.00 0.00 H new ATOM 0 HG3 GLU B 27 3.564 13.216 24.542 1.00 0.00 H new ATOM 1495 N GLY B 28 5.122 16.606 27.003 1.00 0.00 N ATOM 1496 CA GLY B 28 5.180 16.651 28.473 1.00 0.00 C ATOM 1497 C GLY B 28 6.323 17.490 29.058 1.00 0.00 C ATOM 1498 O GLY B 28 6.842 17.151 30.125 1.00 0.00 O ATOM 0 H GLY B 28 4.308 17.084 26.616 1.00 0.00 H new ATOM 0 HA2 GLY B 28 4.234 17.045 28.846 1.00 0.00 H new ATOM 0 HA3 GLY B 28 5.271 15.632 28.848 1.00 0.00 H new ATOM 1502 N GLY B 29 6.749 18.546 28.359 1.00 0.00 N ATOM 1503 CA GLY B 29 7.876 19.406 28.764 1.00 0.00 C ATOM 1504 C GLY B 29 9.265 18.784 28.535 1.00 0.00 C ATOM 1505 O GLY B 29 10.241 19.194 29.164 1.00 0.00 O ATOM 0 H GLY B 29 6.317 18.836 27.482 1.00 0.00 H new ATOM 0 HA2 GLY B 29 7.817 20.345 28.214 1.00 0.00 H new ATOM 0 HA3 GLY B 29 7.770 19.649 29.821 1.00 0.00 H new ATOM 1509 N ALA B 30 9.343 17.773 27.669 1.00 0.00 N ATOM 1510 CA ALA B 30 10.528 16.971 27.374 1.00 0.00 C ATOM 1511 C ALA B 30 10.525 16.500 25.907 1.00 0.00 C ATOM 1512 O ALA B 30 9.506 16.590 25.215 1.00 0.00 O ATOM 1513 CB ALA B 30 10.522 15.768 28.335 1.00 0.00 C ATOM 0 H ALA B 30 8.534 17.476 27.124 1.00 0.00 H new ATOM 0 HA ALA B 30 11.431 17.566 27.513 1.00 0.00 H new ATOM 0 HB1 ALA B 30 11.395 15.145 28.143 1.00 0.00 H new ATOM 0 HB2 ALA B 30 10.550 16.125 29.365 1.00 0.00 H new ATOM 0 HB3 ALA B 30 9.616 15.182 28.178 1.00 0.00 H new ATOM 1519 N VAL B 31 11.644 15.933 25.445 1.00 0.00 N ATOM 1520 CA VAL B 31 11.619 14.975 24.325 1.00 0.00 C ATOM 1521 C VAL B 31 11.644 13.547 24.859 1.00 0.00 C ATOM 1522 O VAL B 31 12.452 13.214 25.727 1.00 0.00 O ATOM 1523 CB VAL B 31 12.715 15.243 23.279 1.00 0.00 C ATOM 1524 CG1 VAL B 31 12.817 14.127 22.235 1.00 0.00 C ATOM 1525 CG2 VAL B 31 12.377 16.535 22.532 1.00 0.00 C ATOM 0 H VAL B 31 12.574 16.116 25.823 1.00 0.00 H new ATOM 0 HA VAL B 31 10.683 15.116 23.785 1.00 0.00 H new ATOM 0 HB VAL B 31 13.662 15.307 23.815 1.00 0.00 H new ATOM 0 HG11 VAL B 31 13.605 14.367 21.522 1.00 0.00 H new ATOM 0 HG12 VAL B 31 13.051 13.185 22.731 1.00 0.00 H new ATOM 0 HG13 VAL B 31 11.867 14.034 21.708 1.00 0.00 H new ATOM 0 HG21 VAL B 31 13.147 16.737 21.787 1.00 0.00 H new ATOM 0 HG22 VAL B 31 11.412 16.427 22.037 1.00 0.00 H new ATOM 0 HG23 VAL B 31 12.331 17.363 23.239 1.00 0.00 H new ATOM 1535 N ARG B 32 10.765 12.697 24.329 1.00 0.00 N ATOM 1536 CA ARG B 32 10.758 11.241 24.508 1.00 0.00 C ATOM 1537 C ARG B 32 11.080 10.566 23.174 1.00 0.00 C ATOM 1538 O ARG B 32 10.709 11.076 22.116 1.00 0.00 O ATOM 1539 CB ARG B 32 9.421 10.749 25.100 1.00 0.00 C ATOM 1540 CG ARG B 32 9.329 10.876 26.636 1.00 0.00 C ATOM 1541 CD ARG B 32 9.185 12.314 27.161 1.00 0.00 C ATOM 1542 NE ARG B 32 7.866 12.535 27.790 1.00 0.00 N ATOM 1543 CZ ARG B 32 7.585 12.861 29.038 1.00 0.00 C ATOM 1544 NH1 ARG B 32 6.353 13.080 29.389 1.00 0.00 N1+ ATOM 1545 NH2 ARG B 32 8.501 12.974 29.963 1.00 0.00 N ATOM 0 H ARG B 32 10.001 13.018 23.734 1.00 0.00 H new ATOM 0 HA ARG B 32 11.528 10.967 25.229 1.00 0.00 H new ATOM 0 HB2 ARG B 32 8.606 11.315 24.650 1.00 0.00 H new ATOM 0 HB3 ARG B 32 9.275 9.705 24.823 1.00 0.00 H new ATOM 0 HG2 ARG B 32 8.477 10.291 26.984 1.00 0.00 H new ATOM 0 HG3 ARG B 32 10.222 10.432 27.076 1.00 0.00 H new ATOM 0 HD2 ARG B 32 9.973 12.518 27.886 1.00 0.00 H new ATOM 0 HD3 ARG B 32 9.319 13.017 26.339 1.00 0.00 H new ATOM 0 HE ARG B 32 7.061 12.420 27.174 1.00 0.00 H new ATOM 0 HH11 ARG B 32 5.605 13.000 28.701 1.00 0.00 H new ATOM 0 HH12 ARG B 32 6.134 13.332 30.353 1.00 0.00 H new ATOM 0 HH21 ARG B 32 9.481 12.808 29.733 1.00 0.00 H new ATOM 0 HH22 ARG B 32 8.236 13.228 30.915 1.00 0.00 H new ATOM 1559 N VAL B 33 11.777 9.437 23.208 1.00 0.00 N ATOM 1560 CA VAL B 33 12.294 8.747 22.011 1.00 0.00 C ATOM 1561 C VAL B 33 12.265 7.230 22.184 1.00 0.00 C ATOM 1562 O VAL B 33 12.504 6.726 23.279 1.00 0.00 O ATOM 1563 CB VAL B 33 13.680 9.302 21.633 1.00 0.00 C ATOM 1564 CG1 VAL B 33 14.748 9.070 22.708 1.00 0.00 C ATOM 1565 CG2 VAL B 33 14.198 8.744 20.310 1.00 0.00 C ATOM 0 H VAL B 33 12.008 8.959 24.079 1.00 0.00 H new ATOM 0 HA VAL B 33 11.635 8.952 21.167 1.00 0.00 H new ATOM 0 HB VAL B 33 13.514 10.375 21.535 1.00 0.00 H new ATOM 0 HG11 VAL B 33 15.698 9.487 22.373 1.00 0.00 H new ATOM 0 HG12 VAL B 33 14.444 9.558 23.634 1.00 0.00 H new ATOM 0 HG13 VAL B 33 14.863 8.000 22.882 1.00 0.00 H new ATOM 0 HG21 VAL B 33 15.178 9.170 20.094 1.00 0.00 H new ATOM 0 HG22 VAL B 33 14.281 7.659 20.380 1.00 0.00 H new ATOM 0 HG23 VAL B 33 13.505 9.004 19.509 1.00 0.00 H new ATOM 1575 N THR B 34 11.954 6.512 21.099 1.00 0.00 N ATOM 1576 CA THR B 34 11.705 5.062 21.041 1.00 0.00 C ATOM 1577 C THR B 34 12.620 4.397 20.019 1.00 0.00 C ATOM 1578 O THR B 34 12.798 4.910 18.913 1.00 0.00 O ATOM 1579 CB THR B 34 10.238 4.790 20.649 1.00 0.00 C ATOM 1580 OG1 THR B 34 9.355 5.471 21.510 1.00 0.00 O ATOM 1581 CG2 THR B 34 9.853 3.313 20.690 1.00 0.00 C ATOM 0 H THR B 34 11.863 6.951 20.183 1.00 0.00 H new ATOM 0 HA THR B 34 11.908 4.647 22.028 1.00 0.00 H new ATOM 0 HB THR B 34 10.155 5.144 19.622 1.00 0.00 H new ATOM 0 HG1 THR B 34 8.889 4.824 22.079 1.00 0.00 H new ATOM 0 HG21 THR B 34 8.808 3.201 20.402 1.00 0.00 H new ATOM 0 HG22 THR B 34 10.482 2.754 19.997 1.00 0.00 H new ATOM 0 HG23 THR B 34 9.994 2.928 21.700 1.00 0.00 H new ATOM 1589 N THR B 35 13.170 3.230 20.360 1.00 0.00 N ATOM 1590 CA THR B 35 13.957 2.377 19.447 1.00 0.00 C ATOM 1591 C THR B 35 13.192 1.104 19.063 1.00 0.00 C ATOM 1592 O THR B 35 12.232 0.704 19.731 1.00 0.00 O ATOM 1593 CB THR B 35 15.315 1.999 20.060 1.00 0.00 C ATOM 1594 OG1 THR B 35 15.139 1.140 21.167 1.00 0.00 O ATOM 1595 CG2 THR B 35 16.138 3.205 20.520 1.00 0.00 C ATOM 0 H THR B 35 13.083 2.837 21.297 1.00 0.00 H new ATOM 0 HA THR B 35 14.131 2.963 18.545 1.00 0.00 H new ATOM 0 HB THR B 35 15.864 1.502 19.260 1.00 0.00 H new ATOM 0 HG1 THR B 35 14.526 1.555 21.809 1.00 0.00 H new ATOM 0 HG21 THR B 35 17.083 2.861 20.941 1.00 0.00 H new ATOM 0 HG22 THR B 35 16.336 3.856 19.669 1.00 0.00 H new ATOM 0 HG23 THR B 35 15.582 3.757 21.278 1.00 0.00 H new ATOM 1603 N LEU B 36 13.638 0.408 18.003 1.00 0.00 N ATOM 1604 CA LEU B 36 13.076 -0.885 17.573 1.00 0.00 C ATOM 1605 C LEU B 36 13.268 -2.041 18.585 1.00 0.00 C ATOM 1606 O LEU B 36 12.641 -3.091 18.440 1.00 0.00 O ATOM 1607 CB LEU B 36 13.596 -1.252 16.169 1.00 0.00 C ATOM 1608 CG LEU B 36 15.016 -1.845 16.101 1.00 0.00 C ATOM 1609 CD1 LEU B 36 15.257 -2.363 14.682 1.00 0.00 C ATOM 1610 CD2 LEU B 36 16.087 -0.807 16.432 1.00 0.00 C ATOM 0 H LEU B 36 14.406 0.730 17.415 1.00 0.00 H new ATOM 0 HA LEU B 36 11.996 -0.747 17.529 1.00 0.00 H new ATOM 0 HB2 LEU B 36 12.905 -1.968 15.724 1.00 0.00 H new ATOM 0 HB3 LEU B 36 13.569 -0.356 15.549 1.00 0.00 H new ATOM 0 HG LEU B 36 15.086 -2.646 16.837 1.00 0.00 H new ATOM 0 HD11 LEU B 36 16.259 -2.787 14.615 1.00 0.00 H new ATOM 0 HD12 LEU B 36 14.521 -3.131 14.445 1.00 0.00 H new ATOM 0 HD13 LEU B 36 15.163 -1.540 13.973 1.00 0.00 H new ATOM 0 HD21 LEU B 36 17.072 -1.269 16.372 1.00 0.00 H new ATOM 0 HD22 LEU B 36 16.028 0.016 15.720 1.00 0.00 H new ATOM 0 HD23 LEU B 36 15.926 -0.427 17.441 1.00 0.00 H new ATOM 1622 N PHE B 37 14.099 -1.854 19.617 1.00 0.00 N ATOM 1623 CA PHE B 37 14.257 -2.788 20.744 1.00 0.00 C ATOM 1624 C PHE B 37 13.104 -2.703 21.770 1.00 0.00 C ATOM 1625 O PHE B 37 13.129 -3.392 22.791 1.00 0.00 O ATOM 1626 CB PHE B 37 15.623 -2.539 21.403 1.00 0.00 C ATOM 1627 CG PHE B 37 16.798 -2.566 20.439 1.00 0.00 C ATOM 1628 CD1 PHE B 37 17.192 -3.785 19.855 1.00 0.00 C ATOM 1629 CD2 PHE B 37 17.483 -1.378 20.108 1.00 0.00 C ATOM 1630 CE1 PHE B 37 18.252 -3.816 18.928 1.00 0.00 C ATOM 1631 CE2 PHE B 37 18.541 -1.410 19.183 1.00 0.00 C ATOM 1632 CZ PHE B 37 18.924 -2.629 18.592 1.00 0.00 C ATOM 0 H PHE B 37 14.695 -1.030 19.696 1.00 0.00 H new ATOM 0 HA PHE B 37 14.215 -3.805 20.353 1.00 0.00 H new ATOM 0 HB2 PHE B 37 15.601 -1.571 21.903 1.00 0.00 H new ATOM 0 HB3 PHE B 37 15.784 -3.292 22.174 1.00 0.00 H new ATOM 0 HD1 PHE B 37 16.680 -4.699 20.119 1.00 0.00 H new ATOM 0 HD2 PHE B 37 17.194 -0.443 20.566 1.00 0.00 H new ATOM 0 HE1 PHE B 37 18.548 -4.751 18.476 1.00 0.00 H new ATOM 0 HE2 PHE B 37 19.060 -0.499 18.926 1.00 0.00 H new ATOM 0 HZ PHE B 37 19.735 -2.652 17.880 1.00 0.00 H new ATOM 1642 N ASP B 38 12.107 -1.840 21.527 1.00 0.00 N ATOM 1643 CA ASP B 38 11.044 -1.423 22.463 1.00 0.00 C ATOM 1644 C ASP B 38 11.573 -0.723 23.740 1.00 0.00 C ATOM 1645 O ASP B 38 10.878 -0.614 24.756 1.00 0.00 O ATOM 1646 CB ASP B 38 10.069 -2.589 22.729 1.00 0.00 C ATOM 1647 CG ASP B 38 8.696 -2.154 23.283 1.00 0.00 C ATOM 1648 OD1 ASP B 38 8.033 -2.976 23.963 1.00 0.00 O ATOM 1649 OD2 ASP B 38 8.236 -1.022 22.995 1.00 0.00 O1- ATOM 0 H ASP B 38 12.012 -1.385 20.619 1.00 0.00 H new ATOM 0 HA ASP B 38 10.468 -0.636 21.976 1.00 0.00 H new ATOM 0 HB2 ASP B 38 9.916 -3.138 21.800 1.00 0.00 H new ATOM 0 HB3 ASP B 38 10.531 -3.279 23.435 1.00 0.00 H new ATOM 1654 N GLU B 39 12.820 -0.234 23.700 1.00 0.00 N ATOM 1655 CA GLU B 39 13.423 0.629 24.719 1.00 0.00 C ATOM 1656 C GLU B 39 13.096 2.108 24.441 1.00 0.00 C ATOM 1657 O GLU B 39 13.092 2.545 23.282 1.00 0.00 O ATOM 1658 CB GLU B 39 14.942 0.380 24.767 1.00 0.00 C ATOM 1659 CG GLU B 39 15.656 1.168 25.876 1.00 0.00 C ATOM 1660 CD GLU B 39 17.100 0.687 26.149 1.00 0.00 C ATOM 1661 OE1 GLU B 39 17.608 0.948 27.268 1.00 0.00 O ATOM 1662 OE2 GLU B 39 17.751 0.074 25.267 1.00 0.00 O1- ATOM 0 H GLU B 39 13.457 -0.437 22.929 1.00 0.00 H new ATOM 0 HA GLU B 39 13.004 0.387 25.696 1.00 0.00 H new ATOM 0 HB2 GLU B 39 15.123 -0.685 24.914 1.00 0.00 H new ATOM 0 HB3 GLU B 39 15.377 0.648 23.804 1.00 0.00 H new ATOM 0 HG2 GLU B 39 15.679 2.223 25.603 1.00 0.00 H new ATOM 0 HG3 GLU B 39 15.076 1.090 26.796 1.00 0.00 H new ATOM 1669 N GLU B 40 12.844 2.885 25.500 1.00 0.00 N ATOM 1670 CA GLU B 40 12.560 4.328 25.434 1.00 0.00 C ATOM 1671 C GLU B 40 13.462 5.157 26.362 1.00 0.00 C ATOM 1672 O GLU B 40 13.886 4.693 27.420 1.00 0.00 O ATOM 1673 CB GLU B 40 11.076 4.627 25.721 1.00 0.00 C ATOM 1674 CG GLU B 40 10.125 4.049 24.664 1.00 0.00 C ATOM 1675 CD GLU B 40 8.671 4.500 24.899 1.00 0.00 C ATOM 1676 OE1 GLU B 40 8.334 5.685 24.646 1.00 0.00 O ATOM 1677 OE2 GLU B 40 7.841 3.667 25.342 1.00 0.00 O1- ATOM 0 H GLU B 40 12.831 2.521 26.453 1.00 0.00 H new ATOM 0 HA GLU B 40 12.785 4.630 24.411 1.00 0.00 H new ATOM 0 HB2 GLU B 40 10.813 4.221 26.698 1.00 0.00 H new ATOM 0 HB3 GLU B 40 10.934 5.706 25.776 1.00 0.00 H new ATOM 0 HG2 GLU B 40 10.448 4.365 23.672 1.00 0.00 H new ATOM 0 HG3 GLU B 40 10.176 2.960 24.685 1.00 0.00 H new ATOM 1684 N HIS B 41 13.692 6.413 25.975 1.00 0.00 N ATOM 1685 CA HIS B 41 14.490 7.407 26.708 1.00 0.00 C ATOM 1686 C HIS B 41 13.749 8.754 26.801 1.00 0.00 C ATOM 1687 O HIS B 41 12.859 9.031 25.987 1.00 0.00 O ATOM 1688 CB HIS B 41 15.866 7.585 26.035 1.00 0.00 C ATOM 1689 CG HIS B 41 16.596 6.296 25.727 1.00 0.00 C ATOM 1690 ND1 HIS B 41 17.306 5.517 26.644 1.00 0.00 N ATOM 1691 CD2 HIS B 41 16.660 5.696 24.502 1.00 0.00 C ATOM 1692 CE1 HIS B 41 17.786 4.465 25.957 1.00 0.00 C ATOM 1693 NE2 HIS B 41 17.410 4.550 24.664 1.00 0.00 N ATOM 0 H HIS B 41 13.312 6.785 25.105 1.00 0.00 H new ATOM 0 HA HIS B 41 14.643 7.042 27.724 1.00 0.00 H new ATOM 0 HB2 HIS B 41 15.731 8.140 25.107 1.00 0.00 H new ATOM 0 HB3 HIS B 41 16.495 8.196 26.683 1.00 0.00 H new ATOM 0 HD2 HIS B 41 16.211 6.050 23.586 1.00 0.00 H new ATOM 0 HE1 HIS B 41 18.384 3.670 26.378 1.00 0.00 H new ATOM 0 HE2 HIS B 41 17.641 3.880 23.930 1.00 0.00 H new ATOM 1701 N ALA B 42 14.113 9.591 27.775 1.00 0.00 N ATOM 1702 CA ALA B 42 13.467 10.879 28.047 1.00 0.00 C ATOM 1703 C ALA B 42 14.484 11.976 28.428 1.00 0.00 C ATOM 1704 O ALA B 42 15.435 11.734 29.179 1.00 0.00 O ATOM 1705 CB ALA B 42 12.414 10.687 29.150 1.00 0.00 C ATOM 0 H ALA B 42 14.883 9.388 28.412 1.00 0.00 H new ATOM 0 HA ALA B 42 12.981 11.222 27.134 1.00 0.00 H new ATOM 0 HB1 ALA B 42 11.928 11.640 29.359 1.00 0.00 H new ATOM 0 HB2 ALA B 42 11.668 9.964 28.819 1.00 0.00 H new ATOM 0 HB3 ALA B 42 12.898 10.320 30.055 1.00 0.00 H new ATOM 1711 N PHE B 43 14.244 13.198 27.940 1.00 0.00 N ATOM 1712 CA PHE B 43 15.132 14.364 28.073 1.00 0.00 C ATOM 1713 C PHE B 43 14.326 15.653 28.338 1.00 0.00 C ATOM 1714 O PHE B 43 13.864 16.292 27.383 1.00 0.00 O ATOM 1715 CB PHE B 43 16.006 14.480 26.809 1.00 0.00 C ATOM 1716 CG PHE B 43 16.832 13.244 26.506 1.00 0.00 C ATOM 1717 CD1 PHE B 43 16.346 12.265 25.614 1.00 0.00 C ATOM 1718 CD2 PHE B 43 18.064 13.038 27.163 1.00 0.00 C ATOM 1719 CE1 PHE B 43 17.073 11.082 25.398 1.00 0.00 C ATOM 1720 CE2 PHE B 43 18.789 11.855 26.947 1.00 0.00 C ATOM 1721 CZ PHE B 43 18.296 10.877 26.064 1.00 0.00 C ATOM 0 H PHE B 43 13.393 13.413 27.421 1.00 0.00 H new ATOM 0 HA PHE B 43 15.784 14.226 28.935 1.00 0.00 H new ATOM 0 HB2 PHE B 43 15.363 14.691 25.955 1.00 0.00 H new ATOM 0 HB3 PHE B 43 16.676 15.332 26.922 1.00 0.00 H new ATOM 0 HD1 PHE B 43 15.412 12.425 25.096 1.00 0.00 H new ATOM 0 HD2 PHE B 43 18.450 13.792 27.833 1.00 0.00 H new ATOM 0 HE1 PHE B 43 16.694 10.331 24.721 1.00 0.00 H new ATOM 0 HE2 PHE B 43 19.726 11.696 27.459 1.00 0.00 H new ATOM 0 HZ PHE B 43 18.856 9.969 25.897 1.00 0.00 H new ATOM 1731 N PRO B 44 14.116 16.039 29.613 1.00 0.00 N ATOM 1732 CA PRO B 44 13.390 17.252 29.993 1.00 0.00 C ATOM 1733 C PRO B 44 14.008 18.549 29.460 1.00 0.00 C ATOM 1734 O PRO B 44 15.233 18.674 29.349 1.00 0.00 O ATOM 1735 CB PRO B 44 13.323 17.242 31.522 1.00 0.00 C ATOM 1736 CG PRO B 44 13.451 15.763 31.874 1.00 0.00 C ATOM 1737 CD PRO B 44 14.415 15.255 30.803 1.00 0.00 C ATOM 0 HA PRO B 44 12.399 17.239 29.539 1.00 0.00 H new ATOM 0 HB2 PRO B 44 14.127 17.831 31.963 1.00 0.00 H new ATOM 0 HB3 PRO B 44 12.385 17.661 31.885 1.00 0.00 H new ATOM 0 HG2 PRO B 44 13.847 15.617 32.879 1.00 0.00 H new ATOM 0 HG3 PRO B 44 12.490 15.250 31.832 1.00 0.00 H new ATOM 0 HD2 PRO B 44 15.452 15.389 31.112 1.00 0.00 H new ATOM 0 HD3 PRO B 44 14.272 14.190 30.619 1.00 0.00 H new ATOM 1745 N GLY B 45 13.151 19.527 29.152 1.00 0.00 N ATOM 1746 CA GLY B 45 13.543 20.853 28.662 1.00 0.00 C ATOM 1747 C GLY B 45 13.923 20.915 27.175 1.00 0.00 C ATOM 1748 O GLY B 45 14.364 21.967 26.710 1.00 0.00 O ATOM 0 H GLY B 45 12.141 19.416 29.238 1.00 0.00 H new ATOM 0 HA2 GLY B 45 12.721 21.546 28.840 1.00 0.00 H new ATOM 0 HA3 GLY B 45 14.389 21.205 29.252 1.00 0.00 H new ATOM 1752 N LEU B 46 13.749 19.821 26.418 1.00 0.00 N ATOM 1753 CA LEU B 46 13.971 19.778 24.969 1.00 0.00 C ATOM 1754 C LEU B 46 12.663 19.813 24.151 1.00 0.00 C ATOM 1755 O LEU B 46 11.581 19.488 24.651 1.00 0.00 O ATOM 1756 CB LEU B 46 14.822 18.550 24.579 1.00 0.00 C ATOM 1757 CG LEU B 46 16.213 18.439 25.240 1.00 0.00 C ATOM 1758 CD1 LEU B 46 16.970 17.266 24.605 1.00 0.00 C ATOM 1759 CD2 LEU B 46 17.078 19.687 25.059 1.00 0.00 C ATOM 0 H LEU B 46 13.445 18.927 26.804 1.00 0.00 H new ATOM 0 HA LEU B 46 14.518 20.687 24.718 1.00 0.00 H new ATOM 0 HB2 LEU B 46 14.256 17.651 24.822 1.00 0.00 H new ATOM 0 HB3 LEU B 46 14.958 18.558 23.498 1.00 0.00 H new ATOM 0 HG LEU B 46 16.037 18.302 26.307 1.00 0.00 H new ATOM 0 HD11 LEU B 46 17.955 17.177 25.064 1.00 0.00 H new ATOM 0 HD12 LEU B 46 16.411 16.344 24.764 1.00 0.00 H new ATOM 0 HD13 LEU B 46 17.083 17.442 23.535 1.00 0.00 H new ATOM 0 HD21 LEU B 46 18.040 19.537 25.549 1.00 0.00 H new ATOM 0 HD22 LEU B 46 17.237 19.869 23.996 1.00 0.00 H new ATOM 0 HD23 LEU B 46 16.575 20.546 25.503 1.00 0.00 H new ATOM 1771 N ALA B 47 12.805 20.144 22.867 1.00 0.00 N ATOM 1772 CA ALA B 47 11.837 19.971 21.786 1.00 0.00 C ATOM 1773 C ALA B 47 12.567 19.601 20.477 1.00 0.00 C ATOM 1774 O ALA B 47 13.780 19.785 20.360 1.00 0.00 O ATOM 1775 CB ALA B 47 11.015 21.257 21.649 1.00 0.00 C ATOM 0 H ALA B 47 13.667 20.573 22.531 1.00 0.00 H new ATOM 0 HA ALA B 47 11.154 19.152 22.011 1.00 0.00 H new ATOM 0 HB1 ALA B 47 10.288 21.140 20.845 1.00 0.00 H new ATOM 0 HB2 ALA B 47 10.492 21.456 22.584 1.00 0.00 H new ATOM 0 HB3 ALA B 47 11.679 22.091 21.420 1.00 0.00 H new ATOM 1781 N ILE B 48 11.854 19.060 19.479 1.00 0.00 N ATOM 1782 CA ILE B 48 12.418 18.748 18.152 1.00 0.00 C ATOM 1783 C ILE B 48 12.625 20.063 17.376 1.00 0.00 C ATOM 1784 O ILE B 48 11.672 20.810 17.132 1.00 0.00 O ATOM 1785 CB ILE B 48 11.531 17.748 17.367 1.00 0.00 C ATOM 1786 CG1 ILE B 48 11.340 16.398 18.110 1.00 0.00 C ATOM 1787 CG2 ILE B 48 12.145 17.480 15.978 1.00 0.00 C ATOM 1788 CD1 ILE B 48 10.049 15.679 17.681 1.00 0.00 C ATOM 0 H ILE B 48 10.865 18.824 19.567 1.00 0.00 H new ATOM 0 HA ILE B 48 13.381 18.255 18.282 1.00 0.00 H new ATOM 0 HB ILE B 48 10.548 18.210 17.269 1.00 0.00 H new ATOM 0 HG12 ILE B 48 12.196 15.753 17.914 1.00 0.00 H new ATOM 0 HG13 ILE B 48 11.315 16.577 19.185 1.00 0.00 H new ATOM 0 HG21 ILE B 48 11.517 16.776 15.432 1.00 0.00 H new ATOM 0 HG22 ILE B 48 12.210 18.415 15.422 1.00 0.00 H new ATOM 0 HG23 ILE B 48 13.143 17.058 16.097 1.00 0.00 H new ATOM 0 HD11 ILE B 48 9.957 14.740 18.226 1.00 0.00 H new ATOM 0 HD12 ILE B 48 9.190 16.312 17.901 1.00 0.00 H new ATOM 0 HD13 ILE B 48 10.085 15.475 16.611 1.00 0.00 H new ATOM 1800 N GLY B 49 13.867 20.367 16.986 1.00 0.00 N ATOM 1801 CA GLY B 49 14.230 21.606 16.287 1.00 0.00 C ATOM 1802 C GLY B 49 14.327 21.475 14.767 1.00 0.00 C ATOM 1803 O GLY B 49 13.997 22.417 14.043 1.00 0.00 O ATOM 0 H GLY B 49 14.662 19.749 17.149 1.00 0.00 H new ATOM 0 HA2 GLY B 49 13.492 22.372 16.526 1.00 0.00 H new ATOM 0 HA3 GLY B 49 15.188 21.956 16.670 1.00 0.00 H new ATOM 1807 N ARG B 50 14.770 20.312 14.271 1.00 0.00 N ATOM 1808 CA ARG B 50 15.056 20.055 12.852 1.00 0.00 C ATOM 1809 C ARG B 50 15.009 18.564 12.531 1.00 0.00 C ATOM 1810 O ARG B 50 15.432 17.745 13.350 1.00 0.00 O ATOM 1811 CB ARG B 50 16.444 20.655 12.542 1.00 0.00 C ATOM 1812 CG ARG B 50 16.985 20.446 11.121 1.00 0.00 C ATOM 1813 CD ARG B 50 18.391 21.039 11.001 1.00 0.00 C ATOM 1814 NE ARG B 50 19.410 20.098 11.508 1.00 0.00 N ATOM 1815 CZ ARG B 50 20.276 19.403 10.799 1.00 0.00 C ATOM 1816 NH1 ARG B 50 20.459 19.568 9.522 1.00 0.00 N1+ ATOM 1817 NH2 ARG B 50 20.983 18.480 11.384 1.00 0.00 N ATOM 0 H ARG B 50 14.945 19.500 14.863 1.00 0.00 H new ATOM 0 HA ARG B 50 14.295 20.522 12.227 1.00 0.00 H new ATOM 0 HB2 ARG B 50 16.402 21.727 12.736 1.00 0.00 H new ATOM 0 HB3 ARG B 50 17.162 20.232 13.245 1.00 0.00 H new ATOM 0 HG2 ARG B 50 17.009 19.382 10.886 1.00 0.00 H new ATOM 0 HG3 ARG B 50 16.320 20.917 10.397 1.00 0.00 H new ATOM 0 HD2 ARG B 50 18.600 21.279 9.959 1.00 0.00 H new ATOM 0 HD3 ARG B 50 18.444 21.973 11.560 1.00 0.00 H new ATOM 0 HE ARG B 50 19.448 19.972 12.520 1.00 0.00 H new ATOM 0 HH11 ARG B 50 19.916 20.267 9.015 1.00 0.00 H new ATOM 0 HH12 ARG B 50 21.146 18.998 9.027 1.00 0.00 H new ATOM 0 HH21 ARG B 50 20.863 18.301 12.381 1.00 0.00 H new ATOM 0 HH22 ARG B 50 21.657 17.935 10.845 1.00 0.00 H new ATOM 1831 N VAL B 51 14.581 18.215 11.314 1.00 0.00 N ATOM 1832 CA VAL B 51 14.779 16.882 10.712 1.00 0.00 C ATOM 1833 C VAL B 51 15.440 17.042 9.340 1.00 0.00 C ATOM 1834 O VAL B 51 15.015 17.864 8.532 1.00 0.00 O ATOM 1835 CB VAL B 51 13.480 16.053 10.636 1.00 0.00 C ATOM 1836 CG1 VAL B 51 13.774 14.586 10.318 1.00 0.00 C ATOM 1837 CG2 VAL B 51 12.655 16.088 11.931 1.00 0.00 C ATOM 0 H VAL B 51 14.077 18.859 10.704 1.00 0.00 H new ATOM 0 HA VAL B 51 15.440 16.311 11.364 1.00 0.00 H new ATOM 0 HB VAL B 51 12.901 16.518 9.838 1.00 0.00 H new ATOM 0 HG11 VAL B 51 12.838 14.029 10.271 1.00 0.00 H new ATOM 0 HG12 VAL B 51 14.285 14.517 9.358 1.00 0.00 H new ATOM 0 HG13 VAL B 51 14.408 14.165 11.098 1.00 0.00 H new ATOM 0 HG21 VAL B 51 11.756 15.484 11.806 1.00 0.00 H new ATOM 0 HG22 VAL B 51 13.250 15.688 12.752 1.00 0.00 H new ATOM 0 HG23 VAL B 51 12.373 17.117 12.155 1.00 0.00 H new ATOM 1847 N ASP B 52 16.496 16.271 9.081 1.00 0.00 N ATOM 1848 CA ASP B 52 17.390 16.377 7.922 1.00 0.00 C ATOM 1849 C ASP B 52 17.550 15.004 7.252 1.00 0.00 C ATOM 1850 O ASP B 52 18.341 14.156 7.677 1.00 0.00 O ATOM 1851 CB ASP B 52 18.718 16.980 8.408 1.00 0.00 C ATOM 1852 CG ASP B 52 19.830 17.071 7.350 1.00 0.00 C ATOM 1853 OD1 ASP B 52 19.574 16.821 6.150 1.00 0.00 O ATOM 1854 OD2 ASP B 52 20.970 17.424 7.742 1.00 0.00 O1- ATOM 0 H ASP B 52 16.768 15.513 9.707 1.00 0.00 H new ATOM 0 HA ASP B 52 16.979 17.034 7.155 1.00 0.00 H new ATOM 0 HB2 ASP B 52 18.523 17.981 8.792 1.00 0.00 H new ATOM 0 HB3 ASP B 52 19.084 16.383 9.244 1.00 0.00 H new ATOM 1859 N LEU B 53 16.740 14.774 6.220 1.00 0.00 N ATOM 1860 CA LEU B 53 16.509 13.464 5.617 1.00 0.00 C ATOM 1861 C LEU B 53 17.623 13.054 4.637 1.00 0.00 C ATOM 1862 O LEU B 53 17.760 11.869 4.332 1.00 0.00 O ATOM 1863 CB LEU B 53 15.124 13.462 4.937 1.00 0.00 C ATOM 1864 CG LEU B 53 13.874 13.658 5.832 1.00 0.00 C ATOM 1865 CD1 LEU B 53 13.828 12.662 6.992 1.00 0.00 C ATOM 1866 CD2 LEU B 53 13.696 15.068 6.398 1.00 0.00 C ATOM 0 H LEU B 53 16.210 15.518 5.767 1.00 0.00 H new ATOM 0 HA LEU B 53 16.528 12.715 6.408 1.00 0.00 H new ATOM 0 HB2 LEU B 53 15.121 14.249 4.183 1.00 0.00 H new ATOM 0 HB3 LEU B 53 15.012 12.515 4.410 1.00 0.00 H new ATOM 0 HG LEU B 53 13.049 13.478 5.143 1.00 0.00 H new ATOM 0 HD11 LEU B 53 12.934 12.840 7.589 1.00 0.00 H new ATOM 0 HD12 LEU B 53 13.805 11.646 6.598 1.00 0.00 H new ATOM 0 HD13 LEU B 53 14.713 12.789 7.616 1.00 0.00 H new ATOM 0 HD21 LEU B 53 12.795 15.103 7.010 1.00 0.00 H new ATOM 0 HD22 LEU B 53 14.560 15.326 7.010 1.00 0.00 H new ATOM 0 HD23 LEU B 53 13.606 15.781 5.578 1.00 0.00 H new ATOM 1878 N ARG B 54 18.465 14.003 4.203 1.00 0.00 N ATOM 1879 CA ARG B 54 19.688 13.729 3.419 1.00 0.00 C ATOM 1880 C ARG B 54 20.757 12.982 4.233 1.00 0.00 C ATOM 1881 O ARG B 54 21.637 12.349 3.640 1.00 0.00 O ATOM 1882 CB ARG B 54 20.246 15.042 2.836 1.00 0.00 C ATOM 1883 CG ARG B 54 19.225 15.749 1.929 1.00 0.00 C ATOM 1884 CD ARG B 54 19.829 16.939 1.173 1.00 0.00 C ATOM 1885 NE ARG B 54 20.762 16.508 0.110 1.00 0.00 N ATOM 1886 CZ ARG B 54 21.379 17.287 -0.759 1.00 0.00 C ATOM 1887 NH1 ARG B 54 21.241 18.583 -0.749 1.00 0.00 N1+ ATOM 1888 NH2 ARG B 54 22.160 16.777 -1.669 1.00 0.00 N ATOM 0 H ARG B 54 18.318 14.996 4.386 1.00 0.00 H new ATOM 0 HA ARG B 54 19.411 13.066 2.599 1.00 0.00 H new ATOM 0 HB2 ARG B 54 20.530 15.708 3.650 1.00 0.00 H new ATOM 0 HB3 ARG B 54 21.151 14.830 2.267 1.00 0.00 H new ATOM 0 HG2 ARG B 54 18.826 15.033 1.211 1.00 0.00 H new ATOM 0 HG3 ARG B 54 18.387 16.095 2.534 1.00 0.00 H new ATOM 0 HD2 ARG B 54 19.028 17.532 0.733 1.00 0.00 H new ATOM 0 HD3 ARG B 54 20.355 17.585 1.876 1.00 0.00 H new ATOM 0 HE ARG B 54 20.948 15.507 0.041 1.00 0.00 H new ATOM 0 HH11 ARG B 54 20.641 19.027 -0.054 1.00 0.00 H new ATOM 0 HH12 ARG B 54 21.733 19.154 -1.436 1.00 0.00 H new ATOM 0 HH21 ARG B 54 22.299 15.768 -1.714 1.00 0.00 H new ATOM 0 HH22 ARG B 54 22.632 17.387 -2.336 1.00 0.00 H new ATOM 1902 N SER B 55 20.659 13.001 5.567 1.00 0.00 N ATOM 1903 CA SER B 55 21.547 12.278 6.500 1.00 0.00 C ATOM 1904 C SER B 55 20.814 11.402 7.535 1.00 0.00 C ATOM 1905 O SER B 55 21.465 10.675 8.296 1.00 0.00 O ATOM 1906 CB SER B 55 22.466 13.275 7.219 1.00 0.00 C ATOM 1907 OG SER B 55 23.249 14.024 6.295 1.00 0.00 O ATOM 0 H SER B 55 19.937 13.537 6.048 1.00 0.00 H new ATOM 0 HA SER B 55 22.125 11.588 5.885 1.00 0.00 H new ATOM 0 HB2 SER B 55 21.865 13.955 7.823 1.00 0.00 H new ATOM 0 HB3 SER B 55 23.123 12.738 7.903 1.00 0.00 H new ATOM 0 HG SER B 55 23.822 14.651 6.784 1.00 0.00 H new ATOM 1913 N GLY B 56 19.480 11.451 7.582 1.00 0.00 N ATOM 1914 CA GLY B 56 18.653 10.738 8.570 1.00 0.00 C ATOM 1915 C GLY B 56 18.776 11.266 10.008 1.00 0.00 C ATOM 1916 O GLY B 56 18.705 10.486 10.960 1.00 0.00 O ATOM 0 H GLY B 56 18.929 11.999 6.921 1.00 0.00 H new ATOM 0 HA2 GLY B 56 17.609 10.799 8.262 1.00 0.00 H new ATOM 0 HA3 GLY B 56 18.927 9.683 8.560 1.00 0.00 H new ATOM 1920 N VAL B 57 19.015 12.572 10.172 1.00 0.00 N ATOM 1921 CA VAL B 57 19.301 13.213 11.467 1.00 0.00 C ATOM 1922 C VAL B 57 18.090 13.978 12.010 1.00 0.00 C ATOM 1923 O VAL B 57 17.436 14.719 11.279 1.00 0.00 O ATOM 1924 CB VAL B 57 20.543 14.127 11.370 1.00 0.00 C ATOM 1925 CG1 VAL B 57 20.840 14.880 12.674 1.00 0.00 C ATOM 1926 CG2 VAL B 57 21.785 13.304 11.017 1.00 0.00 C ATOM 0 H VAL B 57 19.016 13.230 9.393 1.00 0.00 H new ATOM 0 HA VAL B 57 19.520 12.418 12.179 1.00 0.00 H new ATOM 0 HB VAL B 57 20.314 14.855 10.592 1.00 0.00 H new ATOM 0 HG11 VAL B 57 21.724 15.504 12.541 1.00 0.00 H new ATOM 0 HG12 VAL B 57 19.988 15.508 12.934 1.00 0.00 H new ATOM 0 HG13 VAL B 57 21.020 14.163 13.475 1.00 0.00 H new ATOM 0 HG21 VAL B 57 22.651 13.962 10.952 1.00 0.00 H new ATOM 0 HG22 VAL B 57 21.956 12.554 11.789 1.00 0.00 H new ATOM 0 HG23 VAL B 57 21.633 12.809 10.058 1.00 0.00 H new ATOM 1936 N ILE B 58 17.833 13.844 13.308 1.00 0.00 N ATOM 1937 CA ILE B 58 16.848 14.613 14.085 1.00 0.00 C ATOM 1938 C ILE B 58 17.620 15.448 15.122 1.00 0.00 C ATOM 1939 O ILE B 58 18.187 14.894 16.066 1.00 0.00 O ATOM 1940 CB ILE B 58 15.843 13.648 14.750 1.00 0.00 C ATOM 1941 CG1 ILE B 58 14.966 12.897 13.721 1.00 0.00 C ATOM 1942 CG2 ILE B 58 14.947 14.377 15.771 1.00 0.00 C ATOM 1943 CD1 ILE B 58 14.620 11.475 14.182 1.00 0.00 C ATOM 0 H ILE B 58 18.329 13.162 13.882 1.00 0.00 H new ATOM 0 HA ILE B 58 16.272 15.283 13.447 1.00 0.00 H new ATOM 0 HB ILE B 58 16.445 12.907 15.275 1.00 0.00 H new ATOM 0 HG12 ILE B 58 14.046 13.457 13.553 1.00 0.00 H new ATOM 0 HG13 ILE B 58 15.489 12.850 12.766 1.00 0.00 H new ATOM 0 HG21 ILE B 58 14.253 13.666 16.219 1.00 0.00 H new ATOM 0 HG22 ILE B 58 15.568 14.818 16.551 1.00 0.00 H new ATOM 0 HG23 ILE B 58 14.386 15.164 15.266 1.00 0.00 H new ATOM 0 HD11 ILE B 58 14.003 10.988 13.427 1.00 0.00 H new ATOM 0 HD12 ILE B 58 15.538 10.905 14.324 1.00 0.00 H new ATOM 0 HD13 ILE B 58 14.072 11.521 15.123 1.00 0.00 H new ATOM 1955 N SER B 59 17.669 16.772 14.957 1.00 0.00 N ATOM 1956 CA SER B 59 18.347 17.675 15.904 1.00 0.00 C ATOM 1957 C SER B 59 17.354 18.238 16.922 1.00 0.00 C ATOM 1958 O SER B 59 16.373 18.895 16.551 1.00 0.00 O ATOM 1959 CB SER B 59 19.076 18.817 15.189 1.00 0.00 C ATOM 1960 OG SER B 59 19.959 18.343 14.182 1.00 0.00 O ATOM 0 H SER B 59 17.242 17.253 14.165 1.00 0.00 H new ATOM 0 HA SER B 59 19.096 17.083 16.429 1.00 0.00 H new ATOM 0 HB2 SER B 59 18.344 19.489 14.741 1.00 0.00 H new ATOM 0 HB3 SER B 59 19.639 19.400 15.918 1.00 0.00 H new ATOM 0 HG SER B 59 20.785 18.871 14.196 1.00 0.00 H new ATOM 1966 N LEU B 60 17.603 17.994 18.211 1.00 0.00 N ATOM 1967 CA LEU B 60 16.833 18.575 19.313 1.00 0.00 C ATOM 1968 C LEU B 60 17.397 19.938 19.752 1.00 0.00 C ATOM 1969 O LEU B 60 18.598 20.204 19.630 1.00 0.00 O ATOM 1970 CB LEU B 60 16.760 17.595 20.496 1.00 0.00 C ATOM 1971 CG LEU B 60 16.301 16.165 20.150 1.00 0.00 C ATOM 1972 CD1 LEU B 60 16.121 15.377 21.444 1.00 0.00 C ATOM 1973 CD2 LEU B 60 14.987 16.115 19.370 1.00 0.00 C ATOM 0 H LEU B 60 18.355 17.379 18.522 1.00 0.00 H new ATOM 0 HA LEU B 60 15.820 18.753 18.951 1.00 0.00 H new ATOM 0 HB2 LEU B 60 17.745 17.539 20.959 1.00 0.00 H new ATOM 0 HB3 LEU B 60 16.080 18.005 21.242 1.00 0.00 H new ATOM 0 HG LEU B 60 17.073 15.735 19.511 1.00 0.00 H new ATOM 0 HD11 LEU B 60 15.796 14.363 21.210 1.00 0.00 H new ATOM 0 HD12 LEU B 60 17.068 15.340 21.982 1.00 0.00 H new ATOM 0 HD13 LEU B 60 15.370 15.865 22.065 1.00 0.00 H new ATOM 0 HD21 LEU B 60 14.727 15.077 19.162 1.00 0.00 H new ATOM 0 HD22 LEU B 60 14.195 16.576 19.961 1.00 0.00 H new ATOM 0 HD23 LEU B 60 15.101 16.656 18.431 1.00 0.00 H new ATOM 1985 N ILE B 61 16.526 20.782 20.299 1.00 0.00 N ATOM 1986 CA ILE B 61 16.815 22.129 20.821 1.00 0.00 C ATOM 1987 C ILE B 61 16.190 22.328 22.207 1.00 0.00 C ATOM 1988 O ILE B 61 15.240 21.636 22.583 1.00 0.00 O ATOM 1989 CB ILE B 61 16.392 23.229 19.813 1.00 0.00 C ATOM 1990 CG1 ILE B 61 14.908 23.211 19.378 1.00 0.00 C ATOM 1991 CG2 ILE B 61 17.287 23.160 18.565 1.00 0.00 C ATOM 1992 CD1 ILE B 61 13.938 23.907 20.340 1.00 0.00 C ATOM 0 H ILE B 61 15.541 20.537 20.399 1.00 0.00 H new ATOM 0 HA ILE B 61 17.894 22.222 20.945 1.00 0.00 H new ATOM 0 HB ILE B 61 16.520 24.166 20.355 1.00 0.00 H new ATOM 0 HG12 ILE B 61 14.827 23.685 18.400 1.00 0.00 H new ATOM 0 HG13 ILE B 61 14.594 22.174 19.257 1.00 0.00 H new ATOM 0 HG21 ILE B 61 16.987 23.934 17.859 1.00 0.00 H new ATOM 0 HG22 ILE B 61 18.327 23.315 18.854 1.00 0.00 H new ATOM 0 HG23 ILE B 61 17.183 22.181 18.096 1.00 0.00 H new ATOM 0 HD11 ILE B 61 12.924 23.840 19.946 1.00 0.00 H new ATOM 0 HD12 ILE B 61 13.981 23.422 21.315 1.00 0.00 H new ATOM 0 HD13 ILE B 61 14.218 24.955 20.444 1.00 0.00 H new ATOM 2004 N GLU B 62 16.715 23.275 22.978 1.00 0.00 N ATOM 2005 CA GLU B 62 16.155 23.692 24.273 1.00 0.00 C ATOM 2006 C GLU B 62 14.830 24.453 24.069 1.00 0.00 C ATOM 2007 O GLU B 62 14.768 25.415 23.296 1.00 0.00 O ATOM 2008 CB GLU B 62 17.202 24.529 25.021 1.00 0.00 C ATOM 2009 CG GLU B 62 16.742 24.999 26.402 1.00 0.00 C ATOM 2010 CD GLU B 62 17.791 25.908 27.077 1.00 0.00 C ATOM 2011 OE1 GLU B 62 18.199 26.925 26.466 1.00 0.00 O ATOM 2012 OE2 GLU B 62 18.218 25.605 28.219 1.00 0.00 O1- ATOM 0 H GLU B 62 17.558 23.788 22.721 1.00 0.00 H new ATOM 0 HA GLU B 62 15.920 22.818 24.881 1.00 0.00 H new ATOM 0 HB2 GLU B 62 18.113 23.940 25.132 1.00 0.00 H new ATOM 0 HB3 GLU B 62 17.457 25.400 24.417 1.00 0.00 H new ATOM 0 HG2 GLU B 62 15.800 25.539 26.307 1.00 0.00 H new ATOM 0 HG3 GLU B 62 16.550 24.133 27.035 1.00 0.00 H new ATOM 2019 N GLU B 63 13.757 24.033 24.749 1.00 0.00 N ATOM 2020 CA GLU B 63 12.388 24.510 24.493 1.00 0.00 C ATOM 2021 C GLU B 63 12.102 25.936 25.018 1.00 0.00 C ATOM 2022 O GLU B 63 11.236 26.625 24.468 1.00 0.00 O ATOM 2023 CB GLU B 63 11.386 23.468 25.021 1.00 0.00 C ATOM 2024 CG GLU B 63 11.288 23.344 26.552 1.00 0.00 C ATOM 2025 CD GLU B 63 10.197 24.210 27.210 1.00 0.00 C ATOM 2026 OE1 GLU B 63 10.416 24.683 28.352 1.00 0.00 O ATOM 2027 OE2 GLU B 63 9.104 24.396 26.623 1.00 0.00 O1- ATOM 0 H GLU B 63 13.812 23.346 25.501 1.00 0.00 H new ATOM 0 HA GLU B 63 12.270 24.609 23.414 1.00 0.00 H new ATOM 0 HB2 GLU B 63 10.398 23.713 24.632 1.00 0.00 H new ATOM 0 HB3 GLU B 63 11.656 22.494 24.614 1.00 0.00 H new ATOM 0 HG2 GLU B 63 11.103 22.300 26.805 1.00 0.00 H new ATOM 0 HG3 GLU B 63 12.252 23.611 26.985 1.00 0.00 H new ATOM 2034 N GLN B 64 12.846 26.407 26.026 1.00 0.00 N ATOM 2035 CA GLN B 64 12.851 27.791 26.527 1.00 0.00 C ATOM 2036 C GLN B 64 14.266 28.210 26.960 1.00 0.00 C ATOM 2037 O GLN B 64 14.874 27.571 27.825 1.00 0.00 O ATOM 2038 CB GLN B 64 11.869 27.971 27.701 1.00 0.00 C ATOM 2039 CG GLN B 64 10.386 27.990 27.301 1.00 0.00 C ATOM 2040 CD GLN B 64 10.011 29.209 26.453 1.00 0.00 C ATOM 2041 OE1 GLN B 64 9.748 30.294 26.958 1.00 0.00 O ATOM 2042 NE2 GLN B 64 9.984 29.098 25.138 1.00 0.00 N ATOM 0 H GLN B 64 13.492 25.807 26.540 1.00 0.00 H new ATOM 0 HA GLN B 64 12.526 28.433 25.708 1.00 0.00 H new ATOM 0 HB2 GLN B 64 12.028 27.164 28.417 1.00 0.00 H new ATOM 0 HB3 GLN B 64 12.105 28.903 28.214 1.00 0.00 H new ATOM 0 HG2 GLN B 64 10.154 27.082 26.745 1.00 0.00 H new ATOM 0 HG3 GLN B 64 9.772 27.978 28.202 1.00 0.00 H new ATOM 0 HE21 GLN B 64 10.200 28.204 24.697 1.00 0.00 H new ATOM 0 HE22 GLN B 64 9.747 29.906 24.563 1.00 0.00 H new ATOM 2051 N ASN B 65 14.776 29.295 26.376 1.00 0.00 N ATOM 2052 CA ASN B 65 16.142 29.797 26.585 1.00 0.00 C ATOM 2053 C ASN B 65 16.273 30.860 27.707 1.00 0.00 C ATOM 2054 O ASN B 65 17.374 31.365 27.946 1.00 0.00 O ATOM 2055 CB ASN B 65 16.693 30.292 25.231 1.00 0.00 C ATOM 2056 CG ASN B 65 16.502 29.308 24.084 1.00 0.00 C ATOM 2057 OD1 ASN B 65 15.834 29.593 23.100 1.00 0.00 O ATOM 2058 ND2 ASN B 65 17.032 28.109 24.176 1.00 0.00 N ATOM 0 H ASN B 65 14.238 29.868 25.726 1.00 0.00 H new ATOM 0 HA ASN B 65 16.749 28.970 26.954 1.00 0.00 H new ATOM 0 HB2 ASN B 65 16.205 31.232 24.974 1.00 0.00 H new ATOM 0 HB3 ASN B 65 17.757 30.505 25.340 1.00 0.00 H new ATOM 0 HD21 ASN B 65 16.884 27.428 23.431 1.00 0.00 H new ATOM 0 HD22 ASN B 65 17.591 27.860 24.992 1.00 0.00 H new ATOM 2065 N ARG B 66 15.166 31.217 28.375 1.00 0.00 N ATOM 2066 CA ARG B 66 15.080 32.239 29.440 1.00 0.00 C ATOM 2067 C ARG B 66 15.886 31.914 30.715 1.00 0.00 C ATOM 2068 O ARG B 66 16.006 30.720 31.083 1.00 0.00 O ATOM 2069 CB ARG B 66 13.599 32.552 29.761 1.00 0.00 C ATOM 2070 CG ARG B 66 12.792 31.398 30.383 1.00 0.00 C ATOM 2071 CD ARG B 66 11.316 31.765 30.607 1.00 0.00 C ATOM 2072 NE ARG B 66 10.579 31.949 29.341 1.00 0.00 N ATOM 2073 CZ ARG B 66 10.103 33.069 28.830 1.00 0.00 C ATOM 2074 NH1 ARG B 66 10.241 34.230 29.398 1.00 0.00 N1+ ATOM 2075 NH2 ARG B 66 9.471 33.030 27.698 1.00 0.00 N ATOM 2076 OXT ARG B 66 16.395 32.868 31.343 1.00 0.00 O1- ATOM 0 H ARG B 66 14.263 30.784 28.182 1.00 0.00 H new ATOM 0 HA ARG B 66 15.561 33.132 29.040 1.00 0.00 H new ATOM 0 HB2 ARG B 66 13.566 33.402 30.442 1.00 0.00 H new ATOM 0 HB3 ARG B 66 13.105 32.862 28.840 1.00 0.00 H new ATOM 0 HG2 ARG B 66 12.851 30.526 29.732 1.00 0.00 H new ATOM 0 HG3 ARG B 66 13.242 31.117 31.335 1.00 0.00 H new ATOM 0 HD2 ARG B 66 10.835 30.981 31.193 1.00 0.00 H new ATOM 0 HD3 ARG B 66 11.258 32.682 31.193 1.00 0.00 H new ATOM 0 HE ARG B 66 10.417 31.104 28.792 1.00 0.00 H new ATOM 0 HH11 ARG B 66 10.739 34.308 30.285 1.00 0.00 H new ATOM 0 HH12 ARG B 66 9.852 35.063 28.957 1.00 0.00 H new ATOM 0 HH21 ARG B 66 9.347 32.141 27.214 1.00 0.00 H new ATOM 0 HH22 ARG B 66 9.098 33.888 27.292 1.00 0.00 H new TER 2090 ARG B 66