USER MOD reduce.3.24.130724 H: found=0, std=0, add=649, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 647 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 GLY N :NH3+ -124:sc= 0.0727 (180deg=0) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 7 ASN : amide:sc= 0 X(o=0,f=-0.0002) USER MOD Single : A 12 SER OG : rot 82:sc= 0.458 USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 19 SER OG : rot 160:sc= -0.357 USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 LYS NZ :NH3+ 173:sc= -0.0927 (180deg=-0.187) USER MOD Single : A 30 THR OG1 : rot 180:sc= -0.0412 USER MOD Single : A 31 THR OG1 : rot 180:sc= 0 USER MOD Single : A 33 SER OG : rot -95:sc= -0.431 USER MOD Single : A 40 ASN : amide:sc= -0.07 K(o=-0.07,f=-4.3!) USER MOD Single : A 43 SER OG : rot 180:sc= 0 USER MOD Single : A 47 TYR OH : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= 0 USER MOD Single : A 60 LYS NZ :NH3+ -150:sc= 0 (180deg=-0.0112) USER MOD Single : A 64 ASN : amide:sc= -0.304 K(o=-0.3,f=-1.8!) USER MOD Single : A 67 ASN :FLIP amide:sc= -0.186 F(o=-0.92,f=-0.19) USER MOD Single : A 71 THR OG1 : rot 110:sc= -1.2 USER MOD Single : A 77 ASN : amide:sc= -1.5 X(o=-1.5,f=-1.4!) USER MOD Single : A 80 LYS NZ :NH3+ -118:sc= 1.35 (180deg=-0.474) USER MOD Single : A 81 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 83 LYS NZ :NH3+ -160:sc= -0.0278 (180deg=-0.237) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 5.825 1.808 -8.408 1.00 40.34 N ATOM 2 CA GLY A 1 7.097 2.192 -7.824 1.00 51.24 C ATOM 3 C GLY A 1 7.139 1.967 -6.326 1.00 75.10 C ATOM 4 O GLY A 1 6.190 1.462 -5.726 1.00 74.31 O ATOM 0 H1 GLY A 1 5.986 1.112 -9.164 1.00 40.34 H new ATOM 0 H2 GLY A 1 5.219 1.389 -7.674 1.00 40.34 H new ATOM 0 H3 GLY A 1 5.358 2.648 -8.805 1.00 40.34 H new ATOM 0 HA2 GLY A 1 7.897 1.622 -8.296 1.00 51.24 H new ATOM 0 HA3 GLY A 1 7.288 3.244 -8.036 1.00 51.24 H new ATOM 8 N PRO A 2 8.261 2.346 -5.698 1.00 24.33 N ATOM 9 CA PRO A 2 8.450 2.191 -4.252 1.00 65.24 C ATOM 10 C PRO A 2 7.565 3.136 -3.447 1.00 72.53 C ATOM 11 O PRO A 2 6.894 2.720 -2.503 1.00 70.05 O ATOM 12 CB PRO A 2 9.927 2.538 -4.049 1.00 2.45 C ATOM 13 CG PRO A 2 10.268 3.429 -5.193 1.00 42.00 C ATOM 14 CD PRO A 2 9.433 2.955 -6.350 1.00 33.11 C ATOM 0 HA PRO A 2 8.182 1.191 -3.910 1.00 65.24 H new ATOM 0 HB2 PRO A 2 10.088 3.040 -3.095 1.00 2.45 H new ATOM 0 HB3 PRO A 2 10.547 1.642 -4.047 1.00 2.45 H new ATOM 0 HG2 PRO A 2 10.050 4.470 -4.955 1.00 42.00 H new ATOM 0 HG3 PRO A 2 11.331 3.372 -5.429 1.00 42.00 H new ATOM 0 HD2 PRO A 2 9.146 3.779 -7.003 1.00 33.11 H new ATOM 0 HD3 PRO A 2 9.971 2.233 -6.965 1.00 33.11 H new ATOM 22 N GLY A 3 7.567 4.410 -3.827 1.00 62.24 N ATOM 23 CA GLY A 3 6.760 5.393 -3.130 1.00 54.40 C ATOM 24 C GLY A 3 7.390 5.842 -1.827 1.00 11.24 C ATOM 25 O GLY A 3 6.699 6.323 -0.928 1.00 70.32 O ATOM 0 H GLY A 3 8.113 4.778 -4.605 1.00 62.24 H new ATOM 0 HA2 GLY A 3 6.610 6.259 -3.775 1.00 54.40 H new ATOM 0 HA3 GLY A 3 5.775 4.972 -2.928 1.00 54.40 H new ATOM 29 N SER A 4 8.705 5.684 -1.722 1.00 5.01 N ATOM 30 CA SER A 4 9.428 6.072 -0.516 1.00 64.42 C ATOM 31 C SER A 4 10.382 7.227 -0.803 1.00 3.33 C ATOM 32 O SER A 4 11.441 7.340 -0.185 1.00 53.21 O ATOM 33 CB SER A 4 10.207 4.879 0.042 1.00 1.15 C ATOM 34 OG SER A 4 11.336 4.585 -0.762 1.00 3.42 O ATOM 0 H SER A 4 9.292 5.290 -2.457 1.00 5.01 H new ATOM 0 HA SER A 4 8.700 6.401 0.225 1.00 64.42 H new ATOM 0 HB2 SER A 4 10.529 5.095 1.061 1.00 1.15 H new ATOM 0 HB3 SER A 4 9.555 4.007 0.092 1.00 1.15 H new ATOM 0 HG SER A 4 11.817 3.820 -0.383 1.00 3.42 H new ATOM 40 N MET A 5 9.999 8.083 -1.744 1.00 52.32 N ATOM 41 CA MET A 5 10.819 9.231 -2.112 1.00 50.55 C ATOM 42 C MET A 5 9.946 10.417 -2.512 1.00 3.11 C ATOM 43 O MET A 5 8.720 10.356 -2.422 1.00 21.44 O ATOM 44 CB MET A 5 11.760 8.866 -3.262 1.00 72.50 C ATOM 45 CG MET A 5 12.799 7.822 -2.888 1.00 23.53 C ATOM 46 SD MET A 5 14.019 8.445 -1.716 1.00 2.25 S ATOM 47 CE MET A 5 15.381 8.827 -2.815 1.00 14.41 C ATOM 0 H MET A 5 9.126 8.004 -2.266 1.00 52.32 H new ATOM 0 HA MET A 5 11.412 9.515 -1.243 1.00 50.55 H new ATOM 0 HB2 MET A 5 11.170 8.495 -4.100 1.00 72.50 H new ATOM 0 HB3 MET A 5 12.269 9.767 -3.604 1.00 72.50 H new ATOM 0 HG2 MET A 5 12.298 6.954 -2.458 1.00 23.53 H new ATOM 0 HG3 MET A 5 13.308 7.482 -3.790 1.00 23.53 H new ATOM 0 HE1 MET A 5 16.215 9.224 -2.236 1.00 14.41 H new ATOM 0 HE2 MET A 5 15.697 7.921 -3.332 1.00 14.41 H new ATOM 0 HE3 MET A 5 15.061 9.569 -3.546 1.00 14.41 H new ATOM 57 N ASP A 6 10.586 11.495 -2.953 1.00 70.40 N ATOM 58 CA ASP A 6 9.868 12.694 -3.367 1.00 14.30 C ATOM 59 C ASP A 6 9.520 12.635 -4.851 1.00 61.42 C ATOM 60 O ASP A 6 9.071 13.621 -5.433 1.00 74.44 O ATOM 61 CB ASP A 6 10.704 13.941 -3.076 1.00 40.30 C ATOM 62 CG ASP A 6 10.541 14.428 -1.650 1.00 13.05 C ATOM 63 OD1 ASP A 6 10.400 13.578 -0.746 1.00 12.33 O ATOM 64 OD2 ASP A 6 10.553 15.659 -1.437 1.00 60.11 O ATOM 0 H ASP A 6 11.601 11.562 -3.033 1.00 70.40 H new ATOM 0 HA ASP A 6 8.940 12.746 -2.797 1.00 14.30 H new ATOM 0 HB2 ASP A 6 11.755 13.722 -3.264 1.00 40.30 H new ATOM 0 HB3 ASP A 6 10.416 14.736 -3.764 1.00 40.30 H new ATOM 69 N ASN A 7 9.733 11.471 -5.457 1.00 50.02 N ATOM 70 CA ASN A 7 9.444 11.283 -6.874 1.00 52.23 C ATOM 71 C ASN A 7 8.029 11.746 -7.207 1.00 13.32 C ATOM 72 O ASN A 7 7.821 12.517 -8.144 1.00 11.42 O ATOM 73 CB ASN A 7 9.615 9.813 -7.261 1.00 22.34 C ATOM 74 CG ASN A 7 9.482 9.588 -8.754 1.00 74.14 C ATOM 75 OD1 ASN A 7 10.301 10.064 -9.541 1.00 31.44 O ATOM 76 ND2 ASN A 7 8.445 8.860 -9.153 1.00 32.04 N ATOM 0 H ASN A 7 10.105 10.644 -4.989 1.00 50.02 H new ATOM 0 HA ASN A 7 10.149 11.887 -7.445 1.00 52.23 H new ATOM 0 HB2 ASN A 7 10.593 9.465 -6.930 1.00 22.34 H new ATOM 0 HB3 ASN A 7 8.869 9.214 -6.738 1.00 22.34 H new ATOM 0 HD21 ASN A 7 8.303 8.676 -10.146 1.00 32.04 H new ATOM 0 HD22 ASN A 7 7.791 8.485 -8.466 1.00 32.04 H new ATOM 83 N ASP A 8 7.060 11.271 -6.432 1.00 55.15 N ATOM 84 CA ASP A 8 5.664 11.637 -6.643 1.00 53.40 C ATOM 85 C ASP A 8 5.287 12.851 -5.799 1.00 43.44 C ATOM 86 O ASP A 8 4.108 13.150 -5.617 1.00 34.11 O ATOM 87 CB ASP A 8 4.748 10.460 -6.302 1.00 44.42 C ATOM 88 CG ASP A 8 5.094 9.825 -4.970 1.00 63.31 C ATOM 89 OD1 ASP A 8 6.076 9.055 -4.917 1.00 23.31 O ATOM 90 OD2 ASP A 8 4.384 10.098 -3.980 1.00 73.05 O ATOM 0 H ASP A 8 7.215 10.632 -5.652 1.00 55.15 H new ATOM 0 HA ASP A 8 5.537 11.894 -7.695 1.00 53.40 H new ATOM 0 HB2 ASP A 8 3.714 10.803 -6.280 1.00 44.42 H new ATOM 0 HB3 ASP A 8 4.818 9.709 -7.089 1.00 44.42 H new ATOM 95 N GLU A 9 6.298 13.546 -5.287 1.00 42.32 N ATOM 96 CA GLU A 9 6.072 14.727 -4.461 1.00 60.52 C ATOM 97 C GLU A 9 6.351 16.003 -5.249 1.00 2.41 C ATOM 98 O GLU A 9 5.711 17.032 -5.031 1.00 12.25 O ATOM 99 CB GLU A 9 6.956 14.680 -3.213 1.00 45.35 C ATOM 100 CG GLU A 9 6.484 15.598 -2.098 1.00 71.41 C ATOM 101 CD GLU A 9 5.305 15.027 -1.334 1.00 0.12 C ATOM 102 OE1 GLU A 9 5.514 14.096 -0.529 1.00 33.50 O ATOM 103 OE2 GLU A 9 4.173 15.513 -1.541 1.00 3.33 O ATOM 0 H GLU A 9 7.281 13.312 -5.429 1.00 42.32 H new ATOM 0 HA GLU A 9 5.026 14.731 -4.156 1.00 60.52 H new ATOM 0 HB2 GLU A 9 6.989 13.656 -2.840 1.00 45.35 H new ATOM 0 HB3 GLU A 9 7.975 14.952 -3.489 1.00 45.35 H new ATOM 0 HG2 GLU A 9 7.308 15.778 -1.407 1.00 71.41 H new ATOM 0 HG3 GLU A 9 6.206 16.564 -2.520 1.00 71.41 H new ATOM 110 N ILE A 10 7.311 15.929 -6.164 1.00 62.34 N ATOM 111 CA ILE A 10 7.675 17.077 -6.985 1.00 11.44 C ATOM 112 C ILE A 10 6.517 17.501 -7.882 1.00 12.35 C ATOM 113 O ILE A 10 6.080 18.652 -7.847 1.00 74.31 O ATOM 114 CB ILE A 10 8.905 16.776 -7.861 1.00 51.43 C ATOM 115 CG1 ILE A 10 10.087 16.349 -6.990 1.00 5.14 C ATOM 116 CG2 ILE A 10 9.269 17.993 -8.698 1.00 43.44 C ATOM 117 CD1 ILE A 10 11.194 15.668 -7.764 1.00 32.40 C ATOM 0 H ILE A 10 7.851 15.085 -6.356 1.00 62.34 H new ATOM 0 HA ILE A 10 7.917 17.890 -6.300 1.00 11.44 H new ATOM 0 HB ILE A 10 8.660 15.955 -8.535 1.00 51.43 H new ATOM 0 HG12 ILE A 10 10.493 17.227 -6.487 1.00 5.14 H new ATOM 0 HG13 ILE A 10 9.730 15.674 -6.213 1.00 5.14 H new ATOM 0 HG21 ILE A 10 10.140 17.765 -9.312 1.00 43.44 H new ATOM 0 HG22 ILE A 10 8.430 18.256 -9.342 1.00 43.44 H new ATOM 0 HG23 ILE A 10 9.498 18.832 -8.040 1.00 43.44 H new ATOM 0 HD11 ILE A 10 11.999 15.393 -7.082 1.00 32.40 H new ATOM 0 HD12 ILE A 10 10.803 14.771 -8.245 1.00 32.40 H new ATOM 0 HD13 ILE A 10 11.579 16.349 -8.524 1.00 32.40 H new ATOM 129 N PHE A 11 6.023 16.564 -8.683 1.00 75.41 N ATOM 130 CA PHE A 11 4.914 16.839 -9.589 1.00 53.22 C ATOM 131 C PHE A 11 3.644 17.168 -8.810 1.00 54.32 C ATOM 132 O PHE A 11 2.827 17.979 -9.248 1.00 33.44 O ATOM 133 CB PHE A 11 4.667 15.640 -10.506 1.00 75.43 C ATOM 134 CG PHE A 11 3.661 14.666 -9.961 1.00 64.54 C ATOM 135 CD1 PHE A 11 3.991 13.825 -8.910 1.00 52.30 C ATOM 136 CD2 PHE A 11 2.387 14.590 -10.500 1.00 41.52 C ATOM 137 CE1 PHE A 11 3.068 12.928 -8.407 1.00 71.44 C ATOM 138 CE2 PHE A 11 1.460 13.695 -10.001 1.00 71.04 C ATOM 139 CZ PHE A 11 1.801 12.863 -8.953 1.00 14.21 C ATOM 0 H PHE A 11 6.373 15.607 -8.724 1.00 75.41 H new ATOM 0 HA PHE A 11 5.181 17.703 -10.197 1.00 53.22 H new ATOM 0 HB2 PHE A 11 4.324 15.999 -11.476 1.00 75.43 H new ATOM 0 HB3 PHE A 11 5.610 15.120 -10.673 1.00 75.43 H new ATOM 0 HD1 PHE A 11 4.980 13.871 -8.479 1.00 52.30 H new ATOM 0 HD2 PHE A 11 2.115 15.238 -11.320 1.00 41.52 H new ATOM 0 HE1 PHE A 11 3.337 12.278 -7.587 1.00 71.44 H new ATOM 0 HE2 PHE A 11 0.470 13.646 -10.430 1.00 71.04 H new ATOM 0 HZ PHE A 11 1.078 12.163 -8.561 1.00 14.21 H new ATOM 149 N SER A 12 3.485 16.533 -7.653 1.00 53.15 N ATOM 150 CA SER A 12 2.313 16.754 -6.815 1.00 14.33 C ATOM 151 C SER A 12 2.335 18.154 -6.208 1.00 52.13 C ATOM 152 O SER A 12 1.337 18.875 -6.243 1.00 62.20 O ATOM 153 CB SER A 12 2.250 15.705 -5.703 1.00 13.43 C ATOM 154 OG SER A 12 1.215 16.001 -4.781 1.00 33.21 O ATOM 0 H SER A 12 4.153 15.861 -7.275 1.00 53.15 H new ATOM 0 HA SER A 12 1.426 16.663 -7.442 1.00 14.33 H new ATOM 0 HB2 SER A 12 2.083 14.719 -6.138 1.00 13.43 H new ATOM 0 HB3 SER A 12 3.206 15.666 -5.181 1.00 13.43 H new ATOM 0 HG SER A 12 0.359 15.685 -5.138 1.00 33.21 H new ATOM 160 N LYS A 13 3.481 18.533 -5.652 1.00 75.12 N ATOM 161 CA LYS A 13 3.636 19.846 -5.038 1.00 42.34 C ATOM 162 C LYS A 13 3.443 20.955 -6.068 1.00 70.43 C ATOM 163 O LYS A 13 2.865 22.000 -5.769 1.00 61.34 O ATOM 164 CB LYS A 13 5.019 19.970 -4.394 1.00 34.03 C ATOM 165 CG LYS A 13 5.301 21.348 -3.820 1.00 30.43 C ATOM 166 CD LYS A 13 6.567 21.353 -2.979 1.00 71.23 C ATOM 167 CE LYS A 13 6.411 20.497 -1.731 1.00 41.44 C ATOM 168 NZ LYS A 13 7.321 20.939 -0.639 1.00 5.11 N ATOM 0 H LYS A 13 4.316 17.949 -5.614 1.00 75.12 H new ATOM 0 HA LYS A 13 2.872 19.952 -4.268 1.00 42.34 H new ATOM 0 HB2 LYS A 13 5.108 19.229 -3.599 1.00 34.03 H new ATOM 0 HB3 LYS A 13 5.780 19.733 -5.138 1.00 34.03 H new ATOM 0 HG2 LYS A 13 5.400 22.068 -4.632 1.00 30.43 H new ATOM 0 HG3 LYS A 13 4.457 21.669 -3.210 1.00 30.43 H new ATOM 0 HD2 LYS A 13 7.402 20.982 -3.574 1.00 71.23 H new ATOM 0 HD3 LYS A 13 6.810 22.376 -2.692 1.00 71.23 H new ATOM 0 HE2 LYS A 13 5.378 20.544 -1.385 1.00 41.44 H new ATOM 0 HE3 LYS A 13 6.618 19.455 -1.977 1.00 41.44 H new ATOM 0 HZ1 LYS A 13 7.185 20.331 0.194 1.00 5.11 H new ATOM 0 HZ2 LYS A 13 8.308 20.870 -0.960 1.00 5.11 H new ATOM 0 HZ3 LYS A 13 7.107 21.925 -0.387 1.00 5.11 H new ATOM 182 N VAL A 14 3.929 20.719 -7.283 1.00 20.01 N ATOM 183 CA VAL A 14 3.807 21.696 -8.358 1.00 3.40 C ATOM 184 C VAL A 14 2.369 21.792 -8.853 1.00 53.23 C ATOM 185 O VAL A 14 1.851 22.886 -9.079 1.00 73.01 O ATOM 186 CB VAL A 14 4.725 21.343 -9.544 1.00 14.51 C ATOM 187 CG1 VAL A 14 4.536 22.338 -10.679 1.00 44.22 C ATOM 188 CG2 VAL A 14 6.178 21.300 -9.098 1.00 23.31 C ATOM 0 H VAL A 14 4.411 19.860 -7.547 1.00 20.01 H new ATOM 0 HA VAL A 14 4.111 22.659 -7.947 1.00 3.40 H new ATOM 0 HB VAL A 14 4.452 20.353 -9.911 1.00 14.51 H new ATOM 0 HG11 VAL A 14 5.192 22.073 -11.508 1.00 44.22 H new ATOM 0 HG12 VAL A 14 3.499 22.314 -11.015 1.00 44.22 H new ATOM 0 HG13 VAL A 14 4.781 23.341 -10.328 1.00 44.22 H new ATOM 0 HG21 VAL A 14 6.812 21.049 -9.948 1.00 23.31 H new ATOM 0 HG22 VAL A 14 6.467 22.275 -8.705 1.00 23.31 H new ATOM 0 HG23 VAL A 14 6.298 20.545 -8.321 1.00 23.31 H new ATOM 198 N ARG A 15 1.728 20.640 -9.020 1.00 20.22 N ATOM 199 CA ARG A 15 0.349 20.593 -9.489 1.00 54.43 C ATOM 200 C ARG A 15 -0.602 21.165 -8.441 1.00 42.34 C ATOM 201 O ARG A 15 -1.657 21.704 -8.774 1.00 53.13 O ATOM 202 CB ARG A 15 -0.050 19.155 -9.824 1.00 55.14 C ATOM 203 CG ARG A 15 -0.976 19.044 -11.025 1.00 34.24 C ATOM 204 CD ARG A 15 -0.352 18.214 -12.135 1.00 62.30 C ATOM 205 NE ARG A 15 1.000 18.662 -12.459 1.00 70.40 N ATOM 206 CZ ARG A 15 1.578 18.462 -13.638 1.00 75.54 C ATOM 207 NH1 ARG A 15 0.924 17.825 -14.601 1.00 24.13 N ATOM 208 NH2 ARG A 15 2.811 18.899 -13.857 1.00 51.23 N ATOM 0 H ARG A 15 2.142 19.726 -8.837 1.00 20.22 H new ATOM 0 HA ARG A 15 0.278 21.202 -10.390 1.00 54.43 H new ATOM 0 HB2 ARG A 15 0.851 18.572 -10.015 1.00 55.14 H new ATOM 0 HB3 ARG A 15 -0.539 18.711 -8.957 1.00 55.14 H new ATOM 0 HG2 ARG A 15 -1.919 18.592 -10.718 1.00 34.24 H new ATOM 0 HG3 ARG A 15 -1.207 20.041 -11.401 1.00 34.24 H new ATOM 0 HD2 ARG A 15 -0.324 17.167 -11.833 1.00 62.30 H new ATOM 0 HD3 ARG A 15 -0.977 18.272 -13.026 1.00 62.30 H new ATOM 0 HE ARG A 15 1.529 19.156 -11.740 1.00 70.40 H new ATOM 0 HH11 ARG A 15 -0.025 17.488 -14.437 1.00 24.13 H new ATOM 0 HH12 ARG A 15 1.370 17.673 -15.506 1.00 24.13 H new ATOM 0 HH21 ARG A 15 3.317 19.389 -13.119 1.00 51.23 H new ATOM 0 HH22 ARG A 15 3.253 18.745 -14.763 1.00 51.23 H new ATOM 222 N SER A 16 -0.220 21.043 -7.174 1.00 42.41 N ATOM 223 CA SER A 16 -1.040 21.544 -6.077 1.00 43.00 C ATOM 224 C SER A 16 -1.284 23.043 -6.222 1.00 34.01 C ATOM 225 O SER A 16 -2.267 23.575 -5.705 1.00 53.13 O ATOM 226 CB SER A 16 -0.366 21.253 -4.735 1.00 3.23 C ATOM 227 OG SER A 16 -1.113 21.797 -3.661 1.00 3.35 O ATOM 0 H SER A 16 0.652 20.602 -6.882 1.00 42.41 H new ATOM 0 HA SER A 16 -2.002 21.032 -6.111 1.00 43.00 H new ATOM 0 HB2 SER A 16 -0.263 20.176 -4.602 1.00 3.23 H new ATOM 0 HB3 SER A 16 0.640 21.672 -4.731 1.00 3.23 H new ATOM 0 HG SER A 16 -0.662 21.596 -2.814 1.00 3.35 H new ATOM 233 N ILE A 17 -0.383 23.718 -6.928 1.00 33.41 N ATOM 234 CA ILE A 17 -0.501 25.155 -7.142 1.00 71.50 C ATOM 235 C ILE A 17 -1.536 25.467 -8.218 1.00 3.02 C ATOM 236 O ILE A 17 -2.474 26.230 -7.988 1.00 12.25 O ATOM 237 CB ILE A 17 0.848 25.776 -7.548 1.00 25.23 C ATOM 238 CG1 ILE A 17 1.895 25.533 -6.458 1.00 14.02 C ATOM 239 CG2 ILE A 17 0.688 27.265 -7.813 1.00 14.23 C ATOM 240 CD1 ILE A 17 3.318 25.555 -6.970 1.00 54.53 C ATOM 0 H ILE A 17 0.437 23.293 -7.361 1.00 33.41 H new ATOM 0 HA ILE A 17 -0.822 25.590 -6.195 1.00 71.50 H new ATOM 0 HB ILE A 17 1.189 25.298 -8.466 1.00 25.23 H new ATOM 0 HG12 ILE A 17 1.784 26.292 -5.684 1.00 14.02 H new ATOM 0 HG13 ILE A 17 1.701 24.569 -5.988 1.00 14.02 H new ATOM 0 HG21 ILE A 17 1.651 27.689 -8.099 1.00 14.23 H new ATOM 0 HG22 ILE A 17 -0.029 27.416 -8.620 1.00 14.23 H new ATOM 0 HG23 ILE A 17 0.328 27.759 -6.910 1.00 14.23 H new ATOM 0 HD11 ILE A 17 4.005 25.376 -6.143 1.00 54.53 H new ATOM 0 HD12 ILE A 17 3.446 24.777 -7.723 1.00 54.53 H new ATOM 0 HD13 ILE A 17 3.530 26.528 -7.414 1.00 54.53 H new ATOM 252 N ILE A 18 -1.359 24.871 -9.392 1.00 64.11 N ATOM 253 CA ILE A 18 -2.279 25.083 -10.503 1.00 4.45 C ATOM 254 C ILE A 18 -3.633 24.441 -10.225 1.00 14.35 C ATOM 255 O ILE A 18 -4.664 24.909 -10.708 1.00 34.11 O ATOM 256 CB ILE A 18 -1.714 24.515 -11.818 1.00 0.21 C ATOM 257 CG1 ILE A 18 -1.697 22.986 -11.773 1.00 34.12 C ATOM 258 CG2 ILE A 18 -0.316 25.058 -12.073 1.00 2.35 C ATOM 259 CD1 ILE A 18 -1.122 22.351 -13.019 1.00 70.22 C ATOM 0 H ILE A 18 -0.587 24.237 -9.599 1.00 64.11 H new ATOM 0 HA ILE A 18 -2.405 26.161 -10.607 1.00 4.45 H new ATOM 0 HB ILE A 18 -2.359 24.829 -12.638 1.00 0.21 H new ATOM 0 HG12 ILE A 18 -1.116 22.663 -10.909 1.00 34.12 H new ATOM 0 HG13 ILE A 18 -2.715 22.624 -11.627 1.00 34.12 H new ATOM 0 HG21 ILE A 18 0.069 24.647 -13.006 1.00 2.35 H new ATOM 0 HG22 ILE A 18 -0.355 26.145 -12.144 1.00 2.35 H new ATOM 0 HG23 ILE A 18 0.341 24.772 -11.252 1.00 2.35 H new ATOM 0 HD11 ILE A 18 -1.142 21.266 -12.917 1.00 70.22 H new ATOM 0 HD12 ILE A 18 -1.716 22.645 -13.884 1.00 70.22 H new ATOM 0 HD13 ILE A 18 -0.093 22.684 -13.155 1.00 70.22 H new ATOM 271 N SER A 19 -3.624 23.368 -9.441 1.00 23.22 N ATOM 272 CA SER A 19 -4.852 22.660 -9.099 1.00 62.53 C ATOM 273 C SER A 19 -5.904 23.625 -8.561 1.00 23.42 C ATOM 274 O SER A 19 -7.103 23.402 -8.718 1.00 75.23 O ATOM 275 CB SER A 19 -4.566 21.570 -8.064 1.00 70.55 C ATOM 276 OG SER A 19 -4.146 22.132 -6.834 1.00 13.45 O ATOM 0 H SER A 19 -2.780 22.970 -9.030 1.00 23.22 H new ATOM 0 HA SER A 19 -5.240 22.197 -10.006 1.00 62.53 H new ATOM 0 HB2 SER A 19 -5.462 20.970 -7.906 1.00 70.55 H new ATOM 0 HB3 SER A 19 -3.795 20.898 -8.442 1.00 70.55 H new ATOM 0 HG SER A 19 -4.276 21.479 -6.115 1.00 13.45 H new ATOM 282 N GLU A 20 -5.443 24.697 -7.925 1.00 12.33 N ATOM 283 CA GLU A 20 -6.344 25.696 -7.362 1.00 12.20 C ATOM 284 C GLU A 20 -7.086 26.443 -8.466 1.00 53.34 C ATOM 285 O GLU A 20 -8.256 26.794 -8.314 1.00 1.10 O ATOM 286 CB GLU A 20 -5.565 26.687 -6.495 1.00 50.52 C ATOM 287 CG GLU A 20 -6.447 27.518 -5.578 1.00 42.32 C ATOM 288 CD GLU A 20 -6.877 26.760 -4.338 1.00 21.43 C ATOM 289 OE1 GLU A 20 -6.078 25.941 -3.837 1.00 24.11 O ATOM 290 OE2 GLU A 20 -8.012 26.984 -3.868 1.00 61.10 O ATOM 0 H GLU A 20 -4.452 24.896 -7.787 1.00 12.33 H new ATOM 0 HA GLU A 20 -7.076 25.179 -6.742 1.00 12.20 H new ATOM 0 HB2 GLU A 20 -4.842 26.138 -5.891 1.00 50.52 H new ATOM 0 HB3 GLU A 20 -4.997 27.355 -7.143 1.00 50.52 H new ATOM 0 HG2 GLU A 20 -5.909 28.418 -5.281 1.00 42.32 H new ATOM 0 HG3 GLU A 20 -7.332 27.842 -6.126 1.00 42.32 H new ATOM 297 N GLN A 21 -6.397 26.683 -9.577 1.00 63.11 N ATOM 298 CA GLN A 21 -6.990 27.389 -10.706 1.00 43.44 C ATOM 299 C GLN A 21 -7.744 26.425 -11.616 1.00 52.41 C ATOM 300 O GLN A 21 -8.931 26.611 -11.887 1.00 13.31 O ATOM 301 CB GLN A 21 -5.907 28.120 -11.503 1.00 75.13 C ATOM 302 CG GLN A 21 -6.430 29.314 -12.286 1.00 61.54 C ATOM 303 CD GLN A 21 -6.645 30.535 -11.414 1.00 71.33 C ATOM 304 OE1 GLN A 21 -5.701 31.071 -10.833 1.00 71.02 O ATOM 305 NE2 GLN A 21 -7.892 30.982 -11.318 1.00 62.23 N ATOM 0 H GLN A 21 -5.428 26.399 -9.719 1.00 63.11 H new ATOM 0 HA GLN A 21 -7.698 28.119 -10.314 1.00 43.44 H new ATOM 0 HB2 GLN A 21 -5.129 28.458 -10.818 1.00 75.13 H new ATOM 0 HB3 GLN A 21 -5.441 27.418 -12.195 1.00 75.13 H new ATOM 0 HG2 GLN A 21 -5.725 29.559 -13.081 1.00 61.54 H new ATOM 0 HG3 GLN A 21 -7.371 29.045 -12.766 1.00 61.54 H new ATOM 0 HE21 GLN A 21 -8.644 30.507 -11.817 1.00 62.23 H new ATOM 0 HE22 GLN A 21 -8.098 31.801 -10.745 1.00 62.23 H new ATOM 314 N LEU A 22 -7.048 25.396 -12.085 1.00 74.33 N ATOM 315 CA LEU A 22 -7.653 24.402 -12.966 1.00 24.44 C ATOM 316 C LEU A 22 -8.750 23.629 -12.242 1.00 35.23 C ATOM 317 O LEU A 22 -9.729 23.201 -12.854 1.00 12.01 O ATOM 318 CB LEU A 22 -6.587 23.433 -13.481 1.00 43.24 C ATOM 319 CG LEU A 22 -5.612 23.997 -14.516 1.00 74.35 C ATOM 320 CD1 LEU A 22 -6.367 24.712 -15.626 1.00 72.12 C ATOM 321 CD2 LEU A 22 -4.616 24.937 -13.854 1.00 51.35 C ATOM 0 H LEU A 22 -6.065 25.227 -11.871 1.00 74.33 H new ATOM 0 HA LEU A 22 -8.100 24.925 -13.811 1.00 24.44 H new ATOM 0 HB2 LEU A 22 -6.012 23.070 -12.629 1.00 43.24 H new ATOM 0 HB3 LEU A 22 -7.089 22.570 -13.917 1.00 43.24 H new ATOM 0 HG LEU A 22 -5.059 23.167 -14.957 1.00 74.35 H new ATOM 0 HD11 LEU A 22 -5.657 25.107 -16.353 1.00 72.12 H new ATOM 0 HD12 LEU A 22 -7.039 24.010 -16.119 1.00 72.12 H new ATOM 0 HD13 LEU A 22 -6.946 25.532 -15.202 1.00 72.12 H new ATOM 0 HD21 LEU A 22 -3.930 25.329 -14.605 1.00 51.35 H new ATOM 0 HD22 LEU A 22 -5.151 25.763 -13.386 1.00 51.35 H new ATOM 0 HD23 LEU A 22 -4.052 24.394 -13.096 1.00 51.35 H new ATOM 333 N ASP A 23 -8.582 23.456 -10.936 1.00 21.45 N ATOM 334 CA ASP A 23 -9.560 22.737 -10.127 1.00 11.21 C ATOM 335 C ASP A 23 -9.639 21.272 -10.544 1.00 70.00 C ATOM 336 O ASP A 23 -10.671 20.622 -10.375 1.00 63.31 O ATOM 337 CB ASP A 23 -10.937 23.391 -10.253 1.00 41.34 C ATOM 338 CG ASP A 23 -11.893 22.942 -9.166 1.00 52.31 C ATOM 339 OD1 ASP A 23 -11.731 23.389 -8.011 1.00 24.30 O ATOM 340 OD2 ASP A 23 -12.805 22.145 -9.470 1.00 41.24 O ATOM 0 H ASP A 23 -7.778 23.804 -10.414 1.00 21.45 H new ATOM 0 HA ASP A 23 -9.238 22.783 -9.087 1.00 11.21 H new ATOM 0 HB2 ASP A 23 -10.827 24.475 -10.211 1.00 41.34 H new ATOM 0 HB3 ASP A 23 -11.362 23.152 -11.228 1.00 41.34 H new ATOM 345 N LYS A 24 -8.543 20.758 -11.091 1.00 24.12 N ATOM 346 CA LYS A 24 -8.486 19.370 -11.533 1.00 30.44 C ATOM 347 C LYS A 24 -7.511 18.566 -10.678 1.00 42.02 C ATOM 348 O LYS A 24 -6.967 19.072 -9.696 1.00 63.13 O ATOM 349 CB LYS A 24 -8.071 19.297 -13.004 1.00 2.52 C ATOM 350 CG LYS A 24 -8.886 20.203 -13.911 1.00 4.22 C ATOM 351 CD LYS A 24 -8.738 19.809 -15.371 1.00 3.21 C ATOM 352 CE LYS A 24 -9.761 18.758 -15.771 1.00 32.42 C ATOM 353 NZ LYS A 24 -11.103 19.355 -16.017 1.00 62.14 N ATOM 0 H LYS A 24 -7.681 21.283 -11.239 1.00 24.12 H new ATOM 0 HA LYS A 24 -9.481 18.939 -11.421 1.00 30.44 H new ATOM 0 HB2 LYS A 24 -7.018 19.564 -13.089 1.00 2.52 H new ATOM 0 HB3 LYS A 24 -8.168 18.268 -13.350 1.00 2.52 H new ATOM 0 HG2 LYS A 24 -9.937 20.156 -13.625 1.00 4.22 H new ATOM 0 HG3 LYS A 24 -8.566 21.236 -13.778 1.00 4.22 H new ATOM 0 HD2 LYS A 24 -8.856 20.691 -16.001 1.00 3.21 H new ATOM 0 HD3 LYS A 24 -7.733 19.425 -15.545 1.00 3.21 H new ATOM 0 HE2 LYS A 24 -9.421 18.245 -16.671 1.00 32.42 H new ATOM 0 HE3 LYS A 24 -9.836 18.007 -14.985 1.00 32.42 H new ATOM 0 HZ1 LYS A 24 -11.772 18.606 -16.287 1.00 62.14 H new ATOM 0 HZ2 LYS A 24 -11.439 19.823 -15.151 1.00 62.14 H new ATOM 0 HZ3 LYS A 24 -11.037 20.053 -16.785 1.00 62.14 H new ATOM 367 N LYS A 25 -7.293 17.312 -11.059 1.00 24.23 N ATOM 368 CA LYS A 25 -6.381 16.438 -10.330 1.00 3.23 C ATOM 369 C LYS A 25 -5.059 16.287 -11.076 1.00 72.33 C ATOM 370 O LYS A 25 -5.028 16.285 -12.306 1.00 52.14 O ATOM 371 CB LYS A 25 -7.019 15.064 -10.117 1.00 71.21 C ATOM 372 CG LYS A 25 -7.314 14.324 -11.410 1.00 72.42 C ATOM 373 CD LYS A 25 -8.712 14.629 -11.921 1.00 35.32 C ATOM 374 CE LYS A 25 -9.696 13.532 -11.542 1.00 0.24 C ATOM 375 NZ LYS A 25 -9.659 13.234 -10.083 1.00 62.21 N ATOM 0 H LYS A 25 -7.736 16.878 -11.869 1.00 24.23 H new ATOM 0 HA LYS A 25 -6.180 16.892 -9.360 1.00 3.23 H new ATOM 0 HB2 LYS A 25 -6.355 14.455 -9.503 1.00 71.21 H new ATOM 0 HB3 LYS A 25 -7.947 15.186 -9.558 1.00 71.21 H new ATOM 0 HG2 LYS A 25 -6.580 14.604 -12.166 1.00 72.42 H new ATOM 0 HG3 LYS A 25 -7.211 13.251 -11.248 1.00 72.42 H new ATOM 0 HD2 LYS A 25 -9.051 15.581 -11.511 1.00 35.32 H new ATOM 0 HD3 LYS A 25 -8.688 14.739 -13.005 1.00 35.32 H new ATOM 0 HE2 LYS A 25 -10.704 13.834 -11.826 1.00 0.24 H new ATOM 0 HE3 LYS A 25 -9.465 12.627 -12.104 1.00 0.24 H new ATOM 0 HZ1 LYS A 25 -10.422 12.569 -9.845 1.00 62.21 H new ATOM 0 HZ2 LYS A 25 -8.742 12.810 -9.839 1.00 62.21 H new ATOM 0 HZ3 LYS A 25 -9.787 14.115 -9.545 1.00 62.21 H new ATOM 389 N GLU A 26 -3.971 16.158 -10.324 1.00 1.22 N ATOM 390 CA GLU A 26 -2.647 16.005 -10.916 1.00 52.31 C ATOM 391 C GLU A 26 -2.536 14.680 -11.665 1.00 50.30 C ATOM 392 O GLU A 26 -1.613 14.476 -12.454 1.00 1.43 O ATOM 393 CB GLU A 26 -1.568 16.084 -9.834 1.00 42.44 C ATOM 394 CG GLU A 26 -1.762 15.085 -8.707 1.00 30.14 C ATOM 395 CD GLU A 26 -1.251 15.601 -7.375 1.00 61.14 C ATOM 396 OE1 GLU A 26 -1.346 16.823 -7.138 1.00 0.33 O ATOM 397 OE2 GLU A 26 -0.756 14.783 -6.572 1.00 41.20 O ATOM 0 H GLU A 26 -3.980 16.156 -9.304 1.00 1.22 H new ATOM 0 HA GLU A 26 -2.499 16.818 -11.627 1.00 52.31 H new ATOM 0 HB2 GLU A 26 -0.593 15.917 -10.292 1.00 42.44 H new ATOM 0 HB3 GLU A 26 -1.556 17.091 -9.417 1.00 42.44 H new ATOM 0 HG2 GLU A 26 -2.822 14.846 -8.617 1.00 30.14 H new ATOM 0 HG3 GLU A 26 -1.246 14.158 -8.955 1.00 30.14 H new ATOM 404 N ASP A 27 -3.483 13.783 -11.412 1.00 4.42 N ATOM 405 CA ASP A 27 -3.492 12.478 -12.062 1.00 34.14 C ATOM 406 C ASP A 27 -4.072 12.576 -13.469 1.00 61.13 C ATOM 407 O ASP A 27 -4.354 11.562 -14.106 1.00 64.53 O ATOM 408 CB ASP A 27 -4.300 11.478 -11.233 1.00 21.13 C ATOM 409 CG ASP A 27 -3.498 10.896 -10.085 1.00 70.02 C ATOM 410 OD1 ASP A 27 -2.517 10.172 -10.355 1.00 1.24 O ATOM 411 OD2 ASP A 27 -3.852 11.164 -8.918 1.00 31.33 O ATOM 0 H ASP A 27 -4.254 13.936 -10.762 1.00 4.42 H new ATOM 0 HA ASP A 27 -2.462 12.129 -12.136 1.00 34.14 H new ATOM 0 HB2 ASP A 27 -5.188 11.971 -10.838 1.00 21.13 H new ATOM 0 HB3 ASP A 27 -4.644 10.670 -11.878 1.00 21.13 H new ATOM 416 N GLU A 28 -4.248 13.804 -13.947 1.00 61.13 N ATOM 417 CA GLU A 28 -4.796 14.033 -15.279 1.00 0.31 C ATOM 418 C GLU A 28 -3.714 13.887 -16.345 1.00 40.31 C ATOM 419 O GLU A 28 -3.958 14.125 -17.528 1.00 70.15 O ATOM 420 CB GLU A 28 -5.425 15.425 -15.363 1.00 15.43 C ATOM 421 CG GLU A 28 -6.887 15.458 -14.948 1.00 1.51 C ATOM 422 CD GLU A 28 -7.819 15.020 -16.060 1.00 72.25 C ATOM 423 OE1 GLU A 28 -8.074 15.830 -16.976 1.00 30.12 O ATOM 424 OE2 GLU A 28 -8.294 13.865 -16.015 1.00 43.44 O ATOM 0 H GLU A 28 -4.019 14.655 -13.432 1.00 61.13 H new ATOM 0 HA GLU A 28 -5.565 13.283 -15.461 1.00 0.31 H new ATOM 0 HB2 GLU A 28 -4.860 16.109 -14.729 1.00 15.43 H new ATOM 0 HB3 GLU A 28 -5.338 15.793 -16.385 1.00 15.43 H new ATOM 0 HG2 GLU A 28 -7.030 14.810 -14.083 1.00 1.51 H new ATOM 0 HG3 GLU A 28 -7.150 16.469 -14.636 1.00 1.51 H new ATOM 431 N ILE A 29 -2.519 13.496 -15.917 1.00 23.12 N ATOM 432 CA ILE A 29 -1.400 13.318 -16.834 1.00 22.12 C ATOM 433 C ILE A 29 -1.809 12.488 -18.046 1.00 20.43 C ATOM 434 O ILE A 29 -2.128 11.304 -17.923 1.00 53.52 O ATOM 435 CB ILE A 29 -0.205 12.638 -16.139 1.00 73.32 C ATOM 436 CG1 ILE A 29 0.280 13.488 -14.963 1.00 65.43 C ATOM 437 CG2 ILE A 29 0.923 12.405 -17.133 1.00 72.40 C ATOM 438 CD1 ILE A 29 0.841 14.830 -15.379 1.00 20.22 C ATOM 0 H ILE A 29 -2.300 13.296 -14.941 1.00 23.12 H new ATOM 0 HA ILE A 29 -1.100 14.313 -17.163 1.00 22.12 H new ATOM 0 HB ILE A 29 -0.529 11.671 -15.754 1.00 73.32 H new ATOM 0 HG12 ILE A 29 -0.549 13.648 -14.274 1.00 65.43 H new ATOM 0 HG13 ILE A 29 1.046 12.936 -14.418 1.00 65.43 H new ATOM 0 HG21 ILE A 29 1.760 11.924 -16.627 1.00 72.40 H new ATOM 0 HG22 ILE A 29 0.570 11.764 -17.940 1.00 72.40 H new ATOM 0 HG23 ILE A 29 1.248 13.360 -17.545 1.00 72.40 H new ATOM 0 HD11 ILE A 29 1.165 15.379 -14.495 1.00 20.22 H new ATOM 0 HD12 ILE A 29 1.691 14.679 -16.044 1.00 20.22 H new ATOM 0 HD13 ILE A 29 0.071 15.401 -15.898 1.00 20.22 H new ATOM 450 N THR A 30 -1.796 13.115 -19.218 1.00 23.22 N ATOM 451 CA THR A 30 -2.164 12.435 -20.453 1.00 35.51 C ATOM 452 C THR A 30 -1.750 13.248 -21.674 1.00 14.35 C ATOM 453 O THR A 30 -1.535 14.457 -21.583 1.00 42.53 O ATOM 454 CB THR A 30 -3.680 12.169 -20.517 1.00 15.20 C ATOM 455 OG1 THR A 30 -4.026 11.606 -21.787 1.00 40.35 O ATOM 456 CG2 THR A 30 -4.464 13.454 -20.296 1.00 35.03 C ATOM 0 H THR A 30 -1.534 14.094 -19.338 1.00 23.22 H new ATOM 0 HA THR A 30 -1.634 11.482 -20.459 1.00 35.51 H new ATOM 0 HB THR A 30 -3.937 11.464 -19.726 1.00 15.20 H new ATOM 0 HG1 THR A 30 -4.991 11.438 -21.819 1.00 40.35 H new ATOM 0 HG21 THR A 30 -5.532 13.242 -20.346 1.00 35.03 H new ATOM 0 HG22 THR A 30 -4.221 13.865 -19.316 1.00 35.03 H new ATOM 0 HG23 THR A 30 -4.202 14.178 -21.068 1.00 35.03 H new ATOM 464 N THR A 31 -1.641 12.578 -22.817 1.00 12.24 N ATOM 465 CA THR A 31 -1.252 13.239 -24.056 1.00 15.31 C ATOM 466 C THR A 31 -2.434 13.971 -24.683 1.00 61.40 C ATOM 467 O THR A 31 -2.271 14.723 -25.643 1.00 53.45 O ATOM 468 CB THR A 31 -0.686 12.233 -25.076 1.00 12.24 C ATOM 469 OG1 THR A 31 -1.683 11.261 -25.410 1.00 40.11 O ATOM 470 CG2 THR A 31 0.545 11.534 -24.519 1.00 71.13 C ATOM 0 H THR A 31 -1.817 11.578 -22.910 1.00 12.24 H new ATOM 0 HA THR A 31 -0.476 13.960 -23.799 1.00 15.31 H new ATOM 0 HB THR A 31 -0.399 12.781 -25.974 1.00 12.24 H new ATOM 0 HG1 THR A 31 -1.316 10.626 -26.060 1.00 40.11 H new ATOM 0 HG21 THR A 31 0.928 10.828 -25.256 1.00 71.13 H new ATOM 0 HG22 THR A 31 1.313 12.274 -24.293 1.00 71.13 H new ATOM 0 HG23 THR A 31 0.278 10.998 -23.608 1.00 71.13 H new ATOM 478 N ASP A 32 -3.622 13.745 -24.134 1.00 32.12 N ATOM 479 CA ASP A 32 -4.832 14.384 -24.639 1.00 3.32 C ATOM 480 C ASP A 32 -5.231 15.564 -23.758 1.00 32.12 C ATOM 481 O ASP A 32 -6.388 15.984 -23.753 1.00 51.10 O ATOM 482 CB ASP A 32 -5.977 13.373 -24.709 1.00 53.42 C ATOM 483 CG ASP A 32 -6.917 13.643 -25.868 1.00 11.12 C ATOM 484 OD1 ASP A 32 -6.444 14.136 -26.913 1.00 52.25 O ATOM 485 OD2 ASP A 32 -8.125 13.360 -25.729 1.00 54.43 O ATOM 0 H ASP A 32 -3.773 13.124 -23.339 1.00 32.12 H new ATOM 0 HA ASP A 32 -4.625 14.756 -25.642 1.00 3.32 H new ATOM 0 HB2 ASP A 32 -5.565 12.368 -24.805 1.00 53.42 H new ATOM 0 HB3 ASP A 32 -6.539 13.399 -23.775 1.00 53.42 H new ATOM 490 N SER A 33 -4.266 16.093 -23.013 1.00 20.15 N ATOM 491 CA SER A 33 -4.518 17.221 -22.124 1.00 20.15 C ATOM 492 C SER A 33 -3.709 18.441 -22.552 1.00 3.44 C ATOM 493 O SER A 33 -4.257 19.527 -22.744 1.00 63.10 O ATOM 494 CB SER A 33 -4.174 16.847 -20.680 1.00 43.15 C ATOM 495 OG SER A 33 -5.273 16.225 -20.039 1.00 33.03 O ATOM 0 H SER A 33 -3.302 15.759 -23.007 1.00 20.15 H new ATOM 0 HA SER A 33 -5.577 17.470 -22.185 1.00 20.15 H new ATOM 0 HB2 SER A 33 -3.315 16.176 -20.670 1.00 43.15 H new ATOM 0 HB3 SER A 33 -3.886 17.742 -20.128 1.00 43.15 H new ATOM 0 HG SER A 33 -5.783 16.896 -19.540 1.00 33.03 H new ATOM 501 N ARG A 34 -2.401 18.255 -22.699 1.00 31.55 N ATOM 502 CA ARG A 34 -1.515 19.339 -23.102 1.00 41.45 C ATOM 503 C ARG A 34 -1.568 20.487 -22.098 1.00 43.01 C ATOM 504 O ARG A 34 -2.359 20.465 -21.155 1.00 71.22 O ATOM 505 CB ARG A 34 -1.897 19.847 -24.494 1.00 11.31 C ATOM 506 CG ARG A 34 -1.586 18.862 -25.609 1.00 32.14 C ATOM 507 CD ARG A 34 -1.353 19.573 -26.932 1.00 53.33 C ATOM 508 NE ARG A 34 -2.443 20.488 -27.261 1.00 53.12 N ATOM 509 CZ ARG A 34 -3.623 20.089 -27.724 1.00 1.40 C ATOM 510 NH1 ARG A 34 -3.864 18.799 -27.911 1.00 43.10 N ATOM 511 NH2 ARG A 34 -4.565 20.982 -28.000 1.00 43.43 N ATOM 0 H ARG A 34 -1.932 17.363 -22.545 1.00 31.55 H new ATOM 0 HA ARG A 34 -0.497 18.951 -23.130 1.00 41.45 H new ATOM 0 HB2 ARG A 34 -2.963 20.074 -24.509 1.00 11.31 H new ATOM 0 HB3 ARG A 34 -1.369 20.781 -24.688 1.00 11.31 H new ATOM 0 HG2 ARG A 34 -0.702 18.281 -25.346 1.00 32.14 H new ATOM 0 HG3 ARG A 34 -2.411 18.157 -25.714 1.00 32.14 H new ATOM 0 HD2 ARG A 34 -0.416 20.128 -26.885 1.00 53.33 H new ATOM 0 HD3 ARG A 34 -1.247 18.835 -27.727 1.00 53.33 H new ATOM 0 HE ARG A 34 -2.290 21.488 -27.128 1.00 53.12 H new ATOM 0 HH11 ARG A 34 -3.143 18.110 -27.699 1.00 43.10 H new ATOM 0 HH12 ARG A 34 -4.771 18.496 -28.266 1.00 43.10 H new ATOM 0 HH21 ARG A 34 -4.384 21.975 -27.857 1.00 43.43 H new ATOM 0 HH22 ARG A 34 -5.470 20.675 -28.355 1.00 43.43 H new ATOM 525 N PHE A 35 -0.719 21.488 -22.307 1.00 14.52 N ATOM 526 CA PHE A 35 -0.668 22.644 -21.419 1.00 51.42 C ATOM 527 C PHE A 35 -2.014 23.362 -21.382 1.00 73.21 C ATOM 528 O PHE A 35 -2.361 24.004 -20.391 1.00 33.13 O ATOM 529 CB PHE A 35 0.427 23.613 -21.871 1.00 55.14 C ATOM 530 CG PHE A 35 1.808 23.025 -21.816 1.00 55.15 C ATOM 531 CD1 PHE A 35 2.267 22.409 -20.664 1.00 1.04 C ATOM 532 CD2 PHE A 35 2.646 23.088 -22.918 1.00 31.22 C ATOM 533 CE1 PHE A 35 3.538 21.868 -20.610 1.00 73.12 C ATOM 534 CE2 PHE A 35 3.918 22.548 -22.870 1.00 55.05 C ATOM 535 CZ PHE A 35 4.363 21.936 -21.715 1.00 45.34 C ATOM 0 H PHE A 35 -0.058 21.522 -23.083 1.00 14.52 H new ATOM 0 HA PHE A 35 -0.438 22.289 -20.415 1.00 51.42 H new ATOM 0 HB2 PHE A 35 0.218 23.934 -22.891 1.00 55.14 H new ATOM 0 HB3 PHE A 35 0.395 24.504 -21.243 1.00 55.14 H new ATOM 0 HD1 PHE A 35 1.625 22.351 -19.798 1.00 1.04 H new ATOM 0 HD2 PHE A 35 2.302 23.564 -23.824 1.00 31.22 H new ATOM 0 HE1 PHE A 35 3.885 21.393 -19.705 1.00 73.12 H new ATOM 0 HE2 PHE A 35 4.563 22.605 -23.735 1.00 55.05 H new ATOM 0 HZ PHE A 35 5.355 21.511 -21.676 1.00 45.34 H new ATOM 545 N VAL A 36 -2.769 23.248 -22.471 1.00 1.24 N ATOM 546 CA VAL A 36 -4.077 23.885 -22.564 1.00 33.24 C ATOM 547 C VAL A 36 -5.028 23.344 -21.502 1.00 74.21 C ATOM 548 O VAL A 36 -5.670 24.108 -20.782 1.00 43.42 O ATOM 549 CB VAL A 36 -4.705 23.676 -23.954 1.00 53.14 C ATOM 550 CG1 VAL A 36 -3.960 24.487 -25.004 1.00 74.40 C ATOM 551 CG2 VAL A 36 -4.715 22.199 -24.318 1.00 34.13 C ATOM 0 H VAL A 36 -2.497 22.721 -23.300 1.00 1.24 H new ATOM 0 HA VAL A 36 -3.922 24.951 -22.400 1.00 33.24 H new ATOM 0 HB VAL A 36 -5.737 24.026 -23.923 1.00 53.14 H new ATOM 0 HG11 VAL A 36 -4.418 24.327 -25.980 1.00 74.40 H new ATOM 0 HG12 VAL A 36 -4.010 25.546 -24.749 1.00 74.40 H new ATOM 0 HG13 VAL A 36 -2.917 24.170 -25.036 1.00 74.40 H new ATOM 0 HG21 VAL A 36 -5.162 22.070 -25.304 1.00 34.13 H new ATOM 0 HG22 VAL A 36 -3.693 21.821 -24.331 1.00 34.13 H new ATOM 0 HG23 VAL A 36 -5.297 21.646 -23.580 1.00 34.13 H new ATOM 561 N GLU A 37 -5.114 22.020 -21.411 1.00 2.30 N ATOM 562 CA GLU A 37 -5.988 21.377 -20.437 1.00 4.13 C ATOM 563 C GLU A 37 -5.293 21.248 -19.084 1.00 42.52 C ATOM 564 O GLU A 37 -5.789 21.740 -18.070 1.00 44.44 O ATOM 565 CB GLU A 37 -6.415 19.996 -20.936 1.00 74.51 C ATOM 566 CG GLU A 37 -7.809 19.590 -20.485 1.00 64.13 C ATOM 567 CD GLU A 37 -7.876 19.283 -19.002 1.00 5.43 C ATOM 568 OE1 GLU A 37 -6.965 18.594 -18.497 1.00 65.34 O ATOM 569 OE2 GLU A 37 -8.838 19.733 -18.345 1.00 71.53 O ATOM 0 H GLU A 37 -4.589 21.373 -22.000 1.00 2.30 H new ATOM 0 HA GLU A 37 -6.873 22.001 -20.314 1.00 4.13 H new ATOM 0 HB2 GLU A 37 -6.377 19.985 -22.025 1.00 74.51 H new ATOM 0 HB3 GLU A 37 -5.698 19.254 -20.584 1.00 74.51 H new ATOM 0 HG2 GLU A 37 -8.510 20.391 -20.718 1.00 64.13 H new ATOM 0 HG3 GLU A 37 -8.128 18.713 -21.048 1.00 64.13 H new ATOM 576 N ASP A 38 -4.143 20.583 -19.078 1.00 2.55 N ATOM 577 CA ASP A 38 -3.379 20.390 -17.851 1.00 23.34 C ATOM 578 C ASP A 38 -3.034 21.730 -17.208 1.00 31.42 C ATOM 579 O ASP A 38 -3.441 22.012 -16.080 1.00 2.10 O ATOM 580 CB ASP A 38 -2.098 19.605 -18.140 1.00 75.34 C ATOM 581 CG ASP A 38 -1.399 19.150 -16.875 1.00 1.24 C ATOM 582 OD1 ASP A 38 -1.579 19.809 -15.829 1.00 24.51 O ATOM 583 OD2 ASP A 38 -0.671 18.137 -16.930 1.00 31.33 O ATOM 0 H ASP A 38 -3.720 20.169 -19.908 1.00 2.55 H new ATOM 0 HA ASP A 38 -3.996 19.821 -17.155 1.00 23.34 H new ATOM 0 HB2 ASP A 38 -2.339 18.735 -18.751 1.00 75.34 H new ATOM 0 HB3 ASP A 38 -1.419 20.226 -18.723 1.00 75.34 H new ATOM 588 N LEU A 39 -2.281 22.551 -17.932 1.00 35.25 N ATOM 589 CA LEU A 39 -1.881 23.861 -17.432 1.00 4.52 C ATOM 590 C LEU A 39 -2.945 24.910 -17.739 1.00 43.21 C ATOM 591 O LEU A 39 -3.929 24.629 -18.422 1.00 24.33 O ATOM 592 CB LEU A 39 -0.545 24.278 -18.049 1.00 65.24 C ATOM 593 CG LEU A 39 0.711 23.787 -17.327 1.00 73.24 C ATOM 594 CD1 LEU A 39 1.962 24.243 -18.062 1.00 11.24 C ATOM 595 CD2 LEU A 39 0.725 24.280 -15.888 1.00 22.32 C ATOM 0 H LEU A 39 -1.936 22.333 -18.867 1.00 35.25 H new ATOM 0 HA LEU A 39 -1.769 23.790 -16.350 1.00 4.52 H new ATOM 0 HB2 LEU A 39 -0.514 23.916 -19.077 1.00 65.24 H new ATOM 0 HB3 LEU A 39 -0.512 25.367 -18.093 1.00 65.24 H new ATOM 0 HG LEU A 39 0.699 22.697 -17.316 1.00 73.24 H new ATOM 0 HD11 LEU A 39 2.845 23.884 -17.534 1.00 11.24 H new ATOM 0 HD12 LEU A 39 1.956 23.840 -19.075 1.00 11.24 H new ATOM 0 HD13 LEU A 39 1.982 25.332 -18.105 1.00 11.24 H new ATOM 0 HD21 LEU A 39 1.625 23.921 -15.389 1.00 22.32 H new ATOM 0 HD22 LEU A 39 0.714 25.370 -15.877 1.00 22.32 H new ATOM 0 HD23 LEU A 39 -0.154 23.902 -15.365 1.00 22.32 H new ATOM 607 N ASN A 40 -2.739 26.121 -17.232 1.00 5.23 N ATOM 608 CA ASN A 40 -3.680 27.213 -17.453 1.00 44.14 C ATOM 609 C ASN A 40 -3.094 28.251 -18.406 1.00 71.24 C ATOM 610 O ASN A 40 -3.311 29.451 -18.243 1.00 30.03 O ATOM 611 CB ASN A 40 -4.047 27.875 -16.124 1.00 11.21 C ATOM 612 CG ASN A 40 -2.825 28.276 -15.320 1.00 51.13 C ATOM 613 OD1 ASN A 40 -1.701 28.242 -15.821 1.00 22.13 O ATOM 614 ND2 ASN A 40 -3.041 28.658 -14.067 1.00 43.50 N ATOM 0 H ASN A 40 -1.929 26.371 -16.665 1.00 5.23 H new ATOM 0 HA ASN A 40 -4.581 26.797 -17.905 1.00 44.14 H new ATOM 0 HB2 ASN A 40 -4.657 28.758 -16.317 1.00 11.21 H new ATOM 0 HB3 ASN A 40 -4.656 27.189 -15.536 1.00 11.21 H new ATOM 0 HD21 ASN A 40 -2.258 28.939 -13.477 1.00 43.50 H new ATOM 0 HD22 ASN A 40 -3.990 28.670 -13.694 1.00 43.50 H new ATOM 621 N ALA A 41 -2.351 27.779 -19.402 1.00 74.04 N ATOM 622 CA ALA A 41 -1.737 28.665 -20.383 1.00 41.02 C ATOM 623 C ALA A 41 -1.454 27.928 -21.688 1.00 35.01 C ATOM 624 O ALA A 41 -1.539 26.701 -21.750 1.00 14.30 O ATOM 625 CB ALA A 41 -0.454 29.263 -19.824 1.00 73.40 C ATOM 0 H ALA A 41 -2.160 26.788 -19.551 1.00 74.04 H new ATOM 0 HA ALA A 41 -2.439 29.471 -20.596 1.00 41.02 H new ATOM 0 HB1 ALA A 41 -0.006 29.923 -20.567 1.00 73.40 H new ATOM 0 HB2 ALA A 41 -0.681 29.833 -18.923 1.00 73.40 H new ATOM 0 HB3 ALA A 41 0.245 28.463 -19.581 1.00 73.40 H new ATOM 631 N ASP A 42 -1.119 28.683 -22.728 1.00 13.40 N ATOM 632 CA ASP A 42 -0.824 28.101 -24.032 1.00 40.41 C ATOM 633 C ASP A 42 0.674 27.863 -24.194 1.00 41.53 C ATOM 634 O ASP A 42 1.489 28.480 -23.507 1.00 75.31 O ATOM 635 CB ASP A 42 -1.332 29.015 -25.149 1.00 23.12 C ATOM 636 CG ASP A 42 -2.746 29.500 -24.901 1.00 54.43 C ATOM 637 OD1 ASP A 42 -3.695 28.808 -25.327 1.00 22.11 O ATOM 638 OD2 ASP A 42 -2.905 30.573 -24.281 1.00 73.54 O ATOM 0 H ASP A 42 -1.045 29.700 -22.694 1.00 13.40 H new ATOM 0 HA ASP A 42 -1.336 27.141 -24.098 1.00 40.41 H new ATOM 0 HB2 ASP A 42 -0.667 29.874 -25.242 1.00 23.12 H new ATOM 0 HB3 ASP A 42 -1.296 28.479 -26.098 1.00 23.12 H new ATOM 643 N SER A 43 1.030 26.965 -25.107 1.00 21.12 N ATOM 644 CA SER A 43 2.430 26.642 -25.356 1.00 20.31 C ATOM 645 C SER A 43 3.245 27.908 -25.597 1.00 5.50 C ATOM 646 O SER A 43 4.453 27.939 -25.355 1.00 51.21 O ATOM 647 CB SER A 43 2.553 25.706 -26.560 1.00 31.43 C ATOM 648 OG SER A 43 2.593 26.437 -27.773 1.00 1.34 O ATOM 0 H SER A 43 0.368 26.448 -25.686 1.00 21.12 H new ATOM 0 HA SER A 43 2.824 26.140 -24.472 1.00 20.31 H new ATOM 0 HB2 SER A 43 3.456 25.103 -26.465 1.00 31.43 H new ATOM 0 HB3 SER A 43 1.710 25.016 -26.576 1.00 31.43 H new ATOM 0 HG SER A 43 2.674 25.816 -28.527 1.00 1.34 H new ATOM 654 N LEU A 44 2.577 28.952 -26.075 1.00 43.23 N ATOM 655 CA LEU A 44 3.238 30.223 -26.350 1.00 5.31 C ATOM 656 C LEU A 44 4.025 30.702 -25.134 1.00 13.13 C ATOM 657 O LEU A 44 5.192 31.077 -25.245 1.00 21.10 O ATOM 658 CB LEU A 44 2.208 31.280 -26.754 1.00 24.33 C ATOM 659 CG LEU A 44 1.252 30.888 -27.881 1.00 2.31 C ATOM 660 CD1 LEU A 44 0.384 32.072 -28.280 1.00 23.33 C ATOM 661 CD2 LEU A 44 2.028 30.365 -29.081 1.00 1.30 C ATOM 0 H LEU A 44 1.578 28.943 -26.280 1.00 43.23 H new ATOM 0 HA LEU A 44 3.935 30.071 -27.174 1.00 5.31 H new ATOM 0 HB2 LEU A 44 1.616 31.537 -25.875 1.00 24.33 H new ATOM 0 HB3 LEU A 44 2.741 32.182 -27.054 1.00 24.33 H new ATOM 0 HG LEU A 44 0.601 30.092 -27.519 1.00 2.31 H new ATOM 0 HD11 LEU A 44 -0.290 31.775 -29.083 1.00 23.33 H new ATOM 0 HD12 LEU A 44 -0.199 32.402 -27.420 1.00 23.33 H new ATOM 0 HD13 LEU A 44 1.019 32.889 -28.623 1.00 23.33 H new ATOM 0 HD21 LEU A 44 1.331 30.091 -29.873 1.00 1.30 H new ATOM 0 HD22 LEU A 44 2.703 31.140 -29.444 1.00 1.30 H new ATOM 0 HD23 LEU A 44 2.606 29.489 -28.787 1.00 1.30 H new ATOM 673 N ASP A 45 3.378 30.685 -23.973 1.00 70.15 N ATOM 674 CA ASP A 45 4.018 31.114 -22.735 1.00 55.12 C ATOM 675 C ASP A 45 4.903 30.008 -22.169 1.00 14.11 C ATOM 676 O ASP A 45 5.877 30.278 -21.467 1.00 3.34 O ATOM 677 CB ASP A 45 2.962 31.518 -21.704 1.00 62.24 C ATOM 678 CG ASP A 45 3.516 31.558 -20.294 1.00 21.43 C ATOM 679 OD1 ASP A 45 4.251 32.515 -19.972 1.00 73.40 O ATOM 680 OD2 ASP A 45 3.216 30.631 -19.512 1.00 13.13 O ATOM 0 H ASP A 45 2.411 30.379 -23.864 1.00 70.15 H new ATOM 0 HA ASP A 45 4.645 31.977 -22.959 1.00 55.12 H new ATOM 0 HB2 ASP A 45 2.563 32.499 -21.962 1.00 62.24 H new ATOM 0 HB3 ASP A 45 2.131 30.814 -21.745 1.00 62.24 H new ATOM 685 N ILE A 46 4.556 28.763 -22.478 1.00 52.32 N ATOM 686 CA ILE A 46 5.319 27.617 -22.000 1.00 52.11 C ATOM 687 C ILE A 46 6.682 27.542 -22.680 1.00 32.13 C ATOM 688 O ILE A 46 7.641 27.015 -22.115 1.00 14.12 O ATOM 689 CB ILE A 46 4.563 26.297 -22.242 1.00 43.15 C ATOM 690 CG1 ILE A 46 3.165 26.364 -21.625 1.00 71.22 C ATOM 691 CG2 ILE A 46 5.346 25.126 -21.669 1.00 22.34 C ATOM 692 CD1 ILE A 46 3.175 26.511 -20.120 1.00 23.33 C ATOM 0 H ILE A 46 3.752 28.522 -23.057 1.00 52.32 H new ATOM 0 HA ILE A 46 5.458 27.755 -20.928 1.00 52.11 H new ATOM 0 HB ILE A 46 4.458 26.147 -23.317 1.00 43.15 H new ATOM 0 HG12 ILE A 46 2.625 27.204 -22.060 1.00 71.22 H new ATOM 0 HG13 ILE A 46 2.616 25.460 -21.890 1.00 71.22 H new ATOM 0 HG21 ILE A 46 4.799 24.200 -21.848 1.00 22.34 H new ATOM 0 HG22 ILE A 46 6.322 25.070 -22.151 1.00 22.34 H new ATOM 0 HG23 ILE A 46 5.479 25.267 -20.596 1.00 22.34 H new ATOM 0 HD11 ILE A 46 2.150 26.552 -19.752 1.00 23.33 H new ATOM 0 HD12 ILE A 46 3.687 25.658 -19.675 1.00 23.33 H new ATOM 0 HD13 ILE A 46 3.695 27.429 -19.848 1.00 23.33 H new ATOM 704 N TYR A 47 6.761 28.073 -23.894 1.00 50.54 N ATOM 705 CA TYR A 47 8.007 28.066 -24.652 1.00 53.31 C ATOM 706 C TYR A 47 9.155 28.628 -23.819 1.00 34.44 C ATOM 707 O TYR A 47 10.201 27.995 -23.678 1.00 53.14 O ATOM 708 CB TYR A 47 7.850 28.879 -25.938 1.00 45.43 C ATOM 709 CG TYR A 47 9.105 28.927 -26.781 1.00 2.34 C ATOM 710 CD1 TYR A 47 10.119 29.835 -26.501 1.00 42.01 C ATOM 711 CD2 TYR A 47 9.277 28.064 -27.856 1.00 20.35 C ATOM 712 CE1 TYR A 47 11.267 29.883 -27.269 1.00 32.44 C ATOM 713 CE2 TYR A 47 10.422 28.103 -28.628 1.00 0.24 C ATOM 714 CZ TYR A 47 11.414 29.015 -28.330 1.00 73.45 C ATOM 715 OH TYR A 47 12.556 29.058 -29.097 1.00 20.15 O ATOM 0 H TYR A 47 5.977 28.514 -24.375 1.00 50.54 H new ATOM 0 HA TYR A 47 8.241 27.033 -24.909 1.00 53.31 H new ATOM 0 HB2 TYR A 47 7.040 28.453 -26.531 1.00 45.43 H new ATOM 0 HB3 TYR A 47 7.556 29.897 -25.681 1.00 45.43 H new ATOM 0 HD1 TYR A 47 10.008 30.515 -25.669 1.00 42.01 H new ATOM 0 HD2 TYR A 47 8.502 27.350 -28.092 1.00 20.35 H new ATOM 0 HE1 TYR A 47 12.045 30.596 -27.039 1.00 32.44 H new ATOM 0 HE2 TYR A 47 10.540 27.424 -29.460 1.00 0.24 H new ATOM 0 HH TYR A 47 12.502 28.380 -29.803 1.00 20.15 H new ATOM 725 N GLU A 48 8.949 29.820 -23.267 1.00 62.31 N ATOM 726 CA GLU A 48 9.967 30.467 -22.447 1.00 74.03 C ATOM 727 C GLU A 48 10.135 29.741 -21.116 1.00 2.03 C ATOM 728 O GLU A 48 11.234 29.684 -20.561 1.00 73.03 O ATOM 729 CB GLU A 48 9.598 31.931 -22.199 1.00 41.24 C ATOM 730 CG GLU A 48 9.709 32.805 -23.438 1.00 21.24 C ATOM 731 CD GLU A 48 9.509 34.277 -23.133 1.00 73.30 C ATOM 732 OE1 GLU A 48 8.390 34.651 -22.723 1.00 44.43 O ATOM 733 OE2 GLU A 48 10.471 35.054 -23.304 1.00 63.25 O ATOM 0 H GLU A 48 8.088 30.356 -23.373 1.00 62.31 H new ATOM 0 HA GLU A 48 10.913 30.424 -22.986 1.00 74.03 H new ATOM 0 HB2 GLU A 48 8.577 31.980 -21.820 1.00 41.24 H new ATOM 0 HB3 GLU A 48 10.247 32.334 -21.421 1.00 41.24 H new ATOM 0 HG2 GLU A 48 10.689 32.662 -23.892 1.00 21.24 H new ATOM 0 HG3 GLU A 48 8.968 32.486 -24.171 1.00 21.24 H new ATOM 740 N LEU A 49 9.039 29.188 -20.607 1.00 45.14 N ATOM 741 CA LEU A 49 9.064 28.466 -19.340 1.00 62.32 C ATOM 742 C LEU A 49 10.099 27.346 -19.372 1.00 25.01 C ATOM 743 O LEU A 49 11.042 27.335 -18.580 1.00 25.05 O ATOM 744 CB LEU A 49 7.681 27.889 -19.032 1.00 64.24 C ATOM 745 CG LEU A 49 7.335 27.730 -17.552 1.00 31.14 C ATOM 746 CD1 LEU A 49 7.184 29.091 -16.890 1.00 22.34 C ATOM 747 CD2 LEU A 49 6.063 26.911 -17.386 1.00 62.44 C ATOM 0 H LEU A 49 8.122 29.226 -21.053 1.00 45.14 H new ATOM 0 HA LEU A 49 9.341 29.169 -18.555 1.00 62.32 H new ATOM 0 HB2 LEU A 49 6.931 28.531 -19.493 1.00 64.24 H new ATOM 0 HB3 LEU A 49 7.602 26.913 -19.510 1.00 64.24 H new ATOM 0 HG LEU A 49 8.152 27.199 -17.063 1.00 31.14 H new ATOM 0 HD11 LEU A 49 6.938 28.958 -15.837 1.00 22.34 H new ATOM 0 HD12 LEU A 49 8.119 29.644 -16.977 1.00 22.34 H new ATOM 0 HD13 LEU A 49 6.386 29.648 -17.381 1.00 22.34 H new ATOM 0 HD21 LEU A 49 5.832 26.808 -16.326 1.00 62.44 H new ATOM 0 HD22 LEU A 49 5.238 27.414 -17.890 1.00 62.44 H new ATOM 0 HD23 LEU A 49 6.207 25.923 -17.823 1.00 62.44 H new ATOM 759 N LEU A 50 9.919 26.406 -20.293 1.00 52.44 N ATOM 760 CA LEU A 50 10.839 25.282 -20.431 1.00 14.43 C ATOM 761 C LEU A 50 12.187 25.745 -20.972 1.00 42.53 C ATOM 762 O LEU A 50 13.237 25.256 -20.554 1.00 72.13 O ATOM 763 CB LEU A 50 10.242 24.220 -21.356 1.00 23.03 C ATOM 764 CG LEU A 50 9.645 24.731 -22.667 1.00 63.35 C ATOM 765 CD1 LEU A 50 10.481 24.268 -23.850 1.00 63.44 C ATOM 766 CD2 LEU A 50 8.204 24.264 -22.815 1.00 44.11 C ATOM 0 H LEU A 50 9.144 26.400 -20.956 1.00 52.44 H new ATOM 0 HA LEU A 50 10.995 24.848 -19.443 1.00 14.43 H new ATOM 0 HB2 LEU A 50 11.020 23.494 -21.593 1.00 23.03 H new ATOM 0 HB3 LEU A 50 9.464 23.687 -20.809 1.00 23.03 H new ATOM 0 HG LEU A 50 9.652 25.821 -22.647 1.00 63.35 H new ATOM 0 HD11 LEU A 50 10.041 24.641 -24.775 1.00 63.44 H new ATOM 0 HD12 LEU A 50 11.496 24.652 -23.751 1.00 63.44 H new ATOM 0 HD13 LEU A 50 10.506 23.179 -23.874 1.00 63.44 H new ATOM 0 HD21 LEU A 50 7.795 24.637 -23.754 1.00 44.11 H new ATOM 0 HD22 LEU A 50 8.173 23.174 -22.813 1.00 44.11 H new ATOM 0 HD23 LEU A 50 7.611 24.645 -21.984 1.00 44.11 H new ATOM 778 N TYR A 51 12.151 26.693 -21.903 1.00 24.22 N ATOM 779 CA TYR A 51 13.371 27.222 -22.502 1.00 13.22 C ATOM 780 C TYR A 51 14.365 27.650 -21.426 1.00 54.44 C ATOM 781 O TYR A 51 15.550 27.322 -21.493 1.00 32.51 O ATOM 782 CB TYR A 51 13.044 28.408 -23.411 1.00 70.02 C ATOM 783 CG TYR A 51 14.252 29.240 -23.778 1.00 53.34 C ATOM 784 CD1 TYR A 51 15.447 28.638 -24.154 1.00 15.25 C ATOM 785 CD2 TYR A 51 14.198 30.628 -23.749 1.00 45.34 C ATOM 786 CE1 TYR A 51 16.553 29.394 -24.489 1.00 52.53 C ATOM 787 CE2 TYR A 51 15.299 31.392 -24.085 1.00 2.41 C ATOM 788 CZ TYR A 51 16.474 30.771 -24.454 1.00 1.11 C ATOM 789 OH TYR A 51 17.573 31.529 -24.787 1.00 63.25 O ATOM 0 H TYR A 51 11.291 27.110 -22.259 1.00 24.22 H new ATOM 0 HA TYR A 51 13.826 26.431 -23.097 1.00 13.22 H new ATOM 0 HB2 TYR A 51 12.577 28.038 -24.324 1.00 70.02 H new ATOM 0 HB3 TYR A 51 12.312 29.045 -22.914 1.00 70.02 H new ATOM 0 HD1 TYR A 51 15.512 27.560 -24.185 1.00 15.25 H new ATOM 0 HD2 TYR A 51 13.280 31.118 -23.459 1.00 45.34 H new ATOM 0 HE1 TYR A 51 17.475 28.910 -24.777 1.00 52.53 H new ATOM 0 HE2 TYR A 51 15.240 32.470 -24.059 1.00 2.41 H new ATOM 0 HH TYR A 51 17.349 32.480 -24.712 1.00 63.25 H new ATOM 799 N LEU A 52 13.873 28.386 -20.435 1.00 61.23 N ATOM 800 CA LEU A 52 14.716 28.860 -19.343 1.00 64.23 C ATOM 801 C LEU A 52 14.968 27.750 -18.328 1.00 34.41 C ATOM 802 O LEU A 52 15.997 27.733 -17.652 1.00 22.00 O ATOM 803 CB LEU A 52 14.065 30.060 -18.654 1.00 30.45 C ATOM 804 CG LEU A 52 14.408 31.433 -19.231 1.00 54.41 C ATOM 805 CD1 LEU A 52 13.890 31.558 -20.655 1.00 75.15 C ATOM 806 CD2 LEU A 52 13.835 32.538 -18.355 1.00 3.11 C ATOM 0 H LEU A 52 12.895 28.667 -20.365 1.00 61.23 H new ATOM 0 HA LEU A 52 15.674 29.166 -19.763 1.00 64.23 H new ATOM 0 HB2 LEU A 52 12.983 29.932 -18.692 1.00 30.45 H new ATOM 0 HB3 LEU A 52 14.351 30.049 -17.602 1.00 30.45 H new ATOM 0 HG LEU A 52 15.493 31.537 -19.250 1.00 54.41 H new ATOM 0 HD11 LEU A 52 14.144 32.542 -21.049 1.00 75.15 H new ATOM 0 HD12 LEU A 52 14.347 30.789 -21.277 1.00 75.15 H new ATOM 0 HD13 LEU A 52 12.807 31.433 -20.661 1.00 75.15 H new ATOM 0 HD21 LEU A 52 14.089 33.509 -18.781 1.00 3.11 H new ATOM 0 HD22 LEU A 52 12.751 32.437 -18.304 1.00 3.11 H new ATOM 0 HD23 LEU A 52 14.254 32.461 -17.352 1.00 3.11 H new ATOM 818 N LEU A 53 14.022 26.822 -18.227 1.00 53.31 N ATOM 819 CA LEU A 53 14.141 25.706 -17.296 1.00 30.14 C ATOM 820 C LEU A 53 15.315 24.807 -17.670 1.00 50.13 C ATOM 821 O LEU A 53 16.118 24.432 -16.817 1.00 45.31 O ATOM 822 CB LEU A 53 12.846 24.892 -17.276 1.00 62.54 C ATOM 823 CG LEU A 53 12.470 24.260 -15.935 1.00 41.34 C ATOM 824 CD1 LEU A 53 12.324 25.330 -14.864 1.00 63.12 C ATOM 825 CD2 LEU A 53 11.185 23.455 -16.067 1.00 3.55 C ATOM 0 H LEU A 53 13.164 26.821 -18.779 1.00 53.31 H new ATOM 0 HA LEU A 53 14.322 26.113 -16.301 1.00 30.14 H new ATOM 0 HB2 LEU A 53 12.028 25.540 -17.591 1.00 62.54 H new ATOM 0 HB3 LEU A 53 12.928 24.098 -18.019 1.00 62.54 H new ATOM 0 HG LEU A 53 13.270 23.583 -15.636 1.00 41.34 H new ATOM 0 HD11 LEU A 53 12.056 24.862 -13.917 1.00 63.12 H new ATOM 0 HD12 LEU A 53 13.268 25.863 -14.751 1.00 63.12 H new ATOM 0 HD13 LEU A 53 11.543 26.032 -15.155 1.00 63.12 H new ATOM 0 HD21 LEU A 53 10.932 23.012 -15.103 1.00 3.55 H new ATOM 0 HD22 LEU A 53 10.376 24.111 -16.388 1.00 3.55 H new ATOM 0 HD23 LEU A 53 11.325 22.664 -16.804 1.00 3.55 H new ATOM 837 N GLU A 54 15.408 24.467 -18.952 1.00 40.22 N ATOM 838 CA GLU A 54 16.485 23.614 -19.439 1.00 62.42 C ATOM 839 C GLU A 54 17.840 24.296 -19.268 1.00 75.25 C ATOM 840 O GLU A 54 18.859 23.634 -19.074 1.00 54.14 O ATOM 841 CB GLU A 54 16.261 23.262 -20.911 1.00 60.43 C ATOM 842 CG GLU A 54 16.820 24.294 -21.876 1.00 11.11 C ATOM 843 CD GLU A 54 16.247 24.157 -23.273 1.00 43.13 C ATOM 844 OE1 GLU A 54 15.084 24.563 -23.479 1.00 61.44 O ATOM 845 OE2 GLU A 54 16.961 23.645 -24.160 1.00 64.41 O ATOM 0 H GLU A 54 14.751 24.769 -19.671 1.00 40.22 H new ATOM 0 HA GLU A 54 16.482 22.697 -18.849 1.00 62.42 H new ATOM 0 HB2 GLU A 54 16.721 22.296 -21.119 1.00 60.43 H new ATOM 0 HB3 GLU A 54 15.192 23.151 -21.091 1.00 60.43 H new ATOM 0 HG2 GLU A 54 16.607 25.293 -21.497 1.00 11.11 H new ATOM 0 HG3 GLU A 54 17.904 24.194 -21.921 1.00 11.11 H new ATOM 852 N GLU A 55 17.841 25.623 -19.343 1.00 54.11 N ATOM 853 CA GLU A 55 19.069 26.395 -19.198 1.00 64.43 C ATOM 854 C GLU A 55 19.637 26.254 -17.789 1.00 1.32 C ATOM 855 O GLU A 55 20.852 26.197 -17.600 1.00 72.54 O ATOM 856 CB GLU A 55 18.811 27.870 -19.512 1.00 25.15 C ATOM 857 CG GLU A 55 20.027 28.758 -19.304 1.00 32.15 C ATOM 858 CD GLU A 55 19.996 30.001 -20.171 1.00 43.20 C ATOM 859 OE1 GLU A 55 18.957 30.693 -20.181 1.00 73.24 O ATOM 860 OE2 GLU A 55 21.013 30.282 -20.840 1.00 1.44 O ATOM 0 H GLU A 55 17.005 26.186 -19.503 1.00 54.11 H new ATOM 0 HA GLU A 55 19.800 26.004 -19.906 1.00 64.43 H new ATOM 0 HB2 GLU A 55 18.478 27.960 -20.546 1.00 25.15 H new ATOM 0 HB3 GLU A 55 17.997 28.230 -18.883 1.00 25.15 H new ATOM 0 HG2 GLU A 55 20.083 29.052 -18.256 1.00 32.15 H new ATOM 0 HG3 GLU A 55 20.930 28.189 -19.524 1.00 32.15 H new ATOM 867 N ALA A 56 18.748 26.201 -16.802 1.00 65.30 N ATOM 868 CA ALA A 56 19.160 26.066 -15.410 1.00 73.22 C ATOM 869 C ALA A 56 19.791 24.702 -15.154 1.00 20.40 C ATOM 870 O ALA A 56 20.524 24.518 -14.182 1.00 11.32 O ATOM 871 CB ALA A 56 17.971 26.282 -14.485 1.00 71.53 C ATOM 0 H ALA A 56 17.739 26.249 -16.941 1.00 65.30 H new ATOM 0 HA ALA A 56 19.911 26.829 -15.203 1.00 73.22 H new ATOM 0 HB1 ALA A 56 18.293 26.178 -13.449 1.00 71.53 H new ATOM 0 HB2 ALA A 56 17.566 27.282 -14.641 1.00 71.53 H new ATOM 0 HB3 ALA A 56 17.202 25.541 -14.702 1.00 71.53 H new ATOM 877 N PHE A 57 19.502 23.747 -16.032 1.00 34.44 N ATOM 878 CA PHE A 57 20.040 22.398 -15.899 1.00 70.11 C ATOM 879 C PHE A 57 21.096 22.127 -16.967 1.00 30.54 C ATOM 880 O PHE A 57 21.748 21.082 -16.959 1.00 75.01 O ATOM 881 CB PHE A 57 18.916 21.365 -16.003 1.00 61.22 C ATOM 882 CG PHE A 57 17.662 21.768 -15.281 1.00 42.35 C ATOM 883 CD1 PHE A 57 17.723 22.300 -14.003 1.00 64.32 C ATOM 884 CD2 PHE A 57 16.422 21.617 -15.881 1.00 65.23 C ATOM 885 CE1 PHE A 57 16.571 22.671 -13.337 1.00 21.13 C ATOM 886 CE2 PHE A 57 15.267 21.987 -15.220 1.00 34.33 C ATOM 887 CZ PHE A 57 15.341 22.515 -13.946 1.00 43.51 C ATOM 0 H PHE A 57 18.898 23.882 -16.843 1.00 34.44 H new ATOM 0 HA PHE A 57 20.510 22.315 -14.919 1.00 70.11 H new ATOM 0 HB2 PHE A 57 18.683 21.199 -17.055 1.00 61.22 H new ATOM 0 HB3 PHE A 57 19.268 20.415 -15.601 1.00 61.22 H new ATOM 0 HD1 PHE A 57 18.682 22.426 -13.522 1.00 64.32 H new ATOM 0 HD2 PHE A 57 16.358 21.205 -16.877 1.00 65.23 H new ATOM 0 HE1 PHE A 57 16.632 23.083 -12.340 1.00 21.13 H new ATOM 0 HE2 PHE A 57 14.307 21.864 -15.699 1.00 34.33 H new ATOM 0 HZ PHE A 57 14.439 22.805 -13.427 1.00 43.51 H new ATOM 897 N ASP A 58 21.259 23.074 -17.883 1.00 74.04 N ATOM 898 CA ASP A 58 22.235 22.939 -18.958 1.00 23.32 C ATOM 899 C ASP A 58 21.933 21.714 -19.816 1.00 51.42 C ATOM 900 O ASP A 58 22.629 20.702 -19.739 1.00 4.14 O ATOM 901 CB ASP A 58 23.648 22.836 -18.382 1.00 4.45 C ATOM 902 CG ASP A 58 23.996 24.012 -17.490 1.00 23.15 C ATOM 903 OD1 ASP A 58 23.893 25.165 -17.959 1.00 70.33 O ATOM 904 OD2 ASP A 58 24.371 23.779 -16.321 1.00 50.24 O ATOM 0 H ASP A 58 20.728 23.944 -17.903 1.00 74.04 H new ATOM 0 HA ASP A 58 22.170 23.827 -19.587 1.00 23.32 H new ATOM 0 HB2 ASP A 58 23.738 21.912 -17.812 1.00 4.45 H new ATOM 0 HB3 ASP A 58 24.367 22.778 -19.199 1.00 4.45 H new ATOM 909 N ASP A 59 20.890 21.814 -20.633 1.00 32.13 N ATOM 910 CA ASP A 59 20.495 20.715 -21.506 1.00 32.31 C ATOM 911 C ASP A 59 19.525 21.196 -22.580 1.00 73.14 C ATOM 912 O ASP A 59 18.689 22.065 -22.333 1.00 54.33 O ATOM 913 CB ASP A 59 19.854 19.591 -20.689 1.00 42.31 C ATOM 914 CG ASP A 59 20.869 18.572 -20.211 1.00 63.33 C ATOM 915 OD1 ASP A 59 21.404 17.826 -21.058 1.00 44.20 O ATOM 916 OD2 ASP A 59 21.128 18.519 -18.990 1.00 70.55 O ATOM 0 H ASP A 59 20.303 22.645 -20.709 1.00 32.13 H new ATOM 0 HA ASP A 59 21.391 20.333 -21.995 1.00 32.31 H new ATOM 0 HB2 ASP A 59 19.340 20.019 -19.828 1.00 42.31 H new ATOM 0 HB3 ASP A 59 19.099 19.091 -21.295 1.00 42.31 H new ATOM 921 N LYS A 60 19.642 20.626 -23.775 1.00 25.23 N ATOM 922 CA LYS A 60 18.777 20.995 -24.888 1.00 53.32 C ATOM 923 C LYS A 60 17.419 20.311 -24.772 1.00 73.51 C ATOM 924 O LYS A 60 17.340 19.100 -24.560 1.00 51.10 O ATOM 925 CB LYS A 60 19.435 20.623 -26.219 1.00 4.15 C ATOM 926 CG LYS A 60 20.547 21.572 -26.633 1.00 73.34 C ATOM 927 CD LYS A 60 21.027 21.284 -28.046 1.00 24.22 C ATOM 928 CE LYS A 60 20.258 22.099 -29.074 1.00 34.14 C ATOM 929 NZ LYS A 60 20.710 23.517 -29.108 1.00 51.33 N ATOM 0 H LYS A 60 20.329 19.905 -23.997 1.00 25.23 H new ATOM 0 HA LYS A 60 18.625 22.074 -24.854 1.00 53.32 H new ATOM 0 HB2 LYS A 60 19.839 19.613 -26.146 1.00 4.15 H new ATOM 0 HB3 LYS A 60 18.674 20.606 -26.999 1.00 4.15 H new ATOM 0 HG2 LYS A 60 20.191 22.600 -26.571 1.00 73.34 H new ATOM 0 HG3 LYS A 60 21.382 21.481 -25.938 1.00 73.34 H new ATOM 0 HD2 LYS A 60 22.091 21.510 -28.123 1.00 24.22 H new ATOM 0 HD3 LYS A 60 20.910 20.222 -28.261 1.00 24.22 H new ATOM 0 HE2 LYS A 60 20.386 21.653 -30.060 1.00 34.14 H new ATOM 0 HE3 LYS A 60 19.193 22.063 -28.844 1.00 34.14 H new ATOM 0 HZ1 LYS A 60 19.916 24.128 -29.386 1.00 51.33 H new ATOM 0 HZ2 LYS A 60 21.048 23.796 -28.165 1.00 51.33 H new ATOM 0 HZ3 LYS A 60 21.483 23.619 -29.797 1.00 51.33 H new ATOM 943 N ILE A 61 16.353 21.092 -24.914 1.00 23.32 N ATOM 944 CA ILE A 61 14.999 20.559 -24.827 1.00 42.02 C ATOM 945 C ILE A 61 14.639 19.766 -26.079 1.00 42.42 C ATOM 946 O ILE A 61 14.313 18.581 -26.021 1.00 20.40 O ATOM 947 CB ILE A 61 13.964 21.682 -24.629 1.00 1.00 C ATOM 948 CG1 ILE A 61 13.801 21.998 -23.141 1.00 2.41 C ATOM 949 CG2 ILE A 61 12.629 21.286 -25.241 1.00 71.31 C ATOM 950 CD1 ILE A 61 13.090 20.911 -22.366 1.00 53.14 C ATOM 0 H ILE A 61 16.401 22.096 -25.090 1.00 23.32 H new ATOM 0 HA ILE A 61 14.975 19.897 -23.961 1.00 42.02 H new ATOM 0 HB ILE A 61 14.322 22.579 -25.135 1.00 1.00 H new ATOM 0 HG12 ILE A 61 14.786 22.161 -22.703 1.00 2.41 H new ATOM 0 HG13 ILE A 61 13.247 22.931 -23.035 1.00 2.41 H new ATOM 0 HG21 ILE A 61 11.908 22.090 -25.093 1.00 71.31 H new ATOM 0 HG22 ILE A 61 12.757 21.106 -26.308 1.00 71.31 H new ATOM 0 HG23 ILE A 61 12.264 20.378 -24.761 1.00 71.31 H new ATOM 0 HD11 ILE A 61 13.010 21.203 -21.319 1.00 53.14 H new ATOM 0 HD12 ILE A 61 12.092 20.763 -22.779 1.00 53.14 H new ATOM 0 HD13 ILE A 61 13.655 19.982 -22.441 1.00 53.14 H new ATOM 962 N PRO A 62 14.701 20.435 -27.241 1.00 31.54 N ATOM 963 CA PRO A 62 14.387 19.811 -28.530 1.00 2.51 C ATOM 964 C PRO A 62 15.437 18.788 -28.950 1.00 50.40 C ATOM 965 O PRO A 62 15.286 18.114 -29.968 1.00 61.10 O ATOM 966 CB PRO A 62 14.374 20.994 -29.502 1.00 2.24 C ATOM 967 CG PRO A 62 15.257 22.014 -28.869 1.00 62.20 C ATOM 968 CD PRO A 62 15.082 21.850 -27.385 1.00 21.44 C ATOM 0 HA PRO A 62 13.449 19.258 -28.497 1.00 2.51 H new ATOM 0 HB2 PRO A 62 14.746 20.703 -30.484 1.00 2.24 H new ATOM 0 HB3 PRO A 62 13.364 21.378 -29.644 1.00 2.24 H new ATOM 0 HG2 PRO A 62 16.297 21.863 -29.158 1.00 62.20 H new ATOM 0 HG3 PRO A 62 14.981 23.020 -29.186 1.00 62.20 H new ATOM 0 HD2 PRO A 62 16.001 22.076 -26.845 1.00 21.44 H new ATOM 0 HD3 PRO A 62 14.312 22.515 -26.995 1.00 21.44 H new ATOM 976 N GLU A 63 16.500 18.679 -28.159 1.00 72.30 N ATOM 977 CA GLU A 63 17.574 17.737 -28.451 1.00 4.32 C ATOM 978 C GLU A 63 17.606 16.611 -27.421 1.00 54.24 C ATOM 979 O GLU A 63 17.387 15.447 -27.753 1.00 24.10 O ATOM 980 CB GLU A 63 18.923 18.460 -28.474 1.00 21.33 C ATOM 981 CG GLU A 63 19.853 17.977 -29.574 1.00 24.03 C ATOM 982 CD GLU A 63 20.643 16.746 -29.172 1.00 12.21 C ATOM 983 OE1 GLU A 63 20.041 15.654 -29.099 1.00 63.05 O ATOM 984 OE2 GLU A 63 21.861 16.875 -28.930 1.00 31.23 O ATOM 0 H GLU A 63 16.640 19.230 -27.312 1.00 72.30 H new ATOM 0 HA GLU A 63 17.385 17.303 -29.433 1.00 4.32 H new ATOM 0 HB2 GLU A 63 18.751 19.529 -28.599 1.00 21.33 H new ATOM 0 HB3 GLU A 63 19.414 18.327 -27.510 1.00 21.33 H new ATOM 0 HG2 GLU A 63 19.269 17.754 -30.467 1.00 24.03 H new ATOM 0 HG3 GLU A 63 20.544 18.778 -29.838 1.00 24.03 H new ATOM 991 N ASN A 64 17.879 16.968 -26.171 1.00 3.23 N ATOM 992 CA ASN A 64 17.941 15.988 -25.092 1.00 54.42 C ATOM 993 C ASN A 64 16.540 15.542 -24.682 1.00 43.51 C ATOM 994 O ASN A 64 16.188 14.371 -24.816 1.00 11.25 O ATOM 995 CB ASN A 64 18.676 16.574 -23.885 1.00 33.54 C ATOM 996 CG ASN A 64 19.390 15.511 -23.072 1.00 60.10 C ATOM 997 OD1 ASN A 64 19.766 14.462 -23.595 1.00 71.22 O ATOM 998 ND2 ASN A 64 19.580 15.779 -21.785 1.00 63.34 N ATOM 0 H ASN A 64 18.061 17.928 -25.879 1.00 3.23 H new ATOM 0 HA ASN A 64 18.488 15.118 -25.455 1.00 54.42 H new ATOM 0 HB2 ASN A 64 19.400 17.313 -24.228 1.00 33.54 H new ATOM 0 HB3 ASN A 64 17.963 17.097 -23.248 1.00 33.54 H new ATOM 0 HD21 ASN A 64 20.055 15.102 -21.188 1.00 63.34 H new ATOM 0 HD22 ASN A 64 19.251 16.662 -21.394 1.00 63.34 H new ATOM 1005 N GLU A 65 15.747 16.486 -24.183 1.00 61.44 N ATOM 1006 CA GLU A 65 14.386 16.189 -23.754 1.00 15.11 C ATOM 1007 C GLU A 65 13.564 15.618 -24.906 1.00 32.10 C ATOM 1008 O GLU A 65 12.570 14.925 -24.690 1.00 23.32 O ATOM 1009 CB GLU A 65 13.713 17.451 -23.210 1.00 34.25 C ATOM 1010 CG GLU A 65 14.260 17.901 -21.865 1.00 73.23 C ATOM 1011 CD GLU A 65 13.167 18.141 -20.842 1.00 1.23 C ATOM 1012 OE1 GLU A 65 12.031 18.461 -21.250 1.00 20.44 O ATOM 1013 OE2 GLU A 65 13.449 18.010 -19.632 1.00 70.41 O ATOM 0 H GLU A 65 16.024 17.461 -24.066 1.00 61.44 H new ATOM 0 HA GLU A 65 14.437 15.442 -22.962 1.00 15.11 H new ATOM 0 HB2 GLU A 65 13.837 18.258 -23.932 1.00 34.25 H new ATOM 0 HB3 GLU A 65 12.642 17.270 -23.115 1.00 34.25 H new ATOM 0 HG2 GLU A 65 14.948 17.146 -21.486 1.00 73.23 H new ATOM 0 HG3 GLU A 65 14.835 18.817 -21.999 1.00 73.23 H new ATOM 1020 N ALA A 66 13.986 15.915 -26.131 1.00 2.15 N ATOM 1021 CA ALA A 66 13.291 15.431 -27.317 1.00 24.22 C ATOM 1022 C ALA A 66 13.428 13.918 -27.454 1.00 14.14 C ATOM 1023 O ALA A 66 12.745 13.295 -28.265 1.00 51.03 O ATOM 1024 CB ALA A 66 13.824 16.125 -28.561 1.00 45.41 C ATOM 0 H ALA A 66 14.806 16.489 -26.328 1.00 2.15 H new ATOM 0 HA ALA A 66 12.232 15.666 -27.209 1.00 24.22 H new ATOM 0 HB1 ALA A 66 13.296 15.754 -29.439 1.00 45.41 H new ATOM 0 HB2 ALA A 66 13.669 17.200 -28.472 1.00 45.41 H new ATOM 0 HB3 ALA A 66 14.889 15.919 -28.664 1.00 45.41 H new ATOM 1030 N ASN A 67 14.315 13.334 -26.655 1.00 34.14 N ATOM 1031 CA ASN A 67 14.541 11.894 -26.688 1.00 22.41 C ATOM 1032 C ASN A 67 13.258 11.133 -26.367 1.00 10.55 C ATOM 1033 O ASN A 67 13.049 10.019 -26.844 1.00 65.04 O ATOM 1034 CB ASN A 67 15.639 11.506 -25.695 1.00 60.12 C ATOM 1035 CG ASN A 67 15.113 11.357 -24.281 1.00 3.55 C ATOM 1036 OD1 ASN A 67 14.553 12.434 -23.742 1.00 3.21 O flip ATOM 1037 ND2 ASN A 67 15.209 10.287 -23.680 1.00 4.34 N flip ATOM 0 H ASN A 67 14.889 13.836 -25.977 1.00 34.14 H new ATOM 0 HA ASN A 67 14.859 11.625 -27.695 1.00 22.41 H new ATOM 0 HB2 ASN A 67 16.096 10.568 -26.011 1.00 60.12 H new ATOM 0 HB3 ASN A 67 16.423 12.263 -25.710 1.00 60.12 H new ATOM 0 HD21 ASN A 67 15.647 9.485 -24.133 1.00 4.34 H new ATOM 0 HD22 ASN A 67 14.851 10.202 -22.729 1.00 4.34 H new ATOM 1044 N GLU A 68 12.402 11.745 -25.554 1.00 52.32 N ATOM 1045 CA GLU A 68 11.139 11.126 -25.169 1.00 62.32 C ATOM 1046 C GLU A 68 10.097 12.185 -24.822 1.00 72.21 C ATOM 1047 O GLU A 68 9.381 12.065 -23.827 1.00 43.13 O ATOM 1048 CB GLU A 68 11.348 10.189 -23.977 1.00 54.50 C ATOM 1049 CG GLU A 68 11.637 8.752 -24.375 1.00 43.03 C ATOM 1050 CD GLU A 68 10.457 8.086 -25.055 1.00 32.32 C ATOM 1051 OE1 GLU A 68 10.250 8.334 -26.261 1.00 60.13 O ATOM 1052 OE2 GLU A 68 9.740 7.317 -24.381 1.00 30.11 O ATOM 0 H GLU A 68 12.560 12.668 -25.150 1.00 52.32 H new ATOM 0 HA GLU A 68 10.774 10.547 -26.017 1.00 62.32 H new ATOM 0 HB2 GLU A 68 12.174 10.563 -23.373 1.00 54.50 H new ATOM 0 HB3 GLU A 68 10.458 10.211 -23.348 1.00 54.50 H new ATOM 0 HG2 GLU A 68 12.497 8.730 -25.045 1.00 43.03 H new ATOM 0 HG3 GLU A 68 11.910 8.181 -23.487 1.00 43.03 H new ATOM 1059 N PHE A 69 10.018 13.222 -25.649 1.00 74.13 N ATOM 1060 CA PHE A 69 9.065 14.304 -25.430 1.00 35.40 C ATOM 1061 C PHE A 69 7.829 14.126 -26.307 1.00 34.40 C ATOM 1062 O PHE A 69 7.915 13.613 -27.422 1.00 64.12 O ATOM 1063 CB PHE A 69 9.719 15.656 -25.720 1.00 65.54 C ATOM 1064 CG PHE A 69 9.583 16.641 -24.595 1.00 45.55 C ATOM 1065 CD1 PHE A 69 9.788 16.248 -23.283 1.00 30.31 C ATOM 1066 CD2 PHE A 69 9.251 17.962 -24.851 1.00 15.14 C ATOM 1067 CE1 PHE A 69 9.664 17.153 -22.245 1.00 70.54 C ATOM 1068 CE2 PHE A 69 9.126 18.871 -23.817 1.00 54.44 C ATOM 1069 CZ PHE A 69 9.331 18.466 -22.513 1.00 63.11 C ATOM 0 H PHE A 69 10.602 13.336 -26.477 1.00 74.13 H new ATOM 0 HA PHE A 69 8.755 14.275 -24.385 1.00 35.40 H new ATOM 0 HB2 PHE A 69 10.777 15.501 -25.931 1.00 65.54 H new ATOM 0 HB3 PHE A 69 9.274 16.080 -26.620 1.00 65.54 H new ATOM 0 HD1 PHE A 69 10.048 15.222 -23.068 1.00 30.31 H new ATOM 0 HD2 PHE A 69 9.088 18.285 -25.869 1.00 15.14 H new ATOM 0 HE1 PHE A 69 9.827 16.833 -21.226 1.00 70.54 H new ATOM 0 HE2 PHE A 69 8.868 19.898 -24.029 1.00 54.44 H new ATOM 0 HZ PHE A 69 9.231 19.175 -21.704 1.00 63.11 H new ATOM 1079 N GLU A 70 6.679 14.553 -25.793 1.00 62.33 N ATOM 1080 CA GLU A 70 5.425 14.439 -26.529 1.00 44.21 C ATOM 1081 C GLU A 70 4.379 15.401 -25.973 1.00 44.13 C ATOM 1082 O GLU A 70 3.862 16.257 -26.691 1.00 52.34 O ATOM 1083 CB GLU A 70 4.899 13.004 -26.465 1.00 62.25 C ATOM 1084 CG GLU A 70 3.709 12.751 -27.376 1.00 21.14 C ATOM 1085 CD GLU A 70 4.122 12.322 -28.770 1.00 50.33 C ATOM 1086 OE1 GLU A 70 5.339 12.183 -29.013 1.00 32.41 O ATOM 1087 OE2 GLU A 70 3.227 12.126 -29.619 1.00 41.33 O ATOM 0 H GLU A 70 6.590 14.980 -24.871 1.00 62.33 H new ATOM 0 HA GLU A 70 5.619 14.701 -27.569 1.00 44.21 H new ATOM 0 HB2 GLU A 70 5.703 12.319 -26.733 1.00 62.25 H new ATOM 0 HB3 GLU A 70 4.615 12.776 -25.438 1.00 62.25 H new ATOM 0 HG2 GLU A 70 3.076 11.980 -26.935 1.00 21.14 H new ATOM 0 HG3 GLU A 70 3.108 13.658 -27.442 1.00 21.14 H new ATOM 1094 N THR A 71 4.072 15.254 -24.688 1.00 73.33 N ATOM 1095 CA THR A 71 3.087 16.107 -24.035 1.00 71.24 C ATOM 1096 C THR A 71 3.508 16.441 -22.609 1.00 45.42 C ATOM 1097 O THR A 71 4.581 16.039 -22.157 1.00 53.15 O ATOM 1098 CB THR A 71 1.698 15.441 -24.005 1.00 64.42 C ATOM 1099 OG1 THR A 71 1.742 14.253 -23.206 1.00 11.54 O ATOM 1100 CG2 THR A 71 1.234 15.094 -25.412 1.00 31.03 C ATOM 0 H THR A 71 4.492 14.552 -24.079 1.00 73.33 H new ATOM 0 HA THR A 71 3.029 17.026 -24.619 1.00 71.24 H new ATOM 0 HB THR A 71 0.990 16.146 -23.569 1.00 64.42 H new ATOM 0 HG1 THR A 71 1.239 14.397 -22.377 1.00 11.54 H new ATOM 0 HG21 THR A 71 0.251 14.625 -25.366 1.00 31.03 H new ATOM 0 HG22 THR A 71 1.174 16.003 -26.010 1.00 31.03 H new ATOM 0 HG23 THR A 71 1.944 14.405 -25.870 1.00 31.03 H new ATOM 1108 N VAL A 72 2.658 17.180 -21.903 1.00 71.33 N ATOM 1109 CA VAL A 72 2.942 17.567 -20.527 1.00 32.14 C ATOM 1110 C VAL A 72 3.312 16.354 -19.680 1.00 0.41 C ATOM 1111 O VAL A 72 4.230 16.411 -18.863 1.00 1.50 O ATOM 1112 CB VAL A 72 1.737 18.279 -19.884 1.00 52.30 C ATOM 1113 CG1 VAL A 72 2.105 18.818 -18.510 1.00 42.22 C ATOM 1114 CG2 VAL A 72 1.235 19.396 -20.787 1.00 1.10 C ATOM 0 H VAL A 72 1.767 17.523 -22.262 1.00 71.33 H new ATOM 0 HA VAL A 72 3.787 18.255 -20.560 1.00 32.14 H new ATOM 0 HB VAL A 72 0.933 17.554 -19.759 1.00 52.30 H new ATOM 0 HG11 VAL A 72 1.241 19.318 -18.072 1.00 42.22 H new ATOM 0 HG12 VAL A 72 2.413 17.994 -17.866 1.00 42.22 H new ATOM 0 HG13 VAL A 72 2.925 19.529 -18.606 1.00 42.22 H new ATOM 0 HG21 VAL A 72 0.383 19.888 -20.317 1.00 1.10 H new ATOM 0 HG22 VAL A 72 2.032 20.122 -20.945 1.00 1.10 H new ATOM 0 HG23 VAL A 72 0.929 18.979 -21.746 1.00 1.10 H new ATOM 1124 N GLY A 73 2.591 15.256 -19.881 1.00 75.25 N ATOM 1125 CA GLY A 73 2.858 14.044 -19.129 1.00 65.14 C ATOM 1126 C GLY A 73 4.328 13.671 -19.135 1.00 74.35 C ATOM 1127 O GLY A 73 4.867 13.230 -18.121 1.00 22.54 O ATOM 0 H GLY A 73 1.826 15.184 -20.552 1.00 75.25 H new ATOM 0 HA2 GLY A 73 2.524 14.177 -18.100 1.00 65.14 H new ATOM 0 HA3 GLY A 73 2.276 13.224 -19.549 1.00 65.14 H new ATOM 1131 N ASP A 74 4.976 13.846 -20.281 1.00 41.25 N ATOM 1132 CA ASP A 74 6.392 13.524 -20.416 1.00 0.01 C ATOM 1133 C ASP A 74 7.244 14.445 -19.547 1.00 74.33 C ATOM 1134 O ASP A 74 8.203 14.005 -18.914 1.00 1.35 O ATOM 1135 CB ASP A 74 6.826 13.637 -21.878 1.00 60.52 C ATOM 1136 CG ASP A 74 6.179 12.584 -22.757 1.00 15.42 C ATOM 1137 OD1 ASP A 74 5.104 12.074 -22.377 1.00 23.22 O ATOM 1138 OD2 ASP A 74 6.746 12.271 -23.824 1.00 65.22 O ATOM 0 H ASP A 74 4.543 14.209 -21.130 1.00 41.25 H new ATOM 0 HA ASP A 74 6.539 12.498 -20.080 1.00 0.01 H new ATOM 0 HB2 ASP A 74 6.570 14.627 -22.254 1.00 60.52 H new ATOM 0 HB3 ASP A 74 7.910 13.542 -21.941 1.00 60.52 H new ATOM 1143 N VAL A 75 6.887 15.725 -19.524 1.00 34.02 N ATOM 1144 CA VAL A 75 7.618 16.708 -18.733 1.00 54.13 C ATOM 1145 C VAL A 75 7.524 16.395 -17.244 1.00 51.42 C ATOM 1146 O VAL A 75 8.504 16.520 -16.510 1.00 21.33 O ATOM 1147 CB VAL A 75 7.089 18.133 -18.982 1.00 11.33 C ATOM 1148 CG1 VAL A 75 8.021 19.164 -18.364 1.00 3.12 C ATOM 1149 CG2 VAL A 75 6.916 18.385 -20.472 1.00 34.50 C ATOM 0 H VAL A 75 6.096 16.106 -20.044 1.00 34.02 H new ATOM 0 HA VAL A 75 8.661 16.655 -19.047 1.00 54.13 H new ATOM 0 HB VAL A 75 6.113 18.228 -18.505 1.00 11.33 H new ATOM 0 HG11 VAL A 75 7.631 20.165 -18.550 1.00 3.12 H new ATOM 0 HG12 VAL A 75 8.089 18.995 -17.289 1.00 3.12 H new ATOM 0 HG13 VAL A 75 9.012 19.072 -18.809 1.00 3.12 H new ATOM 0 HG21 VAL A 75 6.542 19.397 -20.629 1.00 34.50 H new ATOM 0 HG22 VAL A 75 7.877 18.272 -20.974 1.00 34.50 H new ATOM 0 HG23 VAL A 75 6.205 17.667 -20.882 1.00 34.50 H new ATOM 1159 N VAL A 76 6.338 15.988 -16.804 1.00 54.10 N ATOM 1160 CA VAL A 76 6.115 15.655 -15.402 1.00 3.50 C ATOM 1161 C VAL A 76 7.084 14.575 -14.933 1.00 53.52 C ATOM 1162 O VAL A 76 7.810 14.760 -13.957 1.00 74.32 O ATOM 1163 CB VAL A 76 4.672 15.175 -15.161 1.00 72.12 C ATOM 1164 CG1 VAL A 76 4.485 14.750 -13.713 1.00 20.13 C ATOM 1165 CG2 VAL A 76 3.678 16.264 -15.538 1.00 64.54 C ATOM 0 H VAL A 76 5.516 15.881 -17.398 1.00 54.10 H new ATOM 0 HA VAL A 76 6.286 16.566 -14.829 1.00 3.50 H new ATOM 0 HB VAL A 76 4.485 14.309 -15.796 1.00 72.12 H new ATOM 0 HG11 VAL A 76 3.459 14.414 -13.562 1.00 20.13 H new ATOM 0 HG12 VAL A 76 5.171 13.936 -13.481 1.00 20.13 H new ATOM 0 HG13 VAL A 76 4.690 15.595 -13.056 1.00 20.13 H new ATOM 0 HG21 VAL A 76 2.663 15.907 -15.361 1.00 64.54 H new ATOM 0 HG22 VAL A 76 3.862 17.151 -14.931 1.00 64.54 H new ATOM 0 HG23 VAL A 76 3.796 16.515 -16.592 1.00 64.54 H new ATOM 1175 N ASN A 77 7.089 13.448 -15.636 1.00 62.43 N ATOM 1176 CA ASN A 77 7.969 12.337 -15.292 1.00 60.41 C ATOM 1177 C ASN A 77 9.422 12.675 -15.609 1.00 44.21 C ATOM 1178 O ASN A 77 10.345 12.081 -15.052 1.00 5.14 O ATOM 1179 CB ASN A 77 7.551 11.074 -16.049 1.00 10.30 C ATOM 1180 CG ASN A 77 8.357 10.867 -17.317 1.00 34.01 C ATOM 1181 OD1 ASN A 77 9.507 10.431 -17.270 1.00 42.53 O ATOM 1182 ND2 ASN A 77 7.754 11.179 -18.458 1.00 40.33 N ATOM 0 H ASN A 77 6.494 13.279 -16.447 1.00 62.43 H new ATOM 0 HA ASN A 77 7.882 12.156 -14.221 1.00 60.41 H new ATOM 0 HB2 ASN A 77 7.672 10.207 -15.399 1.00 10.30 H new ATOM 0 HB3 ASN A 77 6.492 11.138 -16.301 1.00 10.30 H new ATOM 0 HD21 ASN A 77 8.246 11.060 -19.344 1.00 40.33 H new ATOM 0 HD22 ASN A 77 6.799 11.537 -18.449 1.00 40.33 H new ATOM 1189 N PHE A 78 9.618 13.634 -16.508 1.00 3.53 N ATOM 1190 CA PHE A 78 10.959 14.053 -16.900 1.00 21.42 C ATOM 1191 C PHE A 78 11.659 14.779 -15.755 1.00 30.34 C ATOM 1192 O PHE A 78 12.707 14.342 -15.277 1.00 50.45 O ATOM 1193 CB PHE A 78 10.894 14.960 -18.130 1.00 1.10 C ATOM 1194 CG PHE A 78 11.192 14.247 -19.418 1.00 21.44 C ATOM 1195 CD1 PHE A 78 10.789 12.935 -19.607 1.00 71.43 C ATOM 1196 CD2 PHE A 78 11.875 14.888 -20.438 1.00 71.05 C ATOM 1197 CE1 PHE A 78 11.063 12.276 -20.791 1.00 34.30 C ATOM 1198 CE2 PHE A 78 12.151 14.234 -21.625 1.00 1.24 C ATOM 1199 CZ PHE A 78 11.743 12.927 -21.801 1.00 64.43 C ATOM 0 H PHE A 78 8.865 14.136 -16.979 1.00 3.53 H new ATOM 0 HA PHE A 78 11.534 13.160 -17.146 1.00 21.42 H new ATOM 0 HB2 PHE A 78 9.901 15.404 -18.192 1.00 1.10 H new ATOM 0 HB3 PHE A 78 11.602 15.779 -18.005 1.00 1.10 H new ATOM 0 HD1 PHE A 78 10.255 12.422 -18.821 1.00 71.43 H new ATOM 0 HD2 PHE A 78 12.196 15.911 -20.305 1.00 71.05 H new ATOM 0 HE1 PHE A 78 10.745 11.253 -20.926 1.00 34.30 H new ATOM 0 HE2 PHE A 78 12.685 14.745 -22.413 1.00 1.24 H new ATOM 0 HZ PHE A 78 11.955 12.414 -22.728 1.00 64.43 H new ATOM 1209 N ILE A 79 11.072 15.889 -15.320 1.00 22.45 N ATOM 1210 CA ILE A 79 11.638 16.675 -14.231 1.00 5.03 C ATOM 1211 C ILE A 79 11.671 15.874 -12.933 1.00 45.15 C ATOM 1212 O ILE A 79 12.487 16.136 -12.049 1.00 41.32 O ATOM 1213 CB ILE A 79 10.841 17.972 -14.000 1.00 5.53 C ATOM 1214 CG1 ILE A 79 10.685 18.742 -15.313 1.00 63.41 C ATOM 1215 CG2 ILE A 79 11.528 18.836 -12.952 1.00 51.31 C ATOM 1216 CD1 ILE A 79 10.092 20.122 -15.138 1.00 71.12 C ATOM 0 H ILE A 79 10.205 16.264 -15.705 1.00 22.45 H new ATOM 0 HA ILE A 79 12.657 16.931 -14.523 1.00 5.03 H new ATOM 0 HB ILE A 79 9.848 17.710 -13.634 1.00 5.53 H new ATOM 0 HG12 ILE A 79 11.661 18.833 -15.790 1.00 63.41 H new ATOM 0 HG13 ILE A 79 10.052 18.167 -15.989 1.00 63.41 H new ATOM 0 HG21 ILE A 79 10.953 19.749 -12.800 1.00 51.31 H new ATOM 0 HG22 ILE A 79 11.592 18.287 -12.013 1.00 51.31 H new ATOM 0 HG23 ILE A 79 12.532 19.092 -13.292 1.00 51.31 H new ATOM 0 HD11 ILE A 79 10.011 20.609 -16.110 1.00 71.12 H new ATOM 0 HD12 ILE A 79 9.102 20.038 -14.690 1.00 71.12 H new ATOM 0 HD13 ILE A 79 10.735 20.715 -14.488 1.00 71.12 H new ATOM 1228 N LYS A 80 10.780 14.895 -12.827 1.00 22.54 N ATOM 1229 CA LYS A 80 10.708 14.051 -11.639 1.00 52.52 C ATOM 1230 C LYS A 80 12.029 13.325 -11.406 1.00 53.22 C ATOM 1231 O LYS A 80 12.602 13.390 -10.318 1.00 54.13 O ATOM 1232 CB LYS A 80 9.572 13.035 -11.779 1.00 3.03 C ATOM 1233 CG LYS A 80 8.240 13.535 -11.249 1.00 14.23 C ATOM 1234 CD LYS A 80 7.087 12.671 -11.732 1.00 63.32 C ATOM 1235 CE LYS A 80 6.284 12.111 -10.568 1.00 60.23 C ATOM 1236 NZ LYS A 80 4.905 11.727 -10.980 1.00 2.34 N ATOM 0 H LYS A 80 10.097 14.666 -13.549 1.00 22.54 H new ATOM 0 HA LYS A 80 10.510 14.692 -10.780 1.00 52.52 H new ATOM 0 HB2 LYS A 80 9.459 12.771 -12.831 1.00 3.03 H new ATOM 0 HB3 LYS A 80 9.845 12.122 -11.249 1.00 3.03 H new ATOM 0 HG2 LYS A 80 8.260 13.540 -10.159 1.00 14.23 H new ATOM 0 HG3 LYS A 80 8.083 14.565 -11.570 1.00 14.23 H new ATOM 0 HD2 LYS A 80 6.434 13.261 -12.376 1.00 63.32 H new ATOM 0 HD3 LYS A 80 7.474 11.851 -12.336 1.00 63.32 H new ATOM 0 HE2 LYS A 80 6.796 11.240 -10.159 1.00 60.23 H new ATOM 0 HE3 LYS A 80 6.232 12.854 -9.772 1.00 60.23 H new ATOM 0 HZ1 LYS A 80 4.214 12.299 -10.455 1.00 2.34 H new ATOM 0 HZ2 LYS A 80 4.788 11.893 -12.000 1.00 2.34 H new ATOM 0 HZ3 LYS A 80 4.749 10.720 -10.773 1.00 2.34 H new ATOM 1250 N LYS A 81 12.508 12.634 -12.435 1.00 3.50 N ATOM 1251 CA LYS A 81 13.763 11.898 -12.344 1.00 63.22 C ATOM 1252 C LYS A 81 14.957 12.834 -12.508 1.00 74.33 C ATOM 1253 O LYS A 81 16.029 12.589 -11.956 1.00 44.50 O ATOM 1254 CB LYS A 81 13.812 10.800 -13.409 1.00 43.02 C ATOM 1255 CG LYS A 81 13.531 11.303 -14.814 1.00 74.15 C ATOM 1256 CD LYS A 81 14.384 10.584 -15.846 1.00 23.04 C ATOM 1257 CE LYS A 81 14.776 11.509 -16.988 1.00 12.02 C ATOM 1258 NZ LYS A 81 15.886 10.944 -17.804 1.00 32.32 N ATOM 0 H LYS A 81 12.046 12.568 -13.342 1.00 3.50 H new ATOM 0 HA LYS A 81 13.816 11.441 -11.356 1.00 63.22 H new ATOM 0 HB2 LYS A 81 14.796 10.331 -13.390 1.00 43.02 H new ATOM 0 HB3 LYS A 81 13.085 10.028 -13.156 1.00 43.02 H new ATOM 0 HG2 LYS A 81 12.476 11.159 -15.049 1.00 74.15 H new ATOM 0 HG3 LYS A 81 13.725 12.374 -14.863 1.00 74.15 H new ATOM 0 HD2 LYS A 81 15.282 10.193 -15.368 1.00 23.04 H new ATOM 0 HD3 LYS A 81 13.835 9.729 -16.241 1.00 23.04 H new ATOM 0 HE2 LYS A 81 13.910 11.685 -17.626 1.00 12.02 H new ATOM 0 HE3 LYS A 81 15.077 12.476 -16.585 1.00 12.02 H new ATOM 0 HZ1 LYS A 81 16.123 11.604 -18.572 1.00 32.32 H new ATOM 0 HZ2 LYS A 81 16.721 10.799 -17.201 1.00 32.32 H new ATOM 0 HZ3 LYS A 81 15.590 10.033 -18.210 1.00 32.32 H new ATOM 1272 N ARG A 82 14.762 13.906 -13.269 1.00 72.33 N ATOM 1273 CA ARG A 82 15.822 14.878 -13.505 1.00 62.03 C ATOM 1274 C ARG A 82 16.227 15.568 -12.206 1.00 34.44 C ATOM 1275 O ARG A 82 17.413 15.748 -11.929 1.00 14.14 O ATOM 1276 CB ARG A 82 15.369 15.921 -14.529 1.00 34.33 C ATOM 1277 CG ARG A 82 16.007 15.748 -15.898 1.00 15.35 C ATOM 1278 CD ARG A 82 14.996 15.962 -17.014 1.00 22.42 C ATOM 1279 NE ARG A 82 14.305 17.242 -16.889 1.00 43.34 N ATOM 1280 CZ ARG A 82 14.876 18.413 -17.149 1.00 0.42 C ATOM 1281 NH1 ARG A 82 16.140 18.465 -17.545 1.00 42.22 N ATOM 1282 NH2 ARG A 82 14.182 19.536 -17.012 1.00 73.13 N ATOM 0 H ARG A 82 13.880 14.123 -13.732 1.00 72.33 H new ATOM 0 HA ARG A 82 16.688 14.345 -13.898 1.00 62.03 H new ATOM 0 HB2 ARG A 82 14.285 15.868 -14.633 1.00 34.33 H new ATOM 0 HB3 ARG A 82 15.605 16.916 -14.151 1.00 34.33 H new ATOM 0 HG2 ARG A 82 16.829 16.455 -16.010 1.00 15.35 H new ATOM 0 HG3 ARG A 82 16.433 14.748 -15.978 1.00 15.35 H new ATOM 0 HD2 ARG A 82 15.504 15.917 -17.977 1.00 22.42 H new ATOM 0 HD3 ARG A 82 14.266 15.153 -17.001 1.00 22.42 H new ATOM 0 HE ARG A 82 13.331 17.237 -16.586 1.00 43.34 H new ATOM 0 HH11 ARG A 82 16.677 17.604 -17.651 1.00 42.22 H new ATOM 0 HH12 ARG A 82 16.575 19.366 -17.744 1.00 42.22 H new ATOM 0 HH21 ARG A 82 13.209 19.500 -16.707 1.00 73.13 H new ATOM 0 HH22 ARG A 82 14.621 20.435 -17.212 1.00 73.13 H new ATOM 1296 N LYS A 83 15.233 15.952 -11.412 1.00 32.43 N ATOM 1297 CA LYS A 83 15.483 16.621 -10.141 1.00 23.34 C ATOM 1298 C LYS A 83 15.625 15.606 -9.010 1.00 42.34 C ATOM 1299 O LYS A 83 16.539 15.699 -8.192 1.00 32.54 O ATOM 1300 CB LYS A 83 14.349 17.598 -9.823 1.00 44.43 C ATOM 1301 CG LYS A 83 14.818 18.872 -9.141 1.00 34.02 C ATOM 1302 CD LYS A 83 14.868 18.709 -7.631 1.00 14.41 C ATOM 1303 CE LYS A 83 15.731 19.781 -6.983 1.00 64.23 C ATOM 1304 NZ LYS A 83 17.175 19.596 -7.300 1.00 32.23 N ATOM 0 H LYS A 83 14.246 15.811 -11.627 1.00 32.43 H new ATOM 0 HA LYS A 83 16.418 17.175 -10.229 1.00 23.34 H new ATOM 0 HB2 LYS A 83 13.835 17.859 -10.748 1.00 44.43 H new ATOM 0 HB3 LYS A 83 13.620 17.100 -9.183 1.00 44.43 H new ATOM 0 HG2 LYS A 83 15.807 19.142 -9.512 1.00 34.02 H new ATOM 0 HG3 LYS A 83 14.147 19.692 -9.398 1.00 34.02 H new ATOM 0 HD2 LYS A 83 13.858 18.759 -7.225 1.00 14.41 H new ATOM 0 HD3 LYS A 83 15.263 17.724 -7.383 1.00 14.41 H new ATOM 0 HE2 LYS A 83 15.407 20.764 -7.325 1.00 64.23 H new ATOM 0 HE3 LYS A 83 15.590 19.757 -5.902 1.00 64.23 H new ATOM 0 HZ1 LYS A 83 17.752 20.105 -6.600 1.00 32.23 H new ATOM 0 HZ2 LYS A 83 17.410 18.583 -7.271 1.00 32.23 H new ATOM 0 HZ3 LYS A 83 17.373 19.970 -8.250 1.00 32.23 H new ATOM 1318 N GLY A 84 14.715 14.637 -8.973 1.00 4.31 N ATOM 1319 CA GLY A 84 14.758 13.619 -7.940 1.00 24.01 C ATOM 1320 C GLY A 84 14.637 14.202 -6.546 1.00 23.22 C ATOM 1321 O GLY A 84 15.439 13.893 -5.665 1.00 24.32 O ATOM 0 H GLY A 84 13.949 14.539 -9.640 1.00 4.31 H new ATOM 0 HA2 GLY A 84 13.950 12.906 -8.103 1.00 24.01 H new ATOM 0 HA3 GLY A 84 15.693 13.065 -8.019 1.00 24.01 H new TER 1325 GLY A 84