USER MOD reduce.3.24.130724 H: found=0, std=0, add=898, rem=0, adj=21 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 84 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 86 TYR OH : rot 180:sc= 0 USER MOD Set 2.1: A 78 GLN : amide:sc= -0.366 X(o=-0.38,f=-0.095) USER MOD Set 2.2: A 101 LYS NZ :NH3+ -119:sc= -0.0106 (180deg=-0.0413) USER MOD Single : A 1 LYS N :NH3+ 169:sc= 0 (180deg=-0.188) USER MOD Single : A 1 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 THR OG1 : rot 180:sc= 0 USER MOD Single : A 5 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 THR OG1 : rot 180:sc= 0 USER MOD Single : A 15 GLN : amide:sc= 0.0621 K(o=0.062,f=-0.81) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=-0.31) USER MOD Single : A 23 SER OG : rot 180:sc= 0 USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 45:sc= 0.029 USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 38 THR OG1 : rot 180:sc= -0.164 USER MOD Single : A 39 SER OG : rot 180:sc= 0 USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 46 GLN : amide:sc= 0 X(o=0,f=-0.17) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 60 TYR OH : rot 110:sc= 1.45 USER MOD Single : A 61 LYS NZ :NH3+ 173:sc= -4.32! (180deg=-4.36!) USER MOD Single : A 64 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.118) USER MOD Single : A 65 ASN : amide:sc= -0.103 X(o=-0.1,f=-0.19) USER MOD Single : A 67 THR OG1 : rot 15:sc= 0.204 USER MOD Single : A 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HE2:sc= 0 K(o=0,f=-0.53) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 TYR OH : rot -39:sc= 1.26 USER MOD Single : A 82 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 THR OG1 : rot -138:sc= 0.358 USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 91 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 ASN : amide:sc= -0.0683 X(o=-0.068,f=0.051) USER MOD Single : A 96 LYS NZ :NH3+ -159:sc= 0 (180deg=-0.37) USER MOD Single : A 103 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N LYS A 1 21.620 0.657 -21.847 1.00 0.00 N ATOM 2 CA LYS A 1 20.447 0.010 -21.212 1.00 0.00 C ATOM 3 C LYS A 1 19.708 0.973 -20.237 1.00 0.00 C ATOM 4 O LYS A 1 20.333 1.756 -19.516 1.00 0.00 O ATOM 5 CB LYS A 1 20.822 -1.363 -20.585 1.00 0.00 C ATOM 6 CG LYS A 1 21.722 -1.412 -19.317 1.00 0.00 C ATOM 7 CD LYS A 1 23.247 -1.247 -19.506 1.00 0.00 C ATOM 8 CE LYS A 1 23.933 -2.408 -20.253 1.00 0.00 C ATOM 9 NZ LYS A 1 25.388 -2.201 -20.370 1.00 0.00 N ATOM 0 H1 LYS A 1 22.189 -0.061 -22.339 1.00 0.00 H new ATOM 0 H2 LYS A 1 21.295 1.370 -22.531 1.00 0.00 H new ATOM 0 H3 LYS A 1 22.200 1.117 -21.117 1.00 0.00 H new ATOM 0 HA LYS A 1 19.721 -0.214 -21.994 1.00 0.00 H new ATOM 0 HB2 LYS A 1 19.891 -1.876 -20.343 1.00 0.00 H new ATOM 0 HB3 LYS A 1 21.317 -1.950 -21.359 1.00 0.00 H new ATOM 0 HG2 LYS A 1 21.383 -0.631 -18.636 1.00 0.00 H new ATOM 0 HG3 LYS A 1 21.548 -2.366 -18.820 1.00 0.00 H new ATOM 0 HD2 LYS A 1 23.434 -0.322 -20.051 1.00 0.00 H new ATOM 0 HD3 LYS A 1 23.711 -1.139 -18.526 1.00 0.00 H new ATOM 0 HE2 LYS A 1 23.740 -3.343 -19.727 1.00 0.00 H new ATOM 0 HE3 LYS A 1 23.499 -2.507 -21.248 1.00 0.00 H new ATOM 0 HZ1 LYS A 1 25.813 -3.003 -20.878 1.00 0.00 H new ATOM 0 HZ2 LYS A 1 25.573 -1.322 -20.894 1.00 0.00 H new ATOM 0 HZ3 LYS A 1 25.806 -2.132 -19.420 1.00 0.00 H new ATOM 10 N GLU A 2 18.361 0.878 -20.207 1.00 0.00 N ATOM 11 CA GLU A 2 17.503 1.708 -19.309 1.00 0.00 C ATOM 12 C GLU A 2 17.512 1.223 -17.823 1.00 0.00 C ATOM 13 O GLU A 2 17.840 0.065 -17.534 1.00 0.00 O ATOM 14 CB GLU A 2 16.074 1.857 -19.917 1.00 0.00 C ATOM 15 CG GLU A 2 15.135 0.624 -20.008 1.00 0.00 C ATOM 16 CD GLU A 2 14.557 0.112 -18.679 1.00 0.00 C ATOM 17 OE1 GLU A 2 13.928 0.904 -17.942 1.00 0.00 O ATOM 18 OE2 GLU A 2 14.740 -1.083 -18.363 1.00 0.00 O ATOM 0 H GLU A 2 17.834 0.233 -20.795 1.00 0.00 H new ATOM 0 HA GLU A 2 17.938 2.706 -19.257 1.00 0.00 H new ATOM 0 HB2 GLU A 2 15.553 2.619 -19.337 1.00 0.00 H new ATOM 0 HB3 GLU A 2 16.191 2.250 -20.927 1.00 0.00 H new ATOM 0 HG2 GLU A 2 14.305 0.873 -20.669 1.00 0.00 H new ATOM 0 HG3 GLU A 2 15.684 -0.191 -20.479 1.00 0.00 H new ATOM 19 N ILE A 3 17.135 2.124 -16.894 1.00 0.00 N ATOM 20 CA ILE A 3 17.093 1.825 -15.429 1.00 0.00 C ATOM 21 C ILE A 3 15.718 2.212 -14.811 1.00 0.00 C ATOM 22 O ILE A 3 15.090 3.215 -15.170 1.00 0.00 O ATOM 23 CB ILE A 3 18.279 2.454 -14.616 1.00 0.00 C ATOM 24 CG1 ILE A 3 18.484 3.987 -14.811 1.00 0.00 C ATOM 25 CG2 ILE A 3 19.583 1.655 -14.843 1.00 0.00 C ATOM 26 CD1 ILE A 3 19.289 4.684 -13.705 1.00 0.00 C ATOM 0 H ILE A 3 16.851 3.076 -17.125 1.00 0.00 H new ATOM 0 HA ILE A 3 17.220 0.745 -15.347 1.00 0.00 H new ATOM 0 HB ILE A 3 17.988 2.367 -13.569 1.00 0.00 H new ATOM 0 HG12 ILE A 3 18.987 4.152 -15.764 1.00 0.00 H new ATOM 0 HG13 ILE A 3 17.506 4.462 -14.881 1.00 0.00 H new ATOM 0 HG21 ILE A 3 20.392 2.108 -14.270 1.00 0.00 H new ATOM 0 HG22 ILE A 3 19.440 0.625 -14.516 1.00 0.00 H new ATOM 0 HG23 ILE A 3 19.838 1.668 -15.903 1.00 0.00 H new ATOM 0 HD11 ILE A 3 19.376 5.746 -13.933 1.00 0.00 H new ATOM 0 HD12 ILE A 3 18.779 4.558 -12.750 1.00 0.00 H new ATOM 0 HD13 ILE A 3 20.284 4.243 -13.646 1.00 0.00 H new ATOM 27 N THR A 4 15.309 1.409 -13.814 1.00 0.00 N ATOM 28 CA THR A 4 14.059 1.601 -13.038 1.00 0.00 C ATOM 29 C THR A 4 14.244 2.677 -11.912 1.00 0.00 C ATOM 30 O THR A 4 15.361 3.073 -11.553 1.00 0.00 O ATOM 31 CB THR A 4 13.589 0.213 -12.472 1.00 0.00 C ATOM 32 OG1 THR A 4 14.040 -0.915 -13.228 1.00 0.00 O ATOM 33 CG2 THR A 4 12.066 0.083 -12.428 1.00 0.00 C ATOM 0 H THR A 4 15.843 0.593 -13.515 1.00 0.00 H new ATOM 0 HA THR A 4 13.278 1.987 -13.694 1.00 0.00 H new ATOM 0 HB THR A 4 14.031 0.201 -11.476 1.00 0.00 H new ATOM 0 HG1 THR A 4 13.710 -1.740 -12.814 1.00 0.00 H new ATOM 0 HG21 THR A 4 11.796 -0.895 -12.029 1.00 0.00 H new ATOM 0 HG22 THR A 4 11.653 0.863 -11.789 1.00 0.00 H new ATOM 0 HG23 THR A 4 11.663 0.188 -13.435 1.00 0.00 H new ATOM 34 N ASN A 5 13.108 3.118 -11.356 1.00 0.00 N ATOM 35 CA ASN A 5 13.074 3.990 -10.140 1.00 0.00 C ATOM 36 C ASN A 5 12.044 3.395 -9.128 1.00 0.00 C ATOM 37 O ASN A 5 10.965 3.942 -8.874 1.00 0.00 O ATOM 38 CB ASN A 5 12.732 5.451 -10.513 1.00 0.00 C ATOM 39 CG ASN A 5 13.797 6.212 -11.328 1.00 0.00 C ATOM 40 OD1 ASN A 5 14.910 6.450 -10.858 1.00 0.00 O ATOM 41 ND2 ASN A 5 13.481 6.614 -12.548 1.00 0.00 N ATOM 0 H ASN A 5 12.184 2.891 -11.722 1.00 0.00 H new ATOM 0 HA ASN A 5 14.059 4.011 -9.674 1.00 0.00 H new ATOM 0 HB2 ASN A 5 11.801 5.451 -11.081 1.00 0.00 H new ATOM 0 HB3 ASN A 5 12.544 6.005 -9.593 1.00 0.00 H new ATOM 0 HD21 ASN A 5 14.162 7.126 -13.109 1.00 0.00 H new ATOM 0 HD22 ASN A 5 12.556 6.412 -12.928 1.00 0.00 H new ATOM 42 N ALA A 6 12.420 2.229 -8.589 1.00 0.00 N ATOM 43 CA ALA A 6 11.498 1.341 -7.834 1.00 0.00 C ATOM 44 C ALA A 6 12.183 0.596 -6.658 1.00 0.00 C ATOM 45 O ALA A 6 13.401 0.640 -6.447 1.00 0.00 O ATOM 46 CB ALA A 6 10.913 0.327 -8.851 1.00 0.00 C ATOM 0 H ALA A 6 13.370 1.865 -8.658 1.00 0.00 H new ATOM 0 HA ALA A 6 10.721 1.950 -7.373 1.00 0.00 H new ATOM 0 HB1 ALA A 6 10.228 -0.348 -8.339 1.00 0.00 H new ATOM 0 HB2 ALA A 6 10.376 0.864 -9.633 1.00 0.00 H new ATOM 0 HB3 ALA A 6 11.723 -0.249 -9.297 1.00 0.00 H new ATOM 47 N LEU A 7 11.326 -0.098 -5.891 1.00 0.00 N ATOM 48 CA LEU A 7 11.717 -0.942 -4.755 1.00 0.00 C ATOM 49 C LEU A 7 11.702 -2.415 -5.239 1.00 0.00 C ATOM 50 O LEU A 7 10.737 -2.914 -5.830 1.00 0.00 O ATOM 51 CB LEU A 7 10.699 -0.778 -3.595 1.00 0.00 C ATOM 52 CG LEU A 7 10.694 0.529 -2.765 1.00 0.00 C ATOM 53 CD1 LEU A 7 11.979 0.739 -1.942 1.00 0.00 C ATOM 54 CD2 LEU A 7 10.317 1.820 -3.518 1.00 0.00 C ATOM 0 H LEU A 7 10.318 -0.086 -6.049 1.00 0.00 H new ATOM 0 HA LEU A 7 12.706 -0.656 -4.396 1.00 0.00 H new ATOM 0 HB2 LEU A 7 9.701 -0.902 -4.016 1.00 0.00 H new ATOM 0 HB3 LEU A 7 10.857 -1.604 -2.902 1.00 0.00 H new ATOM 0 HG LEU A 7 9.866 0.348 -2.080 1.00 0.00 H new ATOM 0 HD11 LEU A 7 11.906 1.674 -1.386 1.00 0.00 H new ATOM 0 HD12 LEU A 7 12.104 -0.089 -1.245 1.00 0.00 H new ATOM 0 HD13 LEU A 7 12.837 0.782 -2.612 1.00 0.00 H new ATOM 0 HD21 LEU A 7 10.349 2.665 -2.830 1.00 0.00 H new ATOM 0 HD22 LEU A 7 11.024 1.986 -4.331 1.00 0.00 H new ATOM 0 HD23 LEU A 7 9.311 1.723 -3.926 1.00 0.00 H new ATOM 55 N GLU A 8 12.794 -3.095 -4.887 1.00 0.00 N ATOM 56 CA GLU A 8 12.892 -4.578 -4.976 1.00 0.00 C ATOM 57 C GLU A 8 12.296 -5.190 -3.676 1.00 0.00 C ATOM 58 O GLU A 8 12.900 -5.153 -2.602 1.00 0.00 O ATOM 59 CB GLU A 8 14.309 -5.058 -5.392 1.00 0.00 C ATOM 60 CG GLU A 8 15.567 -4.613 -4.608 1.00 0.00 C ATOM 61 CD GLU A 8 15.853 -5.379 -3.314 1.00 0.00 C ATOM 62 OE1 GLU A 8 16.093 -6.605 -3.370 1.00 0.00 O ATOM 63 OE2 GLU A 8 15.853 -4.754 -2.228 1.00 0.00 O ATOM 0 H GLU A 8 13.640 -2.649 -4.532 1.00 0.00 H new ATOM 0 HA GLU A 8 12.286 -4.962 -5.797 1.00 0.00 H new ATOM 0 HB2 GLU A 8 14.293 -6.148 -5.377 1.00 0.00 H new ATOM 0 HB3 GLU A 8 14.456 -4.755 -6.429 1.00 0.00 H new ATOM 0 HG2 GLU A 8 16.433 -4.709 -5.263 1.00 0.00 H new ATOM 0 HG3 GLU A 8 15.466 -3.555 -4.366 1.00 0.00 H new ATOM 64 N THR A 9 11.051 -5.676 -3.803 1.00 0.00 N ATOM 65 CA THR A 9 10.182 -6.038 -2.651 1.00 0.00 C ATOM 66 C THR A 9 9.932 -7.569 -2.774 1.00 0.00 C ATOM 67 O THR A 9 9.337 -8.030 -3.753 1.00 0.00 O ATOM 68 CB THR A 9 8.893 -5.158 -2.697 1.00 0.00 C ATOM 69 OG1 THR A 9 9.238 -3.775 -2.652 1.00 0.00 O ATOM 70 CG2 THR A 9 7.888 -5.402 -1.567 1.00 0.00 C ATOM 0 H THR A 9 10.609 -5.833 -4.709 1.00 0.00 H new ATOM 0 HA THR A 9 10.626 -5.842 -1.675 1.00 0.00 H new ATOM 0 HB THR A 9 8.412 -5.447 -3.631 1.00 0.00 H new ATOM 0 HG1 THR A 9 8.422 -3.233 -2.683 1.00 0.00 H new ATOM 0 HG21 THR A 9 7.031 -4.741 -1.693 1.00 0.00 H new ATOM 0 HG22 THR A 9 7.553 -6.439 -1.595 1.00 0.00 H new ATOM 0 HG23 THR A 9 8.364 -5.200 -0.607 1.00 0.00 H new ATOM 71 N TRP A 10 10.440 -8.355 -1.807 1.00 0.00 N ATOM 72 CA TRP A 10 10.542 -9.838 -1.939 1.00 0.00 C ATOM 73 C TRP A 10 9.796 -10.581 -0.794 1.00 0.00 C ATOM 74 O TRP A 10 9.599 -10.055 0.308 1.00 0.00 O ATOM 75 CB TRP A 10 12.040 -10.251 -2.031 1.00 0.00 C ATOM 76 CG TRP A 10 12.687 -9.977 -3.398 1.00 0.00 C ATOM 77 CD1 TRP A 10 13.435 -8.838 -3.758 1.00 0.00 C ATOM 78 CD2 TRP A 10 12.632 -10.761 -4.539 1.00 0.00 C ATOM 79 NE1 TRP A 10 13.847 -8.889 -5.102 1.00 0.00 N ATOM 80 CE2 TRP A 10 13.336 -10.086 -5.569 1.00 0.00 C ATOM 81 CE3 TRP A 10 12.031 -12.019 -4.789 1.00 0.00 C ATOM 82 CZ2 TRP A 10 13.442 -10.670 -6.856 1.00 0.00 C ATOM 83 CZ3 TRP A 10 12.157 -12.577 -6.060 1.00 0.00 C ATOM 84 CH2 TRP A 10 12.847 -11.913 -7.079 1.00 0.00 C ATOM 0 H TRP A 10 10.790 -7.995 -0.919 1.00 0.00 H new ATOM 0 HA TRP A 10 10.043 -10.140 -2.860 1.00 0.00 H new ATOM 0 HB2 TRP A 10 12.600 -9.717 -1.263 1.00 0.00 H new ATOM 0 HB3 TRP A 10 12.126 -11.314 -1.807 1.00 0.00 H new ATOM 0 HD1 TRP A 10 13.664 -8.025 -3.084 1.00 0.00 H new ATOM 0 HE1 TRP A 10 14.397 -8.200 -5.615 1.00 0.00 H new ATOM 0 HE3 TRP A 10 11.487 -12.535 -4.012 1.00 0.00 H new ATOM 0 HZ2 TRP A 10 13.973 -10.163 -7.649 1.00 0.00 H new ATOM 0 HZ3 TRP A 10 11.713 -13.541 -6.262 1.00 0.00 H new ATOM 0 HH2 TRP A 10 12.921 -12.369 -8.055 1.00 0.00 H new ATOM 85 N GLY A 11 9.396 -11.830 -1.088 1.00 0.00 N ATOM 86 CA GLY A 11 8.685 -12.692 -0.121 1.00 0.00 C ATOM 87 C GLY A 11 8.537 -14.155 -0.583 1.00 0.00 C ATOM 88 O GLY A 11 8.697 -14.490 -1.759 1.00 0.00 O ATOM 0 H GLY A 11 9.554 -12.270 -1.995 1.00 0.00 H new ATOM 0 HA2 GLY A 11 9.219 -12.673 0.829 1.00 0.00 H new ATOM 0 HA3 GLY A 11 7.694 -12.276 0.062 1.00 0.00 H new ATOM 89 N ALA A 12 8.214 -15.031 0.379 1.00 0.00 N ATOM 90 CA ALA A 12 8.039 -16.490 0.134 1.00 0.00 C ATOM 91 C ALA A 12 6.543 -16.925 0.177 1.00 0.00 C ATOM 92 O ALA A 12 5.684 -16.200 0.694 1.00 0.00 O ATOM 93 CB ALA A 12 8.874 -17.225 1.205 1.00 0.00 C ATOM 0 H ALA A 12 8.065 -14.760 1.351 1.00 0.00 H new ATOM 0 HA ALA A 12 8.381 -16.744 -0.869 1.00 0.00 H new ATOM 0 HB1 ALA A 12 8.777 -18.302 1.066 1.00 0.00 H new ATOM 0 HB2 ALA A 12 9.922 -16.939 1.109 1.00 0.00 H new ATOM 0 HB3 ALA A 12 8.513 -16.953 2.197 1.00 0.00 H new ATOM 94 N LEU A 13 6.235 -18.136 -0.354 1.00 0.00 N ATOM 95 CA LEU A 13 4.836 -18.659 -0.419 1.00 0.00 C ATOM 96 C LEU A 13 4.132 -18.791 0.971 1.00 0.00 C ATOM 97 O LEU A 13 4.680 -19.364 1.917 1.00 0.00 O ATOM 98 CB LEU A 13 4.697 -20.002 -1.205 1.00 0.00 C ATOM 99 CG LEU A 13 4.704 -19.899 -2.756 1.00 0.00 C ATOM 100 CD1 LEU A 13 6.119 -19.894 -3.324 1.00 0.00 C ATOM 101 CD2 LEU A 13 3.865 -20.986 -3.452 1.00 0.00 C ATOM 0 H LEU A 13 6.932 -18.771 -0.744 1.00 0.00 H new ATOM 0 HA LEU A 13 4.317 -17.882 -0.980 1.00 0.00 H new ATOM 0 HB2 LEU A 13 5.511 -20.661 -0.903 1.00 0.00 H new ATOM 0 HB3 LEU A 13 3.768 -20.483 -0.899 1.00 0.00 H new ATOM 0 HG LEU A 13 4.232 -18.940 -2.972 1.00 0.00 H new ATOM 0 HD11 LEU A 13 6.075 -19.821 -4.411 1.00 0.00 H new ATOM 0 HD12 LEU A 13 6.668 -19.041 -2.925 1.00 0.00 H new ATOM 0 HD13 LEU A 13 6.627 -20.816 -3.043 1.00 0.00 H new ATOM 0 HD21 LEU A 13 3.917 -20.850 -4.532 1.00 0.00 H new ATOM 0 HD22 LEU A 13 4.255 -21.970 -3.191 1.00 0.00 H new ATOM 0 HD23 LEU A 13 2.828 -20.909 -3.127 1.00 0.00 H new ATOM 102 N GLY A 14 2.915 -18.229 1.052 1.00 0.00 N ATOM 103 CA GLY A 14 2.126 -18.131 2.300 1.00 0.00 C ATOM 104 C GLY A 14 2.671 -17.114 3.326 1.00 0.00 C ATOM 105 O GLY A 14 3.155 -17.544 4.375 1.00 0.00 O ATOM 0 H GLY A 14 2.442 -17.823 0.245 1.00 0.00 H new ATOM 0 HA2 GLY A 14 1.102 -17.858 2.046 1.00 0.00 H new ATOM 0 HA3 GLY A 14 2.087 -19.115 2.768 1.00 0.00 H new ATOM 106 N GLN A 15 2.623 -15.794 3.024 1.00 0.00 N ATOM 107 CA GLN A 15 3.294 -14.769 3.887 1.00 0.00 C ATOM 108 C GLN A 15 2.554 -13.404 3.819 1.00 0.00 C ATOM 109 O GLN A 15 2.429 -12.819 2.747 1.00 0.00 O ATOM 110 CB GLN A 15 4.789 -14.649 3.466 1.00 0.00 C ATOM 111 CG GLN A 15 5.716 -13.919 4.467 1.00 0.00 C ATOM 112 CD GLN A 15 7.191 -13.867 4.014 1.00 0.00 C ATOM 113 OE1 GLN A 15 7.774 -14.865 3.594 1.00 0.00 O ATOM 114 NE2 GLN A 15 7.837 -12.714 4.109 1.00 0.00 N ATOM 0 H GLN A 15 2.141 -15.412 2.211 1.00 0.00 H new ATOM 0 HA GLN A 15 3.252 -15.087 4.929 1.00 0.00 H new ATOM 0 HB2 GLN A 15 5.182 -15.652 3.302 1.00 0.00 H new ATOM 0 HB3 GLN A 15 4.837 -14.128 2.510 1.00 0.00 H new ATOM 0 HG2 GLN A 15 5.352 -12.902 4.611 1.00 0.00 H new ATOM 0 HG3 GLN A 15 5.658 -14.418 5.434 1.00 0.00 H new ATOM 0 HE21 GLN A 15 7.354 -11.886 4.457 1.00 0.00 H new ATOM 0 HE22 GLN A 15 8.817 -12.655 3.834 1.00 0.00 H new ATOM 115 N ASP A 16 2.115 -12.852 4.965 1.00 0.00 N ATOM 116 CA ASP A 16 1.401 -11.533 5.004 1.00 0.00 C ATOM 117 C ASP A 16 2.414 -10.360 4.824 1.00 0.00 C ATOM 118 O ASP A 16 3.334 -10.205 5.633 1.00 0.00 O ATOM 119 CB ASP A 16 0.614 -11.323 6.324 1.00 0.00 C ATOM 120 CG ASP A 16 -0.553 -12.282 6.646 1.00 0.00 C ATOM 121 OD1 ASP A 16 -0.481 -13.489 6.333 1.00 0.00 O ATOM 122 OD2 ASP A 16 -1.550 -11.811 7.238 1.00 0.00 O ATOM 0 H ASP A 16 2.235 -13.286 5.880 1.00 0.00 H new ATOM 0 HA ASP A 16 0.685 -11.542 4.182 1.00 0.00 H new ATOM 0 HB2 ASP A 16 1.326 -11.379 7.147 1.00 0.00 H new ATOM 0 HB3 ASP A 16 0.216 -10.308 6.315 1.00 0.00 H new ATOM 123 N ILE A 17 2.266 -9.583 3.732 1.00 0.00 N ATOM 124 CA ILE A 17 3.314 -8.611 3.270 1.00 0.00 C ATOM 125 C ILE A 17 2.609 -7.266 2.900 1.00 0.00 C ATOM 126 O ILE A 17 1.616 -7.252 2.166 1.00 0.00 O ATOM 127 CB ILE A 17 4.177 -9.229 2.105 1.00 0.00 C ATOM 128 CG1 ILE A 17 5.077 -10.418 2.575 1.00 0.00 C ATOM 129 CG2 ILE A 17 5.080 -8.197 1.376 1.00 0.00 C ATOM 130 CD1 ILE A 17 5.404 -11.432 1.474 1.00 0.00 C ATOM 0 H ILE A 17 1.433 -9.600 3.143 1.00 0.00 H new ATOM 0 HA ILE A 17 4.029 -8.399 4.065 1.00 0.00 H new ATOM 0 HB ILE A 17 3.427 -9.593 1.403 1.00 0.00 H new ATOM 0 HG12 ILE A 17 6.009 -10.018 2.973 1.00 0.00 H new ATOM 0 HG13 ILE A 17 4.577 -10.936 3.393 1.00 0.00 H new ATOM 0 HG21 ILE A 17 5.642 -8.698 0.588 1.00 0.00 H new ATOM 0 HG22 ILE A 17 4.459 -7.416 0.938 1.00 0.00 H new ATOM 0 HG23 ILE A 17 5.773 -7.752 2.090 1.00 0.00 H new ATOM 0 HD11 ILE A 17 6.032 -12.224 1.883 1.00 0.00 H new ATOM 0 HD12 ILE A 17 4.479 -11.863 1.090 1.00 0.00 H new ATOM 0 HD13 ILE A 17 5.934 -10.931 0.664 1.00 0.00 H new ATOM 131 N ASN A 18 3.181 -6.135 3.360 1.00 0.00 N ATOM 132 CA ASN A 18 2.606 -4.774 3.160 1.00 0.00 C ATOM 133 C ASN A 18 3.127 -4.047 1.877 1.00 0.00 C ATOM 134 O ASN A 18 4.147 -4.438 1.293 1.00 0.00 O ATOM 135 CB ASN A 18 2.897 -3.921 4.438 1.00 0.00 C ATOM 136 CG ASN A 18 2.135 -4.308 5.727 1.00 0.00 C ATOM 137 OD1 ASN A 18 1.499 -5.356 5.838 1.00 0.00 O ATOM 138 ND2 ASN A 18 2.188 -3.458 6.741 1.00 0.00 N ATOM 0 H ASN A 18 4.057 -6.131 3.883 1.00 0.00 H new ATOM 0 HA ASN A 18 1.533 -4.890 3.005 1.00 0.00 H new ATOM 0 HB2 ASN A 18 3.965 -3.976 4.646 1.00 0.00 H new ATOM 0 HB3 ASN A 18 2.670 -2.880 4.210 1.00 0.00 H new ATOM 0 HD21 ASN A 18 1.702 -3.672 7.612 1.00 0.00 H new ATOM 0 HD22 ASN A 18 2.715 -2.589 6.651 1.00 0.00 H new ATOM 139 N LEU A 19 2.435 -2.952 1.479 1.00 0.00 N ATOM 140 CA LEU A 19 3.009 -1.923 0.556 1.00 0.00 C ATOM 141 C LEU A 19 3.048 -0.599 1.347 1.00 0.00 C ATOM 142 O LEU A 19 2.016 0.006 1.665 1.00 0.00 O ATOM 143 CB LEU A 19 2.317 -1.764 -0.830 1.00 0.00 C ATOM 144 CG LEU A 19 2.601 -2.892 -1.853 1.00 0.00 C ATOM 145 CD1 LEU A 19 1.908 -2.544 -3.175 1.00 0.00 C ATOM 146 CD2 LEU A 19 4.090 -3.198 -2.129 1.00 0.00 C ATOM 0 H LEU A 19 1.480 -2.752 1.778 1.00 0.00 H new ATOM 0 HA LEU A 19 4.002 -2.261 0.260 1.00 0.00 H new ATOM 0 HB2 LEU A 19 1.240 -1.703 -0.673 1.00 0.00 H new ATOM 0 HB3 LEU A 19 2.630 -0.815 -1.266 1.00 0.00 H new ATOM 0 HG LEU A 19 2.207 -3.800 -1.396 1.00 0.00 H new ATOM 0 HD11 LEU A 19 2.100 -3.331 -3.905 1.00 0.00 H new ATOM 0 HD12 LEU A 19 0.834 -2.456 -3.011 1.00 0.00 H new ATOM 0 HD13 LEU A 19 2.296 -1.598 -3.551 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.167 -4.003 -2.859 1.00 0.00 H new ATOM 0 HD22 LEU A 19 4.578 -2.306 -2.520 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.577 -3.501 -1.202 1.00 0.00 H new ATOM 147 N ASP A 20 4.289 -0.201 1.670 1.00 0.00 N ATOM 148 CA ASP A 20 4.576 0.879 2.636 1.00 0.00 C ATOM 149 C ASP A 20 5.052 2.127 1.837 1.00 0.00 C ATOM 150 O ASP A 20 6.200 2.220 1.389 1.00 0.00 O ATOM 151 CB ASP A 20 5.619 0.356 3.664 1.00 0.00 C ATOM 152 CG ASP A 20 5.818 1.280 4.874 1.00 0.00 C ATOM 153 OD1 ASP A 20 5.003 1.218 5.819 1.00 0.00 O ATOM 154 OD2 ASP A 20 6.782 2.078 4.876 1.00 0.00 O ATOM 0 H ASP A 20 5.128 -0.620 1.268 1.00 0.00 H new ATOM 0 HA ASP A 20 3.696 1.178 3.206 1.00 0.00 H new ATOM 0 HB2 ASP A 20 5.305 -0.626 4.017 1.00 0.00 H new ATOM 0 HB3 ASP A 20 6.576 0.223 3.160 1.00 0.00 H new ATOM 155 N ILE A 21 4.134 3.094 1.717 1.00 0.00 N ATOM 156 CA ILE A 21 4.422 4.477 1.235 1.00 0.00 C ATOM 157 C ILE A 21 5.335 5.349 2.189 1.00 0.00 C ATOM 158 O ILE A 21 6.178 6.049 1.620 1.00 0.00 O ATOM 159 CB ILE A 21 3.127 5.321 0.871 1.00 0.00 C ATOM 160 CG1 ILE A 21 1.816 4.530 0.579 1.00 0.00 C ATOM 161 CG2 ILE A 21 3.469 6.286 -0.293 1.00 0.00 C ATOM 162 CD1 ILE A 21 0.519 5.347 0.510 1.00 0.00 C ATOM 0 H ILE A 21 3.152 2.949 1.952 1.00 0.00 H new ATOM 0 HA ILE A 21 4.986 4.273 0.325 1.00 0.00 H new ATOM 0 HB ILE A 21 2.875 5.858 1.785 1.00 0.00 H new ATOM 0 HG12 ILE A 21 1.939 4.006 -0.369 1.00 0.00 H new ATOM 0 HG13 ILE A 21 1.698 3.769 1.351 1.00 0.00 H new ATOM 0 HG21 ILE A 21 2.587 6.871 -0.552 1.00 0.00 H new ATOM 0 HG22 ILE A 21 4.272 6.956 0.014 1.00 0.00 H new ATOM 0 HG23 ILE A 21 3.790 5.710 -1.161 1.00 0.00 H new ATOM 0 HD11 ILE A 21 -0.319 4.682 0.301 1.00 0.00 H new ATOM 0 HD12 ILE A 21 0.355 5.850 1.463 1.00 0.00 H new ATOM 0 HD13 ILE A 21 0.599 6.090 -0.283 1.00 0.00 H new ATOM 163 N PRO A 22 5.199 5.403 3.558 1.00 0.00 N ATOM 164 CA PRO A 22 5.819 6.450 4.428 1.00 0.00 C ATOM 165 C PRO A 22 7.343 6.774 4.350 1.00 0.00 C ATOM 166 O PRO A 22 8.108 6.169 3.593 1.00 0.00 O ATOM 167 CB PRO A 22 5.371 6.000 5.837 1.00 0.00 C ATOM 168 CG PRO A 22 4.006 5.364 5.636 1.00 0.00 C ATOM 169 CD PRO A 22 4.149 4.663 4.288 1.00 0.00 C ATOM 0 HA PRO A 22 5.480 7.425 4.079 1.00 0.00 H new ATOM 0 HB2 PRO A 22 6.077 5.289 6.267 1.00 0.00 H new ATOM 0 HB3 PRO A 22 5.314 6.846 6.521 1.00 0.00 H new ATOM 0 HG2 PRO A 22 3.767 4.660 6.433 1.00 0.00 H new ATOM 0 HG3 PRO A 22 3.211 6.110 5.621 1.00 0.00 H new ATOM 0 HD2 PRO A 22 4.427 3.617 4.419 1.00 0.00 H new ATOM 0 HD3 PRO A 22 3.208 4.676 3.739 1.00 0.00 H new ATOM 170 N SER A 23 7.716 7.807 5.133 1.00 0.00 N ATOM 171 CA SER A 23 8.896 8.696 4.923 1.00 0.00 C ATOM 172 C SER A 23 8.460 9.908 4.041 1.00 0.00 C ATOM 173 O SER A 23 8.809 10.006 2.859 1.00 0.00 O ATOM 174 CB SER A 23 10.228 8.024 4.506 1.00 0.00 C ATOM 175 OG SER A 23 11.315 8.931 4.626 1.00 0.00 O ATOM 0 H SER A 23 7.186 8.062 5.966 1.00 0.00 H new ATOM 0 HA SER A 23 9.194 9.056 5.908 1.00 0.00 H new ATOM 0 HB2 SER A 23 10.409 7.149 5.130 1.00 0.00 H new ATOM 0 HB3 SER A 23 10.155 7.672 3.477 1.00 0.00 H new ATOM 0 HG SER A 23 12.145 8.484 4.359 1.00 0.00 H new ATOM 176 N PHE A 24 7.637 10.796 4.638 1.00 0.00 N ATOM 177 CA PHE A 24 6.931 11.900 3.931 1.00 0.00 C ATOM 178 C PHE A 24 6.365 12.907 4.986 1.00 0.00 C ATOM 179 O PHE A 24 6.230 12.600 6.182 1.00 0.00 O ATOM 180 CB PHE A 24 5.817 11.319 2.987 1.00 0.00 C ATOM 181 CG PHE A 24 5.288 12.264 1.890 1.00 0.00 C ATOM 182 CD1 PHE A 24 6.166 12.802 0.938 1.00 0.00 C ATOM 183 CD2 PHE A 24 3.926 12.592 1.825 1.00 0.00 C ATOM 184 CE1 PHE A 24 5.694 13.673 -0.039 1.00 0.00 C ATOM 185 CE2 PHE A 24 3.456 13.453 0.835 1.00 0.00 C ATOM 186 CZ PHE A 24 4.343 13.997 -0.089 1.00 0.00 C ATOM 0 H PHE A 24 7.438 10.771 5.638 1.00 0.00 H new ATOM 0 HA PHE A 24 7.626 12.445 3.292 1.00 0.00 H new ATOM 0 HB2 PHE A 24 6.210 10.423 2.506 1.00 0.00 H new ATOM 0 HB3 PHE A 24 4.975 11.006 3.604 1.00 0.00 H new ATOM 0 HD1 PHE A 24 7.213 12.539 0.963 1.00 0.00 H new ATOM 0 HD2 PHE A 24 3.238 12.175 2.546 1.00 0.00 H new ATOM 0 HE1 PHE A 24 6.378 14.098 -0.759 1.00 0.00 H new ATOM 0 HE2 PHE A 24 2.405 13.698 0.785 1.00 0.00 H new ATOM 0 HZ PHE A 24 3.980 14.674 -0.848 1.00 0.00 H new ATOM 187 N GLN A 25 5.993 14.118 4.524 1.00 0.00 N ATOM 188 CA GLN A 25 5.324 15.154 5.368 1.00 0.00 C ATOM 189 C GLN A 25 3.943 14.669 5.922 1.00 0.00 C ATOM 190 O GLN A 25 3.193 13.960 5.241 1.00 0.00 O ATOM 191 CB GLN A 25 5.192 16.458 4.528 1.00 0.00 C ATOM 192 CG GLN A 25 4.838 17.724 5.342 1.00 0.00 C ATOM 193 CD GLN A 25 4.715 18.991 4.482 1.00 0.00 C ATOM 194 OE1 GLN A 25 5.708 19.649 4.167 1.00 0.00 O ATOM 195 NE2 GLN A 25 3.506 19.358 4.089 1.00 0.00 N ATOM 0 H GLN A 25 6.143 14.414 3.560 1.00 0.00 H new ATOM 0 HA GLN A 25 5.935 15.348 6.250 1.00 0.00 H new ATOM 0 HB2 GLN A 25 6.132 16.632 4.004 1.00 0.00 H new ATOM 0 HB3 GLN A 25 4.426 16.307 3.767 1.00 0.00 H new ATOM 0 HG2 GLN A 25 3.897 17.558 5.866 1.00 0.00 H new ATOM 0 HG3 GLN A 25 5.603 17.883 6.102 1.00 0.00 H new ATOM 0 HE21 GLN A 25 2.693 18.804 4.357 1.00 0.00 H new ATOM 0 HE22 GLN A 25 3.387 20.195 3.518 1.00 0.00 H new ATOM 196 N MET A 26 3.638 15.059 7.177 1.00 0.00 N ATOM 197 CA MET A 26 2.445 14.577 7.934 1.00 0.00 C ATOM 198 C MET A 26 1.084 14.895 7.246 1.00 0.00 C ATOM 199 O MET A 26 0.943 15.909 6.553 1.00 0.00 O ATOM 200 CB MET A 26 2.460 15.183 9.367 1.00 0.00 C ATOM 201 CG MET A 26 3.612 14.721 10.280 1.00 0.00 C ATOM 202 SD MET A 26 3.456 15.497 11.906 1.00 0.00 S ATOM 203 CE MET A 26 2.313 14.383 12.749 1.00 0.00 C ATOM 0 H MET A 26 4.210 15.720 7.703 1.00 0.00 H new ATOM 0 HA MET A 26 2.522 13.490 7.967 1.00 0.00 H new ATOM 0 HB2 MET A 26 2.503 16.269 9.281 1.00 0.00 H new ATOM 0 HB3 MET A 26 1.516 14.939 9.854 1.00 0.00 H new ATOM 0 HG2 MET A 26 3.594 13.636 10.382 1.00 0.00 H new ATOM 0 HG3 MET A 26 4.570 14.984 9.832 1.00 0.00 H new ATOM 0 HE1 MET A 26 2.132 14.745 13.761 1.00 0.00 H new ATOM 0 HE2 MET A 26 1.371 14.346 12.202 1.00 0.00 H new ATOM 0 HE3 MET A 26 2.746 13.384 12.794 1.00 0.00 H new ATOM 204 N SER A 27 0.093 14.002 7.452 1.00 0.00 N ATOM 205 CA SER A 27 -1.242 14.099 6.802 1.00 0.00 C ATOM 206 C SER A 27 -2.206 15.024 7.581 1.00 0.00 C ATOM 207 O SER A 27 -3.037 14.616 8.400 1.00 0.00 O ATOM 208 CB SER A 27 -1.823 12.707 6.502 1.00 0.00 C ATOM 209 OG SER A 27 -1.953 11.890 7.662 1.00 0.00 O ATOM 0 H SER A 27 0.189 13.196 8.069 1.00 0.00 H new ATOM 0 HA SER A 27 -1.107 14.582 5.834 1.00 0.00 H new ATOM 0 HB2 SER A 27 -2.801 12.822 6.035 1.00 0.00 H new ATOM 0 HB3 SER A 27 -1.182 12.201 5.779 1.00 0.00 H new ATOM 0 HG SER A 27 -2.337 12.418 8.393 1.00 0.00 H new ATOM 210 N ASP A 28 -2.034 16.302 7.247 1.00 0.00 N ATOM 211 CA ASP A 28 -2.856 17.433 7.759 1.00 0.00 C ATOM 212 C ASP A 28 -3.923 17.802 6.687 1.00 0.00 C ATOM 213 O ASP A 28 -5.108 17.560 6.929 1.00 0.00 O ATOM 214 CB ASP A 28 -1.957 18.624 8.201 1.00 0.00 C ATOM 215 CG ASP A 28 -1.043 18.334 9.404 1.00 0.00 C ATOM 216 OD1 ASP A 28 0.102 17.869 9.194 1.00 0.00 O ATOM 217 OD2 ASP A 28 -1.468 18.560 10.559 1.00 0.00 O ATOM 0 H ASP A 28 -1.306 16.602 6.599 1.00 0.00 H new ATOM 0 HA ASP A 28 -3.392 17.140 8.662 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -1.337 18.925 7.357 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -2.597 19.472 8.445 1.00 0.00 H new ATOM 218 N ASP A 29 -3.513 18.319 5.506 1.00 0.00 N ATOM 219 CA ASP A 29 -4.387 18.388 4.301 1.00 0.00 C ATOM 220 C ASP A 29 -3.869 17.366 3.235 1.00 0.00 C ATOM 221 O ASP A 29 -3.348 17.748 2.185 1.00 0.00 O ATOM 222 CB ASP A 29 -4.445 19.875 3.841 1.00 0.00 C ATOM 223 CG ASP A 29 -5.490 20.178 2.757 1.00 0.00 C ATOM 224 OD1 ASP A 29 -6.665 20.432 3.110 1.00 0.00 O ATOM 225 OD2 ASP A 29 -5.146 20.162 1.556 1.00 0.00 O ATOM 0 H ASP A 29 -2.578 18.698 5.357 1.00 0.00 H new ATOM 0 HA ASP A 29 -5.417 18.089 4.497 1.00 0.00 H new ATOM 0 HB2 ASP A 29 -4.652 20.501 4.709 1.00 0.00 H new ATOM 0 HB3 ASP A 29 -3.462 20.163 3.468 1.00 0.00 H new ATOM 226 N ILE A 30 -4.031 16.056 3.531 1.00 0.00 N ATOM 227 CA ILE A 30 -3.604 14.938 2.633 1.00 0.00 C ATOM 228 C ILE A 30 -4.644 13.802 2.904 1.00 0.00 C ATOM 229 O ILE A 30 -4.765 13.331 4.041 1.00 0.00 O ATOM 230 CB ILE A 30 -2.122 14.433 2.838 1.00 0.00 C ATOM 231 CG1 ILE A 30 -1.038 15.556 2.891 1.00 0.00 C ATOM 232 CG2 ILE A 30 -1.756 13.398 1.742 1.00 0.00 C ATOM 233 CD1 ILE A 30 0.410 15.132 3.199 1.00 0.00 C ATOM 0 H ILE A 30 -4.461 15.735 4.398 1.00 0.00 H new ATOM 0 HA ILE A 30 -3.590 15.281 1.598 1.00 0.00 H new ATOM 0 HB ILE A 30 -2.112 13.975 3.827 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -1.041 16.072 1.931 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -1.343 16.283 3.644 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -0.732 13.056 1.892 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -2.435 12.548 1.803 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -1.843 13.862 0.760 1.00 0.00 H new ATOM 0 HD11 ILE A 30 1.053 16.012 3.204 1.00 0.00 H new ATOM 0 HD12 ILE A 30 0.448 14.649 4.175 1.00 0.00 H new ATOM 0 HD13 ILE A 30 0.755 14.435 2.436 1.00 0.00 H new ATOM 234 N ASP A 31 -5.382 13.364 1.859 1.00 0.00 N ATOM 235 CA ASP A 31 -6.543 12.435 2.022 1.00 0.00 C ATOM 236 C ASP A 31 -6.605 11.230 1.031 1.00 0.00 C ATOM 237 O ASP A 31 -6.922 10.119 1.469 1.00 0.00 O ATOM 238 CB ASP A 31 -7.882 13.237 2.014 1.00 0.00 C ATOM 239 CG ASP A 31 -8.610 13.238 3.366 1.00 0.00 C ATOM 240 OD1 ASP A 31 -9.075 12.159 3.797 1.00 0.00 O ATOM 241 OD2 ASP A 31 -8.717 14.308 4.004 1.00 0.00 O ATOM 0 H ASP A 31 -5.201 13.634 0.892 1.00 0.00 H new ATOM 0 HA ASP A 31 -6.386 11.964 2.992 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -7.677 14.267 1.721 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -8.543 12.816 1.256 1.00 0.00 H new ATOM 242 N ASP A 32 -6.375 11.442 -0.281 1.00 0.00 N ATOM 243 CA ASP A 32 -6.558 10.396 -1.323 1.00 0.00 C ATOM 244 C ASP A 32 -5.234 9.595 -1.501 1.00 0.00 C ATOM 245 O ASP A 32 -4.152 10.165 -1.672 1.00 0.00 O ATOM 246 CB ASP A 32 -7.038 11.127 -2.611 1.00 0.00 C ATOM 247 CG ASP A 32 -7.290 10.338 -3.911 1.00 0.00 C ATOM 248 OD1 ASP A 32 -6.902 9.156 -4.035 1.00 0.00 O ATOM 249 OD2 ASP A 32 -7.875 10.934 -4.841 1.00 0.00 O ATOM 0 H ASP A 32 -6.058 12.337 -0.653 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.308 9.653 -1.051 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -7.966 11.641 -2.362 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -6.299 11.895 -2.839 1.00 0.00 H new ATOM 250 N ILE A 33 -5.363 8.260 -1.451 1.00 0.00 N ATOM 251 CA ILE A 33 -4.226 7.310 -1.658 1.00 0.00 C ATOM 252 C ILE A 33 -4.686 6.284 -2.743 1.00 0.00 C ATOM 253 O ILE A 33 -5.867 5.958 -2.858 1.00 0.00 O ATOM 254 CB ILE A 33 -3.737 6.688 -0.293 1.00 0.00 C ATOM 255 CG1 ILE A 33 -2.886 7.684 0.563 1.00 0.00 C ATOM 256 CG2 ILE A 33 -2.955 5.355 -0.417 1.00 0.00 C ATOM 257 CD1 ILE A 33 -3.664 8.490 1.612 1.00 0.00 C ATOM 0 H ILE A 33 -6.252 7.795 -1.267 1.00 0.00 H new ATOM 0 HA ILE A 33 -3.331 7.810 -2.030 1.00 0.00 H new ATOM 0 HB ILE A 33 -4.677 6.470 0.214 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -2.103 7.121 1.071 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -2.390 8.382 -0.111 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -2.664 5.011 0.575 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -3.588 4.604 -0.890 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -2.063 5.512 -1.023 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -2.979 9.148 2.147 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -4.429 9.088 1.117 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -4.137 7.807 2.318 1.00 0.00 H new ATOM 258 N LYS A 34 -3.731 5.763 -3.533 1.00 0.00 N ATOM 259 CA LYS A 34 -4.034 4.800 -4.623 1.00 0.00 C ATOM 260 C LYS A 34 -2.826 3.877 -4.872 1.00 0.00 C ATOM 261 O LYS A 34 -1.687 4.341 -4.963 1.00 0.00 O ATOM 262 CB LYS A 34 -4.429 5.632 -5.886 1.00 0.00 C ATOM 263 CG LYS A 34 -4.752 4.875 -7.195 1.00 0.00 C ATOM 264 CD LYS A 34 -5.107 5.846 -8.344 1.00 0.00 C ATOM 265 CE LYS A 34 -5.586 5.124 -9.615 1.00 0.00 C ATOM 266 NZ LYS A 34 -5.817 6.054 -10.733 1.00 0.00 N ATOM 0 H LYS A 34 -2.740 5.989 -3.442 1.00 0.00 H new ATOM 0 HA LYS A 34 -4.863 4.145 -4.357 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -5.300 6.234 -5.627 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -3.614 6.324 -6.096 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -3.895 4.266 -7.484 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -5.585 4.193 -7.025 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -5.885 6.530 -8.006 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -4.233 6.451 -8.584 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -4.844 4.382 -9.910 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -6.508 4.584 -9.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -6.138 5.522 -11.567 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -6.544 6.747 -10.463 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -4.932 6.551 -10.960 1.00 0.00 H new ATOM 267 N TRP A 35 -3.115 2.576 -5.051 1.00 0.00 N ATOM 268 CA TRP A 35 -2.136 1.620 -5.624 1.00 0.00 C ATOM 269 C TRP A 35 -2.802 0.962 -6.857 1.00 0.00 C ATOM 270 O TRP A 35 -3.839 0.277 -6.785 1.00 0.00 O ATOM 271 CB TRP A 35 -1.642 0.536 -4.651 1.00 0.00 C ATOM 272 CG TRP A 35 -0.800 1.086 -3.488 1.00 0.00 C ATOM 273 CD1 TRP A 35 -1.199 1.588 -2.235 1.00 0.00 C ATOM 274 CD2 TRP A 35 0.558 1.139 -3.465 1.00 0.00 C ATOM 275 NE1 TRP A 35 -0.109 1.902 -1.407 1.00 0.00 N ATOM 276 CE2 TRP A 35 0.981 1.610 -2.197 1.00 0.00 C ATOM 277 CE3 TRP A 35 1.495 0.757 -4.442 1.00 0.00 C ATOM 278 CZ2 TRP A 35 2.358 1.658 -1.890 1.00 0.00 C ATOM 279 CZ3 TRP A 35 2.840 0.800 -4.121 1.00 0.00 C ATOM 280 CH2 TRP A 35 3.261 1.216 -2.857 1.00 0.00 C ATOM 0 H TRP A 35 -4.014 2.158 -4.810 1.00 0.00 H new ATOM 0 HA TRP A 35 -1.241 2.185 -5.883 1.00 0.00 H new ATOM 0 HB2 TRP A 35 -2.503 0.005 -4.245 1.00 0.00 H new ATOM 0 HB3 TRP A 35 -1.050 -0.193 -5.204 1.00 0.00 H new ATOM 0 HD1 TRP A 35 -2.230 1.718 -1.942 1.00 0.00 H new ATOM 0 HE1 TRP A 35 -0.121 2.260 -0.452 1.00 0.00 H new ATOM 0 HE3 TRP A 35 1.171 0.437 -5.421 1.00 0.00 H new ATOM 0 HZ2 TRP A 35 2.702 2.026 -0.935 1.00 0.00 H new ATOM 0 HZ3 TRP A 35 3.574 0.508 -4.858 1.00 0.00 H new ATOM 0 HH2 TRP A 35 4.315 1.195 -2.621 1.00 0.00 H new ATOM 281 N GLU A 36 -2.108 1.221 -7.971 1.00 0.00 N ATOM 282 CA GLU A 36 -2.414 0.689 -9.315 1.00 0.00 C ATOM 283 C GLU A 36 -1.259 -0.237 -9.806 1.00 0.00 C ATOM 284 O GLU A 36 -0.355 -0.612 -9.049 1.00 0.00 O ATOM 285 CB GLU A 36 -2.732 1.918 -10.228 1.00 0.00 C ATOM 286 CG GLU A 36 -1.581 2.926 -10.492 1.00 0.00 C ATOM 287 CD GLU A 36 -1.997 4.104 -11.371 1.00 0.00 C ATOM 288 OE1 GLU A 36 -1.917 3.989 -12.612 1.00 0.00 O ATOM 289 OE2 GLU A 36 -2.399 5.157 -10.826 1.00 0.00 O ATOM 0 H GLU A 36 -1.288 1.828 -7.967 1.00 0.00 H new ATOM 0 HA GLU A 36 -3.289 0.039 -9.328 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -3.079 1.542 -11.191 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -3.563 2.464 -9.781 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -1.214 3.305 -9.538 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -0.751 2.403 -10.967 1.00 0.00 H new ATOM 290 N LYS A 37 -1.303 -0.623 -11.093 1.00 0.00 N ATOM 291 CA LYS A 37 -0.238 -1.432 -11.756 1.00 0.00 C ATOM 292 C LYS A 37 1.223 -0.873 -11.758 1.00 0.00 C ATOM 293 O LYS A 37 1.437 0.332 -11.627 1.00 0.00 O ATOM 294 CB LYS A 37 -0.734 -1.629 -13.223 1.00 0.00 C ATOM 295 CG LYS A 37 -0.607 -0.436 -14.221 1.00 0.00 C ATOM 296 CD LYS A 37 -1.679 0.673 -14.123 1.00 0.00 C ATOM 297 CE LYS A 37 -1.541 1.821 -15.142 1.00 0.00 C ATOM 298 NZ LYS A 37 -1.739 1.416 -16.547 1.00 0.00 N ATOM 0 H LYS A 37 -2.077 -0.387 -11.714 1.00 0.00 H new ATOM 0 HA LYS A 37 -0.123 -2.344 -11.170 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -0.190 -2.474 -13.646 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -1.785 -1.915 -13.181 1.00 0.00 H new ATOM 0 HG2 LYS A 37 0.371 0.024 -14.078 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -0.625 -0.837 -15.234 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -2.661 0.217 -14.247 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -1.648 1.096 -13.119 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -2.264 2.598 -14.895 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -0.550 2.264 -15.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -1.630 2.245 -17.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -1.033 0.697 -16.804 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -2.694 1.021 -16.663 1.00 0.00 H new ATOM 299 N THR A 38 2.231 -1.724 -12.042 1.00 0.00 N ATOM 300 CA THR A 38 2.865 -1.724 -13.399 1.00 0.00 C ATOM 301 C THR A 38 3.093 -3.204 -13.865 1.00 0.00 C ATOM 302 O THR A 38 4.225 -3.691 -13.940 1.00 0.00 O ATOM 303 CB THR A 38 4.135 -0.826 -13.550 1.00 0.00 C ATOM 304 OG1 THR A 38 5.125 -1.148 -12.578 1.00 0.00 O ATOM 305 CG2 THR A 38 3.899 0.688 -13.503 1.00 0.00 C ATOM 0 H THR A 38 2.620 -2.400 -11.385 1.00 0.00 H new ATOM 0 HA THR A 38 2.160 -1.238 -14.074 1.00 0.00 H new ATOM 0 HB THR A 38 4.474 -1.059 -14.560 1.00 0.00 H new ATOM 0 HG1 THR A 38 5.906 -0.569 -12.702 1.00 0.00 H new ATOM 0 HG21 THR A 38 4.850 1.208 -13.618 1.00 0.00 H new ATOM 0 HG22 THR A 38 3.227 0.977 -14.312 1.00 0.00 H new ATOM 0 HG23 THR A 38 3.451 0.957 -12.546 1.00 0.00 H new ATOM 306 N SER A 39 1.983 -3.892 -14.211 1.00 0.00 N ATOM 307 CA SER A 39 1.967 -5.273 -14.776 1.00 0.00 C ATOM 308 C SER A 39 0.525 -5.597 -15.278 1.00 0.00 C ATOM 309 O SER A 39 0.336 -5.790 -16.482 1.00 0.00 O ATOM 310 CB SER A 39 2.534 -6.371 -13.836 1.00 0.00 C ATOM 311 OG SER A 39 2.415 -7.669 -14.408 1.00 0.00 O ATOM 0 H SER A 39 1.048 -3.499 -14.105 1.00 0.00 H new ATOM 0 HA SER A 39 2.662 -5.287 -15.616 1.00 0.00 H new ATOM 0 HB2 SER A 39 3.583 -6.162 -13.624 1.00 0.00 H new ATOM 0 HB3 SER A 39 2.004 -6.343 -12.884 1.00 0.00 H new ATOM 0 HG SER A 39 2.783 -8.334 -13.790 1.00 0.00 H new ATOM 312 N ASP A 40 -0.476 -5.662 -14.369 1.00 0.00 N ATOM 313 CA ASP A 40 -1.899 -5.945 -14.721 1.00 0.00 C ATOM 314 C ASP A 40 -2.678 -4.891 -15.576 1.00 0.00 C ATOM 315 O ASP A 40 -3.681 -5.263 -16.196 1.00 0.00 O ATOM 316 CB ASP A 40 -2.688 -6.335 -13.434 1.00 0.00 C ATOM 317 CG ASP A 40 -2.855 -5.311 -12.289 1.00 0.00 C ATOM 318 OD1 ASP A 40 -2.518 -4.115 -12.443 1.00 0.00 O ATOM 319 OD2 ASP A 40 -3.331 -5.723 -11.208 1.00 0.00 O ATOM 0 H ASP A 40 -0.326 -5.521 -13.370 1.00 0.00 H new ATOM 0 HA ASP A 40 -1.830 -6.778 -15.421 1.00 0.00 H new ATOM 0 HB2 ASP A 40 -3.687 -6.638 -13.746 1.00 0.00 H new ATOM 0 HB3 ASP A 40 -2.205 -7.216 -13.012 1.00 0.00 H new ATOM 320 N LYS A 41 -2.258 -3.604 -15.605 1.00 0.00 N ATOM 321 CA LYS A 41 -2.982 -2.497 -16.298 1.00 0.00 C ATOM 322 C LYS A 41 -4.368 -2.144 -15.664 1.00 0.00 C ATOM 323 O LYS A 41 -5.383 -2.161 -16.364 1.00 0.00 O ATOM 324 CB LYS A 41 -2.933 -2.653 -17.851 1.00 0.00 C ATOM 325 CG LYS A 41 -3.287 -1.384 -18.659 1.00 0.00 C ATOM 326 CD LYS A 41 -3.083 -1.509 -20.189 1.00 0.00 C ATOM 327 CE LYS A 41 -4.036 -2.455 -20.949 1.00 0.00 C ATOM 328 NZ LYS A 41 -5.430 -1.971 -21.003 1.00 0.00 N ATOM 0 H LYS A 41 -1.401 -3.296 -15.146 1.00 0.00 H new ATOM 0 HA LYS A 41 -2.429 -1.576 -16.111 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -1.931 -2.975 -18.135 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -3.618 -3.450 -18.140 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -4.328 -1.126 -18.466 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -2.680 -0.556 -18.292 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -3.175 -0.514 -20.625 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -2.061 -1.843 -20.368 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -3.667 -2.589 -21.966 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -4.019 -3.435 -20.472 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -6.014 -2.653 -21.527 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -5.800 -1.869 -20.036 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -5.459 -1.049 -21.484 1.00 0.00 H new ATOM 329 N LYS A 42 -4.390 -1.800 -14.352 1.00 0.00 N ATOM 330 CA LYS A 42 -5.563 -1.173 -13.681 1.00 0.00 C ATOM 331 C LYS A 42 -5.277 -0.826 -12.195 1.00 0.00 C ATOM 332 O LYS A 42 -4.468 -1.461 -11.512 1.00 0.00 O ATOM 333 CB LYS A 42 -6.894 -2.000 -13.805 1.00 0.00 C ATOM 334 CG LYS A 42 -7.986 -1.313 -14.656 1.00 0.00 C ATOM 335 CD LYS A 42 -9.192 -2.210 -15.012 1.00 0.00 C ATOM 336 CE LYS A 42 -8.864 -3.365 -15.980 1.00 0.00 C ATOM 337 NZ LYS A 42 -10.067 -4.106 -16.392 1.00 0.00 N ATOM 0 H LYS A 42 -3.597 -1.948 -13.728 1.00 0.00 H new ATOM 0 HA LYS A 42 -5.723 -0.245 -14.230 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -6.666 -2.972 -14.242 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -7.289 -2.184 -12.806 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -8.349 -0.438 -14.117 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -7.534 -0.954 -15.580 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -9.602 -2.628 -14.093 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -9.971 -1.591 -15.456 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -8.366 -2.966 -16.863 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -8.164 -4.050 -15.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -9.797 -4.872 -17.042 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -10.530 -4.510 -15.553 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -10.725 -3.460 -16.873 1.00 0.00 H new ATOM 338 N LYS A 43 -6.059 0.159 -11.699 1.00 0.00 N ATOM 339 CA LYS A 43 -6.214 0.458 -10.248 1.00 0.00 C ATOM 340 C LYS A 43 -6.817 -0.747 -9.483 1.00 0.00 C ATOM 341 O LYS A 43 -7.988 -1.091 -9.670 1.00 0.00 O ATOM 342 CB LYS A 43 -6.962 1.810 -10.034 1.00 0.00 C ATOM 343 CG LYS A 43 -8.511 1.891 -10.045 1.00 0.00 C ATOM 344 CD LYS A 43 -9.203 1.502 -11.365 1.00 0.00 C ATOM 345 CE LYS A 43 -10.736 1.602 -11.266 1.00 0.00 C ATOM 346 NZ LYS A 43 -11.386 1.161 -12.514 1.00 0.00 N ATOM 0 H LYS A 43 -6.608 0.778 -12.296 1.00 0.00 H new ATOM 0 HA LYS A 43 -5.228 0.602 -9.806 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.631 2.206 -9.074 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -6.604 2.495 -10.802 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -8.893 1.245 -9.254 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -8.803 2.911 -9.793 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -8.849 2.152 -12.165 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -8.923 0.484 -11.634 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -11.089 0.992 -10.435 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -11.022 2.631 -11.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -12.418 1.241 -12.415 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.067 1.760 -13.302 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -11.132 0.171 -12.707 1.00 0.00 H new ATOM 347 N ILE A 44 -5.988 -1.406 -8.646 1.00 0.00 N ATOM 348 CA ILE A 44 -6.457 -2.533 -7.799 1.00 0.00 C ATOM 349 C ILE A 44 -7.279 -1.966 -6.608 1.00 0.00 C ATOM 350 O ILE A 44 -8.436 -2.387 -6.494 1.00 0.00 O ATOM 351 CB ILE A 44 -5.418 -3.634 -7.387 1.00 0.00 C ATOM 352 CG1 ILE A 44 -4.364 -4.058 -8.457 1.00 0.00 C ATOM 353 CG2 ILE A 44 -6.214 -4.905 -6.970 1.00 0.00 C ATOM 354 CD1 ILE A 44 -3.189 -3.090 -8.655 1.00 0.00 C ATOM 0 H ILE A 44 -4.999 -1.183 -8.536 1.00 0.00 H new ATOM 0 HA ILE A 44 -7.094 -3.131 -8.450 1.00 0.00 H new ATOM 0 HB ILE A 44 -4.833 -3.180 -6.588 1.00 0.00 H new ATOM 0 HG12 ILE A 44 -3.964 -5.033 -8.180 1.00 0.00 H new ATOM 0 HG13 ILE A 44 -4.873 -4.182 -9.413 1.00 0.00 H new ATOM 0 HG21 ILE A 44 -5.518 -5.691 -6.677 1.00 0.00 H new ATOM 0 HG22 ILE A 44 -6.866 -4.667 -6.130 1.00 0.00 H new ATOM 0 HG23 ILE A 44 -6.817 -5.249 -7.811 1.00 0.00 H new ATOM 0 HD11 ILE A 44 -2.519 -3.483 -9.420 1.00 0.00 H new ATOM 0 HD12 ILE A 44 -3.568 -2.117 -8.969 1.00 0.00 H new ATOM 0 HD13 ILE A 44 -2.645 -2.982 -7.717 1.00 0.00 H new ATOM 355 N ALA A 45 -6.769 -1.013 -5.781 1.00 0.00 N ATOM 356 CA ALA A 45 -7.680 -0.284 -4.842 1.00 0.00 C ATOM 357 C ALA A 45 -7.370 1.229 -4.798 1.00 0.00 C ATOM 358 O ALA A 45 -6.304 1.679 -5.249 1.00 0.00 O ATOM 359 CB ALA A 45 -7.578 -0.882 -3.439 1.00 0.00 C ATOM 0 H ALA A 45 -5.787 -0.739 -5.739 1.00 0.00 H new ATOM 0 HA ALA A 45 -8.698 -0.402 -5.213 1.00 0.00 H new ATOM 0 HB1 ALA A 45 -8.245 -0.344 -2.765 1.00 0.00 H new ATOM 0 HB2 ALA A 45 -7.864 -1.933 -3.470 1.00 0.00 H new ATOM 0 HB3 ALA A 45 -6.552 -0.796 -3.080 1.00 0.00 H new ATOM 360 N GLN A 46 -8.280 2.004 -4.166 1.00 0.00 N ATOM 361 CA GLN A 46 -7.950 3.409 -3.797 1.00 0.00 C ATOM 362 C GLN A 46 -8.890 3.938 -2.677 1.00 0.00 C ATOM 363 O GLN A 46 -10.057 3.555 -2.546 1.00 0.00 O ATOM 364 CB GLN A 46 -7.954 4.373 -5.036 1.00 0.00 C ATOM 365 CG GLN A 46 -9.281 4.909 -5.636 1.00 0.00 C ATOM 366 CD GLN A 46 -10.151 3.929 -6.439 1.00 0.00 C ATOM 367 OE1 GLN A 46 -9.723 2.868 -6.893 1.00 0.00 O ATOM 368 NE2 GLN A 46 -11.406 4.300 -6.664 1.00 0.00 N ATOM 0 H GLN A 46 -9.218 1.700 -3.906 1.00 0.00 H new ATOM 0 HA GLN A 46 -6.932 3.395 -3.408 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -7.354 5.242 -4.765 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -7.426 3.860 -5.840 1.00 0.00 H new ATOM 0 HG2 GLN A 46 -9.885 5.300 -4.817 1.00 0.00 H new ATOM 0 HG3 GLN A 46 -9.039 5.751 -6.284 1.00 0.00 H new ATOM 0 HE21 GLN A 46 -11.753 5.181 -6.284 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -12.023 3.704 -7.216 1.00 0.00 H new ATOM 369 N PHE A 47 -8.345 4.911 -1.935 1.00 0.00 N ATOM 370 CA PHE A 47 -9.090 5.747 -0.963 1.00 0.00 C ATOM 371 C PHE A 47 -9.423 7.089 -1.633 1.00 0.00 C ATOM 372 O PHE A 47 -8.545 7.700 -2.269 1.00 0.00 O ATOM 373 CB PHE A 47 -8.200 6.145 0.254 1.00 0.00 C ATOM 374 CG PHE A 47 -7.491 5.085 1.102 1.00 0.00 C ATOM 375 CD1 PHE A 47 -7.623 3.709 0.899 1.00 0.00 C ATOM 376 CD2 PHE A 47 -6.501 5.565 1.959 1.00 0.00 C ATOM 377 CE1 PHE A 47 -6.700 2.835 1.462 1.00 0.00 C ATOM 378 CE2 PHE A 47 -5.593 4.687 2.537 1.00 0.00 C ATOM 379 CZ PHE A 47 -5.676 3.321 2.270 1.00 0.00 C ATOM 0 H PHE A 47 -7.355 5.150 -1.989 1.00 0.00 H new ATOM 0 HA PHE A 47 -9.961 5.173 -0.647 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -7.430 6.818 -0.122 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -8.828 6.725 0.930 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -8.440 3.325 0.306 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -6.440 6.622 2.174 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -6.778 1.775 1.272 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -4.822 5.063 3.194 1.00 0.00 H new ATOM 0 HZ PHE A 47 -4.948 2.642 2.689 1.00 0.00 H new ATOM 380 N ARG A 48 -10.627 7.604 -1.351 1.00 0.00 N ATOM 381 CA ARG A 48 -10.914 9.040 -1.551 1.00 0.00 C ATOM 382 C ARG A 48 -11.811 9.608 -0.416 1.00 0.00 C ATOM 383 O ARG A 48 -12.702 8.937 0.116 1.00 0.00 O ATOM 384 CB ARG A 48 -11.615 9.331 -2.910 1.00 0.00 C ATOM 385 CG ARG A 48 -10.889 8.923 -4.212 1.00 0.00 C ATOM 386 CD ARG A 48 -11.619 9.299 -5.520 1.00 0.00 C ATOM 387 NE ARG A 48 -11.754 10.763 -5.742 1.00 0.00 N ATOM 388 CZ ARG A 48 -12.861 11.491 -5.486 1.00 0.00 C ATOM 389 NH1 ARG A 48 -13.991 10.991 -4.992 1.00 0.00 N ATOM 390 NH2 ARG A 48 -12.821 12.789 -5.737 1.00 0.00 N ATOM 0 H ARG A 48 -11.411 7.061 -0.989 1.00 0.00 H new ATOM 0 HA ARG A 48 -9.940 9.530 -1.542 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -12.583 8.830 -2.898 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -11.811 10.402 -2.960 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -9.903 9.387 -4.219 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -10.734 7.844 -4.199 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -11.081 8.863 -6.362 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -12.613 8.851 -5.510 1.00 0.00 H new ATOM 0 HE ARG A 48 -10.945 11.257 -6.118 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -14.059 9.995 -4.782 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -14.789 11.604 -4.824 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -11.971 13.210 -6.112 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -13.640 13.369 -5.555 1.00 0.00 H new ATOM 391 N LYS A 49 -11.614 10.914 -0.137 1.00 0.00 N ATOM 392 CA LYS A 49 -12.556 11.736 0.650 1.00 0.00 C ATOM 393 C LYS A 49 -13.713 12.221 -0.275 1.00 0.00 C ATOM 394 O LYS A 49 -13.510 12.750 -1.375 1.00 0.00 O ATOM 395 CB LYS A 49 -11.786 12.916 1.306 1.00 0.00 C ATOM 396 CG LYS A 49 -12.602 13.890 2.191 1.00 0.00 C ATOM 397 CD LYS A 49 -13.373 13.281 3.390 1.00 0.00 C ATOM 398 CE LYS A 49 -12.512 12.761 4.560 1.00 0.00 C ATOM 399 NZ LYS A 49 -11.905 13.853 5.342 1.00 0.00 N ATOM 0 H LYS A 49 -10.793 11.430 -0.453 1.00 0.00 H new ATOM 0 HA LYS A 49 -13.002 11.150 1.453 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -10.984 12.499 1.914 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -11.315 13.495 0.512 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -11.920 14.647 2.578 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -13.321 14.404 1.553 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -14.057 14.037 3.777 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -13.984 12.457 3.022 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -13.129 12.148 5.217 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -11.724 12.117 4.169 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -11.337 13.452 6.115 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -11.294 14.424 4.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -12.655 14.454 5.739 1.00 0.00 H new ATOM 400 N GLU A 50 -14.921 12.012 0.259 1.00 0.00 N ATOM 401 CA GLU A 50 -16.237 12.326 -0.373 1.00 0.00 C ATOM 402 C GLU A 50 -16.702 11.102 -1.210 1.00 0.00 C ATOM 403 O GLU A 50 -16.428 11.018 -2.411 1.00 0.00 O ATOM 404 CB GLU A 50 -16.400 13.696 -1.102 1.00 0.00 C ATOM 405 CG GLU A 50 -16.230 14.930 -0.186 1.00 0.00 C ATOM 406 CD GLU A 50 -16.338 16.262 -0.934 1.00 0.00 C ATOM 407 OE1 GLU A 50 -17.471 16.703 -1.228 1.00 0.00 O ATOM 408 OE2 GLU A 50 -15.290 16.874 -1.232 1.00 0.00 O ATOM 0 H GLU A 50 -15.029 11.601 1.186 1.00 0.00 H new ATOM 0 HA GLU A 50 -16.919 12.497 0.459 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -15.669 13.754 -1.909 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -17.387 13.734 -1.563 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -16.988 14.899 0.597 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -15.259 14.876 0.307 1.00 0.00 H new ATOM 409 N LYS A 51 -17.380 10.163 -0.512 1.00 0.00 N ATOM 410 CA LYS A 51 -17.851 8.837 -1.005 1.00 0.00 C ATOM 411 C LYS A 51 -17.298 8.234 -2.327 1.00 0.00 C ATOM 412 O LYS A 51 -17.825 8.435 -3.423 1.00 0.00 O ATOM 413 CB LYS A 51 -19.374 8.655 -0.861 1.00 0.00 C ATOM 414 CG LYS A 51 -20.281 9.685 -1.577 1.00 0.00 C ATOM 415 CD LYS A 51 -21.785 9.465 -1.332 1.00 0.00 C ATOM 416 CE LYS A 51 -22.644 10.465 -2.129 1.00 0.00 C ATOM 417 NZ LYS A 51 -24.082 10.299 -1.857 1.00 0.00 N ATOM 0 H LYS A 51 -17.630 10.313 0.465 1.00 0.00 H new ATOM 0 HA LYS A 51 -17.324 8.199 -0.296 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -19.632 7.663 -1.231 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -19.617 8.672 0.201 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -20.011 10.687 -1.243 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -20.087 9.643 -2.649 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -22.055 8.447 -1.615 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -21.999 9.568 -0.268 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -22.343 11.482 -1.878 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -22.459 10.332 -3.195 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -24.623 10.991 -2.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -24.376 9.337 -2.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -24.264 10.451 -0.844 1.00 0.00 H new ATOM 418 N GLU A 52 -16.230 7.466 -2.117 1.00 0.00 N ATOM 419 CA GLU A 52 -15.602 6.586 -3.139 1.00 0.00 C ATOM 420 C GLU A 52 -14.445 5.837 -2.413 1.00 0.00 C ATOM 421 O GLU A 52 -13.372 6.409 -2.202 1.00 0.00 O ATOM 422 CB GLU A 52 -15.084 7.331 -4.412 1.00 0.00 C ATOM 423 CG GLU A 52 -14.623 6.430 -5.584 1.00 0.00 C ATOM 424 CD GLU A 52 -15.777 5.790 -6.357 1.00 0.00 C ATOM 425 OE1 GLU A 52 -16.290 6.419 -7.313 1.00 0.00 O ATOM 426 OE2 GLU A 52 -16.182 4.659 -6.014 1.00 0.00 O ATOM 0 H GLU A 52 -15.756 7.427 -1.215 1.00 0.00 H new ATOM 0 HA GLU A 52 -16.358 5.905 -3.532 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -15.877 7.986 -4.773 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -14.250 7.970 -4.121 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -14.021 7.024 -6.272 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -13.978 5.643 -5.194 1.00 0.00 H new ATOM 427 N THR A 53 -14.665 4.560 -2.039 1.00 0.00 N ATOM 428 CA THR A 53 -13.613 3.702 -1.422 1.00 0.00 C ATOM 429 C THR A 53 -13.775 2.291 -2.059 1.00 0.00 C ATOM 430 O THR A 53 -14.725 1.561 -1.753 1.00 0.00 O ATOM 431 CB THR A 53 -13.683 3.709 0.139 1.00 0.00 C ATOM 432 OG1 THR A 53 -13.574 5.044 0.626 1.00 0.00 O ATOM 433 CG2 THR A 53 -12.568 2.894 0.822 1.00 0.00 C ATOM 0 H THR A 53 -15.564 4.091 -2.151 1.00 0.00 H new ATOM 0 HA THR A 53 -12.613 4.084 -1.628 1.00 0.00 H new ATOM 0 HB THR A 53 -14.642 3.251 0.382 1.00 0.00 H new ATOM 0 HG1 THR A 53 -13.620 5.040 1.605 1.00 0.00 H new ATOM 0 HG21 THR A 53 -12.687 2.950 1.904 1.00 0.00 H new ATOM 0 HG22 THR A 53 -12.630 1.854 0.503 1.00 0.00 H new ATOM 0 HG23 THR A 53 -11.596 3.302 0.543 1.00 0.00 H new ATOM 434 N PHE A 54 -12.838 1.940 -2.955 1.00 0.00 N ATOM 435 CA PHE A 54 -12.927 0.726 -3.805 1.00 0.00 C ATOM 436 C PHE A 54 -11.940 -0.362 -3.294 1.00 0.00 C ATOM 437 O PHE A 54 -10.726 -0.183 -3.457 1.00 0.00 O ATOM 438 CB PHE A 54 -12.616 1.174 -5.269 1.00 0.00 C ATOM 439 CG PHE A 54 -12.531 0.074 -6.346 1.00 0.00 C ATOM 440 CD1 PHE A 54 -13.674 -0.646 -6.716 1.00 0.00 C ATOM 441 CD2 PHE A 54 -11.307 -0.222 -6.962 1.00 0.00 C ATOM 442 CE1 PHE A 54 -13.589 -1.656 -7.672 1.00 0.00 C ATOM 443 CE2 PHE A 54 -11.228 -1.228 -7.922 1.00 0.00 C ATOM 444 CZ PHE A 54 -12.368 -1.945 -8.274 1.00 0.00 C ATOM 0 H PHE A 54 -11.992 2.487 -3.116 1.00 0.00 H new ATOM 0 HA PHE A 54 -13.919 0.276 -3.765 1.00 0.00 H new ATOM 0 HB2 PHE A 54 -13.384 1.885 -5.574 1.00 0.00 H new ATOM 0 HB3 PHE A 54 -11.668 1.712 -5.262 1.00 0.00 H new ATOM 0 HD1 PHE A 54 -14.625 -0.417 -6.258 1.00 0.00 H new ATOM 0 HD2 PHE A 54 -10.421 0.333 -6.691 1.00 0.00 H new ATOM 0 HE1 PHE A 54 -14.471 -2.215 -7.946 1.00 0.00 H new ATOM 0 HE2 PHE A 54 -10.282 -1.452 -8.393 1.00 0.00 H new ATOM 0 HZ PHE A 54 -12.305 -2.727 -9.016 1.00 0.00 H new ATOM 445 N LYS A 55 -12.501 -1.494 -2.781 1.00 0.00 N ATOM 446 CA LYS A 55 -11.910 -2.858 -2.954 1.00 0.00 C ATOM 447 C LYS A 55 -12.920 -3.978 -2.464 1.00 0.00 C ATOM 448 O LYS A 55 -13.618 -4.552 -3.304 1.00 0.00 O ATOM 449 CB LYS A 55 -10.461 -3.079 -2.427 1.00 0.00 C ATOM 450 CG LYS A 55 -9.418 -3.610 -3.444 1.00 0.00 C ATOM 451 CD LYS A 55 -9.529 -4.976 -4.161 1.00 0.00 C ATOM 452 CE LYS A 55 -10.549 -5.079 -5.304 1.00 0.00 C ATOM 453 NZ LYS A 55 -10.408 -6.360 -6.022 1.00 0.00 N ATOM 0 H LYS A 55 -13.366 -1.490 -2.241 1.00 0.00 H new ATOM 0 HA LYS A 55 -11.767 -2.947 -4.031 1.00 0.00 H new ATOM 0 HB2 LYS A 55 -10.096 -2.132 -2.030 1.00 0.00 H new ATOM 0 HB3 LYS A 55 -10.507 -3.778 -1.592 1.00 0.00 H new ATOM 0 HG2 LYS A 55 -9.349 -2.858 -4.230 1.00 0.00 H new ATOM 0 HG3 LYS A 55 -8.460 -3.616 -2.923 1.00 0.00 H new ATOM 0 HD2 LYS A 55 -8.547 -5.231 -4.559 1.00 0.00 H new ATOM 0 HD3 LYS A 55 -9.777 -5.731 -3.415 1.00 0.00 H new ATOM 0 HE2 LYS A 55 -11.559 -4.991 -4.904 1.00 0.00 H new ATOM 0 HE3 LYS A 55 -10.408 -4.251 -5.998 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 -11.108 -6.406 -6.790 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 -9.450 -6.430 -6.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 -10.566 -7.147 -5.361 1.00 0.00 H new ATOM 454 N GLU A 56 -12.990 -4.302 -1.135 1.00 0.00 N ATOM 455 CA GLU A 56 -13.867 -5.360 -0.502 1.00 0.00 C ATOM 456 C GLU A 56 -13.360 -6.847 -0.640 1.00 0.00 C ATOM 457 O GLU A 56 -13.371 -7.370 -1.758 1.00 0.00 O ATOM 458 CB GLU A 56 -15.386 -5.183 -0.829 1.00 0.00 C ATOM 459 CG GLU A 56 -16.396 -5.873 0.118 1.00 0.00 C ATOM 460 CD GLU A 56 -16.595 -7.375 -0.107 1.00 0.00 C ATOM 461 OE1 GLU A 56 -17.155 -7.757 -1.159 1.00 0.00 O ATOM 462 OE2 GLU A 56 -16.196 -8.179 0.764 1.00 0.00 O ATOM 0 H GLU A 56 -12.418 -3.819 -0.443 1.00 0.00 H new ATOM 0 HA GLU A 56 -13.762 -5.165 0.565 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -15.607 -4.116 -0.840 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -15.560 -5.555 -1.839 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -16.067 -5.718 1.146 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -17.361 -5.377 0.014 1.00 0.00 H new ATOM 463 N LYS A 57 -12.926 -7.498 0.488 1.00 0.00 N ATOM 464 CA LYS A 57 -12.470 -8.942 0.602 1.00 0.00 C ATOM 465 C LYS A 57 -10.925 -9.064 0.884 1.00 0.00 C ATOM 466 O LYS A 57 -10.117 -8.856 -0.021 1.00 0.00 O ATOM 467 CB LYS A 57 -12.941 -9.938 -0.500 1.00 0.00 C ATOM 468 CG LYS A 57 -12.830 -11.441 -0.144 1.00 0.00 C ATOM 469 CD LYS A 57 -13.215 -12.396 -1.298 1.00 0.00 C ATOM 470 CE LYS A 57 -14.704 -12.437 -1.703 1.00 0.00 C ATOM 471 NZ LYS A 57 -15.563 -13.083 -0.691 1.00 0.00 N ATOM 0 H LYS A 57 -12.879 -7.017 1.386 1.00 0.00 H new ATOM 0 HA LYS A 57 -13.020 -9.283 1.479 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -13.981 -9.717 -0.742 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -12.358 -9.754 -1.402 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -11.807 -11.655 0.164 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -13.471 -11.648 0.713 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -12.632 -12.119 -2.176 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -12.911 -13.405 -1.019 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -15.056 -11.420 -1.873 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -14.802 -12.971 -2.648 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -16.550 -13.080 -1.020 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -15.250 -14.064 -0.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -15.496 -12.561 0.206 1.00 0.00 H new ATOM 472 N ASP A 58 -10.489 -9.439 2.110 1.00 0.00 N ATOM 473 CA ASP A 58 -9.175 -8.982 2.690 1.00 0.00 C ATOM 474 C ASP A 58 -7.827 -9.462 2.104 1.00 0.00 C ATOM 475 O ASP A 58 -6.808 -8.801 2.332 1.00 0.00 O ATOM 476 CB ASP A 58 -9.006 -9.187 4.227 1.00 0.00 C ATOM 477 CG ASP A 58 -10.232 -8.961 5.125 1.00 0.00 C ATOM 478 OD1 ASP A 58 -10.576 -7.791 5.401 1.00 0.00 O ATOM 479 OD2 ASP A 58 -10.856 -9.956 5.553 1.00 0.00 O ATOM 0 H ASP A 58 -11.018 -10.056 2.727 1.00 0.00 H new ATOM 0 HA ASP A 58 -9.325 -7.947 2.382 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -8.655 -10.206 4.391 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -8.215 -8.519 4.568 1.00 0.00 H new ATOM 480 N THR A 59 -7.795 -10.621 1.440 1.00 0.00 N ATOM 481 CA THR A 59 -6.501 -11.249 1.013 1.00 0.00 C ATOM 482 C THR A 59 -5.562 -10.424 0.063 1.00 0.00 C ATOM 483 O THR A 59 -4.377 -10.757 -0.034 1.00 0.00 O ATOM 484 CB THR A 59 -6.652 -12.707 0.514 1.00 0.00 C ATOM 485 OG1 THR A 59 -7.426 -12.752 -0.680 1.00 0.00 O ATOM 486 CG2 THR A 59 -7.238 -13.699 1.531 1.00 0.00 C ATOM 0 H THR A 59 -8.627 -11.152 1.181 1.00 0.00 H new ATOM 0 HA THR A 59 -5.966 -11.253 1.963 1.00 0.00 H new ATOM 0 HB THR A 59 -5.628 -13.034 0.334 1.00 0.00 H new ATOM 0 HG1 THR A 59 -7.509 -13.681 -0.981 1.00 0.00 H new ATOM 0 HG21 THR A 59 -7.300 -14.689 1.079 1.00 0.00 H new ATOM 0 HG22 THR A 59 -6.595 -13.741 2.410 1.00 0.00 H new ATOM 0 HG23 THR A 59 -8.235 -13.371 1.826 1.00 0.00 H new ATOM 487 N TYR A 60 -6.050 -9.328 -0.555 1.00 0.00 N ATOM 488 CA TYR A 60 -5.183 -8.213 -0.990 1.00 0.00 C ATOM 489 C TYR A 60 -5.952 -6.901 -0.697 1.00 0.00 C ATOM 490 O TYR A 60 -6.786 -6.501 -1.516 1.00 0.00 O ATOM 491 CB TYR A 60 -4.744 -8.382 -2.471 1.00 0.00 C ATOM 492 CG TYR A 60 -3.903 -7.265 -3.126 1.00 0.00 C ATOM 493 CD1 TYR A 60 -3.327 -6.221 -2.390 1.00 0.00 C ATOM 494 CD2 TYR A 60 -3.863 -7.195 -4.525 1.00 0.00 C ATOM 495 CE1 TYR A 60 -2.857 -5.095 -3.025 1.00 0.00 C ATOM 496 CE2 TYR A 60 -3.378 -6.055 -5.159 1.00 0.00 C ATOM 497 CZ TYR A 60 -2.930 -4.977 -4.402 1.00 0.00 C ATOM 498 OH TYR A 60 -2.629 -3.772 -4.975 1.00 0.00 O ATOM 0 H TYR A 60 -7.039 -9.192 -0.764 1.00 0.00 H new ATOM 0 HA TYR A 60 -4.243 -8.194 -0.439 1.00 0.00 H new ATOM 0 HB2 TYR A 60 -4.176 -9.309 -2.544 1.00 0.00 H new ATOM 0 HB3 TYR A 60 -5.645 -8.512 -3.070 1.00 0.00 H new ATOM 0 HD1 TYR A 60 -3.251 -6.301 -1.316 1.00 0.00 H new ATOM 0 HD2 TYR A 60 -4.211 -8.030 -5.115 1.00 0.00 H new ATOM 0 HE1 TYR A 60 -2.426 -4.294 -2.443 1.00 0.00 H new ATOM 0 HE2 TYR A 60 -3.349 -6.007 -6.238 1.00 0.00 H new ATOM 0 HH TYR A 60 -1.779 -3.842 -5.457 1.00 0.00 H new ATOM 499 N LYS A 61 -5.625 -6.233 0.433 1.00 0.00 N ATOM 500 CA LYS A 61 -6.411 -5.075 0.942 1.00 0.00 C ATOM 501 C LYS A 61 -5.575 -3.847 1.349 1.00 0.00 C ATOM 502 O LYS A 61 -4.628 -3.912 2.128 1.00 0.00 O ATOM 503 CB LYS A 61 -7.383 -5.467 2.101 1.00 0.00 C ATOM 504 CG LYS A 61 -8.745 -4.717 2.100 1.00 0.00 C ATOM 505 CD LYS A 61 -9.868 -5.296 1.196 1.00 0.00 C ATOM 506 CE LYS A 61 -9.384 -5.765 -0.185 1.00 0.00 C ATOM 507 NZ LYS A 61 -10.409 -6.263 -1.082 1.00 0.00 N ATOM 0 H LYS A 61 -4.822 -6.473 1.014 1.00 0.00 H new ATOM 0 HA LYS A 61 -6.997 -4.773 0.074 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -7.576 -6.538 2.046 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -6.884 -5.281 3.052 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -9.116 -4.687 3.124 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -8.564 -3.686 1.797 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -10.336 -6.136 1.709 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -10.638 -4.537 1.060 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -8.876 -4.933 -0.672 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -8.642 -6.551 -0.041 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -9.994 -6.439 -2.019 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -10.800 -7.149 -0.704 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -11.169 -5.558 -1.167 1.00 0.00 H new ATOM 508 N LEU A 62 -6.046 -2.704 0.851 1.00 0.00 N ATOM 509 CA LEU A 62 -5.447 -1.374 1.049 1.00 0.00 C ATOM 510 C LEU A 62 -6.156 -0.716 2.280 1.00 0.00 C ATOM 511 O LEU A 62 -7.389 -0.654 2.312 1.00 0.00 O ATOM 512 CB LEU A 62 -5.591 -0.689 -0.338 1.00 0.00 C ATOM 513 CG LEU A 62 -4.700 -1.195 -1.522 1.00 0.00 C ATOM 514 CD1 LEU A 62 -4.927 -2.602 -2.117 1.00 0.00 C ATOM 515 CD2 LEU A 62 -4.410 -0.140 -2.600 1.00 0.00 C ATOM 0 H LEU A 62 -6.888 -2.672 0.276 1.00 0.00 H new ATOM 0 HA LEU A 62 -4.391 -1.327 1.316 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -6.633 -0.781 -0.645 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -5.391 0.374 -0.204 1.00 0.00 H new ATOM 0 HG LEU A 62 -3.788 -1.366 -0.950 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -4.217 -2.774 -2.926 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -4.782 -3.353 -1.341 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -5.943 -2.673 -2.505 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -3.787 -0.578 -3.380 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.349 0.203 -3.035 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -3.888 0.705 -2.151 1.00 0.00 H new ATOM 516 N PHE A 63 -5.378 -0.289 3.311 1.00 0.00 N ATOM 517 CA PHE A 63 -5.877 0.080 4.675 1.00 0.00 C ATOM 518 C PHE A 63 -6.866 1.310 4.752 1.00 0.00 C ATOM 519 O PHE A 63 -7.829 1.386 3.984 1.00 0.00 O ATOM 520 CB PHE A 63 -4.545 0.205 5.502 1.00 0.00 C ATOM 521 CG PHE A 63 -4.629 0.234 7.043 1.00 0.00 C ATOM 522 CD1 PHE A 63 -5.271 -0.786 7.755 1.00 0.00 C ATOM 523 CD2 PHE A 63 -4.041 1.290 7.751 1.00 0.00 C ATOM 524 CE1 PHE A 63 -5.327 -0.749 9.145 1.00 0.00 C ATOM 525 CE2 PHE A 63 -4.098 1.328 9.143 1.00 0.00 C ATOM 526 CZ PHE A 63 -4.743 0.311 9.838 1.00 0.00 C ATOM 0 H PHE A 63 -4.367 -0.188 3.221 1.00 0.00 H new ATOM 0 HA PHE A 63 -6.555 -0.668 5.086 1.00 0.00 H new ATOM 0 HB2 PHE A 63 -3.902 -0.630 5.222 1.00 0.00 H new ATOM 0 HB3 PHE A 63 -4.041 1.117 5.181 1.00 0.00 H new ATOM 0 HD1 PHE A 63 -5.726 -1.608 7.222 1.00 0.00 H new ATOM 0 HD2 PHE A 63 -3.539 2.081 7.214 1.00 0.00 H new ATOM 0 HE1 PHE A 63 -5.823 -1.541 9.687 1.00 0.00 H new ATOM 0 HE2 PHE A 63 -3.642 2.146 9.681 1.00 0.00 H new ATOM 0 HZ PHE A 63 -4.792 0.342 10.916 1.00 0.00 H new ATOM 527 N LYS A 64 -6.671 2.249 5.700 1.00 0.00 N ATOM 528 CA LYS A 64 -7.373 3.555 5.759 1.00 0.00 C ATOM 529 C LYS A 64 -6.495 4.420 6.707 1.00 0.00 C ATOM 530 O LYS A 64 -6.634 4.370 7.933 1.00 0.00 O ATOM 531 CB LYS A 64 -8.862 3.437 6.198 1.00 0.00 C ATOM 532 CG LYS A 64 -9.644 4.772 6.143 1.00 0.00 C ATOM 533 CD LYS A 64 -11.137 4.667 6.528 1.00 0.00 C ATOM 534 CE LYS A 64 -12.047 3.895 5.546 1.00 0.00 C ATOM 535 NZ LYS A 64 -12.223 4.589 4.254 1.00 0.00 N ATOM 0 H LYS A 64 -6.007 2.121 6.464 1.00 0.00 H new ATOM 0 HA LYS A 64 -7.467 4.016 4.776 1.00 0.00 H new ATOM 0 HB2 LYS A 64 -9.362 2.709 5.559 1.00 0.00 H new ATOM 0 HB3 LYS A 64 -8.900 3.047 7.215 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -9.161 5.487 6.809 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -9.572 5.178 5.134 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -11.205 4.188 7.505 1.00 0.00 H new ATOM 0 HD3 LYS A 64 -11.533 5.676 6.639 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -11.623 2.907 5.366 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -13.023 3.744 6.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -12.957 4.106 3.698 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -12.510 5.574 4.425 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -11.326 4.576 3.728 1.00 0.00 H new ATOM 536 N ASN A 65 -5.580 5.165 6.074 1.00 0.00 N ATOM 537 CA ASN A 65 -4.525 6.008 6.674 1.00 0.00 C ATOM 538 C ASN A 65 -3.524 6.321 5.517 1.00 0.00 C ATOM 539 O ASN A 65 -3.408 7.477 5.096 1.00 0.00 O ATOM 540 CB ASN A 65 -3.768 5.526 7.961 1.00 0.00 C ATOM 541 CG ASN A 65 -4.413 5.832 9.327 1.00 0.00 C ATOM 542 OD1 ASN A 65 -4.812 4.929 10.061 1.00 0.00 O ATOM 543 ND2 ASN A 65 -4.489 7.096 9.712 1.00 0.00 N ATOM 0 H ASN A 65 -5.551 5.201 5.055 1.00 0.00 H new ATOM 0 HA ASN A 65 -5.046 6.870 7.090 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -3.634 4.447 7.887 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -2.773 5.972 7.952 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -4.881 7.328 10.624 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -4.155 7.838 9.096 1.00 0.00 H new ATOM 544 N GLY A 66 -2.820 5.292 5.009 1.00 0.00 N ATOM 545 CA GLY A 66 -1.972 5.400 3.801 1.00 0.00 C ATOM 546 C GLY A 66 -1.059 4.168 3.689 1.00 0.00 C ATOM 547 O GLY A 66 0.157 4.296 3.855 1.00 0.00 O ATOM 0 H GLY A 66 -2.821 4.360 5.423 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -2.598 5.481 2.913 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -1.369 6.307 3.849 1.00 0.00 H new ATOM 548 N THR A 67 -1.653 2.974 3.468 1.00 0.00 N ATOM 549 CA THR A 67 -0.971 1.675 3.681 1.00 0.00 C ATOM 550 C THR A 67 -1.716 0.631 2.801 1.00 0.00 C ATOM 551 O THR A 67 -2.845 0.803 2.332 1.00 0.00 O ATOM 552 CB THR A 67 -0.943 1.326 5.217 1.00 0.00 C ATOM 553 OG1 THR A 67 0.073 2.090 5.857 1.00 0.00 O ATOM 554 CG2 THR A 67 -0.713 -0.153 5.594 1.00 0.00 C ATOM 0 H THR A 67 -2.614 2.882 3.139 1.00 0.00 H new ATOM 0 HA THR A 67 0.076 1.694 3.379 1.00 0.00 H new ATOM 0 HB THR A 67 -1.952 1.565 5.553 1.00 0.00 H new ATOM 0 HG1 THR A 67 0.359 2.816 5.264 1.00 0.00 H new ATOM 0 HG21 THR A 67 -0.716 -0.257 6.679 1.00 0.00 H new ATOM 0 HG22 THR A 67 -1.509 -0.765 5.169 1.00 0.00 H new ATOM 0 HG23 THR A 67 0.248 -0.483 5.201 1.00 0.00 H new ATOM 555 N LEU A 68 -1.033 -0.502 2.627 1.00 0.00 N ATOM 556 CA LEU A 68 -1.615 -1.745 2.085 1.00 0.00 C ATOM 557 C LEU A 68 -1.094 -2.962 2.911 1.00 0.00 C ATOM 558 O LEU A 68 0.025 -2.976 3.429 1.00 0.00 O ATOM 559 CB LEU A 68 -1.289 -1.625 0.572 1.00 0.00 C ATOM 560 CG LEU A 68 -1.534 -2.749 -0.454 1.00 0.00 C ATOM 561 CD1 LEU A 68 -1.247 -2.202 -1.883 1.00 0.00 C ATOM 562 CD2 LEU A 68 -0.699 -4.004 -0.206 1.00 0.00 C ATOM 0 H LEU A 68 -0.044 -0.590 2.860 1.00 0.00 H new ATOM 0 HA LEU A 68 -2.689 -1.905 2.174 1.00 0.00 H new ATOM 0 HB2 LEU A 68 -1.840 -0.757 0.210 1.00 0.00 H new ATOM 0 HB3 LEU A 68 -0.229 -1.380 0.507 1.00 0.00 H new ATOM 0 HG LEU A 68 -2.576 -3.052 -0.349 1.00 0.00 H new ATOM 0 HD11 LEU A 68 -1.418 -2.991 -2.616 1.00 0.00 H new ATOM 0 HD12 LEU A 68 -1.911 -1.363 -2.092 1.00 0.00 H new ATOM 0 HD13 LEU A 68 -0.211 -1.869 -1.944 1.00 0.00 H new ATOM 0 HD21 LEU A 68 -0.927 -4.749 -0.968 1.00 0.00 H new ATOM 0 HD22 LEU A 68 0.360 -3.751 -0.251 1.00 0.00 H new ATOM 0 HD23 LEU A 68 -0.934 -4.409 0.778 1.00 0.00 H new ATOM 563 N LYS A 69 -1.969 -3.972 3.063 1.00 0.00 N ATOM 564 CA LYS A 69 -1.689 -5.261 3.753 1.00 0.00 C ATOM 565 C LYS A 69 -2.238 -6.391 2.831 1.00 0.00 C ATOM 566 O LYS A 69 -3.443 -6.445 2.565 1.00 0.00 O ATOM 567 CB LYS A 69 -2.399 -5.361 5.133 1.00 0.00 C ATOM 568 CG LYS A 69 -1.976 -4.347 6.219 1.00 0.00 C ATOM 569 CD LYS A 69 -2.586 -4.607 7.615 1.00 0.00 C ATOM 570 CE LYS A 69 -4.122 -4.484 7.675 1.00 0.00 C ATOM 571 NZ LYS A 69 -4.629 -4.517 9.061 1.00 0.00 N ATOM 0 H LYS A 69 -2.921 -3.920 2.701 1.00 0.00 H new ATOM 0 HA LYS A 69 -0.617 -5.343 3.933 1.00 0.00 H new ATOM 0 HB2 LYS A 69 -3.471 -5.254 4.970 1.00 0.00 H new ATOM 0 HB3 LYS A 69 -2.235 -6.365 5.525 1.00 0.00 H new ATOM 0 HG2 LYS A 69 -0.889 -4.358 6.304 1.00 0.00 H new ATOM 0 HG3 LYS A 69 -2.260 -3.346 5.893 1.00 0.00 H new ATOM 0 HD2 LYS A 69 -2.301 -5.607 7.941 1.00 0.00 H new ATOM 0 HD3 LYS A 69 -2.150 -3.904 8.325 1.00 0.00 H new ATOM 0 HE2 LYS A 69 -4.429 -3.553 7.199 1.00 0.00 H new ATOM 0 HE3 LYS A 69 -4.573 -5.297 7.105 1.00 0.00 H new ATOM 0 HZ1 LYS A 69 -5.665 -4.431 9.054 1.00 0.00 H new ATOM 0 HZ2 LYS A 69 -4.359 -5.416 9.508 1.00 0.00 H new ATOM 0 HZ3 LYS A 69 -4.220 -3.726 9.599 1.00 0.00 H new ATOM 572 N ILE A 70 -1.368 -7.304 2.362 1.00 0.00 N ATOM 573 CA ILE A 70 -1.765 -8.421 1.458 1.00 0.00 C ATOM 574 C ILE A 70 -1.813 -9.690 2.363 1.00 0.00 C ATOM 575 O ILE A 70 -0.749 -10.234 2.672 1.00 0.00 O ATOM 576 CB ILE A 70 -0.819 -8.594 0.199 1.00 0.00 C ATOM 577 CG1 ILE A 70 -0.383 -7.287 -0.538 1.00 0.00 C ATOM 578 CG2 ILE A 70 -1.505 -9.555 -0.793 1.00 0.00 C ATOM 579 CD1 ILE A 70 0.488 -7.374 -1.819 1.00 0.00 C ATOM 0 H ILE A 70 -0.374 -7.297 2.592 1.00 0.00 H new ATOM 0 HA ILE A 70 -2.734 -8.219 1.002 1.00 0.00 H new ATOM 0 HB ILE A 70 0.117 -8.990 0.592 1.00 0.00 H new ATOM 0 HG12 ILE A 70 -1.291 -6.744 -0.799 1.00 0.00 H new ATOM 0 HG13 ILE A 70 0.159 -6.674 0.182 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -0.870 -9.688 -1.669 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -1.667 -10.520 -0.312 1.00 0.00 H new ATOM 0 HG23 ILE A 70 -2.464 -9.137 -1.100 1.00 0.00 H new ATOM 0 HD11 ILE A 70 0.691 -6.369 -2.190 1.00 0.00 H new ATOM 0 HD12 ILE A 70 1.429 -7.872 -1.586 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -0.043 -7.942 -2.582 1.00 0.00 H new ATOM 580 N LYS A 71 -3.007 -10.159 2.807 1.00 0.00 N ATOM 581 CA LYS A 71 -3.095 -11.272 3.795 1.00 0.00 C ATOM 582 C LYS A 71 -3.003 -12.640 3.059 1.00 0.00 C ATOM 583 O LYS A 71 -3.890 -12.989 2.278 1.00 0.00 O ATOM 584 CB LYS A 71 -4.383 -11.074 4.645 1.00 0.00 C ATOM 585 CG LYS A 71 -4.690 -12.206 5.650 1.00 0.00 C ATOM 586 CD LYS A 71 -5.860 -11.900 6.603 1.00 0.00 C ATOM 587 CE LYS A 71 -6.140 -13.085 7.544 1.00 0.00 C ATOM 588 NZ LYS A 71 -7.171 -12.767 8.543 1.00 0.00 N ATOM 0 H LYS A 71 -3.910 -9.793 2.504 1.00 0.00 H new ATOM 0 HA LYS A 71 -2.256 -11.266 4.491 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -4.296 -10.137 5.194 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -5.232 -10.970 3.969 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -4.915 -13.118 5.096 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -3.796 -12.405 6.241 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -5.629 -11.012 7.192 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -6.755 -11.674 6.023 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -6.458 -13.946 6.957 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -5.219 -13.369 8.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -7.328 -13.593 9.155 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -6.857 -11.962 9.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -8.058 -12.521 8.060 1.00 0.00 H new ATOM 589 N HIS A 72 -1.909 -13.393 3.320 1.00 0.00 N ATOM 590 CA HIS A 72 -1.574 -14.677 2.640 1.00 0.00 C ATOM 591 C HIS A 72 -1.000 -14.385 1.224 1.00 0.00 C ATOM 592 O HIS A 72 -1.662 -13.742 0.400 1.00 0.00 O ATOM 593 CB HIS A 72 -2.699 -15.753 2.665 1.00 0.00 C ATOM 594 CG HIS A 72 -2.250 -17.180 2.335 1.00 0.00 C ATOM 595 ND1 HIS A 72 -1.744 -18.077 3.265 1.00 0.00 N ATOM 596 CD2 HIS A 72 -2.377 -17.799 1.076 1.00 0.00 C ATOM 597 CE1 HIS A 72 -1.614 -19.190 2.472 1.00 0.00 C ATOM 598 NE2 HIS A 72 -1.962 -19.116 1.149 1.00 0.00 N ATOM 0 H HIS A 72 -1.219 -13.125 4.021 1.00 0.00 H new ATOM 0 HA HIS A 72 -0.795 -15.159 3.230 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -3.156 -15.754 3.655 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -3.474 -15.461 1.956 1.00 0.00 H new ATOM 0 HD1 HIS A 72 -1.530 -17.947 4.254 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -2.745 -17.315 0.183 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -1.241 -20.115 2.887 1.00 0.00 H new ATOM 599 N LEU A 73 0.244 -14.840 0.970 1.00 0.00 N ATOM 600 CA LEU A 73 0.992 -14.501 -0.261 1.00 0.00 C ATOM 601 C LEU A 73 1.866 -15.661 -0.830 1.00 0.00 C ATOM 602 O LEU A 73 3.083 -15.749 -0.651 1.00 0.00 O ATOM 603 CB LEU A 73 1.817 -13.208 -0.090 1.00 0.00 C ATOM 604 CG LEU A 73 2.060 -12.505 -1.449 1.00 0.00 C ATOM 605 CD1 LEU A 73 1.193 -11.247 -1.531 1.00 0.00 C ATOM 606 CD2 LEU A 73 3.539 -12.228 -1.673 1.00 0.00 C ATOM 0 H LEU A 73 0.757 -15.449 1.607 1.00 0.00 H new ATOM 0 HA LEU A 73 0.224 -14.325 -1.014 1.00 0.00 H new ATOM 0 HB2 LEU A 73 1.295 -12.529 0.584 1.00 0.00 H new ATOM 0 HB3 LEU A 73 2.774 -13.445 0.375 1.00 0.00 H new ATOM 0 HG LEU A 73 1.761 -13.167 -2.262 1.00 0.00 H new ATOM 0 HD11 LEU A 73 1.362 -10.750 -2.486 1.00 0.00 H new ATOM 0 HD12 LEU A 73 0.142 -11.523 -1.447 1.00 0.00 H new ATOM 0 HD13 LEU A 73 1.456 -10.570 -0.718 1.00 0.00 H new ATOM 0 HD21 LEU A 73 3.675 -11.734 -2.635 1.00 0.00 H new ATOM 0 HD22 LEU A 73 3.913 -11.583 -0.878 1.00 0.00 H new ATOM 0 HD23 LEU A 73 4.090 -13.168 -1.666 1.00 0.00 H new ATOM 607 N LYS A 74 1.169 -16.454 -1.630 1.00 0.00 N ATOM 608 CA LYS A 74 1.744 -17.360 -2.668 1.00 0.00 C ATOM 609 C LYS A 74 1.902 -16.599 -4.027 1.00 0.00 C ATOM 610 O LYS A 74 1.717 -15.378 -4.123 1.00 0.00 O ATOM 611 CB LYS A 74 0.800 -18.601 -2.800 1.00 0.00 C ATOM 612 CG LYS A 74 0.610 -19.477 -1.537 1.00 0.00 C ATOM 613 CD LYS A 74 -0.199 -20.772 -1.744 1.00 0.00 C ATOM 614 CE LYS A 74 -1.654 -20.577 -2.222 1.00 0.00 C ATOM 615 NZ LYS A 74 -2.356 -21.869 -2.346 1.00 0.00 N ATOM 0 H LYS A 74 0.151 -16.501 -1.590 1.00 0.00 H new ATOM 0 HA LYS A 74 2.740 -17.696 -2.379 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -0.181 -18.248 -3.118 1.00 0.00 H new ATOM 0 HB3 LYS A 74 1.185 -19.236 -3.598 1.00 0.00 H new ATOM 0 HG2 LYS A 74 1.593 -19.742 -1.148 1.00 0.00 H new ATOM 0 HG3 LYS A 74 0.115 -18.879 -0.772 1.00 0.00 H new ATOM 0 HD2 LYS A 74 0.324 -21.394 -2.471 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -0.215 -21.324 -0.804 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -2.187 -19.937 -1.519 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -1.657 -20.065 -3.184 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -3.331 -21.705 -2.669 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -1.859 -22.469 -3.035 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -2.373 -22.345 -1.421 1.00 0.00 H new ATOM 616 N THR A 75 2.249 -17.328 -5.106 1.00 0.00 N ATOM 617 CA THR A 75 2.371 -16.775 -6.474 1.00 0.00 C ATOM 618 C THR A 75 1.060 -16.271 -7.141 1.00 0.00 C ATOM 619 O THR A 75 1.084 -15.236 -7.809 1.00 0.00 O ATOM 620 CB THR A 75 3.189 -17.737 -7.384 1.00 0.00 C ATOM 621 OG1 THR A 75 4.436 -18.069 -6.772 1.00 0.00 O ATOM 622 CG2 THR A 75 3.516 -17.178 -8.784 1.00 0.00 C ATOM 0 H THR A 75 2.455 -18.326 -5.055 1.00 0.00 H new ATOM 0 HA THR A 75 2.928 -15.846 -6.349 1.00 0.00 H new ATOM 0 HB THR A 75 2.540 -18.604 -7.506 1.00 0.00 H new ATOM 0 HG1 THR A 75 4.936 -18.676 -7.357 1.00 0.00 H new ATOM 0 HG21 THR A 75 4.087 -17.917 -9.346 1.00 0.00 H new ATOM 0 HG22 THR A 75 2.589 -16.957 -9.313 1.00 0.00 H new ATOM 0 HG23 THR A 75 4.103 -16.265 -8.683 1.00 0.00 H new ATOM 623 N ASP A 76 -0.061 -16.975 -6.936 1.00 0.00 N ATOM 624 CA ASP A 76 -1.414 -16.409 -7.228 1.00 0.00 C ATOM 625 C ASP A 76 -2.002 -15.636 -5.998 1.00 0.00 C ATOM 626 O ASP A 76 -3.076 -15.936 -5.471 1.00 0.00 O ATOM 627 CB ASP A 76 -2.359 -17.513 -7.783 1.00 0.00 C ATOM 628 CG ASP A 76 -1.993 -18.044 -9.179 1.00 0.00 C ATOM 629 OD1 ASP A 76 -2.375 -17.403 -10.186 1.00 0.00 O ATOM 630 OD2 ASP A 76 -1.324 -19.096 -9.272 1.00 0.00 O ATOM 0 H ASP A 76 -0.074 -17.928 -6.574 1.00 0.00 H new ATOM 0 HA ASP A 76 -1.316 -15.659 -8.013 1.00 0.00 H new ATOM 0 HB2 ASP A 76 -2.366 -18.349 -7.084 1.00 0.00 H new ATOM 0 HB3 ASP A 76 -3.374 -17.117 -7.816 1.00 0.00 H new ATOM 631 N ASP A 77 -1.257 -14.591 -5.605 1.00 0.00 N ATOM 632 CA ASP A 77 -1.644 -13.567 -4.595 1.00 0.00 C ATOM 633 C ASP A 77 -0.942 -12.187 -4.891 1.00 0.00 C ATOM 634 O ASP A 77 -1.416 -11.188 -4.342 1.00 0.00 O ATOM 635 CB ASP A 77 -1.337 -14.046 -3.141 1.00 0.00 C ATOM 636 CG ASP A 77 -2.340 -15.034 -2.526 1.00 0.00 C ATOM 637 OD1 ASP A 77 -3.427 -14.595 -2.092 1.00 0.00 O ATOM 638 OD2 ASP A 77 -2.036 -16.246 -2.457 1.00 0.00 O ATOM 0 H ASP A 77 -0.329 -14.420 -5.992 1.00 0.00 H new ATOM 0 HA ASP A 77 -2.722 -13.425 -4.673 1.00 0.00 H new ATOM 0 HB2 ASP A 77 -0.351 -14.510 -3.134 1.00 0.00 H new ATOM 0 HB3 ASP A 77 -1.281 -13.169 -2.496 1.00 0.00 H new ATOM 639 N GLN A 78 0.142 -12.092 -5.717 1.00 0.00 N ATOM 640 CA GLN A 78 0.922 -10.828 -5.921 1.00 0.00 C ATOM 641 C GLN A 78 0.956 -10.266 -7.375 1.00 0.00 C ATOM 642 O GLN A 78 0.529 -10.902 -8.343 1.00 0.00 O ATOM 643 CB GLN A 78 2.356 -11.004 -5.340 1.00 0.00 C ATOM 644 CG GLN A 78 3.205 -12.250 -5.709 1.00 0.00 C ATOM 645 CD GLN A 78 3.499 -12.469 -7.208 1.00 0.00 C ATOM 646 OE1 GLN A 78 2.668 -12.977 -7.956 1.00 0.00 O ATOM 647 NE2 GLN A 78 4.679 -12.117 -7.684 1.00 0.00 N ATOM 0 H GLN A 78 0.499 -12.881 -6.256 1.00 0.00 H new ATOM 0 HA GLN A 78 0.377 -10.059 -5.374 1.00 0.00 H new ATOM 0 HB2 GLN A 78 2.931 -10.125 -5.630 1.00 0.00 H new ATOM 0 HB3 GLN A 78 2.268 -10.984 -4.254 1.00 0.00 H new ATOM 0 HG2 GLN A 78 4.157 -12.181 -5.182 1.00 0.00 H new ATOM 0 HG3 GLN A 78 2.694 -13.135 -5.330 1.00 0.00 H new ATOM 0 HE21 GLN A 78 5.373 -11.695 -7.067 1.00 0.00 H new ATOM 0 HE22 GLN A 78 4.897 -12.267 -8.669 1.00 0.00 H new ATOM 648 N ASP A 79 1.498 -9.032 -7.478 1.00 0.00 N ATOM 649 CA ASP A 79 1.707 -8.301 -8.754 1.00 0.00 C ATOM 650 C ASP A 79 2.946 -7.339 -8.622 1.00 0.00 C ATOM 651 O ASP A 79 3.570 -7.189 -7.563 1.00 0.00 O ATOM 652 CB ASP A 79 0.410 -7.489 -9.059 1.00 0.00 C ATOM 653 CG ASP A 79 0.049 -7.341 -10.542 1.00 0.00 C ATOM 654 OD1 ASP A 79 -0.326 -8.351 -11.177 1.00 0.00 O ATOM 655 OD2 ASP A 79 0.123 -6.213 -11.074 1.00 0.00 O ATOM 0 H ASP A 79 1.809 -8.504 -6.663 1.00 0.00 H new ATOM 0 HA ASP A 79 1.908 -8.997 -9.568 1.00 0.00 H new ATOM 0 HB2 ASP A 79 -0.425 -7.968 -8.547 1.00 0.00 H new ATOM 0 HB3 ASP A 79 0.518 -6.493 -8.630 1.00 0.00 H new ATOM 656 N ILE A 80 3.226 -6.610 -9.719 1.00 0.00 N ATOM 657 CA ILE A 80 4.043 -5.359 -9.688 1.00 0.00 C ATOM 658 C ILE A 80 3.064 -4.135 -9.558 1.00 0.00 C ATOM 659 O ILE A 80 1.947 -4.139 -10.089 1.00 0.00 O ATOM 660 CB ILE A 80 5.009 -5.332 -10.927 1.00 0.00 C ATOM 661 CG1 ILE A 80 6.064 -6.479 -10.893 1.00 0.00 C ATOM 662 CG2 ILE A 80 5.724 -3.973 -11.107 1.00 0.00 C ATOM 663 CD1 ILE A 80 6.765 -6.791 -12.224 1.00 0.00 C ATOM 0 H ILE A 80 2.899 -6.861 -10.652 1.00 0.00 H new ATOM 0 HA ILE A 80 4.703 -5.309 -8.822 1.00 0.00 H new ATOM 0 HB ILE A 80 4.359 -5.488 -11.788 1.00 0.00 H new ATOM 0 HG12 ILE A 80 6.825 -6.224 -10.156 1.00 0.00 H new ATOM 0 HG13 ILE A 80 5.573 -7.387 -10.543 1.00 0.00 H new ATOM 0 HG21 ILE A 80 6.377 -4.018 -11.979 1.00 0.00 H new ATOM 0 HG22 ILE A 80 4.982 -3.187 -11.249 1.00 0.00 H new ATOM 0 HG23 ILE A 80 6.318 -3.754 -10.220 1.00 0.00 H new ATOM 0 HD11 ILE A 80 7.476 -7.604 -12.079 1.00 0.00 H new ATOM 0 HD12 ILE A 80 6.023 -7.086 -12.966 1.00 0.00 H new ATOM 0 HD13 ILE A 80 7.294 -5.904 -12.573 1.00 0.00 H new ATOM 664 N TYR A 81 3.512 -3.094 -8.825 1.00 0.00 N ATOM 665 CA TYR A 81 2.645 -1.960 -8.380 1.00 0.00 C ATOM 666 C TYR A 81 3.316 -0.573 -8.660 1.00 0.00 C ATOM 667 O TYR A 81 4.502 -0.463 -8.988 1.00 0.00 O ATOM 668 CB TYR A 81 2.362 -2.141 -6.849 1.00 0.00 C ATOM 669 CG TYR A 81 1.521 -3.387 -6.481 1.00 0.00 C ATOM 670 CD1 TYR A 81 0.176 -3.518 -6.853 1.00 0.00 C ATOM 671 CD2 TYR A 81 2.149 -4.450 -5.824 1.00 0.00 C ATOM 672 CE1 TYR A 81 -0.463 -4.744 -6.697 1.00 0.00 C ATOM 673 CE2 TYR A 81 1.481 -5.647 -5.598 1.00 0.00 C ATOM 674 CZ TYR A 81 0.177 -5.798 -6.050 1.00 0.00 C ATOM 675 OH TYR A 81 -0.466 -6.991 -5.850 1.00 0.00 O ATOM 0 H TYR A 81 4.482 -3.007 -8.521 1.00 0.00 H new ATOM 0 HA TYR A 81 1.712 -1.973 -8.944 1.00 0.00 H new ATOM 0 HB2 TYR A 81 3.315 -2.197 -6.323 1.00 0.00 H new ATOM 0 HB3 TYR A 81 1.847 -1.253 -6.483 1.00 0.00 H new ATOM 0 HD1 TYR A 81 -0.361 -2.673 -7.258 1.00 0.00 H new ATOM 0 HD2 TYR A 81 3.169 -4.339 -5.487 1.00 0.00 H new ATOM 0 HE1 TYR A 81 -1.463 -4.879 -7.081 1.00 0.00 H new ATOM 0 HE2 TYR A 81 1.972 -6.454 -5.075 1.00 0.00 H new ATOM 0 HH TYR A 81 -1.404 -6.823 -5.622 1.00 0.00 H new ATOM 676 N LYS A 82 2.534 0.512 -8.487 1.00 0.00 N ATOM 677 CA LYS A 82 3.075 1.881 -8.247 1.00 0.00 C ATOM 678 C LYS A 82 2.008 2.698 -7.456 1.00 0.00 C ATOM 679 O LYS A 82 0.796 2.547 -7.657 1.00 0.00 O ATOM 680 CB LYS A 82 3.575 2.622 -9.528 1.00 0.00 C ATOM 681 CG LYS A 82 2.539 3.369 -10.405 1.00 0.00 C ATOM 682 CD LYS A 82 3.166 4.080 -11.618 1.00 0.00 C ATOM 683 CE LYS A 82 2.109 4.797 -12.478 1.00 0.00 C ATOM 684 NZ LYS A 82 2.733 5.557 -13.575 1.00 0.00 N ATOM 0 H LYS A 82 1.515 0.473 -8.508 1.00 0.00 H new ATOM 0 HA LYS A 82 3.984 1.780 -7.654 1.00 0.00 H new ATOM 0 HB2 LYS A 82 4.330 3.345 -9.219 1.00 0.00 H new ATOM 0 HB3 LYS A 82 4.076 1.889 -10.160 1.00 0.00 H new ATOM 0 HG2 LYS A 82 1.791 2.658 -10.756 1.00 0.00 H new ATOM 0 HG3 LYS A 82 2.017 4.104 -9.792 1.00 0.00 H new ATOM 0 HD2 LYS A 82 3.903 4.804 -11.272 1.00 0.00 H new ATOM 0 HD3 LYS A 82 3.698 3.351 -12.230 1.00 0.00 H new ATOM 0 HE2 LYS A 82 1.415 4.064 -12.890 1.00 0.00 H new ATOM 0 HE3 LYS A 82 1.525 5.472 -11.852 1.00 0.00 H new ATOM 0 HZ1 LYS A 82 1.994 6.028 -14.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 82 3.377 6.272 -13.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 82 3.270 4.908 -14.186 1.00 0.00 H new ATOM 685 N VAL A 83 2.482 3.612 -6.597 1.00 0.00 N ATOM 686 CA VAL A 83 1.617 4.494 -5.769 1.00 0.00 C ATOM 687 C VAL A 83 1.432 5.897 -6.411 1.00 0.00 C ATOM 688 O VAL A 83 2.352 6.430 -7.038 1.00 0.00 O ATOM 689 CB VAL A 83 2.186 4.540 -4.315 1.00 0.00 C ATOM 690 CG1 VAL A 83 3.507 5.321 -4.115 1.00 0.00 C ATOM 691 CG2 VAL A 83 1.159 4.980 -3.252 1.00 0.00 C ATOM 0 H VAL A 83 3.479 3.768 -6.450 1.00 0.00 H new ATOM 0 HA VAL A 83 0.610 4.081 -5.721 1.00 0.00 H new ATOM 0 HB VAL A 83 2.430 3.489 -4.160 1.00 0.00 H new ATOM 0 HG11 VAL A 83 3.799 5.280 -3.066 1.00 0.00 H new ATOM 0 HG12 VAL A 83 4.290 4.874 -4.727 1.00 0.00 H new ATOM 0 HG13 VAL A 83 3.364 6.360 -4.411 1.00 0.00 H new ATOM 0 HG21 VAL A 83 1.632 4.986 -2.270 1.00 0.00 H new ATOM 0 HG22 VAL A 83 0.798 5.981 -3.487 1.00 0.00 H new ATOM 0 HG23 VAL A 83 0.320 4.284 -3.246 1.00 0.00 H new ATOM 692 N SER A 84 0.258 6.498 -6.157 1.00 0.00 N ATOM 693 CA SER A 84 0.068 7.972 -6.219 1.00 0.00 C ATOM 694 C SER A 84 -0.591 8.451 -4.890 1.00 0.00 C ATOM 695 O SER A 84 -1.437 7.770 -4.296 1.00 0.00 O ATOM 696 CB SER A 84 -0.807 8.396 -7.416 1.00 0.00 C ATOM 697 OG SER A 84 -0.220 8.027 -8.659 1.00 0.00 O ATOM 0 H SER A 84 -0.587 5.986 -5.903 1.00 0.00 H new ATOM 0 HA SER A 84 1.046 8.435 -6.353 1.00 0.00 H new ATOM 0 HB2 SER A 84 -1.791 7.935 -7.328 1.00 0.00 H new ATOM 0 HB3 SER A 84 -0.957 9.475 -7.392 1.00 0.00 H new ATOM 0 HG SER A 84 -0.804 8.311 -9.393 1.00 0.00 H new ATOM 698 N ILE A 85 -0.211 9.666 -4.467 1.00 0.00 N ATOM 699 CA ILE A 85 -0.881 10.405 -3.356 1.00 0.00 C ATOM 700 C ILE A 85 -1.433 11.697 -4.020 1.00 0.00 C ATOM 701 O ILE A 85 -0.673 12.526 -4.529 1.00 0.00 O ATOM 702 CB ILE A 85 0.040 10.736 -2.124 1.00 0.00 C ATOM 703 CG1 ILE A 85 0.608 9.468 -1.417 1.00 0.00 C ATOM 704 CG2 ILE A 85 -0.699 11.618 -1.075 1.00 0.00 C ATOM 705 CD1 ILE A 85 1.610 9.737 -0.277 1.00 0.00 C ATOM 0 H ILE A 85 0.571 10.176 -4.879 1.00 0.00 H new ATOM 0 HA ILE A 85 -1.656 9.780 -2.912 1.00 0.00 H new ATOM 0 HB ILE A 85 0.882 11.289 -2.540 1.00 0.00 H new ATOM 0 HG12 ILE A 85 -0.226 8.893 -1.016 1.00 0.00 H new ATOM 0 HG13 ILE A 85 1.095 8.843 -2.166 1.00 0.00 H new ATOM 0 HG21 ILE A 85 -0.031 11.826 -0.239 1.00 0.00 H new ATOM 0 HG22 ILE A 85 -1.003 12.557 -1.538 1.00 0.00 H new ATOM 0 HG23 ILE A 85 -1.581 11.090 -0.712 1.00 0.00 H new ATOM 0 HD11 ILE A 85 1.943 8.789 0.146 1.00 0.00 H new ATOM 0 HD12 ILE A 85 2.469 10.281 -0.669 1.00 0.00 H new ATOM 0 HD13 ILE A 85 1.127 10.331 0.499 1.00 0.00 H new ATOM 706 N TYR A 86 -2.754 11.884 -3.904 1.00 0.00 N ATOM 707 CA TYR A 86 -3.437 13.171 -4.212 1.00 0.00 C ATOM 708 C TYR A 86 -3.938 13.769 -2.861 1.00 0.00 C ATOM 709 O TYR A 86 -4.298 13.047 -1.918 1.00 0.00 O ATOM 710 CB TYR A 86 -4.573 12.997 -5.268 1.00 0.00 C ATOM 711 CG TYR A 86 -4.286 12.124 -6.517 1.00 0.00 C ATOM 712 CD1 TYR A 86 -4.499 10.738 -6.460 1.00 0.00 C ATOM 713 CD2 TYR A 86 -3.783 12.688 -7.694 1.00 0.00 C ATOM 714 CE1 TYR A 86 -4.211 9.935 -7.557 1.00 0.00 C ATOM 715 CE2 TYR A 86 -3.492 11.880 -8.790 1.00 0.00 C ATOM 716 CZ TYR A 86 -3.707 10.501 -8.721 1.00 0.00 C ATOM 717 OH TYR A 86 -3.401 9.704 -9.794 1.00 0.00 O ATOM 0 H TYR A 86 -3.392 11.151 -3.593 1.00 0.00 H new ATOM 0 HA TYR A 86 -2.742 13.869 -4.679 1.00 0.00 H new ATOM 0 HB2 TYR A 86 -5.439 12.575 -4.759 1.00 0.00 H new ATOM 0 HB3 TYR A 86 -4.860 13.990 -5.615 1.00 0.00 H new ATOM 0 HD1 TYR A 86 -4.890 10.292 -5.557 1.00 0.00 H new ATOM 0 HD2 TYR A 86 -3.620 13.754 -7.753 1.00 0.00 H new ATOM 0 HE1 TYR A 86 -4.379 8.869 -7.504 1.00 0.00 H new ATOM 0 HE2 TYR A 86 -3.099 12.320 -9.695 1.00 0.00 H new ATOM 0 HH TYR A 86 -3.061 10.259 -10.527 1.00 0.00 H new ATOM 718 N ASP A 87 -3.966 15.106 -2.756 1.00 0.00 N ATOM 719 CA ASP A 87 -4.406 15.813 -1.512 1.00 0.00 C ATOM 720 C ASP A 87 -5.963 15.765 -1.314 1.00 0.00 C ATOM 721 O ASP A 87 -6.691 15.111 -2.070 1.00 0.00 O ATOM 722 CB ASP A 87 -3.828 17.262 -1.545 1.00 0.00 C ATOM 723 CG ASP A 87 -2.299 17.386 -1.453 1.00 0.00 C ATOM 724 OD1 ASP A 87 -1.727 17.070 -0.389 1.00 0.00 O ATOM 725 OD2 ASP A 87 -1.668 17.803 -2.448 1.00 0.00 O ATOM 0 H ASP A 87 -3.691 15.734 -3.512 1.00 0.00 H new ATOM 0 HA ASP A 87 -4.011 15.299 -0.636 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -4.155 17.740 -2.468 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -4.267 17.825 -0.721 1.00 0.00 H new ATOM 726 N THR A 88 -6.492 16.489 -0.302 1.00 0.00 N ATOM 727 CA THR A 88 -7.949 16.827 -0.198 1.00 0.00 C ATOM 728 C THR A 88 -8.597 17.460 -1.476 1.00 0.00 C ATOM 729 O THR A 88 -9.688 17.047 -1.884 1.00 0.00 O ATOM 730 CB THR A 88 -8.317 17.640 1.093 1.00 0.00 C ATOM 731 OG1 THR A 88 -8.191 19.043 0.884 1.00 0.00 O ATOM 732 CG2 THR A 88 -7.599 17.290 2.405 1.00 0.00 C ATOM 0 H THR A 88 -5.933 16.859 0.467 1.00 0.00 H new ATOM 0 HA THR A 88 -8.407 15.842 -0.109 1.00 0.00 H new ATOM 0 HB THR A 88 -9.350 17.327 1.244 1.00 0.00 H new ATOM 0 HG1 THR A 88 -7.764 19.453 1.665 1.00 0.00 H new ATOM 0 HG21 THR A 88 -7.962 17.938 3.203 1.00 0.00 H new ATOM 0 HG22 THR A 88 -7.799 16.250 2.663 1.00 0.00 H new ATOM 0 HG23 THR A 88 -6.525 17.433 2.282 1.00 0.00 H new ATOM 733 N LYS A 89 -7.900 18.426 -2.103 1.00 0.00 N ATOM 734 CA LYS A 89 -8.291 19.010 -3.412 1.00 0.00 C ATOM 735 C LYS A 89 -8.164 18.081 -4.667 1.00 0.00 C ATOM 736 O LYS A 89 -8.881 18.329 -5.641 1.00 0.00 O ATOM 737 CB LYS A 89 -7.529 20.358 -3.577 1.00 0.00 C ATOM 738 CG LYS A 89 -6.010 20.263 -3.885 1.00 0.00 C ATOM 739 CD LYS A 89 -5.184 21.526 -3.581 1.00 0.00 C ATOM 740 CE LYS A 89 -4.820 21.696 -2.094 1.00 0.00 C ATOM 741 NZ LYS A 89 -3.957 22.873 -1.884 1.00 0.00 N ATOM 0 H LYS A 89 -7.045 18.829 -1.719 1.00 0.00 H new ATOM 0 HA LYS A 89 -9.369 19.166 -3.378 1.00 0.00 H new ATOM 0 HB2 LYS A 89 -8.005 20.923 -4.379 1.00 0.00 H new ATOM 0 HB3 LYS A 89 -7.656 20.936 -2.661 1.00 0.00 H new ATOM 0 HG2 LYS A 89 -5.594 19.433 -3.313 1.00 0.00 H new ATOM 0 HG3 LYS A 89 -5.887 20.017 -4.940 1.00 0.00 H new ATOM 0 HD2 LYS A 89 -4.266 21.497 -4.168 1.00 0.00 H new ATOM 0 HD3 LYS A 89 -5.744 22.401 -3.909 1.00 0.00 H new ATOM 0 HE2 LYS A 89 -5.731 21.801 -1.504 1.00 0.00 H new ATOM 0 HE3 LYS A 89 -4.310 20.801 -1.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 -3.729 22.961 -0.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 -3.078 22.761 -2.428 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 -4.454 23.729 -2.202 1.00 0.00 H new ATOM 742 N GLY A 90 -7.264 17.067 -4.683 1.00 0.00 N ATOM 743 CA GLY A 90 -6.933 16.312 -5.914 1.00 0.00 C ATOM 744 C GLY A 90 -5.736 16.936 -6.654 1.00 0.00 C ATOM 745 O GLY A 90 -5.909 17.544 -7.715 1.00 0.00 O ATOM 0 H GLY A 90 -6.755 16.754 -3.856 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -6.704 15.278 -5.657 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -7.800 16.292 -6.574 1.00 0.00 H new ATOM 746 N LYS A 91 -4.537 16.794 -6.063 1.00 0.00 N ATOM 747 CA LYS A 91 -3.294 17.428 -6.575 1.00 0.00 C ATOM 748 C LYS A 91 -2.126 16.474 -6.225 1.00 0.00 C ATOM 749 O LYS A 91 -1.807 16.265 -5.045 1.00 0.00 O ATOM 750 CB LYS A 91 -3.127 18.840 -5.958 1.00 0.00 C ATOM 751 CG LYS A 91 -1.966 19.670 -6.548 1.00 0.00 C ATOM 752 CD LYS A 91 -1.741 21.045 -5.877 1.00 0.00 C ATOM 753 CE LYS A 91 -1.285 21.032 -4.403 1.00 0.00 C ATOM 754 NZ LYS A 91 0.060 20.452 -4.212 1.00 0.00 N ATOM 0 H LYS A 91 -4.395 16.239 -5.219 1.00 0.00 H new ATOM 0 HA LYS A 91 -3.323 17.575 -7.655 1.00 0.00 H new ATOM 0 HB2 LYS A 91 -4.056 19.393 -6.094 1.00 0.00 H new ATOM 0 HB3 LYS A 91 -2.972 18.736 -4.884 1.00 0.00 H new ATOM 0 HG2 LYS A 91 -1.047 19.089 -6.469 1.00 0.00 H new ATOM 0 HG3 LYS A 91 -2.154 19.827 -7.610 1.00 0.00 H new ATOM 0 HD2 LYS A 91 -0.997 21.589 -6.458 1.00 0.00 H new ATOM 0 HD3 LYS A 91 -2.671 21.610 -5.940 1.00 0.00 H new ATOM 0 HE2 LYS A 91 -1.291 22.052 -4.019 1.00 0.00 H new ATOM 0 HE3 LYS A 91 -2.005 20.465 -3.812 1.00 0.00 H new ATOM 0 HZ1 LYS A 91 0.307 20.473 -3.202 1.00 0.00 H new ATOM 0 HZ2 LYS A 91 0.065 19.468 -4.550 1.00 0.00 H new ATOM 0 HZ3 LYS A 91 0.757 21.006 -4.750 1.00 0.00 H new ATOM 755 N ASN A 92 -1.498 15.900 -7.266 1.00 0.00 N ATOM 756 CA ASN A 92 -0.510 14.804 -7.104 1.00 0.00 C ATOM 757 C ASN A 92 0.850 15.319 -6.549 1.00 0.00 C ATOM 758 O ASN A 92 1.524 16.149 -7.169 1.00 0.00 O ATOM 759 CB ASN A 92 -0.343 14.043 -8.449 1.00 0.00 C ATOM 760 CG ASN A 92 0.429 12.705 -8.362 1.00 0.00 C ATOM 761 OD1 ASN A 92 0.331 11.947 -7.398 1.00 0.00 O ATOM 762 ND2 ASN A 92 1.211 12.391 -9.384 1.00 0.00 N ATOM 0 H ASN A 92 -1.654 16.175 -8.236 1.00 0.00 H new ATOM 0 HA ASN A 92 -0.891 14.105 -6.359 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -1.333 13.846 -8.861 1.00 0.00 H new ATOM 0 HB3 ASN A 92 0.172 14.695 -9.155 1.00 0.00 H new ATOM 0 HD21 ASN A 92 1.736 11.517 -9.375 1.00 0.00 H new ATOM 0 HD22 ASN A 92 1.288 13.024 -10.180 1.00 0.00 H new ATOM 763 N VAL A 93 1.216 14.792 -5.375 1.00 0.00 N ATOM 764 CA VAL A 93 2.429 15.208 -4.614 1.00 0.00 C ATOM 765 C VAL A 93 3.587 14.171 -4.737 1.00 0.00 C ATOM 766 O VAL A 93 4.682 14.507 -5.191 1.00 0.00 O ATOM 767 CB VAL A 93 2.101 15.653 -3.141 1.00 0.00 C ATOM 768 CG1 VAL A 93 1.771 17.157 -3.046 1.00 0.00 C ATOM 769 CG2 VAL A 93 1.043 14.828 -2.369 1.00 0.00 C ATOM 0 H VAL A 93 0.682 14.057 -4.911 1.00 0.00 H new ATOM 0 HA VAL A 93 2.811 16.112 -5.088 1.00 0.00 H new ATOM 0 HB VAL A 93 3.039 15.436 -2.629 1.00 0.00 H new ATOM 0 HG11 VAL A 93 1.552 17.417 -2.010 1.00 0.00 H new ATOM 0 HG12 VAL A 93 2.625 17.739 -3.393 1.00 0.00 H new ATOM 0 HG13 VAL A 93 0.903 17.379 -3.667 1.00 0.00 H new ATOM 0 HG21 VAL A 93 0.916 15.244 -1.369 1.00 0.00 H new ATOM 0 HG22 VAL A 93 0.093 14.866 -2.901 1.00 0.00 H new ATOM 0 HG23 VAL A 93 1.375 13.793 -2.292 1.00 0.00 H new ATOM 770 N LEU A 94 3.316 12.928 -4.325 1.00 0.00 N ATOM 771 CA LEU A 94 4.277 11.789 -4.388 1.00 0.00 C ATOM 772 C LEU A 94 3.774 10.724 -5.407 1.00 0.00 C ATOM 773 O LEU A 94 2.594 10.360 -5.412 1.00 0.00 O ATOM 774 CB LEU A 94 4.435 11.194 -2.958 1.00 0.00 C ATOM 775 CG LEU A 94 5.582 10.165 -2.738 1.00 0.00 C ATOM 776 CD1 LEU A 94 6.990 10.773 -2.906 1.00 0.00 C ATOM 777 CD2 LEU A 94 5.464 9.511 -1.348 1.00 0.00 C ATOM 0 H LEU A 94 2.413 12.667 -3.930 1.00 0.00 H new ATOM 0 HA LEU A 94 5.253 12.130 -4.733 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.585 12.020 -2.263 1.00 0.00 H new ATOM 0 HB3 LEU A 94 3.495 10.715 -2.686 1.00 0.00 H new ATOM 0 HG LEU A 94 5.464 9.412 -3.517 1.00 0.00 H new ATOM 0 HD11 LEU A 94 7.742 10.002 -2.739 1.00 0.00 H new ATOM 0 HD12 LEU A 94 7.096 11.171 -3.915 1.00 0.00 H new ATOM 0 HD13 LEU A 94 7.128 11.577 -2.183 1.00 0.00 H new ATOM 0 HD21 LEU A 94 6.274 8.795 -1.213 1.00 0.00 H new ATOM 0 HD22 LEU A 94 5.527 10.280 -0.578 1.00 0.00 H new ATOM 0 HD23 LEU A 94 4.507 8.995 -1.269 1.00 0.00 H new ATOM 778 N GLU A 95 4.692 10.198 -6.244 1.00 0.00 N ATOM 779 CA GLU A 95 4.403 9.068 -7.175 1.00 0.00 C ATOM 780 C GLU A 95 5.701 8.218 -7.307 1.00 0.00 C ATOM 781 O GLU A 95 6.769 8.755 -7.624 1.00 0.00 O ATOM 782 CB GLU A 95 3.874 9.595 -8.539 1.00 0.00 C ATOM 783 CG GLU A 95 3.280 8.505 -9.456 1.00 0.00 C ATOM 784 CD GLU A 95 2.810 9.038 -10.811 1.00 0.00 C ATOM 785 OE1 GLU A 95 3.661 9.243 -11.706 1.00 0.00 O ATOM 786 OE2 GLU A 95 1.591 9.258 -10.989 1.00 0.00 O ATOM 0 H GLU A 95 5.652 10.537 -6.300 1.00 0.00 H new ATOM 0 HA GLU A 95 3.609 8.432 -6.784 1.00 0.00 H new ATOM 0 HB2 GLU A 95 3.111 10.351 -8.352 1.00 0.00 H new ATOM 0 HB3 GLU A 95 4.690 10.090 -9.065 1.00 0.00 H new ATOM 0 HG2 GLU A 95 4.029 7.730 -9.619 1.00 0.00 H new ATOM 0 HG3 GLU A 95 2.439 8.033 -8.948 1.00 0.00 H new ATOM 787 N LYS A 96 5.619 6.899 -7.018 1.00 0.00 N ATOM 788 CA LYS A 96 6.827 6.043 -6.804 1.00 0.00 C ATOM 789 C LYS A 96 6.484 4.550 -7.095 1.00 0.00 C ATOM 790 O LYS A 96 5.391 4.066 -6.788 1.00 0.00 O ATOM 791 CB LYS A 96 7.390 6.277 -5.368 1.00 0.00 C ATOM 792 CG LYS A 96 8.789 5.671 -5.107 1.00 0.00 C ATOM 793 CD LYS A 96 9.503 6.166 -3.829 1.00 0.00 C ATOM 794 CE LYS A 96 9.011 5.590 -2.484 1.00 0.00 C ATOM 795 NZ LYS A 96 7.736 6.163 -2.014 1.00 0.00 N ATOM 0 H LYS A 96 4.735 6.398 -6.926 1.00 0.00 H new ATOM 0 HA LYS A 96 7.616 6.321 -7.503 1.00 0.00 H new ATOM 0 HB2 LYS A 96 7.435 7.350 -5.182 1.00 0.00 H new ATOM 0 HB3 LYS A 96 6.689 5.858 -4.646 1.00 0.00 H new ATOM 0 HG2 LYS A 96 8.691 4.587 -5.050 1.00 0.00 H new ATOM 0 HG3 LYS A 96 9.425 5.889 -5.965 1.00 0.00 H new ATOM 0 HD2 LYS A 96 10.565 5.941 -3.926 1.00 0.00 H new ATOM 0 HD3 LYS A 96 9.409 7.251 -3.787 1.00 0.00 H new ATOM 0 HE2 LYS A 96 8.897 4.511 -2.583 1.00 0.00 H new ATOM 0 HE3 LYS A 96 9.775 5.762 -1.726 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 7.646 6.016 -0.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 7.716 7.182 -2.220 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 6.945 5.696 -2.501 1.00 0.00 H new ATOM 796 N ILE A 97 7.439 3.818 -7.687 1.00 0.00 N ATOM 797 CA ILE A 97 7.206 2.460 -8.273 1.00 0.00 C ATOM 798 C ILE A 97 7.690 1.377 -7.248 1.00 0.00 C ATOM 799 O ILE A 97 8.604 1.584 -6.445 1.00 0.00 O ATOM 800 CB ILE A 97 7.844 2.357 -9.712 1.00 0.00 C ATOM 801 CG1 ILE A 97 7.513 3.568 -10.649 1.00 0.00 C ATOM 802 CG2 ILE A 97 7.482 1.015 -10.411 1.00 0.00 C ATOM 803 CD1 ILE A 97 8.233 3.601 -12.007 1.00 0.00 C ATOM 0 H ILE A 97 8.403 4.139 -7.781 1.00 0.00 H new ATOM 0 HA ILE A 97 6.144 2.276 -8.436 1.00 0.00 H new ATOM 0 HB ILE A 97 8.920 2.388 -9.541 1.00 0.00 H new ATOM 0 HG12 ILE A 97 6.439 3.574 -10.832 1.00 0.00 H new ATOM 0 HG13 ILE A 97 7.750 4.488 -10.115 1.00 0.00 H new ATOM 0 HG21 ILE A 97 7.941 0.984 -11.399 1.00 0.00 H new ATOM 0 HG22 ILE A 97 7.852 0.182 -9.813 1.00 0.00 H new ATOM 0 HG23 ILE A 97 6.399 0.937 -10.511 1.00 0.00 H new ATOM 0 HD11 ILE A 97 7.921 4.485 -12.563 1.00 0.00 H new ATOM 0 HD12 ILE A 97 9.311 3.635 -11.847 1.00 0.00 H new ATOM 0 HD13 ILE A 97 7.978 2.707 -12.576 1.00 0.00 H new ATOM 804 N PHE A 98 6.997 0.228 -7.229 1.00 0.00 N ATOM 805 CA PHE A 98 7.204 -0.888 -6.251 1.00 0.00 C ATOM 806 C PHE A 98 6.980 -2.243 -7.010 1.00 0.00 C ATOM 807 O PHE A 98 6.405 -2.261 -8.106 1.00 0.00 O ATOM 808 CB PHE A 98 6.189 -0.726 -5.081 1.00 0.00 C ATOM 809 CG PHE A 98 6.495 0.379 -4.039 1.00 0.00 C ATOM 810 CD1 PHE A 98 6.247 1.727 -4.337 1.00 0.00 C ATOM 811 CD2 PHE A 98 6.959 0.041 -2.762 1.00 0.00 C ATOM 812 CE1 PHE A 98 6.487 2.720 -3.393 1.00 0.00 C ATOM 813 CE2 PHE A 98 7.176 1.036 -1.808 1.00 0.00 C ATOM 814 CZ PHE A 98 6.936 2.371 -2.121 1.00 0.00 C ATOM 0 H PHE A 98 6.257 0.030 -7.902 1.00 0.00 H new ATOM 0 HA PHE A 98 8.211 -0.872 -5.835 1.00 0.00 H new ATOM 0 HB2 PHE A 98 5.206 -0.527 -5.509 1.00 0.00 H new ATOM 0 HB3 PHE A 98 6.121 -1.679 -4.556 1.00 0.00 H new ATOM 0 HD1 PHE A 98 5.865 1.997 -5.311 1.00 0.00 H new ATOM 0 HD2 PHE A 98 7.150 -0.993 -2.515 1.00 0.00 H new ATOM 0 HE1 PHE A 98 6.326 3.758 -3.645 1.00 0.00 H new ATOM 0 HE2 PHE A 98 7.531 0.769 -0.824 1.00 0.00 H new ATOM 0 HZ PHE A 98 7.098 3.137 -1.377 1.00 0.00 H new ATOM 815 N ASP A 99 7.442 -3.399 -6.477 1.00 0.00 N ATOM 816 CA ASP A 99 7.405 -4.684 -7.248 1.00 0.00 C ATOM 817 C ASP A 99 7.303 -5.895 -6.275 1.00 0.00 C ATOM 818 O ASP A 99 8.375 -6.336 -5.836 1.00 0.00 O ATOM 819 CB ASP A 99 8.680 -4.859 -8.156 1.00 0.00 C ATOM 820 CG ASP A 99 8.958 -3.876 -9.302 1.00 0.00 C ATOM 821 OD1 ASP A 99 9.331 -2.714 -9.030 1.00 0.00 O ATOM 822 OD2 ASP A 99 8.842 -4.271 -10.483 1.00 0.00 O ATOM 0 H ASP A 99 7.837 -3.479 -5.540 1.00 0.00 H new ATOM 0 HA ASP A 99 6.526 -4.648 -7.892 1.00 0.00 H new ATOM 0 HB2 ASP A 99 9.549 -4.841 -7.498 1.00 0.00 H new ATOM 0 HB3 ASP A 99 8.631 -5.857 -8.592 1.00 0.00 H new ATOM 823 N LEU A 100 6.120 -6.504 -5.938 1.00 0.00 N ATOM 824 CA LEU A 100 6.150 -7.726 -5.080 1.00 0.00 C ATOM 825 C LEU A 100 6.402 -8.996 -5.950 1.00 0.00 C ATOM 826 O LEU A 100 5.601 -9.326 -6.830 1.00 0.00 O ATOM 827 CB LEU A 100 4.902 -7.834 -4.171 1.00 0.00 C ATOM 828 CG LEU A 100 5.149 -8.453 -2.762 1.00 0.00 C ATOM 829 CD1 LEU A 100 3.818 -8.522 -2.016 1.00 0.00 C ATOM 830 CD2 LEU A 100 5.852 -9.829 -2.735 1.00 0.00 C ATOM 0 H LEU A 100 5.193 -6.191 -6.227 1.00 0.00 H new ATOM 0 HA LEU A 100 6.991 -7.643 -4.391 1.00 0.00 H new ATOM 0 HB2 LEU A 100 4.481 -6.837 -4.042 1.00 0.00 H new ATOM 0 HB3 LEU A 100 4.150 -8.433 -4.685 1.00 0.00 H new ATOM 0 HG LEU A 100 5.859 -7.788 -2.270 1.00 0.00 H new ATOM 0 HD11 LEU A 100 3.977 -8.954 -1.028 1.00 0.00 H new ATOM 0 HD12 LEU A 100 3.407 -7.518 -1.912 1.00 0.00 H new ATOM 0 HD13 LEU A 100 3.119 -9.144 -2.575 1.00 0.00 H new ATOM 0 HD21 LEU A 100 5.969 -10.158 -1.702 1.00 0.00 H new ATOM 0 HD22 LEU A 100 5.250 -10.556 -3.281 1.00 0.00 H new ATOM 0 HD23 LEU A 100 6.833 -9.746 -3.203 1.00 0.00 H new ATOM 831 N LYS A 101 7.541 -9.668 -5.691 1.00 0.00 N ATOM 832 CA LYS A 101 8.013 -10.860 -6.452 1.00 0.00 C ATOM 833 C LYS A 101 8.255 -12.047 -5.473 1.00 0.00 C ATOM 834 O LYS A 101 8.767 -11.863 -4.361 1.00 0.00 O ATOM 835 CB LYS A 101 9.328 -10.520 -7.214 1.00 0.00 C ATOM 836 CG LYS A 101 9.267 -9.423 -8.310 1.00 0.00 C ATOM 837 CD LYS A 101 8.952 -9.869 -9.757 1.00 0.00 C ATOM 838 CE LYS A 101 7.556 -10.469 -10.023 1.00 0.00 C ATOM 839 NZ LYS A 101 7.531 -11.937 -9.877 1.00 0.00 N ATOM 0 H LYS A 101 8.174 -9.400 -4.937 1.00 0.00 H new ATOM 0 HA LYS A 101 7.251 -11.145 -7.177 1.00 0.00 H new ATOM 0 HB2 LYS A 101 10.073 -10.217 -6.478 1.00 0.00 H new ATOM 0 HB3 LYS A 101 9.693 -11.437 -7.678 1.00 0.00 H new ATOM 0 HG2 LYS A 101 8.514 -8.693 -8.013 1.00 0.00 H new ATOM 0 HG3 LYS A 101 10.226 -8.905 -8.320 1.00 0.00 H new ATOM 0 HD2 LYS A 101 9.079 -9.006 -10.411 1.00 0.00 H new ATOM 0 HD3 LYS A 101 9.698 -10.606 -10.053 1.00 0.00 H new ATOM 0 HE2 LYS A 101 6.837 -10.027 -9.333 1.00 0.00 H new ATOM 0 HE3 LYS A 101 7.236 -10.202 -11.030 1.00 0.00 H new ATOM 0 HZ1 LYS A 101 7.258 -12.371 -10.782 1.00 0.00 H new ATOM 0 HZ2 LYS A 101 8.476 -12.275 -9.602 1.00 0.00 H new ATOM 0 HZ3 LYS A 101 6.842 -12.201 -9.144 1.00 0.00 H new ATOM 840 N ILE A 102 7.920 -13.280 -5.908 1.00 0.00 N ATOM 841 CA ILE A 102 8.093 -14.517 -5.086 1.00 0.00 C ATOM 842 C ILE A 102 9.491 -15.141 -5.381 1.00 0.00 C ATOM 843 O ILE A 102 9.828 -15.424 -6.535 1.00 0.00 O ATOM 844 CB ILE A 102 6.928 -15.547 -5.303 1.00 0.00 C ATOM 845 CG1 ILE A 102 5.504 -14.991 -5.061 1.00 0.00 C ATOM 846 CG2 ILE A 102 7.050 -16.867 -4.506 1.00 0.00 C ATOM 847 CD1 ILE A 102 5.130 -14.556 -3.639 1.00 0.00 C ATOM 0 H ILE A 102 7.524 -13.456 -6.831 1.00 0.00 H new ATOM 0 HA ILE A 102 8.046 -14.242 -4.032 1.00 0.00 H new ATOM 0 HB ILE A 102 7.058 -15.759 -6.364 1.00 0.00 H new ATOM 0 HG12 ILE A 102 5.365 -14.134 -5.719 1.00 0.00 H new ATOM 0 HG13 ILE A 102 4.791 -15.753 -5.375 1.00 0.00 H new ATOM 0 HG21 ILE A 102 6.196 -17.506 -4.728 1.00 0.00 H new ATOM 0 HG22 ILE A 102 7.970 -17.379 -4.789 1.00 0.00 H new ATOM 0 HG23 ILE A 102 7.071 -16.647 -3.439 1.00 0.00 H new ATOM 0 HD11 ILE A 102 4.103 -14.190 -3.629 1.00 0.00 H new ATOM 0 HD12 ILE A 102 5.219 -15.407 -2.963 1.00 0.00 H new ATOM 0 HD13 ILE A 102 5.802 -13.762 -3.313 1.00 0.00 H new ATOM 848 N GLN A 103 10.271 -15.393 -4.312 1.00 0.00 N ATOM 849 CA GLN A 103 11.589 -16.086 -4.404 1.00 0.00 C ATOM 850 C GLN A 103 11.449 -17.640 -4.413 1.00 0.00 C ATOM 851 O GLN A 103 10.488 -18.205 -3.881 1.00 0.00 O ATOM 852 CB GLN A 103 12.555 -15.588 -3.288 1.00 0.00 C ATOM 853 CG GLN A 103 12.107 -15.796 -1.821 1.00 0.00 C ATOM 854 CD GLN A 103 13.221 -15.572 -0.788 1.00 0.00 C ATOM 855 OE1 GLN A 103 13.874 -16.515 -0.339 1.00 0.00 O ATOM 856 NE2 GLN A 103 13.456 -14.332 -0.382 1.00 0.00 N ATOM 0 H GLN A 103 10.015 -15.127 -3.361 1.00 0.00 H new ATOM 0 HA GLN A 103 12.029 -15.822 -5.366 1.00 0.00 H new ATOM 0 HB2 GLN A 103 13.514 -16.089 -3.423 1.00 0.00 H new ATOM 0 HB3 GLN A 103 12.727 -14.523 -3.441 1.00 0.00 H new ATOM 0 HG2 GLN A 103 11.283 -15.116 -1.604 1.00 0.00 H new ATOM 0 HG3 GLN A 103 11.722 -16.810 -1.710 1.00 0.00 H new ATOM 0 HE21 GLN A 103 12.909 -13.559 -0.761 1.00 0.00 H new ATOM 0 HE22 GLN A 103 14.184 -14.151 0.309 1.00 0.00 H new ATOM 857 N GLU A 104 12.448 -18.318 -5.009 1.00 0.00 N ATOM 858 CA GLU A 104 12.563 -19.796 -4.978 1.00 0.00 C ATOM 859 C GLU A 104 14.063 -20.136 -5.178 1.00 0.00 C ATOM 860 O GLU A 104 14.618 -20.049 -6.277 1.00 0.00 O ATOM 861 CB GLU A 104 11.597 -20.562 -5.926 1.00 0.00 C ATOM 862 CG GLU A 104 11.639 -20.242 -7.441 1.00 0.00 C ATOM 863 CD GLU A 104 10.611 -21.049 -8.236 1.00 0.00 C ATOM 864 OE1 GLU A 104 9.442 -20.612 -8.334 1.00 0.00 O ATOM 865 OE2 GLU A 104 10.966 -22.126 -8.766 1.00 0.00 O ATOM 0 H GLU A 104 13.199 -17.861 -5.526 1.00 0.00 H new ATOM 0 HA GLU A 104 12.221 -20.160 -4.009 1.00 0.00 H new ATOM 0 HB2 GLU A 104 11.792 -21.628 -5.807 1.00 0.00 H new ATOM 0 HB3 GLU A 104 10.580 -20.383 -5.578 1.00 0.00 H new ATOM 0 HG2 GLU A 104 11.456 -19.178 -7.590 1.00 0.00 H new ATOM 0 HG3 GLU A 104 12.637 -20.450 -7.826 1.00 0.00 H new ATOM 866 N ARG A 105 14.704 -20.507 -4.058 1.00 0.00 N ATOM 867 CA ARG A 105 16.163 -20.775 -3.989 1.00 0.00 C ATOM 868 C ARG A 105 16.517 -22.150 -4.615 1.00 0.00 C ATOM 869 O ARG A 105 16.075 -23.202 -4.102 1.00 0.00 O ATOM 870 CB ARG A 105 16.624 -20.643 -2.511 1.00 0.00 C ATOM 871 CG ARG A 105 18.151 -20.753 -2.253 1.00 0.00 C ATOM 872 CD ARG A 105 18.624 -22.038 -1.536 1.00 0.00 C ATOM 873 NE ARG A 105 18.192 -22.072 -0.113 1.00 0.00 N ATOM 874 CZ ARG A 105 18.109 -23.182 0.642 1.00 0.00 C ATOM 875 NH1 ARG A 105 18.408 -24.406 0.212 1.00 0.00 N ATOM 876 NH2 ARG A 105 17.706 -23.049 1.893 1.00 0.00 N ATOM 877 OXT ARG A 105 17.247 -22.167 -5.633 1.00 0.00 O ATOM 0 H ARG A 105 14.228 -20.632 -3.165 1.00 0.00 H new ATOM 0 HA ARG A 105 16.705 -20.039 -4.583 1.00 0.00 H new ATOM 0 HB2 ARG A 105 16.281 -19.681 -2.131 1.00 0.00 H new ATOM 0 HB3 ARG A 105 16.122 -21.414 -1.926 1.00 0.00 H new ATOM 0 HG2 ARG A 105 18.667 -20.683 -3.210 1.00 0.00 H new ATOM 0 HG3 ARG A 105 18.462 -19.893 -1.659 1.00 0.00 H new ATOM 0 HD2 ARG A 105 18.228 -22.910 -2.056 1.00 0.00 H new ATOM 0 HD3 ARG A 105 19.711 -22.103 -1.587 1.00 0.00 H new ATOM 0 HE ARG A 105 17.939 -21.186 0.324 1.00 0.00 H new ATOM 0 HH11 ARG A 105 18.724 -24.546 -0.748 1.00 0.00 H new ATOM 0 HH12 ARG A 105 18.321 -25.203 0.842 1.00 0.00 H new ATOM 0 HH21 ARG A 105 17.470 -22.126 2.257 1.00 0.00 H new ATOM 0 HH22 ARG A 105 17.631 -23.869 2.495 1.00 0.00 H new TER 878 ARG A 105