USER MOD reduce.3.24.130724 H: found=0, std=0, add=910, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 911 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 56 THR OG1 : rot 159:sc= -1.51 USER MOD Set 1.2: A 59 GLN :FLIP amide:sc= -1.03 F(o=-3.7,f=-2.5) USER MOD Single : A 3 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 10 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 14 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 CYS SG : rot -27:sc= 0.0728 USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=-0.28) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 SER OG : rot 180:sc= 0.105 USER MOD Single : A 28 LYS NZ :NH3+ -165:sc= -0.0434 (180deg=-0.314) USER MOD Single : A 29 LYS NZ :NH3+ -169:sc= 0 (180deg=-0.0204) USER MOD Single : A 34 ASN : amide:sc= 0 X(o=0,f=0.017) USER MOD Single : A 41 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 43 ASN : amide:sc= -3.21 X(o=-3.2,f=-3.6) USER MOD Single : A 45 SER OG : rot 87:sc= 0.87 USER MOD Single : A 46 THR OG1 : rot 58:sc= 1.13 USER MOD Single : A 65 CYS SG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc=-0.00249 X(o=-0.0025,f=-0.22) USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 SER OG : rot 180:sc= 0.0787 USER MOD Single : A 77 SER OG : rot 180:sc= -0.105 USER MOD Single : A 78 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl 142:sc= -0.419 (180deg=-1.1) USER MOD Single : A 86 THR OG1 : rot -72:sc= 0.978 USER MOD Single : A 88 LYS NZ :NH3+ -160:sc= -1.82! (180deg=-2.69!) USER MOD Single : A 97 ASN : amide:sc= -0.362 X(o=-0.36,f=0) USER MOD Single : A 98 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 102 THR OG1 : rot 180:sc= 0.148 USER MOD Single : A 108 ASN : amide:sc= -0.158 K(o=-0.16,f=-2.1!) USER MOD Single : A 109 MET CE :methyl -156:sc= 0 (180deg=-0.348) USER MOD Single : A 110 TYR OH : rot 180:sc= -1.24 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 112 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 113 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot 180:sc= -0.206 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 2 5.938 0.202 2.533 1.00 13.00 N ATOM 2 CA GLY A 2 6.821 0.437 1.406 1.00 45.03 C ATOM 3 C GLY A 2 6.379 1.613 0.557 1.00 33.05 C ATOM 4 O GLY A 2 5.641 2.480 1.023 1.00 1.12 O ATOM 0 HA2 GLY A 2 7.832 0.617 1.772 1.00 45.03 H new ATOM 0 HA3 GLY A 2 6.861 -0.459 0.787 1.00 45.03 H new ATOM 8 N ASN A 3 6.833 1.643 -0.692 1.00 14.12 N ATOM 9 CA ASN A 3 6.481 2.723 -1.606 1.00 31.02 C ATOM 10 C ASN A 3 5.712 2.188 -2.810 1.00 72.30 C ATOM 11 O ASN A 3 6.273 1.507 -3.667 1.00 75.13 O ATOM 12 CB ASN A 3 7.741 3.453 -2.075 1.00 51.04 C ATOM 13 CG ASN A 3 7.928 4.789 -1.383 1.00 12.21 C ATOM 14 OD1 ASN A 3 8.452 4.856 -0.270 1.00 22.11 O ATOM 15 ND2 ASN A 3 7.499 5.861 -2.038 1.00 3.13 N ATOM 0 H ASN A 3 7.445 0.932 -1.094 1.00 14.12 H new ATOM 0 HA ASN A 3 5.841 3.424 -1.071 1.00 31.02 H new ATOM 0 HB2 ASN A 3 8.612 2.825 -1.888 1.00 51.04 H new ATOM 0 HB3 ASN A 3 7.687 3.610 -3.152 1.00 51.04 H new ATOM 0 HD21 ASN A 3 7.598 6.787 -1.621 1.00 3.13 H new ATOM 0 HD22 ASN A 3 7.071 5.759 -2.958 1.00 3.13 H new ATOM 22 N GLY A 4 4.421 2.502 -2.868 1.00 15.45 N ATOM 23 CA GLY A 4 3.595 2.045 -3.969 1.00 70.45 C ATOM 24 C GLY A 4 3.517 3.058 -5.095 1.00 34.44 C ATOM 25 O GLY A 4 3.266 4.240 -4.856 1.00 4.34 O ATOM 0 H GLY A 4 3.933 3.065 -2.171 1.00 15.45 H new ATOM 0 HA2 GLY A 4 3.996 1.108 -4.355 1.00 70.45 H new ATOM 0 HA3 GLY A 4 2.590 1.835 -3.603 1.00 70.45 H new ATOM 29 N GLN A 5 3.732 2.596 -6.322 1.00 31.31 N ATOM 30 CA GLN A 5 3.686 3.472 -7.486 1.00 55.24 C ATOM 31 C GLN A 5 3.280 2.697 -8.735 1.00 53.24 C ATOM 32 O GLN A 5 3.423 1.477 -8.794 1.00 63.52 O ATOM 33 CB GLN A 5 5.048 4.137 -7.704 1.00 31.22 C ATOM 34 CG GLN A 5 6.118 3.181 -8.206 1.00 63.40 C ATOM 35 CD GLN A 5 7.511 3.775 -8.136 1.00 30.31 C ATOM 36 OE1 GLN A 5 8.142 3.783 -7.079 1.00 12.12 O ATOM 37 NE2 GLN A 5 7.998 4.278 -9.264 1.00 23.14 N ATOM 0 H GLN A 5 3.940 1.621 -6.536 1.00 31.31 H new ATOM 0 HA GLN A 5 2.938 4.243 -7.300 1.00 55.24 H new ATOM 0 HB2 GLN A 5 4.935 4.951 -8.420 1.00 31.22 H new ATOM 0 HB3 GLN A 5 5.381 4.581 -6.766 1.00 31.22 H new ATOM 0 HG2 GLN A 5 6.088 2.265 -7.616 1.00 63.40 H new ATOM 0 HG3 GLN A 5 5.897 2.903 -9.237 1.00 63.40 H new ATOM 0 HE21 GLN A 5 7.440 4.250 -10.117 1.00 23.14 H new ATOM 0 HE22 GLN A 5 8.930 4.692 -9.277 1.00 23.14 H new ATOM 46 N GLY A 6 2.772 3.416 -9.732 1.00 24.25 N ATOM 47 CA GLY A 6 2.351 2.778 -10.966 1.00 42.40 C ATOM 48 C GLY A 6 1.542 3.705 -11.851 1.00 23.52 C ATOM 49 O GLY A 6 1.782 4.912 -11.880 1.00 64.13 O ATOM 0 H GLY A 6 2.645 4.428 -9.707 1.00 24.25 H new ATOM 0 HA2 GLY A 6 3.230 2.435 -11.512 1.00 42.40 H new ATOM 0 HA3 GLY A 6 1.757 1.895 -10.731 1.00 42.40 H new ATOM 53 N ARG A 7 0.581 3.140 -12.575 1.00 61.21 N ATOM 54 CA ARG A 7 -0.265 3.924 -13.468 1.00 54.41 C ATOM 55 C ARG A 7 -1.141 4.891 -12.676 1.00 52.54 C ATOM 56 O ARG A 7 -1.139 6.095 -12.930 1.00 25.34 O ATOM 57 CB ARG A 7 -1.142 3.001 -14.314 1.00 4.13 C ATOM 58 CG ARG A 7 -0.533 2.649 -15.663 1.00 55.20 C ATOM 59 CD ARG A 7 0.215 1.326 -15.608 1.00 73.42 C ATOM 60 NE ARG A 7 1.662 1.512 -15.686 1.00 21.34 N ATOM 61 CZ ARG A 7 2.310 1.767 -16.818 1.00 34.13 C ATOM 62 NH1 ARG A 7 1.644 1.867 -17.959 1.00 23.34 N ATOM 63 NH2 ARG A 7 3.628 1.924 -16.807 1.00 62.42 N ATOM 0 H ARG A 7 0.369 2.142 -12.561 1.00 61.21 H new ATOM 0 HA ARG A 7 0.382 4.503 -14.127 1.00 54.41 H new ATOM 0 HB2 ARG A 7 -1.329 2.082 -13.759 1.00 4.13 H new ATOM 0 HB3 ARG A 7 -2.108 3.479 -14.475 1.00 4.13 H new ATOM 0 HG2 ARG A 7 -1.320 2.592 -16.415 1.00 55.20 H new ATOM 0 HG3 ARG A 7 0.148 3.441 -15.974 1.00 55.20 H new ATOM 0 HD2 ARG A 7 -0.034 0.807 -14.683 1.00 73.42 H new ATOM 0 HD3 ARG A 7 -0.114 0.689 -16.429 1.00 73.42 H new ATOM 0 HE ARG A 7 2.204 1.442 -14.825 1.00 21.34 H new ATOM 0 HH11 ARG A 7 0.631 1.748 -17.970 1.00 23.34 H new ATOM 0 HH12 ARG A 7 2.144 2.063 -18.826 1.00 23.34 H new ATOM 0 HH21 ARG A 7 4.143 1.849 -15.930 1.00 62.42 H new ATOM 0 HH22 ARG A 7 4.126 2.120 -17.676 1.00 62.42 H new ATOM 77 N ASP A 8 -1.887 4.355 -11.717 1.00 13.14 N ATOM 78 CA ASP A 8 -2.767 5.169 -10.887 1.00 40.02 C ATOM 79 C ASP A 8 -2.007 6.344 -10.280 1.00 33.02 C ATOM 80 O ASP A 8 -2.550 7.440 -10.138 1.00 13.24 O ATOM 81 CB ASP A 8 -3.390 4.320 -9.779 1.00 40.30 C ATOM 82 CG ASP A 8 -4.758 4.822 -9.364 1.00 13.14 C ATOM 83 OD1 ASP A 8 -5.747 4.085 -9.565 1.00 31.34 O ATOM 84 OD2 ASP A 8 -4.841 5.951 -8.836 1.00 3.11 O ATOM 0 H ASP A 8 -1.900 3.360 -11.495 1.00 13.14 H new ATOM 0 HA ASP A 8 -3.562 5.562 -11.521 1.00 40.02 H new ATOM 0 HB2 ASP A 8 -3.473 3.288 -10.120 1.00 40.30 H new ATOM 0 HB3 ASP A 8 -2.729 4.317 -8.912 1.00 40.30 H new ATOM 89 N TRP A 9 -0.751 6.108 -9.922 1.00 50.24 N ATOM 90 CA TRP A 9 0.084 7.146 -9.329 1.00 14.04 C ATOM 91 C TRP A 9 0.413 8.230 -10.349 1.00 4.11 C ATOM 92 O TRP A 9 0.070 9.398 -10.163 1.00 15.13 O ATOM 93 CB TRP A 9 1.374 6.540 -8.776 1.00 1.42 C ATOM 94 CG TRP A 9 2.044 7.401 -7.749 1.00 43.23 C ATOM 95 CD1 TRP A 9 3.346 7.812 -7.747 1.00 63.31 C ATOM 96 CD2 TRP A 9 1.445 7.954 -6.573 1.00 13.24 C ATOM 97 NE1 TRP A 9 3.593 8.588 -6.641 1.00 33.44 N ATOM 98 CE2 TRP A 9 2.442 8.691 -5.904 1.00 32.31 C ATOM 99 CE3 TRP A 9 0.163 7.900 -6.019 1.00 75.32 C ATOM 100 CZ2 TRP A 9 2.195 9.367 -4.712 1.00 11.22 C ATOM 101 CZ3 TRP A 9 -0.081 8.571 -4.836 1.00 55.14 C ATOM 102 CH2 TRP A 9 0.931 9.297 -4.193 1.00 74.33 C ATOM 0 H TRP A 9 -0.287 5.206 -10.032 1.00 50.24 H new ATOM 0 HA TRP A 9 -0.474 7.601 -8.511 1.00 14.04 H new ATOM 0 HB2 TRP A 9 1.150 5.569 -8.335 1.00 1.42 H new ATOM 0 HB3 TRP A 9 2.066 6.364 -9.599 1.00 1.42 H new ATOM 0 HD1 TRP A 9 4.075 7.563 -8.504 1.00 63.31 H new ATOM 0 HE1 TRP A 9 4.488 9.018 -6.406 1.00 33.44 H new ATOM 0 HE3 TRP A 9 -0.623 7.343 -6.507 1.00 75.32 H new ATOM 0 HZ2 TRP A 9 2.973 9.927 -4.215 1.00 11.22 H new ATOM 0 HZ3 TRP A 9 -1.068 8.535 -4.399 1.00 55.14 H new ATOM 0 HH2 TRP A 9 0.709 9.811 -3.270 1.00 74.33 H new ATOM 113 N LYS A 10 1.079 7.837 -11.429 1.00 32.10 N ATOM 114 CA LYS A 10 1.454 8.774 -12.481 1.00 43.01 C ATOM 115 C LYS A 10 0.237 9.550 -12.977 1.00 51.24 C ATOM 116 O LYS A 10 0.320 10.748 -13.243 1.00 51.22 O ATOM 117 CB LYS A 10 2.107 8.030 -13.647 1.00 54.43 C ATOM 118 CG LYS A 10 3.625 8.077 -13.625 1.00 41.30 C ATOM 119 CD LYS A 10 4.231 6.856 -14.296 1.00 50.43 C ATOM 120 CE LYS A 10 4.862 7.211 -15.634 1.00 70.35 C ATOM 121 NZ LYS A 10 3.867 7.183 -16.742 1.00 32.43 N ATOM 0 H LYS A 10 1.371 6.874 -11.599 1.00 32.10 H new ATOM 0 HA LYS A 10 2.170 9.482 -12.064 1.00 43.01 H new ATOM 0 HB2 LYS A 10 1.784 6.989 -13.629 1.00 54.43 H new ATOM 0 HB3 LYS A 10 1.752 8.458 -14.585 1.00 54.43 H new ATOM 0 HG2 LYS A 10 3.969 8.979 -14.130 1.00 41.30 H new ATOM 0 HG3 LYS A 10 3.973 8.137 -12.594 1.00 41.30 H new ATOM 0 HD2 LYS A 10 4.984 6.417 -13.642 1.00 50.43 H new ATOM 0 HD3 LYS A 10 3.459 6.101 -14.445 1.00 50.43 H new ATOM 0 HE2 LYS A 10 5.309 8.203 -15.573 1.00 70.35 H new ATOM 0 HE3 LYS A 10 5.668 6.511 -15.852 1.00 70.35 H new ATOM 0 HZ1 LYS A 10 4.336 7.430 -17.636 1.00 32.43 H new ATOM 0 HZ2 LYS A 10 3.458 6.230 -16.818 1.00 32.43 H new ATOM 0 HZ3 LYS A 10 3.110 7.869 -16.547 1.00 32.43 H new ATOM 135 N MET A 11 -0.891 8.858 -13.097 1.00 21.10 N ATOM 136 CA MET A 11 -2.125 9.484 -13.559 1.00 32.23 C ATOM 137 C MET A 11 -2.638 10.493 -12.536 1.00 3.44 C ATOM 138 O MET A 11 -3.211 11.520 -12.896 1.00 45.15 O ATOM 139 CB MET A 11 -3.192 8.421 -13.824 1.00 63.11 C ATOM 140 CG MET A 11 -3.293 8.013 -15.286 1.00 31.24 C ATOM 141 SD MET A 11 -4.845 7.177 -15.668 1.00 72.43 S ATOM 142 CE MET A 11 -4.971 7.488 -17.427 1.00 43.42 C ATOM 0 H MET A 11 -0.976 7.865 -12.881 1.00 21.10 H new ATOM 0 HA MET A 11 -1.910 10.012 -14.488 1.00 32.23 H new ATOM 0 HB2 MET A 11 -2.971 7.539 -13.223 1.00 63.11 H new ATOM 0 HB3 MET A 11 -4.159 8.798 -13.493 1.00 63.11 H new ATOM 0 HG2 MET A 11 -3.198 8.899 -15.914 1.00 31.24 H new ATOM 0 HG3 MET A 11 -2.460 7.355 -15.534 1.00 31.24 H new ATOM 0 HE1 MET A 11 -5.883 7.032 -17.813 1.00 43.42 H new ATOM 0 HE2 MET A 11 -4.999 8.563 -17.605 1.00 43.42 H new ATOM 0 HE3 MET A 11 -4.108 7.058 -17.935 1.00 43.42 H new ATOM 152 N ALA A 12 -2.431 10.190 -11.258 1.00 20.44 N ATOM 153 CA ALA A 12 -2.872 11.071 -10.183 1.00 24.34 C ATOM 154 C ALA A 12 -2.150 12.413 -10.244 1.00 31.45 C ATOM 155 O ALA A 12 -2.764 13.467 -10.069 1.00 32.44 O ATOM 156 CB ALA A 12 -2.647 10.409 -8.832 1.00 21.40 C ATOM 0 H ALA A 12 -1.961 9.342 -10.942 1.00 20.44 H new ATOM 0 HA ALA A 12 -3.939 11.255 -10.311 1.00 24.34 H new ATOM 0 HB1 ALA A 12 -2.981 11.078 -8.039 1.00 21.40 H new ATOM 0 HB2 ALA A 12 -3.213 9.479 -8.784 1.00 21.40 H new ATOM 0 HB3 ALA A 12 -1.586 10.195 -8.704 1.00 21.40 H new ATOM 162 N ILE A 13 -0.846 12.368 -10.490 1.00 71.51 N ATOM 163 CA ILE A 13 -0.042 13.582 -10.573 1.00 22.22 C ATOM 164 C ILE A 13 -0.420 14.409 -11.797 1.00 21.44 C ATOM 165 O ILE A 13 -0.529 15.633 -11.724 1.00 32.31 O ATOM 166 CB ILE A 13 1.462 13.257 -10.633 1.00 74.02 C ATOM 167 CG1 ILE A 13 1.891 12.496 -9.376 1.00 61.20 C ATOM 168 CG2 ILE A 13 2.274 14.535 -10.787 1.00 63.40 C ATOM 169 CD1 ILE A 13 1.784 13.314 -8.109 1.00 53.41 C ATOM 0 H ILE A 13 -0.323 11.505 -10.635 1.00 71.51 H new ATOM 0 HA ILE A 13 -0.246 14.158 -9.671 1.00 22.22 H new ATOM 0 HB ILE A 13 1.648 12.624 -11.501 1.00 74.02 H new ATOM 0 HG12 ILE A 13 1.276 11.602 -9.275 1.00 61.20 H new ATOM 0 HG13 ILE A 13 2.921 12.162 -9.497 1.00 61.20 H new ATOM 0 HG21 ILE A 13 3.335 14.289 -10.828 1.00 63.40 H new ATOM 0 HG22 ILE A 13 1.983 15.042 -11.707 1.00 63.40 H new ATOM 0 HG23 ILE A 13 2.086 15.190 -9.936 1.00 63.40 H new ATOM 0 HD11 ILE A 13 2.104 12.712 -7.259 1.00 53.41 H new ATOM 0 HD12 ILE A 13 2.421 14.195 -8.190 1.00 53.41 H new ATOM 0 HD13 ILE A 13 0.750 13.626 -7.964 1.00 53.41 H new ATOM 181 N LYS A 14 -0.623 13.733 -12.923 1.00 1.32 N ATOM 182 CA LYS A 14 -0.993 14.403 -14.164 1.00 54.40 C ATOM 183 C LYS A 14 -2.406 14.969 -14.075 1.00 24.43 C ATOM 184 O LYS A 14 -2.677 16.068 -14.562 1.00 12.40 O ATOM 185 CB LYS A 14 -0.894 13.431 -15.342 1.00 55.33 C ATOM 186 CG LYS A 14 -1.369 14.021 -16.658 1.00 22.34 C ATOM 187 CD LYS A 14 -2.711 13.442 -17.076 1.00 34.04 C ATOM 188 CE LYS A 14 -2.548 12.092 -17.757 1.00 12.01 C ATOM 189 NZ LYS A 14 -3.848 11.560 -18.252 1.00 42.15 N ATOM 0 H LYS A 14 -0.537 12.720 -13.001 1.00 1.32 H new ATOM 0 HA LYS A 14 -0.299 15.228 -14.323 1.00 54.40 H new ATOM 0 HB2 LYS A 14 0.142 13.109 -15.451 1.00 55.33 H new ATOM 0 HB3 LYS A 14 -1.483 12.541 -15.119 1.00 55.33 H new ATOM 0 HG2 LYS A 14 -1.452 15.104 -16.564 1.00 22.34 H new ATOM 0 HG3 LYS A 14 -0.629 13.825 -17.434 1.00 22.34 H new ATOM 0 HD2 LYS A 14 -3.350 13.334 -16.200 1.00 34.04 H new ATOM 0 HD3 LYS A 14 -3.212 14.134 -17.753 1.00 34.04 H new ATOM 0 HE2 LYS A 14 -1.853 12.188 -18.592 1.00 12.01 H new ATOM 0 HE3 LYS A 14 -2.108 11.382 -17.056 1.00 12.01 H new ATOM 0 HZ1 LYS A 14 -3.694 10.639 -18.710 1.00 42.15 H new ATOM 0 HZ2 LYS A 14 -4.503 11.444 -17.452 1.00 42.15 H new ATOM 0 HZ3 LYS A 14 -4.256 12.225 -18.940 1.00 42.15 H new ATOM 203 N ARG A 15 -3.303 14.214 -13.450 1.00 4.02 N ATOM 204 CA ARG A 15 -4.689 14.642 -13.299 1.00 10.43 C ATOM 205 C ARG A 15 -4.781 15.885 -12.419 1.00 61.32 C ATOM 206 O ARG A 15 -5.312 16.915 -12.837 1.00 60.01 O ATOM 207 CB ARG A 15 -5.529 13.514 -12.696 1.00 32.34 C ATOM 208 CG ARG A 15 -5.980 12.480 -13.713 1.00 11.54 C ATOM 209 CD ARG A 15 -6.841 11.404 -13.069 1.00 5.51 C ATOM 210 NE ARG A 15 -8.243 11.517 -13.461 1.00 0.21 N ATOM 211 CZ ARG A 15 -8.697 11.199 -14.668 1.00 24.11 C ATOM 212 NH1 ARG A 15 -7.863 10.750 -15.596 1.00 24.21 N ATOM 213 NH2 ARG A 15 -9.987 11.329 -14.948 1.00 21.53 N ATOM 0 H ARG A 15 -3.095 13.303 -13.040 1.00 4.02 H new ATOM 0 HA ARG A 15 -5.078 14.888 -14.287 1.00 10.43 H new ATOM 0 HB2 ARG A 15 -4.950 13.017 -11.918 1.00 32.34 H new ATOM 0 HB3 ARG A 15 -6.407 13.944 -12.214 1.00 32.34 H new ATOM 0 HG2 ARG A 15 -6.542 12.971 -14.507 1.00 11.54 H new ATOM 0 HG3 ARG A 15 -5.108 12.020 -14.177 1.00 11.54 H new ATOM 0 HD2 ARG A 15 -6.464 10.421 -13.351 1.00 5.51 H new ATOM 0 HD3 ARG A 15 -6.761 11.477 -11.984 1.00 5.51 H new ATOM 0 HE ARG A 15 -8.911 11.859 -12.770 1.00 0.21 H new ATOM 0 HH11 ARG A 15 -6.871 10.648 -15.384 1.00 24.21 H new ATOM 0 HH12 ARG A 15 -8.214 10.506 -16.522 1.00 24.21 H new ATOM 0 HH21 ARG A 15 -10.631 11.673 -14.236 1.00 21.53 H new ATOM 0 HH22 ARG A 15 -10.335 11.085 -15.875 1.00 21.53 H new ATOM 227 N CYS A 16 -4.261 15.782 -11.202 1.00 34.24 N ATOM 228 CA CYS A 16 -4.286 16.898 -10.262 1.00 64.13 C ATOM 229 C CYS A 16 -3.479 18.077 -10.797 1.00 64.25 C ATOM 230 O CYS A 16 -3.728 19.227 -10.439 1.00 12.22 O ATOM 231 CB CYS A 16 -3.734 16.462 -8.905 1.00 41.13 C ATOM 232 SG CYS A 16 -3.796 17.747 -7.635 1.00 41.14 S ATOM 0 H CYS A 16 -3.817 14.937 -10.842 1.00 34.24 H new ATOM 0 HA CYS A 16 -5.322 17.214 -10.140 1.00 64.13 H new ATOM 0 HB2 CYS A 16 -4.297 15.595 -8.558 1.00 41.13 H new ATOM 0 HB3 CYS A 16 -2.700 16.141 -9.032 1.00 41.13 H new ATOM 0 HG CYS A 16 -3.752 18.917 -8.199 1.00 41.14 H new ATOM 238 N SER A 17 -2.508 17.781 -11.657 1.00 31.20 N ATOM 239 CA SER A 17 -1.661 18.816 -12.238 1.00 45.33 C ATOM 240 C SER A 17 -2.496 19.834 -13.009 1.00 32.33 C ATOM 241 O SER A 17 -2.068 20.966 -13.227 1.00 74.14 O ATOM 242 CB SER A 17 -0.618 18.189 -13.165 1.00 61.23 C ATOM 243 OG SER A 17 -0.393 19.002 -14.304 1.00 63.21 O ATOM 0 H SER A 17 -2.289 16.834 -11.966 1.00 31.20 H new ATOM 0 HA SER A 17 -1.152 19.332 -11.424 1.00 45.33 H new ATOM 0 HB2 SER A 17 0.318 18.050 -12.623 1.00 61.23 H new ATOM 0 HB3 SER A 17 -0.954 17.201 -13.480 1.00 61.23 H new ATOM 0 HG SER A 17 0.279 18.580 -14.880 1.00 63.21 H new ATOM 249 N ASN A 18 -3.692 19.421 -13.417 1.00 41.12 N ATOM 250 CA ASN A 18 -4.588 20.296 -14.164 1.00 44.23 C ATOM 251 C ASN A 18 -5.591 20.969 -13.232 1.00 72.45 C ATOM 252 O ASN A 18 -6.691 21.336 -13.647 1.00 3.33 O ATOM 253 CB ASN A 18 -5.329 19.502 -15.241 1.00 12.33 C ATOM 254 CG ASN A 18 -4.386 18.866 -16.244 1.00 51.31 C ATOM 255 OD1 ASN A 18 -3.413 19.485 -16.675 1.00 72.03 O ATOM 256 ND2 ASN A 18 -4.670 17.624 -16.619 1.00 62.43 N ATOM 0 H ASN A 18 -4.063 18.487 -13.243 1.00 41.12 H new ATOM 0 HA ASN A 18 -3.986 21.069 -14.642 1.00 44.23 H new ATOM 0 HB2 ASN A 18 -5.929 18.725 -14.767 1.00 12.33 H new ATOM 0 HB3 ASN A 18 -6.020 20.163 -15.765 1.00 12.33 H new ATOM 0 HD21 ASN A 18 -4.071 17.144 -17.291 1.00 62.43 H new ATOM 0 HD22 ASN A 18 -5.487 17.150 -16.235 1.00 62.43 H new ATOM 263 N VAL A 19 -5.203 21.131 -11.972 1.00 32.33 N ATOM 264 CA VAL A 19 -6.067 21.763 -10.981 1.00 74.12 C ATOM 265 C VAL A 19 -5.552 23.149 -10.607 1.00 4.54 C ATOM 266 O VAL A 19 -4.375 23.321 -10.292 1.00 65.23 O ATOM 267 CB VAL A 19 -6.177 20.907 -9.705 1.00 21.32 C ATOM 268 CG1 VAL A 19 -7.142 21.544 -8.716 1.00 11.10 C ATOM 269 CG2 VAL A 19 -6.613 19.490 -10.051 1.00 74.42 C ATOM 0 H VAL A 19 -4.296 20.834 -11.612 1.00 32.33 H new ATOM 0 HA VAL A 19 -7.054 21.855 -11.434 1.00 74.12 H new ATOM 0 HB VAL A 19 -5.194 20.857 -9.236 1.00 21.32 H new ATOM 0 HG11 VAL A 19 -7.207 20.925 -7.821 1.00 11.10 H new ATOM 0 HG12 VAL A 19 -6.783 22.537 -8.445 1.00 11.10 H new ATOM 0 HG13 VAL A 19 -8.129 21.627 -9.172 1.00 11.10 H new ATOM 0 HG21 VAL A 19 -6.686 18.899 -9.138 1.00 74.42 H new ATOM 0 HG22 VAL A 19 -7.585 19.518 -10.543 1.00 74.42 H new ATOM 0 HG23 VAL A 19 -5.881 19.037 -10.719 1.00 74.42 H new ATOM 279 N ALA A 20 -6.443 24.135 -10.642 1.00 2.54 N ATOM 280 CA ALA A 20 -6.080 25.505 -10.305 1.00 21.03 C ATOM 281 C ALA A 20 -5.822 25.651 -8.809 1.00 73.22 C ATOM 282 O ALA A 20 -6.756 25.675 -8.007 1.00 1.30 O ATOM 283 CB ALA A 20 -7.173 26.466 -10.750 1.00 1.33 C ATOM 0 H ALA A 20 -7.422 24.010 -10.901 1.00 2.54 H new ATOM 0 HA ALA A 20 -5.159 25.751 -10.833 1.00 21.03 H new ATOM 0 HB1 ALA A 20 -6.888 27.486 -10.492 1.00 1.33 H new ATOM 0 HB2 ALA A 20 -7.308 26.389 -11.829 1.00 1.33 H new ATOM 0 HB3 ALA A 20 -8.107 26.212 -10.249 1.00 1.33 H new ATOM 289 N VAL A 21 -4.549 25.749 -8.440 1.00 33.44 N ATOM 290 CA VAL A 21 -4.168 25.894 -7.039 1.00 60.21 C ATOM 291 C VAL A 21 -4.838 27.112 -6.411 1.00 40.44 C ATOM 292 O VAL A 21 -5.047 27.161 -5.200 1.00 33.34 O ATOM 293 CB VAL A 21 -2.641 26.024 -6.884 1.00 14.11 C ATOM 294 CG1 VAL A 21 -2.247 25.966 -5.416 1.00 13.24 C ATOM 295 CG2 VAL A 21 -1.931 24.938 -7.678 1.00 30.33 C ATOM 0 H VAL A 21 -3.764 25.731 -9.091 1.00 33.44 H new ATOM 0 HA VAL A 21 -4.502 24.993 -6.524 1.00 60.21 H new ATOM 0 HB VAL A 21 -2.334 26.992 -7.280 1.00 14.11 H new ATOM 0 HG11 VAL A 21 -1.165 26.059 -5.326 1.00 13.24 H new ATOM 0 HG12 VAL A 21 -2.728 26.783 -4.878 1.00 13.24 H new ATOM 0 HG13 VAL A 21 -2.566 25.014 -4.991 1.00 13.24 H new ATOM 0 HG21 VAL A 21 -0.853 25.045 -7.557 1.00 30.33 H new ATOM 0 HG22 VAL A 21 -2.242 23.959 -7.314 1.00 30.33 H new ATOM 0 HG23 VAL A 21 -2.189 25.031 -8.733 1.00 30.33 H new ATOM 305 N GLY A 22 -5.171 28.093 -7.244 1.00 63.02 N ATOM 306 CA GLY A 22 -5.814 29.298 -6.751 1.00 44.54 C ATOM 307 C GLY A 22 -7.187 29.025 -6.171 1.00 52.04 C ATOM 308 O GLY A 22 -7.699 27.910 -6.264 1.00 64.10 O ATOM 0 H GLY A 22 -5.007 28.075 -8.251 1.00 63.02 H new ATOM 0 HA2 GLY A 22 -5.185 29.756 -5.988 1.00 44.54 H new ATOM 0 HA3 GLY A 22 -5.903 30.018 -7.565 1.00 44.54 H new ATOM 312 N VAL A 23 -7.786 30.048 -5.568 1.00 52.23 N ATOM 313 CA VAL A 23 -9.108 29.914 -4.969 1.00 34.55 C ATOM 314 C VAL A 23 -10.122 30.812 -5.669 1.00 33.40 C ATOM 315 O VAL A 23 -11.312 30.502 -5.718 1.00 60.45 O ATOM 316 CB VAL A 23 -9.082 30.260 -3.468 1.00 30.41 C ATOM 317 CG1 VAL A 23 -8.120 29.346 -2.726 1.00 74.42 C ATOM 318 CG2 VAL A 23 -8.708 31.721 -3.266 1.00 41.42 C ATOM 0 H VAL A 23 -7.376 30.978 -5.482 1.00 52.23 H new ATOM 0 HA VAL A 23 -9.406 28.872 -5.089 1.00 34.55 H new ATOM 0 HB VAL A 23 -10.080 30.104 -3.059 1.00 30.41 H new ATOM 0 HG11 VAL A 23 -8.115 29.605 -1.667 1.00 74.42 H new ATOM 0 HG12 VAL A 23 -8.438 28.310 -2.844 1.00 74.42 H new ATOM 0 HG13 VAL A 23 -7.116 29.466 -3.134 1.00 74.42 H new ATOM 0 HG21 VAL A 23 -8.694 31.949 -2.200 1.00 41.42 H new ATOM 0 HG22 VAL A 23 -7.721 31.906 -3.689 1.00 41.42 H new ATOM 0 HG23 VAL A 23 -9.441 32.356 -3.763 1.00 41.42 H new ATOM 328 N GLY A 24 -9.642 31.928 -6.211 1.00 2.45 N ATOM 329 CA GLY A 24 -10.520 32.854 -6.902 1.00 42.50 C ATOM 330 C GLY A 24 -10.247 32.910 -8.392 1.00 55.34 C ATOM 331 O GLY A 24 -11.132 32.642 -9.203 1.00 53.10 O ATOM 0 H GLY A 24 -8.661 32.207 -6.184 1.00 2.45 H new ATOM 0 HA2 GLY A 24 -11.556 32.559 -6.737 1.00 42.50 H new ATOM 0 HA3 GLY A 24 -10.400 33.850 -6.476 1.00 42.50 H new ATOM 335 N GLY A 25 -9.016 33.261 -8.754 1.00 32.02 N ATOM 336 CA GLY A 25 -8.650 33.346 -10.156 1.00 32.45 C ATOM 337 C GLY A 25 -8.020 32.068 -10.670 1.00 1.15 C ATOM 338 O GLY A 25 -7.911 31.082 -9.939 1.00 60.25 O ATOM 0 H GLY A 25 -8.266 33.488 -8.101 1.00 32.02 H new ATOM 0 HA2 GLY A 25 -9.538 33.573 -10.747 1.00 32.45 H new ATOM 0 HA3 GLY A 25 -7.954 34.173 -10.297 1.00 32.45 H new ATOM 342 N LYS A 26 -7.606 32.079 -11.931 1.00 64.35 N ATOM 343 CA LYS A 26 -6.984 30.913 -12.545 1.00 2.22 C ATOM 344 C LYS A 26 -5.751 30.477 -11.759 1.00 61.22 C ATOM 345 O LYS A 26 -5.654 29.329 -11.326 1.00 72.11 O ATOM 346 CB LYS A 26 -6.596 31.217 -13.994 1.00 55.01 C ATOM 347 CG LYS A 26 -7.530 30.595 -15.017 1.00 43.41 C ATOM 348 CD LYS A 26 -8.628 31.561 -15.431 1.00 63.33 C ATOM 349 CE LYS A 26 -9.983 31.127 -14.894 1.00 64.34 C ATOM 350 NZ LYS A 26 -10.677 30.196 -15.826 1.00 63.44 N ATOM 0 H LYS A 26 -7.690 32.885 -12.550 1.00 64.35 H new ATOM 0 HA LYS A 26 -7.709 30.099 -12.533 1.00 2.22 H new ATOM 0 HB2 LYS A 26 -6.581 32.297 -14.138 1.00 55.01 H new ATOM 0 HB3 LYS A 26 -5.583 30.857 -14.173 1.00 55.01 H new ATOM 0 HG2 LYS A 26 -6.960 30.293 -15.895 1.00 43.41 H new ATOM 0 HG3 LYS A 26 -7.977 29.692 -14.601 1.00 43.41 H new ATOM 0 HD2 LYS A 26 -8.393 32.560 -15.064 1.00 63.33 H new ATOM 0 HD3 LYS A 26 -8.669 31.623 -16.518 1.00 63.33 H new ATOM 0 HE2 LYS A 26 -9.852 30.642 -13.927 1.00 64.34 H new ATOM 0 HE3 LYS A 26 -10.606 32.006 -14.728 1.00 64.34 H new ATOM 0 HZ1 LYS A 26 -11.597 29.924 -15.424 1.00 63.44 H new ATOM 0 HZ2 LYS A 26 -10.825 30.667 -16.741 1.00 63.44 H new ATOM 0 HZ3 LYS A 26 -10.094 29.346 -15.965 1.00 63.44 H new ATOM 364 N SER A 27 -4.814 31.402 -11.577 1.00 1.24 N ATOM 365 CA SER A 27 -3.586 31.111 -10.845 1.00 74.40 C ATOM 366 C SER A 27 -2.858 29.918 -11.456 1.00 63.54 C ATOM 367 O SER A 27 -3.266 29.390 -12.489 1.00 5.20 O ATOM 368 CB SER A 27 -3.899 30.833 -9.373 1.00 31.44 C ATOM 369 OG SER A 27 -2.740 30.974 -8.570 1.00 12.13 O ATOM 0 H SER A 27 -4.881 32.358 -11.926 1.00 1.24 H new ATOM 0 HA SER A 27 -2.936 31.984 -10.913 1.00 74.40 H new ATOM 0 HB2 SER A 27 -4.671 31.520 -9.026 1.00 31.44 H new ATOM 0 HB3 SER A 27 -4.298 29.824 -9.267 1.00 31.44 H new ATOM 0 HG SER A 27 -2.967 30.793 -7.634 1.00 12.13 H new ATOM 375 N LYS A 28 -1.775 29.501 -10.809 1.00 43.32 N ATOM 376 CA LYS A 28 -0.988 28.369 -11.286 1.00 71.24 C ATOM 377 C LYS A 28 -1.722 27.055 -11.046 1.00 15.11 C ATOM 378 O LYS A 28 -2.829 27.040 -10.507 1.00 33.21 O ATOM 379 CB LYS A 28 0.374 28.341 -10.590 1.00 1.30 C ATOM 380 CG LYS A 28 1.516 28.827 -11.465 1.00 45.13 C ATOM 381 CD LYS A 28 2.759 27.969 -11.290 1.00 22.45 C ATOM 382 CE LYS A 28 3.894 28.443 -12.183 1.00 61.34 C ATOM 383 NZ LYS A 28 3.501 28.456 -13.620 1.00 40.24 N ATOM 0 H LYS A 28 -1.422 29.929 -9.953 1.00 43.32 H new ATOM 0 HA LYS A 28 -0.839 28.488 -12.359 1.00 71.24 H new ATOM 0 HB2 LYS A 28 0.327 28.959 -9.693 1.00 1.30 H new ATOM 0 HB3 LYS A 28 0.585 27.322 -10.265 1.00 1.30 H new ATOM 0 HG2 LYS A 28 1.207 28.811 -12.510 1.00 45.13 H new ATOM 0 HG3 LYS A 28 1.750 29.862 -11.217 1.00 45.13 H new ATOM 0 HD2 LYS A 28 3.078 27.998 -10.248 1.00 22.45 H new ATOM 0 HD3 LYS A 28 2.521 26.931 -11.522 1.00 22.45 H new ATOM 0 HE2 LYS A 28 4.200 29.445 -11.881 1.00 61.34 H new ATOM 0 HE3 LYS A 28 4.758 27.792 -12.049 1.00 61.34 H new ATOM 0 HZ1 LYS A 28 4.352 28.535 -14.212 1.00 40.24 H new ATOM 0 HZ2 LYS A 28 2.999 27.575 -13.851 1.00 40.24 H new ATOM 0 HZ3 LYS A 28 2.877 29.268 -13.802 1.00 40.24 H new ATOM 397 N LYS A 29 -1.099 25.953 -11.446 1.00 2.45 N ATOM 398 CA LYS A 29 -1.691 24.631 -11.271 1.00 24.22 C ATOM 399 C LYS A 29 -0.829 23.764 -10.360 1.00 70.50 C ATOM 400 O LYS A 29 0.337 24.073 -10.114 1.00 60.43 O ATOM 401 CB LYS A 29 -1.868 23.946 -12.628 1.00 2.50 C ATOM 402 CG LYS A 29 -0.566 23.447 -13.232 1.00 22.21 C ATOM 403 CD LYS A 29 -0.704 23.196 -14.724 1.00 61.52 C ATOM 404 CE LYS A 29 0.496 23.729 -15.492 1.00 24.54 C ATOM 405 NZ LYS A 29 0.499 25.217 -15.552 1.00 74.32 N ATOM 0 H LYS A 29 -0.183 25.948 -11.894 1.00 2.45 H new ATOM 0 HA LYS A 29 -2.668 24.757 -10.804 1.00 24.22 H new ATOM 0 HB2 LYS A 29 -2.552 23.105 -12.515 1.00 2.50 H new ATOM 0 HB3 LYS A 29 -2.335 24.646 -13.321 1.00 2.50 H new ATOM 0 HG2 LYS A 29 0.222 24.180 -13.057 1.00 22.21 H new ATOM 0 HG3 LYS A 29 -0.262 22.526 -12.734 1.00 22.21 H new ATOM 0 HD2 LYS A 29 -0.808 22.126 -14.906 1.00 61.52 H new ATOM 0 HD3 LYS A 29 -1.613 23.672 -15.092 1.00 61.52 H new ATOM 0 HE2 LYS A 29 1.414 23.383 -15.017 1.00 24.54 H new ATOM 0 HE3 LYS A 29 0.488 23.325 -16.504 1.00 24.54 H new ATOM 0 HZ1 LYS A 29 1.218 25.536 -16.233 1.00 74.32 H new ATOM 0 HZ2 LYS A 29 -0.437 25.554 -15.854 1.00 74.32 H new ATOM 0 HZ3 LYS A 29 0.719 25.602 -14.611 1.00 74.32 H new ATOM 419 N PHE A 30 -1.409 22.677 -9.863 1.00 2.11 N ATOM 420 CA PHE A 30 -0.692 21.764 -8.980 1.00 30.45 C ATOM 421 C PHE A 30 0.487 21.120 -9.703 1.00 52.01 C ATOM 422 O PHE A 30 0.737 21.397 -10.876 1.00 32.41 O ATOM 423 CB PHE A 30 -1.637 20.679 -8.457 1.00 73.32 C ATOM 424 CG PHE A 30 -2.013 20.858 -7.013 1.00 51.21 C ATOM 425 CD1 PHE A 30 -1.053 20.764 -6.018 1.00 31.32 C ATOM 426 CD2 PHE A 30 -3.325 21.117 -6.652 1.00 73.41 C ATOM 427 CE1 PHE A 30 -1.395 20.928 -4.688 1.00 24.23 C ATOM 428 CE2 PHE A 30 -3.673 21.282 -5.325 1.00 54.23 C ATOM 429 CZ PHE A 30 -2.707 21.186 -4.342 1.00 34.42 C ATOM 0 H PHE A 30 -2.373 22.407 -10.056 1.00 2.11 H new ATOM 0 HA PHE A 30 -0.308 22.340 -8.138 1.00 30.45 H new ATOM 0 HB2 PHE A 30 -2.543 20.675 -9.063 1.00 73.32 H new ATOM 0 HB3 PHE A 30 -1.165 19.705 -8.583 1.00 73.32 H new ATOM 0 HD1 PHE A 30 -0.026 20.560 -6.284 1.00 31.32 H new ATOM 0 HD2 PHE A 30 -4.084 21.191 -7.416 1.00 73.41 H new ATOM 0 HE1 PHE A 30 -0.638 20.854 -3.922 1.00 24.23 H new ATOM 0 HE2 PHE A 30 -4.699 21.486 -5.057 1.00 54.23 H new ATOM 0 HZ PHE A 30 -2.977 21.313 -3.304 1.00 34.42 H new ATOM 439 N GLY A 31 1.211 20.260 -8.993 1.00 30.52 N ATOM 440 CA GLY A 31 2.356 19.590 -9.583 1.00 33.51 C ATOM 441 C GLY A 31 2.841 18.425 -8.744 1.00 62.32 C ATOM 442 O GLY A 31 2.164 18.002 -7.808 1.00 21.32 O ATOM 0 H GLY A 31 1.025 20.015 -8.020 1.00 30.52 H new ATOM 0 HA2 GLY A 31 2.091 19.232 -10.578 1.00 33.51 H new ATOM 0 HA3 GLY A 31 3.168 20.307 -9.708 1.00 33.51 H new ATOM 446 N GLU A 32 4.016 17.903 -9.082 1.00 74.53 N ATOM 447 CA GLU A 32 4.589 16.778 -8.354 1.00 1.42 C ATOM 448 C GLU A 32 5.292 17.251 -7.085 1.00 54.11 C ATOM 449 O GLU A 32 4.988 16.791 -5.985 1.00 72.01 O ATOM 450 CB GLU A 32 5.574 16.015 -9.242 1.00 41.34 C ATOM 451 CG GLU A 32 6.300 14.891 -8.521 1.00 64.33 C ATOM 452 CD GLU A 32 6.581 13.706 -9.424 1.00 10.40 C ATOM 453 OE1 GLU A 32 5.611 13.101 -9.927 1.00 31.01 O ATOM 454 OE2 GLU A 32 7.771 13.382 -9.626 1.00 22.41 O ATOM 0 H GLU A 32 4.589 18.241 -9.855 1.00 74.53 H new ATOM 0 HA GLU A 32 3.775 16.111 -8.070 1.00 1.42 H new ATOM 0 HB2 GLU A 32 5.036 15.600 -10.094 1.00 41.34 H new ATOM 0 HB3 GLU A 32 6.309 16.715 -9.639 1.00 41.34 H new ATOM 0 HG2 GLU A 32 7.241 15.269 -8.120 1.00 64.33 H new ATOM 0 HG3 GLU A 32 5.701 14.562 -7.672 1.00 64.33 H new ATOM 461 N GLY A 33 6.236 18.173 -7.247 1.00 50.32 N ATOM 462 CA GLY A 33 6.969 18.694 -6.108 1.00 14.33 C ATOM 463 C GLY A 33 6.054 19.244 -5.032 1.00 33.42 C ATOM 464 O GLY A 33 6.263 19.000 -3.845 1.00 61.12 O ATOM 0 H GLY A 33 6.506 18.569 -8.147 1.00 50.32 H new ATOM 0 HA2 GLY A 33 7.587 17.902 -5.685 1.00 14.33 H new ATOM 0 HA3 GLY A 33 7.644 19.481 -6.444 1.00 14.33 H new ATOM 468 N ASN A 34 5.036 19.990 -5.448 1.00 61.44 N ATOM 469 CA ASN A 34 4.086 20.580 -4.511 1.00 44.03 C ATOM 470 C ASN A 34 3.253 19.499 -3.830 1.00 54.12 C ATOM 471 O ASN A 34 2.991 19.567 -2.629 1.00 51.50 O ATOM 472 CB ASN A 34 3.168 21.567 -5.236 1.00 1.13 C ATOM 473 CG ASN A 34 2.737 22.716 -4.346 1.00 2.42 C ATOM 474 OD1 ASN A 34 1.610 22.744 -3.852 1.00 23.21 O ATOM 475 ND2 ASN A 34 3.635 23.671 -4.137 1.00 34.00 N ATOM 0 H ASN A 34 4.847 20.201 -6.428 1.00 61.44 H new ATOM 0 HA ASN A 34 4.651 21.114 -3.747 1.00 44.03 H new ATOM 0 HB2 ASN A 34 3.683 21.963 -6.111 1.00 1.13 H new ATOM 0 HB3 ASN A 34 2.285 21.040 -5.597 1.00 1.13 H new ATOM 0 HD21 ASN A 34 3.402 24.469 -3.546 1.00 34.00 H new ATOM 0 HD22 ASN A 34 4.558 23.606 -4.567 1.00 34.00 H new ATOM 482 N PHE A 35 2.841 18.501 -4.604 1.00 61.41 N ATOM 483 CA PHE A 35 2.037 17.405 -4.076 1.00 0.12 C ATOM 484 C PHE A 35 2.774 16.682 -2.952 1.00 71.32 C ATOM 485 O PHE A 35 2.157 16.179 -2.014 1.00 4.02 O ATOM 486 CB PHE A 35 1.688 16.417 -5.190 1.00 44.41 C ATOM 487 CG PHE A 35 1.002 15.175 -4.698 1.00 60.51 C ATOM 488 CD1 PHE A 35 -0.164 15.261 -3.953 1.00 62.01 C ATOM 489 CD2 PHE A 35 1.522 13.922 -4.978 1.00 63.31 C ATOM 490 CE1 PHE A 35 -0.798 14.120 -3.499 1.00 34.32 C ATOM 491 CE2 PHE A 35 0.891 12.778 -4.527 1.00 71.41 C ATOM 492 CZ PHE A 35 -0.270 12.877 -3.784 1.00 64.33 C ATOM 0 H PHE A 35 3.051 18.428 -5.600 1.00 61.41 H new ATOM 0 HA PHE A 35 1.116 17.826 -3.672 1.00 0.12 H new ATOM 0 HB2 PHE A 35 1.045 16.914 -5.917 1.00 44.41 H new ATOM 0 HB3 PHE A 35 2.602 16.135 -5.713 1.00 44.41 H new ATOM 0 HD1 PHE A 35 -0.582 16.231 -3.725 1.00 62.01 H new ATOM 0 HD2 PHE A 35 2.431 13.838 -5.555 1.00 63.31 H new ATOM 0 HE1 PHE A 35 -1.707 14.201 -2.921 1.00 34.32 H new ATOM 0 HE2 PHE A 35 1.305 11.807 -4.755 1.00 71.41 H new ATOM 0 HZ PHE A 35 -0.763 11.985 -3.427 1.00 64.33 H new ATOM 502 N ARG A 36 4.098 16.637 -3.055 1.00 21.02 N ATOM 503 CA ARG A 36 4.920 15.975 -2.049 1.00 72.31 C ATOM 504 C ARG A 36 5.001 16.813 -0.776 1.00 42.42 C ATOM 505 O ARG A 36 4.738 16.320 0.321 1.00 43.33 O ATOM 506 CB ARG A 36 6.326 15.721 -2.595 1.00 3.33 C ATOM 507 CG ARG A 36 6.337 15.163 -4.010 1.00 54.43 C ATOM 508 CD ARG A 36 7.204 13.917 -4.110 1.00 12.04 C ATOM 509 NE ARG A 36 7.882 13.824 -5.400 1.00 61.42 N ATOM 510 CZ ARG A 36 8.983 14.503 -5.702 1.00 34.55 C ATOM 511 NH1 ARG A 36 9.527 15.321 -4.811 1.00 5.23 N ATOM 512 NH2 ARG A 36 9.541 14.366 -6.897 1.00 51.45 N ATOM 0 H ARG A 36 4.624 17.051 -3.824 1.00 21.02 H new ATOM 0 HA ARG A 36 4.454 15.020 -1.806 1.00 72.31 H new ATOM 0 HB2 ARG A 36 6.888 16.655 -2.577 1.00 3.33 H new ATOM 0 HB3 ARG A 36 6.843 15.025 -1.935 1.00 3.33 H new ATOM 0 HG2 ARG A 36 5.318 14.925 -4.316 1.00 54.43 H new ATOM 0 HG3 ARG A 36 6.708 15.922 -4.699 1.00 54.43 H new ATOM 0 HD2 ARG A 36 7.945 13.926 -3.311 1.00 12.04 H new ATOM 0 HD3 ARG A 36 6.585 13.032 -3.961 1.00 12.04 H new ATOM 0 HE ARG A 36 7.489 13.204 -6.108 1.00 61.42 H new ATOM 0 HH11 ARG A 36 9.100 15.430 -3.891 1.00 5.23 H new ATOM 0 HH12 ARG A 36 10.372 15.841 -5.046 1.00 5.23 H new ATOM 0 HH21 ARG A 36 9.125 13.739 -7.585 1.00 51.45 H new ATOM 0 HH22 ARG A 36 10.386 14.888 -7.128 1.00 51.45 H new ATOM 526 N TRP A 37 5.368 18.080 -0.932 1.00 32.13 N ATOM 527 CA TRP A 37 5.484 18.986 0.205 1.00 11.41 C ATOM 528 C TRP A 37 4.201 18.994 1.029 1.00 52.25 C ATOM 529 O TRP A 37 4.235 19.172 2.246 1.00 11.31 O ATOM 530 CB TRP A 37 5.805 20.402 -0.276 1.00 11.52 C ATOM 531 CG TRP A 37 5.587 21.450 0.774 1.00 10.41 C ATOM 532 CD1 TRP A 37 6.536 22.024 1.569 1.00 53.45 C ATOM 533 CD2 TRP A 37 4.339 22.046 1.143 1.00 5.32 C ATOM 534 NE1 TRP A 37 5.955 22.941 2.410 1.00 12.25 N ATOM 535 CE2 TRP A 37 4.607 22.974 2.168 1.00 14.43 C ATOM 536 CE3 TRP A 37 3.020 21.887 0.706 1.00 75.14 C ATOM 537 CZ2 TRP A 37 3.606 23.737 2.762 1.00 21.32 C ATOM 538 CZ3 TRP A 37 2.028 22.647 1.296 1.00 10.22 C ATOM 539 CH2 TRP A 37 2.324 23.562 2.314 1.00 31.12 C ATOM 0 H TRP A 37 5.590 18.503 -1.833 1.00 32.13 H new ATOM 0 HA TRP A 37 6.297 18.632 0.838 1.00 11.41 H new ATOM 0 HB2 TRP A 37 6.843 20.439 -0.606 1.00 11.52 H new ATOM 0 HB3 TRP A 37 5.186 20.632 -1.143 1.00 11.52 H new ATOM 0 HD1 TRP A 37 7.590 21.791 1.541 1.00 53.45 H new ATOM 0 HE1 TRP A 37 6.447 23.506 3.102 1.00 12.25 H new ATOM 0 HE3 TRP A 37 2.781 21.183 -0.078 1.00 75.14 H new ATOM 0 HZ2 TRP A 37 3.832 24.442 3.548 1.00 21.32 H new ATOM 0 HZ3 TRP A 37 1.006 22.533 0.966 1.00 10.22 H new ATOM 0 HH2 TRP A 37 1.526 24.141 2.754 1.00 31.12 H new ATOM 550 N ALA A 38 3.071 18.800 0.358 1.00 64.31 N ATOM 551 CA ALA A 38 1.777 18.783 1.029 1.00 52.44 C ATOM 552 C ALA A 38 1.510 17.425 1.670 1.00 35.41 C ATOM 553 O ALA A 38 1.416 17.314 2.894 1.00 61.34 O ATOM 554 CB ALA A 38 0.669 19.132 0.047 1.00 73.31 C ATOM 0 H ALA A 38 3.025 18.652 -0.650 1.00 64.31 H new ATOM 0 HA ALA A 38 1.795 19.532 1.820 1.00 52.44 H new ATOM 0 HB1 ALA A 38 -0.292 19.116 0.562 1.00 73.31 H new ATOM 0 HB2 ALA A 38 0.845 20.127 -0.361 1.00 73.31 H new ATOM 0 HB3 ALA A 38 0.659 18.404 -0.764 1.00 73.31 H new ATOM 560 N ILE A 39 1.387 16.397 0.838 1.00 33.33 N ATOM 561 CA ILE A 39 1.130 15.047 1.325 1.00 74.02 C ATOM 562 C ILE A 39 2.102 14.671 2.439 1.00 4.03 C ATOM 563 O ILE A 39 1.748 13.940 3.365 1.00 45.30 O ATOM 564 CB ILE A 39 1.239 14.009 0.193 1.00 21.52 C ATOM 565 CG1 ILE A 39 0.733 12.647 0.669 1.00 12.24 C ATOM 566 CG2 ILE A 39 2.676 13.907 -0.296 1.00 42.20 C ATOM 567 CD1 ILE A 39 0.093 11.823 -0.425 1.00 5.40 C ATOM 0 H ILE A 39 1.461 16.473 -0.176 1.00 33.33 H new ATOM 0 HA ILE A 39 0.112 15.041 1.715 1.00 74.02 H new ATOM 0 HB ILE A 39 0.616 14.335 -0.640 1.00 21.52 H new ATOM 0 HG12 ILE A 39 1.566 12.087 1.094 1.00 12.24 H new ATOM 0 HG13 ILE A 39 0.009 12.797 1.470 1.00 12.24 H new ATOM 0 HG21 ILE A 39 2.737 13.169 -1.096 1.00 42.20 H new ATOM 0 HG22 ILE A 39 3.002 14.877 -0.671 1.00 42.20 H new ATOM 0 HG23 ILE A 39 3.320 13.602 0.529 1.00 42.20 H new ATOM 0 HD11 ILE A 39 -0.242 10.871 -0.014 1.00 5.40 H new ATOM 0 HD12 ILE A 39 -0.761 12.362 -0.834 1.00 5.40 H new ATOM 0 HD13 ILE A 39 0.820 11.641 -1.216 1.00 5.40 H new ATOM 579 N ARG A 40 3.327 15.176 2.344 1.00 75.53 N ATOM 580 CA ARG A 40 4.350 14.894 3.343 1.00 2.01 C ATOM 581 C ARG A 40 4.099 15.693 4.619 1.00 41.12 C ATOM 582 O ARG A 40 3.953 15.124 5.700 1.00 2.13 O ATOM 583 CB ARG A 40 5.739 15.221 2.789 1.00 2.44 C ATOM 584 CG ARG A 40 6.875 14.641 3.616 1.00 20.20 C ATOM 585 CD ARG A 40 8.098 15.545 3.591 1.00 63.13 C ATOM 586 NE ARG A 40 8.409 16.082 4.913 1.00 71.44 N ATOM 587 CZ ARG A 40 8.939 15.359 5.893 1.00 21.12 C ATOM 588 NH1 ARG A 40 9.215 14.077 5.701 1.00 73.02 N ATOM 589 NH2 ARG A 40 9.194 15.920 7.068 1.00 14.30 N ATOM 0 H ARG A 40 3.635 15.783 1.585 1.00 75.53 H new ATOM 0 HA ARG A 40 4.303 13.832 3.584 1.00 2.01 H new ATOM 0 HB2 ARG A 40 5.813 14.843 1.769 1.00 2.44 H new ATOM 0 HB3 ARG A 40 5.855 16.304 2.736 1.00 2.44 H new ATOM 0 HG2 ARG A 40 6.544 14.503 4.645 1.00 20.20 H new ATOM 0 HG3 ARG A 40 7.141 13.656 3.232 1.00 20.20 H new ATOM 0 HD2 ARG A 40 8.955 14.985 3.216 1.00 63.13 H new ATOM 0 HD3 ARG A 40 7.927 16.368 2.897 1.00 63.13 H new ATOM 0 HE ARG A 40 8.208 17.066 5.094 1.00 71.44 H new ATOM 0 HH11 ARG A 40 9.020 13.643 4.799 1.00 73.02 H new ATOM 0 HH12 ARG A 40 9.622 13.524 6.456 1.00 73.02 H new ATOM 0 HH21 ARG A 40 8.983 16.906 7.219 1.00 14.30 H new ATOM 0 HH22 ARG A 40 9.601 15.365 7.821 1.00 14.30 H new ATOM 603 N MET A 41 4.051 17.014 4.484 1.00 63.35 N ATOM 604 CA MET A 41 3.818 17.890 5.625 1.00 33.10 C ATOM 605 C MET A 41 2.537 17.501 6.357 1.00 54.40 C ATOM 606 O MET A 41 2.432 17.662 7.572 1.00 15.52 O ATOM 607 CB MET A 41 3.734 19.348 5.168 1.00 45.42 C ATOM 608 CG MET A 41 3.732 20.346 6.315 1.00 4.51 C ATOM 609 SD MET A 41 5.393 20.741 6.895 1.00 43.11 S ATOM 610 CE MET A 41 5.022 21.851 8.251 1.00 41.03 C ATOM 0 H MET A 41 4.170 17.501 3.596 1.00 63.35 H new ATOM 0 HA MET A 41 4.657 17.780 6.312 1.00 33.10 H new ATOM 0 HB2 MET A 41 4.577 19.563 4.511 1.00 45.42 H new ATOM 0 HB3 MET A 41 2.828 19.483 4.578 1.00 45.42 H new ATOM 0 HG2 MET A 41 3.236 21.262 5.994 1.00 4.51 H new ATOM 0 HG3 MET A 41 3.149 19.941 7.142 1.00 4.51 H new ATOM 0 HE1 MET A 41 5.951 22.183 8.714 1.00 41.03 H new ATOM 0 HE2 MET A 41 4.475 22.715 7.874 1.00 41.03 H new ATOM 0 HE3 MET A 41 4.414 21.331 8.991 1.00 41.03 H new ATOM 620 N ALA A 42 1.566 16.988 5.609 1.00 24.11 N ATOM 621 CA ALA A 42 0.294 16.574 6.187 1.00 61.22 C ATOM 622 C ALA A 42 0.454 15.304 7.014 1.00 12.14 C ATOM 623 O ALA A 42 -0.004 15.233 8.154 1.00 53.43 O ATOM 624 CB ALA A 42 -0.740 16.365 5.091 1.00 21.44 C ATOM 0 H ALA A 42 1.636 16.849 4.601 1.00 24.11 H new ATOM 0 HA ALA A 42 -0.050 17.367 6.851 1.00 61.22 H new ATOM 0 HB1 ALA A 42 -1.685 16.056 5.537 1.00 21.44 H new ATOM 0 HB2 ALA A 42 -0.884 17.297 4.544 1.00 21.44 H new ATOM 0 HB3 ALA A 42 -0.392 15.592 4.405 1.00 21.44 H new ATOM 630 N ASN A 43 1.107 14.303 6.433 1.00 54.40 N ATOM 631 CA ASN A 43 1.327 13.034 7.117 1.00 54.52 C ATOM 632 C ASN A 43 2.067 13.248 8.435 1.00 51.41 C ATOM 633 O ASN A 43 1.658 12.739 9.479 1.00 62.52 O ATOM 634 CB ASN A 43 2.120 12.079 6.223 1.00 61.21 C ATOM 635 CG ASN A 43 1.355 11.687 4.974 1.00 21.01 C ATOM 636 OD1 ASN A 43 0.126 11.756 4.938 1.00 21.15 O ATOM 637 ND2 ASN A 43 2.079 11.272 3.942 1.00 73.24 N ATOM 0 H ASN A 43 1.493 14.346 5.490 1.00 54.40 H new ATOM 0 HA ASN A 43 0.354 12.593 7.334 1.00 54.52 H new ATOM 0 HB2 ASN A 43 3.060 12.550 5.937 1.00 61.21 H new ATOM 0 HB3 ASN A 43 2.372 11.182 6.788 1.00 61.21 H new ATOM 0 HD21 ASN A 43 1.619 10.994 3.075 1.00 73.24 H new ATOM 0 HD22 ASN A 43 3.095 11.231 4.016 1.00 73.24 H new ATOM 644 N VAL A 44 3.159 14.003 8.379 1.00 65.23 N ATOM 645 CA VAL A 44 3.955 14.286 9.567 1.00 45.14 C ATOM 646 C VAL A 44 3.133 15.023 10.617 1.00 51.22 C ATOM 647 O VAL A 44 3.210 14.718 11.807 1.00 41.11 O ATOM 648 CB VAL A 44 5.199 15.127 9.221 1.00 5.23 C ATOM 649 CG1 VAL A 44 6.052 15.353 10.460 1.00 31.24 C ATOM 650 CG2 VAL A 44 6.009 14.454 8.122 1.00 0.45 C ATOM 0 H VAL A 44 3.513 14.430 7.523 1.00 65.23 H new ATOM 0 HA VAL A 44 4.275 13.325 9.970 1.00 45.14 H new ATOM 0 HB VAL A 44 4.868 16.099 8.854 1.00 5.23 H new ATOM 0 HG11 VAL A 44 6.926 15.949 10.196 1.00 31.24 H new ATOM 0 HG12 VAL A 44 5.467 15.881 11.213 1.00 31.24 H new ATOM 0 HG13 VAL A 44 6.375 14.392 10.860 1.00 31.24 H new ATOM 0 HG21 VAL A 44 6.884 15.062 7.891 1.00 0.45 H new ATOM 0 HG22 VAL A 44 6.331 13.469 8.459 1.00 0.45 H new ATOM 0 HG23 VAL A 44 5.393 14.349 7.229 1.00 0.45 H new ATOM 660 N SER A 45 2.345 15.995 10.169 1.00 41.11 N ATOM 661 CA SER A 45 1.510 16.779 11.071 1.00 22.13 C ATOM 662 C SER A 45 0.526 15.882 11.816 1.00 31.14 C ATOM 663 O SER A 45 0.041 16.232 12.893 1.00 61.22 O ATOM 664 CB SER A 45 0.749 17.853 10.291 1.00 3.04 C ATOM 665 OG SER A 45 1.603 18.924 9.932 1.00 74.13 O ATOM 0 H SER A 45 2.267 16.258 9.187 1.00 41.11 H new ATOM 0 HA SER A 45 2.159 17.262 11.801 1.00 22.13 H new ATOM 0 HB2 SER A 45 0.313 17.415 9.393 1.00 3.04 H new ATOM 0 HB3 SER A 45 -0.077 18.229 10.895 1.00 3.04 H new ATOM 0 HG SER A 45 2.047 18.718 9.083 1.00 74.13 H new ATOM 671 N THR A 46 0.234 14.722 11.236 1.00 61.34 N ATOM 672 CA THR A 46 -0.693 13.776 11.843 1.00 45.54 C ATOM 673 C THR A 46 0.053 12.707 12.634 1.00 25.41 C ATOM 674 O THR A 46 -0.519 12.053 13.504 1.00 0.32 O ATOM 675 CB THR A 46 -1.573 13.091 10.780 1.00 42.25 C ATOM 676 OG1 THR A 46 -0.912 13.111 9.509 1.00 74.33 O ATOM 677 CG2 THR A 46 -2.922 13.783 10.667 1.00 64.43 C ATOM 0 H THR A 46 0.627 14.415 10.346 1.00 61.34 H new ATOM 0 HA THR A 46 -1.330 14.347 12.519 1.00 45.54 H new ATOM 0 HB THR A 46 -1.737 12.058 11.087 1.00 42.25 H new ATOM 0 HG1 THR A 46 -0.046 12.658 9.584 1.00 74.33 H new ATOM 0 HG21 THR A 46 -3.526 13.282 9.910 1.00 64.43 H new ATOM 0 HG22 THR A 46 -3.435 13.740 11.628 1.00 64.43 H new ATOM 0 HG23 THR A 46 -2.774 14.824 10.382 1.00 64.43 H new ATOM 685 N GLY A 47 1.336 12.536 12.326 1.00 24.44 N ATOM 686 CA GLY A 47 2.138 11.545 13.018 1.00 63.04 C ATOM 687 C GLY A 47 1.920 10.144 12.482 1.00 63.10 C ATOM 688 O GLY A 47 1.981 9.169 13.231 1.00 50.11 O ATOM 0 H GLY A 47 1.833 13.066 11.610 1.00 24.44 H new ATOM 0 HA2 GLY A 47 3.192 11.806 12.925 1.00 63.04 H new ATOM 0 HA3 GLY A 47 1.897 11.565 14.081 1.00 63.04 H new ATOM 692 N ARG A 48 1.663 10.042 11.182 1.00 32.25 N ATOM 693 CA ARG A 48 1.430 8.751 10.548 1.00 45.42 C ATOM 694 C ARG A 48 2.671 8.287 9.788 1.00 14.41 C ATOM 695 O ARG A 48 2.582 7.854 8.640 1.00 34.51 O ATOM 696 CB ARG A 48 0.238 8.833 9.594 1.00 63.34 C ATOM 697 CG ARG A 48 -0.537 7.532 9.473 1.00 24.41 C ATOM 698 CD ARG A 48 -2.015 7.785 9.217 1.00 24.42 C ATOM 699 NE ARG A 48 -2.485 7.105 8.013 1.00 24.34 N ATOM 700 CZ ARG A 48 -2.648 5.789 7.927 1.00 74.23 C ATOM 701 NH1 ARG A 48 -2.378 5.016 8.970 1.00 33.34 N ATOM 702 NH2 ARG A 48 -3.080 5.245 6.797 1.00 74.42 N ATOM 0 H ARG A 48 1.611 10.839 10.547 1.00 32.25 H new ATOM 0 HA ARG A 48 1.210 8.025 11.331 1.00 45.42 H new ATOM 0 HB2 ARG A 48 -0.437 9.617 9.936 1.00 63.34 H new ATOM 0 HB3 ARG A 48 0.594 9.127 8.607 1.00 63.34 H new ATOM 0 HG2 ARG A 48 -0.123 6.935 8.660 1.00 24.41 H new ATOM 0 HG3 ARG A 48 -0.419 6.951 10.388 1.00 24.41 H new ATOM 0 HD2 ARG A 48 -2.595 7.446 10.075 1.00 24.42 H new ATOM 0 HD3 ARG A 48 -2.188 8.857 9.119 1.00 24.42 H new ATOM 0 HE ARG A 48 -2.700 7.672 7.193 1.00 24.34 H new ATOM 0 HH11 ARG A 48 -2.045 5.431 9.840 1.00 33.34 H new ATOM 0 HH12 ARG A 48 -2.504 4.006 8.902 1.00 33.34 H new ATOM 0 HH21 ARG A 48 -3.288 5.837 5.993 1.00 74.42 H new ATOM 0 HH22 ARG A 48 -3.205 4.235 6.732 1.00 74.42 H new ATOM 716 N GLU A 49 3.827 8.383 10.439 1.00 10.35 N ATOM 717 CA GLU A 49 5.084 7.974 9.825 1.00 54.15 C ATOM 718 C GLU A 49 5.395 8.830 8.601 1.00 61.20 C ATOM 719 O GLU A 49 4.518 9.471 8.022 1.00 32.44 O ATOM 720 CB GLU A 49 5.028 6.497 9.428 1.00 64.31 C ATOM 721 CG GLU A 49 5.790 5.584 10.372 1.00 12.10 C ATOM 722 CD GLU A 49 4.875 4.674 11.170 1.00 74.32 C ATOM 723 OE1 GLU A 49 4.325 5.136 12.192 1.00 1.11 O ATOM 724 OE2 GLU A 49 4.709 3.503 10.773 1.00 24.24 O ATOM 0 H GLU A 49 3.918 8.740 11.390 1.00 10.35 H new ATOM 0 HA GLU A 49 5.879 8.115 10.557 1.00 54.15 H new ATOM 0 HB2 GLU A 49 3.986 6.179 9.390 1.00 64.31 H new ATOM 0 HB3 GLU A 49 5.432 6.384 8.422 1.00 64.31 H new ATOM 0 HG2 GLU A 49 6.490 4.977 9.798 1.00 12.10 H new ATOM 0 HG3 GLU A 49 6.382 6.190 11.058 1.00 12.10 H new ATOM 731 N PRO A 50 6.673 8.842 8.196 1.00 5.41 N ATOM 732 CA PRO A 50 7.130 9.614 7.037 1.00 30.14 C ATOM 733 C PRO A 50 6.616 9.042 5.720 1.00 4.02 C ATOM 734 O PRO A 50 6.091 9.771 4.879 1.00 3.42 O ATOM 735 CB PRO A 50 8.654 9.498 7.111 1.00 15.22 C ATOM 736 CG PRO A 50 8.902 8.231 7.855 1.00 64.31 C ATOM 737 CD PRO A 50 7.771 8.101 8.839 1.00 43.54 C ATOM 0 HA PRO A 50 6.765 10.641 7.063 1.00 30.14 H new ATOM 0 HB2 PRO A 50 9.097 9.466 6.116 1.00 15.22 H new ATOM 0 HB3 PRO A 50 9.091 10.352 7.627 1.00 15.22 H new ATOM 0 HG2 PRO A 50 8.929 7.379 7.176 1.00 64.31 H new ATOM 0 HG3 PRO A 50 9.864 8.261 8.367 1.00 64.31 H new ATOM 0 HD2 PRO A 50 7.505 7.058 9.011 1.00 43.54 H new ATOM 0 HD3 PRO A 50 8.030 8.527 9.808 1.00 43.54 H new ATOM 745 N GLY A 51 6.770 7.733 5.548 1.00 2.34 N ATOM 746 CA GLY A 51 6.315 7.086 4.332 1.00 44.54 C ATOM 747 C GLY A 51 4.852 6.695 4.394 1.00 4.12 C ATOM 748 O GLY A 51 4.522 5.510 4.461 1.00 25.24 O ATOM 0 H GLY A 51 7.202 7.109 6.229 1.00 2.34 H new ATOM 0 HA2 GLY A 51 6.473 7.756 3.487 1.00 44.54 H new ATOM 0 HA3 GLY A 51 6.918 6.196 4.150 1.00 44.54 H new ATOM 752 N ASP A 52 3.974 7.691 4.375 1.00 4.15 N ATOM 753 CA ASP A 52 2.537 7.445 4.431 1.00 50.51 C ATOM 754 C ASP A 52 1.870 7.822 3.112 1.00 72.33 C ATOM 755 O ASP A 52 1.194 8.846 3.019 1.00 31.45 O ATOM 756 CB ASP A 52 1.907 8.234 5.580 1.00 53.44 C ATOM 757 CG ASP A 52 0.648 7.578 6.111 1.00 21.20 C ATOM 758 OD1 ASP A 52 -0.378 8.279 6.238 1.00 52.03 O ATOM 759 OD2 ASP A 52 0.688 6.363 6.398 1.00 21.43 O ATOM 0 H ASP A 52 4.231 8.677 4.321 1.00 4.15 H new ATOM 0 HA ASP A 52 2.382 6.380 4.605 1.00 50.51 H new ATOM 0 HB2 ASP A 52 2.631 8.332 6.389 1.00 53.44 H new ATOM 0 HB3 ASP A 52 1.672 9.242 5.239 1.00 53.44 H new ATOM 764 N ILE A 53 2.066 6.989 2.096 1.00 2.13 N ATOM 765 CA ILE A 53 1.482 7.236 0.783 1.00 51.30 C ATOM 766 C ILE A 53 0.421 6.193 0.449 1.00 23.21 C ATOM 767 O ILE A 53 0.649 5.266 -0.328 1.00 1.43 O ATOM 768 CB ILE A 53 2.557 7.230 -0.320 1.00 10.53 C ATOM 769 CG1 ILE A 53 3.678 8.213 0.024 1.00 1.04 C ATOM 770 CG2 ILE A 53 1.936 7.575 -1.666 1.00 14.20 C ATOM 771 CD1 ILE A 53 4.771 8.272 -1.020 1.00 30.14 C ATOM 0 H ILE A 53 2.624 6.138 2.156 1.00 2.13 H new ATOM 0 HA ILE A 53 1.019 8.222 0.823 1.00 51.30 H new ATOM 0 HB ILE A 53 2.985 6.230 -0.385 1.00 10.53 H new ATOM 0 HG12 ILE A 53 3.252 9.208 0.149 1.00 1.04 H new ATOM 0 HG13 ILE A 53 4.116 7.931 0.982 1.00 1.04 H new ATOM 0 HG21 ILE A 53 2.708 7.567 -2.436 1.00 14.20 H new ATOM 0 HG22 ILE A 53 1.170 6.840 -1.912 1.00 14.20 H new ATOM 0 HG23 ILE A 53 1.485 8.566 -1.615 1.00 14.20 H new ATOM 0 HD11 ILE A 53 5.532 8.989 -0.710 1.00 30.14 H new ATOM 0 HD12 ILE A 53 5.224 7.287 -1.129 1.00 30.14 H new ATOM 0 HD13 ILE A 53 4.346 8.583 -1.974 1.00 30.14 H new ATOM 783 N PRO A 54 -0.770 6.349 1.046 1.00 12.22 N ATOM 784 CA PRO A 54 -1.892 5.432 0.826 1.00 22.44 C ATOM 785 C PRO A 54 -2.472 5.553 -0.579 1.00 70.25 C ATOM 786 O PRO A 54 -1.903 6.224 -1.439 1.00 43.32 O ATOM 787 CB PRO A 54 -2.921 5.874 1.869 1.00 24.03 C ATOM 788 CG PRO A 54 -2.604 7.305 2.133 1.00 42.14 C ATOM 789 CD PRO A 54 -1.112 7.432 1.984 1.00 1.11 C ATOM 0 HA PRO A 54 -1.590 4.389 0.920 1.00 22.44 H new ATOM 0 HB2 PRO A 54 -3.938 5.757 1.496 1.00 24.03 H new ATOM 0 HB3 PRO A 54 -2.844 5.278 2.778 1.00 24.03 H new ATOM 0 HG2 PRO A 54 -3.123 7.956 1.430 1.00 42.14 H new ATOM 0 HG3 PRO A 54 -2.923 7.597 3.133 1.00 42.14 H new ATOM 0 HD2 PRO A 54 -0.829 8.408 1.591 1.00 1.11 H new ATOM 0 HD3 PRO A 54 -0.601 7.313 2.939 1.00 1.11 H new ATOM 797 N GLU A 55 -3.608 4.899 -0.805 1.00 74.42 N ATOM 798 CA GLU A 55 -4.263 4.935 -2.106 1.00 23.22 C ATOM 799 C GLU A 55 -5.718 4.486 -1.996 1.00 75.45 C ATOM 800 O GLU A 55 -6.183 3.652 -2.773 1.00 30.43 O ATOM 801 CB GLU A 55 -3.518 4.045 -3.103 1.00 12.31 C ATOM 802 CG GLU A 55 -3.511 4.589 -4.521 1.00 70.23 C ATOM 803 CD GLU A 55 -2.115 4.908 -5.017 1.00 53.32 C ATOM 804 OE1 GLU A 55 -1.334 5.509 -4.248 1.00 21.24 O ATOM 805 OE2 GLU A 55 -1.801 4.558 -6.174 1.00 13.21 O ATOM 0 H GLU A 55 -4.093 4.339 -0.104 1.00 74.42 H new ATOM 0 HA GLU A 55 -4.244 5.964 -2.464 1.00 23.22 H new ATOM 0 HB2 GLU A 55 -2.489 3.920 -2.766 1.00 12.31 H new ATOM 0 HB3 GLU A 55 -3.975 3.055 -3.105 1.00 12.31 H new ATOM 0 HG2 GLU A 55 -3.972 3.860 -5.188 1.00 70.23 H new ATOM 0 HG3 GLU A 55 -4.122 5.491 -4.563 1.00 70.23 H new ATOM 812 N THR A 56 -6.431 5.046 -1.024 1.00 30.24 N ATOM 813 CA THR A 56 -7.831 4.703 -0.809 1.00 2.44 C ATOM 814 C THR A 56 -8.627 5.913 -0.334 1.00 30.24 C ATOM 815 O THR A 56 -8.180 6.660 0.538 1.00 3.31 O ATOM 816 CB THR A 56 -7.980 3.568 0.222 1.00 51.04 C ATOM 817 OG1 THR A 56 -7.768 4.077 1.544 1.00 13.32 O ATOM 818 CG2 THR A 56 -6.991 2.448 -0.060 1.00 4.13 C ATOM 0 H THR A 56 -6.062 5.739 -0.373 1.00 30.24 H new ATOM 0 HA THR A 56 -8.224 4.366 -1.768 1.00 2.44 H new ATOM 0 HB THR A 56 -8.990 3.167 0.145 1.00 51.04 H new ATOM 0 HG1 THR A 56 -8.179 3.473 2.197 1.00 13.32 H new ATOM 0 HG21 THR A 56 -7.115 1.658 0.681 1.00 4.13 H new ATOM 0 HG22 THR A 56 -7.173 2.044 -1.056 1.00 4.13 H new ATOM 0 HG23 THR A 56 -5.975 2.838 -0.008 1.00 4.13 H new ATOM 826 N LEU A 57 -9.809 6.102 -0.911 1.00 72.04 N ATOM 827 CA LEU A 57 -10.668 7.222 -0.547 1.00 34.34 C ATOM 828 C LEU A 57 -10.881 7.277 0.963 1.00 13.31 C ATOM 829 O LEU A 57 -11.037 8.353 1.540 1.00 21.44 O ATOM 830 CB LEU A 57 -12.017 7.110 -1.260 1.00 14.32 C ATOM 831 CG LEU A 57 -12.656 8.427 -1.699 1.00 62.02 C ATOM 832 CD1 LEU A 57 -12.817 9.365 -0.513 1.00 52.03 C ATOM 833 CD2 LEU A 57 -11.826 9.084 -2.792 1.00 11.42 C ATOM 0 H LEU A 57 -10.194 5.493 -1.633 1.00 72.04 H new ATOM 0 HA LEU A 57 -10.174 8.142 -0.860 1.00 34.34 H new ATOM 0 HB2 LEU A 57 -11.889 6.481 -2.141 1.00 14.32 H new ATOM 0 HB3 LEU A 57 -12.713 6.594 -0.598 1.00 14.32 H new ATOM 0 HG LEU A 57 -13.646 8.211 -2.102 1.00 62.02 H new ATOM 0 HD11 LEU A 57 -13.274 10.297 -0.846 1.00 52.03 H new ATOM 0 HD12 LEU A 57 -13.454 8.897 0.237 1.00 52.03 H new ATOM 0 HD13 LEU A 57 -11.839 9.574 -0.079 1.00 52.03 H new ATOM 0 HD21 LEU A 57 -12.296 10.021 -3.092 1.00 11.42 H new ATOM 0 HD22 LEU A 57 -10.823 9.286 -2.416 1.00 11.42 H new ATOM 0 HD23 LEU A 57 -11.764 8.417 -3.652 1.00 11.42 H new ATOM 845 N ASP A 58 -10.882 6.109 1.598 1.00 65.30 N ATOM 846 CA ASP A 58 -11.071 6.024 3.041 1.00 21.04 C ATOM 847 C ASP A 58 -9.881 6.624 3.782 1.00 2.33 C ATOM 848 O ASP A 58 -10.042 7.247 4.831 1.00 4.31 O ATOM 849 CB ASP A 58 -11.271 4.567 3.465 1.00 22.01 C ATOM 850 CG ASP A 58 -12.544 3.968 2.899 1.00 75.31 C ATOM 851 OD1 ASP A 58 -13.596 4.077 3.563 1.00 2.22 O ATOM 852 OD2 ASP A 58 -12.488 3.393 1.793 1.00 43.32 O ATOM 0 H ASP A 58 -10.754 5.209 1.136 1.00 65.30 H new ATOM 0 HA ASP A 58 -11.962 6.596 3.300 1.00 21.04 H new ATOM 0 HB2 ASP A 58 -10.417 3.975 3.135 1.00 22.01 H new ATOM 0 HB3 ASP A 58 -11.298 4.509 4.553 1.00 22.01 H new ATOM 857 N GLN A 59 -8.688 6.430 3.229 1.00 3.03 N ATOM 858 CA GLN A 59 -7.470 6.951 3.840 1.00 1.02 C ATOM 859 C GLN A 59 -7.424 8.472 3.747 1.00 72.23 C ATOM 860 O GLN A 59 -7.182 9.158 4.742 1.00 63.13 O ATOM 861 CB GLN A 59 -6.238 6.349 3.163 1.00 0.14 C ATOM 862 CG GLN A 59 -5.531 5.301 4.008 1.00 40.03 C ATOM 863 CD GLN A 59 -5.878 3.886 3.592 1.00 12.41 C ATOM 864 OE1 GLN A 59 -5.277 3.425 2.502 1.00 4.21 O flip ATOM 865 NE2 GLN A 59 -6.677 3.213 4.244 1.00 63.12 N flip ATOM 0 H GLN A 59 -8.539 5.917 2.360 1.00 3.03 H new ATOM 0 HA GLN A 59 -7.471 6.669 4.893 1.00 1.02 H new ATOM 0 HB2 GLN A 59 -6.537 5.899 2.216 1.00 0.14 H new ATOM 0 HB3 GLN A 59 -5.536 7.149 2.928 1.00 0.14 H new ATOM 0 HG2 GLN A 59 -4.453 5.444 3.931 1.00 40.03 H new ATOM 0 HG3 GLN A 59 -5.798 5.444 5.055 1.00 40.03 H new ATOM 0 HE21 GLN A 59 -7.116 3.607 5.076 1.00 63.12 H new ATOM 0 HE22 GLN A 59 -6.900 2.261 3.952 1.00 63.12 H new ATOM 874 N LEU A 60 -7.656 8.996 2.548 1.00 12.51 N ATOM 875 CA LEU A 60 -7.640 10.437 2.325 1.00 13.52 C ATOM 876 C LEU A 60 -8.673 11.135 3.204 1.00 3.33 C ATOM 877 O LEU A 60 -8.399 12.183 3.789 1.00 3.12 O ATOM 878 CB LEU A 60 -7.911 10.748 0.853 1.00 74.22 C ATOM 879 CG LEU A 60 -6.713 10.630 -0.090 1.00 14.30 C ATOM 880 CD1 LEU A 60 -5.652 11.662 0.261 1.00 1.25 C ATOM 881 CD2 LEU A 60 -6.130 9.225 -0.038 1.00 13.12 C ATOM 0 H LEU A 60 -7.858 8.443 1.715 1.00 12.51 H new ATOM 0 HA LEU A 60 -6.651 10.811 2.592 1.00 13.52 H new ATOM 0 HB2 LEU A 60 -8.694 10.077 0.499 1.00 74.22 H new ATOM 0 HB3 LEU A 60 -8.304 11.762 0.783 1.00 74.22 H new ATOM 0 HG LEU A 60 -7.056 10.823 -1.107 1.00 14.30 H new ATOM 0 HD11 LEU A 60 -4.808 11.562 -0.421 1.00 1.25 H new ATOM 0 HD12 LEU A 60 -6.074 12.663 0.172 1.00 1.25 H new ATOM 0 HD13 LEU A 60 -5.313 11.501 1.284 1.00 1.25 H new ATOM 0 HD21 LEU A 60 -5.278 9.159 -0.715 1.00 13.12 H new ATOM 0 HD22 LEU A 60 -5.803 9.004 0.978 1.00 13.12 H new ATOM 0 HD23 LEU A 60 -6.890 8.504 -0.340 1.00 13.12 H new ATOM 893 N ARG A 61 -9.862 10.546 3.292 1.00 1.42 N ATOM 894 CA ARG A 61 -10.936 11.111 4.099 1.00 55.20 C ATOM 895 C ARG A 61 -10.520 11.211 5.564 1.00 23.44 C ATOM 896 O ARG A 61 -10.637 12.270 6.182 1.00 55.32 O ATOM 897 CB ARG A 61 -12.200 10.258 3.973 1.00 13.43 C ATOM 898 CG ARG A 61 -13.410 10.854 4.673 1.00 53.23 C ATOM 899 CD ARG A 61 -14.548 9.850 4.772 1.00 54.30 C ATOM 900 NE ARG A 61 -14.995 9.398 3.458 1.00 44.25 N ATOM 901 CZ ARG A 61 -15.844 8.394 3.276 1.00 2.51 C ATOM 902 NH1 ARG A 61 -16.336 7.740 4.319 1.00 12.13 N ATOM 903 NH2 ARG A 61 -16.203 8.040 2.048 1.00 74.23 N ATOM 0 H ARG A 61 -10.105 9.678 2.814 1.00 1.42 H new ATOM 0 HA ARG A 61 -11.145 12.115 3.729 1.00 55.20 H new ATOM 0 HB2 ARG A 61 -12.432 10.122 2.917 1.00 13.43 H new ATOM 0 HB3 ARG A 61 -12.003 9.269 4.386 1.00 13.43 H new ATOM 0 HG2 ARG A 61 -13.127 11.184 5.672 1.00 53.23 H new ATOM 0 HG3 ARG A 61 -13.748 11.736 4.129 1.00 53.23 H new ATOM 0 HD2 ARG A 61 -14.224 8.991 5.360 1.00 54.30 H new ATOM 0 HD3 ARG A 61 -15.385 10.302 5.304 1.00 54.30 H new ATOM 0 HE ARG A 61 -14.635 9.880 2.634 1.00 44.25 H new ATOM 0 HH11 ARG A 61 -16.062 8.008 5.264 1.00 12.13 H new ATOM 0 HH12 ARG A 61 -16.988 6.969 4.176 1.00 12.13 H new ATOM 0 HH21 ARG A 61 -15.826 8.540 1.243 1.00 74.23 H new ATOM 0 HH22 ARG A 61 -16.855 7.268 1.910 1.00 74.23 H new ATOM 917 N LEU A 62 -10.037 10.102 6.114 1.00 50.34 N ATOM 918 CA LEU A 62 -9.605 10.065 7.506 1.00 43.54 C ATOM 919 C LEU A 62 -8.597 11.174 7.794 1.00 44.43 C ATOM 920 O LEU A 62 -8.626 11.791 8.858 1.00 60.03 O ATOM 921 CB LEU A 62 -8.987 8.703 7.832 1.00 34.23 C ATOM 922 CG LEU A 62 -9.665 7.910 8.951 1.00 74.35 C ATOM 923 CD1 LEU A 62 -9.694 8.721 10.237 1.00 14.12 C ATOM 924 CD2 LEU A 62 -11.073 7.506 8.541 1.00 10.13 C ATOM 0 H LEU A 62 -9.935 9.217 5.617 1.00 50.34 H new ATOM 0 HA LEU A 62 -10.480 10.222 8.136 1.00 43.54 H new ATOM 0 HB2 LEU A 62 -8.996 8.096 6.927 1.00 34.23 H new ATOM 0 HB3 LEU A 62 -7.942 8.856 8.103 1.00 34.23 H new ATOM 0 HG LEU A 62 -9.087 7.004 9.130 1.00 74.35 H new ATOM 0 HD11 LEU A 62 -10.180 8.141 11.022 1.00 14.12 H new ATOM 0 HD12 LEU A 62 -8.674 8.959 10.540 1.00 14.12 H new ATOM 0 HD13 LEU A 62 -10.249 9.645 10.072 1.00 14.12 H new ATOM 0 HD21 LEU A 62 -11.540 6.943 9.349 1.00 10.13 H new ATOM 0 HD22 LEU A 62 -11.662 8.399 8.334 1.00 10.13 H new ATOM 0 HD23 LEU A 62 -11.027 6.886 7.646 1.00 10.13 H new ATOM 936 N VAL A 63 -7.708 11.422 6.837 1.00 23.34 N ATOM 937 CA VAL A 63 -6.694 12.459 6.985 1.00 30.50 C ATOM 938 C VAL A 63 -7.333 13.836 7.121 1.00 34.11 C ATOM 939 O VAL A 63 -6.922 14.642 7.957 1.00 53.01 O ATOM 940 CB VAL A 63 -5.724 12.471 5.789 1.00 31.42 C ATOM 941 CG1 VAL A 63 -4.604 13.474 6.020 1.00 1.12 C ATOM 942 CG2 VAL A 63 -5.163 11.078 5.545 1.00 30.12 C ATOM 0 H VAL A 63 -7.670 10.919 5.951 1.00 23.34 H new ATOM 0 HA VAL A 63 -6.136 12.229 7.893 1.00 30.50 H new ATOM 0 HB VAL A 63 -6.274 12.777 4.899 1.00 31.42 H new ATOM 0 HG11 VAL A 63 -3.928 13.468 5.165 1.00 1.12 H new ATOM 0 HG12 VAL A 63 -5.028 14.471 6.141 1.00 1.12 H new ATOM 0 HG13 VAL A 63 -4.052 13.202 6.920 1.00 1.12 H new ATOM 0 HG21 VAL A 63 -4.479 11.105 4.696 1.00 30.12 H new ATOM 0 HG22 VAL A 63 -4.627 10.741 6.432 1.00 30.12 H new ATOM 0 HG23 VAL A 63 -5.980 10.389 5.331 1.00 30.12 H new ATOM 952 N ILE A 64 -8.340 14.100 6.297 1.00 24.13 N ATOM 953 CA ILE A 64 -9.037 15.380 6.326 1.00 70.23 C ATOM 954 C ILE A 64 -9.683 15.623 7.686 1.00 71.15 C ATOM 955 O ILE A 64 -9.691 16.747 8.189 1.00 51.35 O ATOM 956 CB ILE A 64 -10.121 15.457 5.234 1.00 12.25 C ATOM 957 CG1 ILE A 64 -9.477 15.490 3.847 1.00 11.51 C ATOM 958 CG2 ILE A 64 -11.000 16.680 5.445 1.00 14.31 C ATOM 959 CD1 ILE A 64 -8.647 16.729 3.596 1.00 15.10 C ATOM 0 H ILE A 64 -8.692 13.444 5.600 1.00 24.13 H new ATOM 0 HA ILE A 64 -8.289 16.150 6.138 1.00 70.23 H new ATOM 0 HB ILE A 64 -10.748 14.568 5.302 1.00 12.25 H new ATOM 0 HG12 ILE A 64 -8.846 14.609 3.727 1.00 11.51 H new ATOM 0 HG13 ILE A 64 -10.259 15.427 3.090 1.00 11.51 H new ATOM 0 HG21 ILE A 64 -11.761 16.720 4.665 1.00 14.31 H new ATOM 0 HG22 ILE A 64 -11.483 16.617 6.420 1.00 14.31 H new ATOM 0 HG23 ILE A 64 -10.387 17.580 5.401 1.00 14.31 H new ATOM 0 HD11 ILE A 64 -8.221 16.685 2.594 1.00 15.10 H new ATOM 0 HD12 ILE A 64 -9.278 17.613 3.683 1.00 15.10 H new ATOM 0 HD13 ILE A 64 -7.843 16.783 4.330 1.00 15.10 H new ATOM 971 N CYS A 65 -10.222 14.562 8.276 1.00 54.41 N ATOM 972 CA CYS A 65 -10.870 14.659 9.580 1.00 31.41 C ATOM 973 C CYS A 65 -9.856 15.001 10.666 1.00 15.33 C ATOM 974 O CYS A 65 -9.983 16.016 11.351 1.00 55.41 O ATOM 975 CB CYS A 65 -11.578 13.347 9.919 1.00 14.35 C ATOM 976 SG CYS A 65 -12.762 13.478 11.280 1.00 23.31 S ATOM 0 H CYS A 65 -10.223 13.625 7.873 1.00 54.41 H new ATOM 0 HA CYS A 65 -11.608 15.459 9.534 1.00 31.41 H new ATOM 0 HB2 CYS A 65 -12.099 12.988 9.032 1.00 14.35 H new ATOM 0 HB3 CYS A 65 -10.829 12.598 10.174 1.00 14.35 H new ATOM 0 HG CYS A 65 -13.311 12.319 11.491 1.00 23.31 H new ATOM 982 N ASP A 66 -8.852 14.145 10.821 1.00 41.34 N ATOM 983 CA ASP A 66 -7.816 14.356 11.825 1.00 51.13 C ATOM 984 C ASP A 66 -7.104 15.687 11.602 1.00 41.21 C ATOM 985 O ASP A 66 -6.914 16.465 12.537 1.00 73.40 O ATOM 986 CB ASP A 66 -6.802 13.210 11.791 1.00 33.25 C ATOM 987 CG ASP A 66 -7.466 11.855 11.648 1.00 52.03 C ATOM 988 OD1 ASP A 66 -8.579 11.678 12.186 1.00 64.13 O ATOM 989 OD2 ASP A 66 -6.872 10.970 10.996 1.00 74.43 O ATOM 0 H ASP A 66 -8.734 13.299 10.264 1.00 41.34 H new ATOM 0 HA ASP A 66 -8.294 14.380 12.804 1.00 51.13 H new ATOM 0 HB2 ASP A 66 -6.112 13.363 10.961 1.00 33.25 H new ATOM 0 HB3 ASP A 66 -6.209 13.226 12.705 1.00 33.25 H new ATOM 994 N LEU A 67 -6.713 15.942 10.358 1.00 10.24 N ATOM 995 CA LEU A 67 -6.021 17.178 10.012 1.00 32.42 C ATOM 996 C LEU A 67 -6.903 18.392 10.292 1.00 44.21 C ATOM 997 O LEU A 67 -6.408 19.462 10.643 1.00 54.01 O ATOM 998 CB LEU A 67 -5.611 17.160 8.538 1.00 32.22 C ATOM 999 CG LEU A 67 -4.787 18.356 8.057 1.00 33.12 C ATOM 1000 CD1 LEU A 67 -3.533 18.515 8.902 1.00 20.23 C ATOM 1001 CD2 LEU A 67 -4.425 18.197 6.587 1.00 2.34 C ATOM 0 H LEU A 67 -6.864 15.309 9.572 1.00 10.24 H new ATOM 0 HA LEU A 67 -5.127 17.251 10.631 1.00 32.42 H new ATOM 0 HB2 LEU A 67 -5.039 16.251 8.352 1.00 32.22 H new ATOM 0 HB3 LEU A 67 -6.514 17.098 7.931 1.00 32.22 H new ATOM 0 HG LEU A 67 -5.391 19.257 8.167 1.00 33.12 H new ATOM 0 HD11 LEU A 67 -2.960 19.371 8.545 1.00 20.23 H new ATOM 0 HD12 LEU A 67 -3.814 18.675 9.943 1.00 20.23 H new ATOM 0 HD13 LEU A 67 -2.925 17.613 8.825 1.00 20.23 H new ATOM 0 HD21 LEU A 67 -3.839 19.057 6.262 1.00 2.34 H new ATOM 0 HD22 LEU A 67 -3.840 17.287 6.453 1.00 2.34 H new ATOM 0 HD23 LEU A 67 -5.336 18.133 5.993 1.00 2.34 H new ATOM 1013 N GLN A 68 -8.211 18.215 10.134 1.00 0.44 N ATOM 1014 CA GLN A 68 -9.161 19.295 10.371 1.00 31.31 C ATOM 1015 C GLN A 68 -9.135 19.731 11.832 1.00 73.32 C ATOM 1016 O GLN A 68 -9.043 20.922 12.133 1.00 42.12 O ATOM 1017 CB GLN A 68 -10.574 18.855 9.983 1.00 72.22 C ATOM 1018 CG GLN A 68 -10.991 19.306 8.593 1.00 70.04 C ATOM 1019 CD GLN A 68 -11.868 20.542 8.619 1.00 70.42 C ATOM 1020 OE1 GLN A 68 -12.871 20.591 9.331 1.00 52.51 O ATOM 1021 NE2 GLN A 68 -11.494 21.551 7.841 1.00 65.45 N ATOM 0 H GLN A 68 -8.636 17.335 9.843 1.00 0.44 H new ATOM 0 HA GLN A 68 -8.870 20.143 9.752 1.00 31.31 H new ATOM 0 HB2 GLN A 68 -10.635 17.768 10.037 1.00 72.22 H new ATOM 0 HB3 GLN A 68 -11.282 19.250 10.712 1.00 72.22 H new ATOM 0 HG2 GLN A 68 -10.100 19.510 7.999 1.00 70.04 H new ATOM 0 HG3 GLN A 68 -11.526 18.496 8.098 1.00 70.04 H new ATOM 0 HE21 GLN A 68 -10.655 21.468 7.266 1.00 65.45 H new ATOM 0 HE22 GLN A 68 -12.045 22.409 7.818 1.00 65.45 H new ATOM 1030 N GLU A 69 -9.219 18.761 12.737 1.00 61.03 N ATOM 1031 CA GLU A 69 -9.206 19.047 14.166 1.00 12.35 C ATOM 1032 C GLU A 69 -7.875 19.665 14.587 1.00 24.31 C ATOM 1033 O GLU A 69 -7.834 20.561 15.429 1.00 15.14 O ATOM 1034 CB GLU A 69 -9.461 17.767 14.968 1.00 63.41 C ATOM 1035 CG GLU A 69 -10.923 17.551 15.318 1.00 31.44 C ATOM 1036 CD GLU A 69 -11.228 17.869 16.770 1.00 1.42 C ATOM 1037 OE1 GLU A 69 -11.773 18.960 17.036 1.00 13.30 O ATOM 1038 OE2 GLU A 69 -10.922 17.026 17.639 1.00 40.44 O ATOM 0 H GLU A 69 -9.297 17.771 12.506 1.00 61.03 H new ATOM 0 HA GLU A 69 -10.001 19.763 14.373 1.00 12.35 H new ATOM 0 HB2 GLU A 69 -9.103 16.912 14.395 1.00 63.41 H new ATOM 0 HB3 GLU A 69 -8.877 17.802 15.888 1.00 63.41 H new ATOM 0 HG2 GLU A 69 -11.543 18.176 14.675 1.00 31.44 H new ATOM 0 HG3 GLU A 69 -11.193 16.515 15.112 1.00 31.44 H new ATOM 1045 N ARG A 70 -6.790 19.180 13.992 1.00 70.51 N ATOM 1046 CA ARG A 70 -5.458 19.684 14.305 1.00 44.41 C ATOM 1047 C ARG A 70 -5.275 21.102 13.775 1.00 64.35 C ATOM 1048 O ARG A 70 -5.005 22.030 14.536 1.00 74.44 O ATOM 1049 CB ARG A 70 -4.390 18.764 13.710 1.00 70.23 C ATOM 1050 CG ARG A 70 -4.241 17.445 14.451 1.00 2.03 C ATOM 1051 CD ARG A 70 -2.779 17.087 14.663 1.00 11.34 C ATOM 1052 NE ARG A 70 -2.130 17.979 15.620 1.00 32.21 N ATOM 1053 CZ ARG A 70 -1.002 17.682 16.255 1.00 3.12 C ATOM 1054 NH1 ARG A 70 -0.400 16.521 16.034 1.00 21.41 N ATOM 1055 NH2 ARG A 70 -0.473 18.547 17.111 1.00 2.34 N ATOM 0 H ARG A 70 -6.807 18.439 13.291 1.00 70.51 H new ATOM 0 HA ARG A 70 -5.349 19.703 15.389 1.00 44.41 H new ATOM 0 HB2 ARG A 70 -4.638 18.560 12.668 1.00 70.23 H new ATOM 0 HB3 ARG A 70 -3.432 19.284 13.714 1.00 70.23 H new ATOM 0 HG2 ARG A 70 -4.744 17.510 15.416 1.00 2.03 H new ATOM 0 HG3 ARG A 70 -4.733 16.652 13.887 1.00 2.03 H new ATOM 0 HD2 ARG A 70 -2.705 16.059 15.018 1.00 11.34 H new ATOM 0 HD3 ARG A 70 -2.253 17.133 13.710 1.00 11.34 H new ATOM 0 HE ARG A 70 -2.567 18.880 15.811 1.00 32.21 H new ATOM 0 HH11 ARG A 70 -0.803 15.855 15.375 1.00 21.41 H new ATOM 0 HH12 ARG A 70 0.466 16.295 16.523 1.00 21.41 H new ATOM 0 HH21 ARG A 70 -0.933 19.441 17.282 1.00 2.34 H new ATOM 0 HH22 ARG A 70 0.393 18.318 17.598 1.00 2.34 H new ATOM 1069 N ARG A 71 -5.424 21.263 12.463 1.00 54.22 N ATOM 1070 CA ARG A 71 -5.273 22.567 11.831 1.00 70.34 C ATOM 1071 C ARG A 71 -6.149 23.610 12.520 1.00 23.01 C ATOM 1072 O ARG A 71 -5.817 24.794 12.544 1.00 73.40 O ATOM 1073 CB ARG A 71 -5.632 22.483 10.347 1.00 60.24 C ATOM 1074 CG ARG A 71 -7.126 22.388 10.087 1.00 21.32 C ATOM 1075 CD ARG A 71 -7.433 22.374 8.597 1.00 1.03 C ATOM 1076 NE ARG A 71 -7.671 23.717 8.075 1.00 23.22 N ATOM 1077 CZ ARG A 71 -8.328 23.961 6.946 1.00 52.44 C ATOM 1078 NH1 ARG A 71 -8.809 22.957 6.224 1.00 55.22 N ATOM 1079 NH2 ARG A 71 -8.504 25.210 6.536 1.00 24.03 N ATOM 0 H ARG A 71 -5.649 20.506 11.818 1.00 54.22 H new ATOM 0 HA ARG A 71 -4.231 22.872 11.928 1.00 70.34 H new ATOM 0 HB2 ARG A 71 -5.238 23.362 9.836 1.00 60.24 H new ATOM 0 HB3 ARG A 71 -5.140 21.613 9.911 1.00 60.24 H new ATOM 0 HG2 ARG A 71 -7.520 21.483 10.549 1.00 21.32 H new ATOM 0 HG3 ARG A 71 -7.632 23.232 10.556 1.00 21.32 H new ATOM 0 HD2 ARG A 71 -6.601 21.918 8.060 1.00 1.03 H new ATOM 0 HD3 ARG A 71 -8.310 21.753 8.413 1.00 1.03 H new ATOM 0 HE ARG A 71 -7.313 24.511 8.606 1.00 23.22 H new ATOM 0 HH11 ARG A 71 -8.675 21.995 6.535 1.00 55.22 H new ATOM 0 HH12 ARG A 71 -9.313 23.147 5.358 1.00 55.22 H new ATOM 0 HH21 ARG A 71 -8.135 25.985 7.087 1.00 24.03 H new ATOM 0 HH22 ARG A 71 -9.008 25.396 5.669 1.00 24.03 H new ATOM 1093 N GLU A 72 -7.268 23.159 13.076 1.00 34.35 N ATOM 1094 CA GLU A 72 -8.193 24.054 13.764 1.00 60.13 C ATOM 1095 C GLU A 72 -7.583 24.574 15.062 1.00 53.44 C ATOM 1096 O GLU A 72 -7.379 25.777 15.227 1.00 55.31 O ATOM 1097 CB GLU A 72 -9.510 23.334 14.059 1.00 11.42 C ATOM 1098 CG GLU A 72 -10.600 24.252 14.586 1.00 4.53 C ATOM 1099 CD GLU A 72 -11.987 23.813 14.157 1.00 33.44 C ATOM 1100 OE1 GLU A 72 -12.758 24.671 13.677 1.00 64.12 O ATOM 1101 OE2 GLU A 72 -12.304 22.614 14.304 1.00 75.01 O ATOM 0 H GLU A 72 -7.557 22.181 13.064 1.00 34.35 H new ATOM 0 HA GLU A 72 -8.390 24.903 13.110 1.00 60.13 H new ATOM 0 HB2 GLU A 72 -9.862 22.851 13.148 1.00 11.42 H new ATOM 0 HB3 GLU A 72 -9.327 22.545 14.788 1.00 11.42 H new ATOM 0 HG2 GLU A 72 -10.552 24.280 15.675 1.00 4.53 H new ATOM 0 HG3 GLU A 72 -10.418 25.267 14.232 1.00 4.53 H new ATOM 1108 N LYS A 73 -7.293 23.659 15.981 1.00 53.33 N ATOM 1109 CA LYS A 73 -6.704 24.023 17.265 1.00 22.33 C ATOM 1110 C LYS A 73 -5.335 24.665 17.074 1.00 43.34 C ATOM 1111 O LYS A 73 -4.865 25.414 17.930 1.00 53.42 O ATOM 1112 CB LYS A 73 -6.580 22.788 18.160 1.00 33.14 C ATOM 1113 CG LYS A 73 -7.410 22.871 19.430 1.00 22.50 C ATOM 1114 CD LYS A 73 -6.544 22.750 20.671 1.00 73.03 C ATOM 1115 CE LYS A 73 -7.384 22.729 21.939 1.00 21.32 C ATOM 1116 NZ LYS A 73 -7.438 24.067 22.591 1.00 40.14 N ATOM 0 H LYS A 73 -7.456 22.659 15.861 1.00 53.33 H new ATOM 0 HA LYS A 73 -7.361 24.748 17.745 1.00 22.33 H new ATOM 0 HB2 LYS A 73 -6.884 21.908 17.594 1.00 33.14 H new ATOM 0 HB3 LYS A 73 -5.533 22.648 18.429 1.00 33.14 H new ATOM 0 HG2 LYS A 73 -7.949 23.818 19.452 1.00 22.50 H new ATOM 0 HG3 LYS A 73 -8.158 22.079 19.429 1.00 22.50 H new ATOM 0 HD2 LYS A 73 -5.949 21.839 20.613 1.00 73.03 H new ATOM 0 HD3 LYS A 73 -5.845 23.585 20.711 1.00 73.03 H new ATOM 0 HE2 LYS A 73 -8.395 22.401 21.699 1.00 21.32 H new ATOM 0 HE3 LYS A 73 -6.970 22.001 22.637 1.00 21.32 H new ATOM 0 HZ1 LYS A 73 -8.020 24.011 23.451 1.00 40.14 H new ATOM 0 HZ2 LYS A 73 -6.475 24.369 22.843 1.00 40.14 H new ATOM 0 HZ3 LYS A 73 -7.857 24.756 21.935 1.00 40.14 H new ATOM 1130 N PHE A 74 -4.700 24.368 15.945 1.00 61.25 N ATOM 1131 CA PHE A 74 -3.384 24.918 15.641 1.00 51.03 C ATOM 1132 C PHE A 74 -3.506 26.280 14.963 1.00 44.43 C ATOM 1133 O PHE A 74 -2.582 27.091 15.005 1.00 50.15 O ATOM 1134 CB PHE A 74 -2.601 23.957 14.743 1.00 51.11 C ATOM 1135 CG PHE A 74 -1.188 24.395 14.482 1.00 33.35 C ATOM 1136 CD1 PHE A 74 -0.876 25.141 13.357 1.00 3.04 C ATOM 1137 CD2 PHE A 74 -0.171 24.062 15.363 1.00 2.15 C ATOM 1138 CE1 PHE A 74 0.422 25.546 13.114 1.00 32.32 C ATOM 1139 CE2 PHE A 74 1.129 24.465 15.126 1.00 63.11 C ATOM 1140 CZ PHE A 74 1.426 25.207 14.000 1.00 73.24 C ATOM 0 H PHE A 74 -5.075 23.750 15.226 1.00 61.25 H new ATOM 0 HA PHE A 74 -2.846 25.047 16.580 1.00 51.03 H new ATOM 0 HB2 PHE A 74 -2.587 22.970 15.206 1.00 51.11 H new ATOM 0 HB3 PHE A 74 -3.123 23.855 13.791 1.00 51.11 H new ATOM 0 HD1 PHE A 74 -1.657 25.409 12.661 1.00 3.04 H new ATOM 0 HD2 PHE A 74 -0.397 23.481 16.245 1.00 2.15 H new ATOM 0 HE1 PHE A 74 0.651 26.127 12.233 1.00 32.32 H new ATOM 0 HE2 PHE A 74 1.912 24.200 15.821 1.00 63.11 H new ATOM 0 HZ PHE A 74 2.442 25.522 13.812 1.00 73.24 H new ATOM 1150 N GLY A 75 -4.654 26.522 14.338 1.00 63.13 N ATOM 1151 CA GLY A 75 -4.877 27.785 13.659 1.00 52.44 C ATOM 1152 C GLY A 75 -4.739 27.667 12.154 1.00 54.53 C ATOM 1153 O GLY A 75 -4.252 26.657 11.646 1.00 54.53 O ATOM 0 H GLY A 75 -5.434 25.866 14.290 1.00 63.13 H new ATOM 0 HA2 GLY A 75 -5.874 28.153 13.901 1.00 52.44 H new ATOM 0 HA3 GLY A 75 -4.166 28.523 14.029 1.00 52.44 H new ATOM 1157 N SER A 76 -5.170 28.701 11.439 1.00 22.35 N ATOM 1158 CA SER A 76 -5.098 28.707 9.983 1.00 5.44 C ATOM 1159 C SER A 76 -3.739 29.211 9.508 1.00 51.20 C ATOM 1160 O SER A 76 -3.199 30.175 10.051 1.00 63.22 O ATOM 1161 CB SER A 76 -6.211 29.578 9.399 1.00 22.53 C ATOM 1162 OG SER A 76 -6.855 30.331 10.413 1.00 42.53 O ATOM 0 H SER A 76 -5.573 29.546 11.845 1.00 22.35 H new ATOM 0 HA SER A 76 -5.228 27.683 9.634 1.00 5.44 H new ATOM 0 HB2 SER A 76 -5.795 30.252 8.650 1.00 22.53 H new ATOM 0 HB3 SER A 76 -6.941 28.948 8.890 1.00 22.53 H new ATOM 0 HG SER A 76 -7.561 30.881 10.014 1.00 42.53 H new ATOM 1168 N SER A 77 -3.192 28.553 8.492 1.00 63.13 N ATOM 1169 CA SER A 77 -1.895 28.931 7.944 1.00 53.32 C ATOM 1170 C SER A 77 -1.817 28.609 6.455 1.00 31.41 C ATOM 1171 O SER A 77 -2.407 27.635 5.987 1.00 51.33 O ATOM 1172 CB SER A 77 -0.771 28.210 8.693 1.00 25.32 C ATOM 1173 OG SER A 77 -0.141 27.251 7.863 1.00 42.54 O ATOM 0 H SER A 77 -3.627 27.754 8.031 1.00 63.13 H new ATOM 0 HA SER A 77 -1.776 30.007 8.071 1.00 53.32 H new ATOM 0 HB2 SER A 77 -0.035 28.936 9.039 1.00 25.32 H new ATOM 0 HB3 SER A 77 -1.175 27.720 9.579 1.00 25.32 H new ATOM 0 HG SER A 77 0.574 26.805 8.363 1.00 42.54 H new ATOM 1179 N LYS A 78 -1.086 29.435 5.715 1.00 70.23 N ATOM 1180 CA LYS A 78 -0.929 29.240 4.279 1.00 50.23 C ATOM 1181 C LYS A 78 -0.405 27.840 3.973 1.00 32.02 C ATOM 1182 O LYS A 78 -0.773 27.237 2.966 1.00 72.01 O ATOM 1183 CB LYS A 78 0.025 30.289 3.702 1.00 73.32 C ATOM 1184 CG LYS A 78 1.372 30.337 4.401 1.00 33.24 C ATOM 1185 CD LYS A 78 2.137 31.603 4.053 1.00 44.11 C ATOM 1186 CE LYS A 78 2.722 32.260 5.293 1.00 72.21 C ATOM 1187 NZ LYS A 78 2.902 33.728 5.110 1.00 11.43 N ATOM 0 H LYS A 78 -0.592 30.247 6.086 1.00 70.23 H new ATOM 0 HA LYS A 78 -1.908 29.352 3.814 1.00 50.23 H new ATOM 0 HB2 LYS A 78 0.182 30.082 2.643 1.00 73.32 H new ATOM 0 HB3 LYS A 78 -0.445 31.270 3.769 1.00 73.32 H new ATOM 0 HG2 LYS A 78 1.225 30.285 5.480 1.00 33.24 H new ATOM 0 HG3 LYS A 78 1.961 29.465 4.117 1.00 33.24 H new ATOM 0 HD2 LYS A 78 2.939 31.364 3.354 1.00 44.11 H new ATOM 0 HD3 LYS A 78 1.472 32.304 3.548 1.00 44.11 H new ATOM 0 HE2 LYS A 78 2.066 32.078 6.144 1.00 72.21 H new ATOM 0 HE3 LYS A 78 3.683 31.803 5.527 1.00 72.21 H new ATOM 0 HZ1 LYS A 78 3.303 34.139 5.977 1.00 11.43 H new ATOM 0 HZ2 LYS A 78 3.548 33.902 4.314 1.00 11.43 H new ATOM 0 HZ3 LYS A 78 1.981 34.169 4.912 1.00 11.43 H new ATOM 1201 N GLU A 79 0.453 27.330 4.852 1.00 45.33 N ATOM 1202 CA GLU A 79 1.025 26.000 4.675 1.00 52.44 C ATOM 1203 C GLU A 79 -0.015 24.919 4.951 1.00 2.33 C ATOM 1204 O GLU A 79 -0.367 24.140 4.064 1.00 54.43 O ATOM 1205 CB GLU A 79 2.230 25.812 5.599 1.00 40.01 C ATOM 1206 CG GLU A 79 3.338 26.826 5.368 1.00 42.21 C ATOM 1207 CD GLU A 79 4.680 26.352 5.892 1.00 34.22 C ATOM 1208 OE1 GLU A 79 4.765 25.188 6.337 1.00 13.20 O ATOM 1209 OE2 GLU A 79 5.644 27.144 5.857 1.00 52.13 O ATOM 0 H GLU A 79 0.767 27.817 5.692 1.00 45.33 H new ATOM 0 HA GLU A 79 1.352 25.908 3.639 1.00 52.44 H new ATOM 0 HB2 GLU A 79 1.897 25.880 6.635 1.00 40.01 H new ATOM 0 HB3 GLU A 79 2.632 24.809 5.458 1.00 40.01 H new ATOM 0 HG2 GLU A 79 3.421 27.032 4.301 1.00 42.21 H new ATOM 0 HG3 GLU A 79 3.073 27.765 5.854 1.00 42.21 H new ATOM 1216 N ILE A 80 -0.503 24.878 6.186 1.00 32.24 N ATOM 1217 CA ILE A 80 -1.504 23.893 6.580 1.00 41.43 C ATOM 1218 C ILE A 80 -2.710 23.932 5.648 1.00 41.43 C ATOM 1219 O ILE A 80 -3.370 22.917 5.427 1.00 1.41 O ATOM 1220 CB ILE A 80 -1.980 24.121 8.027 1.00 42.35 C ATOM 1221 CG1 ILE A 80 -2.795 22.922 8.513 1.00 3.22 C ATOM 1222 CG2 ILE A 80 -2.798 25.399 8.119 1.00 33.54 C ATOM 1223 CD1 ILE A 80 -1.957 21.695 8.798 1.00 75.31 C ATOM 0 H ILE A 80 -0.222 25.515 6.931 1.00 32.24 H new ATOM 0 HA ILE A 80 -1.027 22.915 6.513 1.00 41.43 H new ATOM 0 HB ILE A 80 -1.106 24.226 8.670 1.00 42.35 H new ATOM 0 HG12 ILE A 80 -3.333 23.202 9.418 1.00 3.22 H new ATOM 0 HG13 ILE A 80 -3.544 22.674 7.761 1.00 3.22 H new ATOM 0 HG21 ILE A 80 -3.127 25.547 9.147 1.00 33.54 H new ATOM 0 HG22 ILE A 80 -2.186 26.246 7.809 1.00 33.54 H new ATOM 0 HG23 ILE A 80 -3.668 25.322 7.467 1.00 33.54 H new ATOM 0 HD11 ILE A 80 -2.602 20.885 9.138 1.00 75.31 H new ATOM 0 HD12 ILE A 80 -1.439 21.389 7.889 1.00 75.31 H new ATOM 0 HD13 ILE A 80 -1.225 21.926 9.572 1.00 75.31 H new ATOM 1235 N ASP A 81 -2.990 25.110 5.102 1.00 64.20 N ATOM 1236 CA ASP A 81 -4.116 25.282 4.191 1.00 62.42 C ATOM 1237 C ASP A 81 -3.838 24.609 2.851 1.00 42.22 C ATOM 1238 O ASP A 81 -4.696 23.920 2.300 1.00 74.51 O ATOM 1239 CB ASP A 81 -4.406 26.769 3.979 1.00 71.02 C ATOM 1240 CG ASP A 81 -5.711 27.006 3.244 1.00 41.33 C ATOM 1241 OD1 ASP A 81 -5.663 27.330 2.039 1.00 63.24 O ATOM 1242 OD2 ASP A 81 -6.780 26.865 3.873 1.00 41.13 O ATOM 0 H ASP A 81 -2.453 25.960 5.274 1.00 64.20 H new ATOM 0 HA ASP A 81 -4.990 24.810 4.640 1.00 62.42 H new ATOM 0 HB2 ASP A 81 -4.441 27.271 4.946 1.00 71.02 H new ATOM 0 HB3 ASP A 81 -3.588 27.219 3.416 1.00 71.02 H new ATOM 1247 N MET A 82 -2.631 24.814 2.330 1.00 31.54 N ATOM 1248 CA MET A 82 -2.241 24.227 1.054 1.00 72.23 C ATOM 1249 C MET A 82 -2.135 22.710 1.164 1.00 3.41 C ATOM 1250 O MET A 82 -2.403 21.989 0.202 1.00 41.33 O ATOM 1251 CB MET A 82 -0.904 24.810 0.588 1.00 35.35 C ATOM 1252 CG MET A 82 -0.732 24.801 -0.922 1.00 74.21 C ATOM 1253 SD MET A 82 0.738 25.699 -1.458 1.00 43.22 S ATOM 1254 CE MET A 82 0.145 26.446 -2.973 1.00 62.23 C ATOM 0 H MET A 82 -1.908 25.382 2.772 1.00 31.54 H new ATOM 0 HA MET A 82 -3.011 24.468 0.321 1.00 72.23 H new ATOM 0 HB2 MET A 82 -0.818 25.835 0.949 1.00 35.35 H new ATOM 0 HB3 MET A 82 -0.091 24.243 1.042 1.00 35.35 H new ATOM 0 HG2 MET A 82 -0.671 23.770 -1.271 1.00 74.21 H new ATOM 0 HG3 MET A 82 -1.613 25.243 -1.387 1.00 74.21 H new ATOM 0 HE1 MET A 82 0.557 27.451 -3.069 1.00 62.23 H new ATOM 0 HE2 MET A 82 0.460 25.842 -3.824 1.00 62.23 H new ATOM 0 HE3 MET A 82 -0.943 26.500 -2.950 1.00 62.23 H new ATOM 1264 N ALA A 83 -1.745 22.231 2.340 1.00 12.01 N ATOM 1265 CA ALA A 83 -1.607 20.799 2.575 1.00 41.55 C ATOM 1266 C ALA A 83 -2.959 20.098 2.506 1.00 60.03 C ATOM 1267 O ALA A 83 -3.160 19.195 1.693 1.00 63.42 O ATOM 1268 CB ALA A 83 -0.948 20.546 3.922 1.00 55.35 C ATOM 0 H ALA A 83 -1.519 22.814 3.146 1.00 12.01 H new ATOM 0 HA ALA A 83 -0.973 20.387 1.790 1.00 41.55 H new ATOM 0 HB1 ALA A 83 -0.852 19.472 4.084 1.00 55.35 H new ATOM 0 HB2 ALA A 83 0.040 21.005 3.935 1.00 55.35 H new ATOM 0 HB3 ALA A 83 -1.560 20.979 4.713 1.00 55.35 H new ATOM 1274 N ILE A 84 -3.883 20.518 3.364 1.00 74.23 N ATOM 1275 CA ILE A 84 -5.216 19.931 3.399 1.00 64.30 C ATOM 1276 C ILE A 84 -5.876 19.983 2.025 1.00 34.21 C ATOM 1277 O ILE A 84 -6.495 19.015 1.585 1.00 42.52 O ATOM 1278 CB ILE A 84 -6.120 20.648 4.418 1.00 1.24 C ATOM 1279 CG1 ILE A 84 -7.537 20.070 4.372 1.00 51.33 C ATOM 1280 CG2 ILE A 84 -6.145 22.145 4.145 1.00 43.23 C ATOM 1281 CD1 ILE A 84 -8.071 19.672 5.730 1.00 61.41 C ATOM 0 H ILE A 84 -3.732 21.263 4.044 1.00 74.23 H new ATOM 0 HA ILE A 84 -5.095 18.891 3.702 1.00 64.30 H new ATOM 0 HB ILE A 84 -5.714 20.487 5.417 1.00 1.24 H new ATOM 0 HG12 ILE A 84 -8.207 20.807 3.929 1.00 51.33 H new ATOM 0 HG13 ILE A 84 -7.544 19.198 3.718 1.00 51.33 H new ATOM 0 HG21 ILE A 84 -6.789 22.637 4.874 1.00 43.23 H new ATOM 0 HG22 ILE A 84 -5.135 22.546 4.224 1.00 43.23 H new ATOM 0 HG23 ILE A 84 -6.530 22.325 3.141 1.00 43.23 H new ATOM 0 HD11 ILE A 84 -9.079 19.271 5.621 1.00 61.41 H new ATOM 0 HD12 ILE A 84 -7.423 18.912 6.167 1.00 61.41 H new ATOM 0 HD13 ILE A 84 -8.096 20.546 6.381 1.00 61.41 H new ATOM 1293 N VAL A 85 -5.739 21.121 1.352 1.00 63.33 N ATOM 1294 CA VAL A 85 -6.319 21.299 0.026 1.00 22.53 C ATOM 1295 C VAL A 85 -5.674 20.361 -0.987 1.00 11.22 C ATOM 1296 O VAL A 85 -6.315 19.927 -1.944 1.00 2.43 O ATOM 1297 CB VAL A 85 -6.165 22.751 -0.464 1.00 53.03 C ATOM 1298 CG1 VAL A 85 -6.656 22.887 -1.896 1.00 64.22 C ATOM 1299 CG2 VAL A 85 -6.909 23.706 0.456 1.00 34.34 C ATOM 0 H VAL A 85 -5.232 21.933 1.703 1.00 63.33 H new ATOM 0 HA VAL A 85 -7.380 21.063 0.111 1.00 22.53 H new ATOM 0 HB VAL A 85 -5.107 23.012 -0.442 1.00 53.03 H new ATOM 0 HG11 VAL A 85 -6.539 23.920 -2.224 1.00 64.22 H new ATOM 0 HG12 VAL A 85 -6.074 22.232 -2.544 1.00 64.22 H new ATOM 0 HG13 VAL A 85 -7.708 22.607 -1.948 1.00 64.22 H new ATOM 0 HG21 VAL A 85 -6.789 24.727 0.094 1.00 34.34 H new ATOM 0 HG22 VAL A 85 -7.968 23.448 0.469 1.00 34.34 H new ATOM 0 HG23 VAL A 85 -6.504 23.629 1.465 1.00 34.34 H new ATOM 1309 N THR A 86 -4.400 20.051 -0.771 1.00 13.31 N ATOM 1310 CA THR A 86 -3.666 19.164 -1.665 1.00 74.41 C ATOM 1311 C THR A 86 -4.190 17.735 -1.574 1.00 71.15 C ATOM 1312 O THR A 86 -4.585 17.144 -2.580 1.00 12.42 O ATOM 1313 CB THR A 86 -2.159 19.167 -1.347 1.00 51.43 C ATOM 1314 OG1 THR A 86 -1.586 20.431 -1.703 1.00 1.42 O ATOM 1315 CG2 THR A 86 -1.445 18.051 -2.096 1.00 33.43 C ATOM 0 H THR A 86 -3.854 20.401 0.016 1.00 13.31 H new ATOM 0 HA THR A 86 -3.817 19.540 -2.677 1.00 74.41 H new ATOM 0 HB THR A 86 -2.035 19.001 -0.277 1.00 51.43 H new ATOM 0 HG1 THR A 86 -1.544 20.508 -2.679 1.00 1.42 H new ATOM 0 HG21 THR A 86 -0.382 18.073 -1.855 1.00 33.43 H new ATOM 0 HG22 THR A 86 -1.864 17.089 -1.801 1.00 33.43 H new ATOM 0 HG23 THR A 86 -1.577 18.190 -3.169 1.00 33.43 H new ATOM 1323 N LEU A 87 -4.193 17.187 -0.365 1.00 54.45 N ATOM 1324 CA LEU A 87 -4.669 15.826 -0.143 1.00 33.14 C ATOM 1325 C LEU A 87 -6.128 15.685 -0.564 1.00 70.44 C ATOM 1326 O LEU A 87 -6.572 14.604 -0.951 1.00 20.41 O ATOM 1327 CB LEU A 87 -4.512 15.444 1.330 1.00 32.45 C ATOM 1328 CG LEU A 87 -5.698 15.774 2.239 1.00 53.15 C ATOM 1329 CD1 LEU A 87 -6.674 14.608 2.287 1.00 74.41 C ATOM 1330 CD2 LEU A 87 -5.215 16.126 3.638 1.00 13.44 C ATOM 0 H LEU A 87 -3.871 17.664 0.477 1.00 54.45 H new ATOM 0 HA LEU A 87 -4.067 15.152 -0.753 1.00 33.14 H new ATOM 0 HB2 LEU A 87 -4.322 14.372 1.389 1.00 32.45 H new ATOM 0 HB3 LEU A 87 -3.628 15.946 1.723 1.00 32.45 H new ATOM 0 HG LEU A 87 -6.218 16.639 1.827 1.00 53.15 H new ATOM 0 HD11 LEU A 87 -7.511 14.861 2.938 1.00 74.41 H new ATOM 0 HD12 LEU A 87 -7.045 14.402 1.283 1.00 74.41 H new ATOM 0 HD13 LEU A 87 -6.167 13.725 2.675 1.00 74.41 H new ATOM 0 HD21 LEU A 87 -6.072 16.358 4.271 1.00 13.44 H new ATOM 0 HD22 LEU A 87 -4.671 15.280 4.059 1.00 13.44 H new ATOM 0 HD23 LEU A 87 -4.556 16.993 3.588 1.00 13.44 H new ATOM 1342 N LYS A 88 -6.870 16.785 -0.488 1.00 42.32 N ATOM 1343 CA LYS A 88 -8.278 16.786 -0.865 1.00 23.51 C ATOM 1344 C LYS A 88 -8.437 16.704 -2.380 1.00 54.33 C ATOM 1345 O LYS A 88 -8.947 15.716 -2.908 1.00 32.11 O ATOM 1346 CB LYS A 88 -8.967 18.047 -0.338 1.00 73.43 C ATOM 1347 CG LYS A 88 -10.031 17.766 0.710 1.00 64.32 C ATOM 1348 CD LYS A 88 -10.151 18.909 1.703 1.00 35.42 C ATOM 1349 CE LYS A 88 -11.335 18.713 2.638 1.00 62.43 C ATOM 1350 NZ LYS A 88 -11.126 19.391 3.947 1.00 40.31 N ATOM 0 H LYS A 88 -6.519 17.688 -0.168 1.00 42.32 H new ATOM 0 HA LYS A 88 -8.747 15.909 -0.420 1.00 23.51 H new ATOM 0 HB2 LYS A 88 -8.215 18.710 0.089 1.00 73.43 H new ATOM 0 HB3 LYS A 88 -9.423 18.578 -1.174 1.00 73.43 H new ATOM 0 HG2 LYS A 88 -10.992 17.606 0.221 1.00 64.32 H new ATOM 0 HG3 LYS A 88 -9.786 16.846 1.241 1.00 64.32 H new ATOM 0 HD2 LYS A 88 -9.233 18.983 2.287 1.00 35.42 H new ATOM 0 HD3 LYS A 88 -10.263 19.850 1.164 1.00 35.42 H new ATOM 0 HE2 LYS A 88 -12.238 19.102 2.167 1.00 62.43 H new ATOM 0 HE3 LYS A 88 -11.495 17.647 2.802 1.00 62.43 H new ATOM 0 HZ1 LYS A 88 -11.760 18.974 4.659 1.00 40.31 H new ATOM 0 HZ2 LYS A 88 -10.138 19.268 4.248 1.00 40.31 H new ATOM 0 HZ3 LYS A 88 -11.334 20.405 3.850 1.00 40.31 H new ATOM 1364 N VAL A 89 -7.994 17.747 -3.074 1.00 60.53 N ATOM 1365 CA VAL A 89 -8.084 17.792 -4.529 1.00 3.40 C ATOM 1366 C VAL A 89 -7.495 16.532 -5.155 1.00 32.01 C ATOM 1367 O VAL A 89 -8.046 15.985 -6.110 1.00 72.35 O ATOM 1368 CB VAL A 89 -7.356 19.024 -5.099 1.00 43.50 C ATOM 1369 CG1 VAL A 89 -7.497 19.074 -6.613 1.00 74.12 C ATOM 1370 CG2 VAL A 89 -7.887 20.298 -4.463 1.00 30.24 C ATOM 0 H VAL A 89 -7.569 18.573 -2.652 1.00 60.53 H new ATOM 0 HA VAL A 89 -9.143 17.858 -4.779 1.00 3.40 H new ATOM 0 HB VAL A 89 -6.296 18.941 -4.860 1.00 43.50 H new ATOM 0 HG11 VAL A 89 -6.977 19.951 -6.998 1.00 74.12 H new ATOM 0 HG12 VAL A 89 -7.063 18.174 -7.049 1.00 74.12 H new ATOM 0 HG13 VAL A 89 -8.553 19.133 -6.878 1.00 74.12 H new ATOM 0 HG21 VAL A 89 -7.361 21.158 -4.878 1.00 30.24 H new ATOM 0 HG22 VAL A 89 -8.953 20.391 -4.669 1.00 30.24 H new ATOM 0 HG23 VAL A 89 -7.728 20.260 -3.385 1.00 30.24 H new ATOM 1380 N PHE A 90 -6.373 16.076 -4.608 1.00 1.32 N ATOM 1381 CA PHE A 90 -5.709 14.880 -5.113 1.00 24.01 C ATOM 1382 C PHE A 90 -6.549 13.635 -4.841 1.00 2.22 C ATOM 1383 O PHE A 90 -6.588 12.710 -5.652 1.00 74.15 O ATOM 1384 CB PHE A 90 -4.329 14.727 -4.470 1.00 51.11 C ATOM 1385 CG PHE A 90 -3.598 13.489 -4.904 1.00 63.14 C ATOM 1386 CD1 PHE A 90 -2.733 13.523 -5.987 1.00 11.11 C ATOM 1387 CD2 PHE A 90 -3.777 12.291 -4.231 1.00 10.11 C ATOM 1388 CE1 PHE A 90 -2.059 12.385 -6.389 1.00 61.43 C ATOM 1389 CE2 PHE A 90 -3.105 11.151 -4.628 1.00 64.03 C ATOM 1390 CZ PHE A 90 -2.246 11.197 -5.709 1.00 24.54 C ATOM 0 H PHE A 90 -5.905 16.516 -3.816 1.00 1.32 H new ATOM 0 HA PHE A 90 -5.591 14.989 -6.191 1.00 24.01 H new ATOM 0 HB2 PHE A 90 -3.724 15.600 -4.715 1.00 51.11 H new ATOM 0 HB3 PHE A 90 -4.442 14.711 -3.386 1.00 51.11 H new ATOM 0 HD1 PHE A 90 -2.584 14.449 -6.523 1.00 11.11 H new ATOM 0 HD2 PHE A 90 -4.449 12.248 -3.387 1.00 10.11 H new ATOM 0 HE1 PHE A 90 -1.387 12.425 -7.234 1.00 61.43 H new ATOM 0 HE2 PHE A 90 -3.251 10.224 -4.093 1.00 64.03 H new ATOM 0 HZ PHE A 90 -1.722 10.306 -6.022 1.00 24.54 H new ATOM 1400 N ALA A 91 -7.219 13.620 -3.694 1.00 22.30 N ATOM 1401 CA ALA A 91 -8.060 12.491 -3.315 1.00 45.14 C ATOM 1402 C ALA A 91 -9.192 12.289 -4.317 1.00 34.55 C ATOM 1403 O ALA A 91 -9.448 11.171 -4.763 1.00 41.10 O ATOM 1404 CB ALA A 91 -8.621 12.697 -1.916 1.00 23.42 C ATOM 0 H ALA A 91 -7.196 14.377 -3.011 1.00 22.30 H new ATOM 0 HA ALA A 91 -7.443 11.593 -3.318 1.00 45.14 H new ATOM 0 HB1 ALA A 91 -9.247 11.846 -1.646 1.00 23.42 H new ATOM 0 HB2 ALA A 91 -7.800 12.784 -1.204 1.00 23.42 H new ATOM 0 HB3 ALA A 91 -9.218 13.609 -1.894 1.00 23.42 H new ATOM 1410 N VAL A 92 -9.869 13.378 -4.666 1.00 72.53 N ATOM 1411 CA VAL A 92 -10.974 13.321 -5.616 1.00 34.32 C ATOM 1412 C VAL A 92 -10.463 13.223 -7.049 1.00 71.04 C ATOM 1413 O VAL A 92 -11.035 12.514 -7.875 1.00 42.14 O ATOM 1414 CB VAL A 92 -11.887 14.555 -5.491 1.00 74.33 C ATOM 1415 CG1 VAL A 92 -11.100 15.830 -5.758 1.00 31.22 C ATOM 1416 CG2 VAL A 92 -13.070 14.441 -6.438 1.00 3.24 C ATOM 0 H VAL A 92 -9.672 14.311 -4.305 1.00 72.53 H new ATOM 0 HA VAL A 92 -11.550 12.427 -5.377 1.00 34.32 H new ATOM 0 HB VAL A 92 -12.271 14.600 -4.472 1.00 74.33 H new ATOM 0 HG11 VAL A 92 -11.761 16.692 -5.665 1.00 31.22 H new ATOM 0 HG12 VAL A 92 -10.289 15.915 -5.035 1.00 31.22 H new ATOM 0 HG13 VAL A 92 -10.685 15.797 -6.766 1.00 31.22 H new ATOM 0 HG21 VAL A 92 -13.704 15.322 -6.336 1.00 3.24 H new ATOM 0 HG22 VAL A 92 -12.709 14.371 -7.464 1.00 3.24 H new ATOM 0 HG23 VAL A 92 -13.647 13.549 -6.194 1.00 3.24 H new ATOM 1426 N ALA A 93 -9.381 13.941 -7.335 1.00 74.24 N ATOM 1427 CA ALA A 93 -8.791 13.934 -8.668 1.00 52.11 C ATOM 1428 C ALA A 93 -8.015 12.645 -8.918 1.00 21.12 C ATOM 1429 O ALA A 93 -7.552 12.393 -10.029 1.00 33.01 O ATOM 1430 CB ALA A 93 -7.884 15.142 -8.850 1.00 61.03 C ATOM 0 H ALA A 93 -8.896 14.534 -6.662 1.00 74.24 H new ATOM 0 HA ALA A 93 -9.600 13.988 -9.397 1.00 52.11 H new ATOM 0 HB1 ALA A 93 -7.450 15.124 -9.850 1.00 61.03 H new ATOM 0 HB2 ALA A 93 -8.465 16.056 -8.723 1.00 61.03 H new ATOM 0 HB3 ALA A 93 -7.086 15.113 -8.108 1.00 61.03 H new ATOM 1436 N GLY A 94 -7.876 11.832 -7.875 1.00 2.41 N ATOM 1437 CA GLY A 94 -7.154 10.579 -8.002 1.00 63.30 C ATOM 1438 C GLY A 94 -8.041 9.373 -7.765 1.00 54.22 C ATOM 1439 O GLY A 94 -8.387 8.653 -8.702 1.00 61.41 O ATOM 0 H GLY A 94 -8.250 12.019 -6.945 1.00 2.41 H new ATOM 0 HA2 GLY A 94 -6.717 10.514 -8.998 1.00 63.30 H new ATOM 0 HA3 GLY A 94 -6.329 10.565 -7.290 1.00 63.30 H new ATOM 1443 N LEU A 95 -8.409 9.149 -6.507 1.00 42.14 N ATOM 1444 CA LEU A 95 -9.260 8.020 -6.149 1.00 53.23 C ATOM 1445 C LEU A 95 -10.614 8.117 -6.843 1.00 3.44 C ATOM 1446 O LEU A 95 -11.279 7.105 -7.075 1.00 14.41 O ATOM 1447 CB LEU A 95 -9.454 7.964 -4.632 1.00 64.24 C ATOM 1448 CG LEU A 95 -8.249 7.493 -3.818 1.00 0.22 C ATOM 1449 CD1 LEU A 95 -7.712 6.181 -4.369 1.00 43.41 C ATOM 1450 CD2 LEU A 95 -7.160 8.556 -3.811 1.00 44.24 C ATOM 0 H LEU A 95 -8.131 9.734 -5.719 1.00 42.14 H new ATOM 0 HA LEU A 95 -8.768 7.106 -6.481 1.00 53.23 H new ATOM 0 HB2 LEU A 95 -9.735 8.958 -4.285 1.00 64.24 H new ATOM 0 HB3 LEU A 95 -10.293 7.302 -4.417 1.00 64.24 H new ATOM 0 HG LEU A 95 -8.573 7.327 -2.790 1.00 0.22 H new ATOM 0 HD11 LEU A 95 -6.854 5.861 -3.777 1.00 43.41 H new ATOM 0 HD12 LEU A 95 -8.491 5.420 -4.320 1.00 43.41 H new ATOM 0 HD13 LEU A 95 -7.405 6.320 -5.406 1.00 43.41 H new ATOM 0 HD21 LEU A 95 -6.310 8.203 -3.227 1.00 44.24 H new ATOM 0 HD22 LEU A 95 -6.839 8.755 -4.834 1.00 44.24 H new ATOM 0 HD23 LEU A 95 -7.549 9.473 -3.368 1.00 44.24 H new ATOM 1462 N LEU A 96 -11.017 9.338 -7.177 1.00 40.41 N ATOM 1463 CA LEU A 96 -12.291 9.567 -7.848 1.00 1.45 C ATOM 1464 C LEU A 96 -12.076 9.964 -9.305 1.00 14.04 C ATOM 1465 O LEU A 96 -13.029 10.081 -10.073 1.00 65.32 O ATOM 1466 CB LEU A 96 -13.084 10.654 -7.122 1.00 34.41 C ATOM 1467 CG LEU A 96 -14.516 10.290 -6.725 1.00 73.45 C ATOM 1468 CD1 LEU A 96 -15.143 11.408 -5.907 1.00 42.01 C ATOM 1469 CD2 LEU A 96 -15.353 9.996 -7.961 1.00 20.43 C ATOM 0 H LEU A 96 -10.479 10.185 -6.994 1.00 40.41 H new ATOM 0 HA LEU A 96 -12.858 8.636 -7.825 1.00 1.45 H new ATOM 0 HB2 LEU A 96 -12.538 10.933 -6.221 1.00 34.41 H new ATOM 0 HB3 LEU A 96 -13.119 11.537 -7.760 1.00 34.41 H new ATOM 0 HG LEU A 96 -14.485 9.391 -6.109 1.00 73.45 H new ATOM 0 HD11 LEU A 96 -16.161 11.132 -5.634 1.00 42.01 H new ATOM 0 HD12 LEU A 96 -14.556 11.571 -5.003 1.00 42.01 H new ATOM 0 HD13 LEU A 96 -15.162 12.324 -6.497 1.00 42.01 H new ATOM 0 HD21 LEU A 96 -16.369 9.739 -7.660 1.00 20.43 H new ATOM 0 HD22 LEU A 96 -15.377 10.877 -8.602 1.00 20.43 H new ATOM 0 HD23 LEU A 96 -14.914 9.161 -8.507 1.00 20.43 H new ATOM 1481 N ASN A 97 -10.817 10.167 -9.677 1.00 73.51 N ATOM 1482 CA ASN A 97 -10.476 10.550 -11.042 1.00 41.25 C ATOM 1483 C ASN A 97 -11.320 11.735 -11.502 1.00 20.25 C ATOM 1484 O ASN A 97 -11.637 11.862 -12.684 1.00 63.32 O ATOM 1485 CB ASN A 97 -10.678 9.367 -11.991 1.00 0.51 C ATOM 1486 CG ASN A 97 -9.677 8.254 -11.749 1.00 54.35 C ATOM 1487 OD1 ASN A 97 -9.974 7.276 -11.061 1.00 51.10 O ATOM 1488 ND2 ASN A 97 -8.483 8.398 -12.312 1.00 23.12 N ATOM 0 H ASN A 97 -10.016 10.073 -9.053 1.00 73.51 H new ATOM 0 HA ASN A 97 -9.427 10.846 -11.058 1.00 41.25 H new ATOM 0 HB2 ASN A 97 -11.688 8.976 -11.870 1.00 0.51 H new ATOM 0 HB3 ASN A 97 -10.591 9.712 -13.021 1.00 0.51 H new ATOM 0 HD21 ASN A 97 -7.768 7.682 -12.182 1.00 23.12 H new ATOM 0 HD22 ASN A 97 -8.281 9.225 -12.874 1.00 23.12 H new ATOM 1495 N MET A 98 -11.680 12.598 -10.559 1.00 33.52 N ATOM 1496 CA MET A 98 -12.486 13.774 -10.867 1.00 24.53 C ATOM 1497 C MET A 98 -11.610 15.018 -10.988 1.00 21.25 C ATOM 1498 O MET A 98 -11.162 15.574 -9.985 1.00 1.14 O ATOM 1499 CB MET A 98 -13.550 13.988 -9.789 1.00 52.33 C ATOM 1500 CG MET A 98 -14.904 14.397 -10.343 1.00 35.14 C ATOM 1501 SD MET A 98 -15.944 12.982 -10.753 1.00 13.31 S ATOM 1502 CE MET A 98 -17.350 13.800 -11.503 1.00 73.14 C ATOM 0 H MET A 98 -11.427 12.506 -9.575 1.00 33.52 H new ATOM 0 HA MET A 98 -12.979 13.604 -11.824 1.00 24.53 H new ATOM 0 HB2 MET A 98 -13.664 13.068 -9.216 1.00 52.33 H new ATOM 0 HB3 MET A 98 -13.204 14.755 -9.096 1.00 52.33 H new ATOM 0 HG2 MET A 98 -15.418 15.021 -9.612 1.00 35.14 H new ATOM 0 HG3 MET A 98 -14.758 15.006 -11.235 1.00 35.14 H new ATOM 0 HE1 MET A 98 -18.083 13.054 -11.810 1.00 73.14 H new ATOM 0 HE2 MET A 98 -17.803 14.479 -10.781 1.00 73.14 H new ATOM 0 HE3 MET A 98 -17.020 14.365 -12.375 1.00 73.14 H new ATOM 1512 N THR A 99 -11.370 15.449 -12.222 1.00 25.11 N ATOM 1513 CA THR A 99 -10.548 16.625 -12.475 1.00 54.54 C ATOM 1514 C THR A 99 -11.225 17.890 -11.959 1.00 50.24 C ATOM 1515 O THR A 99 -11.961 18.554 -12.689 1.00 0.34 O ATOM 1516 CB THR A 99 -10.249 16.792 -13.977 1.00 13.21 C ATOM 1517 OG1 THR A 99 -9.933 15.521 -14.556 1.00 3.13 O ATOM 1518 CG2 THR A 99 -9.093 17.756 -14.195 1.00 53.12 C ATOM 0 H THR A 99 -11.734 15.000 -13.063 1.00 25.11 H new ATOM 0 HA THR A 99 -9.610 16.474 -11.941 1.00 54.54 H new ATOM 0 HB THR A 99 -11.137 17.201 -14.459 1.00 13.21 H new ATOM 0 HG1 THR A 99 -9.746 15.634 -15.511 1.00 3.13 H new ATOM 0 HG21 THR A 99 -8.901 17.858 -15.263 1.00 53.12 H new ATOM 0 HG22 THR A 99 -9.348 18.730 -13.778 1.00 53.12 H new ATOM 0 HG23 THR A 99 -8.201 17.372 -13.701 1.00 53.12 H new ATOM 1526 N VAL A 100 -10.969 18.221 -10.697 1.00 24.22 N ATOM 1527 CA VAL A 100 -11.553 19.408 -10.084 1.00 64.23 C ATOM 1528 C VAL A 100 -11.115 20.674 -10.813 1.00 54.31 C ATOM 1529 O VAL A 100 -10.034 20.722 -11.399 1.00 45.45 O ATOM 1530 CB VAL A 100 -11.164 19.522 -8.599 1.00 34.10 C ATOM 1531 CG1 VAL A 100 -11.953 20.633 -7.924 1.00 34.31 C ATOM 1532 CG2 VAL A 100 -11.380 18.195 -7.888 1.00 13.13 C ATOM 0 H VAL A 100 -10.361 17.683 -10.079 1.00 24.22 H new ATOM 0 HA VAL A 100 -12.635 19.304 -10.160 1.00 64.23 H new ATOM 0 HB VAL A 100 -10.105 19.772 -8.537 1.00 34.10 H new ATOM 0 HG11 VAL A 100 -11.665 20.698 -6.875 1.00 34.31 H new ATOM 0 HG12 VAL A 100 -11.742 21.581 -8.418 1.00 34.31 H new ATOM 0 HG13 VAL A 100 -13.019 20.417 -7.994 1.00 34.31 H new ATOM 0 HG21 VAL A 100 -11.100 18.294 -6.839 1.00 13.13 H new ATOM 0 HG22 VAL A 100 -12.430 17.912 -7.958 1.00 13.13 H new ATOM 0 HG23 VAL A 100 -10.765 17.427 -8.357 1.00 13.13 H new ATOM 1542 N SER A 101 -11.961 21.698 -10.770 1.00 53.04 N ATOM 1543 CA SER A 101 -11.662 22.964 -11.428 1.00 22.41 C ATOM 1544 C SER A 101 -10.618 23.752 -10.643 1.00 2.14 C ATOM 1545 O SER A 101 -9.555 24.088 -11.164 1.00 73.04 O ATOM 1546 CB SER A 101 -12.936 23.796 -11.582 1.00 21.30 C ATOM 1547 OG SER A 101 -13.738 23.311 -12.645 1.00 45.24 O ATOM 0 H SER A 101 -12.859 21.676 -10.286 1.00 53.04 H new ATOM 0 HA SER A 101 -11.258 22.745 -12.416 1.00 22.41 H new ATOM 0 HB2 SER A 101 -13.505 23.771 -10.653 1.00 21.30 H new ATOM 0 HB3 SER A 101 -12.673 24.838 -11.767 1.00 21.30 H new ATOM 0 HG SER A 101 -14.547 23.859 -12.721 1.00 45.24 H new ATOM 1553 N THR A 102 -10.930 24.044 -9.383 1.00 20.22 N ATOM 1554 CA THR A 102 -10.021 24.792 -8.525 1.00 33.32 C ATOM 1555 C THR A 102 -9.826 24.090 -7.186 1.00 42.15 C ATOM 1556 O THR A 102 -10.692 23.342 -6.734 1.00 44.21 O ATOM 1557 CB THR A 102 -10.538 26.221 -8.271 1.00 72.03 C ATOM 1558 OG1 THR A 102 -11.631 26.190 -7.346 1.00 20.04 O ATOM 1559 CG2 THR A 102 -10.986 26.874 -9.570 1.00 55.23 C ATOM 0 H THR A 102 -11.806 23.773 -8.935 1.00 20.22 H new ATOM 0 HA THR A 102 -9.066 24.845 -9.047 1.00 33.32 H new ATOM 0 HB THR A 102 -9.722 26.808 -7.850 1.00 72.03 H new ATOM 0 HG1 THR A 102 -11.952 27.102 -7.189 1.00 20.04 H new ATOM 0 HG21 THR A 102 -11.347 27.882 -9.365 1.00 55.23 H new ATOM 0 HG22 THR A 102 -10.145 26.923 -10.261 1.00 55.23 H new ATOM 0 HG23 THR A 102 -11.788 26.285 -10.016 1.00 55.23 H new ATOM 1567 N ALA A 103 -8.681 24.337 -6.556 1.00 4.45 N ATOM 1568 CA ALA A 103 -8.373 23.729 -5.267 1.00 64.10 C ATOM 1569 C ALA A 103 -9.510 23.944 -4.274 1.00 11.34 C ATOM 1570 O ALA A 103 -9.866 23.039 -3.519 1.00 13.41 O ATOM 1571 CB ALA A 103 -7.073 24.295 -4.715 1.00 22.34 C ATOM 0 H ALA A 103 -7.953 24.953 -6.917 1.00 4.45 H new ATOM 0 HA ALA A 103 -8.255 22.656 -5.417 1.00 64.10 H new ATOM 0 HB1 ALA A 103 -6.855 23.833 -3.752 1.00 22.34 H new ATOM 0 HB2 ALA A 103 -6.261 24.086 -5.411 1.00 22.34 H new ATOM 0 HB3 ALA A 103 -7.171 25.373 -4.586 1.00 22.34 H new ATOM 1577 N ALA A 104 -10.076 25.146 -4.279 1.00 14.13 N ATOM 1578 CA ALA A 104 -11.173 25.478 -3.378 1.00 4.43 C ATOM 1579 C ALA A 104 -12.411 24.645 -3.692 1.00 3.13 C ATOM 1580 O ALA A 104 -13.122 24.206 -2.787 1.00 65.42 O ATOM 1581 CB ALA A 104 -11.498 26.962 -3.466 1.00 41.20 C ATOM 0 H ALA A 104 -9.793 25.906 -4.897 1.00 14.13 H new ATOM 0 HA ALA A 104 -10.858 25.246 -2.361 1.00 4.43 H new ATOM 0 HB1 ALA A 104 -12.319 27.196 -2.788 1.00 41.20 H new ATOM 0 HB2 ALA A 104 -10.620 27.544 -3.187 1.00 41.20 H new ATOM 0 HB3 ALA A 104 -11.788 27.211 -4.487 1.00 41.20 H new ATOM 1587 N ALA A 105 -12.664 24.429 -4.979 1.00 42.20 N ATOM 1588 CA ALA A 105 -13.816 23.648 -5.411 1.00 13.43 C ATOM 1589 C ALA A 105 -13.770 22.237 -4.833 1.00 12.21 C ATOM 1590 O ALA A 105 -14.789 21.702 -4.397 1.00 13.31 O ATOM 1591 CB ALA A 105 -13.879 23.595 -6.930 1.00 22.02 C ATOM 0 H ALA A 105 -12.086 24.784 -5.741 1.00 42.20 H new ATOM 0 HA ALA A 105 -14.716 24.137 -5.038 1.00 13.43 H new ATOM 0 HB1 ALA A 105 -14.744 23.008 -7.238 1.00 22.02 H new ATOM 0 HB2 ALA A 105 -13.967 24.607 -7.326 1.00 22.02 H new ATOM 0 HB3 ALA A 105 -12.971 23.132 -7.316 1.00 22.02 H new ATOM 1597 N ALA A 106 -12.583 21.641 -4.834 1.00 41.31 N ATOM 1598 CA ALA A 106 -12.404 20.293 -4.308 1.00 13.14 C ATOM 1599 C ALA A 106 -12.676 20.248 -2.808 1.00 53.20 C ATOM 1600 O ALA A 106 -13.461 19.427 -2.335 1.00 15.21 O ATOM 1601 CB ALA A 106 -10.999 19.791 -4.608 1.00 34.23 C ATOM 0 H ALA A 106 -11.730 22.070 -5.193 1.00 41.31 H new ATOM 0 HA ALA A 106 -13.124 19.639 -4.800 1.00 13.14 H new ATOM 0 HB1 ALA A 106 -10.880 18.784 -4.209 1.00 34.23 H new ATOM 0 HB2 ALA A 106 -10.841 19.776 -5.686 1.00 34.23 H new ATOM 0 HB3 ALA A 106 -10.269 20.454 -4.143 1.00 34.23 H new ATOM 1607 N GLU A 107 -12.020 21.136 -2.066 1.00 2.03 N ATOM 1608 CA GLU A 107 -12.191 21.195 -0.619 1.00 52.53 C ATOM 1609 C GLU A 107 -13.661 21.374 -0.252 1.00 12.23 C ATOM 1610 O GLU A 107 -14.173 20.703 0.644 1.00 24.42 O ATOM 1611 CB GLU A 107 -11.364 22.340 -0.033 1.00 71.40 C ATOM 1612 CG GLU A 107 -11.191 22.257 1.474 1.00 53.20 C ATOM 1613 CD GLU A 107 -11.797 23.444 2.198 1.00 4.12 C ATOM 1614 OE1 GLU A 107 -11.217 24.547 2.117 1.00 50.11 O ATOM 1615 OE2 GLU A 107 -12.850 23.270 2.845 1.00 14.02 O ATOM 0 H GLU A 107 -11.367 21.823 -2.443 1.00 2.03 H new ATOM 0 HA GLU A 107 -11.842 20.252 -0.198 1.00 52.53 H new ATOM 0 HB2 GLU A 107 -10.381 22.344 -0.503 1.00 71.40 H new ATOM 0 HB3 GLU A 107 -11.842 23.287 -0.284 1.00 71.40 H new ATOM 0 HG2 GLU A 107 -11.653 21.340 1.839 1.00 53.20 H new ATOM 0 HG3 GLU A 107 -10.129 22.195 1.711 1.00 53.20 H new ATOM 1622 N ASN A 108 -14.333 22.284 -0.949 1.00 41.22 N ATOM 1623 CA ASN A 108 -15.743 22.553 -0.696 1.00 25.50 C ATOM 1624 C ASN A 108 -16.586 21.301 -0.925 1.00 74.13 C ATOM 1625 O ASN A 108 -17.499 21.007 -0.156 1.00 1.34 O ATOM 1626 CB ASN A 108 -16.238 23.686 -1.597 1.00 43.14 C ATOM 1627 CG ASN A 108 -17.235 24.589 -0.897 1.00 42.31 C ATOM 1628 OD1 ASN A 108 -17.247 24.684 0.330 1.00 12.21 O ATOM 1629 ND2 ASN A 108 -18.076 25.257 -1.677 1.00 32.05 N ATOM 0 H ASN A 108 -13.923 22.848 -1.694 1.00 41.22 H new ATOM 0 HA ASN A 108 -15.848 22.855 0.346 1.00 25.50 H new ATOM 0 HB2 ASN A 108 -15.387 24.279 -1.931 1.00 43.14 H new ATOM 0 HB3 ASN A 108 -16.700 23.262 -2.489 1.00 43.14 H new ATOM 0 HD21 ASN A 108 -18.769 25.881 -1.263 1.00 32.05 H new ATOM 0 HD22 ASN A 108 -18.029 25.147 -2.690 1.00 32.05 H new ATOM 1636 N MET A 109 -16.270 20.568 -1.988 1.00 71.44 N ATOM 1637 CA MET A 109 -16.995 19.348 -2.317 1.00 24.23 C ATOM 1638 C MET A 109 -16.711 18.252 -1.294 1.00 71.34 C ATOM 1639 O MET A 109 -17.624 17.566 -0.835 1.00 55.03 O ATOM 1640 CB MET A 109 -16.615 18.865 -3.719 1.00 13.03 C ATOM 1641 CG MET A 109 -17.698 18.036 -4.390 1.00 45.11 C ATOM 1642 SD MET A 109 -17.026 16.691 -5.385 1.00 5.54 S ATOM 1643 CE MET A 109 -17.292 15.296 -4.294 1.00 12.31 C ATOM 0 H MET A 109 -15.516 20.799 -2.636 1.00 71.44 H new ATOM 0 HA MET A 109 -18.061 19.573 -2.295 1.00 24.23 H new ATOM 0 HB2 MET A 109 -16.391 19.729 -4.344 1.00 13.03 H new ATOM 0 HB3 MET A 109 -15.702 18.273 -3.655 1.00 13.03 H new ATOM 0 HG2 MET A 109 -18.359 17.624 -3.628 1.00 45.11 H new ATOM 0 HG3 MET A 109 -18.305 18.683 -5.023 1.00 45.11 H new ATOM 0 HE1 MET A 109 -16.586 14.502 -4.540 1.00 12.31 H new ATOM 0 HE2 MET A 109 -17.142 15.608 -3.261 1.00 12.31 H new ATOM 0 HE3 MET A 109 -18.310 14.927 -4.417 1.00 12.31 H new ATOM 1653 N TYR A 110 -15.439 18.095 -0.942 1.00 44.31 N ATOM 1654 CA TYR A 110 -15.034 17.081 0.024 1.00 12.41 C ATOM 1655 C TYR A 110 -15.849 17.196 1.309 1.00 65.24 C ATOM 1656 O TYR A 110 -16.293 16.193 1.867 1.00 71.53 O ATOM 1657 CB TYR A 110 -13.543 17.214 0.339 1.00 40.05 C ATOM 1658 CG TYR A 110 -12.866 15.894 0.633 1.00 71.11 C ATOM 1659 CD1 TYR A 110 -12.911 15.336 1.905 1.00 55.05 C ATOM 1660 CD2 TYR A 110 -12.182 15.204 -0.360 1.00 71.53 C ATOM 1661 CE1 TYR A 110 -12.293 14.132 2.179 1.00 22.13 C ATOM 1662 CE2 TYR A 110 -11.563 13.999 -0.096 1.00 2.01 C ATOM 1663 CZ TYR A 110 -11.621 13.466 1.174 1.00 54.12 C ATOM 1664 OH TYR A 110 -11.005 12.266 1.442 1.00 4.52 O ATOM 0 H TYR A 110 -14.672 18.657 -1.311 1.00 44.31 H new ATOM 0 HA TYR A 110 -15.220 16.101 -0.416 1.00 12.41 H new ATOM 0 HB2 TYR A 110 -13.043 17.689 -0.505 1.00 40.05 H new ATOM 0 HB3 TYR A 110 -13.419 17.875 1.197 1.00 40.05 H new ATOM 0 HD1 TYR A 110 -13.439 15.853 2.693 1.00 55.05 H new ATOM 0 HD2 TYR A 110 -12.134 15.618 -1.356 1.00 71.53 H new ATOM 0 HE1 TYR A 110 -12.335 13.714 3.174 1.00 22.13 H new ATOM 0 HE2 TYR A 110 -11.036 13.476 -0.880 1.00 2.01 H new ATOM 0 HH TYR A 110 -10.578 11.928 0.627 1.00 4.52 H new ATOM 1674 N SER A 111 -16.041 18.428 1.771 1.00 24.42 N ATOM 1675 CA SER A 111 -16.800 18.676 2.991 1.00 53.23 C ATOM 1676 C SER A 111 -18.298 18.707 2.703 1.00 3.51 C ATOM 1677 O SER A 111 -19.111 18.342 3.551 1.00 22.01 O ATOM 1678 CB SER A 111 -16.364 19.997 3.628 1.00 65.44 C ATOM 1679 OG SER A 111 -16.993 21.099 2.996 1.00 40.24 O ATOM 0 H SER A 111 -15.682 19.269 1.319 1.00 24.42 H new ATOM 0 HA SER A 111 -16.599 17.861 3.686 1.00 53.23 H new ATOM 0 HB2 SER A 111 -16.612 19.992 4.689 1.00 65.44 H new ATOM 0 HB3 SER A 111 -15.281 20.100 3.554 1.00 65.44 H new ATOM 0 HG SER A 111 -16.700 21.931 3.422 1.00 40.24 H new ATOM 1685 N GLN A 112 -18.654 19.145 1.500 1.00 41.24 N ATOM 1686 CA GLN A 112 -20.053 19.224 1.099 1.00 71.40 C ATOM 1687 C GLN A 112 -20.685 17.837 1.050 1.00 51.33 C ATOM 1688 O GLN A 112 -21.850 17.663 1.405 1.00 14.53 O ATOM 1689 CB GLN A 112 -20.177 19.903 -0.267 1.00 4.23 C ATOM 1690 CG GLN A 112 -21.603 19.957 -0.792 1.00 40.43 C ATOM 1691 CD GLN A 112 -21.761 19.256 -2.127 1.00 13.42 C ATOM 1692 OE1 GLN A 112 -22.507 18.284 -2.245 1.00 24.14 O ATOM 1693 NE2 GLN A 112 -21.058 19.746 -3.140 1.00 40.34 N ATOM 0 H GLN A 112 -17.993 19.451 0.786 1.00 41.24 H new ATOM 0 HA GLN A 112 -20.584 19.819 1.842 1.00 71.40 H new ATOM 0 HB2 GLN A 112 -19.786 20.918 -0.196 1.00 4.23 H new ATOM 0 HB3 GLN A 112 -19.554 19.371 -0.986 1.00 4.23 H new ATOM 0 HG2 GLN A 112 -22.272 19.498 -0.064 1.00 40.43 H new ATOM 0 HG3 GLN A 112 -21.909 20.998 -0.894 1.00 40.43 H new ATOM 0 HE21 GLN A 112 -20.452 20.554 -2.997 1.00 40.34 H new ATOM 0 HE22 GLN A 112 -21.124 19.315 -4.062 1.00 40.34 H new ATOM 1702 N MET A 113 -19.909 16.853 0.607 1.00 73.34 N ATOM 1703 CA MET A 113 -20.393 15.482 0.513 1.00 4.31 C ATOM 1704 C MET A 113 -20.433 14.824 1.888 1.00 11.53 C ATOM 1705 O MET A 113 -21.003 13.746 2.055 1.00 11.13 O ATOM 1706 CB MET A 113 -19.503 14.668 -0.430 1.00 14.13 C ATOM 1707 CG MET A 113 -20.224 14.178 -1.675 1.00 73.12 C ATOM 1708 SD MET A 113 -20.500 12.396 -1.662 1.00 34.54 S ATOM 1709 CE MET A 113 -19.324 11.862 -2.901 1.00 73.24 C ATOM 0 H MET A 113 -18.942 16.980 0.308 1.00 73.34 H new ATOM 0 HA MET A 113 -21.407 15.507 0.113 1.00 4.31 H new ATOM 0 HB2 MET A 113 -18.652 15.279 -0.730 1.00 14.13 H new ATOM 0 HB3 MET A 113 -19.105 13.809 0.111 1.00 14.13 H new ATOM 0 HG2 MET A 113 -21.183 14.690 -1.760 1.00 73.12 H new ATOM 0 HG3 MET A 113 -19.641 14.445 -2.556 1.00 73.12 H new ATOM 0 HE1 MET A 113 -19.375 10.778 -3.008 1.00 73.24 H new ATOM 0 HE2 MET A 113 -19.562 12.333 -3.855 1.00 73.24 H new ATOM 0 HE3 MET A 113 -18.318 12.149 -2.595 1.00 73.24 H new ATOM 1719 N GLY A 114 -19.822 15.479 2.871 1.00 4.25 N ATOM 1720 CA GLY A 114 -19.800 14.941 4.219 1.00 33.10 C ATOM 1721 C GLY A 114 -18.593 14.060 4.472 1.00 74.42 C ATOM 1722 O GLY A 114 -18.584 13.260 5.409 1.00 21.11 O ATOM 0 H GLY A 114 -19.342 16.372 2.758 1.00 4.25 H new ATOM 0 HA2 GLY A 114 -19.802 15.763 4.935 1.00 33.10 H new ATOM 0 HA3 GLY A 114 -20.709 14.365 4.392 1.00 33.10 H new ATOM 1726 N LEU A 115 -17.571 14.205 3.636 1.00 63.52 N ATOM 1727 CA LEU A 115 -16.352 13.414 3.772 1.00 31.54 C ATOM 1728 C LEU A 115 -15.384 14.071 4.750 1.00 52.15 C ATOM 1729 O LEU A 115 -14.654 13.389 5.468 1.00 53.42 O ATOM 1730 CB LEU A 115 -15.679 13.240 2.410 1.00 22.31 C ATOM 1731 CG LEU A 115 -16.594 12.822 1.258 1.00 21.34 C ATOM 1732 CD1 LEU A 115 -16.448 13.780 0.085 1.00 33.51 C ATOM 1733 CD2 LEU A 115 -16.288 11.396 0.824 1.00 51.21 C ATOM 0 H LEU A 115 -17.562 14.863 2.857 1.00 63.52 H new ATOM 0 HA LEU A 115 -16.626 12.434 4.163 1.00 31.54 H new ATOM 0 HB2 LEU A 115 -15.197 14.180 2.142 1.00 22.31 H new ATOM 0 HB3 LEU A 115 -14.890 12.495 2.510 1.00 22.31 H new ATOM 0 HG LEU A 115 -17.626 12.861 1.607 1.00 21.34 H new ATOM 0 HD11 LEU A 115 -17.107 13.466 -0.725 1.00 33.51 H new ATOM 0 HD12 LEU A 115 -16.717 14.787 0.402 1.00 33.51 H new ATOM 0 HD13 LEU A 115 -15.415 13.773 -0.264 1.00 33.51 H new ATOM 0 HD21 LEU A 115 -16.949 11.116 0.004 1.00 51.21 H new ATOM 0 HD22 LEU A 115 -15.251 11.331 0.494 1.00 51.21 H new ATOM 0 HD23 LEU A 115 -16.445 10.719 1.664 1.00 51.21 H new ATOM 1745 N ASP A 116 -15.384 15.400 4.773 1.00 23.33 N ATOM 1746 CA ASP A 116 -14.508 16.150 5.666 1.00 1.22 C ATOM 1747 C ASP A 116 -14.766 15.775 7.122 1.00 20.23 C ATOM 1748 O ASP A 116 -13.894 15.228 7.798 1.00 63.11 O ATOM 1749 CB ASP A 116 -14.710 17.653 5.470 1.00 4.52 C ATOM 1750 CG ASP A 116 -13.928 18.478 6.472 1.00 30.05 C ATOM 1751 OD1 ASP A 116 -12.933 19.116 6.068 1.00 14.42 O ATOM 1752 OD2 ASP A 116 -14.310 18.486 7.660 1.00 30.25 O ATOM 0 H ASP A 116 -15.981 15.980 4.183 1.00 23.33 H new ATOM 0 HA ASP A 116 -13.477 15.895 5.421 1.00 1.22 H new ATOM 0 HB2 ASP A 116 -14.406 17.929 4.460 1.00 4.52 H new ATOM 0 HB3 ASP A 116 -15.771 17.889 5.559 1.00 4.52 H new ATOM 1757 N THR A 117 -15.970 16.073 7.600 1.00 22.32 N ATOM 1758 CA THR A 117 -16.342 15.770 8.976 1.00 34.03 C ATOM 1759 C THR A 117 -17.846 15.555 9.104 1.00 64.11 C ATOM 1760 O THR A 117 -18.610 15.885 8.196 1.00 74.22 O ATOM 1761 CB THR A 117 -15.913 16.897 9.936 1.00 43.32 C ATOM 1762 OG1 THR A 117 -16.209 16.528 11.287 1.00 43.21 O ATOM 1763 CG2 THR A 117 -16.621 18.198 9.592 1.00 32.40 C ATOM 0 H THR A 117 -16.704 16.524 7.054 1.00 22.32 H new ATOM 0 HA THR A 117 -15.821 14.852 9.249 1.00 34.03 H new ATOM 0 HB THR A 117 -14.839 17.048 9.829 1.00 43.32 H new ATOM 0 HG1 THR A 117 -15.932 17.248 11.891 1.00 43.21 H new ATOM 0 HG21 THR A 117 -16.303 18.979 10.283 1.00 32.40 H new ATOM 0 HG22 THR A 117 -16.370 18.491 8.573 1.00 32.40 H new ATOM 0 HG23 THR A 117 -17.699 18.058 9.674 1.00 32.40 H new ATOM 1771 N ARG A 118 -18.266 14.999 10.236 1.00 53.32 N ATOM 1772 CA ARG A 118 -19.678 14.739 10.482 1.00 31.04 C ATOM 1773 C ARG A 118 -20.296 13.957 9.327 1.00 13.03 C ATOM 1774 O ARG A 118 -21.094 14.479 8.547 1.00 13.41 O ATOM 1775 CB ARG A 118 -20.433 16.054 10.684 1.00 64.11 C ATOM 1776 CG ARG A 118 -21.721 15.903 11.477 1.00 4.00 C ATOM 1777 CD ARG A 118 -22.752 16.945 11.072 1.00 54.35 C ATOM 1778 NE ARG A 118 -23.141 16.814 9.670 1.00 35.03 N ATOM 1779 CZ ARG A 118 -23.883 15.815 9.205 1.00 21.03 C ATOM 1780 NH1 ARG A 118 -24.312 14.865 10.026 1.00 64.42 N ATOM 1781 NH2 ARG A 118 -24.197 15.764 7.918 1.00 25.44 N ATOM 0 H ARG A 118 -17.647 14.720 10.997 1.00 53.32 H new ATOM 0 HA ARG A 118 -19.759 14.139 11.388 1.00 31.04 H new ATOM 0 HB2 ARG A 118 -19.782 16.762 11.197 1.00 64.11 H new ATOM 0 HB3 ARG A 118 -20.665 16.483 9.709 1.00 64.11 H new ATOM 0 HG2 ARG A 118 -22.130 14.905 11.321 1.00 4.00 H new ATOM 0 HG3 ARG A 118 -21.507 15.997 12.542 1.00 4.00 H new ATOM 0 HD2 ARG A 118 -23.635 16.846 11.704 1.00 54.35 H new ATOM 0 HD3 ARG A 118 -22.347 17.942 11.244 1.00 54.35 H new ATOM 0 HE ARG A 118 -22.826 17.528 9.013 1.00 35.03 H new ATOM 0 HH11 ARG A 118 -24.072 14.901 11.017 1.00 64.42 H new ATOM 0 HH12 ARG A 118 -24.882 14.099 9.666 1.00 64.42 H new ATOM 0 HH21 ARG A 118 -23.869 16.492 7.284 1.00 25.44 H new ATOM 0 HH22 ARG A 118 -24.767 14.996 7.562 1.00 25.44 H new ATOM 1795 N PRO A 119 -19.921 12.675 9.212 1.00 12.51 N ATOM 1796 CA PRO A 119 -20.426 11.793 8.156 1.00 10.14 C ATOM 1797 C PRO A 119 -21.899 11.446 8.344 1.00 13.11 C ATOM 1798 O PRO A 119 -22.608 11.161 7.380 1.00 4.32 O ATOM 1799 CB PRO A 119 -19.560 10.538 8.296 1.00 33.11 C ATOM 1800 CG PRO A 119 -19.118 10.540 9.719 1.00 43.41 C ATOM 1801 CD PRO A 119 -18.974 11.986 10.106 1.00 11.45 C ATOM 0 HA PRO A 119 -20.367 12.261 7.173 1.00 10.14 H new ATOM 0 HB2 PRO A 119 -20.126 9.638 8.059 1.00 33.11 H new ATOM 0 HB3 PRO A 119 -18.708 10.567 7.617 1.00 33.11 H new ATOM 0 HG2 PRO A 119 -19.847 10.037 10.355 1.00 43.41 H new ATOM 0 HG3 PRO A 119 -18.173 10.009 9.835 1.00 43.41 H new ATOM 0 HD2 PRO A 119 -19.222 12.148 11.155 1.00 11.45 H new ATOM 0 HD3 PRO A 119 -17.954 12.341 9.961 1.00 11.45 H new TER 1809 PRO A 119