USER MOD reduce.3.24.130724 H: found=0, std=0, add=1075, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 1074 hydrogens (12 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 100 ASN : amide:sc= -1.3 X(o=-2.1,f=-2!) USER MOD Set 1.2: A 119 TYR OH : rot 30:sc= -0.758 USER MOD Set 2.1: A 115 GLN : amide:sc= -5.33! C(o=-6.6!,f=-14!) USER MOD Set 2.2: A 117 TYR OH : rot 180:sc= -1.29 USER MOD Set 3.1: A 11 SER OG : rot -100:sc= -1.26 USER MOD Set 3.2: A 33 HIS : no HD1:sc= -3.8! C(o=-5.1!,f=-6.5!) USER MOD Single : A 1 ALA N :NH3+ 170:sc= 0 (180deg=-0.132) USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 THR OG1 : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -143:sc= -0.966 (180deg=-2.5!) USER MOD Single : A 13 ASN : amide:sc= -0.0671 K(o=-0.067,f=-3.5!) USER MOD Single : A 14 TYR OH : rot -140:sc= -1.58 USER MOD Single : A 16 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 MET CE :methyl 147:sc= -3.63 (180deg=-7.05!) USER MOD Single : A 20 LYS NZ :NH3+ 157:sc= -0.0506 (180deg=-0.379) USER MOD Single : A 21 MET CE :methyl -109:sc= -1.06 (180deg=-2.04!) USER MOD Single : A 24 ASN : amide:sc= 0.142 K(o=0.14,f=-6.8!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 35 ASN : amide:sc= -0.355 X(o=-0.35,f=-0.013) USER MOD Single : A 37 LYS NZ :NH3+ -167:sc= -3.28 (180deg=-3.49!) USER MOD Single : A 39 THR OG1 : rot 91:sc= 1.19 USER MOD Single : A 41 THR OG1 : rot 72:sc= -0.518 USER MOD Single : A 42 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 45 ASN : amide:sc= -0.119 K(o=-0.12,f=-3.1) USER MOD Single : A 46 LYS NZ :NH3+ -146:sc= 0 (180deg=-0.0706) USER MOD Single : A 48 THR OG1 : rot 180:sc= -0.665 USER MOD Single : A 50 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.01) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 53 SER OG : rot 180:sc= -0.0947 USER MOD Single : A 57 ASN : amide:sc= -0.824 K(o=-0.82,f=0.042!) USER MOD Single : A 67 THR OG1 : rot -55:sc= 0.459 USER MOD Single : A 69 ASN : amide:sc= -0.626 K(o=-0.63,f=-5.4!) USER MOD Single : A 70 TYR OH : rot -82:sc= -0.899 USER MOD Single : A 71 ASN : amide:sc= -5.02 K(o=-5,f=-12!) USER MOD Single : A 76 THR OG1 : rot -87:sc= -0.397 USER MOD Single : A 81 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 SER OG : rot 180:sc= -0.0589 USER MOD Single : A 87 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 88 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= -0.117 (180deg=-0.117) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 96 THR OG1 : rot 180:sc= 0 USER MOD Single : A 98 ASN : amide:sc= 0 X(o=0,f=0.028) USER MOD Single : A 103 ASN : amide:sc= -0.945 K(o=-0.95,f=0) USER MOD Single : A 104 THR OG1 : rot -98:sc= -0.337! USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 149:sc= 0 (180deg=-0.702) USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 201 KTR O3 : rot -16:sc= -3.18 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -2.828 -0.751 17.852 1.00 0.00 N ATOM 2 CA ALA A 1 -4.017 -1.511 17.388 1.00 0.00 C ATOM 3 C ALA A 1 -4.024 -1.644 15.869 1.00 0.00 C ATOM 4 O ALA A 1 -5.079 -1.593 15.237 1.00 0.00 O ATOM 5 CB ALA A 1 -5.294 -0.834 17.862 1.00 0.00 C ATOM 0 H1 ALA A 1 -2.931 -0.528 18.863 1.00 0.00 H new ATOM 0 H2 ALA A 1 -1.972 -1.324 17.709 1.00 0.00 H new ATOM 0 H3 ALA A 1 -2.747 0.132 17.309 1.00 0.00 H new ATOM 0 HA ALA A 1 -3.967 -2.512 17.816 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -6.157 -1.402 17.515 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -5.301 -0.793 18.951 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -5.340 0.178 17.460 1.00 0.00 H new ATOM 13 N PHE A 2 -2.841 -1.813 15.288 1.00 0.00 N ATOM 14 CA PHE A 2 -2.717 -1.951 13.842 1.00 0.00 C ATOM 15 C PHE A 2 -2.917 -3.401 13.414 1.00 0.00 C ATOM 16 O PHE A 2 -3.666 -3.683 12.479 1.00 0.00 O ATOM 17 CB PHE A 2 -1.353 -1.443 13.372 1.00 0.00 C ATOM 18 CG PHE A 2 -1.360 0.012 13.000 1.00 0.00 C ATOM 19 CD1 PHE A 2 -1.854 0.424 11.772 1.00 0.00 C ATOM 20 CD2 PHE A 2 -0.879 0.968 13.879 1.00 0.00 C ATOM 21 CE1 PHE A 2 -1.867 1.762 11.428 1.00 0.00 C ATOM 22 CE2 PHE A 2 -0.891 2.308 13.542 1.00 0.00 C ATOM 23 CZ PHE A 2 -1.385 2.706 12.315 1.00 0.00 C ATOM 0 H PHE A 2 -1.957 -1.858 15.795 1.00 0.00 H new ATOM 0 HA PHE A 2 -3.496 -1.347 13.376 1.00 0.00 H new ATOM 0 HB2 PHE A 2 -0.620 -1.606 14.162 1.00 0.00 H new ATOM 0 HB3 PHE A 2 -1.031 -2.030 12.512 1.00 0.00 H new ATOM 0 HD1 PHE A 2 -2.233 -0.310 11.076 1.00 0.00 H new ATOM 0 HD2 PHE A 2 -0.490 0.663 14.839 1.00 0.00 H new ATOM 0 HE1 PHE A 2 -2.253 2.070 10.468 1.00 0.00 H new ATOM 0 HE2 PHE A 2 -0.514 3.044 14.237 1.00 0.00 H new ATOM 0 HZ PHE A 2 -1.395 3.753 12.049 1.00 0.00 H new ATOM 33 N ASP A 3 -2.250 -4.320 14.108 1.00 0.00 N ATOM 34 CA ASP A 3 -2.363 -5.743 13.801 1.00 0.00 C ATOM 35 C ASP A 3 -3.827 -6.172 13.771 1.00 0.00 C ATOM 36 O ASP A 3 -4.448 -6.364 14.817 1.00 0.00 O ATOM 37 CB ASP A 3 -1.597 -6.569 14.837 1.00 0.00 C ATOM 38 CG ASP A 3 -1.642 -8.059 14.550 1.00 0.00 C ATOM 39 OD1 ASP A 3 -2.444 -8.477 13.689 1.00 0.00 O ATOM 40 OD2 ASP A 3 -0.874 -8.809 15.189 1.00 0.00 O ATOM 0 H ASP A 3 -1.626 -4.105 14.886 1.00 0.00 H new ATOM 0 HA ASP A 3 -1.930 -5.918 12.816 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -0.558 -6.239 14.862 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -2.015 -6.381 15.826 1.00 0.00 H new ATOM 45 N SER A 4 -4.378 -6.309 12.568 1.00 0.00 N ATOM 46 CA SER A 4 -5.774 -6.704 12.411 1.00 0.00 C ATOM 47 C SER A 4 -6.172 -6.750 10.939 1.00 0.00 C ATOM 48 O SER A 4 -5.337 -6.572 10.052 1.00 0.00 O ATOM 49 CB SER A 4 -6.679 -5.718 13.154 1.00 0.00 C ATOM 50 OG SER A 4 -7.624 -6.398 13.962 1.00 0.00 O ATOM 0 H SER A 4 -3.881 -6.153 11.691 1.00 0.00 H new ATOM 0 HA SER A 4 -5.892 -7.703 12.831 1.00 0.00 H new ATOM 0 HB2 SER A 4 -6.071 -5.060 13.776 1.00 0.00 H new ATOM 0 HB3 SER A 4 -7.200 -5.086 12.435 1.00 0.00 H new ATOM 0 HG SER A 4 -8.188 -5.745 14.426 1.00 0.00 H new ATOM 56 N THR A 5 -7.460 -6.969 10.691 1.00 0.00 N ATOM 57 CA THR A 5 -7.983 -7.014 9.330 1.00 0.00 C ATOM 58 C THR A 5 -8.389 -5.613 8.899 1.00 0.00 C ATOM 59 O THR A 5 -9.260 -4.998 9.514 1.00 0.00 O ATOM 60 CB THR A 5 -9.187 -7.952 9.246 1.00 0.00 C ATOM 61 OG1 THR A 5 -8.823 -9.273 9.607 1.00 0.00 O ATOM 62 CG2 THR A 5 -9.802 -8.004 7.867 1.00 0.00 C ATOM 0 H THR A 5 -8.161 -7.118 11.416 1.00 0.00 H new ATOM 0 HA THR A 5 -7.206 -7.392 8.666 1.00 0.00 H new ATOM 0 HB THR A 5 -9.922 -7.545 9.941 1.00 0.00 H new ATOM 0 HG1 THR A 5 -9.608 -9.856 9.548 1.00 0.00 H new ATOM 0 HG21 THR A 5 -10.652 -8.687 7.873 1.00 0.00 H new ATOM 0 HG22 THR A 5 -10.139 -7.008 7.581 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.059 -8.355 7.150 1.00 0.00 H new ATOM 70 N TRP A 6 -7.745 -5.095 7.859 1.00 0.00 N ATOM 71 CA TRP A 6 -8.044 -3.751 7.391 1.00 0.00 C ATOM 72 C TRP A 6 -8.566 -3.764 5.964 1.00 0.00 C ATOM 73 O TRP A 6 -7.893 -4.211 5.038 1.00 0.00 O ATOM 74 CB TRP A 6 -6.802 -2.862 7.495 1.00 0.00 C ATOM 75 CG TRP A 6 -6.427 -2.521 8.905 1.00 0.00 C ATOM 76 CD1 TRP A 6 -6.569 -3.317 10.003 1.00 0.00 C ATOM 77 CD2 TRP A 6 -5.850 -1.296 9.371 1.00 0.00 C ATOM 78 NE1 TRP A 6 -6.124 -2.663 11.124 1.00 0.00 N ATOM 79 CE2 TRP A 6 -5.678 -1.421 10.763 1.00 0.00 C ATOM 80 CE3 TRP A 6 -5.464 -0.106 8.749 1.00 0.00 C ATOM 81 CZ2 TRP A 6 -5.139 -0.403 11.541 1.00 0.00 C ATOM 82 CZ3 TRP A 6 -4.927 0.905 9.524 1.00 0.00 C ATOM 83 CH2 TRP A 6 -4.769 0.751 10.908 1.00 0.00 C ATOM 0 H TRP A 6 -7.021 -5.581 7.330 1.00 0.00 H new ATOM 0 HA TRP A 6 -8.827 -3.342 8.030 1.00 0.00 H new ATOM 0 HB2 TRP A 6 -5.963 -3.367 7.016 1.00 0.00 H new ATOM 0 HB3 TRP A 6 -6.978 -1.940 6.941 1.00 0.00 H new ATOM 0 HD1 TRP A 6 -6.974 -4.318 9.992 1.00 0.00 H new ATOM 0 HE1 TRP A 6 -6.125 -3.041 12.071 1.00 0.00 H new ATOM 0 HE3 TRP A 6 -5.583 0.022 7.683 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 -5.017 -0.519 12.608 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 -4.624 1.829 9.055 1.00 0.00 H new ATOM 0 HH2 TRP A 6 -4.347 1.560 11.486 1.00 0.00 H new ATOM 94 N LYS A 7 -9.769 -3.240 5.808 1.00 0.00 N ATOM 95 CA LYS A 7 -10.414 -3.152 4.503 1.00 0.00 C ATOM 96 C LYS A 7 -10.617 -1.698 4.107 1.00 0.00 C ATOM 97 O LYS A 7 -11.291 -0.937 4.799 1.00 0.00 O ATOM 98 CB LYS A 7 -11.751 -3.898 4.508 1.00 0.00 C ATOM 99 CG LYS A 7 -12.842 -3.200 5.303 1.00 0.00 C ATOM 100 CD LYS A 7 -14.107 -4.038 5.364 1.00 0.00 C ATOM 101 CE LYS A 7 -15.062 -3.526 6.430 1.00 0.00 C ATOM 102 NZ LYS A 7 -16.318 -2.988 5.838 1.00 0.00 N ATOM 0 H LYS A 7 -10.326 -2.865 6.575 1.00 0.00 H new ATOM 0 HA LYS A 7 -9.763 -3.624 3.767 1.00 0.00 H new ATOM 0 HB2 LYS A 7 -12.089 -4.025 3.480 1.00 0.00 H new ATOM 0 HB3 LYS A 7 -11.598 -4.896 4.919 1.00 0.00 H new ATOM 0 HG2 LYS A 7 -12.487 -3.001 6.314 1.00 0.00 H new ATOM 0 HG3 LYS A 7 -13.065 -2.235 4.848 1.00 0.00 H new ATOM 0 HD2 LYS A 7 -14.602 -4.023 4.393 1.00 0.00 H new ATOM 0 HD3 LYS A 7 -13.848 -5.076 5.574 1.00 0.00 H new ATOM 0 HE2 LYS A 7 -15.303 -4.335 7.120 1.00 0.00 H new ATOM 0 HE3 LYS A 7 -14.572 -2.746 7.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 -16.629 -2.157 6.380 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 -16.146 -2.712 4.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 -17.057 -3.719 5.869 1.00 0.00 H new ATOM 116 N VAL A 8 -10.013 -1.322 2.994 1.00 0.00 N ATOM 117 CA VAL A 8 -10.101 0.039 2.499 1.00 0.00 C ATOM 118 C VAL A 8 -11.530 0.406 2.096 1.00 0.00 C ATOM 119 O VAL A 8 -12.218 -0.370 1.433 1.00 0.00 O ATOM 120 CB VAL A 8 -9.149 0.238 1.306 1.00 0.00 C ATOM 121 CG1 VAL A 8 -9.729 -0.358 0.029 1.00 0.00 C ATOM 122 CG2 VAL A 8 -8.839 1.708 1.125 1.00 0.00 C ATOM 0 H VAL A 8 -9.453 -1.945 2.413 1.00 0.00 H new ATOM 0 HA VAL A 8 -9.804 0.702 3.312 1.00 0.00 H new ATOM 0 HB VAL A 8 -8.220 -0.290 1.520 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -9.033 -0.201 -0.795 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -9.892 -1.427 0.168 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -10.678 0.127 -0.201 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -8.165 1.836 0.278 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -9.763 2.255 0.939 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -8.365 2.094 2.028 1.00 0.00 H new ATOM 132 N ASP A 9 -11.967 1.597 2.500 1.00 0.00 N ATOM 133 CA ASP A 9 -13.310 2.072 2.180 1.00 0.00 C ATOM 134 C ASP A 9 -13.355 2.640 0.762 1.00 0.00 C ATOM 135 O ASP A 9 -14.066 2.122 -0.099 1.00 0.00 O ATOM 136 CB ASP A 9 -13.763 3.122 3.210 1.00 0.00 C ATOM 137 CG ASP A 9 -14.630 4.221 2.618 1.00 0.00 C ATOM 138 OD1 ASP A 9 -15.523 3.901 1.805 1.00 0.00 O ATOM 139 OD2 ASP A 9 -14.419 5.399 2.973 1.00 0.00 O ATOM 0 H ASP A 9 -11.410 2.251 3.050 1.00 0.00 H new ATOM 0 HA ASP A 9 -14.000 1.229 2.226 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -14.316 2.623 4.006 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -12.883 3.573 3.668 1.00 0.00 H new ATOM 144 N ARG A 10 -12.589 3.702 0.522 1.00 0.00 N ATOM 145 CA ARG A 10 -12.550 4.322 -0.799 1.00 0.00 C ATOM 146 C ARG A 10 -11.119 4.631 -1.218 1.00 0.00 C ATOM 147 O ARG A 10 -10.220 4.729 -0.382 1.00 0.00 O ATOM 148 CB ARG A 10 -13.396 5.598 -0.831 1.00 0.00 C ATOM 149 CG ARG A 10 -13.120 6.550 0.319 1.00 0.00 C ATOM 150 CD ARG A 10 -14.133 7.681 0.356 1.00 0.00 C ATOM 151 NE ARG A 10 -15.187 7.442 1.338 1.00 0.00 N ATOM 152 CZ ARG A 10 -15.983 8.394 1.819 1.00 0.00 C ATOM 153 NH1 ARG A 10 -15.848 9.650 1.411 1.00 0.00 N ATOM 154 NH2 ARG A 10 -16.917 8.090 2.710 1.00 0.00 N ATOM 0 H ARG A 10 -11.992 4.148 1.219 1.00 0.00 H new ATOM 0 HA ARG A 10 -12.970 3.609 -1.509 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -13.215 6.118 -1.772 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -14.451 5.323 -0.817 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -13.148 6.003 1.261 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -12.116 6.962 0.220 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -13.624 8.616 0.591 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -14.578 7.801 -0.632 1.00 0.00 H new ATOM 0 HE ARG A 10 -15.321 6.489 1.675 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -15.132 9.889 0.726 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -16.461 10.376 1.783 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -17.025 7.126 3.027 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -17.527 8.820 3.079 1.00 0.00 H new ATOM 168 N SER A 11 -10.915 4.770 -2.522 1.00 0.00 N ATOM 169 CA SER A 11 -9.601 5.051 -3.072 1.00 0.00 C ATOM 170 C SER A 11 -9.596 6.377 -3.830 1.00 0.00 C ATOM 171 O SER A 11 -10.602 6.767 -4.423 1.00 0.00 O ATOM 172 CB SER A 11 -9.190 3.912 -4.002 1.00 0.00 C ATOM 173 OG SER A 11 -9.317 2.654 -3.360 1.00 0.00 O ATOM 0 H SER A 11 -11.653 4.691 -3.222 1.00 0.00 H new ATOM 0 HA SER A 11 -8.887 5.132 -2.252 1.00 0.00 H new ATOM 0 HB2 SER A 11 -9.810 3.930 -4.899 1.00 0.00 H new ATOM 0 HB3 SER A 11 -8.159 4.056 -4.324 1.00 0.00 H new ATOM 0 HG SER A 11 -8.437 2.356 -3.048 1.00 0.00 H new ATOM 179 N GLU A 12 -8.458 7.064 -3.807 1.00 0.00 N ATOM 180 CA GLU A 12 -8.322 8.345 -4.494 1.00 0.00 C ATOM 181 C GLU A 12 -7.018 8.401 -5.285 1.00 0.00 C ATOM 182 O GLU A 12 -5.944 8.131 -4.749 1.00 0.00 O ATOM 183 CB GLU A 12 -8.373 9.496 -3.488 1.00 0.00 C ATOM 184 CG GLU A 12 -9.183 10.689 -3.969 1.00 0.00 C ATOM 185 CD GLU A 12 -8.309 11.825 -4.464 1.00 0.00 C ATOM 186 OE1 GLU A 12 -7.884 11.779 -5.637 1.00 0.00 O ATOM 187 OE2 GLU A 12 -8.051 12.761 -3.678 1.00 0.00 O ATOM 0 H GLU A 12 -7.616 6.756 -3.320 1.00 0.00 H new ATOM 0 HA GLU A 12 -9.154 8.446 -5.191 1.00 0.00 H new ATOM 0 HB2 GLU A 12 -8.799 9.132 -2.553 1.00 0.00 H new ATOM 0 HB3 GLU A 12 -7.356 9.822 -3.270 1.00 0.00 H new ATOM 0 HG2 GLU A 12 -9.849 10.372 -4.771 1.00 0.00 H new ATOM 0 HG3 GLU A 12 -9.813 11.048 -3.155 1.00 0.00 H new ATOM 194 N ASN A 13 -7.122 8.749 -6.565 1.00 0.00 N ATOM 195 CA ASN A 13 -5.959 8.839 -7.434 1.00 0.00 C ATOM 196 C ASN A 13 -5.227 7.499 -7.521 1.00 0.00 C ATOM 197 O ASN A 13 -4.088 7.422 -7.997 1.00 0.00 O ATOM 198 CB ASN A 13 -5.018 9.921 -6.926 1.00 0.00 C ATOM 199 CG ASN A 13 -5.169 11.226 -7.684 1.00 0.00 C ATOM 200 OD1 ASN A 13 -5.837 11.284 -8.717 1.00 0.00 O ATOM 201 ND2 ASN A 13 -4.546 12.282 -7.175 1.00 0.00 N ATOM 0 H ASN A 13 -8.006 8.974 -7.022 1.00 0.00 H new ATOM 0 HA ASN A 13 -6.300 9.099 -8.436 1.00 0.00 H new ATOM 0 HB2 ASN A 13 -5.209 10.096 -5.867 1.00 0.00 H new ATOM 0 HB3 ASN A 13 -3.989 9.572 -7.011 1.00 0.00 H new ATOM 0 HD21 ASN A 13 -4.610 13.186 -7.642 1.00 0.00 H new ATOM 0 HD22 ASN A 13 -4.003 12.189 -6.317 1.00 0.00 H new ATOM 208 N TYR A 14 -5.884 6.434 -7.078 1.00 0.00 N ATOM 209 CA TYR A 14 -5.284 5.116 -7.133 1.00 0.00 C ATOM 210 C TYR A 14 -4.898 4.800 -8.576 1.00 0.00 C ATOM 211 O TYR A 14 -3.773 4.385 -8.855 1.00 0.00 O ATOM 212 CB TYR A 14 -6.253 4.070 -6.577 1.00 0.00 C ATOM 213 CG TYR A 14 -5.577 2.835 -6.020 1.00 0.00 C ATOM 214 CD1 TYR A 14 -4.492 2.262 -6.667 1.00 0.00 C ATOM 215 CD2 TYR A 14 -6.027 2.242 -4.847 1.00 0.00 C ATOM 216 CE1 TYR A 14 -3.874 1.134 -6.164 1.00 0.00 C ATOM 217 CE2 TYR A 14 -5.413 1.114 -4.336 1.00 0.00 C ATOM 218 CZ TYR A 14 -4.337 0.564 -4.999 1.00 0.00 C ATOM 219 OH TYR A 14 -3.723 -0.559 -4.494 1.00 0.00 O ATOM 0 H TYR A 14 -6.823 6.461 -6.681 1.00 0.00 H new ATOM 0 HA TYR A 14 -4.385 5.094 -6.517 1.00 0.00 H new ATOM 0 HB2 TYR A 14 -6.853 4.528 -5.791 1.00 0.00 H new ATOM 0 HB3 TYR A 14 -6.940 3.770 -7.368 1.00 0.00 H new ATOM 0 HD1 TYR A 14 -4.124 2.706 -7.580 1.00 0.00 H new ATOM 0 HD2 TYR A 14 -6.871 2.670 -4.326 1.00 0.00 H new ATOM 0 HE1 TYR A 14 -3.031 0.701 -6.682 1.00 0.00 H new ATOM 0 HE2 TYR A 14 -5.774 0.666 -3.422 1.00 0.00 H new ATOM 0 HH TYR A 14 -4.402 -1.175 -4.146 1.00 0.00 H new ATOM 229 N ASP A 15 -5.833 5.041 -9.495 1.00 0.00 N ATOM 230 CA ASP A 15 -5.587 4.820 -10.917 1.00 0.00 C ATOM 231 C ASP A 15 -4.335 5.572 -11.355 1.00 0.00 C ATOM 232 O ASP A 15 -3.624 5.152 -12.268 1.00 0.00 O ATOM 233 CB ASP A 15 -6.787 5.288 -11.741 1.00 0.00 C ATOM 234 CG ASP A 15 -6.931 4.521 -13.041 1.00 0.00 C ATOM 235 OD1 ASP A 15 -7.350 3.345 -12.993 1.00 0.00 O ATOM 236 OD2 ASP A 15 -6.625 5.096 -14.107 1.00 0.00 O ATOM 0 H ASP A 15 -6.767 5.389 -9.279 1.00 0.00 H new ATOM 0 HA ASP A 15 -5.439 3.753 -11.083 1.00 0.00 H new ATOM 0 HB2 ASP A 15 -7.696 5.172 -11.151 1.00 0.00 H new ATOM 0 HB3 ASP A 15 -6.682 6.351 -11.959 1.00 0.00 H new ATOM 241 N LYS A 16 -4.071 6.687 -10.682 1.00 0.00 N ATOM 242 CA LYS A 16 -2.905 7.512 -10.971 1.00 0.00 C ATOM 243 C LYS A 16 -1.637 6.685 -10.895 1.00 0.00 C ATOM 244 O LYS A 16 -0.740 6.818 -11.727 1.00 0.00 O ATOM 245 CB LYS A 16 -2.836 8.665 -9.968 1.00 0.00 C ATOM 246 CG LYS A 16 -2.227 9.939 -10.520 1.00 0.00 C ATOM 247 CD LYS A 16 -3.265 11.037 -10.636 1.00 0.00 C ATOM 248 CE LYS A 16 -2.869 12.076 -11.672 1.00 0.00 C ATOM 249 NZ LYS A 16 -1.933 13.090 -11.113 1.00 0.00 N ATOM 0 H LYS A 16 -4.656 7.042 -9.925 1.00 0.00 H new ATOM 0 HA LYS A 16 -2.996 7.912 -11.981 1.00 0.00 H new ATOM 0 HB2 LYS A 16 -3.843 8.882 -9.613 1.00 0.00 H new ATOM 0 HB3 LYS A 16 -2.255 8.344 -9.103 1.00 0.00 H new ATOM 0 HG2 LYS A 16 -1.416 10.269 -9.871 1.00 0.00 H new ATOM 0 HG3 LYS A 16 -1.791 9.742 -11.499 1.00 0.00 H new ATOM 0 HD2 LYS A 16 -4.227 10.602 -10.906 1.00 0.00 H new ATOM 0 HD3 LYS A 16 -3.394 11.520 -9.667 1.00 0.00 H new ATOM 0 HE2 LYS A 16 -2.401 11.580 -12.523 1.00 0.00 H new ATOM 0 HE3 LYS A 16 -3.763 12.575 -12.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 -1.688 13.780 -11.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 -2.388 13.581 -10.317 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 -1.069 12.618 -10.779 1.00 0.00 H new ATOM 263 N PHE A 17 -1.568 5.836 -9.885 1.00 0.00 N ATOM 264 CA PHE A 17 -0.401 4.988 -9.692 1.00 0.00 C ATOM 265 C PHE A 17 -0.353 3.881 -10.733 1.00 0.00 C ATOM 266 O PHE A 17 0.714 3.369 -11.058 1.00 0.00 O ATOM 267 CB PHE A 17 -0.385 4.431 -8.266 1.00 0.00 C ATOM 268 CG PHE A 17 -0.029 5.490 -7.267 1.00 0.00 C ATOM 269 CD1 PHE A 17 -0.500 6.784 -7.444 1.00 0.00 C ATOM 270 CD2 PHE A 17 0.789 5.217 -6.176 1.00 0.00 C ATOM 271 CE1 PHE A 17 -0.168 7.786 -6.570 1.00 0.00 C ATOM 272 CE2 PHE A 17 1.121 6.224 -5.289 1.00 0.00 C ATOM 273 CZ PHE A 17 0.643 7.511 -5.489 1.00 0.00 C ATOM 0 H PHE A 17 -2.302 5.714 -9.187 1.00 0.00 H new ATOM 0 HA PHE A 17 0.497 5.590 -9.827 1.00 0.00 H new ATOM 0 HB2 PHE A 17 -1.364 4.016 -8.025 1.00 0.00 H new ATOM 0 HB3 PHE A 17 0.332 3.613 -8.202 1.00 0.00 H new ATOM 0 HD1 PHE A 17 -1.140 7.005 -8.286 1.00 0.00 H new ATOM 0 HD2 PHE A 17 1.166 4.217 -6.021 1.00 0.00 H new ATOM 0 HE1 PHE A 17 -0.540 8.788 -6.727 1.00 0.00 H new ATOM 0 HE2 PHE A 17 1.753 6.009 -4.440 1.00 0.00 H new ATOM 0 HZ PHE A 17 0.906 8.298 -4.798 1.00 0.00 H new ATOM 283 N MET A 18 -1.506 3.528 -11.278 1.00 0.00 N ATOM 284 CA MET A 18 -1.563 2.502 -12.300 1.00 0.00 C ATOM 285 C MET A 18 -0.884 2.983 -13.579 1.00 0.00 C ATOM 286 O MET A 18 -0.303 2.190 -14.320 1.00 0.00 O ATOM 287 CB MET A 18 -3.016 2.129 -12.600 1.00 0.00 C ATOM 288 CG MET A 18 -3.583 1.093 -11.651 1.00 0.00 C ATOM 289 SD MET A 18 -4.015 1.781 -10.044 1.00 0.00 S ATOM 290 CE MET A 18 -2.599 1.272 -9.071 1.00 0.00 C ATOM 0 H MET A 18 -2.408 3.935 -11.030 1.00 0.00 H new ATOM 0 HA MET A 18 -1.038 1.622 -11.928 1.00 0.00 H new ATOM 0 HB2 MET A 18 -3.631 3.028 -12.553 1.00 0.00 H new ATOM 0 HB3 MET A 18 -3.082 1.751 -13.620 1.00 0.00 H new ATOM 0 HG2 MET A 18 -4.469 0.643 -12.099 1.00 0.00 H new ATOM 0 HG3 MET A 18 -2.854 0.294 -11.515 1.00 0.00 H new ATOM 0 HE1 MET A 18 -2.389 2.026 -8.313 1.00 0.00 H new ATOM 0 HE2 MET A 18 -2.814 0.320 -8.586 1.00 0.00 H new ATOM 0 HE3 MET A 18 -1.732 1.160 -9.722 1.00 0.00 H new ATOM 300 N GLU A 19 -0.979 4.285 -13.848 1.00 0.00 N ATOM 301 CA GLU A 19 -0.396 4.847 -15.063 1.00 0.00 C ATOM 302 C GLU A 19 1.092 5.176 -14.919 1.00 0.00 C ATOM 303 O GLU A 19 1.922 4.627 -15.645 1.00 0.00 O ATOM 304 CB GLU A 19 -1.165 6.105 -15.472 1.00 0.00 C ATOM 305 CG GLU A 19 -2.673 5.918 -15.486 1.00 0.00 C ATOM 306 CD GLU A 19 -3.120 4.852 -16.467 1.00 0.00 C ATOM 307 OE1 GLU A 19 -3.081 3.657 -16.104 1.00 0.00 O ATOM 308 OE2 GLU A 19 -3.511 5.211 -17.597 1.00 0.00 O ATOM 0 H GLU A 19 -1.449 4.963 -13.248 1.00 0.00 H new ATOM 0 HA GLU A 19 -0.478 4.082 -15.835 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -0.914 6.914 -14.786 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -0.836 6.415 -16.464 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -3.011 5.650 -14.485 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -3.150 6.864 -15.741 1.00 0.00 H new ATOM 315 N LYS A 20 1.431 6.078 -14.003 1.00 0.00 N ATOM 316 CA LYS A 20 2.820 6.471 -13.805 1.00 0.00 C ATOM 317 C LYS A 20 3.662 5.302 -13.313 1.00 0.00 C ATOM 318 O LYS A 20 4.749 5.045 -13.830 1.00 0.00 O ATOM 319 CB LYS A 20 2.902 7.624 -12.815 1.00 0.00 C ATOM 320 CG LYS A 20 4.246 8.330 -12.825 1.00 0.00 C ATOM 321 CD LYS A 20 4.148 9.755 -13.354 1.00 0.00 C ATOM 322 CE LYS A 20 5.491 10.236 -13.876 1.00 0.00 C ATOM 323 NZ LYS A 20 5.892 9.522 -15.120 1.00 0.00 N ATOM 0 H LYS A 20 0.766 6.548 -13.389 1.00 0.00 H new ATOM 0 HA LYS A 20 3.218 6.793 -14.767 1.00 0.00 H new ATOM 0 HB2 LYS A 20 2.118 8.346 -13.044 1.00 0.00 H new ATOM 0 HB3 LYS A 20 2.705 7.247 -11.811 1.00 0.00 H new ATOM 0 HG2 LYS A 20 4.652 8.348 -11.814 1.00 0.00 H new ATOM 0 HG3 LYS A 20 4.946 7.764 -13.440 1.00 0.00 H new ATOM 0 HD2 LYS A 20 3.407 9.800 -14.152 1.00 0.00 H new ATOM 0 HD3 LYS A 20 3.804 10.418 -12.561 1.00 0.00 H new ATOM 0 HE2 LYS A 20 5.442 11.307 -14.072 1.00 0.00 H new ATOM 0 HE3 LYS A 20 6.252 10.087 -13.110 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 6.570 10.104 -15.651 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 6.335 8.614 -14.872 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 5.051 9.348 -15.707 1.00 0.00 H new ATOM 337 N MET A 21 3.154 4.596 -12.311 1.00 0.00 N ATOM 338 CA MET A 21 3.861 3.455 -11.751 1.00 0.00 C ATOM 339 C MET A 21 3.820 2.267 -12.709 1.00 0.00 C ATOM 340 O MET A 21 4.689 1.396 -12.666 1.00 0.00 O ATOM 341 CB MET A 21 3.250 3.068 -10.403 1.00 0.00 C ATOM 342 CG MET A 21 4.266 2.899 -9.289 1.00 0.00 C ATOM 343 SD MET A 21 3.509 2.982 -7.656 1.00 0.00 S ATOM 344 CE MET A 21 2.390 1.585 -7.730 1.00 0.00 C ATOM 0 H MET A 21 2.256 4.794 -11.871 1.00 0.00 H new ATOM 0 HA MET A 21 4.903 3.737 -11.601 1.00 0.00 H new ATOM 0 HB2 MET A 21 2.529 3.831 -10.110 1.00 0.00 H new ATOM 0 HB3 MET A 21 2.697 2.136 -10.521 1.00 0.00 H new ATOM 0 HG2 MET A 21 4.772 1.941 -9.404 1.00 0.00 H new ATOM 0 HG3 MET A 21 5.028 3.674 -9.374 1.00 0.00 H new ATOM 0 HE1 MET A 21 1.363 1.944 -7.786 1.00 0.00 H new ATOM 0 HE2 MET A 21 2.614 0.986 -8.613 1.00 0.00 H new ATOM 0 HE3 MET A 21 2.512 0.973 -6.836 1.00 0.00 H new ATOM 354 N GLY A 22 2.803 2.233 -13.569 1.00 0.00 N ATOM 355 CA GLY A 22 2.676 1.141 -14.513 1.00 0.00 C ATOM 356 C GLY A 22 2.145 -0.111 -13.853 1.00 0.00 C ATOM 357 O GLY A 22 2.830 -1.132 -13.794 1.00 0.00 O ATOM 0 H GLY A 22 2.070 2.940 -13.627 1.00 0.00 H new ATOM 0 HA2 GLY A 22 2.009 1.436 -15.323 1.00 0.00 H new ATOM 0 HA3 GLY A 22 3.648 0.932 -14.960 1.00 0.00 H new ATOM 361 N VAL A 23 0.921 -0.028 -13.348 1.00 0.00 N ATOM 362 CA VAL A 23 0.295 -1.163 -12.677 1.00 0.00 C ATOM 363 C VAL A 23 -0.790 -1.780 -13.552 1.00 0.00 C ATOM 364 O VAL A 23 -1.820 -1.158 -13.814 1.00 0.00 O ATOM 365 CB VAL A 23 -0.312 -0.749 -11.320 1.00 0.00 C ATOM 366 CG1 VAL A 23 -0.581 -1.967 -10.450 1.00 0.00 C ATOM 367 CG2 VAL A 23 0.600 0.234 -10.599 1.00 0.00 C ATOM 0 H VAL A 23 0.342 0.811 -13.389 1.00 0.00 H new ATOM 0 HA VAL A 23 1.075 -1.903 -12.499 1.00 0.00 H new ATOM 0 HB VAL A 23 -1.264 -0.255 -11.514 1.00 0.00 H new ATOM 0 HG11 VAL A 23 -1.009 -1.648 -9.499 1.00 0.00 H new ATOM 0 HG12 VAL A 23 -1.281 -2.630 -10.958 1.00 0.00 H new ATOM 0 HG13 VAL A 23 0.354 -2.497 -10.268 1.00 0.00 H new ATOM 0 HG21 VAL A 23 0.153 0.513 -9.645 1.00 0.00 H new ATOM 0 HG22 VAL A 23 1.570 -0.231 -10.423 1.00 0.00 H new ATOM 0 HG23 VAL A 23 0.731 1.126 -11.212 1.00 0.00 H new ATOM 377 N ASN A 24 -0.545 -3.003 -14.013 1.00 0.00 N ATOM 378 CA ASN A 24 -1.492 -3.705 -14.873 1.00 0.00 C ATOM 379 C ASN A 24 -2.879 -3.763 -14.251 1.00 0.00 C ATOM 380 O ASN A 24 -3.079 -3.390 -13.095 1.00 0.00 O ATOM 381 CB ASN A 24 -0.999 -5.123 -15.166 1.00 0.00 C ATOM 382 CG ASN A 24 -1.698 -5.759 -16.351 1.00 0.00 C ATOM 383 OD1 ASN A 24 -2.465 -5.106 -17.059 1.00 0.00 O ATOM 384 ND2 ASN A 24 -1.437 -7.042 -16.573 1.00 0.00 N ATOM 0 H ASN A 24 0.303 -3.529 -13.805 1.00 0.00 H new ATOM 0 HA ASN A 24 -1.561 -3.145 -15.806 1.00 0.00 H new ATOM 0 HB2 ASN A 24 0.074 -5.097 -15.355 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -1.152 -5.745 -14.284 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -1.879 -7.524 -17.356 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -0.795 -7.545 -15.961 1.00 0.00 H new ATOM 391 N ILE A 25 -3.830 -4.238 -15.039 1.00 0.00 N ATOM 392 CA ILE A 25 -5.213 -4.358 -14.598 1.00 0.00 C ATOM 393 C ILE A 25 -5.462 -5.703 -13.929 1.00 0.00 C ATOM 394 O ILE A 25 -6.261 -5.809 -13.002 1.00 0.00 O ATOM 395 CB ILE A 25 -6.188 -4.198 -15.781 1.00 0.00 C ATOM 396 CG1 ILE A 25 -7.637 -4.185 -15.285 1.00 0.00 C ATOM 397 CG2 ILE A 25 -5.979 -5.311 -16.800 1.00 0.00 C ATOM 398 CD1 ILE A 25 -8.476 -3.087 -15.901 1.00 0.00 C ATOM 0 H ILE A 25 -3.668 -4.550 -15.997 1.00 0.00 H new ATOM 0 HA ILE A 25 -5.389 -3.560 -13.876 1.00 0.00 H new ATOM 0 HB ILE A 25 -5.984 -3.245 -16.269 1.00 0.00 H new ATOM 0 HG12 ILE A 25 -8.096 -5.149 -15.504 1.00 0.00 H new ATOM 0 HG13 ILE A 25 -7.641 -4.069 -14.201 1.00 0.00 H new ATOM 0 HG21 ILE A 25 -6.676 -5.182 -17.628 1.00 0.00 H new ATOM 0 HG22 ILE A 25 -4.957 -5.272 -17.177 1.00 0.00 H new ATOM 0 HG23 ILE A 25 -6.154 -6.276 -16.325 1.00 0.00 H new ATOM 0 HD11 ILE A 25 -9.490 -3.138 -15.504 1.00 0.00 H new ATOM 0 HD12 ILE A 25 -8.040 -2.117 -15.660 1.00 0.00 H new ATOM 0 HD13 ILE A 25 -8.503 -3.214 -16.983 1.00 0.00 H new ATOM 410 N VAL A 26 -4.776 -6.728 -14.413 1.00 0.00 N ATOM 411 CA VAL A 26 -4.922 -8.077 -13.871 1.00 0.00 C ATOM 412 C VAL A 26 -4.820 -8.083 -12.346 1.00 0.00 C ATOM 413 O VAL A 26 -5.691 -8.616 -11.660 1.00 0.00 O ATOM 414 CB VAL A 26 -3.863 -9.035 -14.452 1.00 0.00 C ATOM 415 CG1 VAL A 26 -4.090 -10.454 -13.952 1.00 0.00 C ATOM 416 CG2 VAL A 26 -3.879 -8.991 -15.974 1.00 0.00 C ATOM 0 H VAL A 26 -4.110 -6.654 -15.182 1.00 0.00 H new ATOM 0 HA VAL A 26 -5.914 -8.423 -14.161 1.00 0.00 H new ATOM 0 HB VAL A 26 -2.881 -8.708 -14.111 1.00 0.00 H new ATOM 0 HG11 VAL A 26 -3.332 -11.114 -14.374 1.00 0.00 H new ATOM 0 HG12 VAL A 26 -4.022 -10.472 -12.864 1.00 0.00 H new ATOM 0 HG13 VAL A 26 -5.079 -10.794 -14.259 1.00 0.00 H new ATOM 0 HG21 VAL A 26 -3.125 -9.674 -16.366 1.00 0.00 H new ATOM 0 HG22 VAL A 26 -4.863 -9.290 -16.336 1.00 0.00 H new ATOM 0 HG23 VAL A 26 -3.661 -7.978 -16.311 1.00 0.00 H new ATOM 426 N LYS A 27 -3.753 -7.487 -11.824 1.00 0.00 N ATOM 427 CA LYS A 27 -3.543 -7.427 -10.381 1.00 0.00 C ATOM 428 C LYS A 27 -4.283 -6.241 -9.771 1.00 0.00 C ATOM 429 O LYS A 27 -4.716 -6.291 -8.620 1.00 0.00 O ATOM 430 CB LYS A 27 -2.049 -7.327 -10.065 1.00 0.00 C ATOM 431 CG LYS A 27 -1.367 -8.677 -9.914 1.00 0.00 C ATOM 432 CD LYS A 27 -1.232 -9.073 -8.452 1.00 0.00 C ATOM 433 CE LYS A 27 -1.335 -10.578 -8.270 1.00 0.00 C ATOM 434 NZ LYS A 27 0.002 -11.211 -8.099 1.00 0.00 N ATOM 0 H LYS A 27 -3.022 -7.040 -12.377 1.00 0.00 H new ATOM 0 HA LYS A 27 -3.940 -8.343 -9.944 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -1.555 -6.767 -10.859 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -1.918 -6.758 -9.144 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -1.940 -9.437 -10.446 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -0.380 -8.641 -10.375 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -0.274 -8.724 -8.067 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -2.009 -8.581 -7.868 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -1.954 -10.797 -7.400 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -1.835 -11.015 -9.135 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -0.113 -12.238 -7.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 0.584 -11.025 -8.940 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 0.469 -10.814 -7.259 1.00 0.00 H new ATOM 448 N ARG A 28 -4.420 -5.175 -10.551 1.00 0.00 N ATOM 449 CA ARG A 28 -5.102 -3.971 -10.094 1.00 0.00 C ATOM 450 C ARG A 28 -6.615 -4.167 -10.031 1.00 0.00 C ATOM 451 O ARG A 28 -7.310 -3.448 -9.320 1.00 0.00 O ATOM 452 CB ARG A 28 -4.774 -2.803 -11.017 1.00 0.00 C ATOM 453 CG ARG A 28 -5.339 -1.496 -10.532 1.00 0.00 C ATOM 454 CD ARG A 28 -6.621 -1.156 -11.246 1.00 0.00 C ATOM 455 NE ARG A 28 -6.385 -0.570 -12.564 1.00 0.00 N ATOM 456 CZ ARG A 28 -7.270 0.185 -13.210 1.00 0.00 C ATOM 457 NH1 ARG A 28 -8.453 0.447 -12.667 1.00 0.00 N ATOM 458 NH2 ARG A 28 -6.973 0.680 -14.404 1.00 0.00 N ATOM 0 H ARG A 28 -4.066 -5.121 -11.506 1.00 0.00 H new ATOM 0 HA ARG A 28 -4.749 -3.755 -9.086 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -3.692 -2.713 -11.110 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -5.163 -3.014 -12.013 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -5.522 -1.552 -9.459 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -4.610 -0.701 -10.690 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -7.224 -2.058 -11.355 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -7.198 -0.458 -10.639 1.00 0.00 H new ATOM 0 HE ARG A 28 -5.488 -0.751 -13.016 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -8.688 0.069 -11.749 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -9.127 1.026 -13.168 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -6.066 0.482 -14.827 1.00 0.00 H new ATOM 0 HH22 ARG A 28 -7.651 1.259 -14.899 1.00 0.00 H new ATOM 472 N LYS A 29 -7.120 -5.140 -10.782 1.00 0.00 N ATOM 473 CA LYS A 29 -8.552 -5.428 -10.822 1.00 0.00 C ATOM 474 C LYS A 29 -9.166 -5.415 -9.427 1.00 0.00 C ATOM 475 O LYS A 29 -10.303 -4.980 -9.243 1.00 0.00 O ATOM 476 CB LYS A 29 -8.794 -6.780 -11.488 1.00 0.00 C ATOM 477 CG LYS A 29 -9.141 -6.670 -12.962 1.00 0.00 C ATOM 478 CD LYS A 29 -9.889 -7.897 -13.442 1.00 0.00 C ATOM 479 CE LYS A 29 -10.090 -7.875 -14.949 1.00 0.00 C ATOM 480 NZ LYS A 29 -11.480 -8.251 -15.329 1.00 0.00 N ATOM 0 H LYS A 29 -6.555 -5.747 -11.376 1.00 0.00 H new ATOM 0 HA LYS A 29 -9.035 -4.644 -11.406 1.00 0.00 H new ATOM 0 HB2 LYS A 29 -7.902 -7.397 -11.377 1.00 0.00 H new ATOM 0 HB3 LYS A 29 -9.603 -7.293 -10.969 1.00 0.00 H new ATOM 0 HG2 LYS A 29 -9.749 -5.781 -13.130 1.00 0.00 H new ATOM 0 HG3 LYS A 29 -8.228 -6.546 -13.545 1.00 0.00 H new ATOM 0 HD2 LYS A 29 -9.337 -8.794 -13.161 1.00 0.00 H new ATOM 0 HD3 LYS A 29 -10.858 -7.951 -12.946 1.00 0.00 H new ATOM 0 HE2 LYS A 29 -9.866 -6.879 -15.331 1.00 0.00 H new ATOM 0 HE3 LYS A 29 -9.387 -8.562 -15.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 -11.576 -8.224 -16.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 -11.686 -9.211 -14.987 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 -12.150 -7.580 -14.901 1.00 0.00 H new ATOM 494 N LEU A 30 -8.408 -5.891 -8.447 1.00 0.00 N ATOM 495 CA LEU A 30 -8.882 -5.929 -7.073 1.00 0.00 C ATOM 496 C LEU A 30 -8.230 -4.822 -6.253 1.00 0.00 C ATOM 497 O LEU A 30 -8.896 -4.113 -5.500 1.00 0.00 O ATOM 498 CB LEU A 30 -8.580 -7.294 -6.453 1.00 0.00 C ATOM 499 CG LEU A 30 -8.830 -8.492 -7.373 1.00 0.00 C ATOM 500 CD1 LEU A 30 -7.811 -9.592 -7.114 1.00 0.00 C ATOM 501 CD2 LEU A 30 -10.246 -9.016 -7.187 1.00 0.00 C ATOM 0 H LEU A 30 -7.464 -6.255 -8.580 1.00 0.00 H new ATOM 0 HA LEU A 30 -9.960 -5.770 -7.071 1.00 0.00 H new ATOM 0 HB2 LEU A 30 -7.537 -7.310 -6.136 1.00 0.00 H new ATOM 0 HB3 LEU A 30 -9.188 -7.411 -5.556 1.00 0.00 H new ATOM 0 HG LEU A 30 -8.717 -8.163 -8.406 1.00 0.00 H new ATOM 0 HD11 LEU A 30 -8.007 -10.434 -7.778 1.00 0.00 H new ATOM 0 HD12 LEU A 30 -6.807 -9.209 -7.300 1.00 0.00 H new ATOM 0 HD13 LEU A 30 -7.887 -9.922 -6.078 1.00 0.00 H new ATOM 0 HD21 LEU A 30 -10.409 -9.868 -7.848 1.00 0.00 H new ATOM 0 HD22 LEU A 30 -10.385 -9.328 -6.152 1.00 0.00 H new ATOM 0 HD23 LEU A 30 -10.960 -8.228 -7.428 1.00 0.00 H new ATOM 513 N ALA A 31 -6.921 -4.681 -6.414 1.00 0.00 N ATOM 514 CA ALA A 31 -6.160 -3.665 -5.701 1.00 0.00 C ATOM 515 C ALA A 31 -6.610 -2.253 -6.073 1.00 0.00 C ATOM 516 O ALA A 31 -6.253 -1.287 -5.400 1.00 0.00 O ATOM 517 CB ALA A 31 -4.675 -3.832 -5.982 1.00 0.00 C ATOM 0 H ALA A 31 -6.361 -5.263 -7.037 1.00 0.00 H new ATOM 0 HA ALA A 31 -6.345 -3.800 -4.635 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -4.115 -3.067 -5.444 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -4.351 -4.819 -5.652 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -4.493 -3.730 -7.052 1.00 0.00 H new ATOM 523 N ALA A 32 -7.372 -2.129 -7.158 1.00 0.00 N ATOM 524 CA ALA A 32 -7.831 -0.821 -7.616 1.00 0.00 C ATOM 525 C ALA A 32 -8.547 -0.034 -6.521 1.00 0.00 C ATOM 526 O ALA A 32 -8.291 1.158 -6.351 1.00 0.00 O ATOM 527 CB ALA A 32 -8.748 -0.970 -8.819 1.00 0.00 C ATOM 0 H ALA A 32 -7.682 -2.913 -7.732 1.00 0.00 H new ATOM 0 HA ALA A 32 -6.941 -0.259 -7.897 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -9.081 0.015 -9.147 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -8.208 -1.459 -9.630 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -9.614 -1.572 -8.544 1.00 0.00 H new ATOM 533 N HIS A 33 -9.452 -0.679 -5.786 1.00 0.00 N ATOM 534 CA HIS A 33 -10.185 0.021 -4.731 1.00 0.00 C ATOM 535 C HIS A 33 -11.216 -0.876 -4.041 1.00 0.00 C ATOM 536 O HIS A 33 -11.035 -1.283 -2.893 1.00 0.00 O ATOM 537 CB HIS A 33 -10.877 1.259 -5.327 1.00 0.00 C ATOM 538 CG HIS A 33 -12.123 1.687 -4.608 1.00 0.00 C ATOM 539 ND1 HIS A 33 -13.256 2.123 -5.264 1.00 0.00 N ATOM 540 CD2 HIS A 33 -12.414 1.739 -3.286 1.00 0.00 C ATOM 541 CE1 HIS A 33 -14.187 2.425 -4.377 1.00 0.00 C ATOM 542 NE2 HIS A 33 -13.702 2.200 -3.171 1.00 0.00 N ATOM 0 H HIS A 33 -9.692 -1.664 -5.897 1.00 0.00 H new ATOM 0 HA HIS A 33 -9.465 0.321 -3.970 1.00 0.00 H new ATOM 0 HB2 HIS A 33 -10.170 2.089 -5.327 1.00 0.00 H new ATOM 0 HB3 HIS A 33 -11.127 1.053 -6.368 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -11.756 1.468 -2.474 1.00 0.00 H new ATOM 0 HE1 HIS A 33 -15.177 2.794 -4.601 1.00 0.00 H new ATOM 0 HE2 HIS A 33 -14.203 2.345 -2.295 1.00 0.00 H new ATOM 551 N ASP A 34 -12.312 -1.143 -4.742 1.00 0.00 N ATOM 552 CA ASP A 34 -13.406 -1.948 -4.210 1.00 0.00 C ATOM 553 C ASP A 34 -12.923 -3.251 -3.587 1.00 0.00 C ATOM 554 O ASP A 34 -13.310 -3.589 -2.468 1.00 0.00 O ATOM 555 CB ASP A 34 -14.420 -2.250 -5.314 1.00 0.00 C ATOM 556 CG ASP A 34 -15.009 -0.991 -5.919 1.00 0.00 C ATOM 557 OD1 ASP A 34 -14.243 -0.206 -6.517 1.00 0.00 O ATOM 558 OD2 ASP A 34 -16.235 -0.790 -5.795 1.00 0.00 O ATOM 0 H ASP A 34 -12.467 -0.809 -5.693 1.00 0.00 H new ATOM 0 HA ASP A 34 -13.877 -1.363 -3.420 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -13.937 -2.834 -6.097 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -15.223 -2.864 -4.907 1.00 0.00 H new ATOM 563 N ASN A 35 -12.099 -3.993 -4.314 1.00 0.00 N ATOM 564 CA ASN A 35 -11.604 -5.264 -3.813 1.00 0.00 C ATOM 565 C ASN A 35 -10.175 -5.147 -3.295 1.00 0.00 C ATOM 566 O ASN A 35 -9.264 -5.804 -3.799 1.00 0.00 O ATOM 567 CB ASN A 35 -11.686 -6.345 -4.895 1.00 0.00 C ATOM 568 CG ASN A 35 -12.920 -6.207 -5.768 1.00 0.00 C ATOM 569 OD1 ASN A 35 -13.923 -6.888 -5.556 1.00 0.00 O ATOM 570 ND2 ASN A 35 -12.850 -5.323 -6.757 1.00 0.00 N ATOM 0 H ASN A 35 -11.763 -3.739 -5.243 1.00 0.00 H new ATOM 0 HA ASN A 35 -12.242 -5.553 -2.978 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -10.795 -6.295 -5.521 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -11.688 -7.327 -4.422 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -13.648 -5.187 -7.377 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -11.998 -4.780 -6.896 1.00 0.00 H new ATOM 577 N LEU A 36 -9.987 -4.314 -2.278 1.00 0.00 N ATOM 578 CA LEU A 36 -8.668 -4.121 -1.688 1.00 0.00 C ATOM 579 C LEU A 36 -8.687 -4.438 -0.195 1.00 0.00 C ATOM 580 O LEU A 36 -9.353 -3.761 0.589 1.00 0.00 O ATOM 581 CB LEU A 36 -8.190 -2.685 -1.920 1.00 0.00 C ATOM 582 CG LEU A 36 -6.906 -2.298 -1.183 1.00 0.00 C ATOM 583 CD1 LEU A 36 -5.731 -3.119 -1.692 1.00 0.00 C ATOM 584 CD2 LEU A 36 -6.629 -0.811 -1.343 1.00 0.00 C ATOM 0 H LEU A 36 -10.729 -3.763 -1.846 1.00 0.00 H new ATOM 0 HA LEU A 36 -7.973 -4.807 -2.172 1.00 0.00 H new ATOM 0 HB2 LEU A 36 -8.034 -2.539 -2.989 1.00 0.00 H new ATOM 0 HB3 LEU A 36 -8.984 -2.002 -1.617 1.00 0.00 H new ATOM 0 HG LEU A 36 -7.039 -2.511 -0.122 1.00 0.00 H new ATOM 0 HD11 LEU A 36 -4.826 -2.830 -1.157 1.00 0.00 H new ATOM 0 HD12 LEU A 36 -5.928 -4.178 -1.526 1.00 0.00 H new ATOM 0 HD13 LEU A 36 -5.595 -2.938 -2.758 1.00 0.00 H new ATOM 0 HD21 LEU A 36 -5.712 -0.553 -0.813 1.00 0.00 H new ATOM 0 HD22 LEU A 36 -6.516 -0.574 -2.401 1.00 0.00 H new ATOM 0 HD23 LEU A 36 -7.460 -0.240 -0.930 1.00 0.00 H new ATOM 596 N LYS A 37 -7.940 -5.468 0.187 1.00 0.00 N ATOM 597 CA LYS A 37 -7.849 -5.883 1.581 1.00 0.00 C ATOM 598 C LYS A 37 -6.430 -5.705 2.079 1.00 0.00 C ATOM 599 O LYS A 37 -5.496 -6.332 1.585 1.00 0.00 O ATOM 600 CB LYS A 37 -8.293 -7.339 1.734 1.00 0.00 C ATOM 601 CG LYS A 37 -8.041 -7.927 3.115 1.00 0.00 C ATOM 602 CD LYS A 37 -8.609 -7.041 4.212 1.00 0.00 C ATOM 603 CE LYS A 37 -10.094 -6.778 4.011 1.00 0.00 C ATOM 604 NZ LYS A 37 -10.887 -7.097 5.230 1.00 0.00 N ATOM 0 H LYS A 37 -7.385 -6.034 -0.455 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.512 -5.259 2.180 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -9.358 -7.408 1.511 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -7.773 -7.945 0.993 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -8.491 -8.918 3.177 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -6.969 -8.054 3.267 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -8.451 -7.515 5.181 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -8.071 -6.093 4.230 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -10.244 -5.732 3.744 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -10.458 -7.375 3.175 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -11.899 -7.117 4.990 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -10.599 -8.026 5.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.717 -6.370 5.954 1.00 0.00 H new ATOM 618 N LEU A 38 -6.286 -4.835 3.056 1.00 0.00 N ATOM 619 CA LEU A 38 -4.994 -4.541 3.640 1.00 0.00 C ATOM 620 C LEU A 38 -4.926 -5.130 5.046 1.00 0.00 C ATOM 621 O LEU A 38 -5.654 -4.709 5.934 1.00 0.00 O ATOM 622 CB LEU A 38 -4.801 -3.015 3.656 1.00 0.00 C ATOM 623 CG LEU A 38 -3.365 -2.486 3.427 1.00 0.00 C ATOM 624 CD1 LEU A 38 -2.473 -3.524 2.754 1.00 0.00 C ATOM 625 CD2 LEU A 38 -3.389 -1.210 2.589 1.00 0.00 C ATOM 0 H LEU A 38 -7.059 -4.312 3.467 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.192 -4.989 3.053 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -5.447 -2.584 2.891 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.151 -2.639 4.617 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.946 -2.268 4.410 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -1.475 -3.109 2.613 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -2.411 -4.413 3.382 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -2.894 -3.793 1.785 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -2.370 -0.854 2.439 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -3.846 -1.418 1.622 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -3.968 -0.445 3.107 1.00 0.00 H new ATOM 637 N THR A 39 -4.076 -6.133 5.237 1.00 0.00 N ATOM 638 CA THR A 39 -3.960 -6.786 6.539 1.00 0.00 C ATOM 639 C THR A 39 -2.704 -6.345 7.282 1.00 0.00 C ATOM 640 O THR A 39 -1.707 -5.960 6.671 1.00 0.00 O ATOM 641 CB THR A 39 -3.961 -8.306 6.376 1.00 0.00 C ATOM 642 OG1 THR A 39 -5.097 -8.730 5.644 1.00 0.00 O ATOM 643 CG2 THR A 39 -3.962 -9.049 7.694 1.00 0.00 C ATOM 0 H THR A 39 -3.462 -6.510 4.515 1.00 0.00 H new ATOM 0 HA THR A 39 -4.824 -6.486 7.132 1.00 0.00 H new ATOM 0 HB THR A 39 -3.038 -8.541 5.846 1.00 0.00 H new ATOM 0 HG1 THR A 39 -4.878 -8.760 4.689 1.00 0.00 H new ATOM 0 HG21 THR A 39 -3.963 -10.123 7.506 1.00 0.00 H new ATOM 0 HG22 THR A 39 -3.072 -8.781 8.264 1.00 0.00 H new ATOM 0 HG23 THR A 39 -4.852 -8.780 8.263 1.00 0.00 H new ATOM 651 N ILE A 40 -2.768 -6.408 8.609 1.00 0.00 N ATOM 652 CA ILE A 40 -1.647 -6.021 9.456 1.00 0.00 C ATOM 653 C ILE A 40 -1.415 -7.051 10.559 1.00 0.00 C ATOM 654 O ILE A 40 -2.352 -7.462 11.243 1.00 0.00 O ATOM 655 CB ILE A 40 -1.886 -4.640 10.100 1.00 0.00 C ATOM 656 CG1 ILE A 40 -2.193 -3.597 9.024 1.00 0.00 C ATOM 657 CG2 ILE A 40 -0.677 -4.218 10.924 1.00 0.00 C ATOM 658 CD1 ILE A 40 -2.660 -2.271 9.584 1.00 0.00 C ATOM 0 H ILE A 40 -3.590 -6.726 9.122 1.00 0.00 H new ATOM 0 HA ILE A 40 -0.765 -5.970 8.818 1.00 0.00 H new ATOM 0 HB ILE A 40 -2.746 -4.713 10.766 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -1.299 -3.434 8.422 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -2.959 -3.990 8.356 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -0.864 -3.241 11.371 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -0.501 -4.950 11.712 1.00 0.00 H new ATOM 0 HG23 ILE A 40 0.200 -4.160 10.280 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -2.859 -1.580 8.765 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -3.572 -2.421 10.162 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -1.886 -1.856 10.229 1.00 0.00 H new ATOM 670 N THR A 41 -0.161 -7.461 10.729 1.00 0.00 N ATOM 671 CA THR A 41 0.190 -8.441 11.752 1.00 0.00 C ATOM 672 C THR A 41 1.268 -7.891 12.681 1.00 0.00 C ATOM 673 O THR A 41 2.013 -6.983 12.313 1.00 0.00 O ATOM 674 CB THR A 41 0.672 -9.738 11.104 1.00 0.00 C ATOM 675 OG1 THR A 41 -0.114 -10.053 9.968 1.00 0.00 O ATOM 676 CG2 THR A 41 0.623 -10.928 12.039 1.00 0.00 C ATOM 0 H THR A 41 0.627 -7.130 10.173 1.00 0.00 H new ATOM 0 HA THR A 41 -0.703 -8.650 12.342 1.00 0.00 H new ATOM 0 HB THR A 41 1.710 -9.555 10.828 1.00 0.00 H new ATOM 0 HG1 THR A 41 0.093 -9.427 9.243 1.00 0.00 H new ATOM 0 HG21 THR A 41 0.978 -11.816 11.516 1.00 0.00 H new ATOM 0 HG22 THR A 41 1.258 -10.737 12.904 1.00 0.00 H new ATOM 0 HG23 THR A 41 -0.403 -11.088 12.371 1.00 0.00 H new ATOM 684 N GLN A 42 1.343 -8.444 13.888 1.00 0.00 N ATOM 685 CA GLN A 42 2.327 -8.002 14.871 1.00 0.00 C ATOM 686 C GLN A 42 3.391 -9.069 15.110 1.00 0.00 C ATOM 687 O GLN A 42 3.100 -10.146 15.630 1.00 0.00 O ATOM 688 CB GLN A 42 1.638 -7.651 16.191 1.00 0.00 C ATOM 689 CG GLN A 42 2.321 -6.528 16.954 1.00 0.00 C ATOM 690 CD GLN A 42 1.650 -5.186 16.739 1.00 0.00 C ATOM 691 OE1 GLN A 42 1.883 -4.515 15.733 1.00 0.00 O ATOM 692 NE2 GLN A 42 0.810 -4.786 17.686 1.00 0.00 N ATOM 0 H GLN A 42 0.735 -9.198 14.209 1.00 0.00 H new ATOM 0 HA GLN A 42 2.818 -7.114 14.473 1.00 0.00 H new ATOM 0 HB2 GLN A 42 0.606 -7.366 15.988 1.00 0.00 H new ATOM 0 HB3 GLN A 42 1.605 -8.540 16.821 1.00 0.00 H new ATOM 0 HG2 GLN A 42 2.321 -6.764 18.018 1.00 0.00 H new ATOM 0 HG3 GLN A 42 3.363 -6.463 16.642 1.00 0.00 H new ATOM 0 HE21 GLN A 42 0.646 -5.373 18.504 1.00 0.00 H new ATOM 0 HE22 GLN A 42 0.329 -3.891 17.596 1.00 0.00 H new ATOM 701 N GLU A 43 4.626 -8.754 14.736 1.00 0.00 N ATOM 702 CA GLU A 43 5.745 -9.673 14.915 1.00 0.00 C ATOM 703 C GLU A 43 7.031 -8.900 15.173 1.00 0.00 C ATOM 704 O GLU A 43 7.751 -8.546 14.241 1.00 0.00 O ATOM 705 CB GLU A 43 5.919 -10.560 13.684 1.00 0.00 C ATOM 706 CG GLU A 43 4.624 -11.182 13.186 1.00 0.00 C ATOM 707 CD GLU A 43 4.077 -12.229 14.136 1.00 0.00 C ATOM 708 OE1 GLU A 43 4.475 -12.223 15.320 1.00 0.00 O ATOM 709 OE2 GLU A 43 3.250 -13.056 13.696 1.00 0.00 O ATOM 0 H GLU A 43 4.879 -7.865 14.305 1.00 0.00 H new ATOM 0 HA GLU A 43 5.528 -10.305 15.776 1.00 0.00 H new ATOM 0 HB2 GLU A 43 6.359 -9.968 12.881 1.00 0.00 H new ATOM 0 HB3 GLU A 43 6.626 -11.356 13.918 1.00 0.00 H new ATOM 0 HG2 GLU A 43 3.879 -10.399 13.047 1.00 0.00 H new ATOM 0 HG3 GLU A 43 4.795 -11.636 12.210 1.00 0.00 H new ATOM 716 N GLY A 44 7.311 -8.631 16.442 1.00 0.00 N ATOM 717 CA GLY A 44 8.508 -7.887 16.790 1.00 0.00 C ATOM 718 C GLY A 44 8.576 -6.559 16.059 1.00 0.00 C ATOM 719 O GLY A 44 7.559 -5.884 15.905 1.00 0.00 O ATOM 0 H GLY A 44 6.734 -8.913 17.234 1.00 0.00 H new ATOM 0 HA2 GLY A 44 8.528 -7.712 17.866 1.00 0.00 H new ATOM 0 HA3 GLY A 44 9.389 -8.481 16.548 1.00 0.00 H new ATOM 723 N ASN A 45 9.763 -6.184 15.589 1.00 0.00 N ATOM 724 CA ASN A 45 9.919 -4.933 14.855 1.00 0.00 C ATOM 725 C ASN A 45 9.472 -5.094 13.405 1.00 0.00 C ATOM 726 O ASN A 45 9.586 -4.164 12.607 1.00 0.00 O ATOM 727 CB ASN A 45 11.372 -4.448 14.894 1.00 0.00 C ATOM 728 CG ASN A 45 12.373 -5.573 14.709 1.00 0.00 C ATOM 729 OD1 ASN A 45 12.053 -6.618 14.142 1.00 0.00 O ATOM 730 ND2 ASN A 45 13.593 -5.364 15.189 1.00 0.00 N ATOM 0 H ASN A 45 10.622 -6.722 15.702 1.00 0.00 H new ATOM 0 HA ASN A 45 9.288 -4.189 15.340 1.00 0.00 H new ATOM 0 HB2 ASN A 45 11.522 -3.702 14.113 1.00 0.00 H new ATOM 0 HB3 ASN A 45 11.560 -3.954 15.847 1.00 0.00 H new ATOM 0 HD21 ASN A 45 14.309 -6.085 15.095 1.00 0.00 H new ATOM 0 HD22 ASN A 45 13.815 -4.483 15.652 1.00 0.00 H new ATOM 737 N LYS A 46 8.965 -6.279 13.061 1.00 0.00 N ATOM 738 CA LYS A 46 8.513 -6.541 11.701 1.00 0.00 C ATOM 739 C LYS A 46 7.007 -6.782 11.652 1.00 0.00 C ATOM 740 O LYS A 46 6.447 -7.491 12.487 1.00 0.00 O ATOM 741 CB LYS A 46 9.282 -7.731 11.102 1.00 0.00 C ATOM 742 CG LYS A 46 8.417 -8.933 10.754 1.00 0.00 C ATOM 743 CD LYS A 46 9.256 -10.157 10.421 1.00 0.00 C ATOM 744 CE LYS A 46 10.248 -9.872 9.304 1.00 0.00 C ATOM 745 NZ LYS A 46 11.615 -9.603 9.829 1.00 0.00 N ATOM 0 H LYS A 46 8.859 -7.065 13.703 1.00 0.00 H new ATOM 0 HA LYS A 46 8.721 -5.657 11.099 1.00 0.00 H new ATOM 0 HB2 LYS A 46 9.797 -7.398 10.201 1.00 0.00 H new ATOM 0 HB3 LYS A 46 10.049 -8.045 11.810 1.00 0.00 H new ATOM 0 HG2 LYS A 46 7.758 -9.161 11.592 1.00 0.00 H new ATOM 0 HG3 LYS A 46 7.779 -8.688 9.905 1.00 0.00 H new ATOM 0 HD2 LYS A 46 9.794 -10.483 11.311 1.00 0.00 H new ATOM 0 HD3 LYS A 46 8.602 -10.977 10.126 1.00 0.00 H new ATOM 0 HE2 LYS A 46 10.282 -10.722 8.623 1.00 0.00 H new ATOM 0 HE3 LYS A 46 9.906 -9.014 8.725 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 12.087 -8.901 9.224 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 11.548 -9.235 10.800 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 12.166 -10.485 9.830 1.00 0.00 H new ATOM 759 N PHE A 47 6.362 -6.185 10.657 1.00 0.00 N ATOM 760 CA PHE A 47 4.924 -6.326 10.475 1.00 0.00 C ATOM 761 C PHE A 47 4.633 -7.189 9.253 1.00 0.00 C ATOM 762 O PHE A 47 5.336 -7.112 8.247 1.00 0.00 O ATOM 763 CB PHE A 47 4.273 -4.952 10.287 1.00 0.00 C ATOM 764 CG PHE A 47 4.139 -4.136 11.549 1.00 0.00 C ATOM 765 CD1 PHE A 47 4.859 -4.454 12.692 1.00 0.00 C ATOM 766 CD2 PHE A 47 3.293 -3.039 11.584 1.00 0.00 C ATOM 767 CE1 PHE A 47 4.736 -3.696 13.840 1.00 0.00 C ATOM 768 CE2 PHE A 47 3.167 -2.277 12.731 1.00 0.00 C ATOM 769 CZ PHE A 47 3.890 -2.606 13.860 1.00 0.00 C ATOM 0 H PHE A 47 6.816 -5.595 9.960 1.00 0.00 H new ATOM 0 HA PHE A 47 4.511 -6.802 11.364 1.00 0.00 H new ATOM 0 HB2 PHE A 47 4.859 -4.384 9.565 1.00 0.00 H new ATOM 0 HB3 PHE A 47 3.282 -5.091 9.855 1.00 0.00 H new ATOM 0 HD1 PHE A 47 5.524 -5.305 12.684 1.00 0.00 H new ATOM 0 HD2 PHE A 47 2.725 -2.776 10.704 1.00 0.00 H new ATOM 0 HE1 PHE A 47 5.302 -3.956 14.722 1.00 0.00 H new ATOM 0 HE2 PHE A 47 2.503 -1.425 12.744 1.00 0.00 H new ATOM 0 HZ PHE A 47 3.794 -2.012 14.757 1.00 0.00 H new ATOM 779 N THR A 48 3.595 -8.011 9.343 1.00 0.00 N ATOM 780 CA THR A 48 3.222 -8.886 8.237 1.00 0.00 C ATOM 781 C THR A 48 2.035 -8.316 7.470 1.00 0.00 C ATOM 782 O THR A 48 0.959 -8.113 8.033 1.00 0.00 O ATOM 783 CB THR A 48 2.889 -10.287 8.751 1.00 0.00 C ATOM 784 OG1 THR A 48 3.563 -10.547 9.970 1.00 0.00 O ATOM 785 CG2 THR A 48 3.259 -11.385 7.778 1.00 0.00 C ATOM 0 H THR A 48 2.998 -8.091 10.166 1.00 0.00 H new ATOM 0 HA THR A 48 4.073 -8.952 7.559 1.00 0.00 H new ATOM 0 HB THR A 48 1.808 -10.295 8.888 1.00 0.00 H new ATOM 0 HG1 THR A 48 3.336 -11.447 10.284 1.00 0.00 H new ATOM 0 HG21 THR A 48 2.996 -12.353 8.205 1.00 0.00 H new ATOM 0 HG22 THR A 48 2.717 -11.241 6.844 1.00 0.00 H new ATOM 0 HG23 THR A 48 4.331 -11.353 7.584 1.00 0.00 H new ATOM 793 N VAL A 49 2.238 -8.059 6.183 1.00 0.00 N ATOM 794 CA VAL A 49 1.185 -7.510 5.339 1.00 0.00 C ATOM 795 C VAL A 49 0.507 -8.602 4.522 1.00 0.00 C ATOM 796 O VAL A 49 1.149 -9.283 3.723 1.00 0.00 O ATOM 797 CB VAL A 49 1.730 -6.441 4.376 1.00 0.00 C ATOM 798 CG1 VAL A 49 0.589 -5.724 3.671 1.00 0.00 C ATOM 799 CG2 VAL A 49 2.611 -5.452 5.121 1.00 0.00 C ATOM 0 H VAL A 49 3.122 -8.222 5.702 1.00 0.00 H new ATOM 0 HA VAL A 49 0.458 -7.051 6.009 1.00 0.00 H new ATOM 0 HB VAL A 49 2.338 -6.937 3.619 1.00 0.00 H new ATOM 0 HG11 VAL A 49 0.995 -4.972 2.994 1.00 0.00 H new ATOM 0 HG12 VAL A 49 0.002 -6.445 3.102 1.00 0.00 H new ATOM 0 HG13 VAL A 49 -0.049 -5.240 4.411 1.00 0.00 H new ATOM 0 HG21 VAL A 49 2.988 -4.703 4.424 1.00 0.00 H new ATOM 0 HG22 VAL A 49 2.028 -4.961 5.901 1.00 0.00 H new ATOM 0 HG23 VAL A 49 3.450 -5.981 5.573 1.00 0.00 H new ATOM 809 N LYS A 50 -0.795 -8.756 4.722 1.00 0.00 N ATOM 810 CA LYS A 50 -1.565 -9.758 3.996 1.00 0.00 C ATOM 811 C LYS A 50 -2.642 -9.091 3.149 1.00 0.00 C ATOM 812 O LYS A 50 -3.596 -8.520 3.677 1.00 0.00 O ATOM 813 CB LYS A 50 -2.202 -10.751 4.971 1.00 0.00 C ATOM 814 CG LYS A 50 -2.137 -12.194 4.498 1.00 0.00 C ATOM 815 CD LYS A 50 -2.758 -13.141 5.512 1.00 0.00 C ATOM 816 CE LYS A 50 -1.805 -13.431 6.660 1.00 0.00 C ATOM 817 NZ LYS A 50 -0.750 -14.408 6.273 1.00 0.00 N ATOM 0 H LYS A 50 -1.340 -8.200 5.381 1.00 0.00 H new ATOM 0 HA LYS A 50 -0.888 -10.301 3.336 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -1.702 -10.671 5.936 1.00 0.00 H new ATOM 0 HB3 LYS A 50 -3.245 -10.475 5.128 1.00 0.00 H new ATOM 0 HG2 LYS A 50 -2.656 -12.289 3.544 1.00 0.00 H new ATOM 0 HG3 LYS A 50 -1.098 -12.475 4.325 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -3.678 -12.705 5.902 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -3.031 -14.074 5.020 1.00 0.00 H new ATOM 0 HE2 LYS A 50 -1.337 -12.502 6.987 1.00 0.00 H new ATOM 0 HE3 LYS A 50 -2.367 -13.821 7.509 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 -0.173 -14.643 7.105 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 -1.196 -15.273 5.905 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 -0.144 -13.991 5.538 1.00 0.00 H new ATOM 831 N GLU A 51 -2.483 -9.162 1.834 1.00 0.00 N ATOM 832 CA GLU A 51 -3.442 -8.559 0.920 1.00 0.00 C ATOM 833 C GLU A 51 -4.441 -9.594 0.415 1.00 0.00 C ATOM 834 O GLU A 51 -4.064 -10.576 -0.224 1.00 0.00 O ATOM 835 CB GLU A 51 -2.719 -7.903 -0.258 1.00 0.00 C ATOM 836 CG GLU A 51 -2.854 -6.389 -0.285 1.00 0.00 C ATOM 837 CD GLU A 51 -1.524 -5.688 -0.482 1.00 0.00 C ATOM 838 OE1 GLU A 51 -0.623 -5.876 0.362 1.00 0.00 O ATOM 839 OE2 GLU A 51 -1.384 -4.951 -1.480 1.00 0.00 O ATOM 0 H GLU A 51 -1.700 -9.630 1.378 1.00 0.00 H new ATOM 0 HA GLU A 51 -3.991 -7.792 1.466 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -1.662 -8.165 -0.217 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -3.112 -8.312 -1.189 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -3.534 -6.103 -1.088 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -3.304 -6.051 0.649 1.00 0.00 H new ATOM 846 N SER A 52 -5.715 -9.364 0.708 1.00 0.00 N ATOM 847 CA SER A 52 -6.772 -10.273 0.286 1.00 0.00 C ATOM 848 C SER A 52 -7.512 -9.724 -0.930 1.00 0.00 C ATOM 849 O SER A 52 -7.661 -8.511 -1.087 1.00 0.00 O ATOM 850 CB SER A 52 -7.757 -10.511 1.432 1.00 0.00 C ATOM 851 OG SER A 52 -8.210 -11.854 1.445 1.00 0.00 O ATOM 0 H SER A 52 -6.041 -8.555 1.237 1.00 0.00 H new ATOM 0 HA SER A 52 -6.311 -11.221 0.009 1.00 0.00 H new ATOM 0 HB2 SER A 52 -7.277 -10.277 2.382 1.00 0.00 H new ATOM 0 HB3 SER A 52 -8.608 -9.838 1.330 1.00 0.00 H new ATOM 0 HG SER A 52 -8.837 -11.981 2.188 1.00 0.00 H new ATOM 857 N SER A 53 -7.973 -10.628 -1.787 1.00 0.00 N ATOM 858 CA SER A 53 -8.700 -10.244 -2.990 1.00 0.00 C ATOM 859 C SER A 53 -9.712 -11.318 -3.374 1.00 0.00 C ATOM 860 O SER A 53 -9.945 -12.261 -2.618 1.00 0.00 O ATOM 861 CB SER A 53 -7.727 -10.002 -4.146 1.00 0.00 C ATOM 862 OG SER A 53 -6.405 -9.812 -3.670 1.00 0.00 O ATOM 0 H SER A 53 -7.855 -11.634 -1.670 1.00 0.00 H new ATOM 0 HA SER A 53 -9.238 -9.319 -2.782 1.00 0.00 H new ATOM 0 HB2 SER A 53 -7.752 -10.850 -4.830 1.00 0.00 H new ATOM 0 HB3 SER A 53 -8.042 -9.126 -4.713 1.00 0.00 H new ATOM 0 HG SER A 53 -5.803 -9.661 -4.428 1.00 0.00 H new ATOM 868 N ALA A 54 -10.308 -11.173 -4.552 1.00 0.00 N ATOM 869 CA ALA A 54 -11.292 -12.136 -5.030 1.00 0.00 C ATOM 870 C ALA A 54 -10.676 -13.524 -5.170 1.00 0.00 C ATOM 871 O ALA A 54 -11.017 -14.443 -4.425 1.00 0.00 O ATOM 872 CB ALA A 54 -11.879 -11.679 -6.357 1.00 0.00 C ATOM 0 H ALA A 54 -10.127 -10.400 -5.192 1.00 0.00 H new ATOM 0 HA ALA A 54 -12.094 -12.195 -4.294 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -12.612 -12.409 -6.701 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -12.364 -10.711 -6.227 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -11.082 -11.589 -7.096 1.00 0.00 H new ATOM 878 N PHE A 55 -9.769 -13.671 -6.131 1.00 0.00 N ATOM 879 CA PHE A 55 -9.108 -14.950 -6.369 1.00 0.00 C ATOM 880 C PHE A 55 -7.593 -14.834 -6.201 1.00 0.00 C ATOM 881 O PHE A 55 -6.921 -15.812 -5.877 1.00 0.00 O ATOM 882 CB PHE A 55 -9.436 -15.462 -7.772 1.00 0.00 C ATOM 883 CG PHE A 55 -9.258 -14.427 -8.846 1.00 0.00 C ATOM 884 CD1 PHE A 55 -10.242 -13.481 -9.085 1.00 0.00 C ATOM 885 CD2 PHE A 55 -8.106 -14.400 -9.616 1.00 0.00 C ATOM 886 CE1 PHE A 55 -10.080 -12.528 -10.072 1.00 0.00 C ATOM 887 CE2 PHE A 55 -7.939 -13.449 -10.604 1.00 0.00 C ATOM 888 CZ PHE A 55 -8.928 -12.511 -10.833 1.00 0.00 C ATOM 0 H PHE A 55 -9.475 -12.921 -6.757 1.00 0.00 H new ATOM 0 HA PHE A 55 -9.479 -15.659 -5.629 1.00 0.00 H new ATOM 0 HB2 PHE A 55 -8.800 -16.318 -7.995 1.00 0.00 H new ATOM 0 HB3 PHE A 55 -10.466 -15.817 -7.789 1.00 0.00 H new ATOM 0 HD1 PHE A 55 -11.145 -13.489 -8.493 1.00 0.00 H new ATOM 0 HD2 PHE A 55 -7.330 -15.131 -9.442 1.00 0.00 H new ATOM 0 HE1 PHE A 55 -10.854 -11.796 -10.248 1.00 0.00 H new ATOM 0 HE2 PHE A 55 -7.036 -13.438 -11.197 1.00 0.00 H new ATOM 0 HZ PHE A 55 -8.800 -11.767 -11.605 1.00 0.00 H new ATOM 898 N ARG A 56 -7.061 -13.635 -6.425 1.00 0.00 N ATOM 899 CA ARG A 56 -5.626 -13.402 -6.299 1.00 0.00 C ATOM 900 C ARG A 56 -5.222 -13.244 -4.836 1.00 0.00 C ATOM 901 O ARG A 56 -6.069 -13.038 -3.966 1.00 0.00 O ATOM 902 CB ARG A 56 -5.221 -12.156 -7.088 1.00 0.00 C ATOM 903 CG ARG A 56 -5.666 -12.185 -8.542 1.00 0.00 C ATOM 904 CD ARG A 56 -4.629 -11.551 -9.455 1.00 0.00 C ATOM 905 NE ARG A 56 -4.763 -12.009 -10.836 1.00 0.00 N ATOM 906 CZ ARG A 56 -4.527 -13.259 -11.229 1.00 0.00 C ATOM 907 NH1 ARG A 56 -4.145 -14.177 -10.350 1.00 0.00 N ATOM 908 NH2 ARG A 56 -4.674 -13.592 -12.504 1.00 0.00 N ATOM 0 H ARG A 56 -7.601 -12.812 -6.694 1.00 0.00 H new ATOM 0 HA ARG A 56 -5.107 -14.269 -6.707 1.00 0.00 H new ATOM 0 HB2 ARG A 56 -5.645 -11.276 -6.604 1.00 0.00 H new ATOM 0 HB3 ARG A 56 -4.137 -12.049 -7.051 1.00 0.00 H new ATOM 0 HG2 ARG A 56 -5.841 -13.216 -8.849 1.00 0.00 H new ATOM 0 HG3 ARG A 56 -6.614 -11.657 -8.644 1.00 0.00 H new ATOM 0 HD2 ARG A 56 -4.731 -10.466 -9.421 1.00 0.00 H new ATOM 0 HD3 ARG A 56 -3.630 -11.789 -9.089 1.00 0.00 H new ATOM 0 HE ARG A 56 -5.054 -11.331 -11.540 1.00 0.00 H new ATOM 0 HH11 ARG A 56 -4.031 -13.926 -9.368 1.00 0.00 H new ATOM 0 HH12 ARG A 56 -3.966 -15.133 -10.657 1.00 0.00 H new ATOM 0 HH21 ARG A 56 -4.968 -12.891 -13.184 1.00 0.00 H new ATOM 0 HH22 ARG A 56 -4.493 -14.550 -12.805 1.00 0.00 H new ATOM 922 N ASN A 57 -3.923 -13.343 -4.574 1.00 0.00 N ATOM 923 CA ASN A 57 -3.403 -13.211 -3.217 1.00 0.00 C ATOM 924 C ASN A 57 -2.080 -12.452 -3.212 1.00 0.00 C ATOM 925 O ASN A 57 -1.177 -12.753 -3.992 1.00 0.00 O ATOM 926 CB ASN A 57 -3.215 -14.592 -2.585 1.00 0.00 C ATOM 927 CG ASN A 57 -2.479 -15.551 -3.500 1.00 0.00 C ATOM 928 OD1 ASN A 57 -1.377 -15.262 -3.965 1.00 0.00 O ATOM 929 ND2 ASN A 57 -3.088 -16.702 -3.762 1.00 0.00 N ATOM 0 H ASN A 57 -3.210 -13.514 -5.283 1.00 0.00 H new ATOM 0 HA ASN A 57 -4.127 -12.645 -2.630 1.00 0.00 H new ATOM 0 HB2 ASN A 57 -2.663 -14.489 -1.651 1.00 0.00 H new ATOM 0 HB3 ASN A 57 -4.190 -15.010 -2.334 1.00 0.00 H new ATOM 0 HD21 ASN A 57 -2.642 -17.388 -4.371 1.00 0.00 H new ATOM 0 HD22 ASN A 57 -4.002 -16.900 -3.354 1.00 0.00 H new ATOM 936 N ILE A 58 -1.974 -11.465 -2.328 1.00 0.00 N ATOM 937 CA ILE A 58 -0.762 -10.660 -2.220 1.00 0.00 C ATOM 938 C ILE A 58 -0.381 -10.444 -0.761 1.00 0.00 C ATOM 939 O ILE A 58 -1.220 -10.554 0.131 1.00 0.00 O ATOM 940 CB ILE A 58 -0.927 -9.288 -2.909 1.00 0.00 C ATOM 941 CG1 ILE A 58 -1.647 -9.440 -4.254 1.00 0.00 C ATOM 942 CG2 ILE A 58 0.429 -8.627 -3.102 1.00 0.00 C ATOM 943 CD1 ILE A 58 -2.274 -8.155 -4.756 1.00 0.00 C ATOM 0 H ILE A 58 -2.713 -11.203 -1.676 1.00 0.00 H new ATOM 0 HA ILE A 58 0.031 -11.212 -2.725 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.536 -8.651 -2.267 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -0.937 -9.803 -4.997 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -2.423 -10.199 -4.157 1.00 0.00 H new ATOM 0 HG21 ILE A 58 0.297 -7.661 -3.589 1.00 0.00 H new ATOM 0 HG22 ILE A 58 0.905 -8.483 -2.132 1.00 0.00 H new ATOM 0 HG23 ILE A 58 1.059 -9.263 -3.724 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -2.765 -8.339 -5.712 1.00 0.00 H new ATOM 0 HD12 ILE A 58 -3.009 -7.802 -4.032 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -1.500 -7.399 -4.886 1.00 0.00 H new ATOM 955 N GLU A 59 0.891 -10.140 -0.524 1.00 0.00 N ATOM 956 CA GLU A 59 1.381 -9.912 0.831 1.00 0.00 C ATOM 957 C GLU A 59 2.848 -9.495 0.814 1.00 0.00 C ATOM 958 O GLU A 59 3.554 -9.724 -0.167 1.00 0.00 O ATOM 959 CB GLU A 59 1.206 -11.173 1.679 1.00 0.00 C ATOM 960 CG GLU A 59 1.615 -12.450 0.963 1.00 0.00 C ATOM 961 CD GLU A 59 2.302 -13.440 1.883 1.00 0.00 C ATOM 962 OE1 GLU A 59 3.539 -13.349 2.035 1.00 0.00 O ATOM 963 OE2 GLU A 59 1.604 -14.305 2.453 1.00 0.00 O ATOM 0 H GLU A 59 1.600 -10.046 -1.251 1.00 0.00 H new ATOM 0 HA GLU A 59 0.797 -9.104 1.271 1.00 0.00 H new ATOM 0 HB2 GLU A 59 1.796 -11.073 2.590 1.00 0.00 H new ATOM 0 HB3 GLU A 59 0.162 -11.255 1.982 1.00 0.00 H new ATOM 0 HG2 GLU A 59 0.732 -12.917 0.528 1.00 0.00 H new ATOM 0 HG3 GLU A 59 2.283 -12.202 0.138 1.00 0.00 H new ATOM 970 N VAL A 60 3.303 -8.881 1.905 1.00 0.00 N ATOM 971 CA VAL A 60 4.689 -8.435 2.001 1.00 0.00 C ATOM 972 C VAL A 60 5.105 -8.169 3.444 1.00 0.00 C ATOM 973 O VAL A 60 4.706 -7.166 4.035 1.00 0.00 O ATOM 974 CB VAL A 60 4.929 -7.145 1.190 1.00 0.00 C ATOM 975 CG1 VAL A 60 5.075 -7.454 -0.289 1.00 0.00 C ATOM 976 CG2 VAL A 60 3.809 -6.138 1.429 1.00 0.00 C ATOM 0 H VAL A 60 2.735 -8.683 2.729 1.00 0.00 H new ATOM 0 HA VAL A 60 5.290 -9.247 1.592 1.00 0.00 H new ATOM 0 HB VAL A 60 5.862 -6.699 1.533 1.00 0.00 H new ATOM 0 HG11 VAL A 60 5.243 -6.528 -0.839 1.00 0.00 H new ATOM 0 HG12 VAL A 60 5.921 -8.124 -0.439 1.00 0.00 H new ATOM 0 HG13 VAL A 60 4.165 -7.932 -0.652 1.00 0.00 H new ATOM 0 HG21 VAL A 60 4.000 -5.236 0.847 1.00 0.00 H new ATOM 0 HG22 VAL A 60 2.857 -6.573 1.123 1.00 0.00 H new ATOM 0 HG23 VAL A 60 3.768 -5.884 2.488 1.00 0.00 H new ATOM 986 N VAL A 61 5.937 -9.046 4.002 1.00 0.00 N ATOM 987 CA VAL A 61 6.420 -8.853 5.363 1.00 0.00 C ATOM 988 C VAL A 61 7.263 -7.586 5.408 1.00 0.00 C ATOM 989 O VAL A 61 7.911 -7.234 4.423 1.00 0.00 O ATOM 990 CB VAL A 61 7.244 -10.065 5.864 1.00 0.00 C ATOM 991 CG1 VAL A 61 8.522 -9.627 6.573 1.00 0.00 C ATOM 992 CG2 VAL A 61 6.400 -10.935 6.783 1.00 0.00 C ATOM 0 H VAL A 61 6.285 -9.885 3.539 1.00 0.00 H new ATOM 0 HA VAL A 61 5.560 -8.759 6.026 1.00 0.00 H new ATOM 0 HB VAL A 61 7.536 -10.648 4.991 1.00 0.00 H new ATOM 0 HG11 VAL A 61 9.071 -10.506 6.909 1.00 0.00 H new ATOM 0 HG12 VAL A 61 9.142 -9.053 5.884 1.00 0.00 H new ATOM 0 HG13 VAL A 61 8.267 -9.008 7.433 1.00 0.00 H new ATOM 0 HG21 VAL A 61 6.993 -11.783 7.127 1.00 0.00 H new ATOM 0 HG22 VAL A 61 6.074 -10.348 7.642 1.00 0.00 H new ATOM 0 HG23 VAL A 61 5.528 -11.299 6.240 1.00 0.00 H new ATOM 1002 N PHE A 62 7.238 -6.892 6.533 1.00 0.00 N ATOM 1003 CA PHE A 62 7.992 -5.652 6.656 1.00 0.00 C ATOM 1004 C PHE A 62 8.572 -5.466 8.040 1.00 0.00 C ATOM 1005 O PHE A 62 8.200 -6.147 8.992 1.00 0.00 O ATOM 1006 CB PHE A 62 7.099 -4.467 6.307 1.00 0.00 C ATOM 1007 CG PHE A 62 6.707 -4.426 4.861 1.00 0.00 C ATOM 1008 CD1 PHE A 62 7.657 -4.596 3.869 1.00 0.00 C ATOM 1009 CD2 PHE A 62 5.391 -4.211 4.495 1.00 0.00 C ATOM 1010 CE1 PHE A 62 7.306 -4.551 2.539 1.00 0.00 C ATOM 1011 CE2 PHE A 62 5.032 -4.166 3.163 1.00 0.00 C ATOM 1012 CZ PHE A 62 5.993 -4.335 2.183 1.00 0.00 C ATOM 0 H PHE A 62 6.712 -7.159 7.365 1.00 0.00 H new ATOM 0 HA PHE A 62 8.827 -5.709 5.958 1.00 0.00 H new ATOM 0 HB2 PHE A 62 6.198 -4.507 6.920 1.00 0.00 H new ATOM 0 HB3 PHE A 62 7.617 -3.543 6.562 1.00 0.00 H new ATOM 0 HD1 PHE A 62 8.688 -4.766 4.142 1.00 0.00 H new ATOM 0 HD2 PHE A 62 4.638 -4.077 5.258 1.00 0.00 H new ATOM 0 HE1 PHE A 62 8.059 -4.685 1.776 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.001 -3.999 2.886 1.00 0.00 H new ATOM 0 HZ PHE A 62 5.714 -4.298 1.140 1.00 0.00 H new ATOM 1022 N GLU A 63 9.502 -4.531 8.125 1.00 0.00 N ATOM 1023 CA GLU A 63 10.168 -4.221 9.368 1.00 0.00 C ATOM 1024 C GLU A 63 10.572 -2.757 9.396 1.00 0.00 C ATOM 1025 O GLU A 63 11.100 -2.227 8.419 1.00 0.00 O ATOM 1026 CB GLU A 63 11.381 -5.129 9.535 1.00 0.00 C ATOM 1027 CG GLU A 63 11.749 -5.402 10.984 1.00 0.00 C ATOM 1028 CD GLU A 63 13.214 -5.753 11.158 1.00 0.00 C ATOM 1029 OE1 GLU A 63 14.029 -4.825 11.341 1.00 0.00 O ATOM 1030 OE2 GLU A 63 13.545 -6.957 11.112 1.00 0.00 O ATOM 0 H GLU A 63 9.813 -3.969 7.333 1.00 0.00 H new ATOM 0 HA GLU A 63 9.486 -4.395 10.200 1.00 0.00 H new ATOM 0 HB2 GLU A 63 11.185 -6.077 9.035 1.00 0.00 H new ATOM 0 HB3 GLU A 63 12.235 -4.675 9.033 1.00 0.00 H new ATOM 0 HG2 GLU A 63 11.516 -4.524 11.586 1.00 0.00 H new ATOM 0 HG3 GLU A 63 11.136 -6.220 11.363 1.00 0.00 H new ATOM 1037 N LEU A 64 10.307 -2.104 10.517 1.00 0.00 N ATOM 1038 CA LEU A 64 10.629 -0.696 10.671 1.00 0.00 C ATOM 1039 C LEU A 64 12.125 -0.465 10.486 1.00 0.00 C ATOM 1040 O LEU A 64 12.930 -0.800 11.355 1.00 0.00 O ATOM 1041 CB LEU A 64 10.167 -0.216 12.043 1.00 0.00 C ATOM 1042 CG LEU A 64 8.723 -0.588 12.396 1.00 0.00 C ATOM 1043 CD1 LEU A 64 8.304 0.075 13.698 1.00 0.00 C ATOM 1044 CD2 LEU A 64 7.778 -0.194 11.271 1.00 0.00 C ATOM 0 H LEU A 64 9.869 -2.529 11.334 1.00 0.00 H new ATOM 0 HA LEU A 64 10.108 -0.122 9.904 1.00 0.00 H new ATOM 0 HB2 LEU A 64 10.831 -0.631 12.801 1.00 0.00 H new ATOM 0 HB3 LEU A 64 10.270 0.868 12.088 1.00 0.00 H new ATOM 0 HG LEU A 64 8.671 -1.669 12.527 1.00 0.00 H new ATOM 0 HD11 LEU A 64 7.276 -0.201 13.932 1.00 0.00 H new ATOM 0 HD12 LEU A 64 8.961 -0.256 14.503 1.00 0.00 H new ATOM 0 HD13 LEU A 64 8.375 1.158 13.594 1.00 0.00 H new ATOM 0 HD21 LEU A 64 6.758 -0.466 11.541 1.00 0.00 H new ATOM 0 HD22 LEU A 64 7.835 0.882 11.108 1.00 0.00 H new ATOM 0 HD23 LEU A 64 8.063 -0.715 10.357 1.00 0.00 H new ATOM 1056 N GLY A 65 12.487 0.092 9.334 1.00 0.00 N ATOM 1057 CA GLY A 65 13.884 0.339 9.032 1.00 0.00 C ATOM 1058 C GLY A 65 14.409 -0.614 7.981 1.00 0.00 C ATOM 1059 O GLY A 65 15.614 -0.843 7.880 1.00 0.00 O ATOM 0 H GLY A 65 11.835 0.377 8.603 1.00 0.00 H new ATOM 0 HA2 GLY A 65 14.005 1.365 8.685 1.00 0.00 H new ATOM 0 HA3 GLY A 65 14.476 0.238 9.942 1.00 0.00 H new ATOM 1063 N VAL A 66 13.493 -1.167 7.192 1.00 0.00 N ATOM 1064 CA VAL A 66 13.849 -2.098 6.136 1.00 0.00 C ATOM 1065 C VAL A 66 13.138 -1.732 4.843 1.00 0.00 C ATOM 1066 O VAL A 66 12.029 -1.198 4.856 1.00 0.00 O ATOM 1067 CB VAL A 66 13.518 -3.547 6.533 1.00 0.00 C ATOM 1068 CG1 VAL A 66 13.927 -4.517 5.434 1.00 0.00 C ATOM 1069 CG2 VAL A 66 14.207 -3.891 7.844 1.00 0.00 C ATOM 0 H VAL A 66 12.493 -0.982 7.268 1.00 0.00 H new ATOM 0 HA VAL A 66 14.925 -2.028 5.980 1.00 0.00 H new ATOM 0 HB VAL A 66 12.440 -3.637 6.669 1.00 0.00 H new ATOM 0 HG11 VAL A 66 13.683 -5.535 5.738 1.00 0.00 H new ATOM 0 HG12 VAL A 66 13.391 -4.274 4.516 1.00 0.00 H new ATOM 0 HG13 VAL A 66 15.000 -4.438 5.260 1.00 0.00 H new ATOM 0 HG21 VAL A 66 13.970 -4.918 8.121 1.00 0.00 H new ATOM 0 HG22 VAL A 66 15.286 -3.787 7.726 1.00 0.00 H new ATOM 0 HG23 VAL A 66 13.860 -3.215 8.626 1.00 0.00 H new ATOM 1079 N THR A 67 13.804 -1.995 3.732 1.00 0.00 N ATOM 1080 CA THR A 67 13.272 -1.670 2.420 1.00 0.00 C ATOM 1081 C THR A 67 11.972 -2.418 2.114 1.00 0.00 C ATOM 1082 O THR A 67 11.791 -3.572 2.501 1.00 0.00 O ATOM 1083 CB THR A 67 14.334 -1.970 1.357 1.00 0.00 C ATOM 1084 OG1 THR A 67 15.231 -0.881 1.230 1.00 0.00 O ATOM 1085 CG2 THR A 67 13.770 -2.257 -0.022 1.00 0.00 C ATOM 0 H THR A 67 14.723 -2.437 3.713 1.00 0.00 H new ATOM 0 HA THR A 67 13.026 -0.608 2.409 1.00 0.00 H new ATOM 0 HB THR A 67 14.835 -2.871 1.711 1.00 0.00 H new ATOM 0 HG1 THR A 67 14.726 -0.061 1.047 1.00 0.00 H new ATOM 0 HG21 THR A 67 14.587 -2.459 -0.714 1.00 0.00 H new ATOM 0 HG22 THR A 67 13.113 -3.125 0.027 1.00 0.00 H new ATOM 0 HG23 THR A 67 13.204 -1.393 -0.371 1.00 0.00 H new ATOM 1093 N PHE A 68 11.087 -1.739 1.386 1.00 0.00 N ATOM 1094 CA PHE A 68 9.807 -2.302 0.976 1.00 0.00 C ATOM 1095 C PHE A 68 10.009 -3.144 -0.279 1.00 0.00 C ATOM 1096 O PHE A 68 11.028 -3.013 -0.957 1.00 0.00 O ATOM 1097 CB PHE A 68 8.799 -1.176 0.698 1.00 0.00 C ATOM 1098 CG PHE A 68 7.557 -1.230 1.548 1.00 0.00 C ATOM 1099 CD1 PHE A 68 7.622 -1.620 2.874 1.00 0.00 C ATOM 1100 CD2 PHE A 68 6.322 -0.886 1.018 1.00 0.00 C ATOM 1101 CE1 PHE A 68 6.482 -1.666 3.653 1.00 0.00 C ATOM 1102 CE2 PHE A 68 5.180 -0.935 1.792 1.00 0.00 C ATOM 1103 CZ PHE A 68 5.260 -1.326 3.110 1.00 0.00 C ATOM 0 H PHE A 68 11.240 -0.783 1.065 1.00 0.00 H new ATOM 0 HA PHE A 68 9.414 -2.930 1.776 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.292 -0.217 0.856 1.00 0.00 H new ATOM 0 HB3 PHE A 68 8.508 -1.216 -0.352 1.00 0.00 H new ATOM 0 HD1 PHE A 68 8.574 -1.891 3.305 1.00 0.00 H new ATOM 0 HD2 PHE A 68 6.253 -0.576 -0.014 1.00 0.00 H new ATOM 0 HE1 PHE A 68 6.547 -1.968 4.688 1.00 0.00 H new ATOM 0 HE2 PHE A 68 4.225 -0.667 1.364 1.00 0.00 H new ATOM 0 HZ PHE A 68 4.368 -1.366 3.717 1.00 0.00 H new ATOM 1113 N ASN A 69 9.051 -4.007 -0.587 1.00 0.00 N ATOM 1114 CA ASN A 69 9.162 -4.860 -1.764 1.00 0.00 C ATOM 1115 C ASN A 69 7.817 -5.043 -2.457 1.00 0.00 C ATOM 1116 O ASN A 69 6.782 -5.170 -1.807 1.00 0.00 O ATOM 1117 CB ASN A 69 9.734 -6.225 -1.375 1.00 0.00 C ATOM 1118 CG ASN A 69 11.088 -6.113 -0.702 1.00 0.00 C ATOM 1119 OD1 ASN A 69 11.954 -5.360 -1.146 1.00 0.00 O ATOM 1120 ND2 ASN A 69 11.277 -6.865 0.376 1.00 0.00 N ATOM 0 H ASN A 69 8.196 -4.135 -0.045 1.00 0.00 H new ATOM 0 HA ASN A 69 9.837 -4.367 -2.464 1.00 0.00 H new ATOM 0 HB2 ASN A 69 9.039 -6.730 -0.704 1.00 0.00 H new ATOM 0 HB3 ASN A 69 9.824 -6.846 -2.267 1.00 0.00 H new ATOM 0 HD21 ASN A 69 12.168 -6.832 0.871 1.00 0.00 H new ATOM 0 HD22 ASN A 69 10.531 -7.475 0.709 1.00 0.00 H new ATOM 1127 N TYR A 70 7.851 -5.065 -3.785 1.00 0.00 N ATOM 1128 CA TYR A 70 6.647 -5.244 -4.586 1.00 0.00 C ATOM 1129 C TYR A 70 7.007 -5.357 -6.065 1.00 0.00 C ATOM 1130 O TYR A 70 6.549 -4.569 -6.893 1.00 0.00 O ATOM 1131 CB TYR A 70 5.669 -4.087 -4.358 1.00 0.00 C ATOM 1132 CG TYR A 70 4.428 -4.491 -3.594 1.00 0.00 C ATOM 1133 CD1 TYR A 70 3.395 -5.175 -4.223 1.00 0.00 C ATOM 1134 CD2 TYR A 70 4.290 -4.190 -2.245 1.00 0.00 C ATOM 1135 CE1 TYR A 70 2.260 -5.547 -3.528 1.00 0.00 C ATOM 1136 CE2 TYR A 70 3.159 -4.560 -1.544 1.00 0.00 C ATOM 1137 CZ TYR A 70 2.147 -5.238 -2.189 1.00 0.00 C ATOM 1138 OH TYR A 70 1.019 -5.608 -1.494 1.00 0.00 O ATOM 0 H TYR A 70 8.706 -4.960 -4.332 1.00 0.00 H new ATOM 0 HA TYR A 70 6.160 -6.168 -4.275 1.00 0.00 H new ATOM 0 HB2 TYR A 70 6.179 -3.292 -3.814 1.00 0.00 H new ATOM 0 HB3 TYR A 70 5.374 -3.675 -5.323 1.00 0.00 H new ATOM 0 HD1 TYR A 70 3.480 -5.420 -5.271 1.00 0.00 H new ATOM 0 HD2 TYR A 70 5.080 -3.658 -1.736 1.00 0.00 H new ATOM 0 HE1 TYR A 70 1.465 -6.077 -4.031 1.00 0.00 H new ATOM 0 HE2 TYR A 70 3.068 -4.319 -0.495 1.00 0.00 H new ATOM 0 HH TYR A 70 0.307 -4.954 -1.654 1.00 0.00 H new ATOM 1148 N ASN A 71 7.838 -6.343 -6.385 1.00 0.00 N ATOM 1149 CA ASN A 71 8.271 -6.565 -7.758 1.00 0.00 C ATOM 1150 C ASN A 71 7.740 -7.892 -8.287 1.00 0.00 C ATOM 1151 O ASN A 71 7.882 -8.930 -7.640 1.00 0.00 O ATOM 1152 CB ASN A 71 9.799 -6.543 -7.841 1.00 0.00 C ATOM 1153 CG ASN A 71 10.306 -6.672 -9.265 1.00 0.00 C ATOM 1154 OD1 ASN A 71 9.700 -7.349 -10.095 1.00 0.00 O ATOM 1155 ND2 ASN A 71 11.427 -6.021 -9.553 1.00 0.00 N ATOM 0 H ASN A 71 8.225 -7.002 -5.710 1.00 0.00 H new ATOM 0 HA ASN A 71 7.869 -5.762 -8.375 1.00 0.00 H new ATOM 0 HB2 ASN A 71 10.170 -5.613 -7.410 1.00 0.00 H new ATOM 0 HB3 ASN A 71 10.204 -7.357 -7.240 1.00 0.00 H new ATOM 0 HD21 ASN A 71 11.818 -6.071 -10.494 1.00 0.00 H new ATOM 0 HD22 ASN A 71 11.897 -5.471 -8.834 1.00 0.00 H new ATOM 1162 N LEU A 72 7.128 -7.851 -9.466 1.00 0.00 N ATOM 1163 CA LEU A 72 6.577 -9.053 -10.078 1.00 0.00 C ATOM 1164 C LEU A 72 5.975 -8.750 -11.447 1.00 0.00 C ATOM 1165 O LEU A 72 5.988 -7.603 -11.908 1.00 0.00 O ATOM 1166 CB LEU A 72 5.514 -9.675 -9.170 1.00 0.00 C ATOM 1167 CG LEU A 72 4.325 -8.766 -8.848 1.00 0.00 C ATOM 1168 CD1 LEU A 72 3.028 -9.560 -8.854 1.00 0.00 C ATOM 1169 CD2 LEU A 72 4.526 -8.082 -7.504 1.00 0.00 C ATOM 0 H LEU A 72 7.002 -7.001 -10.015 1.00 0.00 H new ATOM 0 HA LEU A 72 7.394 -9.762 -10.212 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.140 -10.583 -9.643 1.00 0.00 H new ATOM 0 HB3 LEU A 72 5.987 -9.974 -8.235 1.00 0.00 H new ATOM 0 HG LEU A 72 4.261 -7.998 -9.619 1.00 0.00 H new ATOM 0 HD11 LEU A 72 2.194 -8.897 -8.623 1.00 0.00 H new ATOM 0 HD12 LEU A 72 2.877 -10.003 -9.838 1.00 0.00 H new ATOM 0 HD13 LEU A 72 3.082 -10.350 -8.105 1.00 0.00 H new ATOM 0 HD21 LEU A 72 3.671 -7.440 -7.291 1.00 0.00 H new ATOM 0 HD22 LEU A 72 4.617 -8.836 -6.722 1.00 0.00 H new ATOM 0 HD23 LEU A 72 5.434 -7.480 -7.535 1.00 0.00 H new ATOM 1181 N ALA A 73 5.446 -9.792 -12.086 1.00 0.00 N ATOM 1182 CA ALA A 73 4.832 -9.663 -13.402 1.00 0.00 C ATOM 1183 C ALA A 73 3.727 -8.614 -13.392 1.00 0.00 C ATOM 1184 O ALA A 73 3.619 -7.822 -12.456 1.00 0.00 O ATOM 1185 CB ALA A 73 4.285 -11.007 -13.861 1.00 0.00 C ATOM 0 H ALA A 73 5.432 -10.740 -11.709 1.00 0.00 H new ATOM 0 HA ALA A 73 5.599 -9.336 -14.104 1.00 0.00 H new ATOM 0 HB1 ALA A 73 3.829 -10.897 -14.845 1.00 0.00 H new ATOM 0 HB2 ALA A 73 5.098 -11.731 -13.916 1.00 0.00 H new ATOM 0 HB3 ALA A 73 3.536 -11.357 -13.151 1.00 0.00 H new ATOM 1191 N ASP A 74 2.909 -8.607 -14.441 1.00 0.00 N ATOM 1192 CA ASP A 74 1.819 -7.644 -14.553 1.00 0.00 C ATOM 1193 C ASP A 74 2.377 -6.245 -14.789 1.00 0.00 C ATOM 1194 O ASP A 74 2.162 -5.649 -15.845 1.00 0.00 O ATOM 1195 CB ASP A 74 0.948 -7.660 -13.291 1.00 0.00 C ATOM 1196 CG ASP A 74 -0.428 -8.244 -13.543 1.00 0.00 C ATOM 1197 OD1 ASP A 74 -0.614 -8.902 -14.589 1.00 0.00 O ATOM 1198 OD2 ASP A 74 -1.321 -8.043 -12.693 1.00 0.00 O ATOM 0 H ASP A 74 2.981 -9.257 -15.224 1.00 0.00 H new ATOM 0 HA ASP A 74 1.197 -7.926 -15.403 1.00 0.00 H new ATOM 0 HB2 ASP A 74 1.449 -8.239 -12.515 1.00 0.00 H new ATOM 0 HB3 ASP A 74 0.844 -6.643 -12.912 1.00 0.00 H new ATOM 1203 N GLY A 75 3.105 -5.732 -13.803 1.00 0.00 N ATOM 1204 CA GLY A 75 3.695 -4.415 -13.926 1.00 0.00 C ATOM 1205 C GLY A 75 4.028 -3.796 -12.593 1.00 0.00 C ATOM 1206 O GLY A 75 3.318 -2.908 -12.120 1.00 0.00 O ATOM 0 H GLY A 75 3.296 -6.206 -12.921 1.00 0.00 H new ATOM 0 HA2 GLY A 75 4.602 -4.483 -14.526 1.00 0.00 H new ATOM 0 HA3 GLY A 75 3.006 -3.762 -14.462 1.00 0.00 H new ATOM 1210 N THR A 76 5.112 -4.260 -11.980 1.00 0.00 N ATOM 1211 CA THR A 76 5.516 -3.731 -10.698 1.00 0.00 C ATOM 1212 C THR A 76 6.917 -4.180 -10.308 1.00 0.00 C ATOM 1213 O THR A 76 7.288 -5.344 -10.458 1.00 0.00 O ATOM 1214 CB THR A 76 4.499 -4.136 -9.648 1.00 0.00 C ATOM 1215 OG1 THR A 76 4.579 -3.295 -8.511 1.00 0.00 O ATOM 1216 CG2 THR A 76 4.635 -5.569 -9.178 1.00 0.00 C ATOM 0 H THR A 76 5.716 -4.993 -12.351 1.00 0.00 H new ATOM 0 HA THR A 76 5.551 -2.644 -10.769 1.00 0.00 H new ATOM 0 HB THR A 76 3.534 -4.035 -10.145 1.00 0.00 H new ATOM 0 HG1 THR A 76 5.252 -3.646 -7.891 1.00 0.00 H new ATOM 0 HG21 THR A 76 3.872 -5.780 -8.429 1.00 0.00 H new ATOM 0 HG22 THR A 76 4.508 -6.243 -10.025 1.00 0.00 H new ATOM 0 HG23 THR A 76 5.623 -5.717 -8.742 1.00 0.00 H new ATOM 1224 N GLU A 77 7.672 -3.223 -9.801 1.00 0.00 N ATOM 1225 CA GLU A 77 9.046 -3.436 -9.357 1.00 0.00 C ATOM 1226 C GLU A 77 9.440 -2.291 -8.438 1.00 0.00 C ATOM 1227 O GLU A 77 10.419 -1.584 -8.682 1.00 0.00 O ATOM 1228 CB GLU A 77 10.003 -3.502 -10.552 1.00 0.00 C ATOM 1229 CG GLU A 77 9.562 -4.461 -11.646 1.00 0.00 C ATOM 1230 CD GLU A 77 10.601 -4.617 -12.739 1.00 0.00 C ATOM 1231 OE1 GLU A 77 10.868 -3.625 -13.450 1.00 0.00 O ATOM 1232 OE2 GLU A 77 11.149 -5.730 -12.883 1.00 0.00 O ATOM 0 H GLU A 77 7.349 -2.263 -9.683 1.00 0.00 H new ATOM 0 HA GLU A 77 9.110 -4.385 -8.825 1.00 0.00 H new ATOM 0 HB2 GLU A 77 10.105 -2.504 -10.978 1.00 0.00 H new ATOM 0 HB3 GLU A 77 10.990 -3.800 -10.198 1.00 0.00 H new ATOM 0 HG2 GLU A 77 9.353 -5.436 -11.206 1.00 0.00 H new ATOM 0 HG3 GLU A 77 8.630 -4.103 -12.084 1.00 0.00 H new ATOM 1239 N LEU A 78 8.634 -2.087 -7.405 1.00 0.00 N ATOM 1240 CA LEU A 78 8.846 -1.000 -6.468 1.00 0.00 C ATOM 1241 C LEU A 78 9.589 -1.443 -5.209 1.00 0.00 C ATOM 1242 O LEU A 78 9.207 -2.410 -4.548 1.00 0.00 O ATOM 1243 CB LEU A 78 7.494 -0.389 -6.109 1.00 0.00 C ATOM 1244 CG LEU A 78 6.992 0.662 -7.102 1.00 0.00 C ATOM 1245 CD1 LEU A 78 5.713 0.206 -7.781 1.00 0.00 C ATOM 1246 CD2 LEU A 78 6.767 1.995 -6.429 1.00 0.00 C ATOM 0 H LEU A 78 7.821 -2.667 -7.197 1.00 0.00 H new ATOM 0 HA LEU A 78 9.481 -0.256 -6.949 1.00 0.00 H new ATOM 0 HB2 LEU A 78 6.755 -1.187 -6.039 1.00 0.00 H new ATOM 0 HB3 LEU A 78 7.566 0.067 -5.121 1.00 0.00 H new ATOM 0 HG LEU A 78 7.767 0.784 -7.858 1.00 0.00 H new ATOM 0 HD11 LEU A 78 5.379 0.972 -8.481 1.00 0.00 H new ATOM 0 HD12 LEU A 78 5.899 -0.722 -8.321 1.00 0.00 H new ATOM 0 HD13 LEU A 78 4.941 0.040 -7.029 1.00 0.00 H new ATOM 0 HD21 LEU A 78 6.411 2.718 -7.163 1.00 0.00 H new ATOM 0 HD22 LEU A 78 6.024 1.883 -5.640 1.00 0.00 H new ATOM 0 HD23 LEU A 78 7.704 2.348 -5.998 1.00 0.00 H new ATOM 1258 N ARG A 79 10.654 -0.710 -4.889 1.00 0.00 N ATOM 1259 CA ARG A 79 11.474 -0.985 -3.713 1.00 0.00 C ATOM 1260 C ARG A 79 11.743 0.302 -2.935 1.00 0.00 C ATOM 1261 O ARG A 79 12.356 1.230 -3.459 1.00 0.00 O ATOM 1262 CB ARG A 79 12.803 -1.610 -4.137 1.00 0.00 C ATOM 1263 CG ARG A 79 13.512 -2.355 -3.018 1.00 0.00 C ATOM 1264 CD ARG A 79 14.303 -3.538 -3.552 1.00 0.00 C ATOM 1265 NE ARG A 79 13.571 -4.795 -3.413 1.00 0.00 N ATOM 1266 CZ ARG A 79 14.019 -5.967 -3.856 1.00 0.00 C ATOM 1267 NH1 ARG A 79 15.196 -6.048 -4.465 1.00 0.00 N ATOM 1268 NH2 ARG A 79 13.290 -7.061 -3.690 1.00 0.00 N ATOM 0 H ARG A 79 10.971 0.089 -5.437 1.00 0.00 H new ATOM 0 HA ARG A 79 10.933 -1.681 -3.071 1.00 0.00 H new ATOM 0 HB2 ARG A 79 12.624 -2.298 -4.963 1.00 0.00 H new ATOM 0 HB3 ARG A 79 13.460 -0.825 -4.513 1.00 0.00 H new ATOM 0 HG2 ARG A 79 14.183 -1.674 -2.494 1.00 0.00 H new ATOM 0 HG3 ARG A 79 12.779 -2.704 -2.290 1.00 0.00 H new ATOM 0 HD2 ARG A 79 14.540 -3.371 -4.603 1.00 0.00 H new ATOM 0 HD3 ARG A 79 15.251 -3.610 -3.019 1.00 0.00 H new ATOM 0 HE ARG A 79 12.663 -4.773 -2.949 1.00 0.00 H new ATOM 0 HH11 ARG A 79 15.762 -5.209 -4.595 1.00 0.00 H new ATOM 0 HH12 ARG A 79 15.535 -6.949 -4.803 1.00 0.00 H new ATOM 0 HH21 ARG A 79 12.385 -7.005 -3.223 1.00 0.00 H new ATOM 0 HH22 ARG A 79 13.634 -7.959 -4.030 1.00 0.00 H new ATOM 1282 N GLY A 80 11.289 0.358 -1.687 1.00 0.00 N ATOM 1283 CA GLY A 80 11.504 1.549 -0.878 1.00 0.00 C ATOM 1284 C GLY A 80 11.814 1.221 0.571 1.00 0.00 C ATOM 1285 O GLY A 80 12.798 0.543 0.853 1.00 0.00 O ATOM 0 H GLY A 80 10.779 -0.393 -1.222 1.00 0.00 H new ATOM 0 HA2 GLY A 80 12.326 2.127 -1.300 1.00 0.00 H new ATOM 0 HA3 GLY A 80 10.616 2.179 -0.922 1.00 0.00 H new ATOM 1289 N THR A 81 10.967 1.692 1.489 1.00 0.00 N ATOM 1290 CA THR A 81 11.148 1.428 2.919 1.00 0.00 C ATOM 1291 C THR A 81 9.833 1.587 3.679 1.00 0.00 C ATOM 1292 O THR A 81 8.816 1.973 3.108 1.00 0.00 O ATOM 1293 CB THR A 81 12.201 2.357 3.526 1.00 0.00 C ATOM 1294 OG1 THR A 81 12.036 3.682 3.053 1.00 0.00 O ATOM 1295 CG2 THR A 81 13.619 1.933 3.222 1.00 0.00 C ATOM 0 H THR A 81 10.148 2.259 1.268 1.00 0.00 H new ATOM 0 HA THR A 81 11.490 0.397 3.013 1.00 0.00 H new ATOM 0 HB THR A 81 12.046 2.302 4.604 1.00 0.00 H new ATOM 0 HG1 THR A 81 12.718 4.260 3.455 1.00 0.00 H new ATOM 0 HG21 THR A 81 14.315 2.635 3.682 1.00 0.00 H new ATOM 0 HG22 THR A 81 13.794 0.934 3.622 1.00 0.00 H new ATOM 0 HG23 THR A 81 13.773 1.924 2.143 1.00 0.00 H new ATOM 1303 N TRP A 82 9.870 1.291 4.974 1.00 0.00 N ATOM 1304 CA TRP A 82 8.691 1.405 5.830 1.00 0.00 C ATOM 1305 C TRP A 82 9.096 1.884 7.220 1.00 0.00 C ATOM 1306 O TRP A 82 9.992 1.316 7.844 1.00 0.00 O ATOM 1307 CB TRP A 82 7.976 0.057 5.931 1.00 0.00 C ATOM 1308 CG TRP A 82 6.491 0.183 6.080 1.00 0.00 C ATOM 1309 CD1 TRP A 82 5.626 0.763 5.198 1.00 0.00 C ATOM 1310 CD2 TRP A 82 5.696 -0.277 7.178 1.00 0.00 C ATOM 1311 NE1 TRP A 82 4.342 0.693 5.680 1.00 0.00 N ATOM 1312 CE2 TRP A 82 4.358 0.059 6.895 1.00 0.00 C ATOM 1313 CE3 TRP A 82 5.985 -0.941 8.374 1.00 0.00 C ATOM 1314 CZ2 TRP A 82 3.314 -0.246 7.763 1.00 0.00 C ATOM 1315 CZ3 TRP A 82 4.946 -1.243 9.235 1.00 0.00 C ATOM 1316 CH2 TRP A 82 3.625 -0.896 8.925 1.00 0.00 C ATOM 0 H TRP A 82 10.708 0.968 5.457 1.00 0.00 H new ATOM 0 HA TRP A 82 8.010 2.132 5.389 1.00 0.00 H new ATOM 0 HB2 TRP A 82 8.196 -0.531 5.040 1.00 0.00 H new ATOM 0 HB3 TRP A 82 8.374 -0.495 6.783 1.00 0.00 H new ATOM 0 HD1 TRP A 82 5.910 1.212 4.258 1.00 0.00 H new ATOM 0 HE1 TRP A 82 3.512 1.054 5.210 1.00 0.00 H new ATOM 0 HE3 TRP A 82 7.001 -1.213 8.621 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 2.294 0.021 7.527 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 5.157 -1.755 10.162 1.00 0.00 H new ATOM 0 HH2 TRP A 82 2.836 -1.147 9.618 1.00 0.00 H new ATOM 1327 N SER A 83 8.443 2.938 7.698 1.00 0.00 N ATOM 1328 CA SER A 83 8.753 3.492 9.012 1.00 0.00 C ATOM 1329 C SER A 83 7.488 3.736 9.826 1.00 0.00 C ATOM 1330 O SER A 83 6.425 4.017 9.275 1.00 0.00 O ATOM 1331 CB SER A 83 9.533 4.799 8.862 1.00 0.00 C ATOM 1332 OG SER A 83 9.336 5.367 7.579 1.00 0.00 O ATOM 0 H SER A 83 7.699 3.424 7.198 1.00 0.00 H new ATOM 0 HA SER A 83 9.364 2.763 9.545 1.00 0.00 H new ATOM 0 HB2 SER A 83 9.215 5.506 9.629 1.00 0.00 H new ATOM 0 HB3 SER A 83 10.595 4.612 9.021 1.00 0.00 H new ATOM 0 HG SER A 83 9.844 6.202 7.510 1.00 0.00 H new ATOM 1338 N LEU A 84 7.616 3.635 11.145 1.00 0.00 N ATOM 1339 CA LEU A 84 6.488 3.854 12.042 1.00 0.00 C ATOM 1340 C LEU A 84 6.844 4.879 13.112 1.00 0.00 C ATOM 1341 O LEU A 84 7.874 4.769 13.777 1.00 0.00 O ATOM 1342 CB LEU A 84 6.059 2.540 12.696 1.00 0.00 C ATOM 1343 CG LEU A 84 4.645 2.074 12.344 1.00 0.00 C ATOM 1344 CD1 LEU A 84 4.573 0.555 12.321 1.00 0.00 C ATOM 1345 CD2 LEU A 84 3.637 2.642 13.332 1.00 0.00 C ATOM 0 H LEU A 84 8.490 3.403 11.616 1.00 0.00 H new ATOM 0 HA LEU A 84 5.656 4.240 11.453 1.00 0.00 H new ATOM 0 HB2 LEU A 84 6.764 1.761 12.408 1.00 0.00 H new ATOM 0 HB3 LEU A 84 6.130 2.650 13.778 1.00 0.00 H new ATOM 0 HG LEU A 84 4.398 2.443 11.349 1.00 0.00 H new ATOM 0 HD11 LEU A 84 3.560 0.243 12.069 1.00 0.00 H new ATOM 0 HD12 LEU A 84 5.268 0.169 11.575 1.00 0.00 H new ATOM 0 HD13 LEU A 84 4.840 0.163 13.303 1.00 0.00 H new ATOM 0 HD21 LEU A 84 2.636 2.301 13.067 1.00 0.00 H new ATOM 0 HD22 LEU A 84 3.882 2.302 14.338 1.00 0.00 H new ATOM 0 HD23 LEU A 84 3.670 3.731 13.299 1.00 0.00 H new ATOM 1357 N GLU A 85 5.984 5.875 13.267 1.00 0.00 N ATOM 1358 CA GLU A 85 6.197 6.928 14.250 1.00 0.00 C ATOM 1359 C GLU A 85 4.950 7.129 15.104 1.00 0.00 C ATOM 1360 O GLU A 85 4.039 7.866 14.726 1.00 0.00 O ATOM 1361 CB GLU A 85 6.564 8.234 13.547 1.00 0.00 C ATOM 1362 CG GLU A 85 7.850 8.151 12.740 1.00 0.00 C ATOM 1363 CD GLU A 85 8.752 9.351 12.953 1.00 0.00 C ATOM 1364 OE1 GLU A 85 8.408 10.447 12.461 1.00 0.00 O ATOM 1365 OE2 GLU A 85 9.802 9.196 13.612 1.00 0.00 O ATOM 0 H GLU A 85 5.128 5.976 12.722 1.00 0.00 H new ATOM 0 HA GLU A 85 7.018 6.629 14.902 1.00 0.00 H new ATOM 0 HB2 GLU A 85 5.748 8.522 12.885 1.00 0.00 H new ATOM 0 HB3 GLU A 85 6.663 9.023 14.293 1.00 0.00 H new ATOM 0 HG2 GLU A 85 8.388 7.244 13.014 1.00 0.00 H new ATOM 0 HG3 GLU A 85 7.605 8.069 11.681 1.00 0.00 H new ATOM 1372 N GLY A 86 4.914 6.468 16.256 1.00 0.00 N ATOM 1373 CA GLY A 86 3.772 6.588 17.142 1.00 0.00 C ATOM 1374 C GLY A 86 2.515 5.991 16.545 1.00 0.00 C ATOM 1375 O GLY A 86 2.374 4.770 16.468 1.00 0.00 O ATOM 0 H GLY A 86 5.655 5.852 16.591 1.00 0.00 H new ATOM 0 HA2 GLY A 86 3.994 6.091 18.086 1.00 0.00 H new ATOM 0 HA3 GLY A 86 3.600 7.640 17.368 1.00 0.00 H new ATOM 1379 N ASN A 87 1.599 6.853 16.122 1.00 0.00 N ATOM 1380 CA ASN A 87 0.346 6.403 15.528 1.00 0.00 C ATOM 1381 C ASN A 87 0.313 6.688 14.028 1.00 0.00 C ATOM 1382 O ASN A 87 -0.757 6.748 13.423 1.00 0.00 O ATOM 1383 CB ASN A 87 -0.840 7.085 16.213 1.00 0.00 C ATOM 1384 CG ASN A 87 -0.881 6.813 17.704 1.00 0.00 C ATOM 1385 OD1 ASN A 87 -0.423 7.626 18.507 1.00 0.00 O ATOM 1386 ND2 ASN A 87 -1.430 5.665 18.082 1.00 0.00 N ATOM 0 H ASN A 87 1.700 7.866 16.179 1.00 0.00 H new ATOM 0 HA ASN A 87 0.274 5.325 15.674 1.00 0.00 H new ATOM 0 HB2 ASN A 87 -0.784 8.160 16.044 1.00 0.00 H new ATOM 0 HB3 ASN A 87 -1.768 6.738 15.758 1.00 0.00 H new ATOM 0 HD21 ASN A 87 -1.485 5.428 19.072 1.00 0.00 H new ATOM 0 HD22 ASN A 87 -1.797 5.020 17.382 1.00 0.00 H new ATOM 1393 N LYS A 88 1.490 6.864 13.431 1.00 0.00 N ATOM 1394 CA LYS A 88 1.587 7.143 12.003 1.00 0.00 C ATOM 1395 C LYS A 88 2.719 6.343 11.365 1.00 0.00 C ATOM 1396 O LYS A 88 3.800 6.213 11.937 1.00 0.00 O ATOM 1397 CB LYS A 88 1.809 8.638 11.767 1.00 0.00 C ATOM 1398 CG LYS A 88 0.921 9.528 12.620 1.00 0.00 C ATOM 1399 CD LYS A 88 1.414 10.966 12.625 1.00 0.00 C ATOM 1400 CE LYS A 88 2.821 11.071 13.191 1.00 0.00 C ATOM 1401 NZ LYS A 88 3.061 12.389 13.842 1.00 0.00 N ATOM 0 H LYS A 88 2.387 6.818 13.914 1.00 0.00 H new ATOM 0 HA LYS A 88 0.648 6.843 11.537 1.00 0.00 H new ATOM 0 HB2 LYS A 88 2.852 8.878 11.971 1.00 0.00 H new ATOM 0 HB3 LYS A 88 1.630 8.862 10.715 1.00 0.00 H new ATOM 0 HG2 LYS A 88 -0.101 9.494 12.242 1.00 0.00 H new ATOM 0 HG3 LYS A 88 0.896 9.147 13.641 1.00 0.00 H new ATOM 0 HD2 LYS A 88 1.399 11.360 11.609 1.00 0.00 H new ATOM 0 HD3 LYS A 88 0.736 11.582 13.216 1.00 0.00 H new ATOM 0 HE2 LYS A 88 2.981 10.273 13.916 1.00 0.00 H new ATOM 0 HE3 LYS A 88 3.546 10.924 12.391 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 4.031 12.420 14.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 2.934 13.149 13.144 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 2.386 12.519 14.622 1.00 0.00 H new ATOM 1415 N LEU A 89 2.461 5.809 10.176 1.00 0.00 N ATOM 1416 CA LEU A 89 3.454 5.021 9.454 1.00 0.00 C ATOM 1417 C LEU A 89 3.810 5.690 8.129 1.00 0.00 C ATOM 1418 O LEU A 89 2.966 6.326 7.500 1.00 0.00 O ATOM 1419 CB LEU A 89 2.935 3.602 9.201 1.00 0.00 C ATOM 1420 CG LEU A 89 1.866 3.111 10.181 1.00 0.00 C ATOM 1421 CD1 LEU A 89 0.487 3.588 9.751 1.00 0.00 C ATOM 1422 CD2 LEU A 89 1.899 1.594 10.288 1.00 0.00 C ATOM 0 H LEU A 89 1.570 5.908 9.690 1.00 0.00 H new ATOM 0 HA LEU A 89 4.352 4.961 10.069 1.00 0.00 H new ATOM 0 HB2 LEU A 89 2.527 3.557 8.191 1.00 0.00 H new ATOM 0 HB3 LEU A 89 3.779 2.913 9.235 1.00 0.00 H new ATOM 0 HG LEU A 89 2.081 3.530 11.164 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -0.259 3.229 10.460 1.00 0.00 H new ATOM 0 HD12 LEU A 89 0.470 4.678 9.727 1.00 0.00 H new ATOM 0 HD13 LEU A 89 0.261 3.199 8.758 1.00 0.00 H new ATOM 0 HD21 LEU A 89 1.133 1.262 10.989 1.00 0.00 H new ATOM 0 HD22 LEU A 89 1.709 1.156 9.308 1.00 0.00 H new ATOM 0 HD23 LEU A 89 2.879 1.276 10.644 1.00 0.00 H new ATOM 1434 N ILE A 90 5.065 5.554 7.712 1.00 0.00 N ATOM 1435 CA ILE A 90 5.514 6.157 6.464 1.00 0.00 C ATOM 1436 C ILE A 90 6.205 5.140 5.559 1.00 0.00 C ATOM 1437 O ILE A 90 7.405 4.897 5.682 1.00 0.00 O ATOM 1438 CB ILE A 90 6.480 7.330 6.720 1.00 0.00 C ATOM 1439 CG1 ILE A 90 5.990 8.181 7.895 1.00 0.00 C ATOM 1440 CG2 ILE A 90 6.623 8.181 5.465 1.00 0.00 C ATOM 1441 CD1 ILE A 90 6.329 7.594 9.248 1.00 0.00 C ATOM 0 H ILE A 90 5.784 5.035 8.217 1.00 0.00 H new ATOM 0 HA ILE A 90 4.618 6.527 5.965 1.00 0.00 H new ATOM 0 HB ILE A 90 7.459 6.925 6.976 1.00 0.00 H new ATOM 0 HG12 ILE A 90 6.428 9.176 7.820 1.00 0.00 H new ATOM 0 HG13 ILE A 90 4.909 8.301 7.820 1.00 0.00 H new ATOM 0 HG21 ILE A 90 7.308 9.006 5.661 1.00 0.00 H new ATOM 0 HG22 ILE A 90 7.015 7.569 4.653 1.00 0.00 H new ATOM 0 HG23 ILE A 90 5.648 8.579 5.182 1.00 0.00 H new ATOM 0 HD11 ILE A 90 5.952 8.249 10.034 1.00 0.00 H new ATOM 0 HD12 ILE A 90 5.869 6.610 9.344 1.00 0.00 H new ATOM 0 HD13 ILE A 90 7.411 7.499 9.343 1.00 0.00 H new ATOM 1453 N GLY A 91 5.438 4.564 4.639 1.00 0.00 N ATOM 1454 CA GLY A 91 5.986 3.596 3.709 1.00 0.00 C ATOM 1455 C GLY A 91 6.590 4.266 2.493 1.00 0.00 C ATOM 1456 O GLY A 91 6.328 5.441 2.233 1.00 0.00 O ATOM 0 H GLY A 91 4.442 4.752 4.521 1.00 0.00 H new ATOM 0 HA2 GLY A 91 6.747 3.000 4.211 1.00 0.00 H new ATOM 0 HA3 GLY A 91 5.200 2.910 3.393 1.00 0.00 H new ATOM 1460 N LYS A 92 7.410 3.531 1.752 1.00 0.00 N ATOM 1461 CA LYS A 92 8.056 4.083 0.570 1.00 0.00 C ATOM 1462 C LYS A 92 8.391 3.001 -0.451 1.00 0.00 C ATOM 1463 O LYS A 92 8.577 1.835 -0.104 1.00 0.00 O ATOM 1464 CB LYS A 92 9.340 4.814 0.974 1.00 0.00 C ATOM 1465 CG LYS A 92 9.190 6.323 1.035 1.00 0.00 C ATOM 1466 CD LYS A 92 9.115 6.822 2.469 1.00 0.00 C ATOM 1467 CE LYS A 92 8.163 8.000 2.601 1.00 0.00 C ATOM 1468 NZ LYS A 92 8.773 9.125 3.362 1.00 0.00 N ATOM 0 H LYS A 92 7.642 2.557 1.948 1.00 0.00 H new ATOM 0 HA LYS A 92 7.357 4.779 0.107 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.663 4.450 1.949 1.00 0.00 H new ATOM 0 HB3 LYS A 92 10.128 4.565 0.264 1.00 0.00 H new ATOM 0 HG2 LYS A 92 10.033 6.793 0.529 1.00 0.00 H new ATOM 0 HG3 LYS A 92 8.290 6.621 0.498 1.00 0.00 H new ATOM 0 HD2 LYS A 92 8.786 6.012 3.120 1.00 0.00 H new ATOM 0 HD3 LYS A 92 10.109 7.117 2.805 1.00 0.00 H new ATOM 0 HE2 LYS A 92 7.875 8.347 1.609 1.00 0.00 H new ATOM 0 HE3 LYS A 92 7.251 7.675 3.102 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 8.092 9.908 3.430 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 9.025 8.801 4.318 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 9.629 9.452 2.871 1.00 0.00 H new ATOM 1482 N PHE A 93 8.505 3.414 -1.709 1.00 0.00 N ATOM 1483 CA PHE A 93 8.865 2.510 -2.794 1.00 0.00 C ATOM 1484 C PHE A 93 9.786 3.219 -3.776 1.00 0.00 C ATOM 1485 O PHE A 93 9.972 4.434 -3.712 1.00 0.00 O ATOM 1486 CB PHE A 93 7.653 2.016 -3.590 1.00 0.00 C ATOM 1487 CG PHE A 93 6.810 0.955 -2.929 1.00 0.00 C ATOM 1488 CD1 PHE A 93 7.253 -0.358 -2.870 1.00 0.00 C ATOM 1489 CD2 PHE A 93 5.560 1.260 -2.400 1.00 0.00 C ATOM 1490 CE1 PHE A 93 6.471 -1.344 -2.300 1.00 0.00 C ATOM 1491 CE2 PHE A 93 4.780 0.276 -1.824 1.00 0.00 C ATOM 1492 CZ PHE A 93 5.234 -1.027 -1.776 1.00 0.00 C ATOM 0 H PHE A 93 8.351 4.378 -2.003 1.00 0.00 H new ATOM 0 HA PHE A 93 9.350 1.655 -2.323 1.00 0.00 H new ATOM 0 HB2 PHE A 93 7.015 2.872 -3.810 1.00 0.00 H new ATOM 0 HB3 PHE A 93 8.006 1.627 -4.545 1.00 0.00 H new ATOM 0 HD1 PHE A 93 8.221 -0.613 -3.275 1.00 0.00 H new ATOM 0 HD2 PHE A 93 5.196 2.276 -2.440 1.00 0.00 H new ATOM 0 HE1 PHE A 93 6.828 -2.363 -2.264 1.00 0.00 H new ATOM 0 HE2 PHE A 93 3.814 0.526 -1.411 1.00 0.00 H new ATOM 0 HZ PHE A 93 4.622 -1.797 -1.329 1.00 0.00 H new ATOM 1502 N LYS A 94 10.319 2.451 -4.712 1.00 0.00 N ATOM 1503 CA LYS A 94 11.179 2.989 -5.753 1.00 0.00 C ATOM 1504 C LYS A 94 11.140 2.090 -6.979 1.00 0.00 C ATOM 1505 O LYS A 94 11.303 0.875 -6.873 1.00 0.00 O ATOM 1506 CB LYS A 94 12.622 3.144 -5.283 1.00 0.00 C ATOM 1507 CG LYS A 94 13.380 4.197 -6.057 1.00 0.00 C ATOM 1508 CD LYS A 94 13.599 5.454 -5.234 1.00 0.00 C ATOM 1509 CE LYS A 94 15.068 5.821 -5.194 1.00 0.00 C ATOM 1510 NZ LYS A 94 15.465 6.398 -3.880 1.00 0.00 N ATOM 0 H LYS A 94 10.169 1.444 -4.772 1.00 0.00 H new ATOM 0 HA LYS A 94 10.800 3.980 -6.004 1.00 0.00 H new ATOM 0 HB2 LYS A 94 12.629 3.403 -4.224 1.00 0.00 H new ATOM 0 HB3 LYS A 94 13.136 2.188 -5.381 1.00 0.00 H new ATOM 0 HG2 LYS A 94 14.344 3.795 -6.370 1.00 0.00 H new ATOM 0 HG3 LYS A 94 12.830 4.448 -6.964 1.00 0.00 H new ATOM 0 HD2 LYS A 94 13.025 6.277 -5.659 1.00 0.00 H new ATOM 0 HD3 LYS A 94 13.230 5.299 -4.220 1.00 0.00 H new ATOM 0 HE2 LYS A 94 15.669 4.934 -5.396 1.00 0.00 H new ATOM 0 HE3 LYS A 94 15.284 6.539 -5.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 16.478 6.635 -3.897 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 14.911 7.259 -3.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 15.284 5.704 -3.127 1.00 0.00 H new ATOM 1524 N ARG A 95 10.923 2.689 -8.139 1.00 0.00 N ATOM 1525 CA ARG A 95 10.861 1.928 -9.381 1.00 0.00 C ATOM 1526 C ARG A 95 12.255 1.566 -9.865 1.00 0.00 C ATOM 1527 O ARG A 95 13.229 2.263 -9.576 1.00 0.00 O ATOM 1528 CB ARG A 95 10.129 2.709 -10.471 1.00 0.00 C ATOM 1529 CG ARG A 95 8.625 2.488 -10.476 1.00 0.00 C ATOM 1530 CD ARG A 95 8.091 2.315 -11.889 1.00 0.00 C ATOM 1531 NE ARG A 95 8.625 1.118 -12.534 1.00 0.00 N ATOM 1532 CZ ARG A 95 8.160 -0.111 -12.318 1.00 0.00 C ATOM 1533 NH1 ARG A 95 7.155 -0.310 -11.475 1.00 0.00 N ATOM 1534 NH2 ARG A 95 8.702 -1.144 -12.948 1.00 0.00 N ATOM 0 H ARG A 95 10.787 3.694 -8.249 1.00 0.00 H new ATOM 0 HA ARG A 95 10.307 1.012 -9.174 1.00 0.00 H new ATOM 0 HB2 ARG A 95 10.331 3.772 -10.341 1.00 0.00 H new ATOM 0 HB3 ARG A 95 10.532 2.424 -11.443 1.00 0.00 H new ATOM 0 HG2 ARG A 95 8.384 1.605 -9.884 1.00 0.00 H new ATOM 0 HG3 ARG A 95 8.130 3.335 -10.000 1.00 0.00 H new ATOM 0 HD2 ARG A 95 7.003 2.256 -11.861 1.00 0.00 H new ATOM 0 HD3 ARG A 95 8.348 3.192 -12.483 1.00 0.00 H new ATOM 0 HE ARG A 95 9.399 1.230 -13.188 1.00 0.00 H new ATOM 0 HH11 ARG A 95 6.734 0.481 -10.988 1.00 0.00 H new ATOM 0 HH12 ARG A 95 6.804 -1.254 -11.314 1.00 0.00 H new ATOM 0 HH21 ARG A 95 9.475 -0.997 -13.598 1.00 0.00 H new ATOM 0 HH22 ARG A 95 8.346 -2.086 -12.783 1.00 0.00 H new ATOM 1548 N THR A 96 12.335 0.469 -10.605 1.00 0.00 N ATOM 1549 CA THR A 96 13.598 -0.012 -11.141 1.00 0.00 C ATOM 1550 C THR A 96 14.015 0.782 -12.379 1.00 0.00 C ATOM 1551 O THR A 96 15.196 0.844 -12.719 1.00 0.00 O ATOM 1552 CB THR A 96 13.473 -1.503 -11.465 1.00 0.00 C ATOM 1553 OG1 THR A 96 14.704 -2.170 -11.250 1.00 0.00 O ATOM 1554 CG2 THR A 96 13.036 -1.793 -12.888 1.00 0.00 C ATOM 0 H THR A 96 11.531 -0.109 -10.849 1.00 0.00 H new ATOM 0 HA THR A 96 14.376 0.130 -10.391 1.00 0.00 H new ATOM 0 HB THR A 96 12.697 -1.868 -10.792 1.00 0.00 H new ATOM 0 HG1 THR A 96 14.602 -3.121 -11.461 1.00 0.00 H new ATOM 0 HG21 THR A 96 12.972 -2.871 -13.036 1.00 0.00 H new ATOM 0 HG22 THR A 96 12.060 -1.343 -13.068 1.00 0.00 H new ATOM 0 HG23 THR A 96 13.762 -1.374 -13.584 1.00 0.00 H new ATOM 1562 N ASP A 97 13.036 1.388 -13.048 1.00 0.00 N ATOM 1563 CA ASP A 97 13.299 2.179 -14.248 1.00 0.00 C ATOM 1564 C ASP A 97 14.465 3.141 -14.027 1.00 0.00 C ATOM 1565 O ASP A 97 15.256 3.395 -14.935 1.00 0.00 O ATOM 1566 CB ASP A 97 12.043 2.958 -14.649 1.00 0.00 C ATOM 1567 CG ASP A 97 12.259 3.817 -15.881 1.00 0.00 C ATOM 1568 OD1 ASP A 97 12.713 4.970 -15.728 1.00 0.00 O ATOM 1569 OD2 ASP A 97 11.974 3.335 -16.998 1.00 0.00 O ATOM 0 H ASP A 97 12.053 1.346 -12.779 1.00 0.00 H new ATOM 0 HA ASP A 97 13.570 1.496 -15.053 1.00 0.00 H new ATOM 0 HB2 ASP A 97 11.230 2.257 -14.837 1.00 0.00 H new ATOM 0 HB3 ASP A 97 11.732 3.592 -13.818 1.00 0.00 H new ATOM 1574 N ASN A 98 14.562 3.670 -12.811 1.00 0.00 N ATOM 1575 CA ASN A 98 15.627 4.602 -12.458 1.00 0.00 C ATOM 1576 C ASN A 98 15.463 5.079 -11.019 1.00 0.00 C ATOM 1577 O ASN A 98 15.666 6.254 -10.715 1.00 0.00 O ATOM 1578 CB ASN A 98 15.627 5.802 -13.410 1.00 0.00 C ATOM 1579 CG ASN A 98 17.028 6.233 -13.797 1.00 0.00 C ATOM 1580 OD1 ASN A 98 17.848 6.562 -12.940 1.00 0.00 O ATOM 1581 ND2 ASN A 98 17.309 6.234 -15.095 1.00 0.00 N ATOM 0 H ASN A 98 13.913 3.468 -12.051 1.00 0.00 H new ATOM 0 HA ASN A 98 16.580 4.082 -12.549 1.00 0.00 H new ATOM 0 HB2 ASN A 98 15.066 5.548 -14.310 1.00 0.00 H new ATOM 0 HB3 ASN A 98 15.110 6.637 -12.937 1.00 0.00 H new ATOM 0 HD21 ASN A 98 18.235 6.515 -15.416 1.00 0.00 H new ATOM 0 HD22 ASN A 98 16.598 5.954 -15.771 1.00 0.00 H new ATOM 1588 N GLY A 99 15.086 4.156 -10.139 1.00 0.00 N ATOM 1589 CA GLY A 99 14.889 4.489 -8.743 1.00 0.00 C ATOM 1590 C GLY A 99 14.021 5.717 -8.556 1.00 0.00 C ATOM 1591 O GLY A 99 14.470 6.727 -8.015 1.00 0.00 O ATOM 0 H GLY A 99 14.913 3.178 -10.372 1.00 0.00 H new ATOM 0 HA2 GLY A 99 14.430 3.642 -8.232 1.00 0.00 H new ATOM 0 HA3 GLY A 99 15.858 4.658 -8.273 1.00 0.00 H new ATOM 1595 N ASN A 100 12.770 5.626 -8.995 1.00 0.00 N ATOM 1596 CA ASN A 100 11.838 6.738 -8.857 1.00 0.00 C ATOM 1597 C ASN A 100 11.374 6.849 -7.410 1.00 0.00 C ATOM 1598 O ASN A 100 11.114 5.844 -6.756 1.00 0.00 O ATOM 1599 CB ASN A 100 10.639 6.558 -9.787 1.00 0.00 C ATOM 1600 CG ASN A 100 10.936 7.001 -11.206 1.00 0.00 C ATOM 1601 OD1 ASN A 100 11.271 8.160 -11.450 1.00 0.00 O ATOM 1602 ND2 ASN A 100 10.813 6.078 -12.152 1.00 0.00 N ATOM 0 H ASN A 100 12.380 4.799 -9.447 1.00 0.00 H new ATOM 0 HA ASN A 100 12.350 7.658 -9.138 1.00 0.00 H new ATOM 0 HB2 ASN A 100 10.341 5.510 -9.792 1.00 0.00 H new ATOM 0 HB3 ASN A 100 9.794 7.128 -9.401 1.00 0.00 H new ATOM 0 HD21 ASN A 100 10.999 6.318 -13.126 1.00 0.00 H new ATOM 0 HD22 ASN A 100 10.533 5.129 -11.905 1.00 0.00 H new ATOM 1609 N GLU A 101 11.293 8.072 -6.912 1.00 0.00 N ATOM 1610 CA GLU A 101 10.886 8.310 -5.539 1.00 0.00 C ATOM 1611 C GLU A 101 9.394 8.113 -5.352 1.00 0.00 C ATOM 1612 O GLU A 101 8.577 8.619 -6.124 1.00 0.00 O ATOM 1613 CB GLU A 101 11.289 9.714 -5.099 1.00 0.00 C ATOM 1614 CG GLU A 101 12.558 9.728 -4.271 1.00 0.00 C ATOM 1615 CD GLU A 101 12.292 9.943 -2.794 1.00 0.00 C ATOM 1616 OE1 GLU A 101 11.869 8.980 -2.120 1.00 0.00 O ATOM 1617 OE2 GLU A 101 12.507 11.075 -2.311 1.00 0.00 O ATOM 0 H GLU A 101 11.505 8.918 -7.441 1.00 0.00 H new ATOM 0 HA GLU A 101 11.399 7.578 -4.915 1.00 0.00 H new ATOM 0 HB2 GLU A 101 11.429 10.340 -5.980 1.00 0.00 H new ATOM 0 HB3 GLU A 101 10.478 10.155 -4.520 1.00 0.00 H new ATOM 0 HG2 GLU A 101 13.086 8.784 -4.407 1.00 0.00 H new ATOM 0 HG3 GLU A 101 13.216 10.517 -4.636 1.00 0.00 H new ATOM 1624 N LEU A 102 9.057 7.372 -4.312 1.00 0.00 N ATOM 1625 CA LEU A 102 7.670 7.086 -3.989 1.00 0.00 C ATOM 1626 C LEU A 102 7.450 7.182 -2.480 1.00 0.00 C ATOM 1627 O LEU A 102 7.972 6.373 -1.714 1.00 0.00 O ATOM 1628 CB LEU A 102 7.306 5.698 -4.514 1.00 0.00 C ATOM 1629 CG LEU A 102 5.806 5.380 -4.570 1.00 0.00 C ATOM 1630 CD1 LEU A 102 5.467 4.589 -5.818 1.00 0.00 C ATOM 1631 CD2 LEU A 102 5.372 4.623 -3.325 1.00 0.00 C ATOM 0 H LEU A 102 9.731 6.954 -3.671 1.00 0.00 H new ATOM 0 HA LEU A 102 7.022 7.821 -4.466 1.00 0.00 H new ATOM 0 HB2 LEU A 102 7.719 5.589 -5.517 1.00 0.00 H new ATOM 0 HB3 LEU A 102 7.793 4.953 -3.886 1.00 0.00 H new ATOM 0 HG LEU A 102 5.262 6.324 -4.607 1.00 0.00 H new ATOM 0 HD11 LEU A 102 4.398 4.376 -5.835 1.00 0.00 H new ATOM 0 HD12 LEU A 102 5.735 5.170 -6.701 1.00 0.00 H new ATOM 0 HD13 LEU A 102 6.024 3.652 -5.817 1.00 0.00 H new ATOM 0 HD21 LEU A 102 4.305 4.407 -3.384 1.00 0.00 H new ATOM 0 HD22 LEU A 102 5.928 3.688 -3.255 1.00 0.00 H new ATOM 0 HD23 LEU A 102 5.571 5.230 -2.442 1.00 0.00 H new ATOM 1643 N ASN A 103 6.693 8.195 -2.060 1.00 0.00 N ATOM 1644 CA ASN A 103 6.428 8.417 -0.640 1.00 0.00 C ATOM 1645 C ASN A 103 4.992 8.076 -0.271 1.00 0.00 C ATOM 1646 O ASN A 103 4.065 8.301 -1.046 1.00 0.00 O ATOM 1647 CB ASN A 103 6.716 9.872 -0.261 1.00 0.00 C ATOM 1648 CG ASN A 103 7.974 10.409 -0.916 1.00 0.00 C ATOM 1649 OD1 ASN A 103 9.047 9.814 -0.807 1.00 0.00 O ATOM 1650 ND2 ASN A 103 7.848 11.539 -1.603 1.00 0.00 N ATOM 0 H ASN A 103 6.253 8.874 -2.682 1.00 0.00 H new ATOM 0 HA ASN A 103 7.091 7.754 -0.084 1.00 0.00 H new ATOM 0 HB2 ASN A 103 5.868 10.493 -0.549 1.00 0.00 H new ATOM 0 HB3 ASN A 103 6.814 9.949 0.822 1.00 0.00 H new ATOM 0 HD21 ASN A 103 8.660 11.947 -2.066 1.00 0.00 H new ATOM 0 HD22 ASN A 103 6.940 11.998 -1.667 1.00 0.00 H new ATOM 1657 N THR A 104 4.819 7.542 0.931 1.00 0.00 N ATOM 1658 CA THR A 104 3.499 7.179 1.425 1.00 0.00 C ATOM 1659 C THR A 104 3.410 7.373 2.934 1.00 0.00 C ATOM 1660 O THR A 104 4.250 6.878 3.685 1.00 0.00 O ATOM 1661 CB THR A 104 3.170 5.735 1.054 1.00 0.00 C ATOM 1662 OG1 THR A 104 3.133 5.580 -0.353 1.00 0.00 O ATOM 1663 CG2 THR A 104 1.844 5.258 1.608 1.00 0.00 C ATOM 0 H THR A 104 5.580 7.350 1.583 1.00 0.00 H new ATOM 0 HA THR A 104 2.768 7.836 0.954 1.00 0.00 H new ATOM 0 HB THR A 104 3.963 5.133 1.498 1.00 0.00 H new ATOM 0 HG1 THR A 104 2.204 5.622 -0.662 1.00 0.00 H new ATOM 0 HG21 THR A 104 1.674 4.225 1.306 1.00 0.00 H new ATOM 0 HG22 THR A 104 1.861 5.320 2.696 1.00 0.00 H new ATOM 0 HG23 THR A 104 1.041 5.886 1.221 1.00 0.00 H new ATOM 1671 N VAL A 105 2.386 8.099 3.370 1.00 0.00 N ATOM 1672 CA VAL A 105 2.187 8.366 4.788 1.00 0.00 C ATOM 1673 C VAL A 105 0.796 7.935 5.244 1.00 0.00 C ATOM 1674 O VAL A 105 -0.213 8.398 4.712 1.00 0.00 O ATOM 1675 CB VAL A 105 2.374 9.862 5.102 1.00 0.00 C ATOM 1676 CG1 VAL A 105 2.394 10.096 6.605 1.00 0.00 C ATOM 1677 CG2 VAL A 105 3.647 10.389 4.454 1.00 0.00 C ATOM 0 H VAL A 105 1.681 8.513 2.760 1.00 0.00 H new ATOM 0 HA VAL A 105 2.936 7.786 5.328 1.00 0.00 H new ATOM 0 HB VAL A 105 1.529 10.410 4.686 1.00 0.00 H new ATOM 0 HG11 VAL A 105 2.527 11.159 6.806 1.00 0.00 H new ATOM 0 HG12 VAL A 105 1.452 9.760 7.038 1.00 0.00 H new ATOM 0 HG13 VAL A 105 3.217 9.537 7.049 1.00 0.00 H new ATOM 0 HG21 VAL A 105 3.762 11.448 4.687 1.00 0.00 H new ATOM 0 HG22 VAL A 105 4.506 9.837 4.837 1.00 0.00 H new ATOM 0 HG23 VAL A 105 3.586 10.260 3.373 1.00 0.00 H new ATOM 1687 N ARG A 106 0.749 7.050 6.237 1.00 0.00 N ATOM 1688 CA ARG A 106 -0.522 6.565 6.768 1.00 0.00 C ATOM 1689 C ARG A 106 -0.702 6.991 8.221 1.00 0.00 C ATOM 1690 O ARG A 106 0.058 6.582 9.098 1.00 0.00 O ATOM 1691 CB ARG A 106 -0.622 5.036 6.661 1.00 0.00 C ATOM 1692 CG ARG A 106 0.720 4.322 6.609 1.00 0.00 C ATOM 1693 CD ARG A 106 1.256 4.231 5.189 1.00 0.00 C ATOM 1694 NE ARG A 106 1.112 2.885 4.638 1.00 0.00 N ATOM 1695 CZ ARG A 106 1.891 2.386 3.680 1.00 0.00 C ATOM 1696 NH1 ARG A 106 2.867 3.117 3.156 1.00 0.00 N ATOM 1697 NH2 ARG A 106 1.692 1.149 3.244 1.00 0.00 N ATOM 0 H ARG A 106 1.574 6.655 6.689 1.00 0.00 H new ATOM 0 HA ARG A 106 -1.316 7.009 6.168 1.00 0.00 H new ATOM 0 HB2 ARG A 106 -1.187 4.660 7.514 1.00 0.00 H new ATOM 0 HB3 ARG A 106 -1.190 4.783 5.766 1.00 0.00 H new ATOM 0 HG2 ARG A 106 1.438 4.851 7.235 1.00 0.00 H new ATOM 0 HG3 ARG A 106 0.615 3.319 7.023 1.00 0.00 H new ATOM 0 HD2 ARG A 106 0.726 4.942 4.555 1.00 0.00 H new ATOM 0 HD3 ARG A 106 2.308 4.517 5.179 1.00 0.00 H new ATOM 0 HE ARG A 106 0.370 2.292 5.010 1.00 0.00 H new ATOM 0 HH11 ARG A 106 3.025 4.069 3.487 1.00 0.00 H new ATOM 0 HH12 ARG A 106 3.459 2.727 2.423 1.00 0.00 H new ATOM 0 HH21 ARG A 106 0.944 0.582 3.642 1.00 0.00 H new ATOM 0 HH22 ARG A 106 2.287 0.765 2.510 1.00 0.00 H new ATOM 1711 N GLU A 107 -1.719 7.810 8.467 1.00 0.00 N ATOM 1712 CA GLU A 107 -2.009 8.287 9.813 1.00 0.00 C ATOM 1713 C GLU A 107 -3.447 7.957 10.195 1.00 0.00 C ATOM 1714 O GLU A 107 -4.376 8.208 9.428 1.00 0.00 O ATOM 1715 CB GLU A 107 -1.772 9.796 9.909 1.00 0.00 C ATOM 1716 CG GLU A 107 -2.608 10.607 8.934 1.00 0.00 C ATOM 1717 CD GLU A 107 -2.349 12.097 9.043 1.00 0.00 C ATOM 1718 OE1 GLU A 107 -2.844 12.717 10.007 1.00 0.00 O ATOM 1719 OE2 GLU A 107 -1.650 12.644 8.163 1.00 0.00 O ATOM 0 H GLU A 107 -2.357 8.157 7.751 1.00 0.00 H new ATOM 0 HA GLU A 107 -1.337 7.783 10.508 1.00 0.00 H new ATOM 0 HB2 GLU A 107 -1.992 10.126 10.924 1.00 0.00 H new ATOM 0 HB3 GLU A 107 -0.717 10.002 9.728 1.00 0.00 H new ATOM 0 HG2 GLU A 107 -2.394 10.278 7.917 1.00 0.00 H new ATOM 0 HG3 GLU A 107 -3.665 10.411 9.117 1.00 0.00 H new ATOM 1726 N ILE A 108 -3.625 7.387 11.382 1.00 0.00 N ATOM 1727 CA ILE A 108 -4.952 7.017 11.856 1.00 0.00 C ATOM 1728 C ILE A 108 -5.855 8.238 11.978 1.00 0.00 C ATOM 1729 O ILE A 108 -5.990 8.815 13.057 1.00 0.00 O ATOM 1730 CB ILE A 108 -4.894 6.306 13.225 1.00 0.00 C ATOM 1731 CG1 ILE A 108 -3.936 5.110 13.172 1.00 0.00 C ATOM 1732 CG2 ILE A 108 -6.289 5.866 13.657 1.00 0.00 C ATOM 1733 CD1 ILE A 108 -4.510 3.892 12.478 1.00 0.00 C ATOM 0 H ILE A 108 -2.869 7.172 12.032 1.00 0.00 H new ATOM 0 HA ILE A 108 -5.363 6.330 11.116 1.00 0.00 H new ATOM 0 HB ILE A 108 -4.514 7.011 13.965 1.00 0.00 H new ATOM 0 HG12 ILE A 108 -3.023 5.411 12.659 1.00 0.00 H new ATOM 0 HG13 ILE A 108 -3.655 4.837 14.189 1.00 0.00 H new ATOM 0 HG21 ILE A 108 -6.230 5.367 14.624 1.00 0.00 H new ATOM 0 HG22 ILE A 108 -6.937 6.739 13.738 1.00 0.00 H new ATOM 0 HG23 ILE A 108 -6.699 5.178 12.918 1.00 0.00 H new ATOM 0 HD11 ILE A 108 -3.772 3.090 12.482 1.00 0.00 H new ATOM 0 HD12 ILE A 108 -5.407 3.563 13.003 1.00 0.00 H new ATOM 0 HD13 ILE A 108 -4.765 4.146 11.449 1.00 0.00 H new ATOM 1745 N ILE A 109 -6.487 8.616 10.874 1.00 0.00 N ATOM 1746 CA ILE A 109 -7.391 9.753 10.878 1.00 0.00 C ATOM 1747 C ILE A 109 -8.720 9.347 11.502 1.00 0.00 C ATOM 1748 O ILE A 109 -9.413 8.467 10.989 1.00 0.00 O ATOM 1749 CB ILE A 109 -7.610 10.310 9.453 1.00 0.00 C ATOM 1750 CG1 ILE A 109 -7.901 11.809 9.511 1.00 0.00 C ATOM 1751 CG2 ILE A 109 -8.735 9.573 8.743 1.00 0.00 C ATOM 1752 CD1 ILE A 109 -6.776 12.617 10.121 1.00 0.00 C ATOM 0 H ILE A 109 -6.389 8.153 9.970 1.00 0.00 H new ATOM 0 HA ILE A 109 -6.939 10.547 11.472 1.00 0.00 H new ATOM 0 HB ILE A 109 -6.696 10.152 8.881 1.00 0.00 H new ATOM 0 HG12 ILE A 109 -8.094 12.173 8.502 1.00 0.00 H new ATOM 0 HG13 ILE A 109 -8.811 11.973 10.089 1.00 0.00 H new ATOM 0 HG21 ILE A 109 -8.866 9.986 7.743 1.00 0.00 H new ATOM 0 HG22 ILE A 109 -8.486 8.514 8.668 1.00 0.00 H new ATOM 0 HG23 ILE A 109 -9.660 9.689 9.308 1.00 0.00 H new ATOM 0 HD11 ILE A 109 -7.050 13.672 10.131 1.00 0.00 H new ATOM 0 HD12 ILE A 109 -6.597 12.279 11.142 1.00 0.00 H new ATOM 0 HD13 ILE A 109 -5.870 12.483 9.530 1.00 0.00 H new ATOM 1764 N GLY A 110 -9.065 9.961 12.626 1.00 0.00 N ATOM 1765 CA GLY A 110 -10.302 9.605 13.290 1.00 0.00 C ATOM 1766 C GLY A 110 -10.408 8.111 13.503 1.00 0.00 C ATOM 1767 O GLY A 110 -9.502 7.485 14.053 1.00 0.00 O ATOM 0 H GLY A 110 -8.518 10.690 13.085 1.00 0.00 H new ATOM 0 HA2 GLY A 110 -10.360 10.115 14.251 1.00 0.00 H new ATOM 0 HA3 GLY A 110 -11.148 9.949 12.695 1.00 0.00 H new ATOM 1771 N ASP A 111 -11.503 7.540 13.040 1.00 0.00 N ATOM 1772 CA ASP A 111 -11.726 6.104 13.147 1.00 0.00 C ATOM 1773 C ASP A 111 -11.336 5.406 11.842 1.00 0.00 C ATOM 1774 O ASP A 111 -11.683 4.247 11.617 1.00 0.00 O ATOM 1775 CB ASP A 111 -13.191 5.814 13.479 1.00 0.00 C ATOM 1776 CG ASP A 111 -14.148 6.568 12.576 1.00 0.00 C ATOM 1777 OD1 ASP A 111 -14.338 6.134 11.420 1.00 0.00 O ATOM 1778 OD2 ASP A 111 -14.706 7.591 13.024 1.00 0.00 O ATOM 0 H ASP A 111 -12.259 8.049 12.582 1.00 0.00 H new ATOM 0 HA ASP A 111 -11.101 5.718 13.953 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -13.377 4.744 13.388 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -13.386 6.084 14.517 1.00 0.00 H new ATOM 1783 N GLU A 112 -10.621 6.131 10.982 1.00 0.00 N ATOM 1784 CA GLU A 112 -10.187 5.608 9.695 1.00 0.00 C ATOM 1785 C GLU A 112 -8.705 5.880 9.465 1.00 0.00 C ATOM 1786 O GLU A 112 -8.054 6.549 10.268 1.00 0.00 O ATOM 1787 CB GLU A 112 -11.004 6.261 8.581 1.00 0.00 C ATOM 1788 CG GLU A 112 -12.440 5.777 8.527 1.00 0.00 C ATOM 1789 CD GLU A 112 -13.044 5.890 7.141 1.00 0.00 C ATOM 1790 OE1 GLU A 112 -12.758 6.888 6.447 1.00 0.00 O ATOM 1791 OE2 GLU A 112 -13.804 4.979 6.749 1.00 0.00 O ATOM 0 H GLU A 112 -10.330 7.092 11.160 1.00 0.00 H new ATOM 0 HA GLU A 112 -10.343 4.529 9.690 1.00 0.00 H new ATOM 0 HB2 GLU A 112 -10.997 7.342 8.721 1.00 0.00 H new ATOM 0 HB3 GLU A 112 -10.524 6.061 7.623 1.00 0.00 H new ATOM 0 HG2 GLU A 112 -12.481 4.738 8.853 1.00 0.00 H new ATOM 0 HG3 GLU A 112 -13.041 6.355 9.229 1.00 0.00 H new ATOM 1798 N LEU A 113 -8.181 5.376 8.353 1.00 0.00 N ATOM 1799 CA LEU A 113 -6.778 5.589 8.009 1.00 0.00 C ATOM 1800 C LEU A 113 -6.664 6.339 6.690 1.00 0.00 C ATOM 1801 O LEU A 113 -7.255 5.943 5.685 1.00 0.00 O ATOM 1802 CB LEU A 113 -6.019 4.261 7.902 1.00 0.00 C ATOM 1803 CG LEU A 113 -4.494 4.384 7.966 1.00 0.00 C ATOM 1804 CD1 LEU A 113 -4.015 4.411 9.406 1.00 0.00 C ATOM 1805 CD2 LEU A 113 -3.836 3.244 7.202 1.00 0.00 C ATOM 0 H LEU A 113 -8.703 4.819 7.676 1.00 0.00 H new ATOM 0 HA LEU A 113 -6.332 6.181 8.808 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -6.350 3.604 8.706 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.291 3.778 6.963 1.00 0.00 H new ATOM 0 HG LEU A 113 -4.207 5.325 7.497 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -2.929 4.499 9.427 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -4.458 5.264 9.921 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -4.314 3.490 9.906 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -2.752 3.347 7.258 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -4.133 2.292 7.642 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -4.150 3.276 6.159 1.00 0.00 H new ATOM 1817 N VAL A 114 -5.886 7.410 6.694 1.00 0.00 N ATOM 1818 CA VAL A 114 -5.676 8.199 5.490 1.00 0.00 C ATOM 1819 C VAL A 114 -4.301 7.895 4.914 1.00 0.00 C ATOM 1820 O VAL A 114 -3.280 8.297 5.471 1.00 0.00 O ATOM 1821 CB VAL A 114 -5.795 9.711 5.775 1.00 0.00 C ATOM 1822 CG1 VAL A 114 -4.799 10.138 6.844 1.00 0.00 C ATOM 1823 CG2 VAL A 114 -5.600 10.516 4.497 1.00 0.00 C ATOM 0 H VAL A 114 -5.390 7.753 7.517 1.00 0.00 H new ATOM 0 HA VAL A 114 -6.450 7.930 4.771 1.00 0.00 H new ATOM 0 HB VAL A 114 -6.799 9.910 6.151 1.00 0.00 H new ATOM 0 HG11 VAL A 114 -4.900 11.207 7.029 1.00 0.00 H new ATOM 0 HG12 VAL A 114 -4.997 9.590 7.765 1.00 0.00 H new ATOM 0 HG13 VAL A 114 -3.786 9.923 6.504 1.00 0.00 H new ATOM 0 HG21 VAL A 114 -5.688 11.579 4.720 1.00 0.00 H new ATOM 0 HG22 VAL A 114 -4.611 10.312 4.086 1.00 0.00 H new ATOM 0 HG23 VAL A 114 -6.361 10.234 3.770 1.00 0.00 H new ATOM 1833 N GLN A 115 -4.280 7.161 3.809 1.00 0.00 N ATOM 1834 CA GLN A 115 -3.027 6.780 3.177 1.00 0.00 C ATOM 1835 C GLN A 115 -2.756 7.604 1.924 1.00 0.00 C ATOM 1836 O GLN A 115 -3.374 7.394 0.880 1.00 0.00 O ATOM 1837 CB GLN A 115 -3.046 5.289 2.836 1.00 0.00 C ATOM 1838 CG GLN A 115 -1.789 4.554 3.271 1.00 0.00 C ATOM 1839 CD GLN A 115 -2.084 3.191 3.868 1.00 0.00 C ATOM 1840 OE1 GLN A 115 -1.467 2.785 4.852 1.00 0.00 O ATOM 1841 NE2 GLN A 115 -3.031 2.476 3.272 1.00 0.00 N ATOM 0 H GLN A 115 -5.115 6.819 3.334 1.00 0.00 H new ATOM 0 HA GLN A 115 -2.221 6.979 3.884 1.00 0.00 H new ATOM 0 HB2 GLN A 115 -3.911 4.826 3.311 1.00 0.00 H new ATOM 0 HB3 GLN A 115 -3.172 5.172 1.760 1.00 0.00 H new ATOM 0 HG2 GLN A 115 -1.128 4.435 2.413 1.00 0.00 H new ATOM 0 HG3 GLN A 115 -1.255 5.159 4.004 1.00 0.00 H new ATOM 0 HE21 GLN A 115 -3.518 2.852 2.458 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -3.272 1.551 3.628 1.00 0.00 H new ATOM 1850 N THR A 116 -1.816 8.533 2.037 1.00 0.00 N ATOM 1851 CA THR A 116 -1.439 9.388 0.920 1.00 0.00 C ATOM 1852 C THR A 116 -0.125 8.914 0.316 1.00 0.00 C ATOM 1853 O THR A 116 0.932 9.036 0.933 1.00 0.00 O ATOM 1854 CB THR A 116 -1.308 10.840 1.381 1.00 0.00 C ATOM 1855 OG1 THR A 116 -2.490 11.267 2.035 1.00 0.00 O ATOM 1856 CG2 THR A 116 -1.036 11.805 0.248 1.00 0.00 C ATOM 0 H THR A 116 -1.298 8.714 2.897 1.00 0.00 H new ATOM 0 HA THR A 116 -2.219 9.330 0.161 1.00 0.00 H new ATOM 0 HB THR A 116 -0.455 10.852 2.059 1.00 0.00 H new ATOM 0 HG1 THR A 116 -2.386 12.198 2.324 1.00 0.00 H new ATOM 0 HG21 THR A 116 -0.954 12.817 0.644 1.00 0.00 H new ATOM 0 HG22 THR A 116 -0.104 11.532 -0.246 1.00 0.00 H new ATOM 0 HG23 THR A 116 -1.854 11.762 -0.471 1.00 0.00 H new ATOM 1864 N TYR A 117 -0.196 8.384 -0.899 1.00 0.00 N ATOM 1865 CA TYR A 117 0.987 7.906 -1.589 1.00 0.00 C ATOM 1866 C TYR A 117 1.397 8.925 -2.640 1.00 0.00 C ATOM 1867 O TYR A 117 0.566 9.703 -3.104 1.00 0.00 O ATOM 1868 CB TYR A 117 0.711 6.560 -2.271 1.00 0.00 C ATOM 1869 CG TYR A 117 -0.045 5.555 -1.425 1.00 0.00 C ATOM 1870 CD1 TYR A 117 -1.397 5.721 -1.144 1.00 0.00 C ATOM 1871 CD2 TYR A 117 0.592 4.428 -0.920 1.00 0.00 C ATOM 1872 CE1 TYR A 117 -2.086 4.797 -0.383 1.00 0.00 C ATOM 1873 CE2 TYR A 117 -0.092 3.500 -0.160 1.00 0.00 C ATOM 1874 CZ TYR A 117 -1.430 3.689 0.106 1.00 0.00 C ATOM 1875 OH TYR A 117 -2.116 2.766 0.863 1.00 0.00 O ATOM 0 H TYR A 117 -1.064 8.276 -1.424 1.00 0.00 H new ATOM 0 HA TYR A 117 1.787 7.771 -0.861 1.00 0.00 H new ATOM 0 HB2 TYR A 117 0.145 6.742 -3.184 1.00 0.00 H new ATOM 0 HB3 TYR A 117 1.662 6.119 -2.569 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -1.917 6.587 -1.527 1.00 0.00 H new ATOM 0 HD2 TYR A 117 1.641 4.275 -1.126 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -3.135 4.943 -0.172 1.00 0.00 H new ATOM 0 HE2 TYR A 117 0.420 2.630 0.224 1.00 0.00 H new ATOM 0 HH TYR A 117 -1.508 2.045 1.130 1.00 0.00 H new ATOM 1885 N VAL A 118 2.664 8.916 -3.030 1.00 0.00 N ATOM 1886 CA VAL A 118 3.141 9.837 -4.043 1.00 0.00 C ATOM 1887 C VAL A 118 4.301 9.232 -4.827 1.00 0.00 C ATOM 1888 O VAL A 118 5.164 8.572 -4.255 1.00 0.00 O ATOM 1889 CB VAL A 118 3.588 11.182 -3.438 1.00 0.00 C ATOM 1890 CG1 VAL A 118 4.868 11.018 -2.635 1.00 0.00 C ATOM 1891 CG2 VAL A 118 3.772 12.210 -4.541 1.00 0.00 C ATOM 0 H VAL A 118 3.374 8.284 -2.661 1.00 0.00 H new ATOM 0 HA VAL A 118 2.302 10.022 -4.714 1.00 0.00 H new ATOM 0 HB VAL A 118 2.812 11.532 -2.757 1.00 0.00 H new ATOM 0 HG11 VAL A 118 5.162 11.981 -2.219 1.00 0.00 H new ATOM 0 HG12 VAL A 118 4.701 10.308 -1.825 1.00 0.00 H new ATOM 0 HG13 VAL A 118 5.660 10.646 -3.285 1.00 0.00 H new ATOM 0 HG21 VAL A 118 4.088 13.158 -4.106 1.00 0.00 H new ATOM 0 HG22 VAL A 118 4.531 11.861 -5.241 1.00 0.00 H new ATOM 0 HG23 VAL A 118 2.829 12.350 -5.069 1.00 0.00 H new ATOM 1901 N TYR A 119 4.315 9.464 -6.135 1.00 0.00 N ATOM 1902 CA TYR A 119 5.374 8.945 -6.993 1.00 0.00 C ATOM 1903 C TYR A 119 5.504 9.794 -8.252 1.00 0.00 C ATOM 1904 O TYR A 119 4.568 9.887 -9.044 1.00 0.00 O ATOM 1905 CB TYR A 119 5.094 7.483 -7.350 1.00 0.00 C ATOM 1906 CG TYR A 119 5.927 6.945 -8.493 1.00 0.00 C ATOM 1907 CD1 TYR A 119 5.591 7.214 -9.814 1.00 0.00 C ATOM 1908 CD2 TYR A 119 7.048 6.166 -8.248 1.00 0.00 C ATOM 1909 CE1 TYR A 119 6.351 6.719 -10.857 1.00 0.00 C ATOM 1910 CE2 TYR A 119 7.812 5.669 -9.284 1.00 0.00 C ATOM 1911 CZ TYR A 119 7.460 5.947 -10.587 1.00 0.00 C ATOM 1912 OH TYR A 119 8.220 5.453 -11.622 1.00 0.00 O ATOM 0 H TYR A 119 3.605 10.008 -6.625 1.00 0.00 H new ATOM 0 HA TYR A 119 6.319 8.993 -6.453 1.00 0.00 H new ATOM 0 HB2 TYR A 119 5.269 6.867 -6.468 1.00 0.00 H new ATOM 0 HB3 TYR A 119 4.039 7.380 -7.606 1.00 0.00 H new ATOM 0 HD1 TYR A 119 4.723 7.819 -10.029 1.00 0.00 H new ATOM 0 HD2 TYR A 119 7.328 5.945 -7.229 1.00 0.00 H new ATOM 0 HE1 TYR A 119 6.077 6.936 -11.879 1.00 0.00 H new ATOM 0 HE2 TYR A 119 8.682 5.065 -9.075 1.00 0.00 H new ATOM 0 HH TYR A 119 8.173 6.067 -12.384 1.00 0.00 H new ATOM 1922 N GLU A 120 6.676 10.409 -8.422 1.00 0.00 N ATOM 1923 CA GLU A 120 6.963 11.260 -9.570 1.00 0.00 C ATOM 1924 C GLU A 120 5.700 11.882 -10.161 1.00 0.00 C ATOM 1925 O GLU A 120 5.090 11.325 -11.071 1.00 0.00 O ATOM 1926 CB GLU A 120 7.690 10.448 -10.634 1.00 0.00 C ATOM 1927 CG GLU A 120 9.196 10.420 -10.448 1.00 0.00 C ATOM 1928 CD GLU A 120 9.606 9.980 -9.056 1.00 0.00 C ATOM 1929 OE1 GLU A 120 8.991 9.029 -8.530 1.00 0.00 O ATOM 1930 OE2 GLU A 120 10.542 10.586 -8.493 1.00 0.00 O ATOM 0 H GLU A 120 7.452 10.329 -7.764 1.00 0.00 H new ATOM 0 HA GLU A 120 7.594 12.079 -9.226 1.00 0.00 H new ATOM 0 HB2 GLU A 120 7.311 9.426 -10.622 1.00 0.00 H new ATOM 0 HB3 GLU A 120 7.460 10.862 -11.616 1.00 0.00 H new ATOM 0 HG2 GLU A 120 9.636 9.745 -11.182 1.00 0.00 H new ATOM 0 HG3 GLU A 120 9.601 11.413 -10.645 1.00 0.00 H new ATOM 1937 N GLY A 121 5.321 13.046 -9.643 1.00 0.00 N ATOM 1938 CA GLY A 121 4.142 13.733 -10.138 1.00 0.00 C ATOM 1939 C GLY A 121 2.834 13.031 -9.815 1.00 0.00 C ATOM 1940 O GLY A 121 1.761 13.542 -10.137 1.00 0.00 O ATOM 0 H GLY A 121 5.810 13.526 -8.888 1.00 0.00 H new ATOM 0 HA2 GLY A 121 4.116 14.738 -9.717 1.00 0.00 H new ATOM 0 HA3 GLY A 121 4.226 13.843 -11.219 1.00 0.00 H new ATOM 1944 N VAL A 122 2.911 11.861 -9.195 1.00 0.00 N ATOM 1945 CA VAL A 122 1.715 11.102 -8.855 1.00 0.00 C ATOM 1946 C VAL A 122 1.454 11.118 -7.358 1.00 0.00 C ATOM 1947 O VAL A 122 2.386 11.115 -6.560 1.00 0.00 O ATOM 1948 CB VAL A 122 1.838 9.643 -9.329 1.00 0.00 C ATOM 1949 CG1 VAL A 122 0.496 8.939 -9.295 1.00 0.00 C ATOM 1950 CG2 VAL A 122 2.426 9.588 -10.723 1.00 0.00 C ATOM 0 H VAL A 122 3.787 11.418 -8.918 1.00 0.00 H new ATOM 0 HA VAL A 122 0.878 11.580 -9.364 1.00 0.00 H new ATOM 0 HB VAL A 122 2.508 9.124 -8.644 1.00 0.00 H new ATOM 0 HG11 VAL A 122 0.616 7.910 -9.635 1.00 0.00 H new ATOM 0 HG12 VAL A 122 0.110 8.941 -8.276 1.00 0.00 H new ATOM 0 HG13 VAL A 122 -0.204 9.458 -9.949 1.00 0.00 H new ATOM 0 HG21 VAL A 122 2.506 8.549 -11.043 1.00 0.00 H new ATOM 0 HG22 VAL A 122 1.780 10.131 -11.412 1.00 0.00 H new ATOM 0 HG23 VAL A 122 3.416 10.044 -10.719 1.00 0.00 H new ATOM 1960 N GLU A 123 0.182 11.123 -6.986 1.00 0.00 N ATOM 1961 CA GLU A 123 -0.201 11.124 -5.587 1.00 0.00 C ATOM 1962 C GLU A 123 -1.601 10.555 -5.417 1.00 0.00 C ATOM 1963 O GLU A 123 -2.565 11.071 -5.983 1.00 0.00 O ATOM 1964 CB GLU A 123 -0.130 12.534 -5.009 1.00 0.00 C ATOM 1965 CG GLU A 123 0.345 12.562 -3.569 1.00 0.00 C ATOM 1966 CD GLU A 123 0.902 13.912 -3.160 1.00 0.00 C ATOM 1967 OE1 GLU A 123 1.733 14.464 -3.911 1.00 0.00 O ATOM 1968 OE2 GLU A 123 0.505 14.418 -2.089 1.00 0.00 O ATOM 0 H GLU A 123 -0.602 11.126 -7.638 1.00 0.00 H new ATOM 0 HA GLU A 123 0.500 10.492 -5.042 1.00 0.00 H new ATOM 0 HB2 GLU A 123 0.542 13.137 -5.619 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -1.116 12.995 -5.070 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -0.485 12.303 -2.912 1.00 0.00 H new ATOM 0 HG3 GLU A 123 1.112 11.800 -3.429 1.00 0.00 H new ATOM 1975 N ALA A 124 -1.708 9.483 -4.640 1.00 0.00 N ATOM 1976 CA ALA A 124 -2.994 8.845 -4.407 1.00 0.00 C ATOM 1977 C ALA A 124 -3.351 8.852 -2.929 1.00 0.00 C ATOM 1978 O ALA A 124 -2.517 8.568 -2.072 1.00 0.00 O ATOM 1979 CB ALA A 124 -2.994 7.418 -4.955 1.00 0.00 C ATOM 0 H ALA A 124 -0.922 9.041 -4.164 1.00 0.00 H new ATOM 0 HA ALA A 124 -3.754 9.419 -4.937 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -3.965 6.958 -4.771 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -2.800 7.440 -6.027 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -2.217 6.837 -4.458 1.00 0.00 H new ATOM 1985 N LYS A 125 -4.605 9.174 -2.644 1.00 0.00 N ATOM 1986 CA LYS A 125 -5.096 9.213 -1.275 1.00 0.00 C ATOM 1987 C LYS A 125 -6.046 8.050 -1.055 1.00 0.00 C ATOM 1988 O LYS A 125 -6.956 7.823 -1.851 1.00 0.00 O ATOM 1989 CB LYS A 125 -5.807 10.538 -0.997 1.00 0.00 C ATOM 1990 CG LYS A 125 -4.856 11.692 -0.721 1.00 0.00 C ATOM 1991 CD LYS A 125 -4.724 12.607 -1.929 1.00 0.00 C ATOM 1992 CE LYS A 125 -3.272 12.964 -2.203 1.00 0.00 C ATOM 1993 NZ LYS A 125 -3.123 14.371 -2.667 1.00 0.00 N ATOM 0 H LYS A 125 -5.304 9.413 -3.348 1.00 0.00 H new ATOM 0 HA LYS A 125 -4.254 9.131 -0.588 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -6.434 10.791 -1.852 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -6.471 10.412 -0.142 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -5.216 12.265 0.133 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -3.875 11.300 -0.451 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -5.151 12.118 -2.805 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -5.298 13.518 -1.761 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -2.685 12.817 -1.296 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -2.868 12.289 -2.957 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -2.118 14.574 -2.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -3.662 14.506 -3.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -3.484 15.017 -1.937 1.00 0.00 H new ATOM 2007 N ARG A 126 -5.812 7.289 0.002 1.00 0.00 N ATOM 2008 CA ARG A 126 -6.636 6.125 0.278 1.00 0.00 C ATOM 2009 C ARG A 126 -7.307 6.196 1.646 1.00 0.00 C ATOM 2010 O ARG A 126 -6.645 6.134 2.682 1.00 0.00 O ATOM 2011 CB ARG A 126 -5.774 4.865 0.181 1.00 0.00 C ATOM 2012 CG ARG A 126 -6.521 3.582 0.509 1.00 0.00 C ATOM 2013 CD ARG A 126 -5.572 2.399 0.616 1.00 0.00 C ATOM 2014 NE ARG A 126 -5.976 1.463 1.663 1.00 0.00 N ATOM 2015 CZ ARG A 126 -6.005 1.766 2.960 1.00 0.00 C ATOM 2016 NH1 ARG A 126 -5.663 2.980 3.373 1.00 0.00 N ATOM 2017 NH2 ARG A 126 -6.379 0.853 3.845 1.00 0.00 N ATOM 0 H ARG A 126 -5.065 7.454 0.677 1.00 0.00 H new ATOM 0 HA ARG A 126 -7.433 6.097 -0.465 1.00 0.00 H new ATOM 0 HB2 ARG A 126 -5.369 4.790 -0.828 1.00 0.00 H new ATOM 0 HB3 ARG A 126 -4.926 4.964 0.858 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -7.061 3.703 1.448 1.00 0.00 H new ATOM 0 HG3 ARG A 126 -7.265 3.385 -0.263 1.00 0.00 H new ATOM 0 HD2 ARG A 126 -5.534 1.878 -0.341 1.00 0.00 H new ATOM 0 HD3 ARG A 126 -4.565 2.760 0.822 1.00 0.00 H new ATOM 0 HE ARG A 126 -6.252 0.522 1.384 1.00 0.00 H new ATOM 0 HH11 ARG A 126 -5.376 3.687 2.696 1.00 0.00 H new ATOM 0 HH12 ARG A 126 -5.687 3.206 4.367 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -6.644 -0.081 3.533 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -6.401 1.084 4.838 1.00 0.00 H new ATOM 2031 N ILE A 127 -8.634 6.279 1.633 1.00 0.00 N ATOM 2032 CA ILE A 127 -9.414 6.304 2.860 1.00 0.00 C ATOM 2033 C ILE A 127 -9.570 4.876 3.354 1.00 0.00 C ATOM 2034 O ILE A 127 -9.749 3.958 2.552 1.00 0.00 O ATOM 2035 CB ILE A 127 -10.814 6.923 2.653 1.00 0.00 C ATOM 2036 CG1 ILE A 127 -10.708 8.378 2.181 1.00 0.00 C ATOM 2037 CG2 ILE A 127 -11.627 6.840 3.940 1.00 0.00 C ATOM 2038 CD1 ILE A 127 -10.017 8.546 0.845 1.00 0.00 C ATOM 0 H ILE A 127 -9.191 6.330 0.780 1.00 0.00 H new ATOM 0 HA ILE A 127 -8.888 6.923 3.586 1.00 0.00 H new ATOM 0 HB ILE A 127 -11.325 6.352 1.878 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -11.710 8.801 2.115 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -10.168 8.954 2.932 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -12.611 7.280 3.778 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -11.740 5.796 4.232 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -11.112 7.384 4.731 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -9.983 9.604 0.583 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -9.001 8.155 0.909 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -10.568 8.000 0.079 1.00 0.00 H new ATOM 2050 N PHE A 128 -9.465 4.672 4.657 1.00 0.00 N ATOM 2051 CA PHE A 128 -9.554 3.328 5.201 1.00 0.00 C ATOM 2052 C PHE A 128 -10.639 3.172 6.265 1.00 0.00 C ATOM 2053 O PHE A 128 -10.990 4.114 6.966 1.00 0.00 O ATOM 2054 CB PHE A 128 -8.207 2.943 5.800 1.00 0.00 C ATOM 2055 CG PHE A 128 -8.286 1.748 6.693 1.00 0.00 C ATOM 2056 CD1 PHE A 128 -8.444 0.495 6.151 1.00 0.00 C ATOM 2057 CD2 PHE A 128 -8.236 1.879 8.070 1.00 0.00 C ATOM 2058 CE1 PHE A 128 -8.553 -0.608 6.952 1.00 0.00 C ATOM 2059 CE2 PHE A 128 -8.336 0.766 8.884 1.00 0.00 C ATOM 2060 CZ PHE A 128 -8.496 -0.479 8.322 1.00 0.00 C ATOM 0 H PHE A 128 -9.320 5.408 5.348 1.00 0.00 H new ATOM 0 HA PHE A 128 -9.825 2.670 4.376 1.00 0.00 H new ATOM 0 HB2 PHE A 128 -7.501 2.742 4.994 1.00 0.00 H new ATOM 0 HB3 PHE A 128 -7.812 3.787 6.366 1.00 0.00 H new ATOM 0 HD1 PHE A 128 -8.483 0.380 5.078 1.00 0.00 H new ATOM 0 HD2 PHE A 128 -8.118 2.857 8.512 1.00 0.00 H new ATOM 0 HE1 PHE A 128 -8.684 -1.584 6.509 1.00 0.00 H new ATOM 0 HE2 PHE A 128 -8.289 0.874 9.958 1.00 0.00 H new ATOM 0 HZ PHE A 128 -8.577 -1.352 8.953 1.00 0.00 H new ATOM 2070 N LYS A 129 -11.122 1.941 6.390 1.00 0.00 N ATOM 2071 CA LYS A 129 -12.127 1.584 7.381 1.00 0.00 C ATOM 2072 C LYS A 129 -11.854 0.173 7.884 1.00 0.00 C ATOM 2073 O LYS A 129 -11.219 -0.622 7.195 1.00 0.00 O ATOM 2074 CB LYS A 129 -13.529 1.680 6.802 1.00 0.00 C ATOM 2075 CG LYS A 129 -13.797 0.680 5.700 1.00 0.00 C ATOM 2076 CD LYS A 129 -15.225 0.181 5.762 1.00 0.00 C ATOM 2077 CE LYS A 129 -15.859 0.113 4.382 1.00 0.00 C ATOM 2078 NZ LYS A 129 -16.706 1.305 4.101 1.00 0.00 N ATOM 0 H LYS A 129 -10.826 1.161 5.804 1.00 0.00 H new ATOM 0 HA LYS A 129 -12.067 2.287 8.212 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -14.255 1.531 7.602 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -13.685 2.687 6.414 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -13.610 1.142 4.730 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -13.109 -0.161 5.790 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -15.245 -0.808 6.220 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -15.813 0.840 6.400 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -15.077 0.037 3.627 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -16.465 -0.790 4.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -16.689 1.510 3.082 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -17.684 1.114 4.400 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -16.337 2.124 4.625 1.00 0.00 H new ATOM 2092 N LYS A 130 -12.321 -0.140 9.080 1.00 0.00 N ATOM 2093 CA LYS A 130 -12.096 -1.468 9.644 1.00 0.00 C ATOM 2094 C LYS A 130 -13.373 -2.296 9.681 1.00 0.00 C ATOM 2095 O LYS A 130 -14.477 -1.760 9.769 1.00 0.00 O ATOM 2096 CB LYS A 130 -11.497 -1.369 11.044 1.00 0.00 C ATOM 2097 CG LYS A 130 -12.194 -0.359 11.940 1.00 0.00 C ATOM 2098 CD LYS A 130 -11.516 -0.255 13.297 1.00 0.00 C ATOM 2099 CE LYS A 130 -12.147 -1.199 14.308 1.00 0.00 C ATOM 2100 NZ LYS A 130 -12.146 -0.623 15.681 1.00 0.00 N ATOM 0 H LYS A 130 -12.852 0.495 9.676 1.00 0.00 H new ATOM 0 HA LYS A 130 -11.388 -1.976 8.989 1.00 0.00 H new ATOM 0 HB2 LYS A 130 -11.539 -2.350 11.517 1.00 0.00 H new ATOM 0 HB3 LYS A 130 -10.444 -1.100 10.960 1.00 0.00 H new ATOM 0 HG2 LYS A 130 -12.194 0.618 11.457 1.00 0.00 H new ATOM 0 HG3 LYS A 130 -13.236 -0.649 12.074 1.00 0.00 H new ATOM 0 HD2 LYS A 130 -10.456 -0.486 13.194 1.00 0.00 H new ATOM 0 HD3 LYS A 130 -11.585 0.770 13.662 1.00 0.00 H new ATOM 0 HE2 LYS A 130 -13.171 -1.420 14.008 1.00 0.00 H new ATOM 0 HE3 LYS A 130 -11.604 -2.144 14.310 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 -12.585 -1.297 16.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 -11.167 -0.435 15.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 -12.686 0.266 15.685 1.00 0.00 H new ATOM 2114 N ASP A 131 -13.202 -3.611 9.614 1.00 0.00 N ATOM 2115 CA ASP A 131 -14.326 -4.538 9.638 1.00 0.00 C ATOM 2116 C ASP A 131 -14.836 -4.738 11.062 1.00 0.00 C ATOM 2117 O ASP A 131 -16.043 -4.513 11.294 1.00 0.35 O ATOM 2118 CB ASP A 131 -13.906 -5.880 9.039 1.00 0.00 C ATOM 2119 CG ASP A 131 -15.022 -6.537 8.250 1.00 0.00 C ATOM 2120 OD1 ASP A 131 -16.129 -6.694 8.807 1.00 0.00 O ATOM 2121 OD2 ASP A 131 -14.788 -6.896 7.077 1.00 0.00 O ATOM 2122 OXT ASP A 131 -14.026 -5.119 11.932 1.00 0.35 O ATOM 0 H ASP A 131 -12.289 -4.061 9.542 1.00 0.00 H new ATOM 0 HA ASP A 131 -15.134 -4.115 9.042 1.00 0.00 H new ATOM 0 HB2 ASP A 131 -13.044 -5.730 8.388 1.00 0.00 H new ATOM 0 HB3 ASP A 131 -13.589 -6.548 9.839 1.00 0.00 H new TER 2127 ASP A 131 HETATM 2128 O3 KTR A 201 1.437 4.144 -3.452 1.00 20.00 O HETATM 2129 C4 KTR A 201 -1.083 0.624 -4.575 1.00 20.00 C HETATM 2130 C5 KTR A 201 -0.064 0.881 -3.765 1.00 20.00 C HETATM 2131 C6 KTR A 201 1.825 0.007 -2.747 1.00 20.00 C HETATM 2132 N1 KTR A 201 0.642 -0.258 -3.605 1.00 20.00 N HETATM 2133 C7 KTR A 201 1.520 1.251 -2.002 1.00 20.00 C HETATM 2134 C8 KTR A 201 0.597 1.981 -2.944 1.00 20.00 C HETATM 2135 C9 KTR A 201 1.359 2.959 -3.842 1.00 20.00 C HETATM 2136 C10 KTR A 201 0.891 -3.232 -5.797 1.00 20.00 C HETATM 2137 C11 KTR A 201 1.556 -2.435 -6.724 1.00 20.00 C HETATM 2138 C12 KTR A 201 1.897 -2.936 -7.973 1.00 20.00 C HETATM 2139 C13 KTR A 201 1.572 -4.245 -8.306 1.00 20.00 C HETATM 2140 C14 KTR A 201 0.908 -5.050 -7.387 1.00 20.00 C HETATM 2141 C15 KTR A 201 0.571 -4.542 -6.139 1.00 20.00 C HETATM 2142 O1 KTR A 201 0.576 -3.381 -3.422 1.00 20.00 O HETATM 2143 C1 KTR A 201 0.510 -2.671 -4.426 1.00 20.00 C HETATM 2144 C2 KTR A 201 0.045 -1.219 -4.317 1.00 20.00 C HETATM 2145 C3 KTR A 201 -1.016 -0.701 -4.922 1.00 20.00 C HETATM 2146 O2 KTR A 201 1.847 2.499 -4.897 1.00 20.00 O HETATM 0 H9 KTR A 201 2.419 -2.303 -8.691 1.00 20.00 H new HETATM 0 H8 KTR A 201 1.812 -1.407 -6.467 1.00 20.00 H new HETATM 0 H7 KTR A 201 -0.129 2.591 -2.406 1.00 20.00 H new HETATM 0 H6 KTR A 201 1.041 1.043 -1.045 1.00 20.00 H new HETATM 0 H5 KTR A 201 2.420 1.827 -1.789 1.00 20.00 H new HETATM 0 H4 KTR A 201 2.005 -0.823 -2.063 1.00 20.00 H new HETATM 0 H3 KTR A 201 2.726 0.124 -3.350 1.00 20.00 H new HETATM 0 H2 KTR A 201 -1.838 1.338 -4.905 1.00 20.00 H new HETATM 0 H13 KTR A 201 -1.708 -1.232 -5.576 1.00 20.00 H new HETATM 0 H12 KTR A 201 0.051 -5.176 -5.421 1.00 20.00 H new HETATM 0 H11 KTR A 201 0.652 -6.078 -7.645 1.00 20.00 H new HETATM 0 H10 KTR A 201 1.837 -4.641 -9.286 1.00 20.00 H new HETATM 0 H1 KTR A 201 0.770 4.303 -2.752 1.00 20.00 H new