USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=38 USER MOD reduce.3.24.130724 removed 1305 hydrogens (45 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 153 HIS : no HE2:sc= -3.5! C(o=-2.6!,f=-20!) USER MOD Set 1.2: A 155 TYR OH : rot 101:sc= 0.867 USER MOD Set 2.1: A 143 THR OG1 : rot 180:sc= -0.568 USER MOD Set 2.2: A 154 THR OG1 : rot 180:sc= -5.19! USER MOD Set 3.1: A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.2: A 141 SER OG : rot 150:sc= -2.06 USER MOD Set 4.1: A 85 TYR OH : rot -101:sc= 0.665 USER MOD Set 4.2: A 89 HIS : no HE2:sc= -2.7! C(o=-2!,f=-7.2!) USER MOD Set 5.1: A 63 THR OG1 : rot 44:sc= -0.14 USER MOD Set 5.2: A 65 GLN :FLIP amide:sc= -1.46 F(o=-3.5,f=-1.6) USER MOD Set 6.1: A 58 THR OG1 : rot 100:sc= -0.415 USER MOD Set 6.2: A 92 GLN :FLIP amide:sc= 0.521 F(o=-0.85,f=0.11) USER MOD Set 7.1: A 39 MET CE :methyl -108:sc= -1.24 (180deg=-3.23!) USER MOD Set 7.2: A 59 ASN : amide:sc= -1.17 K(o=-2.4,f=-9.2!) USER MOD Set 8.1: A 29 TYR OH : rot -112:sc= 0.671 USER MOD Set 8.2: A 33 GLN : amide:sc= -3.47 K(o=-2.8,f=-12!) USER MOD Single : A 1 THR N :NH3+ 132:sc= 0.447 (180deg=0.0147) USER MOD Single : A 1 THR OG1 : rot 140:sc= -0.0888 USER MOD Single : A 7 GLN : amide:sc= -3.26! C(o=-3.3!,f=-2.9!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HE2:sc= -1.27 K(o=-1.3,f=-3.1!) USER MOD Single : A 22 HIS : no HD1:sc= -0.0166 X(o=-0.017,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.0473 X(o=-0.047,f=-0.42) USER MOD Single : A 34 THR OG1 : rot -74:sc= 1.26 USER MOD Single : A 37 LYS NZ :NH3+ 158:sc= 0.149 (180deg=0.0226) USER MOD Single : A 45 THR OG1 : rot -80:sc= -0.263 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 170:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -168:sc= -0.0526 (180deg=-0.29) USER MOD Single : A 64 HIS : no HD1:sc= -0.376 X(o=-0.38,f=-0.0064) USER MOD Single : A 68 TYR OH : rot 180:sc= -0.176 USER MOD Single : A 69 GLN : amide:sc= -0.0272 X(o=-0.027,f=-0.21) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HE2:sc= -3.55! C(o=-3.6!,f=-7.8!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.0191 X(o=-0.019,f=0) USER MOD Single : A 101 GLN :FLIP amide:sc= -0.0272 F(o=-2.2!,f=-0.027) USER MOD Single : A 104 THR OG1 : rot 180:sc= -0.293 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= 0 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 41:sc= 0.527 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -121:sc= -3.2 (180deg=-9.12!) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.015 USER MOD Single : A 148 ASN : amide:sc= -0.487 X(o=-0.49,f=-0.0057) USER MOD Single : A 152 THR OG1 : rot 98:sc= 0.00853 USER MOD Single : A 159 GLN : amide:sc= 0 K(o=0,f=-0.56) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 NDP O2D : rot -89:sc= -1.26! USER MOD Single : A 168 NDP O3B : rot 95:sc= 0.204 USER MOD Single : A 168 NDP O3D : rot -150:sc= -0.203 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.901 9.852 4.049 1.00 0.00 N ATOM 2 CA THR A 1 -5.384 9.246 2.788 1.00 0.00 C ATOM 3 C THR A 1 -3.868 9.089 2.877 1.00 0.00 C ATOM 4 O THR A 1 -3.129 10.055 2.873 1.00 0.00 O ATOM 5 CB THR A 1 -5.742 10.140 1.599 1.00 0.00 C ATOM 6 OG1 THR A 1 -6.854 10.956 1.941 1.00 0.00 O ATOM 7 CG2 THR A 1 -6.098 9.264 0.395 1.00 0.00 C ATOM 0 H1 THR A 1 -6.546 10.635 3.819 1.00 0.00 H new ATOM 0 H2 THR A 1 -6.413 9.131 4.596 1.00 0.00 H new ATOM 0 H3 THR A 1 -5.105 10.214 4.612 1.00 0.00 H new ATOM 0 HA THR A 1 -5.839 8.266 2.648 1.00 0.00 H new ATOM 0 HB THR A 1 -4.892 10.774 1.347 1.00 0.00 H new ATOM 0 HG1 THR A 1 -6.721 11.858 1.581 1.00 0.00 H new ATOM 0 HG21 THR A 1 -6.354 9.898 -0.454 1.00 0.00 H new ATOM 0 HG22 THR A 1 -5.244 8.638 0.136 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.950 8.631 0.645 1.00 0.00 H new ATOM 17 N ALA A 2 -3.401 7.873 2.962 1.00 0.00 N ATOM 18 CA ALA A 2 -1.934 7.643 3.061 1.00 0.00 C ATOM 19 C ALA A 2 -1.508 6.557 2.074 1.00 0.00 C ATOM 20 O ALA A 2 -2.288 5.716 1.689 1.00 0.00 O ATOM 21 CB ALA A 2 -1.596 7.186 4.479 1.00 0.00 C ATOM 0 H ALA A 2 -3.974 7.029 2.967 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.408 8.569 2.827 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.523 7.015 4.560 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.896 7.955 5.190 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -2.128 6.261 4.700 1.00 0.00 H new ATOM 27 N PHE A 3 -0.264 6.557 1.686 1.00 0.00 N ATOM 28 CA PHE A 3 0.228 5.513 0.745 1.00 0.00 C ATOM 29 C PHE A 3 1.086 4.521 1.528 1.00 0.00 C ATOM 30 O PHE A 3 1.946 4.911 2.292 1.00 0.00 O ATOM 31 CB PHE A 3 1.077 6.165 -0.346 1.00 0.00 C ATOM 32 CG PHE A 3 0.194 6.645 -1.471 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.943 7.408 -1.201 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.521 6.324 -2.786 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.752 7.847 -2.251 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.286 6.762 -3.836 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.422 7.523 -3.569 1.00 0.00 C ATOM 0 H PHE A 3 0.436 7.238 1.981 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.616 5.000 0.283 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.637 7.002 0.070 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.807 5.450 -0.726 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.197 7.658 -0.182 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.402 5.734 -2.993 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.633 8.437 -2.044 1.00 0.00 H new ATOM 0 HE2 PHE A 3 -0.030 6.511 -4.855 1.00 0.00 H new ATOM 0 HZ PHE A 3 -2.048 7.862 -4.381 1.00 0.00 H new ATOM 47 N LEU A 4 0.863 3.244 1.362 1.00 0.00 N ATOM 48 CA LEU A 4 1.677 2.250 2.118 1.00 0.00 C ATOM 49 C LEU A 4 2.159 1.151 1.166 1.00 0.00 C ATOM 50 O LEU A 4 1.446 0.210 0.886 1.00 0.00 O ATOM 51 CB LEU A 4 0.807 1.636 3.221 1.00 0.00 C ATOM 52 CG LEU A 4 1.554 0.490 3.911 1.00 0.00 C ATOM 53 CD1 LEU A 4 2.828 1.023 4.565 1.00 0.00 C ATOM 54 CD2 LEU A 4 0.652 -0.124 4.982 1.00 0.00 C ATOM 0 H LEU A 4 0.157 2.849 0.740 1.00 0.00 H new ATOM 0 HA LEU A 4 2.544 2.740 2.562 1.00 0.00 H new ATOM 0 HB2 LEU A 4 0.543 2.400 3.953 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.126 1.267 2.795 1.00 0.00 H new ATOM 0 HG LEU A 4 1.819 -0.267 3.173 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.356 0.204 5.054 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.470 1.465 3.803 1.00 0.00 H new ATOM 0 HD13 LEU A 4 2.568 1.780 5.304 1.00 0.00 H new ATOM 0 HD21 LEU A 4 1.178 -0.940 5.477 1.00 0.00 H new ATOM 0 HD22 LEU A 4 0.390 0.637 5.717 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -0.256 -0.507 4.517 1.00 0.00 H new ATOM 66 N TRP A 5 3.364 1.262 0.666 1.00 0.00 N ATOM 67 CA TRP A 5 3.878 0.215 -0.263 1.00 0.00 C ATOM 68 C TRP A 5 5.326 -0.138 0.086 1.00 0.00 C ATOM 69 O TRP A 5 5.921 0.431 0.981 1.00 0.00 O ATOM 70 CB TRP A 5 3.794 0.718 -1.708 1.00 0.00 C ATOM 71 CG TRP A 5 4.837 1.760 -1.978 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.991 1.542 -2.652 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.837 3.170 -1.610 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.691 2.734 -2.738 1.00 0.00 N ATOM 75 CE2 TRP A 5 6.023 3.764 -2.107 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.933 3.986 -0.905 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.298 5.116 -1.915 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.212 5.349 -0.709 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.391 5.912 -1.213 1.00 0.00 C ATOM 0 H TRP A 5 4.009 2.028 0.860 1.00 0.00 H new ATOM 0 HA TRP A 5 3.266 -0.681 -0.160 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.924 -0.118 -2.395 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.804 1.133 -1.895 1.00 0.00 H new ATOM 0 HD1 TRP A 5 6.313 0.594 -3.056 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.589 2.838 -3.210 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.020 3.562 -0.513 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 7.208 5.546 -2.307 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.512 5.967 -0.166 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.598 6.961 -1.059 1.00 0.00 H new ATOM 90 N ALA A 6 5.888 -1.078 -0.620 1.00 0.00 N ATOM 91 CA ALA A 6 7.295 -1.487 -0.355 1.00 0.00 C ATOM 92 C ALA A 6 8.038 -1.564 -1.687 1.00 0.00 C ATOM 93 O ALA A 6 7.513 -2.051 -2.669 1.00 0.00 O ATOM 94 CB ALA A 6 7.314 -2.857 0.326 1.00 0.00 C ATOM 0 H ALA A 6 5.428 -1.585 -1.376 1.00 0.00 H new ATOM 0 HA ALA A 6 7.777 -0.761 0.300 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.345 -3.153 0.518 1.00 0.00 H new ATOM 0 HB2 ALA A 6 6.770 -2.802 1.269 1.00 0.00 H new ATOM 0 HB3 ALA A 6 6.840 -3.593 -0.324 1.00 0.00 H new ATOM 100 N GLN A 7 9.244 -1.071 -1.739 1.00 0.00 N ATOM 101 CA GLN A 7 9.998 -1.109 -3.023 1.00 0.00 C ATOM 102 C GLN A 7 11.483 -1.345 -2.757 1.00 0.00 C ATOM 103 O GLN A 7 11.991 -1.041 -1.697 1.00 0.00 O ATOM 104 CB GLN A 7 9.815 0.220 -3.760 1.00 0.00 C ATOM 105 CG GLN A 7 10.110 1.379 -2.804 1.00 0.00 C ATOM 106 CD GLN A 7 10.693 2.557 -3.586 1.00 0.00 C ATOM 107 OE1 GLN A 7 9.963 3.394 -4.080 1.00 0.00 O ATOM 108 NE2 GLN A 7 11.987 2.658 -3.721 1.00 0.00 N ATOM 0 H GLN A 7 9.737 -0.646 -0.954 1.00 0.00 H new ATOM 0 HA GLN A 7 9.615 -1.925 -3.636 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.482 0.266 -4.621 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.797 0.299 -4.141 1.00 0.00 H new ATOM 0 HG2 GLN A 7 9.196 1.685 -2.295 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.812 1.058 -2.034 1.00 0.00 H new ATOM 0 HE21 GLN A 7 12.599 1.956 -3.306 1.00 0.00 H new ATOM 0 HE22 GLN A 7 12.386 3.439 -4.241 1.00 0.00 H new ATOM 117 N ASP A 8 12.180 -1.892 -3.716 1.00 0.00 N ATOM 118 CA ASP A 8 13.633 -2.156 -3.527 1.00 0.00 C ATOM 119 C ASP A 8 14.432 -0.877 -3.796 1.00 0.00 C ATOM 120 O ASP A 8 13.888 0.209 -3.845 1.00 0.00 O ATOM 121 CB ASP A 8 14.079 -3.268 -4.483 1.00 0.00 C ATOM 122 CG ASP A 8 13.794 -2.863 -5.932 1.00 0.00 C ATOM 123 OD1 ASP A 8 14.094 -1.736 -6.286 1.00 0.00 O ATOM 124 OD2 ASP A 8 13.283 -3.694 -6.665 1.00 0.00 O ATOM 0 H ASP A 8 11.804 -2.167 -4.623 1.00 0.00 H new ATOM 0 HA ASP A 8 13.814 -2.474 -2.500 1.00 0.00 H new ATOM 0 HB2 ASP A 8 15.144 -3.463 -4.355 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.554 -4.194 -4.246 1.00 0.00 H new ATOM 129 N ARG A 9 15.724 -0.999 -3.949 1.00 0.00 N ATOM 130 CA ARG A 9 16.568 0.207 -4.193 1.00 0.00 C ATOM 131 C ARG A 9 16.116 0.935 -5.468 1.00 0.00 C ATOM 132 O ARG A 9 16.068 2.149 -5.505 1.00 0.00 O ATOM 133 CB ARG A 9 18.042 -0.204 -4.317 1.00 0.00 C ATOM 134 CG ARG A 9 18.202 -1.308 -5.369 1.00 0.00 C ATOM 135 CD ARG A 9 19.019 -0.782 -6.556 1.00 0.00 C ATOM 136 NE ARG A 9 20.283 -1.569 -6.680 1.00 0.00 N ATOM 137 CZ ARG A 9 21.341 -1.267 -5.963 1.00 0.00 C ATOM 138 NH1 ARG A 9 21.323 -0.264 -5.122 1.00 0.00 N ATOM 139 NH2 ARG A 9 22.427 -1.981 -6.088 1.00 0.00 N ATOM 0 H ARG A 9 16.232 -1.883 -3.915 1.00 0.00 H new ATOM 0 HA ARG A 9 16.455 0.887 -3.349 1.00 0.00 H new ATOM 0 HB2 ARG A 9 18.645 0.661 -4.593 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.411 -0.555 -3.353 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.699 -2.173 -4.929 1.00 0.00 H new ATOM 0 HG3 ARG A 9 17.222 -1.642 -5.710 1.00 0.00 H new ATOM 0 HD2 ARG A 9 18.438 -0.861 -7.475 1.00 0.00 H new ATOM 0 HD3 ARG A 9 19.248 0.274 -6.414 1.00 0.00 H new ATOM 0 HE ARG A 9 20.325 -2.353 -7.331 1.00 0.00 H new ATOM 0 HH11 ARG A 9 20.478 0.297 -5.016 1.00 0.00 H new ATOM 0 HH12 ARG A 9 22.154 -0.044 -4.573 1.00 0.00 H new ATOM 0 HH21 ARG A 9 22.449 -2.766 -6.739 1.00 0.00 H new ATOM 0 HH22 ARG A 9 23.253 -1.754 -5.535 1.00 0.00 H new ATOM 153 N ASP A 10 15.799 0.218 -6.517 1.00 0.00 N ATOM 154 CA ASP A 10 15.370 0.888 -7.783 1.00 0.00 C ATOM 155 C ASP A 10 13.960 1.468 -7.630 1.00 0.00 C ATOM 156 O ASP A 10 13.633 2.487 -8.208 1.00 0.00 O ATOM 157 CB ASP A 10 15.374 -0.134 -8.922 1.00 0.00 C ATOM 158 CG ASP A 10 16.812 -0.383 -9.380 1.00 0.00 C ATOM 159 OD1 ASP A 10 17.437 0.557 -9.840 1.00 0.00 O ATOM 160 OD2 ASP A 10 17.262 -1.511 -9.264 1.00 0.00 O ATOM 0 H ASP A 10 15.819 -0.801 -6.552 1.00 0.00 H new ATOM 0 HA ASP A 10 16.064 1.699 -8.005 1.00 0.00 H new ATOM 0 HB2 ASP A 10 14.921 -1.067 -8.589 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.774 0.232 -9.755 1.00 0.00 H new ATOM 165 N GLY A 11 13.129 0.832 -6.854 1.00 0.00 N ATOM 166 CA GLY A 11 11.742 1.352 -6.662 1.00 0.00 C ATOM 167 C GLY A 11 10.732 0.401 -7.307 1.00 0.00 C ATOM 168 O GLY A 11 9.751 0.822 -7.889 1.00 0.00 O ATOM 0 H GLY A 11 13.347 -0.024 -6.344 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.528 1.456 -5.598 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.653 2.345 -7.104 1.00 0.00 H new ATOM 172 N LEU A 12 10.958 -0.876 -7.194 1.00 0.00 N ATOM 173 CA LEU A 12 10.014 -1.869 -7.782 1.00 0.00 C ATOM 174 C LEU A 12 8.911 -2.155 -6.762 1.00 0.00 C ATOM 175 O LEU A 12 9.054 -1.843 -5.600 1.00 0.00 O ATOM 176 CB LEU A 12 10.789 -3.158 -8.073 1.00 0.00 C ATOM 177 CG LEU A 12 9.877 -4.202 -8.718 1.00 0.00 C ATOM 178 CD1 LEU A 12 9.378 -3.685 -10.065 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.673 -5.491 -8.930 1.00 0.00 C ATOM 0 H LEU A 12 11.763 -1.280 -6.715 1.00 0.00 H new ATOM 0 HA LEU A 12 9.573 -1.486 -8.702 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.628 -2.942 -8.734 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.206 -3.554 -7.147 1.00 0.00 H new ATOM 0 HG LEU A 12 9.022 -4.395 -8.070 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.728 -4.431 -10.523 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.820 -2.760 -9.916 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.229 -3.494 -10.719 1.00 0.00 H new ATOM 0 HD21 LEU A 12 10.032 -6.243 -9.390 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.523 -5.291 -9.582 1.00 0.00 H new ATOM 0 HD23 LEU A 12 11.032 -5.859 -7.969 1.00 0.00 H new ATOM 191 N ILE A 13 7.823 -2.758 -7.169 1.00 0.00 N ATOM 192 CA ILE A 13 6.752 -3.077 -6.182 1.00 0.00 C ATOM 193 C ILE A 13 6.340 -4.544 -6.353 1.00 0.00 C ATOM 194 O ILE A 13 6.565 -5.354 -5.477 1.00 0.00 O ATOM 195 CB ILE A 13 5.537 -2.151 -6.347 1.00 0.00 C ATOM 196 CG1 ILE A 13 5.249 -1.874 -7.824 1.00 0.00 C ATOM 197 CG2 ILE A 13 5.817 -0.825 -5.638 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.733 -1.829 -8.036 1.00 0.00 C ATOM 0 H ILE A 13 7.632 -3.040 -8.131 1.00 0.00 H new ATOM 0 HA ILE A 13 7.141 -2.917 -5.177 1.00 0.00 H new ATOM 0 HB ILE A 13 4.668 -2.644 -5.911 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.699 -0.928 -8.125 1.00 0.00 H new ATOM 0 HG13 ILE A 13 5.693 -2.651 -8.446 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.958 -0.163 -5.751 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.995 -1.009 -4.579 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.697 -0.356 -6.078 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.518 -1.632 -9.086 1.00 0.00 H new ATOM 0 HD12 ILE A 13 3.297 -2.786 -7.750 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.303 -1.037 -7.423 1.00 0.00 H new ATOM 210 N GLY A 14 5.728 -4.899 -7.456 1.00 0.00 N ATOM 211 CA GLY A 14 5.305 -6.319 -7.642 1.00 0.00 C ATOM 212 C GLY A 14 5.300 -6.664 -9.130 1.00 0.00 C ATOM 213 O GLY A 14 4.949 -5.851 -9.961 1.00 0.00 O ATOM 0 H GLY A 14 5.505 -4.272 -8.229 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.983 -6.984 -7.107 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.311 -6.471 -7.220 1.00 0.00 H new ATOM 217 N LYS A 15 5.696 -7.860 -9.478 1.00 0.00 N ATOM 218 CA LYS A 15 5.720 -8.244 -10.917 1.00 0.00 C ATOM 219 C LYS A 15 4.815 -9.454 -11.142 1.00 0.00 C ATOM 220 O LYS A 15 4.924 -10.459 -10.468 1.00 0.00 O ATOM 221 CB LYS A 15 7.153 -8.601 -11.327 1.00 0.00 C ATOM 222 CG LYS A 15 7.210 -8.851 -12.838 1.00 0.00 C ATOM 223 CD LYS A 15 8.027 -10.116 -13.120 1.00 0.00 C ATOM 224 CE LYS A 15 8.867 -9.914 -14.384 1.00 0.00 C ATOM 225 NZ LYS A 15 10.096 -10.752 -14.304 1.00 0.00 N ATOM 0 H LYS A 15 6.003 -8.585 -8.829 1.00 0.00 H new ATOM 0 HA LYS A 15 5.364 -7.407 -11.518 1.00 0.00 H new ATOM 0 HB2 LYS A 15 7.831 -7.792 -11.057 1.00 0.00 H new ATOM 0 HB3 LYS A 15 7.485 -9.489 -10.789 1.00 0.00 H new ATOM 0 HG2 LYS A 15 6.202 -8.961 -13.237 1.00 0.00 H new ATOM 0 HG3 LYS A 15 7.660 -7.996 -13.341 1.00 0.00 H new ATOM 0 HD2 LYS A 15 8.675 -10.339 -12.272 1.00 0.00 H new ATOM 0 HD3 LYS A 15 7.362 -10.970 -13.246 1.00 0.00 H new ATOM 0 HE2 LYS A 15 8.287 -10.184 -15.266 1.00 0.00 H new ATOM 0 HE3 LYS A 15 9.137 -8.863 -14.490 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 10.666 -10.615 -15.163 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 10.652 -10.474 -13.471 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 9.828 -11.754 -14.223 1.00 0.00 H new ATOM 239 N ASP A 16 3.935 -9.371 -12.102 1.00 0.00 N ATOM 240 CA ASP A 16 3.030 -10.515 -12.404 1.00 0.00 C ATOM 241 C ASP A 16 2.311 -11.011 -11.141 1.00 0.00 C ATOM 242 O ASP A 16 2.343 -12.185 -10.827 1.00 0.00 O ATOM 243 CB ASP A 16 3.849 -11.658 -13.008 1.00 0.00 C ATOM 244 CG ASP A 16 4.330 -11.257 -14.404 1.00 0.00 C ATOM 245 OD1 ASP A 16 3.504 -11.204 -15.301 1.00 0.00 O ATOM 246 OD2 ASP A 16 5.515 -11.009 -14.553 1.00 0.00 O ATOM 0 H ASP A 16 3.804 -8.552 -12.695 1.00 0.00 H new ATOM 0 HA ASP A 16 2.273 -10.176 -13.112 1.00 0.00 H new ATOM 0 HB2 ASP A 16 4.702 -11.886 -12.369 1.00 0.00 H new ATOM 0 HB3 ASP A 16 3.244 -12.563 -13.066 1.00 0.00 H new ATOM 251 N GLY A 17 1.620 -10.146 -10.440 1.00 0.00 N ATOM 252 CA GLY A 17 0.857 -10.596 -9.238 1.00 0.00 C ATOM 253 C GLY A 17 1.754 -10.791 -8.008 1.00 0.00 C ATOM 254 O GLY A 17 1.821 -9.945 -7.138 1.00 0.00 O ATOM 0 H GLY A 17 1.552 -9.150 -10.649 1.00 0.00 H new ATOM 0 HA2 GLY A 17 0.085 -9.862 -9.007 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.349 -11.533 -9.465 1.00 0.00 H new ATOM 258 N HIS A 18 2.399 -11.921 -7.908 1.00 0.00 N ATOM 259 CA HIS A 18 3.245 -12.212 -6.710 1.00 0.00 C ATOM 260 C HIS A 18 4.448 -11.270 -6.618 1.00 0.00 C ATOM 261 O HIS A 18 5.124 -11.002 -7.592 1.00 0.00 O ATOM 262 CB HIS A 18 3.744 -13.656 -6.790 1.00 0.00 C ATOM 263 CG HIS A 18 4.461 -13.869 -8.095 1.00 0.00 C ATOM 264 ND1 HIS A 18 5.772 -13.465 -8.292 1.00 0.00 N ATOM 265 CD2 HIS A 18 4.063 -14.441 -9.278 1.00 0.00 C ATOM 266 CE1 HIS A 18 6.114 -13.796 -9.550 1.00 0.00 C ATOM 267 NE2 HIS A 18 5.108 -14.393 -10.196 1.00 0.00 N ATOM 0 H HIS A 18 2.378 -12.662 -8.609 1.00 0.00 H new ATOM 0 HA HIS A 18 2.633 -12.062 -5.821 1.00 0.00 H new ATOM 0 HB2 HIS A 18 4.414 -13.867 -5.956 1.00 0.00 H new ATOM 0 HB3 HIS A 18 2.905 -14.347 -6.707 1.00 0.00 H new ATOM 0 HD1 HIS A 18 6.369 -13.001 -7.607 1.00 0.00 H new ATOM 0 HD2 HIS A 18 3.087 -14.864 -9.467 1.00 0.00 H new ATOM 0 HE1 HIS A 18 7.083 -13.603 -9.985 1.00 0.00 H new ATOM 275 N LEU A 19 4.724 -10.784 -5.432 1.00 0.00 N ATOM 276 CA LEU A 19 5.893 -9.875 -5.234 1.00 0.00 C ATOM 277 C LEU A 19 7.152 -10.570 -5.766 1.00 0.00 C ATOM 278 O LEU A 19 7.170 -11.776 -5.912 1.00 0.00 O ATOM 279 CB LEU A 19 6.071 -9.592 -3.738 1.00 0.00 C ATOM 280 CG LEU A 19 5.379 -8.277 -3.368 1.00 0.00 C ATOM 281 CD1 LEU A 19 4.721 -8.417 -1.995 1.00 0.00 C ATOM 282 CD2 LEU A 19 6.414 -7.152 -3.313 1.00 0.00 C ATOM 0 H LEU A 19 4.185 -10.980 -4.588 1.00 0.00 H new ATOM 0 HA LEU A 19 5.728 -8.937 -5.765 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.652 -10.410 -3.152 1.00 0.00 H new ATOM 0 HB3 LEU A 19 7.132 -9.536 -3.494 1.00 0.00 H new ATOM 0 HG LEU A 19 4.623 -8.044 -4.118 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.228 -7.481 -1.731 1.00 0.00 H new ATOM 0 HD12 LEU A 19 3.984 -9.220 -2.025 1.00 0.00 H new ATOM 0 HD13 LEU A 19 5.481 -8.650 -1.249 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.921 -6.216 -3.050 1.00 0.00 H new ATOM 0 HD22 LEU A 19 7.169 -7.388 -2.563 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.891 -7.049 -4.288 1.00 0.00 H new ATOM 294 N PRO A 20 8.169 -9.794 -6.042 1.00 0.00 N ATOM 295 CA PRO A 20 9.492 -10.258 -6.577 1.00 0.00 C ATOM 296 C PRO A 20 10.385 -10.746 -5.433 1.00 0.00 C ATOM 297 O PRO A 20 11.172 -11.658 -5.597 1.00 0.00 O ATOM 298 CB PRO A 20 10.121 -9.045 -7.259 1.00 0.00 C ATOM 299 CG PRO A 20 9.279 -7.837 -6.897 1.00 0.00 C ATOM 300 CD PRO A 20 8.236 -8.301 -5.890 1.00 0.00 C ATOM 0 HA PRO A 20 9.372 -11.089 -7.272 1.00 0.00 H new ATOM 0 HB2 PRO A 20 11.151 -8.909 -6.928 1.00 0.00 H new ATOM 0 HB3 PRO A 20 10.149 -9.184 -8.340 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.900 -7.048 -6.472 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.800 -7.422 -7.784 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.519 -8.022 -4.875 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.267 -7.842 -6.088 1.00 0.00 H new ATOM 308 N TRP A 21 10.283 -10.136 -4.283 1.00 0.00 N ATOM 309 CA TRP A 21 11.138 -10.551 -3.135 1.00 0.00 C ATOM 310 C TRP A 21 10.267 -11.095 -1.999 1.00 0.00 C ATOM 311 O TRP A 21 9.224 -10.555 -1.688 1.00 0.00 O ATOM 312 CB TRP A 21 11.911 -9.331 -2.626 1.00 0.00 C ATOM 313 CG TRP A 21 10.943 -8.231 -2.327 1.00 0.00 C ATOM 314 CD1 TRP A 21 10.159 -8.161 -1.225 1.00 0.00 C ATOM 315 CD2 TRP A 21 10.635 -7.053 -3.124 1.00 0.00 C ATOM 316 NE1 TRP A 21 9.382 -7.019 -1.300 1.00 0.00 N ATOM 317 CE2 TRP A 21 9.642 -6.300 -2.450 1.00 0.00 C ATOM 318 CE3 TRP A 21 11.115 -6.568 -4.355 1.00 0.00 C ATOM 319 CZ2 TRP A 21 9.141 -5.110 -2.979 1.00 0.00 C ATOM 320 CZ3 TRP A 21 10.613 -5.369 -4.890 1.00 0.00 C ATOM 321 CH2 TRP A 21 9.628 -4.643 -4.203 1.00 0.00 C ATOM 0 H TRP A 21 9.643 -9.366 -4.089 1.00 0.00 H new ATOM 0 HA TRP A 21 11.827 -11.329 -3.463 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.475 -9.590 -1.730 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.633 -9.004 -3.374 1.00 0.00 H new ATOM 0 HD1 TRP A 21 10.143 -8.880 -0.419 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.701 -6.742 -0.593 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.873 -7.120 -4.891 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.383 -4.554 -2.447 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 10.987 -5.004 -5.835 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.246 -3.723 -4.620 1.00 0.00 H new ATOM 332 N HIS A 22 10.693 -12.156 -1.375 1.00 0.00 N ATOM 333 CA HIS A 22 9.902 -12.727 -0.250 1.00 0.00 C ATOM 334 C HIS A 22 10.390 -12.104 1.061 1.00 0.00 C ATOM 335 O HIS A 22 11.375 -12.532 1.631 1.00 0.00 O ATOM 336 CB HIS A 22 10.096 -14.244 -0.206 1.00 0.00 C ATOM 337 CG HIS A 22 9.073 -14.854 0.711 1.00 0.00 C ATOM 338 ND1 HIS A 22 9.429 -15.585 1.834 1.00 0.00 N ATOM 339 CD2 HIS A 22 7.700 -14.850 0.686 1.00 0.00 C ATOM 340 CE1 HIS A 22 8.294 -15.987 2.433 1.00 0.00 C ATOM 341 NE2 HIS A 22 7.210 -15.567 1.774 1.00 0.00 N ATOM 0 H HIS A 22 11.556 -12.653 -1.595 1.00 0.00 H new ATOM 0 HA HIS A 22 8.843 -12.509 -0.390 1.00 0.00 H new ATOM 0 HB2 HIS A 22 9.998 -14.663 -1.207 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.101 -14.483 0.143 1.00 0.00 H new ATOM 0 HD2 HIS A 22 7.093 -14.365 -0.064 1.00 0.00 H new ATOM 0 HE1 HIS A 22 8.262 -16.577 3.337 1.00 0.00 H new ATOM 0 HE2 HIS A 22 6.234 -15.736 2.016 1.00 0.00 H new ATOM 349 N LEU A 23 9.712 -11.094 1.543 1.00 0.00 N ATOM 350 CA LEU A 23 10.144 -10.442 2.815 1.00 0.00 C ATOM 351 C LEU A 23 9.035 -10.577 3.865 1.00 0.00 C ATOM 352 O LEU A 23 8.062 -9.850 3.827 1.00 0.00 O ATOM 353 CB LEU A 23 10.424 -8.955 2.562 1.00 0.00 C ATOM 354 CG LEU A 23 11.267 -8.387 3.711 1.00 0.00 C ATOM 355 CD1 LEU A 23 12.686 -8.942 3.624 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.320 -6.856 3.614 1.00 0.00 C ATOM 0 H LEU A 23 8.879 -10.693 1.111 1.00 0.00 H new ATOM 0 HA LEU A 23 11.050 -10.927 3.177 1.00 0.00 H new ATOM 0 HB2 LEU A 23 10.950 -8.830 1.615 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.486 -8.407 2.481 1.00 0.00 H new ATOM 0 HG LEU A 23 10.814 -8.675 4.660 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.285 -8.539 4.440 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.657 -10.029 3.698 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.131 -8.655 2.671 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.920 -6.460 4.433 1.00 0.00 H new ATOM 0 HD22 LEU A 23 11.768 -6.567 2.663 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.309 -6.452 3.677 1.00 0.00 H new ATOM 368 N PRO A 24 9.217 -11.499 4.779 1.00 0.00 N ATOM 369 CA PRO A 24 8.263 -11.795 5.902 1.00 0.00 C ATOM 370 C PRO A 24 8.186 -10.588 6.839 1.00 0.00 C ATOM 371 O PRO A 24 7.131 -10.237 7.332 1.00 0.00 O ATOM 372 CB PRO A 24 8.802 -13.011 6.651 1.00 0.00 C ATOM 373 CG PRO A 24 10.099 -13.425 5.992 1.00 0.00 C ATOM 374 CD PRO A 24 10.399 -12.427 4.880 1.00 0.00 C ATOM 0 HA PRO A 24 7.262 -11.997 5.522 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.967 -12.770 7.701 1.00 0.00 H new ATOM 0 HB3 PRO A 24 8.081 -13.828 6.621 1.00 0.00 H new ATOM 0 HG2 PRO A 24 10.910 -13.439 6.721 1.00 0.00 H new ATOM 0 HG3 PRO A 24 10.016 -14.434 5.587 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.308 -11.868 5.101 1.00 0.00 H new ATOM 0 HD3 PRO A 24 10.564 -12.944 3.934 1.00 0.00 H new ATOM 382 N ASP A 25 9.299 -9.949 7.085 1.00 0.00 N ATOM 383 CA ASP A 25 9.300 -8.763 7.987 1.00 0.00 C ATOM 384 C ASP A 25 8.513 -7.618 7.340 1.00 0.00 C ATOM 385 O ASP A 25 8.008 -6.743 8.017 1.00 0.00 O ATOM 386 CB ASP A 25 10.743 -8.315 8.232 1.00 0.00 C ATOM 387 CG ASP A 25 10.886 -7.808 9.668 1.00 0.00 C ATOM 388 OD1 ASP A 25 10.829 -8.626 10.572 1.00 0.00 O ATOM 389 OD2 ASP A 25 11.050 -6.612 9.840 1.00 0.00 O ATOM 0 H ASP A 25 10.209 -10.199 6.698 1.00 0.00 H new ATOM 0 HA ASP A 25 8.832 -9.029 8.935 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.427 -9.146 8.059 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.014 -7.528 7.529 1.00 0.00 H new ATOM 394 N ASP A 26 8.405 -7.614 6.037 1.00 0.00 N ATOM 395 CA ASP A 26 7.651 -6.523 5.353 1.00 0.00 C ATOM 396 C ASP A 26 6.150 -6.760 5.535 1.00 0.00 C ATOM 397 O ASP A 26 5.401 -5.843 5.810 1.00 0.00 O ATOM 398 CB ASP A 26 8.010 -6.513 3.863 1.00 0.00 C ATOM 399 CG ASP A 26 7.137 -5.506 3.109 1.00 0.00 C ATOM 400 OD1 ASP A 26 7.013 -4.378 3.572 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.598 -5.887 2.084 1.00 0.00 O ATOM 0 H ASP A 26 8.806 -8.318 5.418 1.00 0.00 H new ATOM 0 HA ASP A 26 7.916 -5.558 5.786 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.062 -6.257 3.738 1.00 0.00 H new ATOM 0 HB3 ASP A 26 7.872 -7.509 3.443 1.00 0.00 H new ATOM 406 N LEU A 27 5.700 -7.982 5.388 1.00 0.00 N ATOM 407 CA LEU A 27 4.245 -8.269 5.559 1.00 0.00 C ATOM 408 C LEU A 27 3.783 -7.740 6.919 1.00 0.00 C ATOM 409 O LEU A 27 2.799 -7.032 7.018 1.00 0.00 O ATOM 410 CB LEU A 27 4.008 -9.780 5.494 1.00 0.00 C ATOM 411 CG LEU A 27 4.422 -10.306 4.118 1.00 0.00 C ATOM 412 CD1 LEU A 27 4.659 -11.814 4.199 1.00 0.00 C ATOM 413 CD2 LEU A 27 3.309 -10.021 3.106 1.00 0.00 C ATOM 0 H LEU A 27 6.277 -8.791 5.157 1.00 0.00 H new ATOM 0 HA LEU A 27 3.682 -7.781 4.764 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.581 -10.282 6.274 1.00 0.00 H new ATOM 0 HB3 LEU A 27 2.957 -10.002 5.678 1.00 0.00 H new ATOM 0 HG LEU A 27 5.339 -9.809 3.801 1.00 0.00 H new ATOM 0 HD11 LEU A 27 4.954 -12.189 3.219 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.451 -12.020 4.920 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.742 -12.310 4.516 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.604 -10.396 2.126 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.392 -10.518 3.424 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.137 -8.946 3.047 1.00 0.00 H new ATOM 425 N HIS A 28 4.496 -8.066 7.966 1.00 0.00 N ATOM 426 CA HIS A 28 4.110 -7.570 9.318 1.00 0.00 C ATOM 427 C HIS A 28 4.052 -6.041 9.289 1.00 0.00 C ATOM 428 O HIS A 28 3.186 -5.430 9.884 1.00 0.00 O ATOM 429 CB HIS A 28 5.149 -8.021 10.346 1.00 0.00 C ATOM 430 CG HIS A 28 5.131 -9.521 10.455 1.00 0.00 C ATOM 431 ND1 HIS A 28 3.958 -10.233 10.652 1.00 0.00 N ATOM 432 CD2 HIS A 28 6.133 -10.458 10.397 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.280 -11.539 10.704 1.00 0.00 C ATOM 434 NE2 HIS A 28 5.593 -11.731 10.555 1.00 0.00 N ATOM 0 H HIS A 28 5.329 -8.654 7.942 1.00 0.00 H new ATOM 0 HA HIS A 28 3.135 -7.972 9.593 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.141 -7.679 10.050 1.00 0.00 H new ATOM 0 HB3 HIS A 28 4.934 -7.573 11.316 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.181 -10.240 10.251 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.564 -12.334 10.849 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.093 -12.620 10.557 1.00 0.00 H new ATOM 442 N TYR A 29 4.962 -5.424 8.584 1.00 0.00 N ATOM 443 CA TYR A 29 4.959 -3.937 8.492 1.00 0.00 C ATOM 444 C TYR A 29 3.683 -3.483 7.782 1.00 0.00 C ATOM 445 O TYR A 29 3.100 -2.471 8.116 1.00 0.00 O ATOM 446 CB TYR A 29 6.180 -3.471 7.697 1.00 0.00 C ATOM 447 CG TYR A 29 6.276 -1.966 7.761 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.792 -1.346 8.905 1.00 0.00 C ATOM 449 CD2 TYR A 29 5.848 -1.190 6.677 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.881 0.050 8.965 1.00 0.00 C ATOM 451 CE2 TYR A 29 5.937 0.206 6.737 1.00 0.00 C ATOM 452 CZ TYR A 29 6.453 0.826 7.881 1.00 0.00 C ATOM 453 OH TYR A 29 6.541 2.203 7.941 1.00 0.00 O ATOM 0 H TYR A 29 5.709 -5.888 8.067 1.00 0.00 H new ATOM 0 HA TYR A 29 4.996 -3.507 9.493 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.086 -3.922 8.103 1.00 0.00 H new ATOM 0 HB3 TYR A 29 6.099 -3.797 6.660 1.00 0.00 H new ATOM 0 HD1 TYR A 29 7.121 -1.945 9.741 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.449 -1.668 5.795 1.00 0.00 H new ATOM 0 HE1 TYR A 29 7.280 0.528 9.847 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.608 0.805 5.901 1.00 0.00 H new ATOM 0 HH TYR A 29 5.640 2.588 7.968 1.00 0.00 H new ATOM 463 N PHE A 30 3.250 -4.229 6.801 1.00 0.00 N ATOM 464 CA PHE A 30 2.013 -3.855 6.057 1.00 0.00 C ATOM 465 C PHE A 30 0.803 -3.996 6.981 1.00 0.00 C ATOM 466 O PHE A 30 -0.018 -3.107 7.085 1.00 0.00 O ATOM 467 CB PHE A 30 1.845 -4.784 4.851 1.00 0.00 C ATOM 468 CG PHE A 30 0.643 -4.357 4.043 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.588 -3.069 3.496 1.00 0.00 C ATOM 470 CD2 PHE A 30 -0.416 -5.249 3.839 1.00 0.00 C ATOM 471 CE1 PHE A 30 -0.526 -2.674 2.744 1.00 0.00 C ATOM 472 CE2 PHE A 30 -1.530 -4.855 3.088 1.00 0.00 C ATOM 473 CZ PHE A 30 -1.586 -3.567 2.541 1.00 0.00 C ATOM 0 H PHE A 30 3.703 -5.086 6.482 1.00 0.00 H new ATOM 0 HA PHE A 30 2.091 -2.823 5.714 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.741 -4.756 4.231 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.722 -5.814 5.187 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.405 -2.380 3.654 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.374 -6.242 4.261 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -0.568 -1.681 2.321 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.346 -5.544 2.931 1.00 0.00 H new ATOM 0 HZ PHE A 30 -2.446 -3.262 1.963 1.00 0.00 H new ATOM 483 N ARG A 31 0.690 -5.107 7.656 1.00 0.00 N ATOM 484 CA ARG A 31 -0.462 -5.316 8.577 1.00 0.00 C ATOM 485 C ARG A 31 -0.396 -4.292 9.714 1.00 0.00 C ATOM 486 O ARG A 31 -1.290 -3.488 9.891 1.00 0.00 O ATOM 487 CB ARG A 31 -0.381 -6.731 9.154 1.00 0.00 C ATOM 488 CG ARG A 31 -1.665 -7.060 9.915 1.00 0.00 C ATOM 489 CD ARG A 31 -1.401 -8.241 10.850 1.00 0.00 C ATOM 490 NE ARG A 31 -0.509 -7.798 11.963 1.00 0.00 N ATOM 491 CZ ARG A 31 0.527 -8.517 12.331 1.00 0.00 C ATOM 492 NH1 ARG A 31 0.798 -9.660 11.751 1.00 0.00 N ATOM 493 NH2 ARG A 31 1.293 -8.091 13.297 1.00 0.00 N ATOM 0 H ARG A 31 1.350 -5.883 7.608 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.400 -5.191 8.036 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.230 -7.452 8.351 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.477 -6.812 9.821 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.996 -6.193 10.487 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.465 -7.305 9.216 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.341 -8.620 11.251 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.936 -9.059 10.299 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.708 -6.922 12.446 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.200 -10.005 11.000 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.607 -10.205 12.050 1.00 0.00 H new ATOM 0 HH21 ARG A 31 1.085 -7.206 13.760 1.00 0.00 H new ATOM 0 HH22 ARG A 31 2.100 -8.643 13.589 1.00 0.00 H new ATOM 507 N ALA A 32 0.658 -4.326 10.486 1.00 0.00 N ATOM 508 CA ALA A 32 0.802 -3.366 11.624 1.00 0.00 C ATOM 509 C ALA A 32 0.515 -1.933 11.152 1.00 0.00 C ATOM 510 O ALA A 32 -0.070 -1.141 11.865 1.00 0.00 O ATOM 511 CB ALA A 32 2.230 -3.442 12.168 1.00 0.00 C ATOM 0 H ALA A 32 1.432 -4.982 10.377 1.00 0.00 H new ATOM 0 HA ALA A 32 0.089 -3.631 12.405 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.341 -2.744 12.998 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.433 -4.455 12.516 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.935 -3.181 11.378 1.00 0.00 H new ATOM 517 N GLN A 33 0.946 -1.591 9.968 1.00 0.00 N ATOM 518 CA GLN A 33 0.727 -0.204 9.454 1.00 0.00 C ATOM 519 C GLN A 33 -0.745 0.027 9.085 1.00 0.00 C ATOM 520 O GLN A 33 -1.182 1.154 8.955 1.00 0.00 O ATOM 521 CB GLN A 33 1.591 0.007 8.210 1.00 0.00 C ATOM 522 CG GLN A 33 3.004 0.422 8.629 1.00 0.00 C ATOM 523 CD GLN A 33 3.214 1.903 8.316 1.00 0.00 C ATOM 524 OE1 GLN A 33 4.031 2.249 7.486 1.00 0.00 O ATOM 525 NE2 GLN A 33 2.508 2.798 8.952 1.00 0.00 N ATOM 0 H GLN A 33 1.443 -2.213 9.331 1.00 0.00 H new ATOM 0 HA GLN A 33 1.000 0.502 10.238 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.630 -0.910 7.622 1.00 0.00 H new ATOM 0 HB3 GLN A 33 1.149 0.774 7.574 1.00 0.00 H new ATOM 0 HG2 GLN A 33 3.147 0.241 9.694 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.743 -0.181 8.101 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.822 2.506 9.649 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.642 3.789 8.752 1.00 0.00 H new ATOM 534 N THR A 34 -1.512 -1.015 8.898 1.00 0.00 N ATOM 535 CA THR A 34 -2.944 -0.815 8.520 1.00 0.00 C ATOM 536 C THR A 34 -3.870 -1.432 9.569 1.00 0.00 C ATOM 537 O THR A 34 -4.963 -1.866 9.261 1.00 0.00 O ATOM 538 CB THR A 34 -3.214 -1.462 7.157 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.691 -2.787 7.133 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.549 -0.630 6.060 1.00 0.00 C ATOM 0 H THR A 34 -1.214 -1.986 8.989 1.00 0.00 H new ATOM 0 HA THR A 34 -3.141 0.256 8.465 1.00 0.00 H new ATOM 0 HB THR A 34 -4.290 -1.502 6.987 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.714 -2.752 7.068 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.740 -1.088 5.090 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.958 0.380 6.071 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.474 -0.588 6.236 1.00 0.00 H new ATOM 548 N VAL A 35 -3.455 -1.464 10.806 1.00 0.00 N ATOM 549 CA VAL A 35 -4.329 -2.045 11.865 1.00 0.00 C ATOM 550 C VAL A 35 -5.367 -1.006 12.293 1.00 0.00 C ATOM 551 O VAL A 35 -5.034 0.038 12.820 1.00 0.00 O ATOM 552 CB VAL A 35 -3.479 -2.442 13.072 1.00 0.00 C ATOM 553 CG1 VAL A 35 -2.550 -3.590 12.679 1.00 0.00 C ATOM 554 CG2 VAL A 35 -2.645 -1.241 13.534 1.00 0.00 C ATOM 0 H VAL A 35 -2.553 -1.115 11.128 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.835 -2.928 11.473 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.130 -2.761 13.886 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -1.942 -3.876 13.537 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -3.144 -4.444 12.354 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.900 -3.270 11.865 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.040 -1.527 14.394 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.992 -0.918 12.723 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.309 -0.423 13.813 1.00 0.00 H new ATOM 564 N GLY A 36 -6.624 -1.286 12.074 1.00 0.00 N ATOM 565 CA GLY A 36 -7.688 -0.320 12.472 1.00 0.00 C ATOM 566 C GLY A 36 -7.800 0.805 11.437 1.00 0.00 C ATOM 567 O GLY A 36 -8.420 1.820 11.686 1.00 0.00 O ATOM 0 H GLY A 36 -6.960 -2.144 11.636 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.643 -0.837 12.561 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.460 0.100 13.452 1.00 0.00 H new ATOM 571 N LYS A 37 -7.204 0.643 10.282 1.00 0.00 N ATOM 572 CA LYS A 37 -7.284 1.716 9.247 1.00 0.00 C ATOM 573 C LYS A 37 -7.924 1.156 7.974 1.00 0.00 C ATOM 574 O LYS A 37 -7.990 -0.042 7.780 1.00 0.00 O ATOM 575 CB LYS A 37 -5.875 2.221 8.928 1.00 0.00 C ATOM 576 CG LYS A 37 -5.416 3.183 10.026 1.00 0.00 C ATOM 577 CD LYS A 37 -3.889 3.284 10.012 1.00 0.00 C ATOM 578 CE LYS A 37 -3.303 2.323 11.048 1.00 0.00 C ATOM 579 NZ LYS A 37 -1.935 2.776 11.429 1.00 0.00 N ATOM 0 H LYS A 37 -6.668 -0.182 10.013 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.891 2.539 9.625 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.184 1.381 8.854 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.868 2.725 7.962 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -5.857 4.167 9.869 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -5.759 2.831 10.999 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.507 3.043 9.020 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.580 4.306 10.233 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -3.944 2.286 11.929 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.263 1.313 10.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -1.685 2.382 12.358 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -1.250 2.448 10.718 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -1.914 3.815 11.476 1.00 0.00 H new ATOM 593 N ILE A 38 -8.399 2.013 7.105 1.00 0.00 N ATOM 594 CA ILE A 38 -9.034 1.525 5.847 1.00 0.00 C ATOM 595 C ILE A 38 -7.939 1.125 4.853 1.00 0.00 C ATOM 596 O ILE A 38 -7.072 1.909 4.528 1.00 0.00 O ATOM 597 CB ILE A 38 -9.897 2.639 5.251 1.00 0.00 C ATOM 598 CG1 ILE A 38 -10.980 3.037 6.260 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.558 2.140 3.967 1.00 0.00 C ATOM 600 CD1 ILE A 38 -11.786 4.218 5.714 1.00 0.00 C ATOM 0 H ILE A 38 -8.374 3.027 7.214 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.662 0.660 6.059 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.272 3.503 5.026 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.640 2.191 6.451 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -10.522 3.306 7.212 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.173 2.933 3.542 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.789 1.853 3.250 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.184 1.277 4.192 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -12.555 4.498 6.434 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -11.121 5.065 5.545 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.257 3.933 4.773 1.00 0.00 H new ATOM 612 N MET A 39 -7.969 -0.092 4.374 1.00 0.00 N ATOM 613 CA MET A 39 -6.924 -0.545 3.408 1.00 0.00 C ATOM 614 C MET A 39 -7.494 -0.550 1.987 1.00 0.00 C ATOM 615 O MET A 39 -8.349 -1.349 1.656 1.00 0.00 O ATOM 616 CB MET A 39 -6.475 -1.959 3.778 1.00 0.00 C ATOM 617 CG MET A 39 -5.141 -2.267 3.095 1.00 0.00 C ATOM 618 SD MET A 39 -4.749 -4.021 3.302 1.00 0.00 S ATOM 619 CE MET A 39 -6.196 -4.680 2.438 1.00 0.00 C ATOM 0 H MET A 39 -8.672 -0.792 4.610 1.00 0.00 H new ATOM 0 HA MET A 39 -6.075 0.137 3.451 1.00 0.00 H new ATOM 0 HB2 MET A 39 -6.371 -2.047 4.859 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.229 -2.683 3.470 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.197 -2.018 2.035 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.350 -1.653 3.525 1.00 0.00 H new ATOM 0 HE1 MET A 39 -6.883 -5.120 3.161 1.00 0.00 H new ATOM 0 HE2 MET A 39 -6.699 -3.874 1.904 1.00 0.00 H new ATOM 0 HE3 MET A 39 -5.879 -5.444 1.728 1.00 0.00 H new ATOM 629 N VAL A 40 -7.035 0.341 1.148 1.00 0.00 N ATOM 630 CA VAL A 40 -7.559 0.397 -0.248 1.00 0.00 C ATOM 631 C VAL A 40 -6.702 -0.477 -1.173 1.00 0.00 C ATOM 632 O VAL A 40 -5.532 -0.209 -1.403 1.00 0.00 O ATOM 633 CB VAL A 40 -7.526 1.844 -0.740 1.00 0.00 C ATOM 634 CG1 VAL A 40 -8.220 1.935 -2.096 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.256 2.738 0.265 1.00 0.00 C ATOM 0 H VAL A 40 -6.319 1.033 1.370 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.583 0.024 -0.260 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.491 2.173 -0.838 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.197 2.966 -2.448 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.704 1.296 -2.812 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.255 1.608 -1.998 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.234 3.771 -0.083 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.291 2.409 0.360 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.764 2.672 1.235 1.00 0.00 H new ATOM 645 N VAL A 41 -7.291 -1.511 -1.718 1.00 0.00 N ATOM 646 CA VAL A 41 -6.546 -2.411 -2.647 1.00 0.00 C ATOM 647 C VAL A 41 -7.363 -2.584 -3.931 1.00 0.00 C ATOM 648 O VAL A 41 -8.534 -2.906 -3.892 1.00 0.00 O ATOM 649 CB VAL A 41 -6.330 -3.779 -1.993 1.00 0.00 C ATOM 650 CG1 VAL A 41 -5.216 -3.679 -0.950 1.00 0.00 C ATOM 651 CG2 VAL A 41 -7.624 -4.235 -1.315 1.00 0.00 C ATOM 0 H VAL A 41 -8.264 -1.771 -1.557 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.575 -1.972 -2.877 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.047 -4.503 -2.758 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.064 -4.653 -0.486 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.293 -3.359 -1.433 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.496 -2.953 -0.187 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -7.468 -5.209 -0.850 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.910 -3.511 -0.552 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.417 -4.311 -2.059 1.00 0.00 H new ATOM 661 N GLY A 42 -6.759 -2.360 -5.066 1.00 0.00 N ATOM 662 CA GLY A 42 -7.503 -2.491 -6.353 1.00 0.00 C ATOM 663 C GLY A 42 -7.891 -3.950 -6.615 1.00 0.00 C ATOM 664 O GLY A 42 -7.299 -4.872 -6.089 1.00 0.00 O ATOM 0 H GLY A 42 -5.779 -2.091 -5.159 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.400 -1.872 -6.324 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.887 -2.122 -7.173 1.00 0.00 H new ATOM 668 N ARG A 43 -8.898 -4.152 -7.425 1.00 0.00 N ATOM 669 CA ARG A 43 -9.374 -5.533 -7.742 1.00 0.00 C ATOM 670 C ARG A 43 -8.209 -6.439 -8.160 1.00 0.00 C ATOM 671 O ARG A 43 -8.288 -7.646 -8.038 1.00 0.00 O ATOM 672 CB ARG A 43 -10.382 -5.458 -8.893 1.00 0.00 C ATOM 673 CG ARG A 43 -11.132 -6.789 -9.016 1.00 0.00 C ATOM 674 CD ARG A 43 -10.803 -7.446 -10.360 1.00 0.00 C ATOM 675 NE ARG A 43 -11.280 -6.575 -11.476 1.00 0.00 N ATOM 676 CZ ARG A 43 -11.290 -7.020 -12.712 1.00 0.00 C ATOM 677 NH1 ARG A 43 -10.892 -8.234 -12.987 1.00 0.00 N ATOM 678 NH2 ARG A 43 -11.703 -6.242 -13.675 1.00 0.00 N ATOM 0 H ARG A 43 -9.419 -3.407 -7.888 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.836 -5.954 -6.849 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -11.089 -4.647 -8.717 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.866 -5.234 -9.826 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -10.851 -7.452 -8.198 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.206 -6.621 -8.936 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.728 -7.606 -10.444 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -11.277 -8.426 -10.422 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.600 -5.627 -11.277 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -10.569 -8.847 -12.238 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.904 -8.569 -13.950 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -12.016 -5.294 -13.466 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.713 -6.582 -14.637 1.00 0.00 H new ATOM 692 N ARG A 44 -7.134 -5.884 -8.655 1.00 0.00 N ATOM 693 CA ARG A 44 -5.990 -6.741 -9.081 1.00 0.00 C ATOM 694 C ARG A 44 -5.251 -7.260 -7.844 1.00 0.00 C ATOM 695 O ARG A 44 -4.937 -8.430 -7.744 1.00 0.00 O ATOM 696 CB ARG A 44 -5.029 -5.914 -9.941 1.00 0.00 C ATOM 697 CG ARG A 44 -5.429 -6.020 -11.416 1.00 0.00 C ATOM 698 CD ARG A 44 -4.875 -4.813 -12.177 1.00 0.00 C ATOM 699 NE ARG A 44 -5.559 -4.690 -13.500 1.00 0.00 N ATOM 700 CZ ARG A 44 -5.003 -5.148 -14.597 1.00 0.00 C ATOM 701 NH1 ARG A 44 -3.840 -5.749 -14.565 1.00 0.00 N ATOM 702 NH2 ARG A 44 -5.615 -4.994 -15.738 1.00 0.00 N ATOM 0 H ARG A 44 -6.999 -4.881 -8.782 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.363 -7.586 -9.660 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.048 -4.871 -9.624 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.008 -6.270 -9.805 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -5.041 -6.944 -11.845 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -6.514 -6.056 -11.509 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -5.025 -3.904 -11.594 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -3.801 -4.925 -12.322 1.00 0.00 H new ATOM 0 HE ARG A 44 -6.474 -4.242 -13.551 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -3.351 -5.867 -13.678 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -3.423 -6.099 -15.428 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -6.518 -4.521 -15.773 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -5.191 -5.347 -16.596 1.00 0.00 H new ATOM 716 N THR A 45 -4.966 -6.398 -6.903 1.00 0.00 N ATOM 717 CA THR A 45 -4.242 -6.845 -5.678 1.00 0.00 C ATOM 718 C THR A 45 -5.160 -7.716 -4.817 1.00 0.00 C ATOM 719 O THR A 45 -4.803 -8.814 -4.435 1.00 0.00 O ATOM 720 CB THR A 45 -3.802 -5.623 -4.868 1.00 0.00 C ATOM 721 OG1 THR A 45 -3.300 -4.626 -5.749 1.00 0.00 O ATOM 722 CG2 THR A 45 -2.709 -6.032 -3.878 1.00 0.00 C ATOM 0 H THR A 45 -5.203 -5.406 -6.930 1.00 0.00 H new ATOM 0 HA THR A 45 -3.368 -7.425 -5.974 1.00 0.00 H new ATOM 0 HB THR A 45 -4.655 -5.224 -4.319 1.00 0.00 H new ATOM 0 HG1 THR A 45 -2.378 -4.844 -5.998 1.00 0.00 H new ATOM 0 HG21 THR A 45 -2.396 -5.162 -3.301 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.097 -6.794 -3.202 1.00 0.00 H new ATOM 0 HG23 THR A 45 -1.855 -6.432 -4.424 1.00 0.00 H new ATOM 730 N TYR A 46 -6.338 -7.238 -4.504 1.00 0.00 N ATOM 731 CA TYR A 46 -7.276 -8.042 -3.662 1.00 0.00 C ATOM 732 C TYR A 46 -7.428 -9.448 -4.250 1.00 0.00 C ATOM 733 O TYR A 46 -7.626 -10.411 -3.536 1.00 0.00 O ATOM 734 CB TYR A 46 -8.645 -7.359 -3.616 1.00 0.00 C ATOM 735 CG TYR A 46 -9.485 -7.993 -2.532 1.00 0.00 C ATOM 736 CD1 TYR A 46 -9.356 -7.564 -1.205 1.00 0.00 C ATOM 737 CD2 TYR A 46 -10.387 -9.015 -2.852 1.00 0.00 C ATOM 738 CE1 TYR A 46 -10.130 -8.155 -0.199 1.00 0.00 C ATOM 739 CE2 TYR A 46 -11.161 -9.606 -1.845 1.00 0.00 C ATOM 740 CZ TYR A 46 -11.032 -9.176 -0.519 1.00 0.00 C ATOM 741 OH TYR A 46 -11.795 -9.759 0.473 1.00 0.00 O ATOM 0 H TYR A 46 -6.691 -6.326 -4.795 1.00 0.00 H new ATOM 0 HA TYR A 46 -6.873 -8.115 -2.652 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.526 -6.293 -3.422 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.144 -7.454 -4.580 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -8.659 -6.777 -0.958 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.486 -9.348 -3.875 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -10.031 -7.823 0.824 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.858 -10.394 -2.092 1.00 0.00 H new ATOM 0 HH TYR A 46 -12.369 -10.449 0.081 1.00 0.00 H new ATOM 751 N GLU A 47 -7.333 -9.572 -5.547 1.00 0.00 N ATOM 752 CA GLU A 47 -7.468 -10.916 -6.181 1.00 0.00 C ATOM 753 C GLU A 47 -6.129 -11.660 -6.111 1.00 0.00 C ATOM 754 O GLU A 47 -6.075 -12.866 -6.255 1.00 0.00 O ATOM 755 CB GLU A 47 -7.883 -10.749 -7.644 1.00 0.00 C ATOM 756 CG GLU A 47 -9.409 -10.828 -7.756 1.00 0.00 C ATOM 757 CD GLU A 47 -9.790 -11.628 -9.003 1.00 0.00 C ATOM 758 OE1 GLU A 47 -9.864 -11.033 -10.066 1.00 0.00 O ATOM 759 OE2 GLU A 47 -10.003 -12.822 -8.874 1.00 0.00 O ATOM 0 H GLU A 47 -7.168 -8.801 -6.195 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.226 -11.491 -5.649 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.529 -9.792 -8.026 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.422 -11.526 -8.254 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.825 -11.301 -6.867 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.832 -9.825 -7.811 1.00 0.00 H new ATOM 766 N SER A 48 -5.049 -10.954 -5.896 1.00 0.00 N ATOM 767 CA SER A 48 -3.718 -11.625 -5.824 1.00 0.00 C ATOM 768 C SER A 48 -3.318 -11.847 -4.359 1.00 0.00 C ATOM 769 O SER A 48 -2.484 -12.679 -4.059 1.00 0.00 O ATOM 770 CB SER A 48 -2.669 -10.751 -6.515 1.00 0.00 C ATOM 771 OG SER A 48 -2.386 -11.287 -7.801 1.00 0.00 O ATOM 0 H SER A 48 -5.032 -9.942 -5.767 1.00 0.00 H new ATOM 0 HA SER A 48 -3.778 -12.591 -6.325 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.034 -9.728 -6.607 1.00 0.00 H new ATOM 0 HB3 SER A 48 -1.759 -10.712 -5.916 1.00 0.00 H new ATOM 0 HG SER A 48 -1.842 -10.649 -8.309 1.00 0.00 H new ATOM 777 N PHE A 49 -3.897 -11.106 -3.445 1.00 0.00 N ATOM 778 CA PHE A 49 -3.546 -11.270 -1.997 1.00 0.00 C ATOM 779 C PHE A 49 -3.584 -12.760 -1.616 1.00 0.00 C ATOM 780 O PHE A 49 -4.274 -13.537 -2.246 1.00 0.00 O ATOM 781 CB PHE A 49 -4.567 -10.511 -1.143 1.00 0.00 C ATOM 782 CG PHE A 49 -3.930 -9.290 -0.522 1.00 0.00 C ATOM 783 CD1 PHE A 49 -3.303 -9.390 0.725 1.00 0.00 C ATOM 784 CD2 PHE A 49 -3.971 -8.059 -1.186 1.00 0.00 C ATOM 785 CE1 PHE A 49 -2.715 -8.265 1.306 1.00 0.00 C ATOM 786 CE2 PHE A 49 -3.382 -6.930 -0.602 1.00 0.00 C ATOM 787 CZ PHE A 49 -2.754 -7.034 0.644 1.00 0.00 C ATOM 0 H PHE A 49 -4.600 -10.392 -3.639 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.545 -10.876 -1.823 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.416 -10.213 -1.759 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -4.954 -11.164 -0.361 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.274 -10.339 1.239 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -4.456 -7.979 -2.148 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.230 -8.346 2.267 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -3.413 -5.979 -1.114 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.300 -6.164 1.094 1.00 0.00 H new ATOM 797 N PRO A 50 -2.840 -13.116 -0.593 1.00 0.00 N ATOM 798 CA PRO A 50 -2.720 -14.507 -0.041 1.00 0.00 C ATOM 799 C PRO A 50 -3.878 -14.806 0.920 1.00 0.00 C ATOM 800 O PRO A 50 -4.624 -15.747 0.728 1.00 0.00 O ATOM 801 CB PRO A 50 -1.390 -14.555 0.709 1.00 0.00 C ATOM 802 CG PRO A 50 -0.906 -13.126 0.862 1.00 0.00 C ATOM 803 CD PRO A 50 -1.959 -12.221 0.231 1.00 0.00 C ATOM 0 HA PRO A 50 -2.758 -15.251 -0.837 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.516 -15.024 1.685 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.661 -15.151 0.160 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -0.767 -12.878 1.914 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.059 -12.992 0.373 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -2.537 -11.703 0.997 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.493 -11.455 -0.389 1.00 0.00 H new ATOM 811 N LYS A 51 -4.028 -14.022 1.958 1.00 0.00 N ATOM 812 CA LYS A 51 -5.132 -14.277 2.933 1.00 0.00 C ATOM 813 C LYS A 51 -6.080 -13.075 2.991 1.00 0.00 C ATOM 814 O LYS A 51 -5.783 -12.069 3.605 1.00 0.00 O ATOM 815 CB LYS A 51 -4.537 -14.511 4.323 1.00 0.00 C ATOM 816 CG LYS A 51 -3.795 -15.849 4.347 1.00 0.00 C ATOM 817 CD LYS A 51 -3.715 -16.364 5.787 1.00 0.00 C ATOM 818 CE LYS A 51 -4.798 -17.421 6.015 1.00 0.00 C ATOM 819 NZ LYS A 51 -6.112 -16.751 6.241 1.00 0.00 N ATOM 0 H LYS A 51 -3.436 -13.219 2.172 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.690 -15.156 2.611 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.854 -13.701 4.578 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.328 -14.509 5.073 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -4.311 -16.574 3.718 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -2.792 -15.728 3.937 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -2.730 -16.791 5.977 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.845 -15.539 6.487 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -4.860 -18.084 5.152 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -4.541 -18.040 6.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -6.800 -17.446 6.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -5.998 -15.991 6.941 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -6.455 -16.348 5.346 1.00 0.00 H new ATOM 833 N ARG A 52 -7.220 -13.173 2.359 1.00 0.00 N ATOM 834 CA ARG A 52 -8.189 -12.036 2.383 1.00 0.00 C ATOM 835 C ARG A 52 -9.504 -12.496 3.024 1.00 0.00 C ATOM 836 O ARG A 52 -9.969 -13.585 2.756 1.00 0.00 O ATOM 837 CB ARG A 52 -8.471 -11.562 0.952 1.00 0.00 C ATOM 838 CG ARG A 52 -7.181 -11.588 0.133 1.00 0.00 C ATOM 839 CD ARG A 52 -7.180 -12.812 -0.786 1.00 0.00 C ATOM 840 NE ARG A 52 -8.260 -12.668 -1.806 1.00 0.00 N ATOM 841 CZ ARG A 52 -8.364 -13.524 -2.794 1.00 0.00 C ATOM 842 NH1 ARG A 52 -7.524 -14.521 -2.907 1.00 0.00 N ATOM 843 NH2 ARG A 52 -9.317 -13.380 -3.674 1.00 0.00 N ATOM 0 H ARG A 52 -7.522 -13.990 1.828 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.761 -11.217 2.961 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.220 -12.204 0.488 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -8.882 -10.553 0.968 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.096 -10.677 -0.459 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -6.317 -11.619 0.797 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.212 -12.911 -1.277 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -7.335 -13.719 -0.202 1.00 0.00 H new ATOM 0 HE ARG A 52 -8.923 -11.897 -1.734 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -6.778 -14.639 -2.222 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -7.616 -15.180 -3.680 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -9.975 -12.605 -3.591 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.404 -14.042 -4.445 1.00 0.00 H new ATOM 857 N PRO A 53 -10.076 -11.644 3.842 1.00 0.00 N ATOM 858 CA PRO A 53 -9.569 -10.282 4.226 1.00 0.00 C ATOM 859 C PRO A 53 -8.637 -10.391 5.438 1.00 0.00 C ATOM 860 O PRO A 53 -8.459 -11.453 6.003 1.00 0.00 O ATOM 861 CB PRO A 53 -10.807 -9.470 4.592 1.00 0.00 C ATOM 862 CG PRO A 53 -11.932 -10.460 4.838 1.00 0.00 C ATOM 863 CD PRO A 53 -11.377 -11.855 4.554 1.00 0.00 C ATOM 0 HA PRO A 53 -9.005 -9.818 3.417 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.623 -8.867 5.481 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.068 -8.782 3.788 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.288 -10.390 5.866 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.782 -10.245 4.190 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.230 -12.412 5.479 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -12.068 -12.433 3.941 1.00 0.00 H new ATOM 871 N LEU A 54 -8.042 -9.299 5.839 1.00 0.00 N ATOM 872 CA LEU A 54 -7.121 -9.335 7.012 1.00 0.00 C ATOM 873 C LEU A 54 -7.941 -9.400 8.307 1.00 0.00 C ATOM 874 O LEU A 54 -9.069 -8.950 8.345 1.00 0.00 O ATOM 875 CB LEU A 54 -6.254 -8.075 7.020 1.00 0.00 C ATOM 876 CG LEU A 54 -5.250 -8.140 5.867 1.00 0.00 C ATOM 877 CD1 LEU A 54 -5.011 -6.732 5.320 1.00 0.00 C ATOM 878 CD2 LEU A 54 -3.927 -8.726 6.373 1.00 0.00 C ATOM 0 H LEU A 54 -8.154 -8.383 5.404 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.482 -10.215 6.943 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.881 -7.189 6.921 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.728 -7.989 7.971 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.647 -8.774 5.074 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.296 -6.777 4.499 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.952 -6.317 4.959 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.614 -6.097 6.112 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.212 -8.772 5.552 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.528 -8.093 7.166 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.099 -9.730 6.762 1.00 0.00 H new ATOM 890 N PRO A 55 -7.345 -9.958 9.334 1.00 0.00 N ATOM 891 CA PRO A 55 -7.949 -10.134 10.700 1.00 0.00 C ATOM 892 C PRO A 55 -7.958 -8.799 11.453 1.00 0.00 C ATOM 893 O PRO A 55 -6.962 -8.110 11.527 1.00 0.00 O ATOM 894 CB PRO A 55 -7.081 -11.148 11.440 1.00 0.00 C ATOM 895 CG PRO A 55 -5.848 -11.400 10.598 1.00 0.00 C ATOM 896 CD PRO A 55 -5.953 -10.530 9.350 1.00 0.00 C ATOM 0 HA PRO A 55 -8.980 -10.480 10.627 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -6.802 -10.768 12.423 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -7.630 -12.076 11.602 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -4.946 -11.157 11.159 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -5.780 -12.453 10.325 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.208 -9.734 9.370 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.767 -11.119 8.452 1.00 0.00 H new ATOM 904 N GLU A 56 -9.076 -8.445 12.031 1.00 0.00 N ATOM 905 CA GLU A 56 -9.167 -7.168 12.804 1.00 0.00 C ATOM 906 C GLU A 56 -8.593 -6.000 11.990 1.00 0.00 C ATOM 907 O GLU A 56 -7.945 -5.121 12.525 1.00 0.00 O ATOM 908 CB GLU A 56 -8.382 -7.312 14.109 1.00 0.00 C ATOM 909 CG GLU A 56 -9.182 -8.168 15.092 1.00 0.00 C ATOM 910 CD GLU A 56 -8.262 -8.654 16.214 1.00 0.00 C ATOM 911 OE1 GLU A 56 -7.364 -9.428 15.923 1.00 0.00 O ATOM 912 OE2 GLU A 56 -8.471 -8.246 17.344 1.00 0.00 O ATOM 0 H GLU A 56 -9.938 -8.990 12.001 1.00 0.00 H new ATOM 0 HA GLU A 56 -10.215 -6.961 13.019 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.413 -7.772 13.914 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -8.188 -6.330 14.540 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -10.006 -7.588 15.509 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.622 -9.020 14.574 1.00 0.00 H new ATOM 919 N ARG A 57 -8.831 -5.978 10.706 1.00 0.00 N ATOM 920 CA ARG A 57 -8.303 -4.859 9.870 1.00 0.00 C ATOM 921 C ARG A 57 -9.351 -4.458 8.830 1.00 0.00 C ATOM 922 O ARG A 57 -10.014 -5.294 8.248 1.00 0.00 O ATOM 923 CB ARG A 57 -7.022 -5.300 9.158 1.00 0.00 C ATOM 924 CG ARG A 57 -5.802 -4.914 10.004 1.00 0.00 C ATOM 925 CD ARG A 57 -5.085 -6.176 10.494 1.00 0.00 C ATOM 926 NE ARG A 57 -4.942 -6.116 11.979 1.00 0.00 N ATOM 927 CZ ARG A 57 -4.633 -7.189 12.669 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.455 -8.341 12.074 1.00 0.00 N ATOM 929 NH2 ARG A 57 -4.504 -7.107 13.965 1.00 0.00 N ATOM 0 H ARG A 57 -9.366 -6.684 10.200 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.082 -4.007 10.513 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.037 -6.378 8.995 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.960 -4.830 8.177 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -5.119 -4.303 9.414 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.116 -4.310 10.855 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.649 -7.063 10.207 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.104 -6.256 10.025 1.00 0.00 H new ATOM 0 HE ARG A 57 -5.086 -5.230 12.463 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.556 -8.413 11.062 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.215 -9.167 12.623 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.643 -6.213 14.436 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.264 -7.937 14.507 1.00 0.00 H new ATOM 943 N THR A 58 -9.503 -3.182 8.593 1.00 0.00 N ATOM 944 CA THR A 58 -10.506 -2.718 7.591 1.00 0.00 C ATOM 945 C THR A 58 -9.914 -2.838 6.185 1.00 0.00 C ATOM 946 O THR A 58 -8.889 -2.260 5.882 1.00 0.00 O ATOM 947 CB THR A 58 -10.865 -1.257 7.872 1.00 0.00 C ATOM 948 OG1 THR A 58 -10.958 -1.055 9.275 1.00 0.00 O ATOM 949 CG2 THR A 58 -12.205 -0.923 7.215 1.00 0.00 C ATOM 0 H THR A 58 -8.974 -2.440 9.051 1.00 0.00 H new ATOM 0 HA THR A 58 -11.403 -3.333 7.660 1.00 0.00 H new ATOM 0 HB THR A 58 -10.092 -0.607 7.462 1.00 0.00 H new ATOM 0 HG1 THR A 58 -10.131 -0.644 9.602 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.459 0.118 7.416 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.131 -1.077 6.138 1.00 0.00 H new ATOM 0 HG23 THR A 58 -12.981 -1.571 7.622 1.00 0.00 H new ATOM 957 N ASN A 59 -10.552 -3.586 5.325 1.00 0.00 N ATOM 958 CA ASN A 59 -10.026 -3.747 3.937 1.00 0.00 C ATOM 959 C ASN A 59 -11.092 -3.309 2.930 1.00 0.00 C ATOM 960 O ASN A 59 -12.242 -3.690 3.027 1.00 0.00 O ATOM 961 CB ASN A 59 -9.672 -5.219 3.694 1.00 0.00 C ATOM 962 CG ASN A 59 -8.903 -5.773 4.897 1.00 0.00 C ATOM 963 OD1 ASN A 59 -9.135 -6.889 5.319 1.00 0.00 O ATOM 964 ND2 ASN A 59 -7.989 -5.038 5.468 1.00 0.00 N ATOM 0 H ASN A 59 -11.415 -4.093 5.523 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.135 -3.131 3.814 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -10.581 -5.799 3.533 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.069 -5.313 2.791 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -7.470 -5.400 6.268 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -7.794 -4.101 5.115 1.00 0.00 H new ATOM 971 N VAL A 60 -10.720 -2.514 1.959 1.00 0.00 N ATOM 972 CA VAL A 60 -11.709 -2.056 0.940 1.00 0.00 C ATOM 973 C VAL A 60 -11.206 -2.443 -0.453 1.00 0.00 C ATOM 974 O VAL A 60 -10.044 -2.277 -0.769 1.00 0.00 O ATOM 975 CB VAL A 60 -11.864 -0.533 1.018 1.00 0.00 C ATOM 976 CG1 VAL A 60 -12.872 -0.060 -0.032 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.362 -0.136 2.409 1.00 0.00 C ATOM 0 H VAL A 60 -9.771 -2.162 1.829 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.674 -2.526 1.131 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.897 -0.067 0.829 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -12.978 1.023 0.028 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -12.519 -0.336 -1.026 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -13.838 -0.530 0.153 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.471 0.947 2.461 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.326 -0.607 2.598 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.644 -0.465 3.160 1.00 0.00 H new ATOM 987 N VAL A 61 -12.067 -2.967 -1.286 1.00 0.00 N ATOM 988 CA VAL A 61 -11.630 -3.371 -2.653 1.00 0.00 C ATOM 989 C VAL A 61 -12.077 -2.317 -3.670 1.00 0.00 C ATOM 990 O VAL A 61 -13.087 -1.662 -3.498 1.00 0.00 O ATOM 991 CB VAL A 61 -12.265 -4.719 -3.010 1.00 0.00 C ATOM 992 CG1 VAL A 61 -11.567 -5.302 -4.240 1.00 0.00 C ATOM 993 CG2 VAL A 61 -12.114 -5.689 -1.834 1.00 0.00 C ATOM 0 H VAL A 61 -13.052 -3.132 -1.078 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.544 -3.457 -2.674 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.323 -4.572 -3.225 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.019 -6.261 -4.494 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -11.676 -4.616 -5.080 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.508 -5.445 -4.024 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.567 -6.646 -2.092 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -11.056 -5.835 -1.616 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.612 -5.277 -0.956 1.00 0.00 H new ATOM 1003 N LEU A 62 -11.332 -2.153 -4.731 1.00 0.00 N ATOM 1004 CA LEU A 62 -11.708 -1.148 -5.768 1.00 0.00 C ATOM 1005 C LEU A 62 -11.906 -1.866 -7.103 1.00 0.00 C ATOM 1006 O LEU A 62 -11.043 -2.588 -7.563 1.00 0.00 O ATOM 1007 CB LEU A 62 -10.594 -0.104 -5.903 1.00 0.00 C ATOM 1008 CG LEU A 62 -11.101 1.254 -5.406 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -10.915 1.344 -3.891 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -10.308 2.379 -6.082 1.00 0.00 C ATOM 0 H LEU A 62 -10.476 -2.674 -4.925 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.631 -0.646 -5.478 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.722 -0.411 -5.326 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.278 -0.027 -6.943 1.00 0.00 H new ATOM 0 HG LEU A 62 -12.158 1.356 -5.652 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.275 2.310 -3.537 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -11.479 0.547 -3.407 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -9.858 1.240 -3.647 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -10.670 3.344 -5.727 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.251 2.276 -5.838 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -10.438 2.318 -7.162 1.00 0.00 H new ATOM 1022 N THR A 63 -13.041 -1.685 -7.723 1.00 0.00 N ATOM 1023 CA THR A 63 -13.292 -2.373 -9.022 1.00 0.00 C ATOM 1024 C THR A 63 -14.229 -1.533 -9.895 1.00 0.00 C ATOM 1025 O THR A 63 -14.949 -0.681 -9.412 1.00 0.00 O ATOM 1026 CB THR A 63 -13.934 -3.736 -8.753 1.00 0.00 C ATOM 1027 OG1 THR A 63 -14.218 -4.373 -9.988 1.00 0.00 O ATOM 1028 CG2 THR A 63 -15.230 -3.549 -7.963 1.00 0.00 C ATOM 0 H THR A 63 -13.802 -1.094 -7.388 1.00 0.00 H new ATOM 0 HA THR A 63 -12.345 -2.504 -9.545 1.00 0.00 H new ATOM 0 HB THR A 63 -13.247 -4.353 -8.173 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.455 -4.267 -10.594 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.684 -4.522 -7.773 1.00 0.00 H new ATOM 0 HG22 THR A 63 -15.010 -3.060 -7.014 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.921 -2.932 -8.538 1.00 0.00 H new ATOM 1036 N HIS A 64 -14.226 -1.777 -11.179 1.00 0.00 N ATOM 1037 CA HIS A 64 -15.118 -1.010 -12.095 1.00 0.00 C ATOM 1038 C HIS A 64 -16.391 -1.819 -12.371 1.00 0.00 C ATOM 1039 O HIS A 64 -17.232 -1.417 -13.152 1.00 0.00 O ATOM 1040 CB HIS A 64 -14.388 -0.752 -13.418 1.00 0.00 C ATOM 1041 CG HIS A 64 -13.991 0.697 -13.508 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -14.803 1.650 -14.101 1.00 0.00 N ATOM 1043 CD2 HIS A 64 -12.868 1.368 -13.090 1.00 0.00 C ATOM 1044 CE1 HIS A 64 -14.164 2.831 -14.025 1.00 0.00 C ATOM 1045 NE2 HIS A 64 -12.980 2.716 -13.418 1.00 0.00 N ATOM 0 H HIS A 64 -13.641 -2.478 -11.634 1.00 0.00 H new ATOM 0 HA HIS A 64 -15.383 -0.061 -11.629 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.504 -1.386 -13.485 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -15.033 -1.015 -14.257 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -12.026 0.918 -12.584 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -14.560 3.760 -14.408 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -12.303 3.457 -13.234 1.00 0.00 H new ATOM 1053 N GLN A 65 -16.539 -2.960 -11.745 1.00 0.00 N ATOM 1054 CA GLN A 65 -17.754 -3.790 -11.982 1.00 0.00 C ATOM 1055 C GLN A 65 -18.869 -3.349 -11.034 1.00 0.00 C ATOM 1056 O GLN A 65 -18.673 -2.511 -10.176 1.00 0.00 O ATOM 1057 CB GLN A 65 -17.425 -5.262 -11.721 1.00 0.00 C ATOM 1058 CG GLN A 65 -16.722 -5.856 -12.943 1.00 0.00 C ATOM 1059 CD GLN A 65 -15.345 -5.210 -13.102 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -14.395 -5.516 -12.263 1.00 0.00 O flip ATOM 1061 NE2 GLN A 65 -15.131 -4.421 -14.001 1.00 0.00 N flip ATOM 0 H GLN A 65 -15.870 -3.350 -11.081 1.00 0.00 H new ATOM 0 HA GLN A 65 -18.081 -3.664 -13.014 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.786 -5.352 -10.842 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -18.339 -5.817 -11.509 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.618 -6.935 -12.828 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -17.320 -5.687 -13.838 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -15.874 -4.182 -14.657 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -14.208 -3.998 -14.099 1.00 0.00 H new ATOM 1070 N GLU A 66 -20.037 -3.912 -11.184 1.00 0.00 N ATOM 1071 CA GLU A 66 -21.171 -3.533 -10.294 1.00 0.00 C ATOM 1072 C GLU A 66 -21.658 -4.764 -9.519 1.00 0.00 C ATOM 1073 O GLU A 66 -22.440 -4.652 -8.595 1.00 0.00 O ATOM 1074 CB GLU A 66 -22.317 -2.978 -11.144 1.00 0.00 C ATOM 1075 CG GLU A 66 -22.879 -1.716 -10.487 1.00 0.00 C ATOM 1076 CD GLU A 66 -24.007 -1.149 -11.352 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -23.711 -0.660 -12.430 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -25.146 -1.214 -10.922 1.00 0.00 O ATOM 0 H GLU A 66 -20.255 -4.619 -11.886 1.00 0.00 H new ATOM 0 HA GLU A 66 -20.837 -2.774 -9.586 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -21.960 -2.749 -12.148 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -23.102 -3.727 -11.247 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -23.253 -1.948 -9.490 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.090 -0.974 -10.367 1.00 0.00 H new ATOM 1085 N ASP A 67 -21.210 -5.938 -9.888 1.00 0.00 N ATOM 1086 CA ASP A 67 -21.659 -7.166 -9.171 1.00 0.00 C ATOM 1087 C ASP A 67 -20.519 -7.715 -8.308 1.00 0.00 C ATOM 1088 O ASP A 67 -20.507 -8.879 -7.956 1.00 0.00 O ATOM 1089 CB ASP A 67 -22.078 -8.226 -10.192 1.00 0.00 C ATOM 1090 CG ASP A 67 -23.482 -7.910 -10.710 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -23.593 -7.072 -11.589 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -24.423 -8.512 -10.218 1.00 0.00 O ATOM 0 H ASP A 67 -20.554 -6.097 -10.653 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.505 -6.916 -8.530 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -21.370 -8.248 -11.020 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.062 -9.214 -9.733 1.00 0.00 H new ATOM 1097 N TYR A 68 -19.569 -6.890 -7.950 1.00 0.00 N ATOM 1098 CA TYR A 68 -18.445 -7.374 -7.096 1.00 0.00 C ATOM 1099 C TYR A 68 -19.013 -7.852 -5.757 1.00 0.00 C ATOM 1100 O TYR A 68 -19.471 -7.065 -4.952 1.00 0.00 O ATOM 1101 CB TYR A 68 -17.453 -6.233 -6.861 1.00 0.00 C ATOM 1102 CG TYR A 68 -16.104 -6.802 -6.489 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -15.205 -7.183 -7.492 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -15.753 -6.949 -5.142 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -13.955 -7.711 -7.148 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -14.503 -7.477 -4.799 1.00 0.00 C ATOM 1107 CZ TYR A 68 -13.604 -7.858 -5.802 1.00 0.00 C ATOM 1108 OH TYR A 68 -12.372 -8.378 -5.463 1.00 0.00 O ATOM 0 H TYR A 68 -19.523 -5.905 -8.211 1.00 0.00 H new ATOM 0 HA TYR A 68 -17.929 -8.197 -7.591 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.366 -5.623 -7.760 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.815 -5.581 -6.066 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -15.476 -7.070 -8.531 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.446 -6.655 -4.368 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.262 -8.005 -7.922 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.232 -7.591 -3.760 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.288 -8.411 -4.487 1.00 0.00 H new ATOM 1118 N GLN A 69 -18.996 -9.136 -5.516 1.00 0.00 N ATOM 1119 CA GLN A 69 -19.547 -9.662 -4.233 1.00 0.00 C ATOM 1120 C GLN A 69 -18.407 -10.009 -3.272 1.00 0.00 C ATOM 1121 O GLN A 69 -17.663 -10.945 -3.489 1.00 0.00 O ATOM 1122 CB GLN A 69 -20.376 -10.916 -4.513 1.00 0.00 C ATOM 1123 CG GLN A 69 -21.674 -10.522 -5.222 1.00 0.00 C ATOM 1124 CD GLN A 69 -22.793 -10.363 -4.190 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -23.080 -11.276 -3.442 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -23.441 -9.232 -4.118 1.00 0.00 N ATOM 0 H GLN A 69 -18.625 -9.843 -6.151 1.00 0.00 H new ATOM 0 HA GLN A 69 -20.176 -8.898 -3.776 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -19.807 -11.610 -5.132 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.601 -11.432 -3.580 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.534 -9.589 -5.768 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -21.946 -11.282 -5.954 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -23.200 -8.465 -4.746 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -24.188 -9.115 -3.434 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.274 -9.267 -2.206 1.00 0.00 N ATOM 1136 CA ALA A 70 -17.194 -9.555 -1.220 1.00 0.00 C ATOM 1137 C ALA A 70 -17.749 -9.376 0.195 1.00 0.00 C ATOM 1138 O ALA A 70 -17.711 -8.298 0.755 1.00 0.00 O ATOM 1139 CB ALA A 70 -16.026 -8.591 -1.438 1.00 0.00 C ATOM 0 H ALA A 70 -18.869 -8.471 -1.975 1.00 0.00 H new ATOM 0 HA ALA A 70 -16.842 -10.578 -1.351 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.238 -8.804 -0.715 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.635 -8.715 -2.448 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -16.371 -7.566 -1.306 1.00 0.00 H new ATOM 1145 N GLN A 71 -18.272 -10.425 0.773 1.00 0.00 N ATOM 1146 CA GLN A 71 -18.838 -10.320 2.148 1.00 0.00 C ATOM 1147 C GLN A 71 -17.703 -10.307 3.171 1.00 0.00 C ATOM 1148 O GLN A 71 -16.837 -11.159 3.164 1.00 0.00 O ATOM 1149 CB GLN A 71 -19.751 -11.518 2.416 1.00 0.00 C ATOM 1150 CG GLN A 71 -20.906 -11.515 1.412 1.00 0.00 C ATOM 1151 CD GLN A 71 -21.191 -12.948 0.958 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -21.702 -13.748 1.716 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -20.881 -13.307 -0.258 1.00 0.00 N ATOM 0 H GLN A 71 -18.331 -11.351 0.350 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.412 -9.397 2.233 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -19.185 -12.446 2.332 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -20.139 -11.472 3.433 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -21.797 -11.083 1.868 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -20.654 -10.893 0.553 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -20.452 -12.635 -0.894 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -21.068 -14.259 -0.572 1.00 0.00 H new ATOM 1162 N GLY A 72 -17.701 -9.343 4.051 1.00 0.00 N ATOM 1163 CA GLY A 72 -16.623 -9.267 5.075 1.00 0.00 C ATOM 1164 C GLY A 72 -15.678 -8.120 4.725 1.00 0.00 C ATOM 1165 O GLY A 72 -15.137 -7.461 5.592 1.00 0.00 O ATOM 0 H GLY A 72 -18.402 -8.604 4.104 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -17.054 -9.110 6.064 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -16.074 -10.208 5.113 1.00 0.00 H new ATOM 1169 N ALA A 73 -15.471 -7.877 3.457 1.00 0.00 N ATOM 1170 CA ALA A 73 -14.558 -6.775 3.049 1.00 0.00 C ATOM 1171 C ALA A 73 -15.362 -5.655 2.383 1.00 0.00 C ATOM 1172 O ALA A 73 -16.291 -5.896 1.637 1.00 0.00 O ATOM 1173 CB ALA A 73 -13.519 -7.316 2.062 1.00 0.00 C ATOM 0 H ALA A 73 -15.896 -8.396 2.688 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.054 -6.378 3.930 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.849 -6.511 1.761 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.943 -8.109 2.539 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.025 -7.714 1.183 1.00 0.00 H new ATOM 1179 N VAL A 74 -14.994 -4.431 2.645 1.00 0.00 N ATOM 1180 CA VAL A 74 -15.716 -3.277 2.032 1.00 0.00 C ATOM 1181 C VAL A 74 -15.590 -3.362 0.508 1.00 0.00 C ATOM 1182 O VAL A 74 -14.710 -4.024 -0.008 1.00 0.00 O ATOM 1183 CB VAL A 74 -15.091 -1.972 2.524 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -15.935 -0.784 2.056 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -15.027 -1.981 4.053 1.00 0.00 C ATOM 0 H VAL A 74 -14.221 -4.178 3.260 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.768 -3.304 2.315 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.084 -1.880 2.117 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -15.485 0.144 2.409 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -15.978 -0.775 0.967 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -16.944 -0.874 2.458 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -14.581 -1.050 4.404 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.034 -2.077 4.459 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.420 -2.823 4.387 1.00 0.00 H new ATOM 1195 N VAL A 75 -16.447 -2.692 -0.221 1.00 0.00 N ATOM 1196 CA VAL A 75 -16.359 -2.733 -1.711 1.00 0.00 C ATOM 1197 C VAL A 75 -16.805 -1.378 -2.269 1.00 0.00 C ATOM 1198 O VAL A 75 -17.850 -0.869 -1.914 1.00 0.00 O ATOM 1199 CB VAL A 75 -17.281 -3.831 -2.253 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -17.186 -3.875 -3.780 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -16.858 -5.185 -1.682 1.00 0.00 C ATOM 0 H VAL A 75 -17.204 -2.119 0.152 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.333 -2.944 -2.013 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.308 -3.615 -1.957 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -17.842 -4.656 -4.163 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.489 -2.912 -4.191 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.158 -4.088 -4.075 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.515 -5.964 -2.069 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -15.830 -5.398 -1.975 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -16.927 -5.159 -0.595 1.00 0.00 H new ATOM 1211 N VAL A 76 -16.027 -0.792 -3.142 1.00 0.00 N ATOM 1212 CA VAL A 76 -16.412 0.530 -3.718 1.00 0.00 C ATOM 1213 C VAL A 76 -15.996 0.592 -5.190 1.00 0.00 C ATOM 1214 O VAL A 76 -15.171 -0.179 -5.644 1.00 0.00 O ATOM 1215 CB VAL A 76 -15.698 1.645 -2.948 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -16.201 1.685 -1.501 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -14.189 1.381 -2.960 1.00 0.00 C ATOM 0 H VAL A 76 -15.143 -1.172 -3.480 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.492 0.657 -3.639 1.00 0.00 H new ATOM 0 HB VAL A 76 -15.907 2.603 -3.423 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.689 2.480 -0.960 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.274 1.874 -1.494 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -15.998 0.729 -1.019 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.677 2.172 -2.413 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -13.984 0.421 -2.486 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.831 1.361 -3.989 1.00 0.00 H new ATOM 1227 N HIS A 77 -16.561 1.501 -5.941 1.00 0.00 N ATOM 1228 CA HIS A 77 -16.198 1.615 -7.385 1.00 0.00 C ATOM 1229 C HIS A 77 -16.006 3.090 -7.744 1.00 0.00 C ATOM 1230 O HIS A 77 -16.247 3.499 -8.863 1.00 0.00 O ATOM 1231 CB HIS A 77 -17.319 1.039 -8.259 1.00 0.00 C ATOM 1232 CG HIS A 77 -17.871 -0.219 -7.642 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -17.055 -1.195 -7.094 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -19.157 -0.674 -7.488 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -17.851 -2.181 -6.641 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -19.142 -1.914 -6.856 1.00 0.00 N ATOM 0 H HIS A 77 -17.259 2.170 -5.616 1.00 0.00 H new ATOM 0 HA HIS A 77 -15.277 1.059 -7.561 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -18.115 1.775 -8.373 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -16.937 0.825 -9.257 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -16.037 -1.171 -7.043 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -20.045 -0.150 -7.808 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -17.490 -3.079 -6.162 1.00 0.00 H new ATOM 1244 N ASP A 78 -15.575 3.894 -6.808 1.00 0.00 N ATOM 1245 CA ASP A 78 -15.368 5.340 -7.108 1.00 0.00 C ATOM 1246 C ASP A 78 -14.590 5.999 -5.967 1.00 0.00 C ATOM 1247 O ASP A 78 -15.106 6.182 -4.883 1.00 0.00 O ATOM 1248 CB ASP A 78 -16.724 6.030 -7.266 1.00 0.00 C ATOM 1249 CG ASP A 78 -16.630 7.093 -8.363 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -16.552 6.715 -9.520 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -16.637 8.265 -8.027 1.00 0.00 O ATOM 0 H ASP A 78 -15.358 3.613 -5.852 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.801 5.436 -8.034 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -17.490 5.297 -7.520 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -17.022 6.490 -6.324 1.00 0.00 H new ATOM 1256 N VAL A 79 -13.350 6.344 -6.204 1.00 0.00 N ATOM 1257 CA VAL A 79 -12.515 6.990 -5.141 1.00 0.00 C ATOM 1258 C VAL A 79 -13.333 8.038 -4.373 1.00 0.00 C ATOM 1259 O VAL A 79 -13.111 8.271 -3.200 1.00 0.00 O ATOM 1260 CB VAL A 79 -11.316 7.678 -5.798 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -10.467 8.362 -4.726 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -10.470 6.638 -6.540 1.00 0.00 C ATOM 0 H VAL A 79 -12.875 6.205 -7.096 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.179 6.223 -4.443 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.672 8.425 -6.507 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.614 8.851 -5.195 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.070 9.105 -4.204 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.112 7.618 -4.013 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.617 7.129 -7.007 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.115 5.887 -5.834 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.076 6.156 -7.307 1.00 0.00 H new ATOM 1272 N ALA A 80 -14.276 8.666 -5.022 1.00 0.00 N ATOM 1273 CA ALA A 80 -15.106 9.693 -4.327 1.00 0.00 C ATOM 1274 C ALA A 80 -15.811 9.055 -3.126 1.00 0.00 C ATOM 1275 O ALA A 80 -15.847 9.613 -2.047 1.00 0.00 O ATOM 1276 CB ALA A 80 -16.148 10.249 -5.301 1.00 0.00 C ATOM 0 H ALA A 80 -14.508 8.513 -6.003 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.466 10.504 -3.979 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.755 10.999 -4.795 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.643 10.705 -6.153 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.789 9.439 -5.650 1.00 0.00 H new ATOM 1282 N ALA A 81 -16.371 7.889 -3.309 1.00 0.00 N ATOM 1283 CA ALA A 81 -17.075 7.211 -2.184 1.00 0.00 C ATOM 1284 C ALA A 81 -16.066 6.843 -1.094 1.00 0.00 C ATOM 1285 O ALA A 81 -16.294 7.071 0.078 1.00 0.00 O ATOM 1286 CB ALA A 81 -17.753 5.939 -2.700 1.00 0.00 C ATOM 0 H ALA A 81 -16.371 7.377 -4.191 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.826 7.883 -1.770 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.268 5.442 -1.878 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.474 6.200 -3.475 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -17.001 5.268 -3.115 1.00 0.00 H new ATOM 1292 N VAL A 82 -14.952 6.272 -1.470 1.00 0.00 N ATOM 1293 CA VAL A 82 -13.924 5.883 -0.457 1.00 0.00 C ATOM 1294 C VAL A 82 -13.519 7.109 0.366 1.00 0.00 C ATOM 1295 O VAL A 82 -13.393 7.044 1.574 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.687 5.321 -1.168 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.787 4.614 -0.152 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -13.114 4.321 -2.248 1.00 0.00 C ATOM 0 H VAL A 82 -14.708 6.057 -2.437 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.343 5.124 0.203 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.141 6.142 -1.632 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.909 4.215 -0.659 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.473 5.325 0.613 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.337 3.798 0.316 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -12.230 3.926 -2.748 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.666 3.502 -1.787 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.750 4.823 -2.977 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.311 8.227 -0.280 1.00 0.00 N ATOM 1309 CA PHE A 83 -12.912 9.459 0.462 1.00 0.00 C ATOM 1310 C PHE A 83 -13.986 9.819 1.490 1.00 0.00 C ATOM 1311 O PHE A 83 -13.697 10.373 2.533 1.00 0.00 O ATOM 1312 CB PHE A 83 -12.739 10.619 -0.523 1.00 0.00 C ATOM 1313 CG PHE A 83 -11.298 10.700 -0.969 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -10.307 11.056 -0.050 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -10.954 10.426 -2.297 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -8.973 11.139 -0.456 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -9.617 10.507 -2.702 1.00 0.00 C ATOM 1318 CZ PHE A 83 -8.628 10.864 -1.781 1.00 0.00 C ATOM 0 H PHE A 83 -13.400 8.340 -1.290 1.00 0.00 H new ATOM 0 HA PHE A 83 -11.969 9.275 0.977 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.389 10.475 -1.386 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -13.037 11.556 -0.052 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.573 11.267 0.975 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -11.719 10.152 -3.009 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.208 11.416 0.255 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.349 10.294 -3.726 1.00 0.00 H new ATOM 0 HZ PHE A 83 -7.596 10.927 -2.094 1.00 0.00 H new ATOM 1328 N ALA A 84 -15.223 9.511 1.207 1.00 0.00 N ATOM 1329 CA ALA A 84 -16.312 9.840 2.171 1.00 0.00 C ATOM 1330 C ALA A 84 -16.145 9.006 3.445 1.00 0.00 C ATOM 1331 O ALA A 84 -16.083 9.535 4.538 1.00 0.00 O ATOM 1332 CB ALA A 84 -17.669 9.531 1.534 1.00 0.00 C ATOM 0 H ALA A 84 -15.526 9.046 0.351 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.260 10.899 2.424 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.465 9.772 2.239 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -17.791 10.129 0.631 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -17.718 8.473 1.278 1.00 0.00 H new ATOM 1338 N TYR A 85 -16.105 7.705 3.312 1.00 0.00 N ATOM 1339 CA TYR A 85 -15.973 6.811 4.507 1.00 0.00 C ATOM 1340 C TYR A 85 -14.897 7.325 5.474 1.00 0.00 C ATOM 1341 O TYR A 85 -15.160 7.548 6.639 1.00 0.00 O ATOM 1342 CB TYR A 85 -15.595 5.405 4.036 1.00 0.00 C ATOM 1343 CG TYR A 85 -16.156 4.382 4.995 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -17.542 4.220 5.112 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -15.290 3.596 5.767 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -18.063 3.271 6.001 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -15.812 2.648 6.656 1.00 0.00 C ATOM 1348 CZ TYR A 85 -17.198 2.485 6.773 1.00 0.00 C ATOM 1349 OH TYR A 85 -17.713 1.551 7.650 1.00 0.00 O ATOM 0 H TYR A 85 -16.159 7.217 2.418 1.00 0.00 H new ATOM 0 HA TYR A 85 -16.927 6.797 5.035 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -15.984 5.230 3.033 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.511 5.309 3.979 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -18.209 4.826 4.517 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.221 3.721 5.677 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -19.132 3.145 6.091 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -15.145 2.042 7.252 1.00 0.00 H new ATOM 0 HH TYR A 85 -17.687 1.909 8.562 1.00 0.00 H new ATOM 1359 N ALA A 86 -13.689 7.507 5.007 1.00 0.00 N ATOM 1360 CA ALA A 86 -12.602 7.994 5.913 1.00 0.00 C ATOM 1361 C ALA A 86 -13.017 9.307 6.580 1.00 0.00 C ATOM 1362 O ALA A 86 -12.835 9.494 7.767 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.326 8.222 5.106 1.00 0.00 C ATOM 0 H ALA A 86 -13.407 7.341 4.041 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.424 7.242 6.682 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.536 8.577 5.768 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.017 7.286 4.641 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.513 8.967 4.332 1.00 0.00 H new ATOM 1369 N LYS A 87 -13.584 10.211 5.830 1.00 0.00 N ATOM 1370 CA LYS A 87 -14.019 11.506 6.426 1.00 0.00 C ATOM 1371 C LYS A 87 -15.109 11.243 7.468 1.00 0.00 C ATOM 1372 O LYS A 87 -15.305 12.016 8.385 1.00 0.00 O ATOM 1373 CB LYS A 87 -14.574 12.413 5.322 1.00 0.00 C ATOM 1374 CG LYS A 87 -13.606 13.571 5.070 1.00 0.00 C ATOM 1375 CD LYS A 87 -13.851 14.674 6.101 1.00 0.00 C ATOM 1376 CE LYS A 87 -13.324 16.006 5.562 1.00 0.00 C ATOM 1377 NZ LYS A 87 -14.246 17.105 5.966 1.00 0.00 N ATOM 0 H LYS A 87 -13.765 10.110 4.831 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.169 11.994 6.903 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -14.718 11.840 4.406 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -15.551 12.800 5.613 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -12.576 13.219 5.136 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.745 13.963 4.062 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.916 14.754 6.317 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -13.353 14.427 7.038 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -12.323 16.196 5.948 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.244 15.965 4.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.888 18.010 5.600 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -15.193 16.924 5.577 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -14.301 17.148 7.004 1.00 0.00 H new ATOM 1391 N GLN A 88 -15.833 10.167 7.316 1.00 0.00 N ATOM 1392 CA GLN A 88 -16.927 9.860 8.279 1.00 0.00 C ATOM 1393 C GLN A 88 -16.414 8.981 9.425 1.00 0.00 C ATOM 1394 O GLN A 88 -17.025 8.916 10.474 1.00 0.00 O ATOM 1395 CB GLN A 88 -18.060 9.133 7.547 1.00 0.00 C ATOM 1396 CG GLN A 88 -19.329 9.988 7.589 1.00 0.00 C ATOM 1397 CD GLN A 88 -19.273 11.041 6.481 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -19.177 12.221 6.753 1.00 0.00 O ATOM 1399 NE2 GLN A 88 -19.329 10.661 5.234 1.00 0.00 N ATOM 0 H GLN A 88 -15.713 9.487 6.565 1.00 0.00 H new ATOM 0 HA GLN A 88 -17.294 10.797 8.698 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.774 8.940 6.513 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.246 8.165 8.013 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.209 9.358 7.462 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.422 10.472 8.561 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -19.410 9.670 5.006 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -19.292 11.355 4.487 1.00 0.00 H new ATOM 1408 N HIS A 89 -15.309 8.298 9.252 1.00 0.00 N ATOM 1409 CA HIS A 89 -14.797 7.431 10.354 1.00 0.00 C ATOM 1410 C HIS A 89 -13.752 8.199 11.177 1.00 0.00 C ATOM 1411 O HIS A 89 -12.729 8.593 10.653 1.00 0.00 O ATOM 1412 CB HIS A 89 -14.143 6.184 9.750 1.00 0.00 C ATOM 1413 CG HIS A 89 -15.142 5.060 9.709 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -14.960 3.883 10.415 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -16.339 4.921 9.050 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -16.020 3.093 10.168 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -16.891 3.677 9.342 1.00 0.00 N ATOM 0 H HIS A 89 -14.745 8.304 8.402 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.625 7.142 11.001 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -13.783 6.401 8.744 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.276 5.892 10.343 1.00 0.00 H new ATOM 0 HD1 HIS A 89 -14.166 3.656 11.014 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -16.784 5.663 8.404 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.151 2.106 10.587 1.00 0.00 H new ATOM 1425 N PRO A 90 -14.033 8.386 12.447 1.00 0.00 N ATOM 1426 CA PRO A 90 -13.158 9.100 13.438 1.00 0.00 C ATOM 1427 C PRO A 90 -12.085 8.149 13.988 1.00 0.00 C ATOM 1428 O PRO A 90 -11.290 8.520 14.829 1.00 0.00 O ATOM 1429 CB PRO A 90 -14.077 9.558 14.566 1.00 0.00 C ATOM 1430 CG PRO A 90 -15.373 8.783 14.433 1.00 0.00 C ATOM 1431 CD PRO A 90 -15.274 7.934 13.168 1.00 0.00 C ATOM 0 HA PRO A 90 -12.643 9.941 12.974 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.616 9.373 15.536 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.262 10.630 14.500 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.533 8.151 15.307 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.222 9.464 14.372 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -15.215 6.874 13.416 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.156 8.066 12.542 1.00 0.00 H new ATOM 1439 N ASP A 91 -12.052 6.930 13.515 1.00 0.00 N ATOM 1440 CA ASP A 91 -11.026 5.961 14.003 1.00 0.00 C ATOM 1441 C ASP A 91 -10.529 5.107 12.831 1.00 0.00 C ATOM 1442 O ASP A 91 -9.844 4.120 13.015 1.00 0.00 O ATOM 1443 CB ASP A 91 -11.644 5.055 15.070 1.00 0.00 C ATOM 1444 CG ASP A 91 -10.605 4.762 16.155 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -10.323 5.657 16.935 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -10.109 3.648 16.187 1.00 0.00 O ATOM 0 H ASP A 91 -12.692 6.563 12.811 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.187 6.508 14.434 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.518 5.536 15.509 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.986 4.124 14.618 1.00 0.00 H new ATOM 1451 N GLN A 92 -10.866 5.486 11.626 1.00 0.00 N ATOM 1452 CA GLN A 92 -10.418 4.718 10.433 1.00 0.00 C ATOM 1453 C GLN A 92 -10.205 5.705 9.289 1.00 0.00 C ATOM 1454 O GLN A 92 -11.151 6.163 8.678 1.00 0.00 O ATOM 1455 CB GLN A 92 -11.501 3.704 10.043 1.00 0.00 C ATOM 1456 CG GLN A 92 -10.881 2.313 9.878 1.00 0.00 C ATOM 1457 CD GLN A 92 -11.574 1.328 10.824 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -12.763 0.883 10.524 1.00 0.00 O flip ATOM 1459 NE2 GLN A 92 -11.028 0.963 11.846 1.00 0.00 N flip ATOM 0 H GLN A 92 -11.439 6.304 11.418 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.493 4.183 10.649 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -12.278 3.677 10.807 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -11.980 4.010 9.113 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.985 1.977 8.846 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -9.813 2.351 10.094 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -10.098 1.311 12.080 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -11.499 0.308 12.470 1.00 0.00 H new ATOM 1468 N GLU A 93 -8.983 6.054 8.996 1.00 0.00 N ATOM 1469 CA GLU A 93 -8.740 7.031 7.901 1.00 0.00 C ATOM 1470 C GLU A 93 -8.626 6.305 6.561 1.00 0.00 C ATOM 1471 O GLU A 93 -8.990 5.151 6.433 1.00 0.00 O ATOM 1472 CB GLU A 93 -7.448 7.798 8.193 1.00 0.00 C ATOM 1473 CG GLU A 93 -7.722 8.853 9.266 1.00 0.00 C ATOM 1474 CD GLU A 93 -6.468 9.059 10.115 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -5.531 9.661 9.617 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -6.466 8.611 11.250 1.00 0.00 O ATOM 0 H GLU A 93 -8.147 5.706 9.465 1.00 0.00 H new ATOM 0 HA GLU A 93 -9.576 7.729 7.846 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.672 7.111 8.531 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -7.080 8.273 7.284 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.016 9.793 8.799 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.553 8.537 9.897 1.00 0.00 H new ATOM 1483 N LEU A 94 -8.116 6.980 5.568 1.00 0.00 N ATOM 1484 CA LEU A 94 -7.964 6.355 4.227 1.00 0.00 C ATOM 1485 C LEU A 94 -6.508 5.929 4.025 1.00 0.00 C ATOM 1486 O LEU A 94 -5.611 6.748 4.007 1.00 0.00 O ATOM 1487 CB LEU A 94 -8.357 7.374 3.154 1.00 0.00 C ATOM 1488 CG LEU A 94 -8.985 6.654 1.962 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -10.499 6.560 2.164 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -8.686 7.441 0.683 1.00 0.00 C ATOM 0 H LEU A 94 -7.796 7.946 5.630 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.607 5.478 4.152 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -9.061 8.097 3.566 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.479 7.933 2.831 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.569 5.650 1.878 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.948 6.046 1.314 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.710 6.004 3.077 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.918 7.563 2.245 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.132 6.931 -0.171 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.105 8.444 0.766 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.607 7.509 0.542 1.00 0.00 H new ATOM 1502 N VAL A 95 -6.265 4.655 3.879 1.00 0.00 N ATOM 1503 CA VAL A 95 -4.865 4.182 3.672 1.00 0.00 C ATOM 1504 C VAL A 95 -4.797 3.422 2.350 1.00 0.00 C ATOM 1505 O VAL A 95 -5.603 2.552 2.085 1.00 0.00 O ATOM 1506 CB VAL A 95 -4.445 3.254 4.815 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -2.955 2.922 4.684 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -4.695 3.949 6.155 1.00 0.00 C ATOM 0 H VAL A 95 -6.974 3.922 3.894 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.191 5.038 3.651 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.028 2.334 4.767 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.657 2.261 5.498 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.775 2.427 3.730 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.372 3.842 4.731 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.396 3.288 6.969 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -4.113 4.869 6.202 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.755 4.185 6.250 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.863 3.760 1.507 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.763 3.067 0.194 1.00 0.00 C ATOM 1520 C ILE A 96 -2.908 1.808 0.342 1.00 0.00 C ATOM 1521 O ILE A 96 -1.942 1.782 1.083 1.00 0.00 O ATOM 1522 CB ILE A 96 -3.122 3.995 -0.840 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -3.790 5.376 -0.790 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.298 3.392 -2.235 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.281 5.242 -1.093 1.00 0.00 C ATOM 0 H ILE A 96 -3.165 4.486 1.670 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.764 2.794 -0.139 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.061 4.105 -0.617 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.648 5.823 0.194 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.321 6.043 -1.513 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.843 4.050 -2.976 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.816 2.415 -2.272 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.360 3.281 -2.452 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.750 6.225 -1.056 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.413 4.814 -2.087 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.746 4.591 -0.353 1.00 0.00 H new ATOM 1537 N ALA A 97 -3.246 0.772 -0.379 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.452 -0.488 -0.310 1.00 0.00 C ATOM 1539 C ALA A 97 -2.031 -0.901 -1.727 1.00 0.00 C ATOM 1540 O ALA A 97 -1.320 -1.869 -1.914 1.00 0.00 O ATOM 1541 CB ALA A 97 -3.298 -1.594 0.320 1.00 0.00 C ATOM 0 H ALA A 97 -4.042 0.745 -1.016 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.563 -0.326 0.300 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.716 -2.514 0.369 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.594 -1.297 1.326 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.189 -1.761 -0.286 1.00 0.00 H new ATOM 1547 N GLY A 98 -2.432 -0.148 -2.723 1.00 0.00 N ATOM 1548 CA GLY A 98 -2.023 -0.471 -4.122 1.00 0.00 C ATOM 1549 C GLY A 98 -3.132 -1.244 -4.853 1.00 0.00 C ATOM 1550 O GLY A 98 -4.270 -1.251 -4.434 1.00 0.00 O ATOM 0 H GLY A 98 -3.025 0.676 -2.625 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.799 0.449 -4.661 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.108 -1.064 -4.110 1.00 0.00 H new ATOM 1554 N GLY A 99 -2.811 -1.882 -5.959 1.00 0.00 N ATOM 1555 CA GLY A 99 -1.408 -1.872 -6.474 1.00 0.00 C ATOM 1556 C GLY A 99 -1.048 -0.510 -7.083 1.00 0.00 C ATOM 1557 O GLY A 99 -1.410 0.533 -6.575 1.00 0.00 O ATOM 0 H GLY A 99 -3.471 -2.412 -6.528 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -0.719 -2.104 -5.662 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -1.289 -2.652 -7.226 1.00 0.00 H new ATOM 1561 N ALA A 100 -0.337 -0.522 -8.178 1.00 0.00 N ATOM 1562 CA ALA A 100 0.073 0.757 -8.829 1.00 0.00 C ATOM 1563 C ALA A 100 -1.159 1.542 -9.276 1.00 0.00 C ATOM 1564 O ALA A 100 -1.203 2.752 -9.169 1.00 0.00 O ATOM 1565 CB ALA A 100 0.945 0.449 -10.048 1.00 0.00 C ATOM 0 H ALA A 100 -0.020 -1.367 -8.653 1.00 0.00 H new ATOM 0 HA ALA A 100 0.635 1.355 -8.111 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.246 1.382 -10.525 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.832 -0.099 -9.731 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.379 -0.155 -10.757 1.00 0.00 H new ATOM 1571 N GLN A 101 -2.150 0.872 -9.795 1.00 0.00 N ATOM 1572 CA GLN A 101 -3.363 1.590 -10.267 1.00 0.00 C ATOM 1573 C GLN A 101 -3.963 2.411 -9.123 1.00 0.00 C ATOM 1574 O GLN A 101 -4.447 3.506 -9.335 1.00 0.00 O ATOM 1575 CB GLN A 101 -4.397 0.579 -10.771 1.00 0.00 C ATOM 1576 CG GLN A 101 -4.360 0.531 -12.301 1.00 0.00 C ATOM 1577 CD GLN A 101 -5.337 1.562 -12.870 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -6.577 1.218 -13.087 1.00 0.00 O flip ATOM 1579 NE2 GLN A 101 -4.968 2.692 -13.120 1.00 0.00 N flip ATOM 0 H GLN A 101 -2.171 -0.141 -9.912 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.085 2.261 -11.080 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -4.186 -0.408 -10.360 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -5.393 0.860 -10.429 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -3.350 0.736 -12.657 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.624 -0.467 -12.650 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -3.999 2.961 -12.951 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -5.627 3.372 -13.499 1.00 0.00 H new ATOM 1588 N ILE A 102 -3.965 1.900 -7.916 1.00 0.00 N ATOM 1589 CA ILE A 102 -4.571 2.670 -6.794 1.00 0.00 C ATOM 1590 C ILE A 102 -3.624 3.782 -6.334 1.00 0.00 C ATOM 1591 O ILE A 102 -4.057 4.781 -5.795 1.00 0.00 O ATOM 1592 CB ILE A 102 -4.856 1.722 -5.626 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -5.697 0.537 -6.118 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -5.619 2.470 -4.531 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -7.001 1.045 -6.741 1.00 0.00 C ATOM 0 H ILE A 102 -3.576 0.991 -7.664 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.500 3.124 -7.137 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.913 1.354 -5.223 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.134 -0.040 -6.852 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.918 -0.133 -5.287 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.821 1.793 -3.701 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.019 3.309 -4.178 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.561 2.842 -4.933 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.593 0.198 -7.088 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.568 1.602 -5.995 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.772 1.697 -7.584 1.00 0.00 H new ATOM 1607 N PHE A 103 -2.341 3.636 -6.535 1.00 0.00 N ATOM 1608 CA PHE A 103 -1.406 4.712 -6.096 1.00 0.00 C ATOM 1609 C PHE A 103 -1.535 5.911 -7.044 1.00 0.00 C ATOM 1610 O PHE A 103 -1.205 7.029 -6.695 1.00 0.00 O ATOM 1611 CB PHE A 103 0.041 4.199 -6.139 1.00 0.00 C ATOM 1612 CG PHE A 103 0.264 3.136 -5.084 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -0.263 3.297 -3.798 1.00 0.00 C ATOM 1614 CD2 PHE A 103 1.009 1.990 -5.394 1.00 0.00 C ATOM 1615 CE1 PHE A 103 -0.049 2.315 -2.823 1.00 0.00 C ATOM 1616 CE2 PHE A 103 1.223 1.007 -4.419 1.00 0.00 C ATOM 1617 CZ PHE A 103 0.693 1.170 -3.134 1.00 0.00 C ATOM 0 H PHE A 103 -1.904 2.828 -6.979 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.656 5.009 -5.077 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.258 3.790 -7.126 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.731 5.028 -5.979 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.836 4.180 -3.557 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.418 1.865 -6.385 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.457 2.441 -1.831 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.797 0.124 -4.659 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.857 0.412 -2.382 1.00 0.00 H new ATOM 1627 N THR A 104 -1.996 5.685 -8.246 1.00 0.00 N ATOM 1628 CA THR A 104 -2.124 6.805 -9.221 1.00 0.00 C ATOM 1629 C THR A 104 -3.406 7.598 -8.959 1.00 0.00 C ATOM 1630 O THR A 104 -3.388 8.808 -8.875 1.00 0.00 O ATOM 1631 CB THR A 104 -2.163 6.243 -10.647 1.00 0.00 C ATOM 1632 OG1 THR A 104 -1.351 5.075 -10.734 1.00 0.00 O ATOM 1633 CG2 THR A 104 -1.648 7.301 -11.624 1.00 0.00 C ATOM 0 H THR A 104 -2.289 4.772 -8.594 1.00 0.00 H new ATOM 0 HA THR A 104 -1.266 7.467 -9.105 1.00 0.00 H new ATOM 0 HB THR A 104 -3.190 5.980 -10.901 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.383 4.722 -11.648 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.675 6.903 -12.638 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.279 8.188 -11.565 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.623 7.567 -11.366 1.00 0.00 H new ATOM 1641 N ALA A 105 -4.523 6.935 -8.846 1.00 0.00 N ATOM 1642 CA ALA A 105 -5.800 7.669 -8.611 1.00 0.00 C ATOM 1643 C ALA A 105 -5.713 8.477 -7.312 1.00 0.00 C ATOM 1644 O ALA A 105 -6.337 9.511 -7.176 1.00 0.00 O ATOM 1645 CB ALA A 105 -6.955 6.667 -8.508 1.00 0.00 C ATOM 0 H ALA A 105 -4.608 5.920 -8.906 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.975 8.350 -9.444 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.888 7.204 -8.336 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -7.028 6.100 -9.436 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.771 5.984 -7.679 1.00 0.00 H new ATOM 1651 N PHE A 106 -4.968 8.004 -6.349 1.00 0.00 N ATOM 1652 CA PHE A 106 -4.871 8.741 -5.054 1.00 0.00 C ATOM 1653 C PHE A 106 -3.589 9.585 -4.992 1.00 0.00 C ATOM 1654 O PHE A 106 -3.362 10.297 -4.032 1.00 0.00 O ATOM 1655 CB PHE A 106 -4.864 7.730 -3.906 1.00 0.00 C ATOM 1656 CG PHE A 106 -6.213 7.057 -3.815 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -6.577 6.086 -4.753 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -7.098 7.402 -2.790 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -7.825 5.462 -4.667 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -8.345 6.778 -2.703 1.00 0.00 C ATOM 1661 CZ PHE A 106 -8.709 5.808 -3.641 1.00 0.00 C ATOM 0 H PHE A 106 -4.424 7.143 -6.402 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.727 9.410 -4.969 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.085 6.985 -4.069 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.633 8.233 -2.967 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -5.893 5.818 -5.545 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.818 8.151 -2.065 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.106 4.713 -5.393 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -9.028 7.045 -1.910 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.673 5.326 -3.573 1.00 0.00 H new ATOM 1671 N LYS A 107 -2.731 9.500 -5.979 1.00 0.00 N ATOM 1672 CA LYS A 107 -1.464 10.293 -5.926 1.00 0.00 C ATOM 1673 C LYS A 107 -1.755 11.785 -5.672 1.00 0.00 C ATOM 1674 O LYS A 107 -1.030 12.441 -4.954 1.00 0.00 O ATOM 1675 CB LYS A 107 -0.669 10.114 -7.235 1.00 0.00 C ATOM 1676 CG LYS A 107 -1.301 10.908 -8.389 1.00 0.00 C ATOM 1677 CD LYS A 107 -0.209 11.321 -9.382 1.00 0.00 C ATOM 1678 CE LYS A 107 -0.488 10.689 -10.747 1.00 0.00 C ATOM 1679 NZ LYS A 107 0.245 11.444 -11.802 1.00 0.00 N ATOM 0 H LYS A 107 -2.851 8.922 -6.811 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.863 9.922 -5.096 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.359 10.443 -7.086 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.631 9.057 -7.497 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -2.055 10.302 -8.892 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -1.809 11.791 -8.002 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -0.178 12.407 -9.473 1.00 0.00 H new ATOM 0 HD3 LYS A 107 0.768 11.004 -9.016 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -0.175 9.645 -10.747 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -1.558 10.701 -10.953 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 0.056 11.015 -12.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 -0.075 12.434 -11.806 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 1.266 11.411 -11.607 1.00 0.00 H new ATOM 1693 N ASP A 108 -2.797 12.333 -6.247 1.00 0.00 N ATOM 1694 CA ASP A 108 -3.094 13.782 -6.027 1.00 0.00 C ATOM 1695 C ASP A 108 -3.561 14.022 -4.588 1.00 0.00 C ATOM 1696 O ASP A 108 -3.224 15.017 -3.975 1.00 0.00 O ATOM 1697 CB ASP A 108 -4.197 14.221 -6.993 1.00 0.00 C ATOM 1698 CG ASP A 108 -3.938 15.657 -7.450 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -3.228 15.828 -8.427 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -4.454 16.563 -6.815 1.00 0.00 O ATOM 0 H ASP A 108 -3.452 11.842 -6.856 1.00 0.00 H new ATOM 0 HA ASP A 108 -2.186 14.359 -6.204 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.226 13.554 -7.855 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.169 14.154 -6.505 1.00 0.00 H new ATOM 1705 N ASP A 109 -4.345 13.130 -4.051 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.851 13.304 -2.658 1.00 0.00 C ATOM 1707 C ASP A 109 -4.030 12.429 -1.711 1.00 0.00 C ATOM 1708 O ASP A 109 -4.377 11.294 -1.451 1.00 0.00 O ATOM 1709 CB ASP A 109 -6.319 12.880 -2.598 1.00 0.00 C ATOM 1710 CG ASP A 109 -7.205 14.019 -3.102 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -7.426 14.951 -2.346 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -7.651 13.940 -4.235 1.00 0.00 O ATOM 0 H ASP A 109 -4.660 12.281 -4.520 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.760 14.349 -2.361 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.475 11.989 -3.206 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.591 12.620 -1.575 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.937 12.939 -1.201 1.00 0.00 N ATOM 1718 CA VAL A 110 -2.096 12.124 -0.275 1.00 0.00 C ATOM 1719 C VAL A 110 -1.915 12.870 1.051 1.00 0.00 C ATOM 1720 O VAL A 110 -1.908 14.084 1.096 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.723 11.888 -0.905 1.00 0.00 C ATOM 1722 CG1 VAL A 110 0.061 10.888 -0.055 1.00 0.00 C ATOM 1723 CG2 VAL A 110 -0.890 11.333 -2.322 1.00 0.00 C ATOM 0 H VAL A 110 -2.592 13.881 -1.386 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.588 11.169 -0.094 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.181 12.833 -0.952 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.040 10.719 -0.503 1.00 0.00 H new ATOM 0 HG12 VAL A 110 0.187 11.286 0.952 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.484 9.945 -0.007 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.092 11.167 -2.766 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.434 10.389 -2.281 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.447 12.047 -2.929 1.00 0.00 H new ATOM 1733 N ASP A 111 -1.771 12.148 2.132 1.00 0.00 N ATOM 1734 CA ASP A 111 -1.586 12.805 3.458 1.00 0.00 C ATOM 1735 C ASP A 111 -0.394 12.166 4.183 1.00 0.00 C ATOM 1736 O ASP A 111 0.345 12.828 4.886 1.00 0.00 O ATOM 1737 CB ASP A 111 -2.853 12.626 4.299 1.00 0.00 C ATOM 1738 CG ASP A 111 -3.193 13.943 5.000 1.00 0.00 C ATOM 1739 OD1 ASP A 111 -2.524 14.266 5.968 1.00 0.00 O ATOM 1740 OD2 ASP A 111 -4.116 14.607 4.557 1.00 0.00 O ATOM 0 H ASP A 111 -1.774 11.128 2.152 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.395 13.868 3.313 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.683 12.316 3.664 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.704 11.837 5.037 1.00 0.00 H new ATOM 1745 N THR A 112 -0.206 10.882 4.017 1.00 0.00 N ATOM 1746 CA THR A 112 0.935 10.191 4.689 1.00 0.00 C ATOM 1747 C THR A 112 1.535 9.162 3.727 1.00 0.00 C ATOM 1748 O THR A 112 0.824 8.415 3.085 1.00 0.00 O ATOM 1749 CB THR A 112 0.431 9.481 5.950 1.00 0.00 C ATOM 1750 OG1 THR A 112 -0.359 10.381 6.715 1.00 0.00 O ATOM 1751 CG2 THR A 112 1.618 9.000 6.788 1.00 0.00 C ATOM 0 H THR A 112 -0.796 10.280 3.443 1.00 0.00 H new ATOM 0 HA THR A 112 1.696 10.921 4.966 1.00 0.00 H new ATOM 0 HB THR A 112 -0.172 8.620 5.661 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.683 9.928 7.521 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.252 8.496 7.683 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.220 8.306 6.202 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.229 9.855 7.078 1.00 0.00 H new ATOM 1759 N LEU A 113 2.836 9.123 3.615 1.00 0.00 N ATOM 1760 CA LEU A 113 3.475 8.146 2.683 1.00 0.00 C ATOM 1761 C LEU A 113 4.322 7.144 3.469 1.00 0.00 C ATOM 1762 O LEU A 113 5.145 7.514 4.283 1.00 0.00 O ATOM 1763 CB LEU A 113 4.362 8.896 1.689 1.00 0.00 C ATOM 1764 CG LEU A 113 3.508 9.894 0.907 1.00 0.00 C ATOM 1765 CD1 LEU A 113 4.394 11.021 0.372 1.00 0.00 C ATOM 1766 CD2 LEU A 113 2.830 9.173 -0.261 1.00 0.00 C ATOM 0 H LEU A 113 3.483 9.723 4.126 1.00 0.00 H new ATOM 0 HA LEU A 113 2.696 7.606 2.145 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.160 9.418 2.217 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.838 8.193 1.006 1.00 0.00 H new ATOM 0 HG LEU A 113 2.748 10.317 1.564 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.783 11.731 -0.185 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.875 11.532 1.206 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.156 10.604 -0.286 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.220 9.882 -0.821 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.590 8.750 -0.918 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.197 8.373 0.123 1.00 0.00 H new ATOM 1778 N LEU A 114 4.124 5.874 3.228 1.00 0.00 N ATOM 1779 CA LEU A 114 4.909 4.835 3.953 1.00 0.00 C ATOM 1780 C LEU A 114 5.579 3.913 2.929 1.00 0.00 C ATOM 1781 O LEU A 114 4.942 3.078 2.315 1.00 0.00 O ATOM 1782 CB LEU A 114 3.972 4.022 4.848 1.00 0.00 C ATOM 1783 CG LEU A 114 3.091 4.970 5.669 1.00 0.00 C ATOM 1784 CD1 LEU A 114 1.770 4.278 6.004 1.00 0.00 C ATOM 1785 CD2 LEU A 114 3.814 5.346 6.964 1.00 0.00 C ATOM 0 H LEU A 114 3.448 5.511 2.556 1.00 0.00 H new ATOM 0 HA LEU A 114 5.671 5.309 4.572 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.349 3.367 4.239 1.00 0.00 H new ATOM 0 HB3 LEU A 114 4.552 3.382 5.513 1.00 0.00 H new ATOM 0 HG LEU A 114 2.891 5.872 5.090 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.144 4.953 6.588 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.254 4.012 5.081 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.968 3.375 6.582 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.187 6.020 7.548 1.00 0.00 H new ATOM 0 HD22 LEU A 114 4.015 4.445 7.543 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.755 5.841 6.725 1.00 0.00 H new ATOM 1797 N VAL A 115 6.857 4.079 2.728 1.00 0.00 N ATOM 1798 CA VAL A 115 7.569 3.235 1.723 1.00 0.00 C ATOM 1799 C VAL A 115 8.693 2.420 2.373 1.00 0.00 C ATOM 1800 O VAL A 115 9.424 2.901 3.216 1.00 0.00 O ATOM 1801 CB VAL A 115 8.147 4.134 0.628 1.00 0.00 C ATOM 1802 CG1 VAL A 115 9.185 5.084 1.226 1.00 0.00 C ATOM 1803 CG2 VAL A 115 8.803 3.266 -0.448 1.00 0.00 C ATOM 0 H VAL A 115 7.440 4.761 3.214 1.00 0.00 H new ATOM 0 HA VAL A 115 6.854 2.534 1.293 1.00 0.00 H new ATOM 0 HB VAL A 115 7.343 4.721 0.184 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.591 5.720 0.440 1.00 0.00 H new ATOM 0 HG12 VAL A 115 8.714 5.705 1.988 1.00 0.00 H new ATOM 0 HG13 VAL A 115 9.991 4.505 1.677 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.215 3.905 -1.229 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.603 2.676 -0.001 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.058 2.598 -0.881 1.00 0.00 H new ATOM 1813 N THR A 116 8.841 1.188 1.954 1.00 0.00 N ATOM 1814 CA THR A 116 9.922 0.320 2.506 1.00 0.00 C ATOM 1815 C THR A 116 11.007 0.149 1.439 1.00 0.00 C ATOM 1816 O THR A 116 10.784 -0.461 0.412 1.00 0.00 O ATOM 1817 CB THR A 116 9.358 -1.062 2.864 1.00 0.00 C ATOM 1818 OG1 THR A 116 7.994 -0.948 3.250 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.167 -1.658 4.016 1.00 0.00 C ATOM 0 H THR A 116 8.254 0.745 1.248 1.00 0.00 H new ATOM 0 HA THR A 116 10.334 0.783 3.403 1.00 0.00 H new ATOM 0 HB THR A 116 9.427 -1.712 1.992 1.00 0.00 H new ATOM 0 HG1 THR A 116 7.642 -1.835 3.475 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.768 -2.640 4.271 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.210 -1.758 3.715 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.101 -1.002 4.884 1.00 0.00 H new ATOM 1827 N ARG A 117 12.177 0.685 1.667 1.00 0.00 N ATOM 1828 CA ARG A 117 13.265 0.548 0.656 1.00 0.00 C ATOM 1829 C ARG A 117 14.172 -0.626 1.037 1.00 0.00 C ATOM 1830 O ARG A 117 14.842 -0.603 2.051 1.00 0.00 O ATOM 1831 CB ARG A 117 14.079 1.844 0.602 1.00 0.00 C ATOM 1832 CG ARG A 117 13.296 2.900 -0.186 1.00 0.00 C ATOM 1833 CD ARG A 117 14.199 4.100 -0.482 1.00 0.00 C ATOM 1834 NE ARG A 117 13.424 5.365 -0.301 1.00 0.00 N ATOM 1835 CZ ARG A 117 12.642 5.819 -1.253 1.00 0.00 C ATOM 1836 NH1 ARG A 117 12.522 5.178 -2.388 1.00 0.00 N ATOM 1837 NH2 ARG A 117 11.976 6.926 -1.066 1.00 0.00 N ATOM 0 H ARG A 117 12.425 1.209 2.506 1.00 0.00 H new ATOM 0 HA ARG A 117 12.831 0.359 -0.326 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.281 2.202 1.611 1.00 0.00 H new ATOM 0 HB3 ARG A 117 15.044 1.662 0.129 1.00 0.00 H new ATOM 0 HG2 ARG A 117 12.927 2.472 -1.118 1.00 0.00 H new ATOM 0 HG3 ARG A 117 12.424 3.221 0.385 1.00 0.00 H new ATOM 0 HD2 ARG A 117 15.062 4.092 0.183 1.00 0.00 H new ATOM 0 HD3 ARG A 117 14.581 4.038 -1.501 1.00 0.00 H new ATOM 0 HE ARG A 117 13.504 5.883 0.574 1.00 0.00 H new ATOM 0 HH11 ARG A 117 13.040 4.313 -2.542 1.00 0.00 H new ATOM 0 HH12 ARG A 117 11.910 5.543 -3.118 1.00 0.00 H new ATOM 0 HH21 ARG A 117 12.065 7.432 -0.185 1.00 0.00 H new ATOM 0 HH22 ARG A 117 11.367 7.285 -1.801 1.00 0.00 H new ATOM 1851 N LEU A 118 14.188 -1.657 0.231 1.00 0.00 N ATOM 1852 CA LEU A 118 15.041 -2.843 0.541 1.00 0.00 C ATOM 1853 C LEU A 118 16.464 -2.596 0.038 1.00 0.00 C ATOM 1854 O LEU A 118 16.691 -1.786 -0.840 1.00 0.00 O ATOM 1855 CB LEU A 118 14.469 -4.087 -0.151 1.00 0.00 C ATOM 1856 CG LEU A 118 13.178 -4.530 0.545 1.00 0.00 C ATOM 1857 CD1 LEU A 118 12.074 -3.502 0.287 1.00 0.00 C ATOM 1858 CD2 LEU A 118 12.741 -5.892 -0.005 1.00 0.00 C ATOM 0 H LEU A 118 13.646 -1.728 -0.630 1.00 0.00 H new ATOM 0 HA LEU A 118 15.056 -3.001 1.619 1.00 0.00 H new ATOM 0 HB2 LEU A 118 14.269 -3.870 -1.200 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.200 -4.895 -0.126 1.00 0.00 H new ATOM 0 HG LEU A 118 13.357 -4.609 1.617 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.157 -3.820 0.783 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.381 -2.532 0.679 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.896 -3.420 -0.785 1.00 0.00 H new ATOM 0 HD21 LEU A 118 11.823 -6.207 0.490 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.565 -5.812 -1.078 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.524 -6.627 0.181 1.00 0.00 H new ATOM 1870 N ALA A 119 17.425 -3.294 0.583 1.00 0.00 N ATOM 1871 CA ALA A 119 18.833 -3.105 0.135 1.00 0.00 C ATOM 1872 C ALA A 119 19.081 -3.933 -1.128 1.00 0.00 C ATOM 1873 O ALA A 119 19.908 -3.591 -1.951 1.00 0.00 O ATOM 1874 CB ALA A 119 19.791 -3.557 1.240 1.00 0.00 C ATOM 0 H ALA A 119 17.294 -3.987 1.320 1.00 0.00 H new ATOM 0 HA ALA A 119 19.005 -2.051 -0.081 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.820 -3.417 0.909 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.615 -2.965 2.138 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.621 -4.611 1.461 1.00 0.00 H new ATOM 1880 N GLY A 120 18.371 -5.020 -1.291 1.00 0.00 N ATOM 1881 CA GLY A 120 18.566 -5.864 -2.505 1.00 0.00 C ATOM 1882 C GLY A 120 17.935 -5.169 -3.713 1.00 0.00 C ATOM 1883 O GLY A 120 17.201 -4.211 -3.572 1.00 0.00 O ATOM 0 H GLY A 120 17.666 -5.358 -0.636 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.629 -6.028 -2.680 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.112 -6.844 -2.357 1.00 0.00 H new ATOM 1887 N SER A 121 18.219 -5.638 -4.900 1.00 0.00 N ATOM 1888 CA SER A 121 17.638 -4.994 -6.114 1.00 0.00 C ATOM 1889 C SER A 121 16.912 -6.040 -6.964 1.00 0.00 C ATOM 1890 O SER A 121 17.499 -7.001 -7.421 1.00 0.00 O ATOM 1891 CB SER A 121 18.761 -4.363 -6.934 1.00 0.00 C ATOM 1892 OG SER A 121 19.694 -5.369 -7.305 1.00 0.00 O ATOM 0 H SER A 121 18.827 -6.437 -5.081 1.00 0.00 H new ATOM 0 HA SER A 121 16.926 -4.227 -5.809 1.00 0.00 H new ATOM 0 HB2 SER A 121 18.352 -3.884 -7.824 1.00 0.00 H new ATOM 0 HB3 SER A 121 19.258 -3.586 -6.354 1.00 0.00 H new ATOM 0 HG SER A 121 19.213 -6.184 -7.559 1.00 0.00 H new ATOM 1898 N PHE A 122 15.635 -5.860 -7.166 1.00 0.00 N ATOM 1899 CA PHE A 122 14.853 -6.840 -7.975 1.00 0.00 C ATOM 1900 C PHE A 122 14.380 -6.181 -9.273 1.00 0.00 C ATOM 1901 O PHE A 122 14.361 -4.972 -9.396 1.00 0.00 O ATOM 1902 CB PHE A 122 13.649 -7.319 -7.162 1.00 0.00 C ATOM 1903 CG PHE A 122 14.124 -7.782 -5.806 1.00 0.00 C ATOM 1904 CD1 PHE A 122 14.362 -6.846 -4.794 1.00 0.00 C ATOM 1905 CD2 PHE A 122 14.336 -9.145 -5.563 1.00 0.00 C ATOM 1906 CE1 PHE A 122 14.810 -7.270 -3.538 1.00 0.00 C ATOM 1907 CE2 PHE A 122 14.786 -9.570 -4.307 1.00 0.00 C ATOM 1908 CZ PHE A 122 15.023 -8.632 -3.294 1.00 0.00 C ATOM 0 H PHE A 122 15.097 -5.073 -6.804 1.00 0.00 H new ATOM 0 HA PHE A 122 15.484 -7.694 -8.224 1.00 0.00 H new ATOM 0 HB2 PHE A 122 12.924 -6.512 -7.052 1.00 0.00 H new ATOM 0 HB3 PHE A 122 13.143 -8.133 -7.682 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.200 -5.795 -4.982 1.00 0.00 H new ATOM 0 HD2 PHE A 122 14.152 -9.868 -6.344 1.00 0.00 H new ATOM 0 HE1 PHE A 122 14.991 -6.547 -2.757 1.00 0.00 H new ATOM 0 HE2 PHE A 122 14.950 -10.621 -4.119 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.370 -8.959 -2.325 1.00 0.00 H new ATOM 1918 N GLU A 123 13.994 -6.972 -10.241 1.00 0.00 N ATOM 1919 CA GLU A 123 13.517 -6.400 -11.535 1.00 0.00 C ATOM 1920 C GLU A 123 12.049 -6.779 -11.756 1.00 0.00 C ATOM 1921 O GLU A 123 11.521 -7.657 -11.101 1.00 0.00 O ATOM 1922 CB GLU A 123 14.366 -6.949 -12.684 1.00 0.00 C ATOM 1923 CG GLU A 123 14.430 -8.475 -12.593 1.00 0.00 C ATOM 1924 CD GLU A 123 14.373 -9.074 -13.999 1.00 0.00 C ATOM 1925 OE1 GLU A 123 15.308 -8.859 -14.752 1.00 0.00 O ATOM 1926 OE2 GLU A 123 13.394 -9.738 -14.300 1.00 0.00 O ATOM 0 H GLU A 123 13.989 -7.991 -10.191 1.00 0.00 H new ATOM 0 HA GLU A 123 13.609 -5.314 -11.504 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.938 -6.650 -13.641 1.00 0.00 H new ATOM 0 HB3 GLU A 123 15.371 -6.530 -12.639 1.00 0.00 H new ATOM 0 HG2 GLU A 123 15.349 -8.782 -12.093 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.600 -8.849 -11.993 1.00 0.00 H new ATOM 1933 N GLY A 124 11.388 -6.125 -12.676 1.00 0.00 N ATOM 1934 CA GLY A 124 9.954 -6.442 -12.946 1.00 0.00 C ATOM 1935 C GLY A 124 9.436 -5.516 -14.049 1.00 0.00 C ATOM 1936 O GLY A 124 10.189 -5.065 -14.890 1.00 0.00 O ATOM 0 H GLY A 124 11.781 -5.382 -13.254 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.850 -7.484 -13.250 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.363 -6.314 -12.039 1.00 0.00 H new ATOM 1940 N ASP A 125 8.162 -5.216 -14.054 1.00 0.00 N ATOM 1941 CA ASP A 125 7.605 -4.304 -15.098 1.00 0.00 C ATOM 1942 C ASP A 125 6.618 -3.326 -14.436 1.00 0.00 C ATOM 1943 O ASP A 125 6.250 -2.318 -15.006 1.00 0.00 O ATOM 1944 CB ASP A 125 6.875 -5.128 -16.164 1.00 0.00 C ATOM 1945 CG ASP A 125 7.595 -4.983 -17.507 1.00 0.00 C ATOM 1946 OD1 ASP A 125 8.525 -5.736 -17.742 1.00 0.00 O ATOM 1947 OD2 ASP A 125 7.204 -4.121 -18.276 1.00 0.00 O ATOM 0 H ASP A 125 7.482 -5.564 -13.378 1.00 0.00 H new ATOM 0 HA ASP A 125 8.415 -3.747 -15.569 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.843 -6.177 -15.869 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.843 -4.791 -16.255 1.00 0.00 H new ATOM 1952 N THR A 126 6.199 -3.619 -13.229 1.00 0.00 N ATOM 1953 CA THR A 126 5.254 -2.717 -12.513 1.00 0.00 C ATOM 1954 C THR A 126 5.998 -2.067 -11.349 1.00 0.00 C ATOM 1955 O THR A 126 6.514 -2.743 -10.478 1.00 0.00 O ATOM 1956 CB THR A 126 4.067 -3.523 -11.979 1.00 0.00 C ATOM 1957 OG1 THR A 126 3.587 -4.388 -12.999 1.00 0.00 O ATOM 1958 CG2 THR A 126 2.952 -2.567 -11.550 1.00 0.00 C ATOM 0 H THR A 126 6.475 -4.451 -12.708 1.00 0.00 H new ATOM 0 HA THR A 126 4.880 -1.953 -13.195 1.00 0.00 H new ATOM 0 HB THR A 126 4.385 -4.115 -11.121 1.00 0.00 H new ATOM 0 HG1 THR A 126 2.828 -4.906 -12.658 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.107 -3.141 -11.170 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.322 -1.904 -10.768 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.632 -1.974 -12.407 1.00 0.00 H new ATOM 1966 N LYS A 127 6.057 -0.764 -11.327 1.00 0.00 N ATOM 1967 CA LYS A 127 6.775 -0.069 -10.224 1.00 0.00 C ATOM 1968 C LYS A 127 5.862 0.977 -9.592 1.00 0.00 C ATOM 1969 O LYS A 127 4.834 1.332 -10.136 1.00 0.00 O ATOM 1970 CB LYS A 127 8.025 0.614 -10.781 1.00 0.00 C ATOM 1971 CG LYS A 127 8.959 -0.441 -11.376 1.00 0.00 C ATOM 1972 CD LYS A 127 10.211 0.238 -11.933 1.00 0.00 C ATOM 1973 CE LYS A 127 11.329 -0.797 -12.085 1.00 0.00 C ATOM 1974 NZ LYS A 127 11.343 -1.315 -13.483 1.00 0.00 N ATOM 0 H LYS A 127 5.638 -0.151 -12.026 1.00 0.00 H new ATOM 0 HA LYS A 127 7.064 -0.798 -9.467 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.746 1.340 -11.544 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.536 1.163 -9.990 1.00 0.00 H new ATOM 0 HG2 LYS A 127 9.236 -1.168 -10.613 1.00 0.00 H new ATOM 0 HG3 LYS A 127 8.448 -0.989 -12.167 1.00 0.00 H new ATOM 0 HD2 LYS A 127 9.991 0.695 -12.898 1.00 0.00 H new ATOM 0 HD3 LYS A 127 10.531 1.039 -11.266 1.00 0.00 H new ATOM 0 HE2 LYS A 127 12.291 -0.346 -11.844 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.177 -1.617 -11.384 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 12.103 -2.018 -13.585 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 10.428 -1.760 -13.697 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 11.508 -0.528 -14.143 1.00 0.00 H new ATOM 1988 N MET A 128 6.235 1.475 -8.447 1.00 0.00 N ATOM 1989 CA MET A 128 5.397 2.498 -7.768 1.00 0.00 C ATOM 1990 C MET A 128 5.316 3.755 -8.632 1.00 0.00 C ATOM 1991 O MET A 128 6.171 4.011 -9.458 1.00 0.00 O ATOM 1992 CB MET A 128 6.017 2.845 -6.417 1.00 0.00 C ATOM 1993 CG MET A 128 4.903 3.148 -5.417 1.00 0.00 C ATOM 1994 SD MET A 128 4.698 4.937 -5.260 1.00 0.00 S ATOM 1995 CE MET A 128 3.238 4.883 -4.199 1.00 0.00 C ATOM 0 H MET A 128 7.088 1.216 -7.951 1.00 0.00 H new ATOM 0 HA MET A 128 4.393 2.101 -7.618 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.627 2.016 -6.060 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.677 3.707 -6.517 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.970 2.693 -5.748 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.143 2.713 -4.447 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.414 5.404 -4.687 1.00 0.00 H new ATOM 0 HE2 MET A 128 2.956 3.845 -4.021 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.461 5.367 -3.248 1.00 0.00 H new ATOM 2005 N ILE A 129 4.287 4.538 -8.453 1.00 0.00 N ATOM 2006 CA ILE A 129 4.131 5.778 -9.263 1.00 0.00 C ATOM 2007 C ILE A 129 5.108 6.850 -8.762 1.00 0.00 C ATOM 2008 O ILE A 129 5.727 6.685 -7.730 1.00 0.00 O ATOM 2009 CB ILE A 129 2.692 6.280 -9.124 1.00 0.00 C ATOM 2010 CG1 ILE A 129 2.353 6.464 -7.639 1.00 0.00 C ATOM 2011 CG2 ILE A 129 1.738 5.254 -9.743 1.00 0.00 C ATOM 2012 CD1 ILE A 129 1.800 7.873 -7.401 1.00 0.00 C ATOM 0 H ILE A 129 3.543 4.370 -7.776 1.00 0.00 H new ATOM 0 HA ILE A 129 4.348 5.567 -10.310 1.00 0.00 H new ATOM 0 HB ILE A 129 2.587 7.235 -9.639 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.620 5.719 -7.329 1.00 0.00 H new ATOM 0 HG13 ILE A 129 3.244 6.306 -7.031 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.711 5.607 -9.646 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.979 5.123 -10.798 1.00 0.00 H new ATOM 0 HG23 ILE A 129 1.844 4.300 -9.226 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.561 7.997 -6.345 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.547 8.611 -7.693 1.00 0.00 H new ATOM 0 HD13 ILE A 129 0.898 8.015 -7.996 1.00 0.00 H new ATOM 2024 N PRO A 130 5.224 7.916 -9.519 1.00 0.00 N ATOM 2025 CA PRO A 130 6.123 9.089 -9.242 1.00 0.00 C ATOM 2026 C PRO A 130 5.523 9.971 -8.142 1.00 0.00 C ATOM 2027 O PRO A 130 4.637 10.767 -8.386 1.00 0.00 O ATOM 2028 CB PRO A 130 6.233 9.877 -10.545 1.00 0.00 C ATOM 2029 CG PRO A 130 5.237 9.289 -11.524 1.00 0.00 C ATOM 2030 CD PRO A 130 4.485 8.177 -10.803 1.00 0.00 C ATOM 0 HA PRO A 130 7.103 8.756 -8.900 1.00 0.00 H new ATOM 0 HB2 PRO A 130 6.022 10.932 -10.373 1.00 0.00 H new ATOM 0 HB3 PRO A 130 7.245 9.815 -10.945 1.00 0.00 H new ATOM 0 HG2 PRO A 130 4.545 10.055 -11.873 1.00 0.00 H new ATOM 0 HG3 PRO A 130 5.749 8.898 -12.403 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.455 8.473 -10.603 1.00 0.00 H new ATOM 0 HD3 PRO A 130 4.445 7.277 -11.416 1.00 0.00 H new ATOM 2038 N LEU A 131 5.998 9.830 -6.932 1.00 0.00 N ATOM 2039 CA LEU A 131 5.457 10.657 -5.815 1.00 0.00 C ATOM 2040 C LEU A 131 6.276 11.945 -5.689 1.00 0.00 C ATOM 2041 O LEU A 131 7.401 12.021 -6.143 1.00 0.00 O ATOM 2042 CB LEU A 131 5.537 9.862 -4.511 1.00 0.00 C ATOM 2043 CG LEU A 131 4.261 9.040 -4.348 1.00 0.00 C ATOM 2044 CD1 LEU A 131 4.480 7.957 -3.290 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.120 9.963 -3.916 1.00 0.00 C ATOM 0 H LEU A 131 6.737 9.178 -6.670 1.00 0.00 H new ATOM 0 HA LEU A 131 4.417 10.912 -6.019 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.408 9.206 -4.523 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.659 10.538 -3.665 1.00 0.00 H new ATOM 0 HG LEU A 131 4.006 8.566 -5.296 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.568 7.371 -3.175 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.294 7.303 -3.602 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.734 8.424 -2.338 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.206 9.381 -3.798 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.374 10.436 -2.967 1.00 0.00 H new ATOM 0 HD23 LEU A 131 2.966 10.731 -4.674 1.00 0.00 H new ATOM 2057 N ASN A 132 5.712 12.964 -5.095 1.00 0.00 N ATOM 2058 CA ASN A 132 6.447 14.257 -4.959 1.00 0.00 C ATOM 2059 C ASN A 132 7.172 14.316 -3.606 1.00 0.00 C ATOM 2060 O ASN A 132 6.833 15.099 -2.741 1.00 0.00 O ATOM 2061 CB ASN A 132 5.444 15.411 -5.064 1.00 0.00 C ATOM 2062 CG ASN A 132 5.831 16.327 -6.227 1.00 0.00 C ATOM 2063 OD1 ASN A 132 5.231 16.273 -7.283 1.00 0.00 O ATOM 2064 ND2 ASN A 132 6.815 17.170 -6.078 1.00 0.00 N ATOM 0 H ASN A 132 4.773 12.957 -4.698 1.00 0.00 H new ATOM 0 HA ASN A 132 7.190 14.339 -5.753 1.00 0.00 H new ATOM 0 HB2 ASN A 132 4.439 15.019 -5.217 1.00 0.00 H new ATOM 0 HB3 ASN A 132 5.428 15.977 -4.133 1.00 0.00 H new ATOM 0 HD21 ASN A 132 7.081 17.784 -6.848 1.00 0.00 H new ATOM 0 HD22 ASN A 132 7.318 17.215 -5.192 1.00 0.00 H new ATOM 2071 N TRP A 133 8.168 13.491 -3.422 1.00 0.00 N ATOM 2072 CA TRP A 133 8.922 13.485 -2.129 1.00 0.00 C ATOM 2073 C TRP A 133 9.362 14.908 -1.761 1.00 0.00 C ATOM 2074 O TRP A 133 9.462 15.253 -0.600 1.00 0.00 O ATOM 2075 CB TRP A 133 10.162 12.599 -2.273 1.00 0.00 C ATOM 2076 CG TRP A 133 9.736 11.222 -2.655 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.774 10.716 -3.909 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.204 10.170 -1.804 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.292 9.422 -3.881 1.00 0.00 N ATOM 2080 CE2 TRP A 133 8.930 9.040 -2.605 1.00 0.00 C ATOM 2081 CE3 TRP A 133 8.934 10.088 -0.427 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.405 7.870 -2.062 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 8.406 8.910 0.124 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.142 7.804 -0.693 1.00 0.00 C ATOM 0 H TRP A 133 8.495 12.817 -4.114 1.00 0.00 H new ATOM 0 HA TRP A 133 8.273 13.099 -1.343 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.831 13.009 -3.029 1.00 0.00 H new ATOM 0 HB3 TRP A 133 10.717 12.574 -1.335 1.00 0.00 H new ATOM 0 HD1 TRP A 133 10.124 11.238 -4.787 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.213 8.822 -4.702 1.00 0.00 H new ATOM 0 HE3 TRP A 133 9.134 10.936 0.211 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.203 7.019 -2.696 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.202 8.856 1.183 1.00 0.00 H new ATOM 0 HH2 TRP A 133 7.735 6.900 -0.264 1.00 0.00 H new ATOM 2095 N ASP A 134 9.632 15.728 -2.739 1.00 0.00 N ATOM 2096 CA ASP A 134 10.073 17.123 -2.445 1.00 0.00 C ATOM 2097 C ASP A 134 8.947 17.905 -1.756 1.00 0.00 C ATOM 2098 O ASP A 134 9.197 18.835 -1.014 1.00 0.00 O ATOM 2099 CB ASP A 134 10.461 17.821 -3.752 1.00 0.00 C ATOM 2100 CG ASP A 134 11.914 18.295 -3.666 1.00 0.00 C ATOM 2101 OD1 ASP A 134 12.152 19.295 -3.008 1.00 0.00 O ATOM 2102 OD2 ASP A 134 12.763 17.650 -4.258 1.00 0.00 O ATOM 0 H ASP A 134 9.567 15.493 -3.730 1.00 0.00 H new ATOM 0 HA ASP A 134 10.934 17.089 -1.778 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.340 17.137 -4.592 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.801 18.669 -3.934 1.00 0.00 H new ATOM 2107 N ASP A 135 7.711 17.544 -1.993 1.00 0.00 N ATOM 2108 CA ASP A 135 6.580 18.281 -1.349 1.00 0.00 C ATOM 2109 C ASP A 135 6.251 17.654 0.011 1.00 0.00 C ATOM 2110 O ASP A 135 5.532 18.225 0.808 1.00 0.00 O ATOM 2111 CB ASP A 135 5.346 18.208 -2.253 1.00 0.00 C ATOM 2112 CG ASP A 135 5.180 19.529 -3.005 1.00 0.00 C ATOM 2113 OD1 ASP A 135 5.844 19.701 -4.014 1.00 0.00 O ATOM 2114 OD2 ASP A 135 4.391 20.346 -2.560 1.00 0.00 O ATOM 0 H ASP A 135 7.436 16.774 -2.602 1.00 0.00 H new ATOM 0 HA ASP A 135 6.870 19.322 -1.202 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.450 17.386 -2.961 1.00 0.00 H new ATOM 0 HB3 ASP A 135 4.457 18.004 -1.656 1.00 0.00 H new ATOM 2119 N PHE A 136 6.776 16.490 0.285 1.00 0.00 N ATOM 2120 CA PHE A 136 6.498 15.836 1.595 1.00 0.00 C ATOM 2121 C PHE A 136 7.791 15.756 2.404 1.00 0.00 C ATOM 2122 O PHE A 136 8.872 15.952 1.885 1.00 0.00 O ATOM 2123 CB PHE A 136 5.967 14.420 1.369 1.00 0.00 C ATOM 2124 CG PHE A 136 4.587 14.471 0.758 1.00 0.00 C ATOM 2125 CD1 PHE A 136 4.440 14.686 -0.615 1.00 0.00 C ATOM 2126 CD2 PHE A 136 3.457 14.284 1.561 1.00 0.00 C ATOM 2127 CE1 PHE A 136 3.164 14.713 -1.187 1.00 0.00 C ATOM 2128 CE2 PHE A 136 2.181 14.314 0.989 1.00 0.00 C ATOM 2129 CZ PHE A 136 2.035 14.527 -0.385 1.00 0.00 C ATOM 0 H PHE A 136 7.385 15.964 -0.342 1.00 0.00 H new ATOM 0 HA PHE A 136 5.754 16.422 2.135 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.643 13.871 0.713 1.00 0.00 H new ATOM 0 HB3 PHE A 136 5.934 13.881 2.316 1.00 0.00 H new ATOM 0 HD1 PHE A 136 5.312 14.831 -1.235 1.00 0.00 H new ATOM 0 HD2 PHE A 136 3.570 14.117 2.622 1.00 0.00 H new ATOM 0 HE1 PHE A 136 3.051 14.878 -2.248 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.308 14.173 1.609 1.00 0.00 H new ATOM 0 HZ PHE A 136 1.050 14.548 -0.827 1.00 0.00 H new ATOM 2139 N THR A 137 7.689 15.450 3.668 1.00 0.00 N ATOM 2140 CA THR A 137 8.913 15.335 4.508 1.00 0.00 C ATOM 2141 C THR A 137 8.800 14.092 5.389 1.00 0.00 C ATOM 2142 O THR A 137 7.784 13.855 6.014 1.00 0.00 O ATOM 2143 CB THR A 137 9.059 16.578 5.388 1.00 0.00 C ATOM 2144 OG1 THR A 137 8.750 17.735 4.625 1.00 0.00 O ATOM 2145 CG2 THR A 137 10.497 16.670 5.902 1.00 0.00 C ATOM 0 H THR A 137 6.810 15.275 4.155 1.00 0.00 H new ATOM 0 HA THR A 137 9.789 15.252 3.865 1.00 0.00 H new ATOM 0 HB THR A 137 8.376 16.510 6.234 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.842 18.532 5.188 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.603 17.555 6.529 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.732 15.781 6.487 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.182 16.740 5.057 1.00 0.00 H new ATOM 2153 N LYS A 138 9.828 13.288 5.435 1.00 0.00 N ATOM 2154 CA LYS A 138 9.768 12.054 6.266 1.00 0.00 C ATOM 2155 C LYS A 138 9.788 12.439 7.746 1.00 0.00 C ATOM 2156 O LYS A 138 10.711 13.069 8.224 1.00 0.00 O ATOM 2157 CB LYS A 138 10.971 11.166 5.945 1.00 0.00 C ATOM 2158 CG LYS A 138 10.626 9.711 6.263 1.00 0.00 C ATOM 2159 CD LYS A 138 11.862 9.000 6.809 1.00 0.00 C ATOM 2160 CE LYS A 138 12.819 8.674 5.661 1.00 0.00 C ATOM 2161 NZ LYS A 138 14.190 9.140 6.011 1.00 0.00 N ATOM 0 H LYS A 138 10.704 13.433 4.934 1.00 0.00 H new ATOM 0 HA LYS A 138 8.850 11.508 6.048 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.241 11.266 4.894 1.00 0.00 H new ATOM 0 HB3 LYS A 138 11.836 11.482 6.528 1.00 0.00 H new ATOM 0 HG2 LYS A 138 9.818 9.669 6.993 1.00 0.00 H new ATOM 0 HG3 LYS A 138 10.270 9.206 5.365 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.362 9.631 7.544 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.569 8.084 7.322 1.00 0.00 H new ATOM 0 HE2 LYS A 138 12.825 7.601 5.472 1.00 0.00 H new ATOM 0 HE3 LYS A 138 12.482 9.157 4.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 14.841 8.919 5.231 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 14.177 10.168 6.171 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 14.510 8.659 6.876 1.00 0.00 H new ATOM 2175 N VAL A 139 8.764 12.071 8.470 1.00 0.00 N ATOM 2176 CA VAL A 139 8.702 12.419 9.919 1.00 0.00 C ATOM 2177 C VAL A 139 9.242 11.259 10.759 1.00 0.00 C ATOM 2178 O VAL A 139 9.682 11.448 11.877 1.00 0.00 O ATOM 2179 CB VAL A 139 7.250 12.700 10.314 1.00 0.00 C ATOM 2180 CG1 VAL A 139 6.753 13.947 9.579 1.00 0.00 C ATOM 2181 CG2 VAL A 139 6.372 11.500 9.937 1.00 0.00 C ATOM 0 H VAL A 139 7.966 11.543 8.118 1.00 0.00 H new ATOM 0 HA VAL A 139 9.310 13.305 10.100 1.00 0.00 H new ATOM 0 HB VAL A 139 7.194 12.865 11.390 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.719 14.147 9.860 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.374 14.801 9.850 1.00 0.00 H new ATOM 0 HG13 VAL A 139 6.811 13.782 8.503 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.339 11.702 10.219 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.428 11.332 8.862 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.724 10.612 10.462 1.00 0.00 H new ATOM 2191 N SER A 140 9.204 10.060 10.241 1.00 0.00 N ATOM 2192 CA SER A 140 9.709 8.897 11.026 1.00 0.00 C ATOM 2193 C SER A 140 10.368 7.884 10.089 1.00 0.00 C ATOM 2194 O SER A 140 9.875 7.602 9.014 1.00 0.00 O ATOM 2195 CB SER A 140 8.540 8.231 11.754 1.00 0.00 C ATOM 2196 OG SER A 140 7.943 9.168 12.639 1.00 0.00 O ATOM 0 H SER A 140 8.847 9.837 9.312 1.00 0.00 H new ATOM 0 HA SER A 140 10.444 9.245 11.752 1.00 0.00 H new ATOM 0 HB2 SER A 140 7.804 7.874 11.034 1.00 0.00 H new ATOM 0 HB3 SER A 140 8.891 7.361 12.309 1.00 0.00 H new ATOM 0 HG SER A 140 7.192 8.745 13.106 1.00 0.00 H new ATOM 2202 N SER A 141 11.479 7.330 10.497 1.00 0.00 N ATOM 2203 CA SER A 141 12.178 6.329 9.643 1.00 0.00 C ATOM 2204 C SER A 141 12.867 5.296 10.535 1.00 0.00 C ATOM 2205 O SER A 141 13.553 5.639 11.478 1.00 0.00 O ATOM 2206 CB SER A 141 13.231 7.028 8.777 1.00 0.00 C ATOM 2207 OG SER A 141 13.264 8.413 9.095 1.00 0.00 O ATOM 0 H SER A 141 11.933 7.529 11.388 1.00 0.00 H new ATOM 0 HA SER A 141 11.450 5.836 8.999 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.211 6.582 8.947 1.00 0.00 H new ATOM 0 HB3 SER A 141 12.997 6.892 7.721 1.00 0.00 H new ATOM 0 HG SER A 141 14.169 8.761 8.950 1.00 0.00 H new ATOM 2213 N ARG A 142 12.696 4.036 10.243 1.00 0.00 N ATOM 2214 CA ARG A 142 13.346 2.982 11.068 1.00 0.00 C ATOM 2215 C ARG A 142 14.070 2.012 10.133 1.00 0.00 C ATOM 2216 O ARG A 142 13.499 1.529 9.175 1.00 0.00 O ATOM 2217 CB ARG A 142 12.278 2.224 11.859 1.00 0.00 C ATOM 2218 CG ARG A 142 12.857 1.764 13.197 1.00 0.00 C ATOM 2219 CD ARG A 142 11.726 1.246 14.086 1.00 0.00 C ATOM 2220 NE ARG A 142 12.280 0.293 15.093 1.00 0.00 N ATOM 2221 CZ ARG A 142 11.526 -0.644 15.618 1.00 0.00 C ATOM 2222 NH1 ARG A 142 10.266 -0.763 15.281 1.00 0.00 N ATOM 2223 NH2 ARG A 142 12.038 -1.467 16.492 1.00 0.00 N ATOM 0 H ARG A 142 12.132 3.691 9.466 1.00 0.00 H new ATOM 0 HA ARG A 142 14.054 3.433 11.763 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.413 2.865 12.027 1.00 0.00 H new ATOM 0 HB3 ARG A 142 11.930 1.364 11.287 1.00 0.00 H new ATOM 0 HG2 ARG A 142 13.597 0.980 13.036 1.00 0.00 H new ATOM 0 HG3 ARG A 142 13.371 2.591 13.687 1.00 0.00 H new ATOM 0 HD2 ARG A 142 11.235 2.079 14.590 1.00 0.00 H new ATOM 0 HD3 ARG A 142 10.969 0.750 13.478 1.00 0.00 H new ATOM 0 HE ARG A 142 13.257 0.371 15.376 1.00 0.00 H new ATOM 0 HH11 ARG A 142 9.857 -0.122 14.601 1.00 0.00 H new ATOM 0 HH12 ARG A 142 9.694 -1.497 15.698 1.00 0.00 H new ATOM 0 HH21 ARG A 142 13.018 -1.379 16.762 1.00 0.00 H new ATOM 0 HH22 ARG A 142 11.459 -2.198 16.905 1.00 0.00 H new ATOM 2237 N THR A 143 15.315 1.721 10.398 1.00 0.00 N ATOM 2238 CA THR A 143 16.061 0.776 9.517 1.00 0.00 C ATOM 2239 C THR A 143 16.281 -0.534 10.267 1.00 0.00 C ATOM 2240 O THR A 143 16.701 -0.541 11.408 1.00 0.00 O ATOM 2241 CB THR A 143 17.414 1.387 9.139 1.00 0.00 C ATOM 2242 OG1 THR A 143 17.239 2.762 8.826 1.00 0.00 O ATOM 2243 CG2 THR A 143 17.992 0.655 7.924 1.00 0.00 C ATOM 0 H THR A 143 15.847 2.095 11.184 1.00 0.00 H new ATOM 0 HA THR A 143 15.488 0.587 8.609 1.00 0.00 H new ATOM 0 HB THR A 143 18.102 1.288 9.978 1.00 0.00 H new ATOM 0 HG1 THR A 143 18.104 3.155 8.586 1.00 0.00 H new ATOM 0 HG21 THR A 143 18.954 1.093 7.659 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.127 -0.399 8.165 1.00 0.00 H new ATOM 0 HG23 THR A 143 17.306 0.750 7.082 1.00 0.00 H new ATOM 2251 N VAL A 144 16.003 -1.644 9.641 1.00 0.00 N ATOM 2252 CA VAL A 144 16.196 -2.949 10.328 1.00 0.00 C ATOM 2253 C VAL A 144 17.045 -3.875 9.451 1.00 0.00 C ATOM 2254 O VAL A 144 16.788 -4.051 8.273 1.00 0.00 O ATOM 2255 CB VAL A 144 14.825 -3.585 10.600 1.00 0.00 C ATOM 2256 CG1 VAL A 144 14.048 -3.728 9.287 1.00 0.00 C ATOM 2257 CG2 VAL A 144 15.008 -4.966 11.244 1.00 0.00 C ATOM 0 H VAL A 144 15.651 -1.703 8.685 1.00 0.00 H new ATOM 0 HA VAL A 144 16.713 -2.793 11.275 1.00 0.00 H new ATOM 0 HB VAL A 144 14.265 -2.943 11.281 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.076 -4.180 9.487 1.00 0.00 H new ATOM 0 HG12 VAL A 144 13.906 -2.744 8.839 1.00 0.00 H new ATOM 0 HG13 VAL A 144 14.608 -4.362 8.600 1.00 0.00 H new ATOM 0 HG21 VAL A 144 14.031 -5.411 11.434 1.00 0.00 H new ATOM 0 HG22 VAL A 144 15.575 -5.609 10.571 1.00 0.00 H new ATOM 0 HG23 VAL A 144 15.548 -4.860 12.185 1.00 0.00 H new ATOM 2267 N GLU A 145 18.060 -4.468 10.024 1.00 0.00 N ATOM 2268 CA GLU A 145 18.936 -5.382 9.240 1.00 0.00 C ATOM 2269 C GLU A 145 18.352 -6.795 9.284 1.00 0.00 C ATOM 2270 O GLU A 145 17.553 -7.118 10.142 1.00 0.00 O ATOM 2271 CB GLU A 145 20.347 -5.385 9.840 1.00 0.00 C ATOM 2272 CG GLU A 145 20.285 -5.784 11.318 1.00 0.00 C ATOM 2273 CD GLU A 145 21.178 -4.850 12.139 1.00 0.00 C ATOM 2274 OE1 GLU A 145 20.869 -3.671 12.202 1.00 0.00 O ATOM 2275 OE2 GLU A 145 22.156 -5.329 12.689 1.00 0.00 O ATOM 0 H GLU A 145 18.319 -4.357 11.004 1.00 0.00 H new ATOM 0 HA GLU A 145 18.990 -5.041 8.206 1.00 0.00 H new ATOM 0 HB2 GLU A 145 20.983 -6.081 9.293 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.796 -4.397 9.740 1.00 0.00 H new ATOM 0 HG2 GLU A 145 19.257 -5.730 11.677 1.00 0.00 H new ATOM 0 HG3 GLU A 145 20.611 -6.817 11.441 1.00 0.00 H new ATOM 2282 N ASP A 146 18.736 -7.635 8.362 1.00 0.00 N ATOM 2283 CA ASP A 146 18.193 -9.022 8.348 1.00 0.00 C ATOM 2284 C ASP A 146 19.298 -10.015 7.977 1.00 0.00 C ATOM 2285 O ASP A 146 20.287 -9.661 7.366 1.00 0.00 O ATOM 2286 CB ASP A 146 17.060 -9.108 7.321 1.00 0.00 C ATOM 2287 CG ASP A 146 15.861 -9.834 7.935 1.00 0.00 C ATOM 2288 OD1 ASP A 146 15.906 -11.051 8.010 1.00 0.00 O ATOM 2289 OD2 ASP A 146 14.920 -9.161 8.320 1.00 0.00 O ATOM 0 H ASP A 146 19.401 -7.421 7.619 1.00 0.00 H new ATOM 0 HA ASP A 146 17.813 -9.270 9.339 1.00 0.00 H new ATOM 0 HB2 ASP A 146 16.768 -8.107 7.003 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.402 -9.638 6.432 1.00 0.00 H new ATOM 2294 N THR A 147 19.127 -11.261 8.337 1.00 0.00 N ATOM 2295 CA THR A 147 20.152 -12.297 8.009 1.00 0.00 C ATOM 2296 C THR A 147 20.350 -12.381 6.487 1.00 0.00 C ATOM 2297 O THR A 147 21.309 -12.956 6.010 1.00 0.00 O ATOM 2298 CB THR A 147 19.676 -13.654 8.533 1.00 0.00 C ATOM 2299 OG1 THR A 147 18.284 -13.792 8.283 1.00 0.00 O ATOM 2300 CG2 THR A 147 19.934 -13.741 10.038 1.00 0.00 C ATOM 0 H THR A 147 18.315 -11.608 8.848 1.00 0.00 H new ATOM 0 HA THR A 147 21.099 -12.027 8.476 1.00 0.00 H new ATOM 0 HB THR A 147 20.220 -14.451 8.026 1.00 0.00 H new ATOM 0 HG1 THR A 147 17.976 -14.661 8.616 1.00 0.00 H new ATOM 0 HG21 THR A 147 19.595 -14.708 10.410 1.00 0.00 H new ATOM 0 HG22 THR A 147 21.001 -13.632 10.231 1.00 0.00 H new ATOM 0 HG23 THR A 147 19.390 -12.945 10.547 1.00 0.00 H new ATOM 2308 N ASN A 148 19.457 -11.803 5.727 1.00 0.00 N ATOM 2309 CA ASN A 148 19.604 -11.843 4.243 1.00 0.00 C ATOM 2310 C ASN A 148 19.922 -10.435 3.725 1.00 0.00 C ATOM 2311 O ASN A 148 19.172 -9.508 3.960 1.00 0.00 O ATOM 2312 CB ASN A 148 18.308 -12.342 3.607 1.00 0.00 C ATOM 2313 CG ASN A 148 18.637 -13.146 2.348 1.00 0.00 C ATOM 2314 OD1 ASN A 148 19.089 -14.271 2.431 1.00 0.00 O ATOM 2315 ND2 ASN A 148 18.430 -12.612 1.175 1.00 0.00 N ATOM 0 H ASN A 148 18.634 -11.306 6.069 1.00 0.00 H new ATOM 0 HA ASN A 148 20.415 -12.521 3.979 1.00 0.00 H new ATOM 0 HB2 ASN A 148 17.758 -12.962 4.315 1.00 0.00 H new ATOM 0 HB3 ASN A 148 17.665 -11.499 3.356 1.00 0.00 H new ATOM 0 HD21 ASN A 148 18.648 -13.139 0.329 1.00 0.00 H new ATOM 0 HD22 ASN A 148 18.051 -11.668 1.104 1.00 0.00 H new ATOM 2322 N PRO A 149 21.034 -10.312 3.038 1.00 0.00 N ATOM 2323 CA PRO A 149 21.551 -9.032 2.440 1.00 0.00 C ATOM 2324 C PRO A 149 20.432 -8.295 1.698 1.00 0.00 C ATOM 2325 O PRO A 149 20.267 -7.099 1.837 1.00 0.00 O ATOM 2326 CB PRO A 149 22.659 -9.414 1.460 1.00 0.00 C ATOM 2327 CG PRO A 149 22.921 -10.896 1.614 1.00 0.00 C ATOM 2328 CD PRO A 149 22.004 -11.417 2.714 1.00 0.00 C ATOM 0 HA PRO A 149 21.925 -8.369 3.220 1.00 0.00 H new ATOM 0 HB2 PRO A 149 22.361 -9.183 0.437 1.00 0.00 H new ATOM 0 HB3 PRO A 149 23.564 -8.843 1.665 1.00 0.00 H new ATOM 0 HG2 PRO A 149 22.728 -11.418 0.677 1.00 0.00 H new ATOM 0 HG3 PRO A 149 23.965 -11.075 1.870 1.00 0.00 H new ATOM 0 HD2 PRO A 149 21.474 -12.311 2.384 1.00 0.00 H new ATOM 0 HD3 PRO A 149 22.580 -11.696 3.596 1.00 0.00 H new ATOM 2336 N ALA A 150 19.680 -8.994 0.890 1.00 0.00 N ATOM 2337 CA ALA A 150 18.592 -8.328 0.117 1.00 0.00 C ATOM 2338 C ALA A 150 17.352 -8.128 0.993 1.00 0.00 C ATOM 2339 O ALA A 150 16.640 -7.152 0.848 1.00 0.00 O ATOM 2340 CB ALA A 150 18.225 -9.191 -1.092 1.00 0.00 C ATOM 0 H ALA A 150 19.772 -9.997 0.732 1.00 0.00 H new ATOM 0 HA ALA A 150 18.947 -7.353 -0.216 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.430 -8.705 -1.658 1.00 0.00 H new ATOM 0 HB2 ALA A 150 19.100 -9.315 -1.730 1.00 0.00 H new ATOM 0 HB3 ALA A 150 17.883 -10.168 -0.751 1.00 0.00 H new ATOM 2346 N LEU A 151 17.073 -9.040 1.891 1.00 0.00 N ATOM 2347 CA LEU A 151 15.861 -8.885 2.753 1.00 0.00 C ATOM 2348 C LEU A 151 16.045 -7.725 3.742 1.00 0.00 C ATOM 2349 O LEU A 151 15.144 -7.399 4.492 1.00 0.00 O ATOM 2350 CB LEU A 151 15.603 -10.184 3.523 1.00 0.00 C ATOM 2351 CG LEU A 151 15.403 -11.345 2.540 1.00 0.00 C ATOM 2352 CD1 LEU A 151 15.170 -12.635 3.324 1.00 0.00 C ATOM 2353 CD2 LEU A 151 14.185 -11.082 1.647 1.00 0.00 C ATOM 0 H LEU A 151 17.627 -9.879 2.064 1.00 0.00 H new ATOM 0 HA LEU A 151 15.006 -8.665 2.113 1.00 0.00 H new ATOM 0 HB2 LEU A 151 16.443 -10.397 4.185 1.00 0.00 H new ATOM 0 HB3 LEU A 151 14.720 -10.074 4.153 1.00 0.00 H new ATOM 0 HG LEU A 151 16.293 -11.436 1.917 1.00 0.00 H new ATOM 0 HD11 LEU A 151 15.027 -13.462 2.629 1.00 0.00 H new ATOM 0 HD12 LEU A 151 16.034 -12.837 3.957 1.00 0.00 H new ATOM 0 HD13 LEU A 151 14.282 -12.527 3.947 1.00 0.00 H new ATOM 0 HD21 LEU A 151 14.055 -11.914 0.955 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.294 -10.983 2.267 1.00 0.00 H new ATOM 0 HD23 LEU A 151 14.339 -10.162 1.084 1.00 0.00 H new ATOM 2365 N THR A 152 17.184 -7.079 3.739 1.00 0.00 N ATOM 2366 CA THR A 152 17.382 -5.925 4.662 1.00 0.00 C ATOM 2367 C THR A 152 16.572 -4.752 4.113 1.00 0.00 C ATOM 2368 O THR A 152 16.351 -4.662 2.920 1.00 0.00 O ATOM 2369 CB THR A 152 18.868 -5.553 4.706 1.00 0.00 C ATOM 2370 OG1 THR A 152 19.634 -6.711 5.007 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.106 -4.488 5.779 1.00 0.00 C ATOM 0 H THR A 152 17.980 -7.301 3.140 1.00 0.00 H new ATOM 0 HA THR A 152 17.056 -6.176 5.671 1.00 0.00 H new ATOM 0 HB THR A 152 19.169 -5.156 3.737 1.00 0.00 H new ATOM 0 HG1 THR A 152 19.991 -7.092 4.178 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.164 -4.228 5.805 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.520 -3.599 5.546 1.00 0.00 H new ATOM 0 HG23 THR A 152 18.804 -4.877 6.751 1.00 0.00 H new ATOM 2379 N HIS A 153 16.118 -3.851 4.946 1.00 0.00 N ATOM 2380 CA HIS A 153 15.321 -2.714 4.399 1.00 0.00 C ATOM 2381 C HIS A 153 15.051 -1.655 5.468 1.00 0.00 C ATOM 2382 O HIS A 153 15.374 -1.819 6.628 1.00 0.00 O ATOM 2383 CB HIS A 153 13.989 -3.246 3.867 1.00 0.00 C ATOM 2384 CG HIS A 153 13.293 -4.043 4.936 1.00 0.00 C ATOM 2385 ND1 HIS A 153 13.727 -5.303 5.320 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.187 -3.778 5.705 1.00 0.00 C ATOM 2387 CE1 HIS A 153 12.894 -5.745 6.281 1.00 0.00 C ATOM 2388 NE2 HIS A 153 11.937 -4.853 6.553 1.00 0.00 N ATOM 0 H HIS A 153 16.260 -3.851 5.956 1.00 0.00 H new ATOM 0 HA HIS A 153 15.894 -2.248 3.597 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.357 -2.417 3.550 1.00 0.00 H new ATOM 0 HB3 HIS A 153 14.161 -3.870 2.990 1.00 0.00 H new ATOM 0 HD1 HIS A 153 14.531 -5.804 4.943 1.00 0.00 H new ATOM 0 HD2 HIS A 153 11.600 -2.873 5.659 1.00 0.00 H new ATOM 0 HE1 HIS A 153 12.988 -6.703 6.772 1.00 0.00 H new ATOM 2396 N THR A 154 14.451 -0.566 5.065 1.00 0.00 N ATOM 2397 CA THR A 154 14.137 0.533 6.019 1.00 0.00 C ATOM 2398 C THR A 154 12.686 0.980 5.810 1.00 0.00 C ATOM 2399 O THR A 154 12.125 0.813 4.745 1.00 0.00 O ATOM 2400 CB THR A 154 15.076 1.712 5.745 1.00 0.00 C ATOM 2401 OG1 THR A 154 16.416 1.244 5.692 1.00 0.00 O ATOM 2402 CG2 THR A 154 14.940 2.752 6.855 1.00 0.00 C ATOM 0 H THR A 154 14.162 -0.391 4.102 1.00 0.00 H new ATOM 0 HA THR A 154 14.269 0.187 7.044 1.00 0.00 H new ATOM 0 HB THR A 154 14.811 2.171 4.792 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.019 1.996 5.515 1.00 0.00 H new ATOM 0 HG21 THR A 154 15.610 3.588 6.655 1.00 0.00 H new ATOM 0 HG22 THR A 154 13.912 3.112 6.892 1.00 0.00 H new ATOM 0 HG23 THR A 154 15.201 2.299 7.812 1.00 0.00 H new ATOM 2410 N TYR A 155 12.075 1.551 6.815 1.00 0.00 N ATOM 2411 CA TYR A 155 10.666 2.017 6.669 1.00 0.00 C ATOM 2412 C TYR A 155 10.657 3.547 6.661 1.00 0.00 C ATOM 2413 O TYR A 155 11.193 4.177 7.550 1.00 0.00 O ATOM 2414 CB TYR A 155 9.827 1.517 7.848 1.00 0.00 C ATOM 2415 CG TYR A 155 9.908 0.012 7.937 1.00 0.00 C ATOM 2416 CD1 TYR A 155 9.141 -0.784 7.078 1.00 0.00 C ATOM 2417 CD2 TYR A 155 10.741 -0.588 8.889 1.00 0.00 C ATOM 2418 CE1 TYR A 155 9.208 -2.180 7.171 1.00 0.00 C ATOM 2419 CE2 TYR A 155 10.809 -1.983 8.981 1.00 0.00 C ATOM 2420 CZ TYR A 155 10.042 -2.779 8.122 1.00 0.00 C ATOM 2421 OH TYR A 155 10.106 -4.155 8.215 1.00 0.00 O ATOM 0 H TYR A 155 12.492 1.715 7.731 1.00 0.00 H new ATOM 0 HA TYR A 155 10.246 1.629 5.741 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.185 1.964 8.775 1.00 0.00 H new ATOM 0 HB3 TYR A 155 8.789 1.827 7.724 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.498 -0.322 6.344 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.332 0.026 9.553 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.616 -2.794 6.509 1.00 0.00 H new ATOM 0 HE2 TYR A 155 11.453 -2.445 9.714 1.00 0.00 H new ATOM 0 HH TYR A 155 10.916 -4.476 7.767 1.00 0.00 H new ATOM 2431 N GLU A 156 10.073 4.153 5.661 1.00 0.00 N ATOM 2432 CA GLU A 156 10.060 5.643 5.606 1.00 0.00 C ATOM 2433 C GLU A 156 8.620 6.164 5.699 1.00 0.00 C ATOM 2434 O GLU A 156 7.776 5.829 4.892 1.00 0.00 O ATOM 2435 CB GLU A 156 10.686 6.099 4.287 1.00 0.00 C ATOM 2436 CG GLU A 156 12.156 5.674 4.240 1.00 0.00 C ATOM 2437 CD GLU A 156 12.282 4.314 3.552 1.00 0.00 C ATOM 2438 OE1 GLU A 156 12.069 4.257 2.352 1.00 0.00 O ATOM 2439 OE2 GLU A 156 12.596 3.353 4.235 1.00 0.00 O ATOM 0 H GLU A 156 9.607 3.683 4.885 1.00 0.00 H new ATOM 0 HA GLU A 156 10.631 6.040 6.445 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.145 5.664 3.447 1.00 0.00 H new ATOM 0 HB3 GLU A 156 10.607 7.182 4.191 1.00 0.00 H new ATOM 0 HG2 GLU A 156 12.742 6.419 3.702 1.00 0.00 H new ATOM 0 HG3 GLU A 156 12.560 5.619 5.251 1.00 0.00 H new ATOM 2446 N VAL A 157 8.339 6.986 6.679 1.00 0.00 N ATOM 2447 CA VAL A 157 6.959 7.542 6.836 1.00 0.00 C ATOM 2448 C VAL A 157 6.995 9.053 6.578 1.00 0.00 C ATOM 2449 O VAL A 157 7.763 9.770 7.187 1.00 0.00 O ATOM 2450 CB VAL A 157 6.472 7.282 8.265 1.00 0.00 C ATOM 2451 CG1 VAL A 157 5.001 7.686 8.394 1.00 0.00 C ATOM 2452 CG2 VAL A 157 6.626 5.795 8.593 1.00 0.00 C ATOM 0 H VAL A 157 9.010 7.298 7.381 1.00 0.00 H new ATOM 0 HA VAL A 157 6.283 7.064 6.126 1.00 0.00 H new ATOM 0 HB VAL A 157 7.067 7.873 8.961 1.00 0.00 H new ATOM 0 HG11 VAL A 157 4.660 7.499 9.412 1.00 0.00 H new ATOM 0 HG12 VAL A 157 4.893 8.746 8.164 1.00 0.00 H new ATOM 0 HG13 VAL A 157 4.401 7.101 7.697 1.00 0.00 H new ATOM 0 HG21 VAL A 157 6.280 5.609 9.610 1.00 0.00 H new ATOM 0 HG22 VAL A 157 6.033 5.205 7.894 1.00 0.00 H new ATOM 0 HG23 VAL A 157 7.675 5.511 8.509 1.00 0.00 H new ATOM 2462 N TRP A 158 6.180 9.548 5.681 1.00 0.00 N ATOM 2463 CA TRP A 158 6.199 11.016 5.395 1.00 0.00 C ATOM 2464 C TRP A 158 4.865 11.667 5.768 1.00 0.00 C ATOM 2465 O TRP A 158 3.859 11.011 5.946 1.00 0.00 O ATOM 2466 CB TRP A 158 6.457 11.244 3.904 1.00 0.00 C ATOM 2467 CG TRP A 158 7.780 10.662 3.525 1.00 0.00 C ATOM 2468 CD1 TRP A 158 8.102 9.351 3.593 1.00 0.00 C ATOM 2469 CD2 TRP A 158 8.963 11.347 3.021 1.00 0.00 C ATOM 2470 NE1 TRP A 158 9.406 9.188 3.161 1.00 0.00 N ATOM 2471 CE2 TRP A 158 9.979 10.390 2.801 1.00 0.00 C ATOM 2472 CE3 TRP A 158 9.247 12.693 2.737 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 11.236 10.756 2.317 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 10.510 13.066 2.250 1.00 0.00 C ATOM 2475 CH2 TRP A 158 11.503 12.099 2.041 1.00 0.00 C ATOM 0 H TRP A 158 5.508 9.006 5.138 1.00 0.00 H new ATOM 0 HA TRP A 158 6.992 11.467 5.992 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.664 10.784 3.314 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.442 12.311 3.682 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.448 8.560 3.930 1.00 0.00 H new ATOM 0 HE1 TRP A 158 9.885 8.289 3.114 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.489 13.446 2.894 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 11.997 10.006 2.157 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 10.718 14.104 2.035 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.473 12.392 1.667 1.00 0.00 H new ATOM 2486 N GLN A 159 4.860 12.971 5.854 1.00 0.00 N ATOM 2487 CA GLN A 159 3.612 13.718 6.179 1.00 0.00 C ATOM 2488 C GLN A 159 3.554 14.947 5.267 1.00 0.00 C ATOM 2489 O GLN A 159 4.576 15.519 4.938 1.00 0.00 O ATOM 2490 CB GLN A 159 3.644 14.162 7.644 1.00 0.00 C ATOM 2491 CG GLN A 159 3.289 12.978 8.548 1.00 0.00 C ATOM 2492 CD GLN A 159 1.817 13.067 8.956 1.00 0.00 C ATOM 2493 OE1 GLN A 159 0.958 13.296 8.127 1.00 0.00 O ATOM 2494 NE2 GLN A 159 1.488 12.895 10.207 1.00 0.00 N ATOM 0 H GLN A 159 5.682 13.558 5.710 1.00 0.00 H new ATOM 0 HA GLN A 159 2.736 13.087 6.026 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.634 14.542 7.898 1.00 0.00 H new ATOM 0 HB3 GLN A 159 2.939 14.978 7.803 1.00 0.00 H new ATOM 0 HG2 GLN A 159 3.476 12.040 8.026 1.00 0.00 H new ATOM 0 HG3 GLN A 159 3.923 12.981 9.434 1.00 0.00 H new ATOM 0 HE21 GLN A 159 2.209 12.703 10.902 1.00 0.00 H new ATOM 0 HE22 GLN A 159 0.510 12.953 10.490 1.00 0.00 H new ATOM 2503 N LYS A 160 2.388 15.355 4.833 1.00 0.00 N ATOM 2504 CA LYS A 160 2.307 16.536 3.923 1.00 0.00 C ATOM 2505 C LYS A 160 2.368 17.838 4.724 1.00 0.00 C ATOM 2506 O LYS A 160 1.663 18.015 5.698 1.00 0.00 O ATOM 2507 CB LYS A 160 0.984 16.486 3.160 1.00 0.00 C ATOM 2508 CG LYS A 160 1.074 17.371 1.916 1.00 0.00 C ATOM 2509 CD LYS A 160 -0.318 17.526 1.301 1.00 0.00 C ATOM 2510 CE LYS A 160 -0.187 17.957 -0.161 1.00 0.00 C ATOM 2511 NZ LYS A 160 -1.286 18.906 -0.498 1.00 0.00 N ATOM 0 H LYS A 160 1.494 14.924 5.068 1.00 0.00 H new ATOM 0 HA LYS A 160 3.149 16.506 3.232 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.757 15.459 2.872 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.170 16.825 3.801 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.478 18.348 2.180 1.00 0.00 H new ATOM 0 HG3 LYS A 160 1.757 16.929 1.191 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.862 16.584 1.366 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.893 18.265 1.859 1.00 0.00 H new ATOM 0 HE2 LYS A 160 0.781 18.430 -0.327 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -0.231 17.085 -0.814 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -1.198 19.200 -1.492 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -2.204 18.439 -0.355 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -1.223 19.742 0.117 1.00 0.00 H new ATOM 2525 N LYS A 161 3.202 18.755 4.309 1.00 0.00 N ATOM 2526 CA LYS A 161 3.309 20.056 5.030 1.00 0.00 C ATOM 2527 C LYS A 161 2.182 20.983 4.565 1.00 0.00 C ATOM 2528 O LYS A 161 1.598 20.788 3.517 1.00 0.00 O ATOM 2529 CB LYS A 161 4.659 20.706 4.717 1.00 0.00 C ATOM 2530 CG LYS A 161 5.789 19.709 4.987 1.00 0.00 C ATOM 2531 CD LYS A 161 6.097 19.674 6.486 1.00 0.00 C ATOM 2532 CE LYS A 161 5.514 18.398 7.099 1.00 0.00 C ATOM 2533 NZ LYS A 161 5.213 18.632 8.540 1.00 0.00 N ATOM 0 H LYS A 161 3.815 18.658 3.500 1.00 0.00 H new ATOM 0 HA LYS A 161 3.228 19.885 6.104 1.00 0.00 H new ATOM 0 HB2 LYS A 161 4.686 21.027 3.676 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.794 21.598 5.329 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.501 18.716 4.641 1.00 0.00 H new ATOM 0 HG3 LYS A 161 6.681 19.995 4.429 1.00 0.00 H new ATOM 0 HD2 LYS A 161 7.174 19.708 6.647 1.00 0.00 H new ATOM 0 HD3 LYS A 161 5.674 20.551 6.975 1.00 0.00 H new ATOM 0 HE2 LYS A 161 4.606 18.109 6.569 1.00 0.00 H new ATOM 0 HE3 LYS A 161 6.221 17.575 6.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 4.817 17.766 8.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 6.088 18.888 9.040 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 4.524 19.406 8.629 1.00 0.00 H new ATOM 2547 N ALA A 162 1.875 21.991 5.337 1.00 0.00 N ATOM 2548 CA ALA A 162 0.788 22.932 4.940 1.00 0.00 C ATOM 2549 C ALA A 162 1.341 24.358 4.883 1.00 0.00 C ATOM 2550 O ALA A 162 2.133 24.700 5.745 1.00 0.00 O ATOM 2551 CB ALA A 162 -0.346 22.865 5.965 1.00 0.00 C ATOM 2552 OXT ALA A 162 0.962 25.083 3.978 1.00 0.00 O ATOM 0 H ALA A 162 2.330 22.203 6.225 1.00 0.00 H new ATOM 0 HA ALA A 162 0.407 22.651 3.958 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -1.140 23.553 5.675 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -0.741 21.850 6.004 1.00 0.00 H new ATOM 0 HB3 ALA A 162 0.035 23.144 6.947 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 PA NDP A 168 -3.619 -2.777 -9.288 1.00 0.00 P HETATM 2560 O1A NDP A 168 -3.111 -1.511 -8.728 1.00 0.00 O HETATM 2561 O2A NDP A 168 -3.618 -3.961 -8.404 1.00 0.00 O HETATM 2562 O5B NDP A 168 -5.034 -2.575 -9.992 1.00 0.00 O HETATM 2563 C5B NDP A 168 -6.061 -1.781 -9.372 1.00 0.00 C HETATM 2564 C4B NDP A 168 -7.411 -2.123 -9.958 1.00 0.00 C HETATM 2565 O4B NDP A 168 -8.446 -1.408 -9.233 1.00 0.00 O HETATM 2566 C3B NDP A 168 -7.617 -1.720 -11.409 1.00 0.00 C HETATM 2567 O3B NDP A 168 -7.115 -2.723 -12.296 1.00 0.00 O HETATM 2568 C2B NDP A 168 -9.133 -1.601 -11.499 1.00 0.00 C HETATM 2569 O2B NDP A 168 -9.793 -2.835 -11.690 1.00 0.00 O HETATM 2570 C1B NDP A 168 -9.474 -1.016 -10.127 1.00 0.00 C HETATM 2571 N9A NDP A 168 -9.546 0.444 -10.124 1.00 0.00 N HETATM 2572 C8A NDP A 168 -8.506 1.338 -10.195 1.00 0.00 C HETATM 2573 N7A NDP A 168 -8.884 2.593 -10.162 1.00 0.00 N HETATM 2574 C5A NDP A 168 -10.267 2.521 -10.064 1.00 0.00 C HETATM 2575 C6A NDP A 168 -11.265 3.511 -9.987 1.00 0.00 C HETATM 2576 N6A NDP A 168 -11.009 4.821 -9.993 1.00 0.00 N HETATM 2577 N1A NDP A 168 -12.552 3.102 -9.899 1.00 0.00 N HETATM 2578 C2A NDP A 168 -12.808 1.787 -9.890 1.00 0.00 C HETATM 2579 N3A NDP A 168 -11.958 0.763 -9.958 1.00 0.00 N HETATM 2580 C4A NDP A 168 -10.688 1.203 -10.043 1.00 0.00 C HETATM 2581 O3 NDP A 168 -2.748 -3.137 -10.642 1.00 0.00 O HETATM 2582 PN NDP A 168 -1.245 -2.762 -11.209 1.00 0.00 P HETATM 2583 O1N NDP A 168 -0.948 -3.646 -12.353 1.00 0.00 O HETATM 2584 O2N NDP A 168 -1.183 -1.306 -11.439 1.00 0.00 O HETATM 2585 O5D NDP A 168 -0.414 -3.185 -9.917 1.00 0.00 O HETATM 2586 C5D NDP A 168 -0.786 -4.344 -9.151 1.00 0.00 C HETATM 2587 C4D NDP A 168 0.445 -5.125 -8.753 1.00 0.00 C HETATM 2588 O4D NDP A 168 1.339 -4.279 -7.981 1.00 0.00 O HETATM 2589 C3D NDP A 168 0.210 -6.331 -7.857 1.00 0.00 C HETATM 2590 O3D NDP A 168 -0.152 -7.479 -8.631 1.00 0.00 O HETATM 2591 C2D NDP A 168 1.575 -6.515 -7.203 1.00 0.00 C HETATM 2592 O2D NDP A 168 2.507 -7.219 -8.026 1.00 0.00 O HETATM 2593 C1D NDP A 168 2.024 -5.062 -7.017 1.00 0.00 C HETATM 2594 N1N NDP A 168 1.742 -4.511 -5.690 1.00 0.00 N HETATM 2595 C2N NDP A 168 2.516 -3.790 -4.888 1.00 0.00 C HETATM 2596 C3N NDP A 168 2.187 -3.261 -3.752 1.00 0.00 C HETATM 2597 C7N NDP A 168 3.327 -2.632 -3.153 1.00 0.00 C HETATM 2598 O7N NDP A 168 2.847 -2.081 -2.059 1.00 0.00 O HETATM 2599 N7N NDP A 168 4.617 -2.553 -3.561 1.00 0.00 N HETATM 2600 C4N NDP A 168 0.780 -3.462 -3.269 1.00 0.00 C HETATM 2601 C5N NDP A 168 -0.117 -4.244 -4.076 1.00 0.00 C HETATM 2602 C6N NDP A 168 0.281 -4.811 -5.294 1.00 0.00 C HETATM 2603 P2B NDP A 168 -10.887 -3.237 -12.887 1.00 0.00 P HETATM 2604 O1X NDP A 168 -11.950 -3.963 -11.971 1.00 0.00 O HETATM 2605 O2X NDP A 168 -11.402 -1.848 -13.262 1.00 0.00 O HETATM 2606 O3X NDP A 168 -10.083 -4.283 -13.656 1.00 0.00 O HETATM 0 HO3N NDP A 168 -0.734 -8.061 -8.100 1.00 0.00 H new HETATM 0 HO3A NDP A 168 -7.845 -3.322 -12.559 1.00 0.00 H new HETATM 0 HO2N NDP A 168 2.425 -8.182 -7.863 1.00 0.00 H new HETATM 0 H72N NDP A 168 5.302 -2.054 -2.993 1.00 0.00 H new HETATM 0 H71N NDP A 168 4.903 -2.993 -4.436 1.00 0.00 H new HETATM 0 H62A NDP A 168 -11.776 5.491 -9.935 1.00 0.00 H new HETATM 0 H61A NDP A 168 -10.046 5.152 -10.056 1.00 0.00 H new HETATM 0 H52N NDP A 168 -1.336 -4.039 -8.260 1.00 0.00 H new HETATM 0 H52A NDP A 168 -6.068 -1.958 -8.297 1.00 0.00 H new HETATM 0 H51N NDP A 168 -1.453 -4.977 -9.736 1.00 0.00 H new HETATM 0 H51A NDP A 168 -5.850 -0.722 -9.519 1.00 0.00 H new HETATM 0 H42N NDP A 168 0.831 -3.927 -2.284 1.00 0.00 H new HETATM 0 H41N NDP A 168 0.332 -2.478 -3.134 1.00 0.00 H new HETATM 0 H8A NDP A 168 -7.463 1.032 -10.272 1.00 0.00 H new HETATM 0 H6N NDP A 168 -0.386 -5.414 -5.910 1.00 0.00 H new HETATM 0 H5N NDP A 168 -1.139 -4.401 -3.729 1.00 0.00 H new HETATM 0 H4D NDP A 168 0.840 -5.467 -9.710 1.00 0.00 H new HETATM 0 H4B NDP A 168 -7.461 -3.209 -9.884 1.00 0.00 H new HETATM 0 H3D NDP A 168 -0.602 -6.199 -7.142 1.00 0.00 H new HETATM 0 H3B NDP A 168 -7.094 -0.806 -11.692 1.00 0.00 H new HETATM 0 H2N NDP A 168 3.540 -3.625 -5.222 1.00 0.00 H new HETATM 0 H2D NDP A 168 1.523 -7.110 -6.291 1.00 0.00 H new HETATM 0 H2B NDP A 168 -9.451 -1.007 -12.355 1.00 0.00 H new HETATM 0 H2A NDP A 168 -13.861 1.516 -9.817 1.00 0.00 H new HETATM 0 H1D NDP A 168 3.107 -5.040 -7.135 1.00 0.00 H new HETATM 0 H1B NDP A 168 -10.457 -1.388 -9.838 1.00 0.00 H new HETATM 2633 N1 TRR A 170 4.018 -4.638 1.552 1.00 0.00 N HETATM 2634 C2 TRR A 170 3.854 -3.303 1.837 1.00 0.00 C HETATM 2635 N2 TRR A 170 4.806 -2.641 2.579 1.00 0.00 N HETATM 2636 N3 TRR A 170 2.739 -2.632 1.379 1.00 0.00 N HETATM 2637 C4 TRR A 170 1.787 -3.298 0.634 1.00 0.00 C HETATM 2638 N4 TRR A 170 0.676 -2.625 0.178 1.00 0.00 N HETATM 2639 C5 TRR A 170 1.951 -4.648 0.346 1.00 0.00 C HETATM 2640 C6 TRR A 170 3.076 -5.313 0.811 1.00 0.00 C HETATM 2641 C7 TRR A 170 0.915 -5.378 -0.465 1.00 0.00 C HETATM 2642 C11 TRR A 170 0.939 -6.867 -0.269 1.00 0.00 C HETATM 2643 C12 TRR A 170 1.251 -7.698 -1.341 1.00 0.00 C HETATM 2644 C13 TRR A 170 1.273 -9.087 -1.171 1.00 0.00 C HETATM 2645 C14 TRR A 170 0.981 -9.637 0.078 1.00 0.00 C HETATM 2646 C15 TRR A 170 0.668 -8.806 1.156 1.00 0.00 C HETATM 2647 C16 TRR A 170 0.648 -7.415 0.979 1.00 0.00 C HETATM 2648 O13 TRR A 170 1.584 -9.928 -2.238 1.00 0.00 O HETATM 2649 O14 TRR A 170 1.001 -11.006 0.247 1.00 0.00 O HETATM 2650 O15 TRR A 170 0.387 -9.373 2.398 1.00 0.00 O HETATM 2651 C17 TRR A 170 1.875 -9.362 -3.493 1.00 0.00 C HETATM 2652 C18 TRR A 170 2.241 -11.627 0.446 1.00 0.00 C HETATM 2653 C19 TRR A 170 0.094 -8.531 3.485 1.00 0.00 C HETATM 0 H193 TRR A 170 0.941 -7.872 3.673 1.00 0.00 H new HETATM 0 H192 TRR A 170 -0.787 -7.932 3.254 1.00 0.00 H new HETATM 0 H191 TRR A 170 -0.100 -9.135 4.371 1.00 0.00 H new HETATM 0 H183 TRR A 170 2.884 -11.439 -0.414 1.00 0.00 H new HETATM 0 H182 TRR A 170 2.709 -11.225 1.344 1.00 0.00 H new HETATM 0 H181 TRR A 170 2.096 -12.701 0.563 1.00 0.00 H new HETATM 0 H173 TRR A 170 1.017 -8.787 -3.841 1.00 0.00 H new HETATM 0 H172 TRR A 170 2.740 -8.704 -3.404 1.00 0.00 H new HETATM 0 H171 TRR A 170 2.094 -10.155 -4.208 1.00 0.00 H new HETATM 0 H72 TRR A 170 -0.073 -5.001 -0.201 1.00 0.00 H new HETATM 0 H71 TRR A 170 1.069 -5.156 -1.521 1.00 0.00 H new HETATM 0 H6 TRR A 170 3.214 -6.371 0.589 1.00 0.00 H new HETATM 0 H42 TRR A 170 -0.028 -3.117 -0.373 1.00 0.00 H new HETATM 0 H41 TRR A 170 0.557 -1.635 0.391 1.00 0.00 H new HETATM 0 H22 TRR A 170 4.688 -1.651 2.793 1.00 0.00 H new HETATM 0 H21 TRR A 170 5.629 -3.141 2.915 1.00 0.00 H new HETATM 0 H16 TRR A 170 0.405 -6.762 1.817 1.00 0.00 H new HETATM 0 H12 TRR A 170 1.479 -7.266 -2.315 1.00 0.00 H new HETATM 0 H1 TRR A 170 4.844 -5.131 1.892 1.00 0.00 H new