USER MOD reduce.3.24.130724 H: found=0, std=0, add=1030, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 1035 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 19 TYR OH : rot 101:sc= 2.2 USER MOD Set 1.2: A 102 THR OG1 : rot -180:sc= 1.22 USER MOD Set 2.1: A 80 CYS SG : rot 82:sc= 1.19 USER MOD Set 2.2: A 82 SER OG : rot 180:sc= 0.924 USER MOD Set 2.3: A 95 GLN : amide:sc= 0.618 K(o=2.7,f=-2.4!) USER MOD Set 3.1: A 36 THR OG1 : rot -155:sc= 1.27 USER MOD Set 3.2: A 56 THR OG1 : rot -16:sc= 1.14 USER MOD Set 4.1: A 12 ASN : amide:sc= 0.336 K(o=0.65,f=-0.047) USER MOD Set 4.2: A 14 GLN : amide:sc= 0.316 K(o=0.65,f=-0.34) USER MOD Set 5.1: A 5 CYS SG : rot 125:sc= 0.0394 USER MOD Set 5.2: A 44 GLN : amide:sc= 0.0411 K(o=0.08,f=-2.9!) USER MOD Single : A 1 VAL N :NH3+ -120:sc= 0 (180deg=-0.563) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 THR OG1 : rot -58:sc= 1.19 USER MOD Single : A 13 SER OG : rot 29:sc= 0.885 USER MOD Single : A 15 ASN : amide:sc= 0 X(o=0,f=-0.038) USER MOD Single : A 20 MET CE :methyl -162:sc= -0.451 (180deg=-1.58) USER MOD Single : A 21 LYS NZ :NH3+ -167:sc= 0.0643 (180deg=-0.22) USER MOD Single : A 29 THR OG1 : rot 180:sc= 0 USER MOD Single : A 31 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 ASN : amide:sc= 0.775 K(o=0.77,f=-0.87) USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 43 SER OG : rot 33:sc= 0.193 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 55 SER OG : rot -100:sc= 1.38 USER MOD Single : A 58 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= 0.25 K(o=0.25,f=-3.2!) USER MOD Single : A 60 THR OG1 : rot 180:sc= 0.00257 USER MOD Single : A 63 SER OG : rot 31:sc= 0.783 USER MOD Single : A 65 GLN : amide:sc= 0.361 X(o=0.36,f=0) USER MOD Single : A 73 THR OG1 : rot 180:sc= 0 USER MOD Single : A 74 THR OG1 : rot 140:sc= -0.19 USER MOD Single : A 79 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 81 LYS NZ :NH3+ -170:sc= 0.841 (180deg=0.765) USER MOD Single : A 85 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 HIS : no HD1:sc= -0.147 K(o=-0.15,f=-0.9) USER MOD Single : A 96 LYS NZ :NH3+ -177:sc= 0.69 (180deg=0.687) USER MOD Single : A 100 LYS NZ :NH3+ -159:sc= 0.2 (180deg=0.13) USER MOD Single : A 103 ASN : amide:sc= 0.512 K(o=0.51,f=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 MET CE :methyl -168:sc= 0 (180deg=-0.0457) USER MOD Single : A 115 MET CE :methyl -160:sc=-0.000865 (180deg=-0.806) USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 118 THR OG1 : rot 63:sc= 1.1 USER MOD Single : A 127 HIS : no HE2:sc= 0.217 K(o=0.22,f=-0.8) USER MOD Single : A 128 TYR OH : rot 12:sc= 1.26 USER MOD Single : A 130 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N VAL A 1 2.626 -0.851 -1.828 1.00 0.00 N ATOM 2 CA VAL A 1 1.639 -0.654 -2.931 1.00 0.00 C ATOM 3 C VAL A 1 0.884 0.711 -2.809 1.00 0.00 C ATOM 4 O VAL A 1 0.982 1.546 -3.714 1.00 0.00 O ATOM 5 CB VAL A 1 0.777 -1.949 -3.143 1.00 0.00 C ATOM 6 CG1 VAL A 1 -0.241 -2.282 -2.029 1.00 0.00 C ATOM 7 CG2 VAL A 1 0.033 -1.964 -4.494 1.00 0.00 C ATOM 0 H1 VAL A 1 3.579 -0.958 -2.230 1.00 0.00 H new ATOM 0 H2 VAL A 1 2.608 -0.026 -1.195 1.00 0.00 H new ATOM 0 H3 VAL A 1 2.379 -1.706 -1.290 1.00 0.00 H new ATOM 0 HA VAL A 1 2.157 -0.536 -3.883 1.00 0.00 H new ATOM 0 HB VAL A 1 1.543 -2.724 -3.117 1.00 0.00 H new ATOM 0 HG11 VAL A 1 -0.776 -3.196 -2.286 1.00 0.00 H new ATOM 0 HG12 VAL A 1 0.286 -2.423 -1.085 1.00 0.00 H new ATOM 0 HG13 VAL A 1 -0.952 -1.462 -1.929 1.00 0.00 H new ATOM 0 HG21 VAL A 1 -0.545 -2.884 -4.581 1.00 0.00 H new ATOM 0 HG22 VAL A 1 -0.639 -1.107 -4.549 1.00 0.00 H new ATOM 0 HG23 VAL A 1 0.756 -1.911 -5.308 1.00 0.00 H new ATOM 18 N GLU A 2 0.173 0.963 -1.691 1.00 0.00 N ATOM 19 CA GLU A 2 -0.484 2.276 -1.408 1.00 0.00 C ATOM 20 C GLU A 2 0.466 3.505 -1.196 1.00 0.00 C ATOM 21 O GLU A 2 0.165 4.589 -1.700 1.00 0.00 O ATOM 22 CB GLU A 2 -1.532 2.095 -0.274 1.00 0.00 C ATOM 23 CG GLU A 2 -0.999 1.822 1.160 1.00 0.00 C ATOM 24 CD GLU A 2 -2.094 1.627 2.205 1.00 0.00 C ATOM 25 OE1 GLU A 2 -2.347 0.551 2.736 1.00 0.00 O ATOM 26 OE2 GLU A 2 -2.755 2.784 2.489 1.00 0.00 O ATOM 0 H GLU A 2 0.033 0.271 -0.955 1.00 0.00 H new ATOM 0 HA GLU A 2 -0.991 2.563 -2.329 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -2.147 2.994 -0.238 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -2.188 1.270 -0.551 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -0.369 0.933 1.139 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -0.365 2.654 1.465 1.00 0.00 H new ATOM 34 N ALA A 3 1.624 3.341 -0.522 1.00 0.00 N ATOM 35 CA ALA A 3 2.695 4.379 -0.474 1.00 0.00 C ATOM 36 C ALA A 3 3.304 4.864 -1.839 1.00 0.00 C ATOM 37 O ALA A 3 3.722 6.020 -1.941 1.00 0.00 O ATOM 38 CB ALA A 3 3.780 3.827 0.470 1.00 0.00 C ATOM 0 H ALA A 3 1.849 2.496 0.002 1.00 0.00 H new ATOM 0 HA ALA A 3 2.233 5.300 -0.118 1.00 0.00 H new ATOM 0 HB1 ALA A 3 4.596 4.546 0.547 1.00 0.00 H new ATOM 0 HB2 ALA A 3 3.351 3.658 1.458 1.00 0.00 H new ATOM 0 HB3 ALA A 3 4.162 2.886 0.075 1.00 0.00 H new ATOM 44 N PHE A 4 3.319 4.011 -2.881 1.00 0.00 N ATOM 45 CA PHE A 4 3.603 4.442 -4.280 1.00 0.00 C ATOM 46 C PHE A 4 2.430 5.157 -5.039 1.00 0.00 C ATOM 47 O PHE A 4 2.721 5.769 -6.065 1.00 0.00 O ATOM 48 CB PHE A 4 4.123 3.224 -5.109 1.00 0.00 C ATOM 49 CG PHE A 4 5.471 2.627 -4.666 1.00 0.00 C ATOM 50 CD1 PHE A 4 6.672 3.286 -4.954 1.00 0.00 C ATOM 51 CD2 PHE A 4 5.499 1.454 -3.903 1.00 0.00 C ATOM 52 CE1 PHE A 4 7.868 2.824 -4.414 1.00 0.00 C ATOM 53 CE2 PHE A 4 6.699 0.988 -3.374 1.00 0.00 C ATOM 54 CZ PHE A 4 7.876 1.686 -3.614 1.00 0.00 C ATOM 0 H PHE A 4 3.138 3.012 -2.788 1.00 0.00 H new ATOM 0 HA PHE A 4 4.366 5.215 -4.184 1.00 0.00 H new ATOM 0 HB2 PHE A 4 3.370 2.437 -5.070 1.00 0.00 H new ATOM 0 HB3 PHE A 4 4.210 3.531 -6.151 1.00 0.00 H new ATOM 0 HD1 PHE A 4 6.670 4.154 -5.596 1.00 0.00 H new ATOM 0 HD2 PHE A 4 4.585 0.908 -3.724 1.00 0.00 H new ATOM 0 HE1 PHE A 4 8.790 3.349 -4.616 1.00 0.00 H new ATOM 0 HE2 PHE A 4 6.715 0.087 -2.779 1.00 0.00 H new ATOM 0 HZ PHE A 4 8.802 1.343 -3.177 1.00 0.00 H new ATOM 64 N CYS A 5 1.151 5.104 -4.611 1.00 0.00 N ATOM 65 CA CYS A 5 0.004 5.632 -5.401 1.00 0.00 C ATOM 66 C CYS A 5 -0.135 7.192 -5.372 1.00 0.00 C ATOM 67 O CYS A 5 -0.674 7.768 -4.422 1.00 0.00 O ATOM 68 CB CYS A 5 -1.252 4.904 -4.876 1.00 0.00 C ATOM 69 SG CYS A 5 -2.696 5.287 -5.927 1.00 0.00 S ATOM 0 H CYS A 5 0.879 4.698 -3.716 1.00 0.00 H new ATOM 0 HA CYS A 5 0.162 5.430 -6.460 1.00 0.00 H new ATOM 0 HB2 CYS A 5 -1.078 3.828 -4.864 1.00 0.00 H new ATOM 0 HB3 CYS A 5 -1.452 5.206 -3.848 1.00 0.00 H new ATOM 0 HG CYS A 5 -3.222 4.181 -6.362 1.00 0.00 H new ATOM 75 N ALA A 6 0.362 7.870 -6.425 1.00 0.00 N ATOM 76 CA ALA A 6 0.357 9.359 -6.537 1.00 0.00 C ATOM 77 C ALA A 6 0.730 9.847 -7.981 1.00 0.00 C ATOM 78 O ALA A 6 1.261 9.099 -8.813 1.00 0.00 O ATOM 79 CB ALA A 6 1.321 9.975 -5.487 1.00 0.00 C ATOM 0 H ALA A 6 0.782 7.407 -7.231 1.00 0.00 H new ATOM 0 HA ALA A 6 -0.659 9.700 -6.338 1.00 0.00 H new ATOM 0 HB1 ALA A 6 1.310 11.061 -5.577 1.00 0.00 H new ATOM 0 HB2 ALA A 6 0.998 9.690 -4.486 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.332 9.606 -5.661 1.00 0.00 H new ATOM 85 N THR A 7 0.507 11.149 -8.263 1.00 0.00 N ATOM 86 CA THR A 7 1.202 11.853 -9.385 1.00 0.00 C ATOM 87 C THR A 7 2.620 12.289 -8.899 1.00 0.00 C ATOM 88 O THR A 7 2.745 13.078 -7.961 1.00 0.00 O ATOM 89 CB THR A 7 0.333 13.045 -9.886 1.00 0.00 C ATOM 90 OG1 THR A 7 -0.919 12.557 -10.358 1.00 0.00 O ATOM 91 CG2 THR A 7 0.940 13.850 -11.047 1.00 0.00 C ATOM 0 H THR A 7 -0.141 11.737 -7.740 1.00 0.00 H new ATOM 0 HA THR A 7 1.334 11.190 -10.240 1.00 0.00 H new ATOM 0 HB THR A 7 0.250 13.705 -9.022 1.00 0.00 H new ATOM 0 HG1 THR A 7 -1.466 13.308 -10.671 1.00 0.00 H new ATOM 0 HG21 THR A 7 0.262 14.657 -11.324 1.00 0.00 H new ATOM 0 HG22 THR A 7 1.897 14.271 -10.737 1.00 0.00 H new ATOM 0 HG23 THR A 7 1.093 13.194 -11.904 1.00 0.00 H new ATOM 99 N TRP A 8 3.688 11.761 -9.513 1.00 0.00 N ATOM 100 CA TRP A 8 5.080 12.013 -9.051 1.00 0.00 C ATOM 101 C TRP A 8 5.821 12.972 -10.033 1.00 0.00 C ATOM 102 O TRP A 8 6.031 12.646 -11.206 1.00 0.00 O ATOM 103 CB TRP A 8 5.815 10.656 -8.905 1.00 0.00 C ATOM 104 CG TRP A 8 5.360 9.758 -7.750 1.00 0.00 C ATOM 105 CD1 TRP A 8 4.473 8.670 -7.849 1.00 0.00 C ATOM 106 CD2 TRP A 8 5.754 9.795 -6.426 1.00 0.00 C ATOM 107 NE1 TRP A 8 4.320 8.011 -6.617 1.00 0.00 N ATOM 108 CE2 TRP A 8 5.119 8.728 -5.747 1.00 0.00 C ATOM 109 CE3 TRP A 8 6.615 10.675 -5.730 1.00 0.00 C ATOM 110 CZ2 TRP A 8 5.334 8.537 -4.363 1.00 0.00 C ATOM 111 CZ3 TRP A 8 6.819 10.469 -4.366 1.00 0.00 C ATOM 112 CH2 TRP A 8 6.189 9.415 -3.692 1.00 0.00 C ATOM 0 H TRP A 8 3.625 11.156 -10.331 1.00 0.00 H new ATOM 0 HA TRP A 8 5.064 12.507 -8.079 1.00 0.00 H new ATOM 0 HB2 TRP A 8 5.698 10.102 -9.836 1.00 0.00 H new ATOM 0 HB3 TRP A 8 6.880 10.855 -8.785 1.00 0.00 H new ATOM 0 HD1 TRP A 8 3.972 8.377 -8.760 1.00 0.00 H new ATOM 0 HE1 TRP A 8 3.749 7.191 -6.412 1.00 0.00 H new ATOM 0 HE3 TRP A 8 7.104 11.489 -6.244 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 4.848 7.730 -3.836 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 7.473 11.133 -3.820 1.00 0.00 H new ATOM 0 HH2 TRP A 8 6.367 9.279 -2.636 1.00 0.00 H new ATOM 123 N LYS A 9 6.268 14.136 -9.535 1.00 0.00 N ATOM 124 CA LYS A 9 7.031 15.134 -10.339 1.00 0.00 C ATOM 125 C LYS A 9 8.558 15.056 -10.021 1.00 0.00 C ATOM 126 O LYS A 9 8.979 15.036 -8.856 1.00 0.00 O ATOM 127 CB LYS A 9 6.476 16.557 -10.067 1.00 0.00 C ATOM 128 CG LYS A 9 5.081 16.837 -10.680 1.00 0.00 C ATOM 129 CD LYS A 9 4.567 18.273 -10.447 1.00 0.00 C ATOM 130 CE LYS A 9 5.240 19.325 -11.348 1.00 0.00 C ATOM 131 NZ LYS A 9 4.665 20.658 -11.091 1.00 0.00 N ATOM 0 H LYS A 9 6.117 14.422 -8.568 1.00 0.00 H new ATOM 0 HA LYS A 9 6.906 14.906 -11.397 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.422 16.711 -8.989 1.00 0.00 H new ATOM 0 HB3 LYS A 9 7.183 17.289 -10.458 1.00 0.00 H new ATOM 0 HG2 LYS A 9 5.123 16.647 -11.753 1.00 0.00 H new ATOM 0 HG3 LYS A 9 4.363 16.133 -10.259 1.00 0.00 H new ATOM 0 HD2 LYS A 9 3.491 18.296 -10.618 1.00 0.00 H new ATOM 0 HD3 LYS A 9 4.730 18.543 -9.404 1.00 0.00 H new ATOM 0 HE2 LYS A 9 6.314 19.342 -11.161 1.00 0.00 H new ATOM 0 HE3 LYS A 9 5.104 19.058 -12.396 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 5.127 21.359 -11.705 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 3.645 20.641 -11.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 4.817 20.916 -10.095 1.00 0.00 H new ATOM 144 N LEU A 10 9.393 15.012 -11.075 1.00 0.00 N ATOM 145 CA LEU A 10 10.874 14.912 -10.925 1.00 0.00 C ATOM 146 C LEU A 10 11.548 16.198 -10.340 1.00 0.00 C ATOM 147 O LEU A 10 11.332 17.318 -10.813 1.00 0.00 O ATOM 148 CB LEU A 10 11.462 14.519 -12.310 1.00 0.00 C ATOM 149 CG LEU A 10 12.979 14.201 -12.436 1.00 0.00 C ATOM 150 CD1 LEU A 10 13.871 15.434 -12.653 1.00 0.00 C ATOM 151 CD2 LEU A 10 13.547 13.245 -11.371 1.00 0.00 C ATOM 0 H LEU A 10 9.077 15.044 -12.044 1.00 0.00 H new ATOM 0 HA LEU A 10 11.096 14.146 -10.182 1.00 0.00 H new ATOM 0 HB2 LEU A 10 10.915 13.644 -12.661 1.00 0.00 H new ATOM 0 HB3 LEU A 10 11.240 15.332 -13.001 1.00 0.00 H new ATOM 0 HG LEU A 10 13.018 13.633 -13.366 1.00 0.00 H new ATOM 0 HD11 LEU A 10 14.912 15.121 -12.730 1.00 0.00 H new ATOM 0 HD12 LEU A 10 13.575 15.940 -13.572 1.00 0.00 H new ATOM 0 HD13 LEU A 10 13.759 16.117 -11.811 1.00 0.00 H new ATOM 0 HD21 LEU A 10 14.611 13.091 -11.551 1.00 0.00 H new ATOM 0 HD22 LEU A 10 13.405 13.678 -10.381 1.00 0.00 H new ATOM 0 HD23 LEU A 10 13.027 12.288 -11.426 1.00 0.00 H new ATOM 163 N THR A 11 12.424 15.988 -9.348 1.00 0.00 N ATOM 164 CA THR A 11 13.283 17.058 -8.744 1.00 0.00 C ATOM 165 C THR A 11 14.774 17.046 -9.236 1.00 0.00 C ATOM 166 O THR A 11 15.342 18.117 -9.462 1.00 0.00 O ATOM 167 CB THR A 11 13.198 17.049 -7.183 1.00 0.00 C ATOM 168 OG1 THR A 11 13.772 15.869 -6.629 1.00 0.00 O ATOM 169 CG2 THR A 11 11.784 17.178 -6.593 1.00 0.00 C ATOM 0 H THR A 11 12.570 15.070 -8.928 1.00 0.00 H new ATOM 0 HA THR A 11 12.867 17.997 -9.109 1.00 0.00 H new ATOM 0 HB THR A 11 13.758 17.943 -6.910 1.00 0.00 H new ATOM 0 HG1 THR A 11 13.318 15.081 -6.995 1.00 0.00 H new ATOM 0 HG21 THR A 11 11.841 17.161 -5.505 1.00 0.00 H new ATOM 0 HG22 THR A 11 11.338 18.118 -6.918 1.00 0.00 H new ATOM 0 HG23 THR A 11 11.169 16.347 -6.937 1.00 0.00 H new ATOM 177 N ASN A 12 15.419 15.867 -9.380 1.00 0.00 N ATOM 178 CA ASN A 12 16.838 15.743 -9.824 1.00 0.00 C ATOM 179 C ASN A 12 17.080 14.321 -10.439 1.00 0.00 C ATOM 180 O ASN A 12 16.781 13.305 -9.802 1.00 0.00 O ATOM 181 CB ASN A 12 17.789 16.037 -8.624 1.00 0.00 C ATOM 182 CG ASN A 12 19.293 15.961 -8.930 1.00 0.00 C ATOM 183 OD1 ASN A 12 19.759 16.288 -10.016 1.00 0.00 O ATOM 184 ND2 ASN A 12 20.094 15.502 -8.001 1.00 0.00 N ATOM 0 H ASN A 12 14.975 14.968 -9.193 1.00 0.00 H new ATOM 0 HA ASN A 12 17.053 16.475 -10.602 1.00 0.00 H new ATOM 0 HB2 ASN A 12 17.565 17.033 -8.242 1.00 0.00 H new ATOM 0 HB3 ASN A 12 17.564 15.331 -7.825 1.00 0.00 H new ATOM 0 HD21 ASN A 12 21.094 15.420 -8.185 1.00 0.00 H new ATOM 0 HD22 ASN A 12 19.718 15.227 -7.094 1.00 0.00 H new ATOM 191 N SER A 13 17.668 14.256 -11.647 1.00 0.00 N ATOM 192 CA SER A 13 18.111 12.979 -12.280 1.00 0.00 C ATOM 193 C SER A 13 19.667 12.899 -12.342 1.00 0.00 C ATOM 194 O SER A 13 20.281 13.592 -13.162 1.00 0.00 O ATOM 195 CB SER A 13 17.472 12.876 -13.686 1.00 0.00 C ATOM 196 OG SER A 13 18.028 13.817 -14.607 1.00 0.00 O ATOM 0 H SER A 13 17.854 15.080 -12.219 1.00 0.00 H new ATOM 0 HA SER A 13 17.780 12.132 -11.679 1.00 0.00 H new ATOM 0 HB2 SER A 13 17.612 11.867 -14.073 1.00 0.00 H new ATOM 0 HB3 SER A 13 16.397 13.041 -13.607 1.00 0.00 H new ATOM 0 HG SER A 13 18.954 14.014 -14.354 1.00 0.00 H new ATOM 202 N GLN A 14 20.302 12.074 -11.491 1.00 0.00 N ATOM 203 CA GLN A 14 21.755 12.225 -11.174 1.00 0.00 C ATOM 204 C GLN A 14 22.774 11.859 -12.313 1.00 0.00 C ATOM 205 O GLN A 14 23.573 12.709 -12.711 1.00 0.00 O ATOM 206 CB GLN A 14 22.017 11.481 -9.827 1.00 0.00 C ATOM 207 CG GLN A 14 23.246 11.973 -9.019 1.00 0.00 C ATOM 208 CD GLN A 14 22.989 13.240 -8.188 1.00 0.00 C ATOM 209 OE1 GLN A 14 22.797 14.336 -8.702 1.00 0.00 O ATOM 210 NE2 GLN A 14 22.960 13.142 -6.880 1.00 0.00 N ATOM 0 H GLN A 14 19.847 11.299 -11.008 1.00 0.00 H new ATOM 0 HA GLN A 14 21.960 13.291 -11.077 1.00 0.00 H new ATOM 0 HB2 GLN A 14 21.130 11.578 -9.201 1.00 0.00 H new ATOM 0 HB3 GLN A 14 22.144 10.419 -10.038 1.00 0.00 H new ATOM 0 HG2 GLN A 14 23.571 11.175 -8.352 1.00 0.00 H new ATOM 0 HG3 GLN A 14 24.067 12.166 -9.710 1.00 0.00 H new ATOM 0 HE21 GLN A 14 23.117 12.239 -6.433 1.00 0.00 H new ATOM 0 HE22 GLN A 14 22.780 13.969 -6.310 1.00 0.00 H new ATOM 219 N ASN A 15 22.762 10.615 -12.827 1.00 0.00 N ATOM 220 CA ASN A 15 23.656 10.179 -13.950 1.00 0.00 C ATOM 221 C ASN A 15 22.845 9.681 -15.197 1.00 0.00 C ATOM 222 O ASN A 15 23.159 8.640 -15.780 1.00 0.00 O ATOM 223 CB ASN A 15 24.637 9.142 -13.324 1.00 0.00 C ATOM 224 CG ASN A 15 25.860 8.761 -14.160 1.00 0.00 C ATOM 225 OD1 ASN A 15 25.985 7.649 -14.661 1.00 0.00 O ATOM 226 ND2 ASN A 15 26.799 9.659 -14.346 1.00 0.00 N ATOM 0 H ASN A 15 22.143 9.879 -12.488 1.00 0.00 H new ATOM 0 HA ASN A 15 24.231 11.003 -14.373 1.00 0.00 H new ATOM 0 HB2 ASN A 15 24.987 9.537 -12.370 1.00 0.00 H new ATOM 0 HB3 ASN A 15 24.077 8.233 -13.106 1.00 0.00 H new ATOM 0 HD21 ASN A 15 27.622 9.428 -14.903 1.00 0.00 H new ATOM 0 HD22 ASN A 15 26.706 10.587 -13.934 1.00 0.00 H new ATOM 233 N PHE A 16 21.804 10.422 -15.634 1.00 0.00 N ATOM 234 CA PHE A 16 20.825 9.901 -16.634 1.00 0.00 C ATOM 235 C PHE A 16 21.316 9.850 -18.119 1.00 0.00 C ATOM 236 O PHE A 16 21.121 8.816 -18.760 1.00 0.00 O ATOM 237 CB PHE A 16 19.449 10.587 -16.414 1.00 0.00 C ATOM 238 CG PHE A 16 18.260 9.879 -17.095 1.00 0.00 C ATOM 239 CD1 PHE A 16 17.907 8.568 -16.743 1.00 0.00 C ATOM 240 CD2 PHE A 16 17.544 10.531 -18.102 1.00 0.00 C ATOM 241 CE1 PHE A 16 16.875 7.915 -17.412 1.00 0.00 C ATOM 242 CE2 PHE A 16 16.497 9.880 -18.754 1.00 0.00 C ATOM 243 CZ PHE A 16 16.165 8.574 -18.410 1.00 0.00 C ATOM 0 H PHE A 16 21.614 11.373 -15.319 1.00 0.00 H new ATOM 0 HA PHE A 16 20.708 8.835 -16.440 1.00 0.00 H new ATOM 0 HB2 PHE A 16 19.255 10.646 -15.343 1.00 0.00 H new ATOM 0 HB3 PHE A 16 19.505 11.611 -16.784 1.00 0.00 H new ATOM 0 HD1 PHE A 16 18.438 8.063 -15.950 1.00 0.00 H new ATOM 0 HD2 PHE A 16 17.802 11.543 -18.377 1.00 0.00 H new ATOM 0 HE1 PHE A 16 16.626 6.896 -17.156 1.00 0.00 H new ATOM 0 HE2 PHE A 16 15.943 10.391 -19.528 1.00 0.00 H new ATOM 0 HZ PHE A 16 15.355 8.071 -18.918 1.00 0.00 H new ATOM 253 N ASP A 17 21.999 10.886 -18.651 1.00 0.00 N ATOM 254 CA ASP A 17 22.793 10.777 -19.921 1.00 0.00 C ATOM 255 C ASP A 17 23.736 9.531 -20.029 1.00 0.00 C ATOM 256 O ASP A 17 23.678 8.777 -21.001 1.00 0.00 O ATOM 257 CB ASP A 17 23.594 12.101 -20.085 1.00 0.00 C ATOM 258 CG ASP A 17 24.202 12.300 -21.478 1.00 0.00 C ATOM 259 OD1 ASP A 17 23.537 12.535 -22.486 1.00 0.00 O ATOM 260 OD2 ASP A 17 25.562 12.150 -21.491 1.00 0.00 O ATOM 0 H ASP A 17 22.024 11.814 -18.229 1.00 0.00 H new ATOM 0 HA ASP A 17 22.082 10.622 -20.733 1.00 0.00 H new ATOM 0 HB2 ASP A 17 22.935 12.941 -19.865 1.00 0.00 H new ATOM 0 HB3 ASP A 17 24.394 12.122 -19.345 1.00 0.00 H new ATOM 266 N GLU A 18 24.580 9.346 -19.009 1.00 0.00 N ATOM 267 CA GLU A 18 25.501 8.189 -18.888 1.00 0.00 C ATOM 268 C GLU A 18 24.829 6.796 -18.684 1.00 0.00 C ATOM 269 O GLU A 18 25.219 5.850 -19.374 1.00 0.00 O ATOM 270 CB GLU A 18 26.521 8.567 -17.781 1.00 0.00 C ATOM 271 CG GLU A 18 27.749 9.381 -18.272 1.00 0.00 C ATOM 272 CD GLU A 18 27.490 10.883 -18.449 1.00 0.00 C ATOM 273 OE1 GLU A 18 26.939 11.381 -19.431 1.00 0.00 O ATOM 274 OE2 GLU A 18 27.923 11.607 -17.379 1.00 0.00 O ATOM 0 H GLU A 18 24.651 9.999 -18.229 1.00 0.00 H new ATOM 0 HA GLU A 18 25.996 8.025 -19.845 1.00 0.00 H new ATOM 0 HB2 GLU A 18 26.005 9.144 -17.014 1.00 0.00 H new ATOM 0 HB3 GLU A 18 26.876 7.652 -17.307 1.00 0.00 H new ATOM 0 HG2 GLU A 18 28.565 9.248 -17.561 1.00 0.00 H new ATOM 0 HG3 GLU A 18 28.085 8.969 -19.224 1.00 0.00 H new ATOM 282 N TYR A 19 23.796 6.660 -17.828 1.00 0.00 N ATOM 283 CA TYR A 19 22.876 5.485 -17.854 1.00 0.00 C ATOM 284 C TYR A 19 22.243 5.188 -19.258 1.00 0.00 C ATOM 285 O TYR A 19 22.366 4.060 -19.733 1.00 0.00 O ATOM 286 CB TYR A 19 21.840 5.649 -16.700 1.00 0.00 C ATOM 287 CG TYR A 19 20.680 4.634 -16.683 1.00 0.00 C ATOM 288 CD1 TYR A 19 20.890 3.318 -16.260 1.00 0.00 C ATOM 289 CD2 TYR A 19 19.456 4.980 -17.272 1.00 0.00 C ATOM 290 CE1 TYR A 19 19.905 2.353 -16.467 1.00 0.00 C ATOM 291 CE2 TYR A 19 18.480 4.009 -17.483 1.00 0.00 C ATOM 292 CZ TYR A 19 18.715 2.694 -17.096 1.00 0.00 C ATOM 293 OH TYR A 19 17.804 1.723 -17.404 1.00 0.00 O ATOM 0 H TYR A 19 23.571 7.345 -17.107 1.00 0.00 H new ATOM 0 HA TYR A 19 23.457 4.580 -17.677 1.00 0.00 H new ATOM 0 HB2 TYR A 19 22.370 5.580 -15.750 1.00 0.00 H new ATOM 0 HB3 TYR A 19 21.418 6.652 -16.758 1.00 0.00 H new ATOM 0 HD1 TYR A 19 21.815 3.049 -15.773 1.00 0.00 H new ATOM 0 HD2 TYR A 19 19.269 6.003 -17.563 1.00 0.00 H new ATOM 0 HE1 TYR A 19 20.068 1.338 -16.137 1.00 0.00 H new ATOM 0 HE2 TYR A 19 17.542 4.277 -17.946 1.00 0.00 H new ATOM 0 HH TYR A 19 17.086 1.724 -16.737 1.00 0.00 H new ATOM 303 N MET A 20 21.599 6.166 -19.917 1.00 0.00 N ATOM 304 CA MET A 20 21.031 5.982 -21.283 1.00 0.00 C ATOM 305 C MET A 20 22.067 5.646 -22.411 1.00 0.00 C ATOM 306 O MET A 20 21.823 4.747 -23.221 1.00 0.00 O ATOM 307 CB MET A 20 20.192 7.231 -21.643 1.00 0.00 C ATOM 308 CG MET A 20 18.871 7.435 -20.874 1.00 0.00 C ATOM 309 SD MET A 20 17.898 8.748 -21.647 1.00 0.00 S ATOM 310 CE MET A 20 18.915 10.195 -21.296 1.00 0.00 C ATOM 0 H MET A 20 21.453 7.099 -19.532 1.00 0.00 H new ATOM 0 HA MET A 20 20.408 5.089 -21.238 1.00 0.00 H new ATOM 0 HB2 MET A 20 20.814 8.113 -21.487 1.00 0.00 H new ATOM 0 HB3 MET A 20 19.961 7.188 -22.707 1.00 0.00 H new ATOM 0 HG2 MET A 20 18.300 6.507 -20.864 1.00 0.00 H new ATOM 0 HG3 MET A 20 19.082 7.691 -19.836 1.00 0.00 H new ATOM 0 HE1 MET A 20 18.317 11.098 -21.417 1.00 0.00 H new ATOM 0 HE2 MET A 20 19.286 10.139 -20.273 1.00 0.00 H new ATOM 0 HE3 MET A 20 19.758 10.223 -21.986 1.00 0.00 H new ATOM 320 N LYS A 21 23.226 6.328 -22.458 1.00 0.00 N ATOM 321 CA LYS A 21 24.366 5.929 -23.331 1.00 0.00 C ATOM 322 C LYS A 21 24.968 4.503 -23.059 1.00 0.00 C ATOM 323 O LYS A 21 25.221 3.772 -24.020 1.00 0.00 O ATOM 324 CB LYS A 21 25.393 7.093 -23.279 1.00 0.00 C ATOM 325 CG LYS A 21 26.510 7.081 -24.348 1.00 0.00 C ATOM 326 CD LYS A 21 26.139 7.632 -25.747 1.00 0.00 C ATOM 327 CE LYS A 21 25.257 6.754 -26.663 1.00 0.00 C ATOM 328 NZ LYS A 21 23.847 7.207 -26.694 1.00 0.00 N ATOM 0 H LYS A 21 23.407 7.164 -21.902 1.00 0.00 H new ATOM 0 HA LYS A 21 24.007 5.788 -24.350 1.00 0.00 H new ATOM 0 HB2 LYS A 21 24.847 8.032 -23.367 1.00 0.00 H new ATOM 0 HB3 LYS A 21 25.863 7.089 -22.296 1.00 0.00 H new ATOM 0 HG2 LYS A 21 27.352 7.659 -23.967 1.00 0.00 H new ATOM 0 HG3 LYS A 21 26.856 6.054 -24.467 1.00 0.00 H new ATOM 0 HD2 LYS A 21 25.629 8.585 -25.606 1.00 0.00 H new ATOM 0 HD3 LYS A 21 27.066 7.843 -26.279 1.00 0.00 H new ATOM 0 HE2 LYS A 21 25.662 6.768 -27.675 1.00 0.00 H new ATOM 0 HE3 LYS A 21 25.296 5.721 -26.318 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 23.256 6.473 -27.135 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 23.517 7.380 -25.723 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 23.777 8.086 -27.246 1.00 0.00 H new ATOM 341 N ALA A 22 25.125 4.077 -21.790 1.00 0.00 N ATOM 342 CA ALA A 22 25.376 2.649 -21.440 1.00 0.00 C ATOM 343 C ALA A 22 24.236 1.625 -21.781 1.00 0.00 C ATOM 344 O ALA A 22 24.532 0.527 -22.255 1.00 0.00 O ATOM 345 CB ALA A 22 25.728 2.629 -19.941 1.00 0.00 C ATOM 0 H ALA A 22 25.084 4.698 -20.982 1.00 0.00 H new ATOM 0 HA ALA A 22 26.187 2.293 -22.075 1.00 0.00 H new ATOM 0 HB1 ALA A 22 25.923 1.604 -19.627 1.00 0.00 H new ATOM 0 HB2 ALA A 22 26.616 3.237 -19.768 1.00 0.00 H new ATOM 0 HB3 ALA A 22 24.894 3.032 -19.366 1.00 0.00 H new ATOM 351 N LEU A 23 22.954 1.983 -21.577 1.00 0.00 N ATOM 352 CA LEU A 23 21.771 1.181 -22.011 1.00 0.00 C ATOM 353 C LEU A 23 21.656 0.888 -23.551 1.00 0.00 C ATOM 354 O LEU A 23 21.196 -0.189 -23.942 1.00 0.00 O ATOM 355 CB LEU A 23 20.530 1.974 -21.490 1.00 0.00 C ATOM 356 CG LEU A 23 19.166 1.241 -21.474 1.00 0.00 C ATOM 357 CD1 LEU A 23 19.100 0.266 -20.292 1.00 0.00 C ATOM 358 CD2 LEU A 23 18.006 2.247 -21.359 1.00 0.00 C ATOM 0 H LEU A 23 22.697 2.847 -21.101 1.00 0.00 H new ATOM 0 HA LEU A 23 21.859 0.177 -21.595 1.00 0.00 H new ATOM 0 HB2 LEU A 23 20.745 2.305 -20.474 1.00 0.00 H new ATOM 0 HB3 LEU A 23 20.423 2.870 -22.102 1.00 0.00 H new ATOM 0 HG LEU A 23 19.071 0.691 -22.410 1.00 0.00 H new ATOM 0 HD11 LEU A 23 18.136 -0.242 -20.293 1.00 0.00 H new ATOM 0 HD12 LEU A 23 19.899 -0.470 -20.383 1.00 0.00 H new ATOM 0 HD13 LEU A 23 19.219 0.817 -19.359 1.00 0.00 H new ATOM 0 HD21 LEU A 23 17.058 1.709 -21.350 1.00 0.00 H new ATOM 0 HD22 LEU A 23 18.109 2.817 -20.436 1.00 0.00 H new ATOM 0 HD23 LEU A 23 18.029 2.928 -22.210 1.00 0.00 H new ATOM 370 N GLY A 24 22.034 1.861 -24.398 1.00 0.00 N ATOM 371 CA GLY A 24 21.923 1.768 -25.876 1.00 0.00 C ATOM 372 C GLY A 24 20.801 2.616 -26.511 1.00 0.00 C ATOM 373 O GLY A 24 20.038 2.093 -27.325 1.00 0.00 O ATOM 0 H GLY A 24 22.430 2.745 -24.079 1.00 0.00 H new ATOM 0 HA2 GLY A 24 22.875 2.069 -26.314 1.00 0.00 H new ATOM 0 HA3 GLY A 24 21.763 0.724 -26.146 1.00 0.00 H new ATOM 377 N VAL A 25 20.721 3.919 -26.184 1.00 0.00 N ATOM 378 CA VAL A 25 19.694 4.836 -26.778 1.00 0.00 C ATOM 379 C VAL A 25 20.208 5.555 -28.079 1.00 0.00 C ATOM 380 O VAL A 25 21.410 5.794 -28.257 1.00 0.00 O ATOM 381 CB VAL A 25 19.128 5.865 -25.733 1.00 0.00 C ATOM 382 CG1 VAL A 25 18.584 5.225 -24.436 1.00 0.00 C ATOM 383 CG2 VAL A 25 20.052 7.053 -25.377 1.00 0.00 C ATOM 0 H VAL A 25 21.345 4.372 -25.517 1.00 0.00 H new ATOM 0 HA VAL A 25 18.862 4.198 -27.076 1.00 0.00 H new ATOM 0 HB VAL A 25 18.290 6.281 -26.293 1.00 0.00 H new ATOM 0 HG11 VAL A 25 18.214 6.006 -23.772 1.00 0.00 H new ATOM 0 HG12 VAL A 25 17.771 4.542 -24.681 1.00 0.00 H new ATOM 0 HG13 VAL A 25 19.383 4.675 -23.939 1.00 0.00 H new ATOM 0 HG21 VAL A 25 19.556 7.694 -24.648 1.00 0.00 H new ATOM 0 HG22 VAL A 25 20.983 6.676 -24.954 1.00 0.00 H new ATOM 0 HG23 VAL A 25 20.269 7.627 -26.277 1.00 0.00 H new ATOM 393 N GLY A 26 19.271 6.017 -28.930 1.00 0.00 N ATOM 394 CA GLY A 26 19.582 7.025 -29.984 1.00 0.00 C ATOM 395 C GLY A 26 19.854 8.467 -29.480 1.00 0.00 C ATOM 396 O GLY A 26 19.416 8.871 -28.397 1.00 0.00 O ATOM 0 H GLY A 26 18.297 5.716 -28.916 1.00 0.00 H new ATOM 0 HA2 GLY A 26 20.455 6.684 -30.540 1.00 0.00 H new ATOM 0 HA3 GLY A 26 18.749 7.057 -30.687 1.00 0.00 H new ATOM 400 N PHE A 27 20.550 9.272 -30.303 1.00 0.00 N ATOM 401 CA PHE A 27 20.916 10.676 -29.935 1.00 0.00 C ATOM 402 C PHE A 27 19.718 11.642 -29.613 1.00 0.00 C ATOM 403 O PHE A 27 19.789 12.393 -28.636 1.00 0.00 O ATOM 404 CB PHE A 27 21.889 11.249 -31.007 1.00 0.00 C ATOM 405 CG PHE A 27 22.697 12.474 -30.534 1.00 0.00 C ATOM 406 CD1 PHE A 27 22.166 13.765 -30.650 1.00 0.00 C ATOM 407 CD2 PHE A 27 23.954 12.302 -29.944 1.00 0.00 C ATOM 408 CE1 PHE A 27 22.872 14.862 -30.163 1.00 0.00 C ATOM 409 CE2 PHE A 27 24.660 13.402 -29.460 1.00 0.00 C ATOM 410 CZ PHE A 27 24.116 14.680 -29.566 1.00 0.00 C ATOM 0 H PHE A 27 20.875 8.987 -31.227 1.00 0.00 H new ATOM 0 HA PHE A 27 21.420 10.617 -28.971 1.00 0.00 H new ATOM 0 HB2 PHE A 27 22.583 10.464 -31.309 1.00 0.00 H new ATOM 0 HB3 PHE A 27 21.316 11.525 -31.892 1.00 0.00 H new ATOM 0 HD1 PHE A 27 21.204 13.910 -31.119 1.00 0.00 H new ATOM 0 HD2 PHE A 27 24.379 11.312 -29.863 1.00 0.00 H new ATOM 0 HE1 PHE A 27 22.454 15.854 -30.249 1.00 0.00 H new ATOM 0 HE2 PHE A 27 25.629 13.264 -29.003 1.00 0.00 H new ATOM 0 HZ PHE A 27 24.660 15.531 -29.184 1.00 0.00 H new ATOM 420 N ALA A 28 18.611 11.587 -30.379 1.00 0.00 N ATOM 421 CA ALA A 28 17.339 12.270 -30.006 1.00 0.00 C ATOM 422 C ALA A 28 16.717 11.891 -28.616 1.00 0.00 C ATOM 423 O ALA A 28 16.254 12.784 -27.905 1.00 0.00 O ATOM 424 CB ALA A 28 16.349 12.041 -31.163 1.00 0.00 C ATOM 0 H ALA A 28 18.564 11.078 -31.262 1.00 0.00 H new ATOM 0 HA ALA A 28 17.571 13.325 -29.862 1.00 0.00 H new ATOM 0 HB1 ALA A 28 15.401 12.526 -30.932 1.00 0.00 H new ATOM 0 HB2 ALA A 28 16.758 12.463 -32.081 1.00 0.00 H new ATOM 0 HB3 ALA A 28 16.187 10.971 -31.297 1.00 0.00 H new ATOM 430 N THR A 29 16.762 10.606 -28.204 1.00 0.00 N ATOM 431 CA THR A 29 16.407 10.179 -26.815 1.00 0.00 C ATOM 432 C THR A 29 17.304 10.796 -25.689 1.00 0.00 C ATOM 433 O THR A 29 16.744 11.300 -24.714 1.00 0.00 O ATOM 434 CB THR A 29 16.357 8.623 -26.763 1.00 0.00 C ATOM 435 OG1 THR A 29 15.413 8.118 -27.702 1.00 0.00 O ATOM 436 CG2 THR A 29 15.944 8.032 -25.406 1.00 0.00 C ATOM 0 H THR A 29 17.041 9.835 -28.811 1.00 0.00 H new ATOM 0 HA THR A 29 15.420 10.584 -26.591 1.00 0.00 H new ATOM 0 HB THR A 29 17.383 8.327 -26.980 1.00 0.00 H new ATOM 0 HG1 THR A 29 15.397 7.139 -27.656 1.00 0.00 H new ATOM 0 HG21 THR A 29 15.938 6.944 -25.470 1.00 0.00 H new ATOM 0 HG22 THR A 29 16.653 8.347 -24.641 1.00 0.00 H new ATOM 0 HG23 THR A 29 14.947 8.385 -25.144 1.00 0.00 H new ATOM 444 N ARG A 30 18.652 10.785 -25.789 1.00 0.00 N ATOM 445 CA ARG A 30 19.524 11.496 -24.800 1.00 0.00 C ATOM 446 C ARG A 30 19.388 13.056 -24.714 1.00 0.00 C ATOM 447 O ARG A 30 19.508 13.613 -23.619 1.00 0.00 O ATOM 448 CB ARG A 30 20.996 11.000 -24.889 1.00 0.00 C ATOM 449 CG ARG A 30 21.829 11.539 -26.077 1.00 0.00 C ATOM 450 CD ARG A 30 23.252 10.975 -26.220 1.00 0.00 C ATOM 451 NE ARG A 30 24.182 11.565 -25.213 1.00 0.00 N ATOM 452 CZ ARG A 30 25.498 11.711 -25.366 1.00 0.00 C ATOM 453 NH1 ARG A 30 26.152 11.354 -26.444 1.00 0.00 N ATOM 454 NH2 ARG A 30 26.178 12.233 -24.389 1.00 0.00 N ATOM 0 H ARG A 30 19.163 10.303 -26.529 1.00 0.00 H new ATOM 0 HA ARG A 30 19.119 11.202 -23.832 1.00 0.00 H new ATOM 0 HB2 ARG A 30 21.505 11.270 -23.964 1.00 0.00 H new ATOM 0 HB3 ARG A 30 20.988 9.911 -24.942 1.00 0.00 H new ATOM 0 HG2 ARG A 30 21.285 11.333 -26.999 1.00 0.00 H new ATOM 0 HG3 ARG A 30 21.898 12.623 -25.983 1.00 0.00 H new ATOM 0 HD2 ARG A 30 23.228 9.892 -26.103 1.00 0.00 H new ATOM 0 HD3 ARG A 30 23.625 11.179 -27.224 1.00 0.00 H new ATOM 0 HE ARG A 30 23.776 11.884 -24.333 1.00 0.00 H new ATOM 0 HH11 ARG A 30 25.652 10.937 -27.229 1.00 0.00 H new ATOM 0 HH12 ARG A 30 27.161 11.493 -26.498 1.00 0.00 H new ATOM 0 HH21 ARG A 30 25.703 12.519 -23.533 1.00 0.00 H new ATOM 0 HH22 ARG A 30 27.187 12.357 -24.478 1.00 0.00 H new ATOM 468 N GLN A 31 19.089 13.749 -25.829 1.00 0.00 N ATOM 469 CA GLN A 31 18.572 15.149 -25.796 1.00 0.00 C ATOM 470 C GLN A 31 17.182 15.278 -25.076 1.00 0.00 C ATOM 471 O GLN A 31 17.094 15.978 -24.064 1.00 0.00 O ATOM 472 CB GLN A 31 18.564 15.741 -27.238 1.00 0.00 C ATOM 473 CG GLN A 31 19.916 15.822 -28.002 1.00 0.00 C ATOM 474 CD GLN A 31 20.977 16.748 -27.400 1.00 0.00 C ATOM 475 OE1 GLN A 31 21.030 17.941 -27.672 1.00 0.00 O ATOM 476 NE2 GLN A 31 21.859 16.237 -26.574 1.00 0.00 N ATOM 0 H GLN A 31 19.194 13.370 -26.770 1.00 0.00 H new ATOM 0 HA GLN A 31 19.251 15.744 -25.185 1.00 0.00 H new ATOM 0 HB2 GLN A 31 17.876 15.146 -27.839 1.00 0.00 H new ATOM 0 HB3 GLN A 31 18.151 16.748 -27.183 1.00 0.00 H new ATOM 0 HG2 GLN A 31 20.334 14.817 -28.066 1.00 0.00 H new ATOM 0 HG3 GLN A 31 19.714 16.149 -29.022 1.00 0.00 H new ATOM 0 HE21 GLN A 31 21.824 15.245 -26.341 1.00 0.00 H new ATOM 0 HE22 GLN A 31 22.580 16.832 -26.165 1.00 0.00 H new ATOM 485 N VAL A 32 16.135 14.562 -25.544 1.00 0.00 N ATOM 486 CA VAL A 32 14.773 14.531 -24.916 1.00 0.00 C ATOM 487 C VAL A 32 14.764 14.148 -23.395 1.00 0.00 C ATOM 488 O VAL A 32 14.290 14.949 -22.585 1.00 0.00 O ATOM 489 CB VAL A 32 13.817 13.672 -25.830 1.00 0.00 C ATOM 490 CG1 VAL A 32 12.497 13.201 -25.174 1.00 0.00 C ATOM 491 CG2 VAL A 32 13.428 14.411 -27.134 1.00 0.00 C ATOM 0 H VAL A 32 16.202 13.979 -26.378 1.00 0.00 H new ATOM 0 HA VAL A 32 14.381 15.547 -24.878 1.00 0.00 H new ATOM 0 HB VAL A 32 14.428 12.791 -26.028 1.00 0.00 H new ATOM 0 HG11 VAL A 32 11.920 12.620 -25.894 1.00 0.00 H new ATOM 0 HG12 VAL A 32 12.723 12.582 -24.306 1.00 0.00 H new ATOM 0 HG13 VAL A 32 11.917 14.069 -24.860 1.00 0.00 H new ATOM 0 HG21 VAL A 32 12.769 13.778 -27.728 1.00 0.00 H new ATOM 0 HG22 VAL A 32 12.913 15.339 -26.886 1.00 0.00 H new ATOM 0 HG23 VAL A 32 14.328 14.637 -27.706 1.00 0.00 H new ATOM 501 N GLY A 33 15.280 12.965 -23.004 1.00 0.00 N ATOM 502 CA GLY A 33 15.263 12.504 -21.585 1.00 0.00 C ATOM 503 C GLY A 33 15.994 13.323 -20.488 1.00 0.00 C ATOM 504 O GLY A 33 15.664 13.169 -19.309 1.00 0.00 O ATOM 0 H GLY A 33 15.717 12.304 -23.647 1.00 0.00 H new ATOM 0 HA2 GLY A 33 14.218 12.422 -21.285 1.00 0.00 H new ATOM 0 HA3 GLY A 33 15.680 11.497 -21.568 1.00 0.00 H new ATOM 508 N ASN A 34 16.967 14.165 -20.866 1.00 0.00 N ATOM 509 CA ASN A 34 17.592 15.160 -19.944 1.00 0.00 C ATOM 510 C ASN A 34 16.907 16.569 -19.932 1.00 0.00 C ATOM 511 O ASN A 34 16.815 17.155 -18.851 1.00 0.00 O ATOM 512 CB ASN A 34 19.115 15.258 -20.233 1.00 0.00 C ATOM 513 CG ASN A 34 19.916 13.990 -19.906 1.00 0.00 C ATOM 514 OD1 ASN A 34 20.119 13.613 -18.756 1.00 0.00 O ATOM 515 ND2 ASN A 34 20.377 13.275 -20.898 1.00 0.00 N ATOM 0 H ASN A 34 17.350 14.186 -21.811 1.00 0.00 H new ATOM 0 HA ASN A 34 17.433 14.784 -18.933 1.00 0.00 H new ATOM 0 HB2 ASN A 34 19.256 15.498 -21.287 1.00 0.00 H new ATOM 0 HB3 ASN A 34 19.527 16.089 -19.659 1.00 0.00 H new ATOM 0 HD21 ASN A 34 20.897 12.418 -20.710 1.00 0.00 H new ATOM 0 HD22 ASN A 34 20.217 13.574 -21.860 1.00 0.00 H new ATOM 522 N VAL A 35 16.433 17.131 -21.069 1.00 0.00 N ATOM 523 CA VAL A 35 15.698 18.444 -21.078 1.00 0.00 C ATOM 524 C VAL A 35 14.274 18.436 -20.416 1.00 0.00 C ATOM 525 O VAL A 35 13.917 19.412 -19.750 1.00 0.00 O ATOM 526 CB VAL A 35 15.678 19.148 -22.485 1.00 0.00 C ATOM 527 CG1 VAL A 35 17.083 19.441 -23.058 1.00 0.00 C ATOM 528 CG2 VAL A 35 14.824 18.458 -23.575 1.00 0.00 C ATOM 0 H VAL A 35 16.539 16.709 -21.992 1.00 0.00 H new ATOM 0 HA VAL A 35 16.310 19.055 -20.415 1.00 0.00 H new ATOM 0 HB VAL A 35 15.184 20.089 -22.243 1.00 0.00 H new ATOM 0 HG11 VAL A 35 16.986 19.926 -24.029 1.00 0.00 H new ATOM 0 HG12 VAL A 35 17.624 20.097 -22.377 1.00 0.00 H new ATOM 0 HG13 VAL A 35 17.631 18.506 -23.173 1.00 0.00 H new ATOM 0 HG21 VAL A 35 14.885 19.030 -24.501 1.00 0.00 H new ATOM 0 HG22 VAL A 35 15.199 17.449 -23.747 1.00 0.00 H new ATOM 0 HG23 VAL A 35 13.786 18.408 -23.247 1.00 0.00 H new ATOM 538 N THR A 36 13.458 17.380 -20.610 1.00 0.00 N ATOM 539 CA THR A 36 12.085 17.295 -20.027 1.00 0.00 C ATOM 540 C THR A 36 12.068 16.742 -18.561 1.00 0.00 C ATOM 541 O THR A 36 12.926 15.944 -18.164 1.00 0.00 O ATOM 542 CB THR A 36 11.160 16.509 -21.008 1.00 0.00 C ATOM 543 OG1 THR A 36 9.802 16.750 -20.662 1.00 0.00 O ATOM 544 CG2 THR A 36 11.319 14.980 -21.062 1.00 0.00 C ATOM 0 H THR A 36 13.719 16.566 -21.167 1.00 0.00 H new ATOM 0 HA THR A 36 11.687 18.304 -19.922 1.00 0.00 H new ATOM 0 HB THR A 36 11.463 16.884 -21.986 1.00 0.00 H new ATOM 0 HG1 THR A 36 9.248 16.003 -20.972 1.00 0.00 H new ATOM 0 HG21 THR A 36 10.615 14.566 -21.784 1.00 0.00 H new ATOM 0 HG22 THR A 36 12.336 14.730 -21.363 1.00 0.00 H new ATOM 0 HG23 THR A 36 11.118 14.558 -20.077 1.00 0.00 H new ATOM 552 N LYS A 37 11.044 17.123 -17.773 1.00 0.00 N ATOM 553 CA LYS A 37 10.771 16.502 -16.446 1.00 0.00 C ATOM 554 C LYS A 37 9.635 15.419 -16.572 1.00 0.00 C ATOM 555 O LYS A 37 8.456 15.789 -16.504 1.00 0.00 O ATOM 556 CB LYS A 37 10.564 17.602 -15.361 1.00 0.00 C ATOM 557 CG LYS A 37 9.348 18.558 -15.466 1.00 0.00 C ATOM 558 CD LYS A 37 9.294 19.564 -14.295 1.00 0.00 C ATOM 559 CE LYS A 37 8.024 20.434 -14.244 1.00 0.00 C ATOM 560 NZ LYS A 37 8.003 21.455 -15.312 1.00 0.00 N ATOM 0 H LYS A 37 10.386 17.860 -18.027 1.00 0.00 H new ATOM 0 HA LYS A 37 11.636 15.942 -16.092 1.00 0.00 H new ATOM 0 HB2 LYS A 37 10.503 17.101 -14.395 1.00 0.00 H new ATOM 0 HB3 LYS A 37 11.463 18.218 -15.344 1.00 0.00 H new ATOM 0 HG2 LYS A 37 9.397 19.103 -16.409 1.00 0.00 H new ATOM 0 HG3 LYS A 37 8.428 17.973 -15.483 1.00 0.00 H new ATOM 0 HD2 LYS A 37 9.377 19.013 -13.358 1.00 0.00 H new ATOM 0 HD3 LYS A 37 10.163 20.219 -14.358 1.00 0.00 H new ATOM 0 HE2 LYS A 37 7.145 19.796 -14.336 1.00 0.00 H new ATOM 0 HE3 LYS A 37 7.961 20.925 -13.273 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 7.131 22.016 -15.238 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 8.827 22.081 -15.210 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 8.036 20.987 -16.240 1.00 0.00 H new ATOM 573 N PRO A 38 9.890 14.083 -16.768 1.00 0.00 N ATOM 574 CA PRO A 38 8.806 13.089 -16.974 1.00 0.00 C ATOM 575 C PRO A 38 7.993 12.783 -15.684 1.00 0.00 C ATOM 576 O PRO A 38 8.527 12.311 -14.673 1.00 0.00 O ATOM 577 CB PRO A 38 9.544 11.872 -17.549 1.00 0.00 C ATOM 578 CG PRO A 38 10.966 12.000 -17.010 1.00 0.00 C ATOM 579 CD PRO A 38 11.227 13.509 -17.001 1.00 0.00 C ATOM 0 HA PRO A 38 8.028 13.451 -17.646 1.00 0.00 H new ATOM 0 HB2 PRO A 38 9.080 10.939 -17.229 1.00 0.00 H new ATOM 0 HB3 PRO A 38 9.530 11.878 -18.639 1.00 0.00 H new ATOM 0 HG2 PRO A 38 11.053 11.574 -16.010 1.00 0.00 H new ATOM 0 HG3 PRO A 38 11.681 11.475 -17.643 1.00 0.00 H new ATOM 0 HD2 PRO A 38 11.928 13.791 -16.216 1.00 0.00 H new ATOM 0 HD3 PRO A 38 11.652 13.849 -17.945 1.00 0.00 H new ATOM 587 N THR A 39 6.694 13.091 -15.763 1.00 0.00 N ATOM 588 CA THR A 39 5.758 13.018 -14.610 1.00 0.00 C ATOM 589 C THR A 39 5.144 11.586 -14.531 1.00 0.00 C ATOM 590 O THR A 39 4.555 11.077 -15.493 1.00 0.00 O ATOM 591 CB THR A 39 4.714 14.166 -14.743 1.00 0.00 C ATOM 592 OG1 THR A 39 5.384 15.426 -14.757 1.00 0.00 O ATOM 593 CG2 THR A 39 3.705 14.242 -13.586 1.00 0.00 C ATOM 0 H THR A 39 6.250 13.400 -16.627 1.00 0.00 H new ATOM 0 HA THR A 39 6.268 13.173 -13.659 1.00 0.00 H new ATOM 0 HB THR A 39 4.176 13.949 -15.666 1.00 0.00 H new ATOM 0 HG1 THR A 39 4.725 16.146 -14.842 1.00 0.00 H new ATOM 0 HG21 THR A 39 3.015 15.068 -13.758 1.00 0.00 H new ATOM 0 HG22 THR A 39 3.146 13.308 -13.529 1.00 0.00 H new ATOM 0 HG23 THR A 39 4.238 14.403 -12.649 1.00 0.00 H new ATOM 601 N VAL A 40 5.345 10.933 -13.380 1.00 0.00 N ATOM 602 CA VAL A 40 5.087 9.472 -13.218 1.00 0.00 C ATOM 603 C VAL A 40 3.766 9.278 -12.393 1.00 0.00 C ATOM 604 O VAL A 40 3.763 9.391 -11.165 1.00 0.00 O ATOM 605 CB VAL A 40 6.391 8.794 -12.657 1.00 0.00 C ATOM 606 CG1 VAL A 40 6.217 7.315 -12.265 1.00 0.00 C ATOM 607 CG2 VAL A 40 7.568 8.818 -13.667 1.00 0.00 C ATOM 0 H VAL A 40 5.688 11.386 -12.533 1.00 0.00 H new ATOM 0 HA VAL A 40 4.892 8.956 -14.158 1.00 0.00 H new ATOM 0 HB VAL A 40 6.606 9.396 -11.774 1.00 0.00 H new ATOM 0 HG11 VAL A 40 7.163 6.925 -11.888 1.00 0.00 H new ATOM 0 HG12 VAL A 40 5.455 7.231 -11.490 1.00 0.00 H new ATOM 0 HG13 VAL A 40 5.910 6.741 -13.139 1.00 0.00 H new ATOM 0 HG21 VAL A 40 8.439 8.336 -13.223 1.00 0.00 H new ATOM 0 HG22 VAL A 40 7.281 8.284 -14.573 1.00 0.00 H new ATOM 0 HG23 VAL A 40 7.813 9.851 -13.916 1.00 0.00 H new ATOM 617 N ILE A 41 2.638 8.979 -13.067 1.00 0.00 N ATOM 618 CA ILE A 41 1.314 8.755 -12.400 1.00 0.00 C ATOM 619 C ILE A 41 1.200 7.241 -12.036 1.00 0.00 C ATOM 620 O ILE A 41 0.967 6.403 -12.911 1.00 0.00 O ATOM 621 CB ILE A 41 0.100 9.280 -13.259 1.00 0.00 C ATOM 622 CG1 ILE A 41 0.195 10.799 -13.595 1.00 0.00 C ATOM 623 CG2 ILE A 41 -1.264 9.010 -12.560 1.00 0.00 C ATOM 624 CD1 ILE A 41 -0.712 11.275 -14.744 1.00 0.00 C ATOM 0 H ILE A 41 2.605 8.884 -14.082 1.00 0.00 H new ATOM 0 HA ILE A 41 1.265 9.345 -11.485 1.00 0.00 H new ATOM 0 HB ILE A 41 0.155 8.719 -14.192 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -0.052 11.369 -12.699 1.00 0.00 H new ATOM 0 HG13 ILE A 41 1.229 11.035 -13.848 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -2.074 9.387 -13.185 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -1.390 7.938 -12.410 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -1.285 9.516 -11.595 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -0.572 12.345 -14.899 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -0.454 10.739 -15.657 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -1.754 11.079 -14.490 1.00 0.00 H new ATOM 636 N ILE A 42 1.338 6.897 -10.746 1.00 0.00 N ATOM 637 CA ILE A 42 1.179 5.492 -10.261 1.00 0.00 C ATOM 638 C ILE A 42 -0.279 5.352 -9.716 1.00 0.00 C ATOM 639 O ILE A 42 -0.641 5.985 -8.719 1.00 0.00 O ATOM 640 CB ILE A 42 2.281 5.104 -9.212 1.00 0.00 C ATOM 641 CG1 ILE A 42 3.736 5.327 -9.730 1.00 0.00 C ATOM 642 CG2 ILE A 42 2.087 3.650 -8.695 1.00 0.00 C ATOM 643 CD1 ILE A 42 4.887 5.038 -8.754 1.00 0.00 C ATOM 0 H ILE A 42 1.560 7.565 -10.008 1.00 0.00 H new ATOM 0 HA ILE A 42 1.326 4.783 -11.075 1.00 0.00 H new ATOM 0 HB ILE A 42 2.148 5.788 -8.374 1.00 0.00 H new ATOM 0 HG12 ILE A 42 3.878 4.703 -10.613 1.00 0.00 H new ATOM 0 HG13 ILE A 42 3.822 6.364 -10.055 1.00 0.00 H new ATOM 0 HG21 ILE A 42 2.867 3.414 -7.971 1.00 0.00 H new ATOM 0 HG22 ILE A 42 1.111 3.560 -8.219 1.00 0.00 H new ATOM 0 HG23 ILE A 42 2.148 2.955 -9.532 1.00 0.00 H new ATOM 0 HD11 ILE A 42 5.839 5.235 -9.246 1.00 0.00 H new ATOM 0 HD12 ILE A 42 4.791 5.680 -7.878 1.00 0.00 H new ATOM 0 HD13 ILE A 42 4.848 3.994 -8.444 1.00 0.00 H new ATOM 655 N SER A 43 -1.100 4.512 -10.368 1.00 0.00 N ATOM 656 CA SER A 43 -2.529 4.332 -9.995 1.00 0.00 C ATOM 657 C SER A 43 -2.983 2.856 -10.198 1.00 0.00 C ATOM 658 O SER A 43 -2.895 2.321 -11.310 1.00 0.00 O ATOM 659 CB SER A 43 -3.409 5.296 -10.831 1.00 0.00 C ATOM 660 OG SER A 43 -3.340 5.020 -12.234 1.00 0.00 O ATOM 0 H SER A 43 -0.805 3.941 -11.160 1.00 0.00 H new ATOM 0 HA SER A 43 -2.645 4.567 -8.937 1.00 0.00 H new ATOM 0 HB2 SER A 43 -4.444 5.219 -10.499 1.00 0.00 H new ATOM 0 HB3 SER A 43 -3.092 6.323 -10.649 1.00 0.00 H new ATOM 0 HG SER A 43 -3.221 4.057 -12.373 1.00 0.00 H new ATOM 666 N GLN A 44 -3.523 2.214 -9.149 1.00 0.00 N ATOM 667 CA GLN A 44 -4.054 0.824 -9.235 1.00 0.00 C ATOM 668 C GLN A 44 -5.475 0.788 -9.885 1.00 0.00 C ATOM 669 O GLN A 44 -6.431 1.355 -9.345 1.00 0.00 O ATOM 670 CB GLN A 44 -4.039 0.163 -7.831 1.00 0.00 C ATOM 671 CG GLN A 44 -2.631 -0.108 -7.233 1.00 0.00 C ATOM 672 CD GLN A 44 -1.950 1.048 -6.481 1.00 0.00 C ATOM 673 OE1 GLN A 44 -2.565 2.008 -6.030 1.00 0.00 O ATOM 674 NE2 GLN A 44 -0.654 0.970 -6.294 1.00 0.00 N ATOM 0 H GLN A 44 -3.608 2.630 -8.222 1.00 0.00 H new ATOM 0 HA GLN A 44 -3.403 0.245 -9.890 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -4.590 0.803 -7.142 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -4.578 -0.783 -7.888 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -2.712 -0.954 -6.550 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -1.973 -0.416 -8.046 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -0.132 0.176 -6.665 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -0.168 1.703 -5.778 1.00 0.00 H new ATOM 683 N GLU A 45 -5.600 0.149 -11.062 1.00 0.00 N ATOM 684 CA GLU A 45 -6.840 0.214 -11.892 1.00 0.00 C ATOM 685 C GLU A 45 -7.348 -1.225 -12.224 1.00 0.00 C ATOM 686 O GLU A 45 -7.060 -1.775 -13.291 1.00 0.00 O ATOM 687 CB GLU A 45 -6.572 1.070 -13.166 1.00 0.00 C ATOM 688 CG GLU A 45 -6.300 2.578 -12.923 1.00 0.00 C ATOM 689 CD GLU A 45 -5.993 3.366 -14.194 1.00 0.00 C ATOM 690 OE1 GLU A 45 -4.856 3.663 -14.550 1.00 0.00 O ATOM 691 OE2 GLU A 45 -7.127 3.698 -14.879 1.00 0.00 O ATOM 0 H GLU A 45 -4.861 -0.423 -11.470 1.00 0.00 H new ATOM 0 HA GLU A 45 -7.637 0.704 -11.333 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -5.716 0.646 -13.692 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -7.432 0.978 -13.830 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -7.169 3.019 -12.435 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -5.462 2.679 -12.234 1.00 0.00 H new ATOM 699 N GLY A 46 -8.117 -1.835 -11.300 1.00 0.00 N ATOM 700 CA GLY A 46 -8.661 -3.212 -11.489 1.00 0.00 C ATOM 701 C GLY A 46 -7.639 -4.357 -11.324 1.00 0.00 C ATOM 702 O GLY A 46 -7.228 -4.964 -12.314 1.00 0.00 O ATOM 0 H GLY A 46 -8.380 -1.404 -10.414 1.00 0.00 H new ATOM 0 HA2 GLY A 46 -9.471 -3.365 -10.776 1.00 0.00 H new ATOM 0 HA3 GLY A 46 -9.097 -3.278 -12.486 1.00 0.00 H new ATOM 706 N ASP A 47 -7.214 -4.624 -10.075 1.00 0.00 N ATOM 707 CA ASP A 47 -6.101 -5.575 -9.747 1.00 0.00 C ATOM 708 C ASP A 47 -4.656 -5.098 -10.138 1.00 0.00 C ATOM 709 O ASP A 47 -3.752 -5.142 -9.299 1.00 0.00 O ATOM 710 CB ASP A 47 -6.429 -7.041 -10.160 1.00 0.00 C ATOM 711 CG ASP A 47 -5.593 -8.105 -9.448 1.00 0.00 C ATOM 712 OD1 ASP A 47 -5.857 -8.541 -8.334 1.00 0.00 O ATOM 713 OD2 ASP A 47 -4.517 -8.504 -10.181 1.00 0.00 O ATOM 0 H ASP A 47 -7.627 -4.190 -9.250 1.00 0.00 H new ATOM 0 HA ASP A 47 -6.052 -5.570 -8.658 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -7.483 -7.233 -9.961 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -6.283 -7.143 -11.235 1.00 0.00 H new ATOM 719 N LYS A 48 -4.429 -4.681 -11.394 1.00 0.00 N ATOM 720 CA LYS A 48 -3.103 -4.244 -11.893 1.00 0.00 C ATOM 721 C LYS A 48 -2.662 -2.816 -11.432 1.00 0.00 C ATOM 722 O LYS A 48 -3.463 -1.887 -11.274 1.00 0.00 O ATOM 723 CB LYS A 48 -3.133 -4.400 -13.439 1.00 0.00 C ATOM 724 CG LYS A 48 -4.039 -3.401 -14.200 1.00 0.00 C ATOM 725 CD LYS A 48 -4.422 -3.838 -15.624 1.00 0.00 C ATOM 726 CE LYS A 48 -5.520 -4.915 -15.663 1.00 0.00 C ATOM 727 NZ LYS A 48 -5.833 -5.256 -17.064 1.00 0.00 N ATOM 0 H LYS A 48 -5.162 -4.635 -12.102 1.00 0.00 H new ATOM 0 HA LYS A 48 -2.333 -4.875 -11.450 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -2.115 -4.298 -13.815 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -3.460 -5.412 -13.677 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -4.951 -3.247 -13.624 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -3.530 -2.439 -14.254 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -4.760 -2.966 -16.184 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -3.534 -4.218 -16.130 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -5.189 -5.805 -15.127 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -6.416 -4.553 -15.158 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -6.575 -5.984 -17.087 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -6.166 -4.406 -17.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -4.978 -5.619 -17.532 1.00 0.00 H new ATOM 740 N VAL A 49 -1.343 -2.653 -11.289 1.00 0.00 N ATOM 741 CA VAL A 49 -0.697 -1.338 -11.023 1.00 0.00 C ATOM 742 C VAL A 49 -0.389 -0.679 -12.409 1.00 0.00 C ATOM 743 O VAL A 49 0.403 -1.211 -13.198 1.00 0.00 O ATOM 744 CB VAL A 49 0.593 -1.501 -10.142 1.00 0.00 C ATOM 745 CG1 VAL A 49 1.213 -0.140 -9.742 1.00 0.00 C ATOM 746 CG2 VAL A 49 0.437 -2.330 -8.842 1.00 0.00 C ATOM 0 H VAL A 49 -0.680 -3.425 -11.353 1.00 0.00 H new ATOM 0 HA VAL A 49 -1.363 -0.693 -10.450 1.00 0.00 H new ATOM 0 HB VAL A 49 1.245 -2.061 -10.812 1.00 0.00 H new ATOM 0 HG11 VAL A 49 2.102 -0.310 -9.134 1.00 0.00 H new ATOM 0 HG12 VAL A 49 1.488 0.413 -10.640 1.00 0.00 H new ATOM 0 HG13 VAL A 49 0.486 0.437 -9.169 1.00 0.00 H new ATOM 0 HG21 VAL A 49 1.393 -2.372 -8.320 1.00 0.00 H new ATOM 0 HG22 VAL A 49 -0.307 -1.861 -8.199 1.00 0.00 H new ATOM 0 HG23 VAL A 49 0.116 -3.341 -9.092 1.00 0.00 H new ATOM 756 N VAL A 50 -1.014 0.475 -12.702 1.00 0.00 N ATOM 757 CA VAL A 50 -0.751 1.239 -13.956 1.00 0.00 C ATOM 758 C VAL A 50 0.233 2.402 -13.605 1.00 0.00 C ATOM 759 O VAL A 50 -0.119 3.323 -12.859 1.00 0.00 O ATOM 760 CB VAL A 50 -2.073 1.719 -14.649 1.00 0.00 C ATOM 761 CG1 VAL A 50 -1.813 2.495 -15.963 1.00 0.00 C ATOM 762 CG2 VAL A 50 -3.051 0.571 -15.000 1.00 0.00 C ATOM 0 H VAL A 50 -1.708 0.908 -12.092 1.00 0.00 H new ATOM 0 HA VAL A 50 -0.284 0.595 -14.702 1.00 0.00 H new ATOM 0 HB VAL A 50 -2.523 2.367 -13.897 1.00 0.00 H new ATOM 0 HG11 VAL A 50 -2.764 2.802 -16.398 1.00 0.00 H new ATOM 0 HG12 VAL A 50 -1.209 3.377 -15.751 1.00 0.00 H new ATOM 0 HG13 VAL A 50 -1.283 1.853 -16.666 1.00 0.00 H new ATOM 0 HG21 VAL A 50 -3.941 0.984 -15.476 1.00 0.00 H new ATOM 0 HG22 VAL A 50 -2.564 -0.126 -15.683 1.00 0.00 H new ATOM 0 HG23 VAL A 50 -3.338 0.046 -14.089 1.00 0.00 H new ATOM 772 N ILE A 51 1.458 2.361 -14.162 1.00 0.00 N ATOM 773 CA ILE A 51 2.442 3.479 -14.030 1.00 0.00 C ATOM 774 C ILE A 51 2.449 4.258 -15.387 1.00 0.00 C ATOM 775 O ILE A 51 2.888 3.747 -16.424 1.00 0.00 O ATOM 776 CB ILE A 51 3.858 3.010 -13.532 1.00 0.00 C ATOM 777 CG1 ILE A 51 3.794 2.258 -12.167 1.00 0.00 C ATOM 778 CG2 ILE A 51 4.853 4.199 -13.478 1.00 0.00 C ATOM 779 CD1 ILE A 51 5.128 1.790 -11.557 1.00 0.00 C ATOM 0 H ILE A 51 1.800 1.571 -14.709 1.00 0.00 H new ATOM 0 HA ILE A 51 2.135 4.160 -13.236 1.00 0.00 H new ATOM 0 HB ILE A 51 4.228 2.292 -14.264 1.00 0.00 H new ATOM 0 HG12 ILE A 51 3.303 2.910 -11.445 1.00 0.00 H new ATOM 0 HG13 ILE A 51 3.155 1.384 -12.293 1.00 0.00 H new ATOM 0 HG21 ILE A 51 5.824 3.846 -13.130 1.00 0.00 H new ATOM 0 HG22 ILE A 51 4.959 4.630 -14.473 1.00 0.00 H new ATOM 0 HG23 ILE A 51 4.476 4.958 -12.792 1.00 0.00 H new ATOM 0 HD11 ILE A 51 4.938 1.283 -10.611 1.00 0.00 H new ATOM 0 HD12 ILE A 51 5.621 1.103 -12.244 1.00 0.00 H new ATOM 0 HD13 ILE A 51 5.771 2.653 -11.383 1.00 0.00 H new ATOM 791 N ARG A 52 1.970 5.509 -15.349 1.00 0.00 N ATOM 792 CA ARG A 52 1.839 6.389 -16.534 1.00 0.00 C ATOM 793 C ARG A 52 3.040 7.376 -16.621 1.00 0.00 C ATOM 794 O ARG A 52 3.211 8.226 -15.744 1.00 0.00 O ATOM 795 CB ARG A 52 0.475 7.141 -16.420 1.00 0.00 C ATOM 796 CG ARG A 52 -0.459 6.976 -17.627 1.00 0.00 C ATOM 797 CD ARG A 52 0.029 7.721 -18.880 1.00 0.00 C ATOM 798 NE ARG A 52 -0.803 7.239 -20.004 1.00 0.00 N ATOM 799 CZ ARG A 52 -0.491 7.341 -21.293 1.00 0.00 C ATOM 800 NH1 ARG A 52 0.478 8.095 -21.738 1.00 0.00 N ATOM 801 NH2 ARG A 52 -1.180 6.651 -22.150 1.00 0.00 N ATOM 0 H ARG A 52 1.656 5.951 -14.485 1.00 0.00 H new ATOM 0 HA ARG A 52 1.854 5.802 -17.453 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -0.043 6.789 -15.528 1.00 0.00 H new ATOM 0 HB3 ARG A 52 0.674 8.203 -16.276 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -0.558 5.916 -17.859 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -1.452 7.338 -17.361 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -0.074 8.799 -18.755 1.00 0.00 H new ATOM 0 HD3 ARG A 52 1.084 7.521 -19.064 1.00 0.00 H new ATOM 0 HE ARG A 52 -1.689 6.791 -19.771 1.00 0.00 H new ATOM 0 HH11 ARG A 52 1.039 8.643 -21.085 1.00 0.00 H new ATOM 0 HH12 ARG A 52 0.674 8.136 -22.738 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -1.939 6.050 -21.829 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -0.963 6.710 -23.145 1.00 0.00 H new ATOM 815 N THR A 53 3.862 7.277 -17.676 1.00 0.00 N ATOM 816 CA THR A 53 5.059 8.155 -17.846 1.00 0.00 C ATOM 817 C THR A 53 4.740 9.272 -18.888 1.00 0.00 C ATOM 818 O THR A 53 4.775 9.043 -20.103 1.00 0.00 O ATOM 819 CB THR A 53 6.295 7.276 -18.205 1.00 0.00 C ATOM 820 OG1 THR A 53 6.482 6.275 -17.208 1.00 0.00 O ATOM 821 CG2 THR A 53 7.620 8.051 -18.268 1.00 0.00 C ATOM 0 H THR A 53 3.731 6.603 -18.430 1.00 0.00 H new ATOM 0 HA THR A 53 5.310 8.670 -16.919 1.00 0.00 H new ATOM 0 HB THR A 53 6.072 6.870 -19.192 1.00 0.00 H new ATOM 0 HG1 THR A 53 7.259 5.724 -17.439 1.00 0.00 H new ATOM 0 HG21 THR A 53 8.430 7.367 -18.523 1.00 0.00 H new ATOM 0 HG22 THR A 53 7.550 8.830 -19.027 1.00 0.00 H new ATOM 0 HG23 THR A 53 7.822 8.506 -17.298 1.00 0.00 H new ATOM 829 N LEU A 54 4.429 10.484 -18.397 1.00 0.00 N ATOM 830 CA LEU A 54 4.130 11.659 -19.261 1.00 0.00 C ATOM 831 C LEU A 54 5.387 12.576 -19.368 1.00 0.00 C ATOM 832 O LEU A 54 5.682 13.361 -18.460 1.00 0.00 O ATOM 833 CB LEU A 54 2.893 12.423 -18.702 1.00 0.00 C ATOM 834 CG LEU A 54 1.517 11.701 -18.729 1.00 0.00 C ATOM 835 CD1 LEU A 54 0.457 12.570 -18.032 1.00 0.00 C ATOM 836 CD2 LEU A 54 1.038 11.372 -20.155 1.00 0.00 C ATOM 0 H LEU A 54 4.376 10.685 -17.398 1.00 0.00 H new ATOM 0 HA LEU A 54 3.884 11.324 -20.269 1.00 0.00 H new ATOM 0 HB2 LEU A 54 3.107 12.695 -17.668 1.00 0.00 H new ATOM 0 HB3 LEU A 54 2.793 13.353 -19.262 1.00 0.00 H new ATOM 0 HG LEU A 54 1.650 10.756 -18.202 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -0.505 12.058 -18.054 1.00 0.00 H new ATOM 0 HD12 LEU A 54 0.752 12.743 -16.997 1.00 0.00 H new ATOM 0 HD13 LEU A 54 0.372 13.525 -18.550 1.00 0.00 H new ATOM 0 HD21 LEU A 54 0.072 10.869 -20.107 1.00 0.00 H new ATOM 0 HD22 LEU A 54 0.939 12.294 -20.727 1.00 0.00 H new ATOM 0 HD23 LEU A 54 1.763 10.720 -20.641 1.00 0.00 H new ATOM 848 N SER A 55 6.128 12.471 -20.486 1.00 0.00 N ATOM 849 CA SER A 55 7.315 13.339 -20.760 1.00 0.00 C ATOM 850 C SER A 55 7.124 14.582 -21.690 1.00 0.00 C ATOM 851 O SER A 55 8.104 15.289 -21.955 1.00 0.00 O ATOM 852 CB SER A 55 8.459 12.401 -21.228 1.00 0.00 C ATOM 853 OG SER A 55 8.355 12.053 -22.607 1.00 0.00 O ATOM 0 H SER A 55 5.934 11.794 -21.224 1.00 0.00 H new ATOM 0 HA SER A 55 7.549 13.850 -19.826 1.00 0.00 H new ATOM 0 HB2 SER A 55 9.418 12.888 -21.052 1.00 0.00 H new ATOM 0 HB3 SER A 55 8.448 11.492 -20.626 1.00 0.00 H new ATOM 0 HG SER A 55 7.965 11.158 -22.690 1.00 0.00 H new ATOM 859 N THR A 56 5.902 14.862 -22.186 1.00 0.00 N ATOM 860 CA THR A 56 5.628 15.840 -23.289 1.00 0.00 C ATOM 861 C THR A 56 5.940 15.271 -24.713 1.00 0.00 C ATOM 862 O THR A 56 5.044 15.210 -25.558 1.00 0.00 O ATOM 863 CB THR A 56 6.091 17.323 -23.102 1.00 0.00 C ATOM 864 OG1 THR A 56 7.507 17.416 -23.137 1.00 0.00 O ATOM 865 CG2 THR A 56 5.625 17.988 -21.798 1.00 0.00 C ATOM 0 H THR A 56 5.056 14.414 -21.834 1.00 0.00 H new ATOM 0 HA THR A 56 4.547 15.949 -23.202 1.00 0.00 H new ATOM 0 HB THR A 56 5.622 17.852 -23.932 1.00 0.00 H new ATOM 0 HG1 THR A 56 7.896 16.525 -23.017 1.00 0.00 H new ATOM 0 HG21 THR A 56 5.995 19.013 -21.760 1.00 0.00 H new ATOM 0 HG22 THR A 56 4.536 17.994 -21.762 1.00 0.00 H new ATOM 0 HG23 THR A 56 6.013 17.430 -20.946 1.00 0.00 H new ATOM 873 N PHE A 57 7.184 14.827 -24.957 1.00 0.00 N ATOM 874 CA PHE A 57 7.620 14.210 -26.242 1.00 0.00 C ATOM 875 C PHE A 57 7.152 12.715 -26.374 1.00 0.00 C ATOM 876 O PHE A 57 6.385 12.389 -27.282 1.00 0.00 O ATOM 877 CB PHE A 57 9.168 14.354 -26.394 1.00 0.00 C ATOM 878 CG PHE A 57 9.796 15.761 -26.293 1.00 0.00 C ATOM 879 CD1 PHE A 57 10.171 16.258 -25.038 1.00 0.00 C ATOM 880 CD2 PHE A 57 10.046 16.529 -27.435 1.00 0.00 C ATOM 881 CE1 PHE A 57 10.781 17.503 -24.928 1.00 0.00 C ATOM 882 CE2 PHE A 57 10.668 17.773 -27.322 1.00 0.00 C ATOM 883 CZ PHE A 57 11.035 18.256 -26.067 1.00 0.00 C ATOM 0 H PHE A 57 7.932 14.882 -24.266 1.00 0.00 H new ATOM 0 HA PHE A 57 7.138 14.745 -27.060 1.00 0.00 H new ATOM 0 HB2 PHE A 57 9.634 13.729 -25.633 1.00 0.00 H new ATOM 0 HB3 PHE A 57 9.445 13.937 -27.362 1.00 0.00 H new ATOM 0 HD1 PHE A 57 9.985 15.671 -24.151 1.00 0.00 H new ATOM 0 HD2 PHE A 57 9.757 16.158 -28.407 1.00 0.00 H new ATOM 0 HE1 PHE A 57 11.057 17.885 -23.956 1.00 0.00 H new ATOM 0 HE2 PHE A 57 10.865 18.361 -28.206 1.00 0.00 H new ATOM 0 HZ PHE A 57 11.518 19.218 -25.980 1.00 0.00 H new ATOM 893 N LYS A 58 7.605 11.820 -25.471 1.00 0.00 N ATOM 894 CA LYS A 58 7.183 10.392 -25.430 1.00 0.00 C ATOM 895 C LYS A 58 6.205 10.173 -24.230 1.00 0.00 C ATOM 896 O LYS A 58 6.577 10.373 -23.066 1.00 0.00 O ATOM 897 CB LYS A 58 8.436 9.482 -25.280 1.00 0.00 C ATOM 898 CG LYS A 58 9.463 9.460 -26.439 1.00 0.00 C ATOM 899 CD LYS A 58 8.963 8.775 -27.728 1.00 0.00 C ATOM 900 CE LYS A 58 10.067 8.669 -28.795 1.00 0.00 C ATOM 901 NZ LYS A 58 9.550 8.018 -30.015 1.00 0.00 N ATOM 0 H LYS A 58 8.277 12.063 -24.743 1.00 0.00 H new ATOM 0 HA LYS A 58 6.670 10.133 -26.356 1.00 0.00 H new ATOM 0 HB2 LYS A 58 8.962 9.784 -24.374 1.00 0.00 H new ATOM 0 HB3 LYS A 58 8.090 8.461 -25.122 1.00 0.00 H new ATOM 0 HG2 LYS A 58 9.747 10.486 -26.675 1.00 0.00 H new ATOM 0 HG3 LYS A 58 10.364 8.950 -26.099 1.00 0.00 H new ATOM 0 HD2 LYS A 58 8.595 7.778 -27.488 1.00 0.00 H new ATOM 0 HD3 LYS A 58 8.121 9.337 -28.133 1.00 0.00 H new ATOM 0 HE2 LYS A 58 10.442 9.663 -29.038 1.00 0.00 H new ATOM 0 HE3 LYS A 58 10.908 8.099 -28.400 1.00 0.00 H new ATOM 0 HZ1 LYS A 58 10.309 7.955 -30.723 1.00 0.00 H new ATOM 0 HZ2 LYS A 58 9.214 7.062 -29.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 58 8.763 8.578 -30.400 1.00 0.00 H new ATOM 914 N ASN A 59 4.952 9.777 -24.506 1.00 0.00 N ATOM 915 CA ASN A 59 3.889 9.692 -23.461 1.00 0.00 C ATOM 916 C ASN A 59 3.342 8.231 -23.379 1.00 0.00 C ATOM 917 O ASN A 59 2.322 7.898 -23.995 1.00 0.00 O ATOM 918 CB ASN A 59 2.798 10.761 -23.762 1.00 0.00 C ATOM 919 CG ASN A 59 3.269 12.225 -23.687 1.00 0.00 C ATOM 920 OD1 ASN A 59 3.719 12.708 -22.652 1.00 0.00 O ATOM 921 ND2 ASN A 59 3.203 12.951 -24.779 1.00 0.00 N ATOM 0 H ASN A 59 4.639 9.509 -25.439 1.00 0.00 H new ATOM 0 HA ASN A 59 4.288 9.917 -22.472 1.00 0.00 H new ATOM 0 HB2 ASN A 59 2.398 10.576 -24.759 1.00 0.00 H new ATOM 0 HB3 ASN A 59 1.976 10.625 -23.059 1.00 0.00 H new ATOM 0 HD21 ASN A 59 3.526 13.918 -24.769 1.00 0.00 H new ATOM 0 HD22 ASN A 59 2.829 12.548 -25.638 1.00 0.00 H new ATOM 928 N THR A 60 4.010 7.363 -22.596 1.00 0.00 N ATOM 929 CA THR A 60 3.702 5.898 -22.531 1.00 0.00 C ATOM 930 C THR A 60 3.129 5.440 -21.142 1.00 0.00 C ATOM 931 O THR A 60 2.994 6.221 -20.193 1.00 0.00 O ATOM 932 CB THR A 60 4.951 5.103 -23.048 1.00 0.00 C ATOM 933 OG1 THR A 60 4.578 3.752 -23.302 1.00 0.00 O ATOM 934 CG2 THR A 60 6.181 5.058 -22.123 1.00 0.00 C ATOM 0 H THR A 60 4.779 7.644 -21.987 1.00 0.00 H new ATOM 0 HA THR A 60 2.872 5.664 -23.197 1.00 0.00 H new ATOM 0 HB THR A 60 5.257 5.658 -23.935 1.00 0.00 H new ATOM 0 HG1 THR A 60 5.357 3.253 -23.627 1.00 0.00 H new ATOM 0 HG21 THR A 60 6.972 4.478 -22.598 1.00 0.00 H new ATOM 0 HG22 THR A 60 6.535 6.072 -21.939 1.00 0.00 H new ATOM 0 HG23 THR A 60 5.908 4.591 -21.177 1.00 0.00 H new ATOM 942 N GLU A 61 2.758 4.151 -21.033 1.00 0.00 N ATOM 943 CA GLU A 61 2.338 3.525 -19.744 1.00 0.00 C ATOM 944 C GLU A 61 2.741 2.018 -19.634 1.00 0.00 C ATOM 945 O GLU A 61 2.917 1.312 -20.636 1.00 0.00 O ATOM 946 CB GLU A 61 0.827 3.779 -19.460 1.00 0.00 C ATOM 947 CG GLU A 61 -0.208 3.104 -20.394 1.00 0.00 C ATOM 948 CD GLU A 61 -1.651 3.468 -20.044 1.00 0.00 C ATOM 949 OE1 GLU A 61 -2.172 4.545 -20.330 1.00 0.00 O ATOM 950 OE2 GLU A 61 -2.290 2.471 -19.372 1.00 0.00 O ATOM 0 H GLU A 61 2.737 3.509 -21.825 1.00 0.00 H new ATOM 0 HA GLU A 61 2.898 4.021 -18.951 1.00 0.00 H new ATOM 0 HB2 GLU A 61 0.619 3.455 -18.440 1.00 0.00 H new ATOM 0 HB3 GLU A 61 0.656 4.855 -19.494 1.00 0.00 H new ATOM 0 HG2 GLU A 61 -0.005 3.396 -21.424 1.00 0.00 H new ATOM 0 HG3 GLU A 61 -0.088 2.022 -20.339 1.00 0.00 H new ATOM 958 N ILE A 62 2.860 1.534 -18.386 1.00 0.00 N ATOM 959 CA ILE A 62 3.058 0.085 -18.068 1.00 0.00 C ATOM 960 C ILE A 62 1.898 -0.410 -17.144 1.00 0.00 C ATOM 961 O ILE A 62 1.579 0.224 -16.135 1.00 0.00 O ATOM 962 CB ILE A 62 4.467 -0.232 -17.452 1.00 0.00 C ATOM 963 CG1 ILE A 62 4.823 0.569 -16.173 1.00 0.00 C ATOM 964 CG2 ILE A 62 5.580 -0.125 -18.513 1.00 0.00 C ATOM 965 CD1 ILE A 62 6.083 0.122 -15.420 1.00 0.00 C ATOM 0 H ILE A 62 2.823 2.128 -17.558 1.00 0.00 H new ATOM 0 HA ILE A 62 3.030 -0.464 -19.009 1.00 0.00 H new ATOM 0 HB ILE A 62 4.396 -1.267 -17.116 1.00 0.00 H new ATOM 0 HG12 ILE A 62 4.942 1.617 -16.448 1.00 0.00 H new ATOM 0 HG13 ILE A 62 3.977 0.513 -15.488 1.00 0.00 H new ATOM 0 HG21 ILE A 62 6.543 -0.350 -18.054 1.00 0.00 H new ATOM 0 HG22 ILE A 62 5.386 -0.835 -19.317 1.00 0.00 H new ATOM 0 HG23 ILE A 62 5.599 0.886 -18.919 1.00 0.00 H new ATOM 0 HD11 ILE A 62 6.228 0.756 -14.545 1.00 0.00 H new ATOM 0 HD12 ILE A 62 5.969 -0.914 -15.102 1.00 0.00 H new ATOM 0 HD13 ILE A 62 6.949 0.207 -16.077 1.00 0.00 H new ATOM 977 N SER A 63 1.293 -1.556 -17.487 1.00 0.00 N ATOM 978 CA SER A 63 0.120 -2.121 -16.754 1.00 0.00 C ATOM 979 C SER A 63 0.424 -3.575 -16.280 1.00 0.00 C ATOM 980 O SER A 63 0.516 -4.482 -17.117 1.00 0.00 O ATOM 981 CB SER A 63 -1.119 -2.066 -17.682 1.00 0.00 C ATOM 982 OG SER A 63 -0.987 -2.947 -18.802 1.00 0.00 O ATOM 0 H SER A 63 1.592 -2.127 -18.277 1.00 0.00 H new ATOM 0 HA SER A 63 -0.085 -1.531 -15.861 1.00 0.00 H new ATOM 0 HB2 SER A 63 -2.010 -2.332 -17.114 1.00 0.00 H new ATOM 0 HB3 SER A 63 -1.261 -1.046 -18.038 1.00 0.00 H new ATOM 0 HG SER A 63 -0.451 -3.726 -18.544 1.00 0.00 H new ATOM 988 N PHE A 64 0.597 -3.796 -14.965 1.00 0.00 N ATOM 989 CA PHE A 64 1.203 -5.058 -14.437 1.00 0.00 C ATOM 990 C PHE A 64 0.529 -5.573 -13.126 1.00 0.00 C ATOM 991 O PHE A 64 0.241 -4.806 -12.203 1.00 0.00 O ATOM 992 CB PHE A 64 2.744 -4.882 -14.280 1.00 0.00 C ATOM 993 CG PHE A 64 3.252 -3.769 -13.340 1.00 0.00 C ATOM 994 CD1 PHE A 64 3.438 -4.016 -11.976 1.00 0.00 C ATOM 995 CD2 PHE A 64 3.487 -2.484 -13.843 1.00 0.00 C ATOM 996 CE1 PHE A 64 3.850 -2.990 -11.128 1.00 0.00 C ATOM 997 CE2 PHE A 64 3.887 -1.461 -12.989 1.00 0.00 C ATOM 998 CZ PHE A 64 4.071 -1.716 -11.634 1.00 0.00 C ATOM 0 H PHE A 64 0.331 -3.128 -14.241 1.00 0.00 H new ATOM 0 HA PHE A 64 1.013 -5.841 -15.171 1.00 0.00 H new ATOM 0 HB2 PHE A 64 3.155 -5.829 -13.929 1.00 0.00 H new ATOM 0 HB3 PHE A 64 3.162 -4.700 -15.270 1.00 0.00 H new ATOM 0 HD1 PHE A 64 3.262 -5.005 -11.579 1.00 0.00 H new ATOM 0 HD2 PHE A 64 3.357 -2.286 -14.897 1.00 0.00 H new ATOM 0 HE1 PHE A 64 3.998 -3.186 -10.076 1.00 0.00 H new ATOM 0 HE2 PHE A 64 4.055 -0.468 -13.379 1.00 0.00 H new ATOM 0 HZ PHE A 64 4.386 -0.921 -10.974 1.00 0.00 H new ATOM 1008 N GLN A 65 0.337 -6.899 -13.019 1.00 0.00 N ATOM 1009 CA GLN A 65 -0.268 -7.545 -11.807 1.00 0.00 C ATOM 1010 C GLN A 65 0.741 -8.061 -10.710 1.00 0.00 C ATOM 1011 O GLN A 65 0.368 -8.919 -9.907 1.00 0.00 O ATOM 1012 CB GLN A 65 -1.223 -8.667 -12.321 1.00 0.00 C ATOM 1013 CG GLN A 65 -2.487 -8.181 -13.081 1.00 0.00 C ATOM 1014 CD GLN A 65 -3.349 -9.311 -13.647 1.00 0.00 C ATOM 1015 OE1 GLN A 65 -3.059 -9.888 -14.688 1.00 0.00 O ATOM 1016 NE2 GLN A 65 -4.432 -9.661 -12.996 1.00 0.00 N ATOM 0 H GLN A 65 0.589 -7.560 -13.754 1.00 0.00 H new ATOM 0 HA GLN A 65 -0.807 -6.775 -11.255 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -0.657 -9.327 -12.979 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -1.542 -9.265 -11.468 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -3.095 -7.579 -12.406 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -2.178 -7.530 -13.899 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -4.681 -9.186 -12.128 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -5.025 -10.408 -13.357 1.00 0.00 H new ATOM 1025 N LEU A 66 1.977 -7.514 -10.625 1.00 0.00 N ATOM 1026 CA LEU A 66 3.012 -7.871 -9.598 1.00 0.00 C ATOM 1027 C LEU A 66 3.571 -9.325 -9.745 1.00 0.00 C ATOM 1028 O LEU A 66 2.877 -10.302 -9.449 1.00 0.00 O ATOM 1029 CB LEU A 66 2.599 -7.531 -8.133 1.00 0.00 C ATOM 1030 CG LEU A 66 2.264 -6.048 -7.819 1.00 0.00 C ATOM 1031 CD1 LEU A 66 1.731 -5.907 -6.383 1.00 0.00 C ATOM 1032 CD2 LEU A 66 3.481 -5.125 -7.987 1.00 0.00 C ATOM 0 H LEU A 66 2.299 -6.798 -11.276 1.00 0.00 H new ATOM 0 HA LEU A 66 3.848 -7.208 -9.824 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.729 -8.136 -7.878 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.408 -7.842 -7.472 1.00 0.00 H new ATOM 0 HG LEU A 66 1.501 -5.745 -8.536 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.502 -4.861 -6.181 1.00 0.00 H new ATOM 0 HD12 LEU A 66 0.827 -6.505 -6.270 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.486 -6.255 -5.679 1.00 0.00 H new ATOM 0 HD21 LEU A 66 3.194 -4.099 -7.756 1.00 0.00 H new ATOM 0 HD22 LEU A 66 4.274 -5.442 -7.310 1.00 0.00 H new ATOM 0 HD23 LEU A 66 3.839 -5.179 -9.015 1.00 0.00 H new ATOM 1044 N GLY A 67 4.808 -9.481 -10.255 1.00 0.00 N ATOM 1045 CA GLY A 67 5.310 -10.812 -10.718 1.00 0.00 C ATOM 1046 C GLY A 67 4.944 -11.284 -12.153 1.00 0.00 C ATOM 1047 O GLY A 67 5.623 -12.163 -12.684 1.00 0.00 O ATOM 0 H GLY A 67 5.479 -8.720 -10.361 1.00 0.00 H new ATOM 0 HA2 GLY A 67 6.397 -10.802 -10.639 1.00 0.00 H new ATOM 0 HA3 GLY A 67 4.947 -11.565 -10.019 1.00 0.00 H new ATOM 1051 N GLU A 68 3.894 -10.724 -12.779 1.00 0.00 N ATOM 1052 CA GLU A 68 3.470 -11.071 -14.158 1.00 0.00 C ATOM 1053 C GLU A 68 4.370 -10.377 -15.230 1.00 0.00 C ATOM 1054 O GLU A 68 4.499 -9.147 -15.258 1.00 0.00 O ATOM 1055 CB GLU A 68 1.968 -10.684 -14.288 1.00 0.00 C ATOM 1056 CG GLU A 68 1.263 -11.084 -15.611 1.00 0.00 C ATOM 1057 CD GLU A 68 1.168 -12.589 -15.866 1.00 0.00 C ATOM 1058 OE1 GLU A 68 2.091 -13.264 -16.313 1.00 0.00 O ATOM 1059 OE2 GLU A 68 -0.051 -13.099 -15.535 1.00 0.00 O ATOM 0 H GLU A 68 3.308 -10.012 -12.344 1.00 0.00 H new ATOM 0 HA GLU A 68 3.589 -12.139 -14.342 1.00 0.00 H new ATOM 0 HB2 GLU A 68 1.425 -11.140 -13.460 1.00 0.00 H new ATOM 0 HB3 GLU A 68 1.882 -9.604 -14.168 1.00 0.00 H new ATOM 0 HG2 GLU A 68 0.256 -10.667 -15.608 1.00 0.00 H new ATOM 0 HG3 GLU A 68 1.796 -10.623 -16.443 1.00 0.00 H new ATOM 1067 N GLU A 69 4.980 -11.184 -16.114 1.00 0.00 N ATOM 1068 CA GLU A 69 5.848 -10.667 -17.206 1.00 0.00 C ATOM 1069 C GLU A 69 5.025 -10.251 -18.470 1.00 0.00 C ATOM 1070 O GLU A 69 4.167 -10.991 -18.962 1.00 0.00 O ATOM 1071 CB GLU A 69 6.968 -11.700 -17.496 1.00 0.00 C ATOM 1072 CG GLU A 69 8.082 -11.164 -18.435 1.00 0.00 C ATOM 1073 CD GLU A 69 9.376 -11.969 -18.422 1.00 0.00 C ATOM 1074 OE1 GLU A 69 9.697 -12.769 -19.295 1.00 0.00 O ATOM 1075 OE2 GLU A 69 10.153 -11.662 -17.346 1.00 0.00 O ATOM 0 H GLU A 69 4.893 -12.200 -16.101 1.00 0.00 H new ATOM 0 HA GLU A 69 6.327 -9.742 -16.884 1.00 0.00 H new ATOM 0 HB2 GLU A 69 7.418 -12.010 -16.553 1.00 0.00 H new ATOM 0 HB3 GLU A 69 6.524 -12.589 -17.944 1.00 0.00 H new ATOM 0 HG2 GLU A 69 7.697 -11.140 -19.454 1.00 0.00 H new ATOM 0 HG3 GLU A 69 8.309 -10.135 -18.155 1.00 0.00 H new ATOM 1083 N PHE A 70 5.310 -9.046 -18.981 1.00 0.00 N ATOM 1084 CA PHE A 70 4.556 -8.409 -20.094 1.00 0.00 C ATOM 1085 C PHE A 70 5.526 -7.862 -21.194 1.00 0.00 C ATOM 1086 O PHE A 70 6.702 -7.578 -20.946 1.00 0.00 O ATOM 1087 CB PHE A 70 3.581 -7.342 -19.498 1.00 0.00 C ATOM 1088 CG PHE A 70 4.199 -6.083 -18.849 1.00 0.00 C ATOM 1089 CD1 PHE A 70 4.651 -6.115 -17.524 1.00 0.00 C ATOM 1090 CD2 PHE A 70 4.358 -4.914 -19.599 1.00 0.00 C ATOM 1091 CE1 PHE A 70 5.295 -5.009 -16.975 1.00 0.00 C ATOM 1092 CE2 PHE A 70 4.980 -3.802 -19.039 1.00 0.00 C ATOM 1093 CZ PHE A 70 5.459 -3.854 -17.732 1.00 0.00 C ATOM 0 H PHE A 70 6.078 -8.471 -18.636 1.00 0.00 H new ATOM 0 HA PHE A 70 3.943 -9.145 -20.614 1.00 0.00 H new ATOM 0 HB2 PHE A 70 2.915 -7.014 -20.296 1.00 0.00 H new ATOM 0 HB3 PHE A 70 2.962 -7.836 -18.749 1.00 0.00 H new ATOM 0 HD1 PHE A 70 4.500 -7.001 -16.925 1.00 0.00 H new ATOM 0 HD2 PHE A 70 3.997 -4.874 -20.616 1.00 0.00 H new ATOM 0 HE1 PHE A 70 5.667 -5.048 -15.962 1.00 0.00 H new ATOM 0 HE2 PHE A 70 5.091 -2.898 -19.619 1.00 0.00 H new ATOM 0 HZ PHE A 70 5.958 -2.996 -17.306 1.00 0.00 H new ATOM 1103 N ASP A 71 5.027 -7.694 -22.431 1.00 0.00 N ATOM 1104 CA ASP A 71 5.836 -7.076 -23.528 1.00 0.00 C ATOM 1105 C ASP A 71 5.612 -5.532 -23.586 1.00 0.00 C ATOM 1106 O ASP A 71 4.476 -5.054 -23.507 1.00 0.00 O ATOM 1107 CB ASP A 71 5.509 -7.728 -24.895 1.00 0.00 C ATOM 1108 CG ASP A 71 5.964 -9.177 -25.091 1.00 0.00 C ATOM 1109 OD1 ASP A 71 6.653 -9.551 -26.034 1.00 0.00 O ATOM 1110 OD2 ASP A 71 5.511 -9.995 -24.098 1.00 0.00 O ATOM 0 H ASP A 71 4.084 -7.968 -22.706 1.00 0.00 H new ATOM 0 HA ASP A 71 6.888 -7.258 -23.309 1.00 0.00 H new ATOM 0 HB2 ASP A 71 4.430 -7.687 -25.042 1.00 0.00 H new ATOM 0 HB3 ASP A 71 5.961 -7.120 -25.679 1.00 0.00 H new ATOM 1116 N GLU A 72 6.704 -4.766 -23.745 1.00 0.00 N ATOM 1117 CA GLU A 72 6.640 -3.277 -23.785 1.00 0.00 C ATOM 1118 C GLU A 72 7.620 -2.701 -24.853 1.00 0.00 C ATOM 1119 O GLU A 72 8.842 -2.823 -24.713 1.00 0.00 O ATOM 1120 CB GLU A 72 6.943 -2.713 -22.366 1.00 0.00 C ATOM 1121 CG GLU A 72 6.666 -1.196 -22.169 1.00 0.00 C ATOM 1122 CD GLU A 72 5.199 -0.763 -22.054 1.00 0.00 C ATOM 1123 OE1 GLU A 72 4.237 -1.524 -22.112 1.00 0.00 O ATOM 1124 OE2 GLU A 72 5.088 0.571 -21.797 1.00 0.00 O ATOM 0 H GLU A 72 7.646 -5.143 -23.849 1.00 0.00 H new ATOM 0 HA GLU A 72 5.637 -2.968 -24.079 1.00 0.00 H new ATOM 0 HB2 GLU A 72 6.350 -3.269 -21.640 1.00 0.00 H new ATOM 0 HB3 GLU A 72 7.991 -2.905 -22.135 1.00 0.00 H new ATOM 0 HG2 GLU A 72 7.186 -0.871 -21.268 1.00 0.00 H new ATOM 0 HG3 GLU A 72 7.113 -0.659 -23.006 1.00 0.00 H new ATOM 1132 N THR A 73 7.085 -1.991 -25.865 1.00 0.00 N ATOM 1133 CA THR A 73 7.896 -1.085 -26.736 1.00 0.00 C ATOM 1134 C THR A 73 8.059 0.293 -26.015 1.00 0.00 C ATOM 1135 O THR A 73 7.087 1.018 -25.779 1.00 0.00 O ATOM 1136 CB THR A 73 7.274 -0.966 -28.159 1.00 0.00 C ATOM 1137 OG1 THR A 73 7.186 -2.253 -28.762 1.00 0.00 O ATOM 1138 CG2 THR A 73 8.096 -0.109 -29.140 1.00 0.00 C ATOM 0 H THR A 73 6.095 -2.020 -26.108 1.00 0.00 H new ATOM 0 HA THR A 73 8.891 -1.503 -26.890 1.00 0.00 H new ATOM 0 HB THR A 73 6.305 -0.495 -27.996 1.00 0.00 H new ATOM 0 HG1 THR A 73 6.792 -2.169 -29.656 1.00 0.00 H new ATOM 0 HG21 THR A 73 7.593 -0.078 -30.106 1.00 0.00 H new ATOM 0 HG22 THR A 73 8.190 0.904 -28.748 1.00 0.00 H new ATOM 0 HG23 THR A 73 9.088 -0.545 -29.261 1.00 0.00 H new ATOM 1146 N THR A 74 9.298 0.618 -25.620 1.00 0.00 N ATOM 1147 CA THR A 74 9.566 1.724 -24.652 1.00 0.00 C ATOM 1148 C THR A 74 9.714 3.137 -25.307 1.00 0.00 C ATOM 1149 O THR A 74 9.996 3.279 -26.502 1.00 0.00 O ATOM 1150 CB THR A 74 10.817 1.387 -23.774 1.00 0.00 C ATOM 1151 OG1 THR A 74 12.019 1.408 -24.537 1.00 0.00 O ATOM 1152 CG2 THR A 74 10.753 0.057 -23.006 1.00 0.00 C ATOM 0 H THR A 74 10.137 0.140 -25.947 1.00 0.00 H new ATOM 0 HA THR A 74 8.678 1.789 -24.024 1.00 0.00 H new ATOM 0 HB THR A 74 10.813 2.181 -23.027 1.00 0.00 H new ATOM 0 HG1 THR A 74 12.734 1.823 -24.010 1.00 0.00 H new ATOM 0 HG21 THR A 74 11.670 -0.076 -22.431 1.00 0.00 H new ATOM 0 HG22 THR A 74 9.899 0.069 -22.329 1.00 0.00 H new ATOM 0 HG23 THR A 74 10.645 -0.766 -23.712 1.00 0.00 H new ATOM 1160 N ALA A 75 9.640 4.191 -24.468 1.00 0.00 N ATOM 1161 CA ALA A 75 10.074 5.570 -24.837 1.00 0.00 C ATOM 1162 C ALA A 75 11.518 5.779 -25.422 1.00 0.00 C ATOM 1163 O ALA A 75 11.725 6.736 -26.169 1.00 0.00 O ATOM 1164 CB ALA A 75 9.862 6.419 -23.568 1.00 0.00 C ATOM 0 H ALA A 75 9.280 4.119 -23.516 1.00 0.00 H new ATOM 0 HA ALA A 75 9.471 5.866 -25.696 1.00 0.00 H new ATOM 0 HB1 ALA A 75 10.161 7.449 -23.765 1.00 0.00 H new ATOM 0 HB2 ALA A 75 8.810 6.394 -23.285 1.00 0.00 H new ATOM 0 HB3 ALA A 75 10.465 6.015 -22.755 1.00 0.00 H new ATOM 1170 N ASP A 76 12.491 4.887 -25.143 1.00 0.00 N ATOM 1171 CA ASP A 76 13.794 4.862 -25.879 1.00 0.00 C ATOM 1172 C ASP A 76 13.787 4.190 -27.307 1.00 0.00 C ATOM 1173 O ASP A 76 14.845 4.133 -27.940 1.00 0.00 O ATOM 1174 CB ASP A 76 14.905 4.199 -25.008 1.00 0.00 C ATOM 1175 CG ASP A 76 15.047 4.614 -23.539 1.00 0.00 C ATOM 1176 OD1 ASP A 76 15.410 5.723 -23.167 1.00 0.00 O ATOM 1177 OD2 ASP A 76 14.735 3.600 -22.682 1.00 0.00 O ATOM 0 H ASP A 76 12.410 4.173 -24.419 1.00 0.00 H new ATOM 0 HA ASP A 76 14.000 5.917 -26.063 1.00 0.00 H new ATOM 0 HB2 ASP A 76 14.741 3.122 -25.031 1.00 0.00 H new ATOM 0 HB3 ASP A 76 15.861 4.387 -25.496 1.00 0.00 H new ATOM 1183 N ASP A 77 12.644 3.661 -27.810 1.00 0.00 N ATOM 1184 CA ASP A 77 12.551 2.853 -29.064 1.00 0.00 C ATOM 1185 C ASP A 77 13.252 1.455 -28.950 1.00 0.00 C ATOM 1186 O ASP A 77 14.235 1.176 -29.644 1.00 0.00 O ATOM 1187 CB ASP A 77 12.914 3.704 -30.319 1.00 0.00 C ATOM 1188 CG ASP A 77 12.573 3.088 -31.675 1.00 0.00 C ATOM 1189 OD1 ASP A 77 11.694 3.524 -32.412 1.00 0.00 O ATOM 1190 OD2 ASP A 77 13.362 2.010 -31.966 1.00 0.00 O ATOM 0 H ASP A 77 11.741 3.783 -27.351 1.00 0.00 H new ATOM 0 HA ASP A 77 11.507 2.579 -29.214 1.00 0.00 H new ATOM 0 HB2 ASP A 77 12.404 4.664 -30.241 1.00 0.00 H new ATOM 0 HB3 ASP A 77 13.984 3.909 -30.296 1.00 0.00 H new ATOM 1196 N ARG A 78 12.707 0.579 -28.090 1.00 0.00 N ATOM 1197 CA ARG A 78 13.276 -0.769 -27.807 1.00 0.00 C ATOM 1198 C ARG A 78 12.170 -1.668 -27.167 1.00 0.00 C ATOM 1199 O ARG A 78 11.503 -1.256 -26.208 1.00 0.00 O ATOM 1200 CB ARG A 78 14.576 -0.707 -26.941 1.00 0.00 C ATOM 1201 CG ARG A 78 14.463 0.024 -25.579 1.00 0.00 C ATOM 1202 CD ARG A 78 15.741 0.043 -24.717 1.00 0.00 C ATOM 1203 NE ARG A 78 15.662 -0.875 -23.549 1.00 0.00 N ATOM 1204 CZ ARG A 78 15.011 -0.643 -22.410 1.00 0.00 C ATOM 1205 NH1 ARG A 78 14.351 0.456 -22.152 1.00 0.00 N ATOM 1206 NH2 ARG A 78 15.014 -1.567 -21.500 1.00 0.00 N ATOM 0 H ARG A 78 11.856 0.777 -27.564 1.00 0.00 H new ATOM 0 HA ARG A 78 13.590 -1.218 -28.749 1.00 0.00 H new ATOM 0 HB2 ARG A 78 14.911 -1.727 -26.754 1.00 0.00 H new ATOM 0 HB3 ARG A 78 15.354 -0.218 -27.527 1.00 0.00 H new ATOM 0 HG2 ARG A 78 14.158 1.054 -25.765 1.00 0.00 H new ATOM 0 HG3 ARG A 78 13.666 -0.445 -25.002 1.00 0.00 H new ATOM 0 HD2 ARG A 78 16.595 -0.235 -25.335 1.00 0.00 H new ATOM 0 HD3 ARG A 78 15.921 1.058 -24.364 1.00 0.00 H new ATOM 0 HE ARG A 78 16.152 -1.766 -23.628 1.00 0.00 H new ATOM 0 HH11 ARG A 78 14.313 1.203 -22.846 1.00 0.00 H new ATOM 0 HH12 ARG A 78 13.875 0.567 -21.257 1.00 0.00 H new ATOM 0 HH21 ARG A 78 15.507 -2.445 -21.666 1.00 0.00 H new ATOM 0 HH22 ARG A 78 14.524 -1.416 -20.618 1.00 0.00 H new ATOM 1220 N ASN A 79 11.984 -2.890 -27.698 1.00 0.00 N ATOM 1221 CA ASN A 79 10.998 -3.873 -27.162 1.00 0.00 C ATOM 1222 C ASN A 79 11.618 -4.802 -26.066 1.00 0.00 C ATOM 1223 O ASN A 79 12.663 -5.418 -26.292 1.00 0.00 O ATOM 1224 CB ASN A 79 10.310 -4.631 -28.334 1.00 0.00 C ATOM 1225 CG ASN A 79 11.169 -5.568 -29.198 1.00 0.00 C ATOM 1226 OD1 ASN A 79 11.400 -6.724 -28.867 1.00 0.00 O ATOM 1227 ND2 ASN A 79 11.652 -5.120 -30.332 1.00 0.00 N ATOM 0 H ASN A 79 12.505 -3.232 -28.506 1.00 0.00 H new ATOM 0 HA ASN A 79 10.211 -3.333 -26.635 1.00 0.00 H new ATOM 0 HB2 ASN A 79 9.493 -5.220 -27.916 1.00 0.00 H new ATOM 0 HB3 ASN A 79 9.862 -3.888 -28.994 1.00 0.00 H new ATOM 0 HD21 ASN A 79 12.212 -5.732 -30.925 1.00 0.00 H new ATOM 0 HD22 ASN A 79 11.468 -4.159 -30.621 1.00 0.00 H new ATOM 1234 N CYS A 80 10.980 -4.891 -24.885 1.00 0.00 N ATOM 1235 CA CYS A 80 11.486 -5.710 -23.749 1.00 0.00 C ATOM 1236 C CYS A 80 10.414 -6.627 -23.094 1.00 0.00 C ATOM 1237 O CYS A 80 9.237 -6.270 -22.954 1.00 0.00 O ATOM 1238 CB CYS A 80 12.072 -4.758 -22.684 1.00 0.00 C ATOM 1239 SG CYS A 80 10.844 -3.513 -22.173 1.00 0.00 S ATOM 0 H CYS A 80 10.106 -4.405 -24.684 1.00 0.00 H new ATOM 0 HA CYS A 80 12.242 -6.382 -24.154 1.00 0.00 H new ATOM 0 HB2 CYS A 80 12.395 -5.333 -21.816 1.00 0.00 H new ATOM 0 HB3 CYS A 80 12.955 -4.260 -23.083 1.00 0.00 H new ATOM 0 HG CYS A 80 10.053 -4.026 -21.278 1.00 0.00 H new ATOM 1245 N LYS A 81 10.886 -7.778 -22.582 1.00 0.00 N ATOM 1246 CA LYS A 81 10.119 -8.623 -21.629 1.00 0.00 C ATOM 1247 C LYS A 81 10.269 -8.024 -20.191 1.00 0.00 C ATOM 1248 O LYS A 81 11.315 -8.129 -19.540 1.00 0.00 O ATOM 1249 CB LYS A 81 10.615 -10.092 -21.722 1.00 0.00 C ATOM 1250 CG LYS A 81 10.451 -10.813 -23.086 1.00 0.00 C ATOM 1251 CD LYS A 81 9.005 -11.049 -23.573 1.00 0.00 C ATOM 1252 CE LYS A 81 8.242 -12.112 -22.762 1.00 0.00 C ATOM 1253 NZ LYS A 81 6.973 -12.451 -23.430 1.00 0.00 N ATOM 0 H LYS A 81 11.806 -8.154 -22.812 1.00 0.00 H new ATOM 0 HA LYS A 81 9.058 -8.629 -21.878 1.00 0.00 H new ATOM 0 HB2 LYS A 81 11.672 -10.109 -21.457 1.00 0.00 H new ATOM 0 HB3 LYS A 81 10.087 -10.675 -20.967 1.00 0.00 H new ATOM 0 HG2 LYS A 81 10.975 -10.231 -23.844 1.00 0.00 H new ATOM 0 HG3 LYS A 81 10.951 -11.779 -23.023 1.00 0.00 H new ATOM 0 HD2 LYS A 81 8.458 -10.108 -23.526 1.00 0.00 H new ATOM 0 HD3 LYS A 81 9.029 -11.352 -24.620 1.00 0.00 H new ATOM 0 HE2 LYS A 81 8.855 -13.007 -22.655 1.00 0.00 H new ATOM 0 HE3 LYS A 81 8.044 -11.739 -21.757 1.00 0.00 H new ATOM 0 HZ1 LYS A 81 6.392 -13.036 -22.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 81 6.459 -11.577 -23.662 1.00 0.00 H new ATOM 0 HZ3 LYS A 81 7.171 -12.979 -24.304 1.00 0.00 H new ATOM 1266 N SER A 82 9.221 -7.314 -19.759 1.00 0.00 N ATOM 1267 CA SER A 82 9.216 -6.507 -18.515 1.00 0.00 C ATOM 1268 C SER A 82 8.499 -7.234 -17.341 1.00 0.00 C ATOM 1269 O SER A 82 7.366 -7.698 -17.494 1.00 0.00 O ATOM 1270 CB SER A 82 8.484 -5.186 -18.848 1.00 0.00 C ATOM 1271 OG SER A 82 9.176 -4.406 -19.824 1.00 0.00 O ATOM 0 H SER A 82 8.336 -7.278 -20.265 1.00 0.00 H new ATOM 0 HA SER A 82 10.240 -6.334 -18.185 1.00 0.00 H new ATOM 0 HB2 SER A 82 7.482 -5.412 -19.213 1.00 0.00 H new ATOM 0 HB3 SER A 82 8.367 -4.600 -17.936 1.00 0.00 H new ATOM 0 HG SER A 82 8.674 -3.583 -20.001 1.00 0.00 H new ATOM 1277 N VAL A 83 9.136 -7.303 -16.160 1.00 0.00 N ATOM 1278 CA VAL A 83 8.536 -7.926 -14.938 1.00 0.00 C ATOM 1279 C VAL A 83 8.834 -7.047 -13.677 1.00 0.00 C ATOM 1280 O VAL A 83 9.980 -6.644 -13.450 1.00 0.00 O ATOM 1281 CB VAL A 83 8.965 -9.430 -14.810 1.00 0.00 C ATOM 1282 CG1 VAL A 83 10.464 -9.691 -14.534 1.00 0.00 C ATOM 1283 CG2 VAL A 83 8.126 -10.198 -13.768 1.00 0.00 C ATOM 0 H VAL A 83 10.076 -6.935 -16.012 1.00 0.00 H new ATOM 0 HA VAL A 83 7.450 -7.950 -15.027 1.00 0.00 H new ATOM 0 HB VAL A 83 8.768 -9.809 -15.813 1.00 0.00 H new ATOM 0 HG11 VAL A 83 10.640 -10.765 -14.466 1.00 0.00 H new ATOM 0 HG12 VAL A 83 11.061 -9.276 -15.346 1.00 0.00 H new ATOM 0 HG13 VAL A 83 10.749 -9.216 -13.595 1.00 0.00 H new ATOM 0 HG21 VAL A 83 8.464 -11.233 -13.720 1.00 0.00 H new ATOM 0 HG22 VAL A 83 8.245 -9.732 -12.790 1.00 0.00 H new ATOM 0 HG23 VAL A 83 7.075 -10.173 -14.057 1.00 0.00 H new ATOM 1293 N VAL A 84 7.810 -6.748 -12.851 1.00 0.00 N ATOM 1294 CA VAL A 84 7.968 -5.845 -11.665 1.00 0.00 C ATOM 1295 C VAL A 84 7.710 -6.654 -10.353 1.00 0.00 C ATOM 1296 O VAL A 84 6.613 -7.188 -10.146 1.00 0.00 O ATOM 1297 CB VAL A 84 7.073 -4.559 -11.734 1.00 0.00 C ATOM 1298 CG1 VAL A 84 7.466 -3.520 -10.652 1.00 0.00 C ATOM 1299 CG2 VAL A 84 7.087 -3.815 -13.088 1.00 0.00 C ATOM 0 H VAL A 84 6.865 -7.111 -12.973 1.00 0.00 H new ATOM 0 HA VAL A 84 8.995 -5.479 -11.670 1.00 0.00 H new ATOM 0 HB VAL A 84 6.071 -4.958 -11.572 1.00 0.00 H new ATOM 0 HG11 VAL A 84 6.821 -2.645 -10.736 1.00 0.00 H new ATOM 0 HG12 VAL A 84 7.350 -3.963 -9.663 1.00 0.00 H new ATOM 0 HG13 VAL A 84 8.504 -3.220 -10.795 1.00 0.00 H new ATOM 0 HG21 VAL A 84 6.437 -2.942 -13.030 1.00 0.00 H new ATOM 0 HG22 VAL A 84 8.104 -3.496 -13.317 1.00 0.00 H new ATOM 0 HG23 VAL A 84 6.730 -4.482 -13.873 1.00 0.00 H new ATOM 1309 N SER A 85 8.711 -6.695 -9.456 1.00 0.00 N ATOM 1310 CA SER A 85 8.608 -7.377 -8.137 1.00 0.00 C ATOM 1311 C SER A 85 8.597 -6.359 -6.950 1.00 0.00 C ATOM 1312 O SER A 85 9.456 -5.475 -6.856 1.00 0.00 O ATOM 1313 CB SER A 85 9.758 -8.408 -8.023 1.00 0.00 C ATOM 1314 OG SER A 85 11.052 -7.796 -8.023 1.00 0.00 O ATOM 0 H SER A 85 9.618 -6.258 -9.618 1.00 0.00 H new ATOM 0 HA SER A 85 7.655 -7.902 -8.074 1.00 0.00 H new ATOM 0 HB2 SER A 85 9.634 -8.985 -7.106 1.00 0.00 H new ATOM 0 HB3 SER A 85 9.693 -9.111 -8.853 1.00 0.00 H new ATOM 0 HG SER A 85 11.741 -8.488 -7.948 1.00 0.00 H new ATOM 1320 N LEU A 86 7.625 -6.492 -6.027 1.00 0.00 N ATOM 1321 CA LEU A 86 7.538 -5.632 -4.813 1.00 0.00 C ATOM 1322 C LEU A 86 8.278 -6.302 -3.611 1.00 0.00 C ATOM 1323 O LEU A 86 7.740 -7.196 -2.950 1.00 0.00 O ATOM 1324 CB LEU A 86 6.034 -5.333 -4.536 1.00 0.00 C ATOM 1325 CG LEU A 86 5.726 -4.028 -3.758 1.00 0.00 C ATOM 1326 CD1 LEU A 86 4.216 -3.744 -3.785 1.00 0.00 C ATOM 1327 CD2 LEU A 86 6.198 -4.045 -2.295 1.00 0.00 C ATOM 0 H LEU A 86 6.882 -7.188 -6.093 1.00 0.00 H new ATOM 0 HA LEU A 86 8.045 -4.680 -4.968 1.00 0.00 H new ATOM 0 HB2 LEU A 86 5.511 -5.293 -5.492 1.00 0.00 H new ATOM 0 HB3 LEU A 86 5.615 -6.171 -3.978 1.00 0.00 H new ATOM 0 HG LEU A 86 6.286 -3.243 -4.266 1.00 0.00 H new ATOM 0 HD11 LEU A 86 4.009 -2.825 -3.236 1.00 0.00 H new ATOM 0 HD12 LEU A 86 3.885 -3.632 -4.818 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.682 -4.573 -3.321 1.00 0.00 H new ATOM 0 HD21 LEU A 86 5.946 -3.097 -1.820 1.00 0.00 H new ATOM 0 HD22 LEU A 86 5.706 -4.859 -1.763 1.00 0.00 H new ATOM 0 HD23 LEU A 86 7.278 -4.191 -2.263 1.00 0.00 H new ATOM 1339 N ASP A 87 9.512 -5.856 -3.311 1.00 0.00 N ATOM 1340 CA ASP A 87 10.335 -6.441 -2.214 1.00 0.00 C ATOM 1341 C ASP A 87 10.140 -5.664 -0.866 1.00 0.00 C ATOM 1342 O ASP A 87 11.024 -4.909 -0.442 1.00 0.00 O ATOM 1343 CB ASP A 87 11.791 -6.488 -2.758 1.00 0.00 C ATOM 1344 CG ASP A 87 12.821 -7.199 -1.879 1.00 0.00 C ATOM 1345 OD1 ASP A 87 13.367 -8.250 -2.199 1.00 0.00 O ATOM 1346 OD2 ASP A 87 13.068 -6.522 -0.717 1.00 0.00 O ATOM 0 H ASP A 87 9.969 -5.092 -3.808 1.00 0.00 H new ATOM 0 HA ASP A 87 10.028 -7.452 -1.948 1.00 0.00 H new ATOM 0 HB2 ASP A 87 11.777 -6.977 -3.732 1.00 0.00 H new ATOM 0 HB3 ASP A 87 12.129 -5.464 -2.921 1.00 0.00 H new ATOM 1352 N GLY A 88 9.000 -5.873 -0.182 1.00 0.00 N ATOM 1353 CA GLY A 88 8.683 -5.162 1.091 1.00 0.00 C ATOM 1354 C GLY A 88 8.016 -3.788 0.883 1.00 0.00 C ATOM 1355 O GLY A 88 6.788 -3.687 0.887 1.00 0.00 O ATOM 0 H GLY A 88 8.277 -6.527 -0.482 1.00 0.00 H new ATOM 0 HA2 GLY A 88 8.024 -5.788 1.693 1.00 0.00 H new ATOM 0 HA3 GLY A 88 9.603 -5.027 1.660 1.00 0.00 H new ATOM 1359 N ASP A 89 8.832 -2.746 0.661 1.00 0.00 N ATOM 1360 CA ASP A 89 8.347 -1.467 0.060 1.00 0.00 C ATOM 1361 C ASP A 89 9.335 -0.921 -1.033 1.00 0.00 C ATOM 1362 O ASP A 89 9.738 0.248 -1.004 1.00 0.00 O ATOM 1363 CB ASP A 89 8.013 -0.475 1.212 1.00 0.00 C ATOM 1364 CG ASP A 89 7.213 0.763 0.792 1.00 0.00 C ATOM 1365 OD1 ASP A 89 6.278 0.744 -0.005 1.00 0.00 O ATOM 1366 OD2 ASP A 89 7.647 1.893 1.413 1.00 0.00 O ATOM 0 H ASP A 89 9.828 -2.751 0.883 1.00 0.00 H new ATOM 0 HA ASP A 89 7.424 -1.628 -0.498 1.00 0.00 H new ATOM 0 HB2 ASP A 89 7.451 -1.009 1.979 1.00 0.00 H new ATOM 0 HB3 ASP A 89 8.946 -0.147 1.670 1.00 0.00 H new ATOM 1372 N LYS A 90 9.680 -1.752 -2.039 1.00 0.00 N ATOM 1373 CA LYS A 90 10.466 -1.313 -3.222 1.00 0.00 C ATOM 1374 C LYS A 90 10.022 -2.073 -4.512 1.00 0.00 C ATOM 1375 O LYS A 90 10.114 -3.303 -4.585 1.00 0.00 O ATOM 1376 CB LYS A 90 11.996 -1.306 -2.950 1.00 0.00 C ATOM 1377 CG LYS A 90 12.712 -2.662 -2.782 1.00 0.00 C ATOM 1378 CD LYS A 90 14.205 -2.503 -2.442 1.00 0.00 C ATOM 1379 CE LYS A 90 14.941 -3.851 -2.445 1.00 0.00 C ATOM 1380 NZ LYS A 90 16.376 -3.652 -2.177 1.00 0.00 N ATOM 0 H LYS A 90 9.426 -2.740 -2.059 1.00 0.00 H new ATOM 0 HA LYS A 90 10.235 -0.266 -3.417 1.00 0.00 H new ATOM 0 HB2 LYS A 90 12.478 -0.774 -3.771 1.00 0.00 H new ATOM 0 HB3 LYS A 90 12.171 -0.723 -2.046 1.00 0.00 H new ATOM 0 HG2 LYS A 90 12.222 -3.233 -1.993 1.00 0.00 H new ATOM 0 HG3 LYS A 90 12.612 -3.238 -3.702 1.00 0.00 H new ATOM 0 HD2 LYS A 90 14.672 -1.833 -3.164 1.00 0.00 H new ATOM 0 HD3 LYS A 90 14.306 -2.037 -1.462 1.00 0.00 H new ATOM 0 HE2 LYS A 90 14.511 -4.509 -1.690 1.00 0.00 H new ATOM 0 HE3 LYS A 90 14.809 -4.343 -3.409 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 16.861 -4.572 -2.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 16.785 -3.041 -2.912 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 16.496 -3.202 -1.247 1.00 0.00 H new ATOM 1393 N LEU A 91 9.541 -1.336 -5.531 1.00 0.00 N ATOM 1394 CA LEU A 91 9.127 -1.926 -6.837 1.00 0.00 C ATOM 1395 C LEU A 91 10.348 -2.027 -7.807 1.00 0.00 C ATOM 1396 O LEU A 91 10.798 -1.022 -8.369 1.00 0.00 O ATOM 1397 CB LEU A 91 7.965 -1.087 -7.451 1.00 0.00 C ATOM 1398 CG LEU A 91 6.556 -1.275 -6.835 1.00 0.00 C ATOM 1399 CD1 LEU A 91 5.607 -0.157 -7.303 1.00 0.00 C ATOM 1400 CD2 LEU A 91 5.940 -2.632 -7.217 1.00 0.00 C ATOM 0 H LEU A 91 9.426 -0.324 -5.483 1.00 0.00 H new ATOM 0 HA LEU A 91 8.761 -2.940 -6.675 1.00 0.00 H new ATOM 0 HB2 LEU A 91 8.231 -0.033 -7.372 1.00 0.00 H new ATOM 0 HB3 LEU A 91 7.903 -1.321 -8.514 1.00 0.00 H new ATOM 0 HG LEU A 91 6.678 -1.236 -5.753 1.00 0.00 H new ATOM 0 HD11 LEU A 91 4.622 -0.306 -6.860 1.00 0.00 H new ATOM 0 HD12 LEU A 91 6.002 0.810 -6.992 1.00 0.00 H new ATOM 0 HD13 LEU A 91 5.523 -0.182 -8.390 1.00 0.00 H new ATOM 0 HD21 LEU A 91 4.953 -2.724 -6.765 1.00 0.00 H new ATOM 0 HD22 LEU A 91 5.850 -2.698 -8.301 1.00 0.00 H new ATOM 0 HD23 LEU A 91 6.580 -3.437 -6.856 1.00 0.00 H new ATOM 1412 N VAL A 92 10.866 -3.251 -8.000 1.00 0.00 N ATOM 1413 CA VAL A 92 12.065 -3.519 -8.850 1.00 0.00 C ATOM 1414 C VAL A 92 11.559 -3.923 -10.271 1.00 0.00 C ATOM 1415 O VAL A 92 11.114 -5.054 -10.494 1.00 0.00 O ATOM 1416 CB VAL A 92 12.998 -4.588 -8.177 1.00 0.00 C ATOM 1417 CG1 VAL A 92 14.276 -4.868 -9.005 1.00 0.00 C ATOM 1418 CG2 VAL A 92 13.458 -4.219 -6.744 1.00 0.00 C ATOM 0 H VAL A 92 10.474 -4.092 -7.576 1.00 0.00 H new ATOM 0 HA VAL A 92 12.688 -2.630 -8.952 1.00 0.00 H new ATOM 0 HB VAL A 92 12.364 -5.474 -8.131 1.00 0.00 H new ATOM 0 HG11 VAL A 92 14.885 -5.614 -8.494 1.00 0.00 H new ATOM 0 HG12 VAL A 92 13.997 -5.241 -9.990 1.00 0.00 H new ATOM 0 HG13 VAL A 92 14.848 -3.946 -9.114 1.00 0.00 H new ATOM 0 HG21 VAL A 92 14.098 -5.010 -6.352 1.00 0.00 H new ATOM 0 HG22 VAL A 92 14.014 -3.282 -6.770 1.00 0.00 H new ATOM 0 HG23 VAL A 92 12.586 -4.106 -6.100 1.00 0.00 H new ATOM 1428 N HIS A 93 11.621 -2.975 -11.222 1.00 0.00 N ATOM 1429 CA HIS A 93 11.161 -3.191 -12.621 1.00 0.00 C ATOM 1430 C HIS A 93 12.328 -3.729 -13.506 1.00 0.00 C ATOM 1431 O HIS A 93 13.258 -2.994 -13.842 1.00 0.00 O ATOM 1432 CB HIS A 93 10.550 -1.842 -13.088 1.00 0.00 C ATOM 1433 CG HIS A 93 9.997 -1.726 -14.518 1.00 0.00 C ATOM 1434 ND1 HIS A 93 9.757 -2.776 -15.399 1.00 0.00 N ATOM 1435 CD2 HIS A 93 9.730 -0.495 -15.142 1.00 0.00 C ATOM 1436 CE1 HIS A 93 9.377 -2.059 -16.500 1.00 0.00 C ATOM 1437 NE2 HIS A 93 9.354 -0.695 -16.456 1.00 0.00 N ATOM 0 H HIS A 93 11.988 -2.039 -11.052 1.00 0.00 H new ATOM 0 HA HIS A 93 10.396 -3.963 -12.704 1.00 0.00 H new ATOM 0 HB2 HIS A 93 9.741 -1.593 -12.402 1.00 0.00 H new ATOM 0 HB3 HIS A 93 11.316 -1.076 -12.969 1.00 0.00 H new ATOM 0 HD2 HIS A 93 9.808 0.470 -14.662 1.00 0.00 H new ATOM 0 HE1 HIS A 93 9.094 -2.573 -17.407 1.00 0.00 H new ATOM 0 HE2 HIS A 93 9.125 -0.018 -17.184 1.00 0.00 H new ATOM 1445 N ILE A 94 12.261 -5.014 -13.871 1.00 0.00 N ATOM 1446 CA ILE A 94 13.304 -5.715 -14.675 1.00 0.00 C ATOM 1447 C ILE A 94 12.867 -5.699 -16.176 1.00 0.00 C ATOM 1448 O ILE A 94 11.824 -6.267 -16.508 1.00 0.00 O ATOM 1449 CB ILE A 94 13.480 -7.166 -14.087 1.00 0.00 C ATOM 1450 CG1 ILE A 94 14.104 -7.186 -12.657 1.00 0.00 C ATOM 1451 CG2 ILE A 94 14.301 -8.104 -15.008 1.00 0.00 C ATOM 1452 CD1 ILE A 94 13.735 -8.419 -11.814 1.00 0.00 C ATOM 0 H ILE A 94 11.477 -5.616 -13.620 1.00 0.00 H new ATOM 0 HA ILE A 94 14.274 -5.222 -14.621 1.00 0.00 H new ATOM 0 HB ILE A 94 12.460 -7.544 -14.023 1.00 0.00 H new ATOM 0 HG12 ILE A 94 15.189 -7.136 -12.748 1.00 0.00 H new ATOM 0 HG13 ILE A 94 13.787 -6.290 -12.124 1.00 0.00 H new ATOM 0 HG21 ILE A 94 14.385 -9.087 -14.544 1.00 0.00 H new ATOM 0 HG22 ILE A 94 13.799 -8.199 -15.971 1.00 0.00 H new ATOM 0 HG23 ILE A 94 15.297 -7.687 -15.157 1.00 0.00 H new ATOM 0 HD11 ILE A 94 14.213 -8.348 -10.837 1.00 0.00 H new ATOM 0 HD12 ILE A 94 12.653 -8.462 -11.687 1.00 0.00 H new ATOM 0 HD13 ILE A 94 14.077 -9.322 -12.320 1.00 0.00 H new ATOM 1464 N GLN A 95 13.679 -5.120 -17.081 1.00 0.00 N ATOM 1465 CA GLN A 95 13.421 -5.173 -18.551 1.00 0.00 C ATOM 1466 C GLN A 95 14.513 -6.029 -19.259 1.00 0.00 C ATOM 1467 O GLN A 95 15.699 -5.691 -19.202 1.00 0.00 O ATOM 1468 CB GLN A 95 13.364 -3.736 -19.134 1.00 0.00 C ATOM 1469 CG GLN A 95 12.128 -2.912 -18.699 1.00 0.00 C ATOM 1470 CD GLN A 95 11.917 -1.595 -19.457 1.00 0.00 C ATOM 1471 OE1 GLN A 95 12.843 -0.857 -19.791 1.00 0.00 O ATOM 1472 NE2 GLN A 95 10.687 -1.250 -19.749 1.00 0.00 N ATOM 0 H GLN A 95 14.524 -4.607 -16.829 1.00 0.00 H new ATOM 0 HA GLN A 95 12.456 -5.648 -18.729 1.00 0.00 H new ATOM 0 HB2 GLN A 95 14.265 -3.201 -18.834 1.00 0.00 H new ATOM 0 HB3 GLN A 95 13.378 -3.799 -20.222 1.00 0.00 H new ATOM 0 HG2 GLN A 95 11.238 -3.530 -18.823 1.00 0.00 H new ATOM 0 HG3 GLN A 95 12.216 -2.690 -17.636 1.00 0.00 H new ATOM 0 HE21 GLN A 95 9.910 -1.853 -19.478 1.00 0.00 H new ATOM 0 HE22 GLN A 95 10.506 -0.379 -20.247 1.00 0.00 H new ATOM 1481 N LYS A 96 14.102 -7.111 -19.944 1.00 0.00 N ATOM 1482 CA LYS A 96 15.031 -8.054 -20.637 1.00 0.00 C ATOM 1483 C LYS A 96 14.872 -7.944 -22.190 1.00 0.00 C ATOM 1484 O LYS A 96 13.775 -8.122 -22.731 1.00 0.00 O ATOM 1485 CB LYS A 96 14.725 -9.497 -20.150 1.00 0.00 C ATOM 1486 CG LYS A 96 15.132 -9.804 -18.687 1.00 0.00 C ATOM 1487 CD LYS A 96 14.673 -11.183 -18.172 1.00 0.00 C ATOM 1488 CE LYS A 96 13.165 -11.269 -17.878 1.00 0.00 C ATOM 1489 NZ LYS A 96 12.831 -12.612 -17.367 1.00 0.00 N ATOM 0 H LYS A 96 13.119 -7.366 -20.039 1.00 0.00 H new ATOM 0 HA LYS A 96 16.063 -7.799 -20.396 1.00 0.00 H new ATOM 0 HB2 LYS A 96 13.656 -9.680 -20.258 1.00 0.00 H new ATOM 0 HB3 LYS A 96 15.237 -10.200 -20.807 1.00 0.00 H new ATOM 0 HG2 LYS A 96 16.217 -9.742 -18.604 1.00 0.00 H new ATOM 0 HG3 LYS A 96 14.718 -9.032 -18.038 1.00 0.00 H new ATOM 0 HD2 LYS A 96 14.933 -11.941 -18.911 1.00 0.00 H new ATOM 0 HD3 LYS A 96 15.225 -11.422 -17.263 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.884 -10.511 -17.146 1.00 0.00 H new ATOM 0 HE3 LYS A 96 12.596 -11.063 -18.785 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 11.804 -12.681 -17.218 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 13.130 -13.330 -18.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 13.323 -12.773 -16.465 1.00 0.00 H new ATOM 1502 N TRP A 97 15.971 -7.646 -22.909 1.00 0.00 N ATOM 1503 CA TRP A 97 15.953 -7.418 -24.385 1.00 0.00 C ATOM 1504 C TRP A 97 17.367 -7.691 -24.990 1.00 0.00 C ATOM 1505 O TRP A 97 18.369 -7.203 -24.461 1.00 0.00 O ATOM 1506 CB TRP A 97 15.393 -6.005 -24.753 1.00 0.00 C ATOM 1507 CG TRP A 97 16.314 -4.778 -24.628 1.00 0.00 C ATOM 1508 CD1 TRP A 97 16.857 -4.070 -25.719 1.00 0.00 C ATOM 1509 CD2 TRP A 97 16.912 -4.239 -23.505 1.00 0.00 C ATOM 1510 NE1 TRP A 97 17.786 -3.097 -25.302 1.00 0.00 N ATOM 1511 CE2 TRP A 97 17.847 -3.263 -23.931 1.00 0.00 C ATOM 1512 CE3 TRP A 97 16.759 -4.526 -22.129 1.00 0.00 C ATOM 1513 CZ2 TRP A 97 18.657 -2.595 -22.983 1.00 0.00 C ATOM 1514 CZ3 TRP A 97 17.566 -3.860 -21.213 1.00 0.00 C ATOM 1515 CH2 TRP A 97 18.514 -2.924 -21.634 1.00 0.00 C ATOM 0 H TRP A 97 16.898 -7.554 -22.494 1.00 0.00 H new ATOM 0 HA TRP A 97 15.262 -8.130 -24.837 1.00 0.00 H new ATOM 0 HB2 TRP A 97 15.043 -6.049 -25.784 1.00 0.00 H new ATOM 0 HB3 TRP A 97 14.519 -5.825 -24.127 1.00 0.00 H new ATOM 0 HD1 TRP A 97 16.593 -4.252 -26.750 1.00 0.00 H new ATOM 0 HE1 TRP A 97 18.295 -2.426 -25.877 1.00 0.00 H new ATOM 0 HE3 TRP A 97 16.029 -5.249 -21.796 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 19.370 -1.847 -23.296 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 17.458 -4.070 -20.159 1.00 0.00 H new ATOM 0 HH2 TRP A 97 19.148 -2.446 -20.902 1.00 0.00 H new ATOM 1526 N ASP A 98 17.473 -8.440 -26.107 1.00 0.00 N ATOM 1527 CA ASP A 98 18.786 -8.703 -26.804 1.00 0.00 C ATOM 1528 C ASP A 98 19.879 -9.532 -26.013 1.00 0.00 C ATOM 1529 O ASP A 98 21.056 -9.509 -26.387 1.00 0.00 O ATOM 1530 CB ASP A 98 19.410 -7.383 -27.373 1.00 0.00 C ATOM 1531 CG ASP A 98 18.551 -6.474 -28.254 1.00 0.00 C ATOM 1532 OD1 ASP A 98 17.655 -6.879 -28.989 1.00 0.00 O ATOM 1533 OD2 ASP A 98 18.908 -5.159 -28.126 1.00 0.00 O ATOM 0 H ASP A 98 16.673 -8.882 -26.560 1.00 0.00 H new ATOM 0 HA ASP A 98 18.490 -9.370 -27.613 1.00 0.00 H new ATOM 0 HB2 ASP A 98 19.754 -6.790 -26.525 1.00 0.00 H new ATOM 0 HB3 ASP A 98 20.294 -7.659 -27.948 1.00 0.00 H new ATOM 1539 N GLY A 99 19.534 -10.229 -24.911 1.00 0.00 N ATOM 1540 CA GLY A 99 20.536 -10.620 -23.870 1.00 0.00 C ATOM 1541 C GLY A 99 20.942 -9.581 -22.781 1.00 0.00 C ATOM 1542 O GLY A 99 21.727 -9.923 -21.896 1.00 0.00 O ATOM 0 H GLY A 99 18.582 -10.535 -24.710 1.00 0.00 H new ATOM 0 HA2 GLY A 99 20.150 -11.500 -23.356 1.00 0.00 H new ATOM 0 HA3 GLY A 99 21.445 -10.926 -24.387 1.00 0.00 H new ATOM 1546 N LYS A 100 20.435 -8.340 -22.835 1.00 0.00 N ATOM 1547 CA LYS A 100 20.786 -7.235 -21.902 1.00 0.00 C ATOM 1548 C LYS A 100 19.627 -6.970 -20.885 1.00 0.00 C ATOM 1549 O LYS A 100 18.440 -7.132 -21.197 1.00 0.00 O ATOM 1550 CB LYS A 100 21.093 -5.975 -22.764 1.00 0.00 C ATOM 1551 CG LYS A 100 22.428 -6.046 -23.549 1.00 0.00 C ATOM 1552 CD LYS A 100 22.745 -4.846 -24.471 1.00 0.00 C ATOM 1553 CE LYS A 100 22.120 -4.896 -25.879 1.00 0.00 C ATOM 1554 NZ LYS A 100 20.754 -4.346 -25.888 1.00 0.00 N ATOM 0 H LYS A 100 19.754 -8.061 -23.541 1.00 0.00 H new ATOM 0 HA LYS A 100 21.660 -7.500 -21.307 1.00 0.00 H new ATOM 0 HB2 LYS A 100 20.277 -5.826 -23.471 1.00 0.00 H new ATOM 0 HB3 LYS A 100 21.114 -5.101 -22.113 1.00 0.00 H new ATOM 0 HG2 LYS A 100 23.242 -6.150 -22.831 1.00 0.00 H new ATOM 0 HG3 LYS A 100 22.420 -6.951 -24.156 1.00 0.00 H new ATOM 0 HD2 LYS A 100 22.408 -3.934 -23.977 1.00 0.00 H new ATOM 0 HD3 LYS A 100 23.827 -4.770 -24.577 1.00 0.00 H new ATOM 0 HE2 LYS A 100 22.743 -4.334 -26.574 1.00 0.00 H new ATOM 0 HE3 LYS A 100 22.100 -5.927 -26.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 20.241 -4.704 -26.719 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 20.257 -4.637 -25.022 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 20.798 -3.308 -25.929 1.00 0.00 H new ATOM 1567 N GLU A 101 19.986 -6.554 -19.655 1.00 0.00 N ATOM 1568 CA GLU A 101 19.009 -6.364 -18.546 1.00 0.00 C ATOM 1569 C GLU A 101 19.263 -5.036 -17.760 1.00 0.00 C ATOM 1570 O GLU A 101 20.360 -4.797 -17.248 1.00 0.00 O ATOM 1571 CB GLU A 101 19.044 -7.619 -17.629 1.00 0.00 C ATOM 1572 CG GLU A 101 17.888 -7.689 -16.600 1.00 0.00 C ATOM 1573 CD GLU A 101 17.919 -8.940 -15.726 1.00 0.00 C ATOM 1574 OE1 GLU A 101 17.254 -9.946 -15.949 1.00 0.00 O ATOM 1575 OE2 GLU A 101 18.757 -8.806 -14.661 1.00 0.00 O ATOM 0 H GLU A 101 20.949 -6.340 -19.396 1.00 0.00 H new ATOM 0 HA GLU A 101 18.006 -6.262 -18.961 1.00 0.00 H new ATOM 0 HB2 GLU A 101 19.013 -8.512 -18.254 1.00 0.00 H new ATOM 0 HB3 GLU A 101 19.993 -7.637 -17.093 1.00 0.00 H new ATOM 0 HG2 GLU A 101 17.930 -6.808 -15.960 1.00 0.00 H new ATOM 0 HG3 GLU A 101 16.937 -7.652 -17.132 1.00 0.00 H new ATOM 1583 N THR A 102 18.213 -4.207 -17.620 1.00 0.00 N ATOM 1584 CA THR A 102 18.178 -3.078 -16.643 1.00 0.00 C ATOM 1585 C THR A 102 17.116 -3.377 -15.541 1.00 0.00 C ATOM 1586 O THR A 102 16.003 -3.832 -15.831 1.00 0.00 O ATOM 1587 CB THR A 102 17.947 -1.701 -17.347 1.00 0.00 C ATOM 1588 OG1 THR A 102 18.087 -0.640 -16.405 1.00 0.00 O ATOM 1589 CG2 THR A 102 16.595 -1.489 -18.049 1.00 0.00 C ATOM 0 H THR A 102 17.361 -4.292 -18.175 1.00 0.00 H new ATOM 0 HA THR A 102 19.153 -2.997 -16.162 1.00 0.00 H new ATOM 0 HB THR A 102 18.705 -1.703 -18.130 1.00 0.00 H new ATOM 0 HG1 THR A 102 17.936 0.218 -16.854 1.00 0.00 H new ATOM 0 HG21 THR A 102 16.568 -0.494 -18.494 1.00 0.00 H new ATOM 0 HG22 THR A 102 16.469 -2.239 -18.829 1.00 0.00 H new ATOM 0 HG23 THR A 102 15.789 -1.583 -17.322 1.00 0.00 H new ATOM 1597 N ASN A 103 17.460 -3.074 -14.281 1.00 0.00 N ATOM 1598 CA ASN A 103 16.529 -3.207 -13.126 1.00 0.00 C ATOM 1599 C ASN A 103 16.344 -1.823 -12.426 1.00 0.00 C ATOM 1600 O ASN A 103 17.327 -1.196 -12.010 1.00 0.00 O ATOM 1601 CB ASN A 103 16.947 -4.382 -12.193 1.00 0.00 C ATOM 1602 CG ASN A 103 18.382 -4.544 -11.666 1.00 0.00 C ATOM 1603 OD1 ASN A 103 18.894 -5.649 -11.549 1.00 0.00 O ATOM 1604 ND2 ASN A 103 19.075 -3.493 -11.314 1.00 0.00 N ATOM 0 H ASN A 103 18.385 -2.730 -14.023 1.00 0.00 H new ATOM 0 HA ASN A 103 15.536 -3.490 -13.474 1.00 0.00 H new ATOM 0 HB2 ASN A 103 16.297 -4.334 -11.319 1.00 0.00 H new ATOM 0 HB3 ASN A 103 16.702 -5.303 -12.722 1.00 0.00 H new ATOM 0 HD21 ASN A 103 20.022 -3.604 -10.951 1.00 0.00 H new ATOM 0 HD22 ASN A 103 18.669 -2.561 -11.403 1.00 0.00 H new ATOM 1611 N PHE A 104 15.094 -1.329 -12.325 1.00 0.00 N ATOM 1612 CA PHE A 104 14.814 0.047 -11.830 1.00 0.00 C ATOM 1613 C PHE A 104 14.252 -0.065 -10.381 1.00 0.00 C ATOM 1614 O PHE A 104 13.105 -0.486 -10.189 1.00 0.00 O ATOM 1615 CB PHE A 104 13.829 0.811 -12.763 1.00 0.00 C ATOM 1616 CG PHE A 104 14.063 0.817 -14.289 1.00 0.00 C ATOM 1617 CD1 PHE A 104 14.950 1.717 -14.878 1.00 0.00 C ATOM 1618 CD2 PHE A 104 13.283 0.002 -15.115 1.00 0.00 C ATOM 1619 CE1 PHE A 104 14.994 1.865 -16.262 1.00 0.00 C ATOM 1620 CE2 PHE A 104 13.341 0.132 -16.497 1.00 0.00 C ATOM 1621 CZ PHE A 104 14.190 1.071 -17.072 1.00 0.00 C ATOM 0 H PHE A 104 14.258 -1.857 -12.578 1.00 0.00 H new ATOM 0 HA PHE A 104 15.737 0.626 -11.828 1.00 0.00 H new ATOM 0 HB2 PHE A 104 12.834 0.402 -12.589 1.00 0.00 H new ATOM 0 HB3 PHE A 104 13.809 1.850 -12.433 1.00 0.00 H new ATOM 0 HD1 PHE A 104 15.609 2.304 -14.256 1.00 0.00 H new ATOM 0 HD2 PHE A 104 12.629 -0.736 -14.674 1.00 0.00 H new ATOM 0 HE1 PHE A 104 15.653 2.597 -16.706 1.00 0.00 H new ATOM 0 HE2 PHE A 104 12.727 -0.496 -17.125 1.00 0.00 H new ATOM 0 HZ PHE A 104 14.225 1.183 -18.146 1.00 0.00 H new ATOM 1631 N VAL A 105 15.061 0.282 -9.366 1.00 0.00 N ATOM 1632 CA VAL A 105 14.711 0.042 -7.933 1.00 0.00 C ATOM 1633 C VAL A 105 13.957 1.300 -7.384 1.00 0.00 C ATOM 1634 O VAL A 105 14.569 2.308 -7.016 1.00 0.00 O ATOM 1635 CB VAL A 105 15.990 -0.362 -7.115 1.00 0.00 C ATOM 1636 CG1 VAL A 105 15.701 -0.599 -5.614 1.00 0.00 C ATOM 1637 CG2 VAL A 105 16.718 -1.625 -7.638 1.00 0.00 C ATOM 0 H VAL A 105 15.967 0.731 -9.500 1.00 0.00 H new ATOM 0 HA VAL A 105 14.032 -0.804 -7.828 1.00 0.00 H new ATOM 0 HB VAL A 105 16.637 0.505 -7.251 1.00 0.00 H new ATOM 0 HG11 VAL A 105 16.624 -0.875 -5.105 1.00 0.00 H new ATOM 0 HG12 VAL A 105 15.302 0.314 -5.172 1.00 0.00 H new ATOM 0 HG13 VAL A 105 14.973 -1.403 -5.506 1.00 0.00 H new ATOM 0 HG21 VAL A 105 17.588 -1.828 -7.013 1.00 0.00 H new ATOM 0 HG22 VAL A 105 16.039 -2.477 -7.603 1.00 0.00 H new ATOM 0 HG23 VAL A 105 17.040 -1.460 -8.666 1.00 0.00 H new ATOM 1647 N ARG A 106 12.617 1.230 -7.348 1.00 0.00 N ATOM 1648 CA ARG A 106 11.752 2.358 -6.910 1.00 0.00 C ATOM 1649 C ARG A 106 11.421 2.239 -5.393 1.00 0.00 C ATOM 1650 O ARG A 106 10.676 1.333 -5.017 1.00 0.00 O ATOM 1651 CB ARG A 106 10.484 2.275 -7.800 1.00 0.00 C ATOM 1652 CG ARG A 106 9.569 3.515 -7.800 1.00 0.00 C ATOM 1653 CD ARG A 106 8.257 3.326 -8.590 1.00 0.00 C ATOM 1654 NE ARG A 106 8.448 3.360 -10.072 1.00 0.00 N ATOM 1655 CZ ARG A 106 8.628 2.303 -10.869 1.00 0.00 C ATOM 1656 NH1 ARG A 106 8.667 1.066 -10.441 1.00 0.00 N ATOM 1657 NH2 ARG A 106 8.773 2.512 -12.145 1.00 0.00 N ATOM 0 H ARG A 106 12.095 0.396 -7.619 1.00 0.00 H new ATOM 0 HA ARG A 106 12.240 3.326 -7.025 1.00 0.00 H new ATOM 0 HB2 ARG A 106 10.798 2.081 -8.826 1.00 0.00 H new ATOM 0 HB3 ARG A 106 9.896 1.415 -7.479 1.00 0.00 H new ATOM 0 HG2 ARG A 106 9.327 3.775 -6.770 1.00 0.00 H new ATOM 0 HG3 ARG A 106 10.117 4.358 -8.221 1.00 0.00 H new ATOM 0 HD2 ARG A 106 7.807 2.373 -8.311 1.00 0.00 H new ATOM 0 HD3 ARG A 106 7.553 4.107 -8.304 1.00 0.00 H new ATOM 0 HE ARG A 106 8.440 4.278 -10.517 1.00 0.00 H new ATOM 0 HH11 ARG A 106 8.557 0.867 -9.447 1.00 0.00 H new ATOM 0 HH12 ARG A 106 8.808 0.302 -11.102 1.00 0.00 H new ATOM 0 HH21 ARG A 106 8.748 3.463 -12.512 1.00 0.00 H new ATOM 0 HH22 ARG A 106 8.912 1.725 -12.778 1.00 0.00 H new ATOM 1671 N GLU A 107 11.942 3.132 -4.534 1.00 0.00 N ATOM 1672 CA GLU A 107 11.764 3.033 -3.052 1.00 0.00 C ATOM 1673 C GLU A 107 11.261 4.370 -2.416 1.00 0.00 C ATOM 1674 O GLU A 107 11.788 5.448 -2.702 1.00 0.00 O ATOM 1675 CB GLU A 107 13.065 2.489 -2.391 1.00 0.00 C ATOM 1676 CG GLU A 107 14.368 3.312 -2.561 1.00 0.00 C ATOM 1677 CD GLU A 107 15.590 2.651 -1.933 1.00 0.00 C ATOM 1678 OE1 GLU A 107 16.280 1.810 -2.501 1.00 0.00 O ATOM 1679 OE2 GLU A 107 15.828 3.096 -0.668 1.00 0.00 O ATOM 0 H GLU A 107 12.494 3.937 -4.830 1.00 0.00 H new ATOM 0 HA GLU A 107 10.969 2.315 -2.852 1.00 0.00 H new ATOM 0 HB2 GLU A 107 12.876 2.380 -1.323 1.00 0.00 H new ATOM 0 HB3 GLU A 107 13.247 1.490 -2.786 1.00 0.00 H new ATOM 0 HG2 GLU A 107 14.554 3.467 -3.624 1.00 0.00 H new ATOM 0 HG3 GLU A 107 14.228 4.297 -2.115 1.00 0.00 H new ATOM 1687 N ILE A 108 10.259 4.299 -1.516 1.00 0.00 N ATOM 1688 CA ILE A 108 9.772 5.493 -0.749 1.00 0.00 C ATOM 1689 C ILE A 108 10.717 5.752 0.471 1.00 0.00 C ATOM 1690 O ILE A 108 10.952 4.846 1.278 1.00 0.00 O ATOM 1691 CB ILE A 108 8.266 5.340 -0.319 1.00 0.00 C ATOM 1692 CG1 ILE A 108 7.263 5.014 -1.466 1.00 0.00 C ATOM 1693 CG2 ILE A 108 7.727 6.569 0.466 1.00 0.00 C ATOM 1694 CD1 ILE A 108 7.278 5.973 -2.668 1.00 0.00 C ATOM 0 H ILE A 108 9.764 3.435 -1.294 1.00 0.00 H new ATOM 0 HA ILE A 108 9.806 6.367 -1.400 1.00 0.00 H new ATOM 0 HB ILE A 108 8.309 4.466 0.331 1.00 0.00 H new ATOM 0 HG12 ILE A 108 7.470 4.007 -1.828 1.00 0.00 H new ATOM 0 HG13 ILE A 108 6.256 5.002 -1.049 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.684 6.401 0.733 1.00 0.00 H new ATOM 0 HG22 ILE A 108 8.316 6.709 1.373 1.00 0.00 H new ATOM 0 HG23 ILE A 108 7.803 7.460 -0.157 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.541 5.648 -3.402 1.00 0.00 H new ATOM 0 HD12 ILE A 108 7.036 6.981 -2.332 1.00 0.00 H new ATOM 0 HD13 ILE A 108 8.268 5.971 -3.123 1.00 0.00 H new ATOM 1706 N LYS A 109 11.236 6.988 0.614 1.00 0.00 N ATOM 1707 CA LYS A 109 12.155 7.343 1.730 1.00 0.00 C ATOM 1708 C LYS A 109 11.378 8.127 2.837 1.00 0.00 C ATOM 1709 O LYS A 109 10.872 7.508 3.775 1.00 0.00 O ATOM 1710 CB LYS A 109 13.414 7.989 1.086 1.00 0.00 C ATOM 1711 CG LYS A 109 14.567 8.269 2.078 1.00 0.00 C ATOM 1712 CD LYS A 109 15.871 8.746 1.400 1.00 0.00 C ATOM 1713 CE LYS A 109 15.843 10.151 0.766 1.00 0.00 C ATOM 1714 NZ LYS A 109 15.795 11.220 1.783 1.00 0.00 N ATOM 0 H LYS A 109 11.039 7.759 -0.024 1.00 0.00 H new ATOM 0 HA LYS A 109 12.536 6.495 2.300 1.00 0.00 H new ATOM 0 HB2 LYS A 109 13.781 7.332 0.297 1.00 0.00 H new ATOM 0 HB3 LYS A 109 13.124 8.926 0.611 1.00 0.00 H new ATOM 0 HG2 LYS A 109 14.243 9.025 2.793 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.774 7.362 2.645 1.00 0.00 H new ATOM 0 HD2 LYS A 109 16.669 8.722 2.142 1.00 0.00 H new ATOM 0 HD3 LYS A 109 16.135 8.027 0.624 1.00 0.00 H new ATOM 0 HE2 LYS A 109 16.727 10.284 0.143 1.00 0.00 H new ATOM 0 HE3 LYS A 109 14.976 10.235 0.111 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 15.777 12.147 1.312 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 14.938 11.110 2.362 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 16.635 11.157 2.392 1.00 0.00 H new ATOM 1727 N ASP A 110 11.252 9.462 2.730 1.00 0.00 N ATOM 1728 CA ASP A 110 10.385 10.275 3.628 1.00 0.00 C ATOM 1729 C ASP A 110 9.756 11.407 2.763 1.00 0.00 C ATOM 1730 O ASP A 110 10.408 12.419 2.485 1.00 0.00 O ATOM 1731 CB ASP A 110 11.239 10.788 4.817 1.00 0.00 C ATOM 1732 CG ASP A 110 10.435 11.469 5.922 1.00 0.00 C ATOM 1733 OD1 ASP A 110 9.581 10.901 6.595 1.00 0.00 O ATOM 1734 OD2 ASP A 110 10.766 12.780 6.076 1.00 0.00 O ATOM 0 H ASP A 110 11.742 10.013 2.025 1.00 0.00 H new ATOM 0 HA ASP A 110 9.569 9.702 4.067 1.00 0.00 H new ATOM 0 HB2 ASP A 110 11.784 9.948 5.246 1.00 0.00 H new ATOM 0 HB3 ASP A 110 11.982 11.490 4.439 1.00 0.00 H new ATOM 1740 N GLY A 111 8.528 11.198 2.253 1.00 0.00 N ATOM 1741 CA GLY A 111 7.953 12.086 1.198 1.00 0.00 C ATOM 1742 C GLY A 111 8.354 11.798 -0.272 1.00 0.00 C ATOM 1743 O GLY A 111 7.501 11.890 -1.159 1.00 0.00 O ATOM 0 H GLY A 111 7.914 10.436 2.542 1.00 0.00 H new ATOM 0 HA2 GLY A 111 6.867 12.032 1.268 1.00 0.00 H new ATOM 0 HA3 GLY A 111 8.237 13.112 1.430 1.00 0.00 H new ATOM 1747 N LYS A 112 9.638 11.493 -0.541 1.00 0.00 N ATOM 1748 CA LYS A 112 10.129 11.223 -1.915 1.00 0.00 C ATOM 1749 C LYS A 112 10.102 9.711 -2.291 1.00 0.00 C ATOM 1750 O LYS A 112 10.388 8.820 -1.484 1.00 0.00 O ATOM 1751 CB LYS A 112 11.573 11.768 -2.108 1.00 0.00 C ATOM 1752 CG LYS A 112 11.690 13.277 -2.403 1.00 0.00 C ATOM 1753 CD LYS A 112 13.133 13.686 -2.768 1.00 0.00 C ATOM 1754 CE LYS A 112 13.288 15.106 -3.340 1.00 0.00 C ATOM 1755 NZ LYS A 112 12.990 16.156 -2.344 1.00 0.00 N ATOM 0 H LYS A 112 10.361 11.426 0.176 1.00 0.00 H new ATOM 0 HA LYS A 112 9.440 11.743 -2.581 1.00 0.00 H new ATOM 0 HB2 LYS A 112 12.147 11.548 -1.208 1.00 0.00 H new ATOM 0 HB3 LYS A 112 12.041 11.220 -2.926 1.00 0.00 H new ATOM 0 HG2 LYS A 112 11.021 13.539 -3.223 1.00 0.00 H new ATOM 0 HG3 LYS A 112 11.363 13.843 -1.531 1.00 0.00 H new ATOM 0 HD2 LYS A 112 13.754 13.601 -1.876 1.00 0.00 H new ATOM 0 HD3 LYS A 112 13.522 12.974 -3.496 1.00 0.00 H new ATOM 0 HE2 LYS A 112 14.306 15.237 -3.707 1.00 0.00 H new ATOM 0 HE3 LYS A 112 12.623 15.223 -4.196 1.00 0.00 H new ATOM 0 HZ1 LYS A 112 13.109 17.092 -2.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 112 12.010 16.051 -2.012 1.00 0.00 H new ATOM 0 HZ3 LYS A 112 13.641 16.064 -1.538 1.00 0.00 H new ATOM 1768 N MET A 113 9.883 9.473 -3.592 1.00 0.00 N ATOM 1769 CA MET A 113 10.267 8.214 -4.266 1.00 0.00 C ATOM 1770 C MET A 113 11.710 8.373 -4.839 1.00 0.00 C ATOM 1771 O MET A 113 11.953 9.104 -5.807 1.00 0.00 O ATOM 1772 CB MET A 113 9.175 7.919 -5.324 1.00 0.00 C ATOM 1773 CG MET A 113 9.406 6.685 -6.215 1.00 0.00 C ATOM 1774 SD MET A 113 9.910 7.180 -7.876 1.00 0.00 S ATOM 1775 CE MET A 113 8.327 7.676 -8.586 1.00 0.00 C ATOM 0 H MET A 113 9.434 10.147 -4.212 1.00 0.00 H new ATOM 0 HA MET A 113 10.312 7.355 -3.597 1.00 0.00 H new ATOM 0 HB2 MET A 113 8.223 7.795 -4.808 1.00 0.00 H new ATOM 0 HB3 MET A 113 9.077 8.793 -5.968 1.00 0.00 H new ATOM 0 HG2 MET A 113 10.172 6.049 -5.772 1.00 0.00 H new ATOM 0 HG3 MET A 113 8.492 6.093 -6.268 1.00 0.00 H new ATOM 0 HE1 MET A 113 8.435 7.803 -9.663 1.00 0.00 H new ATOM 0 HE2 MET A 113 7.581 6.907 -8.384 1.00 0.00 H new ATOM 0 HE3 MET A 113 8.007 8.618 -8.140 1.00 0.00 H new ATOM 1785 N VAL A 114 12.668 7.666 -4.224 1.00 0.00 N ATOM 1786 CA VAL A 114 14.055 7.545 -4.753 1.00 0.00 C ATOM 1787 C VAL A 114 14.042 6.366 -5.780 1.00 0.00 C ATOM 1788 O VAL A 114 13.983 5.188 -5.408 1.00 0.00 O ATOM 1789 CB VAL A 114 15.078 7.371 -3.577 1.00 0.00 C ATOM 1790 CG1 VAL A 114 16.532 7.156 -4.056 1.00 0.00 C ATOM 1791 CG2 VAL A 114 15.109 8.570 -2.598 1.00 0.00 C ATOM 0 H VAL A 114 12.516 7.161 -3.351 1.00 0.00 H new ATOM 0 HA VAL A 114 14.386 8.447 -5.269 1.00 0.00 H new ATOM 0 HB VAL A 114 14.710 6.481 -3.067 1.00 0.00 H new ATOM 0 HG11 VAL A 114 17.187 7.043 -3.192 1.00 0.00 H new ATOM 0 HG12 VAL A 114 16.584 6.257 -4.670 1.00 0.00 H new ATOM 0 HG13 VAL A 114 16.852 8.016 -4.644 1.00 0.00 H new ATOM 0 HG21 VAL A 114 15.839 8.379 -1.811 1.00 0.00 H new ATOM 0 HG22 VAL A 114 15.387 9.474 -3.139 1.00 0.00 H new ATOM 0 HG23 VAL A 114 14.123 8.702 -2.153 1.00 0.00 H new ATOM 1801 N MET A 115 14.065 6.699 -7.079 1.00 0.00 N ATOM 1802 CA MET A 115 14.151 5.693 -8.165 1.00 0.00 C ATOM 1803 C MET A 115 15.644 5.500 -8.560 1.00 0.00 C ATOM 1804 O MET A 115 16.285 6.421 -9.074 1.00 0.00 O ATOM 1805 CB MET A 115 13.240 6.160 -9.331 1.00 0.00 C ATOM 1806 CG MET A 115 12.917 5.057 -10.362 1.00 0.00 C ATOM 1807 SD MET A 115 12.183 5.747 -11.865 1.00 0.00 S ATOM 1808 CE MET A 115 10.571 6.296 -11.280 1.00 0.00 C ATOM 0 H MET A 115 14.025 7.662 -7.412 1.00 0.00 H new ATOM 0 HA MET A 115 13.791 4.713 -7.852 1.00 0.00 H new ATOM 0 HB2 MET A 115 12.306 6.540 -8.918 1.00 0.00 H new ATOM 0 HB3 MET A 115 13.723 6.991 -9.844 1.00 0.00 H new ATOM 0 HG2 MET A 115 13.829 4.517 -10.616 1.00 0.00 H new ATOM 0 HG3 MET A 115 12.231 4.334 -9.920 1.00 0.00 H new ATOM 0 HE1 MET A 115 9.894 6.406 -12.127 1.00 0.00 H new ATOM 0 HE2 MET A 115 10.166 5.560 -10.585 1.00 0.00 H new ATOM 0 HE3 MET A 115 10.675 7.255 -10.773 1.00 0.00 H new ATOM 1818 N THR A 116 16.196 4.303 -8.319 1.00 0.00 N ATOM 1819 CA THR A 116 17.616 3.985 -8.641 1.00 0.00 C ATOM 1820 C THR A 116 17.635 3.151 -9.963 1.00 0.00 C ATOM 1821 O THR A 116 17.368 1.944 -9.975 1.00 0.00 O ATOM 1822 CB THR A 116 18.269 3.300 -7.405 1.00 0.00 C ATOM 1823 OG1 THR A 116 18.225 4.168 -6.275 1.00 0.00 O ATOM 1824 CG2 THR A 116 19.748 2.933 -7.576 1.00 0.00 C ATOM 0 H THR A 116 15.686 3.526 -7.899 1.00 0.00 H new ATOM 0 HA THR A 116 18.223 4.870 -8.832 1.00 0.00 H new ATOM 0 HB THR A 116 17.689 2.386 -7.278 1.00 0.00 H new ATOM 0 HG1 THR A 116 18.637 3.724 -5.505 1.00 0.00 H new ATOM 0 HG21 THR A 116 20.114 2.462 -6.664 1.00 0.00 H new ATOM 0 HG22 THR A 116 19.857 2.241 -8.411 1.00 0.00 H new ATOM 0 HG23 THR A 116 20.326 3.835 -7.775 1.00 0.00 H new ATOM 1832 N LEU A 117 17.921 3.826 -11.088 1.00 0.00 N ATOM 1833 CA LEU A 117 17.862 3.229 -12.446 1.00 0.00 C ATOM 1834 C LEU A 117 19.280 2.703 -12.810 1.00 0.00 C ATOM 1835 O LEU A 117 20.183 3.513 -13.052 1.00 0.00 O ATOM 1836 CB LEU A 117 17.391 4.293 -13.489 1.00 0.00 C ATOM 1837 CG LEU A 117 15.953 4.878 -13.392 1.00 0.00 C ATOM 1838 CD1 LEU A 117 15.837 5.996 -12.351 1.00 0.00 C ATOM 1839 CD2 LEU A 117 15.511 5.450 -14.749 1.00 0.00 C ATOM 0 H LEU A 117 18.202 4.807 -11.089 1.00 0.00 H new ATOM 0 HA LEU A 117 17.145 2.408 -12.461 1.00 0.00 H new ATOM 0 HB2 LEU A 117 18.088 5.130 -13.439 1.00 0.00 H new ATOM 0 HB3 LEU A 117 17.497 3.849 -14.479 1.00 0.00 H new ATOM 0 HG LEU A 117 15.312 4.050 -13.089 1.00 0.00 H new ATOM 0 HD11 LEU A 117 14.812 6.366 -12.327 1.00 0.00 H new ATOM 0 HD12 LEU A 117 16.106 5.608 -11.369 1.00 0.00 H new ATOM 0 HD13 LEU A 117 16.511 6.811 -12.616 1.00 0.00 H new ATOM 0 HD21 LEU A 117 14.503 5.855 -14.662 1.00 0.00 H new ATOM 0 HD22 LEU A 117 16.196 6.243 -15.050 1.00 0.00 H new ATOM 0 HD23 LEU A 117 15.521 4.658 -15.498 1.00 0.00 H new ATOM 1851 N THR A 118 19.503 1.372 -12.824 1.00 0.00 N ATOM 1852 CA THR A 118 20.877 0.815 -13.010 1.00 0.00 C ATOM 1853 C THR A 118 20.987 -0.321 -14.079 1.00 0.00 C ATOM 1854 O THR A 118 20.189 -1.266 -14.128 1.00 0.00 O ATOM 1855 CB THR A 118 21.558 0.493 -11.645 1.00 0.00 C ATOM 1856 OG1 THR A 118 22.938 0.198 -11.853 1.00 0.00 O ATOM 1857 CG2 THR A 118 20.977 -0.676 -10.842 1.00 0.00 C ATOM 0 H THR A 118 18.773 0.669 -12.712 1.00 0.00 H new ATOM 0 HA THR A 118 21.465 1.614 -13.461 1.00 0.00 H new ATOM 0 HB THR A 118 21.379 1.394 -11.058 1.00 0.00 H new ATOM 0 HG1 THR A 118 23.389 0.986 -12.222 1.00 0.00 H new ATOM 0 HG21 THR A 118 21.538 -0.796 -9.915 1.00 0.00 H new ATOM 0 HG22 THR A 118 19.932 -0.474 -10.609 1.00 0.00 H new ATOM 0 HG23 THR A 118 21.047 -1.591 -11.429 1.00 0.00 H new ATOM 1865 N PHE A 119 22.029 -0.195 -14.924 1.00 0.00 N ATOM 1866 CA PHE A 119 22.412 -1.212 -15.936 1.00 0.00 C ATOM 1867 C PHE A 119 23.767 -1.868 -15.511 1.00 0.00 C ATOM 1868 O PHE A 119 24.843 -1.490 -15.988 1.00 0.00 O ATOM 1869 CB PHE A 119 22.443 -0.471 -17.308 1.00 0.00 C ATOM 1870 CG PHE A 119 22.661 -1.359 -18.542 1.00 0.00 C ATOM 1871 CD1 PHE A 119 21.693 -2.296 -18.912 1.00 0.00 C ATOM 1872 CD2 PHE A 119 23.819 -1.230 -19.317 1.00 0.00 C ATOM 1873 CE1 PHE A 119 21.880 -3.099 -20.032 1.00 0.00 C ATOM 1874 CE2 PHE A 119 24.003 -2.031 -20.442 1.00 0.00 C ATOM 1875 CZ PHE A 119 23.033 -2.963 -20.801 1.00 0.00 C ATOM 0 H PHE A 119 22.638 0.623 -14.927 1.00 0.00 H new ATOM 0 HA PHE A 119 21.709 -2.041 -16.018 1.00 0.00 H new ATOM 0 HB2 PHE A 119 21.502 0.065 -17.431 1.00 0.00 H new ATOM 0 HB3 PHE A 119 23.235 0.277 -17.278 1.00 0.00 H new ATOM 0 HD1 PHE A 119 20.793 -2.397 -18.324 1.00 0.00 H new ATOM 0 HD2 PHE A 119 24.573 -0.507 -19.042 1.00 0.00 H new ATOM 0 HE1 PHE A 119 21.131 -3.828 -20.305 1.00 0.00 H new ATOM 0 HE2 PHE A 119 24.899 -1.929 -21.036 1.00 0.00 H new ATOM 0 HZ PHE A 119 23.175 -3.580 -21.676 1.00 0.00 H new ATOM 1885 N GLY A 120 23.707 -2.830 -14.568 1.00 0.00 N ATOM 1886 CA GLY A 120 24.917 -3.504 -14.021 1.00 0.00 C ATOM 1887 C GLY A 120 25.827 -2.635 -13.125 1.00 0.00 C ATOM 1888 O GLY A 120 25.650 -2.579 -11.908 1.00 0.00 O ATOM 0 H GLY A 120 22.832 -3.163 -14.164 1.00 0.00 H new ATOM 0 HA2 GLY A 120 24.596 -4.373 -13.446 1.00 0.00 H new ATOM 0 HA3 GLY A 120 25.511 -3.876 -14.856 1.00 0.00 H new ATOM 1892 N ASP A 121 26.802 -1.970 -13.757 1.00 0.00 N ATOM 1893 CA ASP A 121 27.710 -1.003 -13.073 1.00 0.00 C ATOM 1894 C ASP A 121 27.191 0.479 -12.998 1.00 0.00 C ATOM 1895 O ASP A 121 27.499 1.177 -12.029 1.00 0.00 O ATOM 1896 CB ASP A 121 29.084 -1.135 -13.787 1.00 0.00 C ATOM 1897 CG ASP A 121 30.253 -0.454 -13.077 1.00 0.00 C ATOM 1898 OD1 ASP A 121 30.945 -0.999 -12.225 1.00 0.00 O ATOM 1899 OD2 ASP A 121 30.441 0.827 -13.498 1.00 0.00 O ATOM 0 H ASP A 121 26.994 -2.077 -14.753 1.00 0.00 H new ATOM 0 HA ASP A 121 27.776 -1.258 -12.015 1.00 0.00 H new ATOM 0 HB2 ASP A 121 29.316 -2.194 -13.901 1.00 0.00 H new ATOM 0 HB3 ASP A 121 28.996 -0.718 -14.790 1.00 0.00 H new ATOM 1905 N VAL A 122 26.463 0.978 -14.015 1.00 0.00 N ATOM 1906 CA VAL A 122 26.103 2.426 -14.137 1.00 0.00 C ATOM 1907 C VAL A 122 24.770 2.709 -13.364 1.00 0.00 C ATOM 1908 O VAL A 122 23.799 1.959 -13.505 1.00 0.00 O ATOM 1909 CB VAL A 122 26.054 2.857 -15.646 1.00 0.00 C ATOM 1910 CG1 VAL A 122 25.790 4.371 -15.823 1.00 0.00 C ATOM 1911 CG2 VAL A 122 27.359 2.557 -16.429 1.00 0.00 C ATOM 0 H VAL A 122 26.104 0.403 -14.777 1.00 0.00 H new ATOM 0 HA VAL A 122 26.874 3.041 -13.673 1.00 0.00 H new ATOM 0 HB VAL A 122 25.234 2.260 -16.045 1.00 0.00 H new ATOM 0 HG11 VAL A 122 25.766 4.614 -16.885 1.00 0.00 H new ATOM 0 HG12 VAL A 122 24.833 4.629 -15.370 1.00 0.00 H new ATOM 0 HG13 VAL A 122 26.585 4.938 -15.339 1.00 0.00 H new ATOM 0 HG21 VAL A 122 27.246 2.883 -17.463 1.00 0.00 H new ATOM 0 HG22 VAL A 122 28.190 3.091 -15.969 1.00 0.00 H new ATOM 0 HG23 VAL A 122 27.559 1.486 -16.407 1.00 0.00 H new ATOM 1921 N VAL A 123 24.732 3.771 -12.535 1.00 0.00 N ATOM 1922 CA VAL A 123 23.608 4.027 -11.577 1.00 0.00 C ATOM 1923 C VAL A 123 23.085 5.495 -11.765 1.00 0.00 C ATOM 1924 O VAL A 123 23.776 6.452 -11.401 1.00 0.00 O ATOM 1925 CB VAL A 123 24.061 3.753 -10.093 1.00 0.00 C ATOM 1926 CG1 VAL A 123 22.912 3.949 -9.077 1.00 0.00 C ATOM 1927 CG2 VAL A 123 24.641 2.343 -9.816 1.00 0.00 C ATOM 0 H VAL A 123 25.467 4.477 -12.501 1.00 0.00 H new ATOM 0 HA VAL A 123 22.789 3.340 -11.790 1.00 0.00 H new ATOM 0 HB VAL A 123 24.854 4.489 -9.965 1.00 0.00 H new ATOM 0 HG11 VAL A 123 23.278 3.748 -8.070 1.00 0.00 H new ATOM 0 HG12 VAL A 123 22.548 4.975 -9.132 1.00 0.00 H new ATOM 0 HG13 VAL A 123 22.098 3.263 -9.311 1.00 0.00 H new ATOM 0 HG21 VAL A 123 24.920 2.264 -8.765 1.00 0.00 H new ATOM 0 HG22 VAL A 123 23.890 1.588 -10.050 1.00 0.00 H new ATOM 0 HG23 VAL A 123 25.522 2.183 -10.438 1.00 0.00 H new ATOM 1937 N ALA A 124 21.844 5.672 -12.257 1.00 0.00 N ATOM 1938 CA ALA A 124 21.165 6.995 -12.302 1.00 0.00 C ATOM 1939 C ALA A 124 20.059 7.124 -11.214 1.00 0.00 C ATOM 1940 O ALA A 124 19.032 6.440 -11.263 1.00 0.00 O ATOM 1941 CB ALA A 124 20.583 7.177 -13.712 1.00 0.00 C ATOM 0 H ALA A 124 21.280 4.910 -12.634 1.00 0.00 H new ATOM 0 HA ALA A 124 21.888 7.781 -12.086 1.00 0.00 H new ATOM 0 HB1 ALA A 124 20.078 8.141 -13.775 1.00 0.00 H new ATOM 0 HB2 ALA A 124 21.388 7.141 -14.446 1.00 0.00 H new ATOM 0 HB3 ALA A 124 19.869 6.379 -13.917 1.00 0.00 H new ATOM 1947 N VAL A 125 20.250 8.032 -10.243 1.00 0.00 N ATOM 1948 CA VAL A 125 19.272 8.239 -9.133 1.00 0.00 C ATOM 1949 C VAL A 125 18.275 9.381 -9.536 1.00 0.00 C ATOM 1950 O VAL A 125 18.659 10.551 -9.649 1.00 0.00 O ATOM 1951 CB VAL A 125 19.994 8.492 -7.764 1.00 0.00 C ATOM 1952 CG1 VAL A 125 18.989 8.557 -6.592 1.00 0.00 C ATOM 1953 CG2 VAL A 125 21.044 7.422 -7.371 1.00 0.00 C ATOM 0 H VAL A 125 21.068 8.640 -10.194 1.00 0.00 H new ATOM 0 HA VAL A 125 18.691 7.330 -8.979 1.00 0.00 H new ATOM 0 HB VAL A 125 20.502 9.442 -7.927 1.00 0.00 H new ATOM 0 HG11 VAL A 125 19.527 8.733 -5.661 1.00 0.00 H new ATOM 0 HG12 VAL A 125 18.283 9.370 -6.763 1.00 0.00 H new ATOM 0 HG13 VAL A 125 18.447 7.614 -6.525 1.00 0.00 H new ATOM 0 HG21 VAL A 125 21.488 7.684 -6.411 1.00 0.00 H new ATOM 0 HG22 VAL A 125 20.560 6.448 -7.294 1.00 0.00 H new ATOM 0 HG23 VAL A 125 21.823 7.380 -8.132 1.00 0.00 H new ATOM 1963 N ARG A 126 16.996 9.028 -9.745 1.00 0.00 N ATOM 1964 CA ARG A 126 15.907 10.001 -10.029 1.00 0.00 C ATOM 1965 C ARG A 126 15.048 10.276 -8.754 1.00 0.00 C ATOM 1966 O ARG A 126 14.437 9.375 -8.170 1.00 0.00 O ATOM 1967 CB ARG A 126 15.059 9.492 -11.224 1.00 0.00 C ATOM 1968 CG ARG A 126 15.667 9.819 -12.606 1.00 0.00 C ATOM 1969 CD ARG A 126 14.860 9.266 -13.799 1.00 0.00 C ATOM 1970 NE ARG A 126 15.168 10.034 -15.041 1.00 0.00 N ATOM 1971 CZ ARG A 126 14.533 11.135 -15.442 1.00 0.00 C ATOM 1972 NH1 ARG A 126 13.479 11.609 -14.841 1.00 0.00 N ATOM 1973 NH2 ARG A 126 14.979 11.779 -16.480 1.00 0.00 N ATOM 0 H ARG A 126 16.678 8.059 -9.723 1.00 0.00 H new ATOM 0 HA ARG A 126 16.341 10.960 -10.311 1.00 0.00 H new ATOM 0 HB2 ARG A 126 14.938 8.412 -11.137 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.063 9.930 -11.163 1.00 0.00 H new ATOM 0 HG2 ARG A 126 15.749 10.901 -12.708 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.679 9.417 -12.649 1.00 0.00 H new ATOM 0 HD2 ARG A 126 15.096 8.212 -13.948 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.793 9.326 -13.583 1.00 0.00 H new ATOM 0 HE ARG A 126 15.925 9.688 -15.630 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.102 11.133 -14.022 1.00 0.00 H new ATOM 0 HH12 ARG A 126 13.031 12.456 -15.190 1.00 0.00 H new ATOM 0 HH21 ARG A 126 15.804 11.440 -16.975 1.00 0.00 H new ATOM 0 HH22 ARG A 126 14.504 12.623 -16.799 1.00 0.00 H new ATOM 1987 N HIS A 127 15.007 11.551 -8.344 1.00 0.00 N ATOM 1988 CA HIS A 127 14.451 11.973 -7.029 1.00 0.00 C ATOM 1989 C HIS A 127 13.027 12.578 -7.237 1.00 0.00 C ATOM 1990 O HIS A 127 12.893 13.717 -7.698 1.00 0.00 O ATOM 1991 CB HIS A 127 15.429 13.010 -6.395 1.00 0.00 C ATOM 1992 CG HIS A 127 16.859 12.546 -6.101 1.00 0.00 C ATOM 1993 ND1 HIS A 127 17.882 12.611 -7.026 1.00 0.00 N ATOM 1994 CD2 HIS A 127 17.349 12.052 -4.883 1.00 0.00 C ATOM 1995 CE1 HIS A 127 18.918 12.127 -6.278 1.00 0.00 C ATOM 1996 NE2 HIS A 127 18.707 11.768 -4.970 1.00 0.00 N ATOM 0 H HIS A 127 15.356 12.327 -8.907 1.00 0.00 H new ATOM 0 HA HIS A 127 14.353 11.123 -6.354 1.00 0.00 H new ATOM 0 HB2 HIS A 127 15.485 13.871 -7.062 1.00 0.00 H new ATOM 0 HB3 HIS A 127 14.990 13.359 -5.460 1.00 0.00 H new ATOM 0 HD1 HIS A 127 17.868 12.930 -7.995 1.00 0.00 H new ATOM 0 HD2 HIS A 127 16.750 11.911 -3.995 1.00 0.00 H new ATOM 0 HE1 HIS A 127 19.901 12.027 -6.715 1.00 0.00 H new ATOM 2004 N TYR A 128 11.960 11.826 -6.924 1.00 0.00 N ATOM 2005 CA TYR A 128 10.566 12.224 -7.260 1.00 0.00 C ATOM 2006 C TYR A 128 9.768 12.712 -6.009 1.00 0.00 C ATOM 2007 O TYR A 128 9.660 11.993 -5.014 1.00 0.00 O ATOM 2008 CB TYR A 128 9.905 10.984 -7.930 1.00 0.00 C ATOM 2009 CG TYR A 128 10.083 10.882 -9.453 1.00 0.00 C ATOM 2010 CD1 TYR A 128 9.185 11.578 -10.260 1.00 0.00 C ATOM 2011 CD2 TYR A 128 11.084 10.110 -10.050 1.00 0.00 C ATOM 2012 CE1 TYR A 128 9.283 11.519 -11.642 1.00 0.00 C ATOM 2013 CE2 TYR A 128 11.184 10.050 -11.444 1.00 0.00 C ATOM 2014 CZ TYR A 128 10.291 10.773 -12.237 1.00 0.00 C ATOM 2015 OH TYR A 128 10.409 10.791 -13.602 1.00 0.00 O ATOM 0 H TYR A 128 12.028 10.933 -6.436 1.00 0.00 H new ATOM 0 HA TYR A 128 10.565 13.078 -7.937 1.00 0.00 H new ATOM 0 HB2 TYR A 128 10.315 10.084 -7.473 1.00 0.00 H new ATOM 0 HB3 TYR A 128 8.838 10.997 -7.706 1.00 0.00 H new ATOM 0 HD1 TYR A 128 8.405 12.169 -9.804 1.00 0.00 H new ATOM 0 HD2 TYR A 128 11.780 9.560 -9.435 1.00 0.00 H new ATOM 0 HE1 TYR A 128 8.574 12.054 -12.256 1.00 0.00 H new ATOM 0 HE2 TYR A 128 11.951 9.446 -11.906 1.00 0.00 H new ATOM 0 HH TYR A 128 9.849 11.506 -13.969 1.00 0.00 H new ATOM 2025 N GLU A 129 9.159 13.909 -6.093 1.00 0.00 N ATOM 2026 CA GLU A 129 8.178 14.418 -5.081 1.00 0.00 C ATOM 2027 C GLU A 129 6.688 14.202 -5.517 1.00 0.00 C ATOM 2028 O GLU A 129 6.375 14.120 -6.709 1.00 0.00 O ATOM 2029 CB GLU A 129 8.453 15.937 -4.837 1.00 0.00 C ATOM 2030 CG GLU A 129 9.433 16.273 -3.687 1.00 0.00 C ATOM 2031 CD GLU A 129 8.831 16.165 -2.283 1.00 0.00 C ATOM 2032 OE1 GLU A 129 8.294 17.107 -1.708 1.00 0.00 O ATOM 2033 OE2 GLU A 129 8.947 14.910 -1.757 1.00 0.00 O ATOM 0 H GLU A 129 9.324 14.561 -6.860 1.00 0.00 H new ATOM 0 HA GLU A 129 8.316 13.848 -4.162 1.00 0.00 H new ATOM 0 HB2 GLU A 129 8.844 16.368 -5.759 1.00 0.00 H new ATOM 0 HB3 GLU A 129 7.502 16.430 -4.633 1.00 0.00 H new ATOM 0 HG2 GLU A 129 10.291 15.605 -3.752 1.00 0.00 H new ATOM 0 HG3 GLU A 129 9.807 17.287 -3.831 1.00 0.00 H new ATOM 2041 N LYS A 130 5.756 14.141 -4.545 1.00 0.00 N ATOM 2042 CA LYS A 130 4.295 14.021 -4.834 1.00 0.00 C ATOM 2043 C LYS A 130 3.639 15.374 -5.277 1.00 0.00 C ATOM 2044 O LYS A 130 3.837 16.418 -4.646 1.00 0.00 O ATOM 2045 CB LYS A 130 3.532 13.473 -3.593 1.00 0.00 C ATOM 2046 CG LYS A 130 3.838 12.013 -3.197 1.00 0.00 C ATOM 2047 CD LYS A 130 2.892 11.471 -2.107 1.00 0.00 C ATOM 2048 CE LYS A 130 3.146 9.985 -1.811 1.00 0.00 C ATOM 2049 NZ LYS A 130 2.215 9.492 -0.779 1.00 0.00 N ATOM 0 H LYS A 130 5.979 14.172 -3.550 1.00 0.00 H new ATOM 0 HA LYS A 130 4.214 13.324 -5.668 1.00 0.00 H new ATOM 0 HB2 LYS A 130 3.758 14.114 -2.741 1.00 0.00 H new ATOM 0 HB3 LYS A 130 2.462 13.560 -3.782 1.00 0.00 H new ATOM 0 HG2 LYS A 130 3.764 11.380 -4.081 1.00 0.00 H new ATOM 0 HG3 LYS A 130 4.867 11.947 -2.843 1.00 0.00 H new ATOM 0 HD2 LYS A 130 3.023 12.050 -1.193 1.00 0.00 H new ATOM 0 HD3 LYS A 130 1.858 11.606 -2.425 1.00 0.00 H new ATOM 0 HE2 LYS A 130 3.027 9.402 -2.724 1.00 0.00 H new ATOM 0 HE3 LYS A 130 4.174 9.846 -1.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 2.403 8.486 -0.594 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 2.348 10.036 0.097 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 1.236 9.605 -1.112 1.00 0.00 H new ATOM 2062 N ALA A 131 2.813 15.313 -6.329 1.00 0.00 N ATOM 2063 CA ALA A 131 1.832 16.366 -6.673 1.00 0.00 C ATOM 2064 C ALA A 131 0.383 15.902 -6.360 1.00 0.00 C ATOM 2065 O ALA A 131 -0.360 16.683 -5.724 1.00 0.00 O ATOM 2066 CB ALA A 131 2.009 16.680 -8.165 1.00 0.00 C ATOM 2067 OXT ALA A 131 -0.025 14.776 -6.746 1.00 0.00 O ATOM 0 H ALA A 131 2.802 14.525 -6.976 1.00 0.00 H new ATOM 0 HA ALA A 131 2.004 17.261 -6.075 1.00 0.00 H new ATOM 0 HB1 ALA A 131 1.301 17.455 -8.460 1.00 0.00 H new ATOM 0 HB2 ALA A 131 3.026 17.029 -8.345 1.00 0.00 H new ATOM 0 HB3 ALA A 131 1.826 15.779 -8.751 1.00 0.00 H new TER 2073 ALA A 131