USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=41 USER MOD reduce.3.24.130724 removed 1293 hydrogens (26 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 126 THR OG1 : rot 150:sc= -0.0245 USER MOD Set 1.2: A 170 NDP O2D : rot 76:sc= -1.65! USER MOD Set 2.1: A 112 THR OG1 : rot 180:sc= 0 USER MOD Set 2.2: A 159 GLN : amide:sc= -0.276 K(o=-0.28,f=-2.9!) USER MOD Set 3.1: A 89 HIS : no HD1:sc= -0.771 X(o=-4.3,f=-4.7) USER MOD Set 3.2: A 92 GLN :FLIP amide:sc= -3.48! F(o=-6.4,f=-4.3!) USER MOD Set 4.1: A 39 MET CE :methyl 169:sc= -3.48! (180deg=-4!) USER MOD Set 4.2: A 59 ASN : amide:sc= -5.34! C(o=-8.8!,f=-16!) USER MOD Single : A 1 THR N :NH3+ 151:sc= 1.47 (180deg=0.871) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0.0999 USER MOD Single : A 7 GLN :FLIP amide:sc= -4.03 F(o=-6.2,f=-4) USER MOD Single : A 15 LYS NZ :NH3+ -148:sc= -0.349 (180deg=-1.67!) USER MOD Single : A 18 HIS : no HE2:sc= -0.254 K(o=-0.25,f=-5!) USER MOD Single : A 22 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.113 X(o=-0.11,f=-0.0078) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN :FLIP amide:sc= -0.0661 F(o=-0.6,f=-0.066) USER MOD Single : A 34 THR OG1 : rot -93:sc= 0.724 USER MOD Single : A 37 LYS NZ :NH3+ 149:sc= 0 (180deg=-1.15) USER MOD Single : A 45 THR OG1 : rot -32:sc= -0.215 USER MOD Single : A 46 TYR OH : rot 89:sc= 1.01 USER MOD Single : A 48 SER OG : rot 150:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 THR OG1 : rot 180:sc=-0.00101 USER MOD Single : A 64 HIS : no HD1:sc= -2.19 X(o=-2.2,f=-2.6) USER MOD Single : A 65 GLN :FLIP amide:sc= 0 F(o=-0.56,f=0) USER MOD Single : A 68 TYR OH : rot 81:sc= 2.17 USER MOD Single : A 69 GLN :FLIP amide:sc= -0.283 F(o=-0.83,f=-0.28) USER MOD Single : A 71 GLN : amide:sc= -0.116 X(o=-0.12,f=-0.052) USER MOD Single : A 77 HIS : no HE2:sc= -3.37 K(o=-3.4,f=-6.7!) USER MOD Single : A 85 TYR OH : rot -166:sc= -5.9! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 GLN : amide:sc= -0.241 X(o=-0.24,f=-0.16) USER MOD Single : A 104 THR OG1 : rot 75:sc= -3.39! USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 116 THR OG1 : rot -46:sc= 0.00757 USER MOD Single : A 121 SER OG : rot -8:sc= 0.837 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -154:sc= -3.41 (180deg=-6.83!) USER MOD Single : A 132 ASN : amide:sc= -0.466 X(o=-0.47,f=0) USER MOD Single : A 137 THR OG1 : rot -160:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -149:sc= 1.1 (180deg=0.324) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 141 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0 USER MOD Single : A 148 ASN : amide:sc= -1.56 K(o=-1.6,f=-3.2!) USER MOD Single : A 152 THR OG1 : rot 88:sc= 1.04 USER MOD Single : A 153 HIS :FLIP no HE2:sc= -8.54! C(o=-9.7!,f=-8.5!) USER MOD Single : A 154 THR OG1 : rot 180:sc= 0 USER MOD Single : A 155 TYR OH : rot -140:sc= 0.0886 USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ -155:sc= -0.109 (180deg=-0.518) USER MOD Single : A 170 NDP O3B : rot 153:sc= 0.226 USER MOD Single : A 170 NDP O3D : rot -90:sc= 0.367 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -4.653 8.550 5.310 1.00 0.00 N ATOM 2 CA THR A 1 -4.228 8.615 3.887 1.00 0.00 C ATOM 3 C THR A 1 -2.723 8.405 3.751 1.00 0.00 C ATOM 4 O THR A 1 -1.973 9.352 3.514 1.00 0.00 O ATOM 5 CB THR A 1 -4.625 9.980 3.322 1.00 0.00 C ATOM 6 OG1 THR A 1 -5.770 10.484 3.986 1.00 0.00 O ATOM 7 CG2 THR A 1 -4.930 9.948 1.840 1.00 0.00 C ATOM 0 H1 THR A 1 -5.495 9.144 5.448 1.00 0.00 H new ATOM 0 H2 THR A 1 -4.879 7.566 5.560 1.00 0.00 H new ATOM 0 H3 THR A 1 -3.883 8.894 5.918 1.00 0.00 H new ATOM 0 HA THR A 1 -4.722 7.819 3.329 1.00 0.00 H new ATOM 0 HB THR A 1 -3.760 10.623 3.485 1.00 0.00 H new ATOM 0 HG1 THR A 1 -6.007 11.358 3.612 1.00 0.00 H new ATOM 0 HG21 THR A 1 -5.205 10.948 1.503 1.00 0.00 H new ATOM 0 HG22 THR A 1 -4.049 9.611 1.294 1.00 0.00 H new ATOM 0 HG23 THR A 1 -5.757 9.263 1.653 1.00 0.00 H new ATOM 17 N ALA A 2 -2.290 7.158 3.902 1.00 0.00 N ATOM 18 CA ALA A 2 -0.875 6.823 3.796 1.00 0.00 C ATOM 19 C ALA A 2 -0.665 5.607 2.901 1.00 0.00 C ATOM 20 O ALA A 2 -1.510 4.714 2.843 1.00 0.00 O ATOM 21 CB ALA A 2 -0.288 6.572 5.177 1.00 0.00 C ATOM 0 H ALA A 2 -2.898 6.363 4.098 1.00 0.00 H new ATOM 0 HA ALA A 2 -0.359 7.669 3.342 1.00 0.00 H new ATOM 0 HB1 ALA A 2 0.769 6.323 5.083 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -0.397 7.469 5.787 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -0.815 5.744 5.651 1.00 0.00 H new ATOM 27 N PHE A 3 0.466 5.580 2.202 1.00 0.00 N ATOM 28 CA PHE A 3 0.784 4.471 1.309 1.00 0.00 C ATOM 29 C PHE A 3 1.824 3.548 1.932 1.00 0.00 C ATOM 30 O PHE A 3 2.893 3.993 2.342 1.00 0.00 O ATOM 31 CB PHE A 3 1.317 4.993 -0.028 1.00 0.00 C ATOM 32 CG PHE A 3 0.341 5.826 -0.815 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.974 5.981 -0.401 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.750 6.454 -1.980 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.858 6.748 -1.134 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.131 7.220 -2.717 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.435 7.367 -2.294 1.00 0.00 C ATOM 0 H PHE A 3 1.176 6.312 2.237 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.136 3.910 1.142 1.00 0.00 H new ATOM 0 HB2 PHE A 3 2.211 5.587 0.161 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.622 4.143 -0.638 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.310 5.497 0.504 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.770 6.343 -2.316 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.879 6.864 -0.801 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.201 7.704 -3.624 1.00 0.00 H new ATOM 0 HZ PHE A 3 -2.125 7.966 -2.869 1.00 0.00 H new ATOM 47 N LEU A 4 1.514 2.260 1.989 1.00 0.00 N ATOM 48 CA LEU A 4 2.436 1.285 2.551 1.00 0.00 C ATOM 49 C LEU A 4 2.657 0.135 1.576 1.00 0.00 C ATOM 50 O LEU A 4 1.738 -0.633 1.293 1.00 0.00 O ATOM 51 CB LEU A 4 1.898 0.750 3.877 1.00 0.00 C ATOM 52 CG LEU A 4 2.777 -0.299 4.557 1.00 0.00 C ATOM 53 CD1 LEU A 4 4.178 0.247 4.787 1.00 0.00 C ATOM 54 CD2 LEU A 4 2.150 -0.739 5.869 1.00 0.00 C ATOM 0 H LEU A 4 0.634 1.868 1.654 1.00 0.00 H new ATOM 0 HA LEU A 4 3.391 1.779 2.731 1.00 0.00 H new ATOM 0 HB2 LEU A 4 1.764 1.588 4.561 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.912 0.318 3.704 1.00 0.00 H new ATOM 0 HG LEU A 4 2.854 -1.167 3.902 1.00 0.00 H new ATOM 0 HD11 LEU A 4 4.790 -0.514 5.272 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.625 0.516 3.830 1.00 0.00 H new ATOM 0 HD13 LEU A 4 4.124 1.130 5.424 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.786 -1.486 6.344 1.00 0.00 H new ATOM 0 HD22 LEU A 4 2.047 0.122 6.530 1.00 0.00 H new ATOM 0 HD23 LEU A 4 1.167 -1.169 5.676 1.00 0.00 H new ATOM 66 N TRP A 5 3.879 0.018 1.064 1.00 0.00 N ATOM 67 CA TRP A 5 4.200 -1.048 0.120 1.00 0.00 C ATOM 68 C TRP A 5 5.694 -1.361 0.116 1.00 0.00 C ATOM 69 O TRP A 5 6.508 -0.559 0.573 1.00 0.00 O ATOM 70 CB TRP A 5 3.730 -0.672 -1.292 1.00 0.00 C ATOM 71 CG TRP A 5 4.668 0.241 -2.024 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.733 -0.126 -2.795 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.622 1.670 -2.058 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.353 0.988 -3.304 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.689 2.104 -2.867 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.781 2.625 -1.483 1.00 0.00 C ATOM 77 CZ2 TRP A 5 5.937 3.452 -3.114 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.028 3.963 -1.729 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.097 4.365 -2.539 1.00 0.00 C ATOM 0 H TRP A 5 4.656 0.641 1.284 1.00 0.00 H new ATOM 0 HA TRP A 5 3.672 -1.946 0.442 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.598 -1.584 -1.875 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.753 -0.193 -1.223 1.00 0.00 H new ATOM 0 HD1 TRP A 5 6.043 -1.144 -2.978 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.174 0.985 -3.909 1.00 0.00 H new ATOM 0 HE3 TRP A 5 2.953 2.324 -0.858 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 6.762 3.765 -3.737 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.385 4.711 -1.289 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.262 5.418 -2.713 1.00 0.00 H new ATOM 90 N ALA A 6 6.045 -2.534 -0.407 1.00 0.00 N ATOM 91 CA ALA A 6 7.441 -2.954 -0.475 1.00 0.00 C ATOM 92 C ALA A 6 7.993 -2.784 -1.886 1.00 0.00 C ATOM 93 O ALA A 6 7.271 -2.957 -2.868 1.00 0.00 O ATOM 94 CB ALA A 6 7.580 -4.399 -0.021 1.00 0.00 C ATOM 0 H ALA A 6 5.382 -3.209 -0.789 1.00 0.00 H new ATOM 0 HA ALA A 6 8.021 -2.319 0.194 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.626 -4.699 -0.077 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.230 -4.493 1.007 1.00 0.00 H new ATOM 0 HB3 ALA A 6 6.983 -5.042 -0.667 1.00 0.00 H new ATOM 100 N GLN A 7 9.276 -2.444 -1.987 1.00 0.00 N ATOM 101 CA GLN A 7 9.909 -2.252 -3.288 1.00 0.00 C ATOM 102 C GLN A 7 11.381 -2.653 -3.260 1.00 0.00 C ATOM 103 O GLN A 7 11.992 -2.735 -2.195 1.00 0.00 O ATOM 104 CB GLN A 7 9.778 -0.792 -3.728 1.00 0.00 C ATOM 105 CG GLN A 7 10.175 0.206 -2.653 1.00 0.00 C ATOM 106 CD GLN A 7 9.040 1.135 -2.269 1.00 0.00 C ATOM 107 OE1 GLN A 7 8.190 0.684 -1.354 1.00 0.00 O flip ATOM 108 NE2 GLN A 7 8.927 2.245 -2.789 1.00 0.00 N flip ATOM 0 H GLN A 7 9.894 -2.297 -1.189 1.00 0.00 H new ATOM 0 HA GLN A 7 9.397 -2.895 -4.003 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.399 -0.630 -4.609 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.747 -0.602 -4.025 1.00 0.00 H new ATOM 0 HG2 GLN A 7 10.512 -0.334 -1.768 1.00 0.00 H new ATOM 0 HG3 GLN A 7 11.020 0.798 -3.006 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.603 2.552 -3.488 1.00 0.00 H new ATOM 0 HE22 GLN A 7 8.157 2.858 -2.521 1.00 0.00 H new ATOM 117 N ASP A 8 11.946 -2.898 -4.443 1.00 0.00 N ATOM 118 CA ASP A 8 13.348 -3.285 -4.552 1.00 0.00 C ATOM 119 C ASP A 8 14.237 -2.061 -4.766 1.00 0.00 C ATOM 120 O ASP A 8 13.790 -0.924 -4.617 1.00 0.00 O ATOM 121 CB ASP A 8 13.543 -4.296 -5.689 1.00 0.00 C ATOM 122 CG ASP A 8 13.261 -3.706 -7.056 1.00 0.00 C ATOM 123 OD1 ASP A 8 12.967 -2.498 -7.133 1.00 0.00 O ATOM 124 OD2 ASP A 8 13.337 -4.456 -8.052 1.00 0.00 O ATOM 0 H ASP A 8 11.454 -2.835 -5.334 1.00 0.00 H new ATOM 0 HA ASP A 8 13.641 -3.758 -3.615 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.566 -4.670 -5.664 1.00 0.00 H new ATOM 0 HB3 ASP A 8 12.887 -5.151 -5.525 1.00 0.00 H new ATOM 129 N ARG A 9 15.503 -2.303 -5.091 1.00 0.00 N ATOM 130 CA ARG A 9 16.465 -1.223 -5.295 1.00 0.00 C ATOM 131 C ARG A 9 16.098 -0.319 -6.471 1.00 0.00 C ATOM 132 O ARG A 9 16.484 0.849 -6.500 1.00 0.00 O ATOM 133 CB ARG A 9 17.870 -1.798 -5.495 1.00 0.00 C ATOM 134 CG ARG A 9 18.775 -1.625 -4.287 1.00 0.00 C ATOM 135 CD ARG A 9 19.128 -0.163 -4.061 1.00 0.00 C ATOM 136 NE ARG A 9 19.490 0.103 -2.671 1.00 0.00 N ATOM 137 CZ ARG A 9 20.145 1.191 -2.271 1.00 0.00 C ATOM 138 NH1 ARG A 9 20.511 2.115 -3.151 1.00 0.00 N ATOM 139 NH2 ARG A 9 20.435 1.356 -0.988 1.00 0.00 N ATOM 0 H ARG A 9 15.888 -3.239 -5.219 1.00 0.00 H new ATOM 0 HA ARG A 9 16.443 -0.605 -4.397 1.00 0.00 H new ATOM 0 HB2 ARG A 9 17.789 -2.859 -5.729 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.332 -1.316 -6.357 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.281 -2.022 -3.401 1.00 0.00 H new ATOM 0 HG3 ARG A 9 19.688 -2.203 -4.429 1.00 0.00 H new ATOM 0 HD2 ARG A 9 19.958 0.115 -4.711 1.00 0.00 H new ATOM 0 HD3 ARG A 9 18.280 0.462 -4.341 1.00 0.00 H new ATOM 0 HE ARG A 9 19.226 -0.585 -1.966 1.00 0.00 H new ATOM 0 HH11 ARG A 9 20.291 1.994 -4.139 1.00 0.00 H new ATOM 0 HH12 ARG A 9 21.013 2.946 -2.839 1.00 0.00 H new ATOM 0 HH21 ARG A 9 20.156 0.649 -0.307 1.00 0.00 H new ATOM 0 HH22 ARG A 9 20.937 2.190 -0.682 1.00 0.00 H new ATOM 153 N ASP A 10 15.360 -0.848 -7.439 1.00 0.00 N ATOM 154 CA ASP A 10 14.966 -0.056 -8.598 1.00 0.00 C ATOM 155 C ASP A 10 13.657 0.671 -8.325 1.00 0.00 C ATOM 156 O ASP A 10 13.451 1.803 -8.763 1.00 0.00 O ATOM 157 CB ASP A 10 14.821 -0.950 -9.831 1.00 0.00 C ATOM 158 CG ASP A 10 16.135 -1.584 -10.242 1.00 0.00 C ATOM 159 OD1 ASP A 10 16.597 -2.505 -9.536 1.00 0.00 O ATOM 160 OD2 ASP A 10 16.702 -1.160 -11.271 1.00 0.00 O ATOM 0 H ASP A 10 15.025 -1.811 -7.446 1.00 0.00 H new ATOM 0 HA ASP A 10 15.744 0.683 -8.789 1.00 0.00 H new ATOM 0 HB2 ASP A 10 14.091 -1.733 -9.625 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.430 -0.360 -10.660 1.00 0.00 H new ATOM 165 N GLY A 11 12.774 -0.004 -7.606 1.00 0.00 N ATOM 166 CA GLY A 11 11.479 0.565 -7.284 1.00 0.00 C ATOM 167 C GLY A 11 10.340 -0.421 -7.481 1.00 0.00 C ATOM 168 O GLY A 11 9.177 -0.079 -7.270 1.00 0.00 O ATOM 0 H GLY A 11 12.931 -0.942 -7.237 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.484 0.906 -6.249 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.307 1.442 -7.908 1.00 0.00 H new ATOM 172 N LEU A 12 10.674 -1.652 -7.878 1.00 0.00 N ATOM 173 CA LEU A 12 9.672 -2.695 -8.091 1.00 0.00 C ATOM 174 C LEU A 12 8.725 -2.775 -6.898 1.00 0.00 C ATOM 175 O LEU A 12 8.903 -2.074 -5.906 1.00 0.00 O ATOM 176 CB LEU A 12 10.367 -4.049 -8.295 1.00 0.00 C ATOM 177 CG LEU A 12 9.595 -5.093 -9.113 1.00 0.00 C ATOM 178 CD1 LEU A 12 9.250 -4.551 -10.492 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.415 -6.368 -9.236 1.00 0.00 C ATOM 0 H LEU A 12 11.633 -1.949 -8.058 1.00 0.00 H new ATOM 0 HA LEU A 12 9.093 -2.448 -8.981 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.325 -3.872 -8.784 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.583 -4.474 -7.315 1.00 0.00 H new ATOM 0 HG LEU A 12 8.664 -5.319 -8.594 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.703 -5.308 -11.054 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.632 -3.659 -10.388 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.167 -4.297 -11.023 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.859 -7.103 -9.818 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.358 -6.147 -9.736 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.616 -6.769 -8.242 1.00 0.00 H new ATOM 191 N ILE A 13 7.744 -3.659 -6.980 1.00 0.00 N ATOM 192 CA ILE A 13 6.804 -3.862 -5.890 1.00 0.00 C ATOM 193 C ILE A 13 6.247 -5.278 -5.946 1.00 0.00 C ATOM 194 O ILE A 13 6.075 -5.937 -4.923 1.00 0.00 O ATOM 195 CB ILE A 13 5.653 -2.827 -5.897 1.00 0.00 C ATOM 196 CG1 ILE A 13 4.722 -3.017 -7.098 1.00 0.00 C ATOM 197 CG2 ILE A 13 6.218 -1.415 -5.889 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.330 -2.469 -6.865 1.00 0.00 C ATOM 0 H ILE A 13 7.578 -4.250 -7.794 1.00 0.00 H new ATOM 0 HA ILE A 13 7.349 -3.719 -4.957 1.00 0.00 H new ATOM 0 HB ILE A 13 5.062 -2.985 -4.995 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.158 -2.527 -7.969 1.00 0.00 H new ATOM 0 HG13 ILE A 13 4.653 -4.079 -7.332 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.399 -0.695 -5.894 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.823 -1.270 -4.994 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.837 -1.266 -6.773 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.720 -2.635 -7.753 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.877 -2.977 -6.014 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.389 -1.400 -6.660 1.00 0.00 H new ATOM 210 N GLY A 14 5.977 -5.741 -7.162 1.00 0.00 N ATOM 211 CA GLY A 14 5.447 -7.072 -7.351 1.00 0.00 C ATOM 212 C GLY A 14 5.892 -7.689 -8.661 1.00 0.00 C ATOM 213 O GLY A 14 6.598 -7.058 -9.448 1.00 0.00 O ATOM 0 H GLY A 14 6.118 -5.212 -8.023 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.767 -7.708 -6.526 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.358 -7.034 -7.321 1.00 0.00 H new ATOM 217 N LYS A 15 5.467 -8.921 -8.896 1.00 0.00 N ATOM 218 CA LYS A 15 5.806 -9.636 -10.120 1.00 0.00 C ATOM 219 C LYS A 15 4.550 -10.234 -10.746 1.00 0.00 C ATOM 220 O LYS A 15 4.408 -11.454 -10.840 1.00 0.00 O ATOM 221 CB LYS A 15 6.820 -10.742 -9.825 1.00 0.00 C ATOM 222 CG LYS A 15 6.442 -11.605 -8.632 1.00 0.00 C ATOM 223 CD LYS A 15 6.506 -13.089 -8.964 1.00 0.00 C ATOM 224 CE LYS A 15 5.131 -13.736 -8.898 1.00 0.00 C ATOM 225 NZ LYS A 15 4.394 -13.350 -7.663 1.00 0.00 N ATOM 0 H LYS A 15 4.882 -9.451 -8.250 1.00 0.00 H new ATOM 0 HA LYS A 15 6.250 -8.931 -10.823 1.00 0.00 H new ATOM 0 HB2 LYS A 15 6.921 -11.376 -10.706 1.00 0.00 H new ATOM 0 HB3 LYS A 15 7.796 -10.291 -9.643 1.00 0.00 H new ATOM 0 HG2 LYS A 15 7.113 -11.389 -7.801 1.00 0.00 H new ATOM 0 HG3 LYS A 15 5.435 -11.349 -8.303 1.00 0.00 H new ATOM 0 HD2 LYS A 15 6.924 -13.222 -9.962 1.00 0.00 H new ATOM 0 HD3 LYS A 15 7.178 -13.590 -8.268 1.00 0.00 H new ATOM 0 HE2 LYS A 15 4.550 -13.445 -9.773 1.00 0.00 H new ATOM 0 HE3 LYS A 15 5.238 -14.820 -8.933 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 3.782 -14.136 -7.364 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 5.074 -13.134 -6.906 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 3.811 -12.510 -7.855 1.00 0.00 H new ATOM 239 N ASP A 16 3.633 -9.365 -11.163 1.00 0.00 N ATOM 240 CA ASP A 16 2.378 -9.800 -11.770 1.00 0.00 C ATOM 241 C ASP A 16 1.431 -10.352 -10.708 1.00 0.00 C ATOM 242 O ASP A 16 0.614 -11.230 -10.985 1.00 0.00 O ATOM 243 CB ASP A 16 2.635 -10.858 -12.848 1.00 0.00 C ATOM 244 CG ASP A 16 1.834 -10.603 -14.110 1.00 0.00 C ATOM 245 OD1 ASP A 16 1.758 -9.432 -14.539 1.00 0.00 O ATOM 246 OD2 ASP A 16 1.283 -11.574 -14.669 1.00 0.00 O ATOM 0 H ASP A 16 3.736 -8.353 -11.091 1.00 0.00 H new ATOM 0 HA ASP A 16 1.911 -8.934 -12.238 1.00 0.00 H new ATOM 0 HB2 ASP A 16 3.697 -10.874 -13.092 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.384 -11.843 -12.454 1.00 0.00 H new ATOM 251 N GLY A 17 1.550 -9.828 -9.492 1.00 0.00 N ATOM 252 CA GLY A 17 0.704 -10.273 -8.400 1.00 0.00 C ATOM 253 C GLY A 17 0.974 -9.515 -7.115 1.00 0.00 C ATOM 254 O GLY A 17 0.089 -8.843 -6.584 1.00 0.00 O ATOM 0 H GLY A 17 2.220 -9.100 -9.243 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -0.342 -10.148 -8.680 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.863 -11.338 -8.231 1.00 0.00 H new ATOM 258 N HIS A 18 2.202 -9.621 -6.615 1.00 0.00 N ATOM 259 CA HIS A 18 2.593 -8.940 -5.385 1.00 0.00 C ATOM 260 C HIS A 18 4.086 -9.117 -5.120 1.00 0.00 C ATOM 261 O HIS A 18 4.821 -9.614 -5.973 1.00 0.00 O ATOM 262 CB HIS A 18 1.781 -9.476 -4.206 1.00 0.00 C ATOM 263 CG HIS A 18 2.036 -10.922 -3.911 1.00 0.00 C ATOM 264 ND1 HIS A 18 3.194 -11.376 -3.316 1.00 0.00 N ATOM 265 CD2 HIS A 18 1.275 -12.020 -4.134 1.00 0.00 C ATOM 266 CE1 HIS A 18 3.134 -12.690 -3.187 1.00 0.00 C ATOM 267 NE2 HIS A 18 1.980 -13.104 -3.675 1.00 0.00 N ATOM 0 H HIS A 18 2.945 -10.173 -7.044 1.00 0.00 H new ATOM 0 HA HIS A 18 2.389 -7.876 -5.501 1.00 0.00 H new ATOM 0 HB2 HIS A 18 2.012 -8.887 -3.319 1.00 0.00 H new ATOM 0 HB3 HIS A 18 0.720 -9.338 -4.413 1.00 0.00 H new ATOM 0 HD1 HIS A 18 3.975 -10.790 -3.021 1.00 0.00 H new ATOM 0 HD2 HIS A 18 0.295 -12.039 -4.589 1.00 0.00 H new ATOM 0 HE1 HIS A 18 3.899 -13.318 -2.756 1.00 0.00 H new ATOM 276 N LEU A 19 4.530 -8.709 -3.934 1.00 0.00 N ATOM 277 CA LEU A 19 5.938 -8.827 -3.565 1.00 0.00 C ATOM 278 C LEU A 19 6.349 -10.297 -3.452 1.00 0.00 C ATOM 279 O LEU A 19 5.799 -11.039 -2.638 1.00 0.00 O ATOM 280 CB LEU A 19 6.205 -8.109 -2.241 1.00 0.00 C ATOM 281 CG LEU A 19 5.305 -8.528 -1.077 1.00 0.00 C ATOM 282 CD1 LEU A 19 5.954 -9.647 -0.276 1.00 0.00 C ATOM 283 CD2 LEU A 19 5.004 -7.335 -0.183 1.00 0.00 C ATOM 0 H LEU A 19 3.938 -8.295 -3.214 1.00 0.00 H new ATOM 0 HA LEU A 19 6.533 -8.359 -4.349 1.00 0.00 H new ATOM 0 HB2 LEU A 19 7.243 -8.281 -1.956 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.091 -7.037 -2.399 1.00 0.00 H new ATOM 0 HG LEU A 19 4.365 -8.900 -1.484 1.00 0.00 H new ATOM 0 HD11 LEU A 19 5.299 -9.932 0.548 1.00 0.00 H new ATOM 0 HD12 LEU A 19 6.119 -10.509 -0.923 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.909 -9.303 0.122 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.363 -7.650 0.640 1.00 0.00 H new ATOM 0 HD22 LEU A 19 5.936 -6.935 0.216 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.497 -6.564 -0.763 1.00 0.00 H new ATOM 295 N PRO A 20 7.314 -10.745 -4.278 1.00 0.00 N ATOM 296 CA PRO A 20 7.780 -12.134 -4.273 1.00 0.00 C ATOM 297 C PRO A 20 8.877 -12.404 -3.245 1.00 0.00 C ATOM 298 O PRO A 20 9.160 -13.558 -2.921 1.00 0.00 O ATOM 299 CB PRO A 20 8.334 -12.295 -5.684 1.00 0.00 C ATOM 300 CG PRO A 20 8.881 -10.949 -6.021 1.00 0.00 C ATOM 301 CD PRO A 20 8.018 -9.941 -5.299 1.00 0.00 C ATOM 0 HA PRO A 20 6.983 -12.828 -4.006 1.00 0.00 H new ATOM 0 HB2 PRO A 20 9.109 -13.060 -5.722 1.00 0.00 H new ATOM 0 HB3 PRO A 20 7.555 -12.595 -6.385 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.921 -10.864 -5.708 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.857 -10.779 -7.097 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.619 -9.154 -4.844 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.318 -9.455 -5.978 1.00 0.00 H new ATOM 309 N TRP A 21 9.502 -11.344 -2.741 1.00 0.00 N ATOM 310 CA TRP A 21 10.573 -11.491 -1.761 1.00 0.00 C ATOM 311 C TRP A 21 10.017 -11.859 -0.389 1.00 0.00 C ATOM 312 O TRP A 21 8.939 -11.408 -0.003 1.00 0.00 O ATOM 313 CB TRP A 21 11.391 -10.201 -1.666 1.00 0.00 C ATOM 314 CG TRP A 21 10.548 -8.966 -1.618 1.00 0.00 C ATOM 315 CD1 TRP A 21 9.668 -8.616 -0.637 1.00 0.00 C ATOM 316 CD2 TRP A 21 10.498 -7.922 -2.596 1.00 0.00 C ATOM 317 NE1 TRP A 21 9.078 -7.414 -0.939 1.00 0.00 N ATOM 318 CE2 TRP A 21 9.570 -6.968 -2.139 1.00 0.00 C ATOM 319 CE3 TRP A 21 11.150 -7.700 -3.812 1.00 0.00 C ATOM 320 CZ2 TRP A 21 9.278 -5.811 -2.856 1.00 0.00 C ATOM 321 CZ3 TRP A 21 10.859 -6.552 -4.523 1.00 0.00 C ATOM 322 CH2 TRP A 21 9.930 -5.620 -4.043 1.00 0.00 C ATOM 0 H TRP A 21 9.287 -10.379 -2.993 1.00 0.00 H new ATOM 0 HA TRP A 21 11.223 -12.300 -2.095 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.016 -10.240 -0.774 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.062 -10.141 -2.523 1.00 0.00 H new ATOM 0 HD1 TRP A 21 9.465 -9.200 0.249 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.387 -6.931 -0.365 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.868 -8.413 -4.189 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.563 -5.090 -2.488 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 11.356 -6.370 -5.464 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.724 -4.732 -4.622 1.00 0.00 H new ATOM 333 N HIS A 22 10.762 -12.684 0.340 1.00 0.00 N ATOM 334 CA HIS A 22 10.346 -13.118 1.669 1.00 0.00 C ATOM 335 C HIS A 22 10.739 -12.091 2.726 1.00 0.00 C ATOM 336 O HIS A 22 11.823 -12.164 3.304 1.00 0.00 O ATOM 337 CB HIS A 22 10.972 -14.473 2.003 1.00 0.00 C ATOM 338 CG HIS A 22 10.148 -15.640 1.556 1.00 0.00 C ATOM 339 ND1 HIS A 22 9.629 -15.752 0.283 1.00 0.00 N ATOM 340 CD2 HIS A 22 9.754 -16.753 2.220 1.00 0.00 C ATOM 341 CE1 HIS A 22 8.951 -16.881 0.184 1.00 0.00 C ATOM 342 NE2 HIS A 22 9.012 -17.507 1.344 1.00 0.00 N ATOM 0 H HIS A 22 11.657 -13.065 0.033 1.00 0.00 H new ATOM 0 HA HIS A 22 9.260 -13.215 1.669 1.00 0.00 H new ATOM 0 HB2 HIS A 22 11.956 -14.534 1.538 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.124 -14.538 3.080 1.00 0.00 H new ATOM 0 HD2 HIS A 22 9.981 -17.001 3.246 1.00 0.00 H new ATOM 0 HE1 HIS A 22 8.434 -17.232 -0.697 1.00 0.00 H new ATOM 0 HE2 HIS A 22 8.578 -18.406 1.556 1.00 0.00 H new ATOM 351 N LEU A 23 9.849 -11.136 2.974 1.00 0.00 N ATOM 352 CA LEU A 23 10.101 -10.095 3.963 1.00 0.00 C ATOM 353 C LEU A 23 9.175 -10.258 5.168 1.00 0.00 C ATOM 354 O LEU A 23 8.075 -9.708 5.193 1.00 0.00 O ATOM 355 CB LEU A 23 9.913 -8.711 3.336 1.00 0.00 C ATOM 356 CG LEU A 23 11.210 -7.960 3.032 1.00 0.00 C ATOM 357 CD1 LEU A 23 11.928 -8.592 1.851 1.00 0.00 C ATOM 358 CD2 LEU A 23 10.923 -6.491 2.759 1.00 0.00 C ATOM 0 H LEU A 23 8.947 -11.062 2.504 1.00 0.00 H new ATOM 0 HA LEU A 23 11.131 -10.190 4.305 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.349 -8.821 2.410 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.307 -8.103 4.008 1.00 0.00 H new ATOM 0 HG LEU A 23 11.860 -8.027 3.905 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.849 -8.044 1.649 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.167 -9.630 2.083 1.00 0.00 H new ATOM 0 HD13 LEU A 23 11.284 -8.556 0.972 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.857 -5.972 2.545 1.00 0.00 H new ATOM 0 HD22 LEU A 23 10.254 -6.404 1.903 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.452 -6.044 3.634 1.00 0.00 H new ATOM 370 N PRO A 24 9.610 -11.022 6.187 1.00 0.00 N ATOM 371 CA PRO A 24 8.811 -11.256 7.395 1.00 0.00 C ATOM 372 C PRO A 24 8.558 -9.974 8.180 1.00 0.00 C ATOM 373 O PRO A 24 7.502 -9.806 8.789 1.00 0.00 O ATOM 374 CB PRO A 24 9.666 -12.227 8.217 1.00 0.00 C ATOM 375 CG PRO A 24 11.052 -12.055 7.698 1.00 0.00 C ATOM 376 CD PRO A 24 10.909 -11.717 6.242 1.00 0.00 C ATOM 0 HA PRO A 24 7.821 -11.644 7.154 1.00 0.00 H new ATOM 0 HB2 PRO A 24 9.612 -11.997 9.281 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.324 -13.255 8.095 1.00 0.00 H new ATOM 0 HG2 PRO A 24 11.574 -11.262 8.233 1.00 0.00 H new ATOM 0 HG3 PRO A 24 11.635 -12.966 7.832 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.722 -11.080 5.894 1.00 0.00 H new ATOM 0 HD3 PRO A 24 10.915 -12.611 5.618 1.00 0.00 H new ATOM 384 N ASP A 25 9.533 -9.072 8.162 1.00 0.00 N ATOM 385 CA ASP A 25 9.418 -7.808 8.869 1.00 0.00 C ATOM 386 C ASP A 25 8.259 -6.981 8.323 1.00 0.00 C ATOM 387 O ASP A 25 7.571 -6.288 9.073 1.00 0.00 O ATOM 388 CB ASP A 25 10.724 -7.026 8.746 1.00 0.00 C ATOM 389 CG ASP A 25 11.259 -7.004 7.327 1.00 0.00 C ATOM 390 OD1 ASP A 25 11.476 -8.095 6.758 1.00 0.00 O ATOM 391 OD2 ASP A 25 11.460 -5.897 6.785 1.00 0.00 O ATOM 0 H ASP A 25 10.414 -9.196 7.663 1.00 0.00 H new ATOM 0 HA ASP A 25 9.220 -8.017 9.920 1.00 0.00 H new ATOM 0 HB2 ASP A 25 10.564 -6.003 9.086 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.471 -7.468 9.405 1.00 0.00 H new ATOM 396 N ASP A 26 8.046 -7.058 7.013 1.00 0.00 N ATOM 397 CA ASP A 26 6.968 -6.316 6.369 1.00 0.00 C ATOM 398 C ASP A 26 5.608 -6.858 6.795 1.00 0.00 C ATOM 399 O ASP A 26 4.775 -6.123 7.324 1.00 0.00 O ATOM 400 CB ASP A 26 7.106 -6.388 4.847 1.00 0.00 C ATOM 401 CG ASP A 26 7.882 -5.215 4.280 1.00 0.00 C ATOM 402 OD1 ASP A 26 7.912 -4.150 4.933 1.00 0.00 O ATOM 403 OD2 ASP A 26 8.459 -5.361 3.182 1.00 0.00 O ATOM 0 H ASP A 26 8.605 -7.626 6.377 1.00 0.00 H new ATOM 0 HA ASP A 26 7.040 -5.274 6.682 1.00 0.00 H new ATOM 0 HB2 ASP A 26 7.606 -7.317 4.574 1.00 0.00 H new ATOM 0 HB3 ASP A 26 6.114 -6.416 4.396 1.00 0.00 H new ATOM 408 N LEU A 27 5.389 -8.148 6.561 1.00 0.00 N ATOM 409 CA LEU A 27 4.132 -8.788 6.919 1.00 0.00 C ATOM 410 C LEU A 27 3.857 -8.651 8.414 1.00 0.00 C ATOM 411 O LEU A 27 2.753 -8.288 8.820 1.00 0.00 O ATOM 412 CB LEU A 27 4.153 -10.266 6.521 1.00 0.00 C ATOM 413 CG LEU A 27 5.510 -10.967 6.650 1.00 0.00 C ATOM 414 CD1 LEU A 27 5.430 -12.110 7.648 1.00 0.00 C ATOM 415 CD2 LEU A 27 5.982 -11.474 5.295 1.00 0.00 C ATOM 0 H LEU A 27 6.069 -8.770 6.124 1.00 0.00 H new ATOM 0 HA LEU A 27 3.331 -8.287 6.375 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.428 -10.800 7.136 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.817 -10.350 5.487 1.00 0.00 H new ATOM 0 HG LEU A 27 6.236 -10.241 7.017 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.403 -12.595 7.725 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.140 -11.721 8.624 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.689 -12.835 7.312 1.00 0.00 H new ATOM 0 HD21 LEU A 27 6.947 -11.968 5.407 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.255 -12.183 4.898 1.00 0.00 H new ATOM 0 HD23 LEU A 27 6.083 -10.634 4.607 1.00 0.00 H new ATOM 427 N HIS A 28 4.867 -8.939 9.230 1.00 0.00 N ATOM 428 CA HIS A 28 4.728 -8.842 10.679 1.00 0.00 C ATOM 429 C HIS A 28 4.329 -7.428 11.089 1.00 0.00 C ATOM 430 O HIS A 28 3.453 -7.238 11.933 1.00 0.00 O ATOM 431 CB HIS A 28 6.037 -9.233 11.369 1.00 0.00 C ATOM 432 CG HIS A 28 6.143 -10.697 11.664 1.00 0.00 C ATOM 433 ND1 HIS A 28 5.377 -11.330 12.620 1.00 0.00 N ATOM 434 CD2 HIS A 28 6.932 -11.656 11.122 1.00 0.00 C ATOM 435 CE1 HIS A 28 5.691 -12.613 12.655 1.00 0.00 C ATOM 436 NE2 HIS A 28 6.631 -12.836 11.756 1.00 0.00 N ATOM 0 H HIS A 28 5.788 -9.241 8.913 1.00 0.00 H new ATOM 0 HA HIS A 28 3.943 -9.531 10.991 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.874 -8.936 10.737 1.00 0.00 H new ATOM 0 HB3 HIS A 28 6.128 -8.675 12.301 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.661 -11.518 10.338 1.00 0.00 H new ATOM 0 HE1 HIS A 28 5.253 -13.353 13.308 1.00 0.00 H new ATOM 0 HE2 HIS A 28 7.064 -13.739 11.563 1.00 0.00 H new ATOM 445 N TYR A 29 4.977 -6.440 10.481 1.00 0.00 N ATOM 446 CA TYR A 29 4.690 -5.041 10.776 1.00 0.00 C ATOM 447 C TYR A 29 3.375 -4.611 10.133 1.00 0.00 C ATOM 448 O TYR A 29 2.687 -3.724 10.636 1.00 0.00 O ATOM 449 CB TYR A 29 5.830 -4.150 10.277 1.00 0.00 C ATOM 450 CG TYR A 29 5.904 -2.811 10.975 1.00 0.00 C ATOM 451 CD1 TYR A 29 5.982 -2.731 12.360 1.00 0.00 C ATOM 452 CD2 TYR A 29 5.898 -1.627 10.249 1.00 0.00 C ATOM 453 CE1 TYR A 29 6.051 -1.508 13.001 1.00 0.00 C ATOM 454 CE2 TYR A 29 5.968 -0.401 10.882 1.00 0.00 C ATOM 455 CZ TYR A 29 6.044 -0.347 12.258 1.00 0.00 C ATOM 456 OH TYR A 29 6.114 0.873 12.892 1.00 0.00 O ATOM 0 H TYR A 29 5.705 -6.582 9.781 1.00 0.00 H new ATOM 0 HA TYR A 29 4.599 -4.933 11.857 1.00 0.00 H new ATOM 0 HB2 TYR A 29 6.776 -4.674 10.414 1.00 0.00 H new ATOM 0 HB3 TYR A 29 5.709 -3.986 9.206 1.00 0.00 H new ATOM 0 HD1 TYR A 29 5.989 -3.639 12.945 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.838 -1.665 9.171 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.110 -1.463 14.078 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.963 0.510 10.302 1.00 0.00 H new ATOM 0 HH TYR A 29 6.099 1.590 12.224 1.00 0.00 H new ATOM 466 N PHE A 30 3.032 -5.248 9.017 1.00 0.00 N ATOM 467 CA PHE A 30 1.799 -4.934 8.304 1.00 0.00 C ATOM 468 C PHE A 30 0.582 -5.161 9.194 1.00 0.00 C ATOM 469 O PHE A 30 -0.162 -4.228 9.496 1.00 0.00 O ATOM 470 CB PHE A 30 1.686 -5.787 7.039 1.00 0.00 C ATOM 471 CG PHE A 30 0.781 -5.197 5.995 1.00 0.00 C ATOM 472 CD1 PHE A 30 -0.594 -5.343 6.089 1.00 0.00 C ATOM 473 CD2 PHE A 30 1.305 -4.498 4.920 1.00 0.00 C ATOM 474 CE1 PHE A 30 -1.429 -4.801 5.130 1.00 0.00 C ATOM 475 CE2 PHE A 30 0.475 -3.954 3.958 1.00 0.00 C ATOM 476 CZ PHE A 30 -0.894 -4.106 4.063 1.00 0.00 C ATOM 0 H PHE A 30 3.591 -5.985 8.587 1.00 0.00 H new ATOM 0 HA PHE A 30 1.829 -3.881 8.023 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.680 -5.922 6.612 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.318 -6.777 7.310 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -1.018 -5.886 6.921 1.00 0.00 H new ATOM 0 HD2 PHE A 30 2.375 -4.377 4.833 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -2.499 -4.921 5.215 1.00 0.00 H new ATOM 0 HE2 PHE A 30 0.896 -3.411 3.125 1.00 0.00 H new ATOM 0 HZ PHE A 30 -1.545 -3.682 3.312 1.00 0.00 H new ATOM 486 N ARG A 31 0.385 -6.408 9.610 1.00 0.00 N ATOM 487 CA ARG A 31 -0.742 -6.760 10.466 1.00 0.00 C ATOM 488 C ARG A 31 -0.618 -6.095 11.833 1.00 0.00 C ATOM 489 O ARG A 31 -1.620 -5.772 12.470 1.00 0.00 O ATOM 490 CB ARG A 31 -0.831 -8.279 10.628 1.00 0.00 C ATOM 491 CG ARG A 31 -1.911 -8.920 9.770 1.00 0.00 C ATOM 492 CD ARG A 31 -1.381 -10.120 9.001 1.00 0.00 C ATOM 493 NE ARG A 31 -1.194 -11.286 9.863 1.00 0.00 N ATOM 494 CZ ARG A 31 -0.015 -11.680 10.345 1.00 0.00 C ATOM 495 NH1 ARG A 31 1.093 -11.007 10.060 1.00 0.00 N ATOM 496 NH2 ARG A 31 0.054 -12.755 11.119 1.00 0.00 N ATOM 0 H ARG A 31 0.991 -7.192 9.368 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.654 -6.399 9.990 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.133 -8.720 10.374 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -1.023 -8.514 11.675 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.741 -9.232 10.403 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.304 -8.183 9.069 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.074 -10.371 8.198 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.432 -9.860 8.533 1.00 0.00 H new ATOM 0 HE ARG A 31 -2.018 -11.833 10.112 1.00 0.00 H new ATOM 0 HH11 ARG A 31 1.048 -10.179 9.466 1.00 0.00 H new ATOM 0 HH12 ARG A 31 1.989 -11.318 10.435 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -0.793 -13.277 11.343 1.00 0.00 H new ATOM 0 HH22 ARG A 31 0.954 -13.060 11.490 1.00 0.00 H new ATOM 510 N ALA A 32 0.618 -5.896 12.280 1.00 0.00 N ATOM 511 CA ALA A 32 0.874 -5.274 13.573 1.00 0.00 C ATOM 512 C ALA A 32 0.495 -3.796 13.564 1.00 0.00 C ATOM 513 O ALA A 32 0.174 -3.223 14.606 1.00 0.00 O ATOM 514 CB ALA A 32 2.337 -5.442 13.956 1.00 0.00 C ATOM 0 H ALA A 32 1.459 -6.157 11.765 1.00 0.00 H new ATOM 0 HA ALA A 32 0.252 -5.774 14.316 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.516 -4.973 14.924 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.578 -6.503 14.017 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.967 -4.970 13.202 1.00 0.00 H new ATOM 520 N GLN A 33 0.536 -3.181 12.386 1.00 0.00 N ATOM 521 CA GLN A 33 0.198 -1.768 12.252 1.00 0.00 C ATOM 522 C GLN A 33 -1.235 -1.588 11.762 1.00 0.00 C ATOM 523 O GLN A 33 -1.891 -0.599 12.086 1.00 0.00 O ATOM 524 CB GLN A 33 1.168 -1.079 11.289 1.00 0.00 C ATOM 525 CG GLN A 33 2.358 -0.434 11.981 1.00 0.00 C ATOM 526 CD GLN A 33 2.667 0.949 11.442 1.00 0.00 C ATOM 527 OE1 GLN A 33 3.301 1.002 10.276 1.00 0.00 O flip ATOM 528 NE2 GLN A 33 2.340 1.959 12.065 1.00 0.00 N flip ATOM 0 H GLN A 33 0.799 -3.637 11.513 1.00 0.00 H new ATOM 0 HA GLN A 33 0.283 -1.309 13.237 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.531 -1.811 10.567 1.00 0.00 H new ATOM 0 HB3 GLN A 33 0.628 -0.317 10.727 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.159 -0.367 13.051 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.234 -1.071 11.859 1.00 0.00 H new ATOM 0 HE21 GLN A 33 1.854 1.873 12.958 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.555 2.882 11.689 1.00 0.00 H new ATOM 537 N THR A 34 -1.718 -2.547 10.978 1.00 0.00 N ATOM 538 CA THR A 34 -3.074 -2.483 10.443 1.00 0.00 C ATOM 539 C THR A 34 -4.076 -3.161 11.376 1.00 0.00 C ATOM 540 O THR A 34 -5.085 -3.703 10.925 1.00 0.00 O ATOM 541 CB THR A 34 -3.131 -3.135 9.061 1.00 0.00 C ATOM 542 OG1 THR A 34 -2.747 -4.496 9.133 1.00 0.00 O ATOM 543 CG2 THR A 34 -2.241 -2.459 8.041 1.00 0.00 C ATOM 0 H THR A 34 -1.192 -3.376 10.700 1.00 0.00 H new ATOM 0 HA THR A 34 -3.346 -1.431 10.358 1.00 0.00 H new ATOM 0 HB THR A 34 -4.167 -3.033 8.737 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.788 -4.575 8.950 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.330 -2.972 7.084 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.546 -1.419 7.925 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.205 -2.498 8.379 1.00 0.00 H new ATOM 551 N VAL A 35 -3.802 -3.120 12.676 1.00 0.00 N ATOM 552 CA VAL A 35 -4.695 -3.727 13.657 1.00 0.00 C ATOM 553 C VAL A 35 -5.690 -2.702 14.186 1.00 0.00 C ATOM 554 O VAL A 35 -5.339 -1.834 14.985 1.00 0.00 O ATOM 555 CB VAL A 35 -3.930 -4.353 14.848 1.00 0.00 C ATOM 556 CG1 VAL A 35 -3.760 -5.851 14.643 1.00 0.00 C ATOM 557 CG2 VAL A 35 -2.580 -3.679 15.057 1.00 0.00 C ATOM 0 H VAL A 35 -2.974 -2.676 13.073 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.224 -4.526 13.138 1.00 0.00 H new ATOM 0 HB VAL A 35 -4.522 -4.191 15.749 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -3.220 -6.275 15.490 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -4.740 -6.321 14.565 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -3.198 -6.031 13.727 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.069 -4.142 15.901 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.974 -3.793 14.158 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.730 -2.619 15.261 1.00 0.00 H new ATOM 567 N GLY A 36 -6.931 -2.807 13.728 1.00 0.00 N ATOM 568 CA GLY A 36 -7.962 -1.881 14.156 1.00 0.00 C ATOM 569 C GLY A 36 -8.102 -0.697 13.219 1.00 0.00 C ATOM 570 O GLY A 36 -8.665 0.332 13.590 1.00 0.00 O ATOM 0 H GLY A 36 -7.242 -3.518 13.067 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.915 -2.406 14.218 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.730 -1.522 15.159 1.00 0.00 H new ATOM 574 N LYS A 37 -7.588 -0.841 11.999 1.00 0.00 N ATOM 575 CA LYS A 37 -7.661 0.227 11.009 1.00 0.00 C ATOM 576 C LYS A 37 -8.281 -0.279 9.711 1.00 0.00 C ATOM 577 O LYS A 37 -8.742 -1.418 9.636 1.00 0.00 O ATOM 578 CB LYS A 37 -6.266 0.794 10.738 1.00 0.00 C ATOM 579 CG LYS A 37 -5.576 1.333 11.982 1.00 0.00 C ATOM 580 CD LYS A 37 -5.050 2.743 11.765 1.00 0.00 C ATOM 581 CE LYS A 37 -3.627 2.730 11.229 1.00 0.00 C ATOM 582 NZ LYS A 37 -3.219 4.064 10.708 1.00 0.00 N ATOM 0 H LYS A 37 -7.118 -1.686 11.675 1.00 0.00 H new ATOM 0 HA LYS A 37 -8.295 1.019 11.408 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.645 0.014 10.297 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.345 1.593 10.001 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.276 1.330 12.817 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -4.751 0.675 12.255 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -5.699 3.271 11.066 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -5.081 3.293 12.706 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -2.943 2.425 12.021 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.545 1.989 10.434 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -2.196 4.191 10.843 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -3.445 4.125 9.695 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -3.731 4.809 11.222 1.00 0.00 H new ATOM 596 N ILE A 38 -8.289 0.572 8.690 1.00 0.00 N ATOM 597 CA ILE A 38 -8.854 0.204 7.395 1.00 0.00 C ATOM 598 C ILE A 38 -7.806 0.315 6.292 1.00 0.00 C ATOM 599 O ILE A 38 -7.150 1.346 6.145 1.00 0.00 O ATOM 600 CB ILE A 38 -10.078 1.077 7.022 1.00 0.00 C ATOM 601 CG1 ILE A 38 -10.446 2.026 8.167 1.00 0.00 C ATOM 602 CG2 ILE A 38 -11.266 0.195 6.665 1.00 0.00 C ATOM 603 CD1 ILE A 38 -11.457 3.082 7.777 1.00 0.00 C ATOM 0 H ILE A 38 -7.912 1.519 8.733 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.185 -0.831 7.485 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.812 1.680 6.154 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.844 1.443 8.997 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.541 2.516 8.527 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -12.119 0.822 6.405 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -11.008 -0.437 5.815 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.523 -0.432 7.519 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -11.670 3.717 8.637 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -11.054 3.690 6.967 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.377 2.600 7.446 1.00 0.00 H new ATOM 615 N MET A 39 -7.653 -0.758 5.523 1.00 0.00 N ATOM 616 CA MET A 39 -6.681 -0.788 4.435 1.00 0.00 C ATOM 617 C MET A 39 -7.378 -0.756 3.076 1.00 0.00 C ATOM 618 O MET A 39 -8.322 -1.506 2.833 1.00 0.00 O ATOM 619 CB MET A 39 -5.807 -2.041 4.550 1.00 0.00 C ATOM 620 CG MET A 39 -4.835 -2.228 3.394 1.00 0.00 C ATOM 621 SD MET A 39 -4.241 -3.925 3.258 1.00 0.00 S ATOM 622 CE MET A 39 -5.790 -4.821 3.162 1.00 0.00 C ATOM 0 H MET A 39 -8.189 -1.619 5.633 1.00 0.00 H new ATOM 0 HA MET A 39 -6.051 0.098 4.514 1.00 0.00 H new ATOM 0 HB2 MET A 39 -5.243 -1.993 5.481 1.00 0.00 H new ATOM 0 HB3 MET A 39 -6.453 -2.917 4.613 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.324 -1.942 2.463 1.00 0.00 H new ATOM 0 HG3 MET A 39 -3.985 -1.559 3.526 1.00 0.00 H new ATOM 0 HE1 MET A 39 -5.595 -5.856 2.880 1.00 0.00 H new ATOM 0 HE2 MET A 39 -6.285 -4.797 4.133 1.00 0.00 H new ATOM 0 HE3 MET A 39 -6.433 -4.357 2.415 1.00 0.00 H new ATOM 632 N VAL A 40 -6.898 0.115 2.193 1.00 0.00 N ATOM 633 CA VAL A 40 -7.465 0.243 0.855 1.00 0.00 C ATOM 634 C VAL A 40 -6.658 -0.564 -0.154 1.00 0.00 C ATOM 635 O VAL A 40 -5.431 -0.475 -0.194 1.00 0.00 O ATOM 636 CB VAL A 40 -7.508 1.714 0.400 1.00 0.00 C ATOM 637 CG1 VAL A 40 -8.249 1.843 -0.922 1.00 0.00 C ATOM 638 CG2 VAL A 40 -8.150 2.589 1.467 1.00 0.00 C ATOM 0 H VAL A 40 -6.117 0.743 2.381 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.483 -0.143 0.901 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.484 2.057 0.252 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.269 2.889 -1.227 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.740 1.252 -1.684 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.270 1.480 -0.804 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.170 3.624 1.125 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.169 2.248 1.653 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.572 2.523 2.388 1.00 0.00 H new ATOM 648 N VAL A 41 -7.351 -1.357 -0.965 1.00 0.00 N ATOM 649 CA VAL A 41 -6.688 -2.181 -1.966 1.00 0.00 C ATOM 650 C VAL A 41 -7.417 -2.118 -3.309 1.00 0.00 C ATOM 651 O VAL A 41 -8.645 -2.047 -3.357 1.00 0.00 O ATOM 652 CB VAL A 41 -6.575 -3.647 -1.486 1.00 0.00 C ATOM 653 CG1 VAL A 41 -7.769 -4.480 -1.936 1.00 0.00 C ATOM 654 CG2 VAL A 41 -5.273 -4.263 -1.968 1.00 0.00 C ATOM 0 H VAL A 41 -8.367 -1.446 -0.948 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.683 -1.782 -2.106 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.576 -3.642 -0.396 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -7.653 -5.504 -1.580 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -8.685 -4.054 -1.526 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.824 -4.479 -3.025 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.209 -5.295 -1.622 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.242 -4.243 -3.057 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.432 -3.694 -1.571 1.00 0.00 H new ATOM 664 N GLY A 42 -6.650 -2.140 -4.397 1.00 0.00 N ATOM 665 CA GLY A 42 -7.239 -2.082 -5.724 1.00 0.00 C ATOM 666 C GLY A 42 -7.966 -3.360 -6.097 1.00 0.00 C ATOM 667 O GLY A 42 -8.104 -4.265 -5.274 1.00 0.00 O ATOM 0 H GLY A 42 -5.632 -2.197 -4.383 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.936 -1.245 -5.772 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.456 -1.887 -6.457 1.00 0.00 H new ATOM 671 N ARG A 43 -8.441 -3.432 -7.338 1.00 0.00 N ATOM 672 CA ARG A 43 -9.167 -4.605 -7.809 1.00 0.00 C ATOM 673 C ARG A 43 -8.230 -5.788 -8.043 1.00 0.00 C ATOM 674 O ARG A 43 -8.442 -6.879 -7.509 1.00 0.00 O ATOM 675 CB ARG A 43 -9.937 -4.292 -9.096 1.00 0.00 C ATOM 676 CG ARG A 43 -9.265 -3.270 -9.999 1.00 0.00 C ATOM 677 CD ARG A 43 -9.554 -3.550 -11.464 1.00 0.00 C ATOM 678 NE ARG A 43 -10.953 -3.303 -11.797 1.00 0.00 N ATOM 679 CZ ARG A 43 -11.467 -3.471 -13.013 1.00 0.00 C ATOM 680 NH1 ARG A 43 -10.700 -3.886 -14.014 1.00 0.00 N ATOM 681 NH2 ARG A 43 -12.751 -3.225 -13.229 1.00 0.00 N ATOM 0 H ARG A 43 -8.336 -2.693 -8.033 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.877 -4.878 -7.028 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -10.076 -5.217 -9.656 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -10.930 -3.927 -8.831 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -9.614 -2.270 -9.742 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -8.188 -3.285 -9.830 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -8.916 -2.923 -12.087 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -9.303 -4.586 -11.692 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.574 -2.983 -11.054 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -9.711 -4.078 -13.853 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -11.100 -4.013 -14.944 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -13.345 -2.907 -12.463 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -13.145 -3.354 -14.161 1.00 0.00 H new ATOM 695 N ARG A 44 -7.199 -5.568 -8.850 1.00 0.00 N ATOM 696 CA ARG A 44 -6.234 -6.614 -9.166 1.00 0.00 C ATOM 697 C ARG A 44 -5.615 -7.208 -7.902 1.00 0.00 C ATOM 698 O ARG A 44 -5.092 -8.322 -7.925 1.00 0.00 O ATOM 699 CB ARG A 44 -5.135 -6.057 -10.072 1.00 0.00 C ATOM 700 CG ARG A 44 -4.994 -6.803 -11.389 1.00 0.00 C ATOM 701 CD ARG A 44 -6.017 -6.329 -12.408 1.00 0.00 C ATOM 702 NE ARG A 44 -7.387 -6.569 -11.960 1.00 0.00 N ATOM 703 CZ ARG A 44 -8.033 -7.721 -12.125 1.00 0.00 C ATOM 704 NH1 ARG A 44 -7.436 -8.748 -12.720 1.00 0.00 N ATOM 705 NH2 ARG A 44 -9.278 -7.849 -11.691 1.00 0.00 N ATOM 0 H ARG A 44 -7.009 -4.672 -9.299 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.765 -7.411 -9.686 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.344 -5.008 -10.279 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.184 -6.093 -9.540 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -3.989 -6.657 -11.785 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.117 -7.872 -11.218 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -5.877 -5.264 -12.593 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -5.850 -6.842 -13.355 1.00 0.00 H new ATOM 0 HE ARG A 44 -7.878 -5.807 -11.492 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -6.476 -8.657 -13.054 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -7.937 -9.628 -12.843 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -9.741 -7.065 -11.231 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -9.774 -8.731 -11.817 1.00 0.00 H new ATOM 719 N THR A 45 -5.664 -6.459 -6.805 1.00 0.00 N ATOM 720 CA THR A 45 -5.092 -6.923 -5.548 1.00 0.00 C ATOM 721 C THR A 45 -5.999 -7.935 -4.853 1.00 0.00 C ATOM 722 O THR A 45 -5.564 -9.038 -4.532 1.00 0.00 O ATOM 723 CB THR A 45 -4.819 -5.746 -4.614 1.00 0.00 C ATOM 724 OG1 THR A 45 -4.578 -4.563 -5.353 1.00 0.00 O ATOM 725 CG2 THR A 45 -3.628 -5.971 -3.708 1.00 0.00 C ATOM 0 H THR A 45 -6.091 -5.534 -6.762 1.00 0.00 H new ATOM 0 HA THR A 45 -4.151 -7.419 -5.786 1.00 0.00 H new ATOM 0 HB THR A 45 -5.714 -5.650 -3.999 1.00 0.00 H new ATOM 0 HG1 THR A 45 -4.146 -4.790 -6.203 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.487 -5.099 -3.069 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.803 -6.850 -3.088 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.735 -6.126 -4.313 1.00 0.00 H new ATOM 733 N TYR A 46 -7.256 -7.561 -4.608 1.00 0.00 N ATOM 734 CA TYR A 46 -8.192 -8.461 -3.934 1.00 0.00 C ATOM 735 C TYR A 46 -8.147 -9.859 -4.549 1.00 0.00 C ATOM 736 O TYR A 46 -8.204 -10.861 -3.838 1.00 0.00 O ATOM 737 CB TYR A 46 -9.628 -7.899 -3.963 1.00 0.00 C ATOM 738 CG TYR A 46 -10.318 -7.969 -5.314 1.00 0.00 C ATOM 739 CD1 TYR A 46 -10.595 -9.189 -5.919 1.00 0.00 C ATOM 740 CD2 TYR A 46 -10.693 -6.810 -5.983 1.00 0.00 C ATOM 741 CE1 TYR A 46 -11.216 -9.253 -7.148 1.00 0.00 C ATOM 742 CE2 TYR A 46 -11.318 -6.868 -7.215 1.00 0.00 C ATOM 743 CZ TYR A 46 -11.575 -8.091 -7.793 1.00 0.00 C ATOM 744 OH TYR A 46 -12.196 -8.152 -9.020 1.00 0.00 O ATOM 0 H TYR A 46 -7.645 -6.653 -4.862 1.00 0.00 H new ATOM 0 HA TYR A 46 -7.883 -8.537 -2.892 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -10.230 -8.444 -3.236 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.601 -6.859 -3.639 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -10.319 -10.104 -5.417 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.493 -5.849 -5.533 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -11.420 -10.211 -7.603 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.603 -5.958 -7.722 1.00 0.00 H new ATOM 0 HH TYR A 46 -13.167 -8.199 -8.893 1.00 0.00 H new ATOM 754 N GLU A 47 -8.046 -9.919 -5.873 1.00 0.00 N ATOM 755 CA GLU A 47 -7.998 -11.195 -6.576 1.00 0.00 C ATOM 756 C GLU A 47 -6.603 -11.803 -6.506 1.00 0.00 C ATOM 757 O GLU A 47 -6.441 -13.022 -6.566 1.00 0.00 O ATOM 758 CB GLU A 47 -8.416 -11.010 -8.037 1.00 0.00 C ATOM 759 CG GLU A 47 -9.674 -11.775 -8.409 1.00 0.00 C ATOM 760 CD GLU A 47 -9.378 -13.036 -9.198 1.00 0.00 C ATOM 761 OE1 GLU A 47 -8.455 -13.007 -10.039 1.00 0.00 O ATOM 762 OE2 GLU A 47 -10.070 -14.052 -8.975 1.00 0.00 O ATOM 0 H GLU A 47 -7.996 -9.100 -6.479 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.695 -11.877 -6.089 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -8.575 -9.949 -8.229 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.600 -11.332 -8.684 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -10.217 -12.038 -7.501 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.328 -11.129 -8.995 1.00 0.00 H new ATOM 769 N SER A 48 -5.600 -10.944 -6.389 1.00 0.00 N ATOM 770 CA SER A 48 -4.212 -11.395 -6.322 1.00 0.00 C ATOM 771 C SER A 48 -3.599 -11.141 -4.946 1.00 0.00 C ATOM 772 O SER A 48 -2.410 -10.845 -4.835 1.00 0.00 O ATOM 773 CB SER A 48 -3.378 -10.695 -7.397 1.00 0.00 C ATOM 774 OG SER A 48 -2.363 -11.551 -7.892 1.00 0.00 O ATOM 0 H SER A 48 -5.718 -9.932 -6.338 1.00 0.00 H new ATOM 0 HA SER A 48 -4.208 -12.471 -6.498 1.00 0.00 H new ATOM 0 HB2 SER A 48 -4.025 -10.381 -8.216 1.00 0.00 H new ATOM 0 HB3 SER A 48 -2.928 -9.793 -6.982 1.00 0.00 H new ATOM 0 HG SER A 48 -2.172 -11.326 -8.827 1.00 0.00 H new ATOM 780 N PHE A 49 -4.411 -11.257 -3.898 1.00 0.00 N ATOM 781 CA PHE A 49 -3.930 -11.036 -2.538 1.00 0.00 C ATOM 782 C PHE A 49 -3.621 -12.366 -1.847 1.00 0.00 C ATOM 783 O PHE A 49 -4.391 -13.320 -1.952 1.00 0.00 O ATOM 784 CB PHE A 49 -4.961 -10.251 -1.727 1.00 0.00 C ATOM 785 CG PHE A 49 -4.349 -9.305 -0.731 1.00 0.00 C ATOM 786 CD1 PHE A 49 -3.436 -8.340 -1.136 1.00 0.00 C ATOM 787 CD2 PHE A 49 -4.686 -9.380 0.610 1.00 0.00 C ATOM 788 CE1 PHE A 49 -2.874 -7.472 -0.219 1.00 0.00 C ATOM 789 CE2 PHE A 49 -4.127 -8.514 1.530 1.00 0.00 C ATOM 790 CZ PHE A 49 -3.220 -7.559 1.115 1.00 0.00 C ATOM 0 H PHE A 49 -5.399 -11.501 -3.964 1.00 0.00 H new ATOM 0 HA PHE A 49 -3.010 -10.454 -2.596 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.595 -9.686 -2.410 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.607 -10.953 -1.200 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.162 -8.267 -2.178 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.395 -10.125 0.941 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.165 -6.726 -0.546 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -4.399 -8.584 2.573 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.782 -6.881 1.833 1.00 0.00 H new ATOM 800 N PRO A 50 -2.481 -12.451 -1.134 1.00 0.00 N ATOM 801 CA PRO A 50 -2.073 -13.677 -0.434 1.00 0.00 C ATOM 802 C PRO A 50 -3.060 -14.100 0.652 1.00 0.00 C ATOM 803 O PRO A 50 -3.061 -15.254 1.081 1.00 0.00 O ATOM 804 CB PRO A 50 -0.723 -13.310 0.197 1.00 0.00 C ATOM 805 CG PRO A 50 -0.255 -12.107 -0.548 1.00 0.00 C ATOM 806 CD PRO A 50 -1.495 -11.370 -0.960 1.00 0.00 C ATOM 0 HA PRO A 50 -2.026 -14.523 -1.120 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -0.831 -13.097 1.260 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.011 -14.130 0.107 1.00 0.00 H new ATOM 0 HG2 PRO A 50 0.381 -11.482 0.079 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.337 -12.392 -1.418 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -1.810 -10.655 -0.200 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.344 -10.810 -1.883 1.00 0.00 H new ATOM 814 N LYS A 51 -3.896 -13.167 1.098 1.00 0.00 N ATOM 815 CA LYS A 51 -4.877 -13.461 2.138 1.00 0.00 C ATOM 816 C LYS A 51 -5.904 -12.341 2.250 1.00 0.00 C ATOM 817 O LYS A 51 -5.689 -11.355 2.956 1.00 0.00 O ATOM 818 CB LYS A 51 -4.176 -13.670 3.483 1.00 0.00 C ATOM 819 CG LYS A 51 -4.571 -14.963 4.179 1.00 0.00 C ATOM 820 CD LYS A 51 -5.538 -14.708 5.324 1.00 0.00 C ATOM 821 CE LYS A 51 -5.955 -16.004 6.000 1.00 0.00 C ATOM 822 NZ LYS A 51 -4.896 -16.523 6.910 1.00 0.00 N ATOM 0 H LYS A 51 -3.914 -12.206 0.758 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.399 -14.377 1.864 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.097 -13.666 3.326 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.406 -12.829 4.138 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -5.030 -15.640 3.458 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -3.678 -15.460 4.559 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -5.071 -14.049 6.056 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -6.421 -14.192 4.948 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -6.871 -15.839 6.567 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -6.180 -16.753 5.241 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -5.220 -17.407 7.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -4.029 -16.705 6.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -4.699 -15.819 7.650 1.00 0.00 H new ATOM 836 N ARG A 52 -7.019 -12.500 1.549 1.00 0.00 N ATOM 837 CA ARG A 52 -8.082 -11.502 1.567 1.00 0.00 C ATOM 838 C ARG A 52 -9.400 -12.111 2.051 1.00 0.00 C ATOM 839 O ARG A 52 -9.840 -13.135 1.529 1.00 0.00 O ATOM 840 CB ARG A 52 -8.268 -10.901 0.172 1.00 0.00 C ATOM 841 CG ARG A 52 -8.292 -11.938 -0.941 1.00 0.00 C ATOM 842 CD ARG A 52 -9.680 -12.074 -1.549 1.00 0.00 C ATOM 843 NE ARG A 52 -9.995 -13.460 -1.887 1.00 0.00 N ATOM 844 CZ ARG A 52 -11.231 -13.911 -2.088 1.00 0.00 C ATOM 845 NH1 ARG A 52 -12.270 -13.091 -1.988 1.00 0.00 N ATOM 846 NH2 ARG A 52 -11.429 -15.187 -2.390 1.00 0.00 N ATOM 0 H ARG A 52 -7.211 -13.311 0.960 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.792 -10.714 2.262 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.200 -10.336 0.151 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.462 -10.193 -0.020 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.580 -11.656 -1.717 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -7.970 -12.902 -0.548 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -10.422 -11.694 -0.847 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -9.745 -11.458 -2.446 1.00 0.00 H new ATOM 0 HE ARG A 52 -9.223 -14.121 -1.974 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -12.124 -12.109 -1.756 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -13.215 -13.443 -2.143 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -10.634 -15.822 -2.468 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -12.376 -15.534 -2.544 1.00 0.00 H new ATOM 860 N PRO A 53 -10.056 -11.493 3.055 1.00 0.00 N ATOM 861 CA PRO A 53 -9.579 -10.276 3.710 1.00 0.00 C ATOM 862 C PRO A 53 -8.626 -10.574 4.863 1.00 0.00 C ATOM 863 O PRO A 53 -8.571 -11.698 5.361 1.00 0.00 O ATOM 864 CB PRO A 53 -10.871 -9.652 4.228 1.00 0.00 C ATOM 865 CG PRO A 53 -11.760 -10.813 4.533 1.00 0.00 C ATOM 866 CD PRO A 53 -11.334 -11.948 3.630 1.00 0.00 C ATOM 0 HA PRO A 53 -9.010 -9.634 3.038 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.690 -9.048 5.117 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.320 -8.995 3.483 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -11.672 -11.101 5.581 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.805 -10.554 4.360 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.211 -12.876 4.188 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -12.075 -12.138 2.853 1.00 0.00 H new ATOM 874 N LEU A 54 -7.877 -9.560 5.284 1.00 0.00 N ATOM 875 CA LEU A 54 -6.926 -9.714 6.379 1.00 0.00 C ATOM 876 C LEU A 54 -7.655 -9.922 7.707 1.00 0.00 C ATOM 877 O LEU A 54 -8.706 -9.327 7.949 1.00 0.00 O ATOM 878 CB LEU A 54 -6.015 -8.489 6.461 1.00 0.00 C ATOM 879 CG LEU A 54 -4.944 -8.407 5.372 1.00 0.00 C ATOM 880 CD1 LEU A 54 -4.403 -6.990 5.262 1.00 0.00 C ATOM 881 CD2 LEU A 54 -3.819 -9.389 5.657 1.00 0.00 C ATOM 0 H LEU A 54 -7.910 -8.623 4.883 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.316 -10.596 6.183 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.632 -7.592 6.411 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.524 -8.484 7.434 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.400 -8.675 4.419 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.642 -6.951 4.482 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.216 -6.309 5.011 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -3.963 -6.694 6.214 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.066 -9.317 4.872 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.364 -9.152 6.619 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.219 -10.403 5.684 1.00 0.00 H new ATOM 893 N PRO A 55 -7.109 -10.783 8.585 1.00 0.00 N ATOM 894 CA PRO A 55 -7.719 -11.081 9.885 1.00 0.00 C ATOM 895 C PRO A 55 -7.560 -9.954 10.902 1.00 0.00 C ATOM 896 O PRO A 55 -6.590 -9.197 10.869 1.00 0.00 O ATOM 897 CB PRO A 55 -6.960 -12.324 10.349 1.00 0.00 C ATOM 898 CG PRO A 55 -5.625 -12.213 9.699 1.00 0.00 C ATOM 899 CD PRO A 55 -5.864 -11.546 8.371 1.00 0.00 C ATOM 0 HA PRO A 55 -8.797 -11.217 9.797 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -6.871 -12.352 11.435 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -7.473 -13.237 10.048 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -4.940 -11.627 10.312 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -5.173 -13.196 9.566 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.036 -10.893 8.096 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -5.974 -12.276 7.569 1.00 0.00 H new ATOM 907 N GLU A 56 -8.524 -9.868 11.815 1.00 0.00 N ATOM 908 CA GLU A 56 -8.521 -8.858 12.871 1.00 0.00 C ATOM 909 C GLU A 56 -8.330 -7.447 12.320 1.00 0.00 C ATOM 910 O GLU A 56 -7.809 -6.572 13.011 1.00 0.00 O ATOM 911 CB GLU A 56 -7.420 -9.167 13.888 1.00 0.00 C ATOM 912 CG GLU A 56 -7.660 -10.445 14.674 1.00 0.00 C ATOM 913 CD GLU A 56 -8.252 -10.183 16.045 1.00 0.00 C ATOM 914 OE1 GLU A 56 -9.468 -9.913 16.125 1.00 0.00 O ATOM 915 OE2 GLU A 56 -7.498 -10.249 17.040 1.00 0.00 O ATOM 0 H GLU A 56 -9.328 -10.495 11.844 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.496 -8.894 13.356 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.466 -9.245 13.366 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.335 -8.333 14.584 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -8.331 -11.093 14.110 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -6.718 -10.981 14.786 1.00 0.00 H new ATOM 922 N ARG A 57 -8.765 -7.219 11.085 1.00 0.00 N ATOM 923 CA ARG A 57 -8.645 -5.898 10.477 1.00 0.00 C ATOM 924 C ARG A 57 -9.756 -5.656 9.459 1.00 0.00 C ATOM 925 O ARG A 57 -10.419 -6.592 9.012 1.00 0.00 O ATOM 926 CB ARG A 57 -7.266 -5.729 9.826 1.00 0.00 C ATOM 927 CG ARG A 57 -7.141 -6.370 8.449 1.00 0.00 C ATOM 928 CD ARG A 57 -7.652 -5.456 7.341 1.00 0.00 C ATOM 929 NE ARG A 57 -7.370 -4.045 7.603 1.00 0.00 N ATOM 930 CZ ARG A 57 -6.193 -3.469 7.376 1.00 0.00 C ATOM 931 NH1 ARG A 57 -5.183 -4.175 6.885 1.00 0.00 N ATOM 932 NH2 ARG A 57 -6.025 -2.181 7.644 1.00 0.00 N ATOM 0 H ARG A 57 -9.200 -7.924 10.490 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.749 -5.153 11.266 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.045 -4.665 9.740 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.511 -6.159 10.484 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.097 -6.620 8.259 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.700 -7.305 8.433 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -7.193 -5.745 6.396 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -8.727 -5.593 7.229 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.121 -3.468 7.982 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.306 -5.166 6.679 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.283 -3.727 6.713 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -6.798 -1.634 8.024 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -5.123 -1.737 7.471 1.00 0.00 H new ATOM 946 N THR A 58 -9.945 -4.393 9.090 1.00 0.00 N ATOM 947 CA THR A 58 -10.966 -4.023 8.116 1.00 0.00 C ATOM 948 C THR A 58 -10.326 -3.729 6.763 1.00 0.00 C ATOM 949 O THR A 58 -9.459 -2.863 6.653 1.00 0.00 O ATOM 950 CB THR A 58 -11.749 -2.803 8.605 1.00 0.00 C ATOM 951 OG1 THR A 58 -12.300 -3.042 9.888 1.00 0.00 O ATOM 952 CG2 THR A 58 -12.884 -2.411 7.684 1.00 0.00 C ATOM 0 H THR A 58 -9.404 -3.608 9.451 1.00 0.00 H new ATOM 0 HA THR A 58 -11.656 -4.859 8.002 1.00 0.00 H new ATOM 0 HB THR A 58 -11.026 -1.988 8.631 1.00 0.00 H new ATOM 0 HG1 THR A 58 -12.795 -2.250 10.184 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.397 -1.539 8.090 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.486 -2.171 6.698 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.587 -3.240 7.600 1.00 0.00 H new ATOM 960 N ASN A 59 -10.746 -4.463 5.739 1.00 0.00 N ATOM 961 CA ASN A 59 -10.195 -4.285 4.400 1.00 0.00 C ATOM 962 C ASN A 59 -11.120 -3.461 3.513 1.00 0.00 C ATOM 963 O ASN A 59 -12.330 -3.403 3.732 1.00 0.00 O ATOM 964 CB ASN A 59 -9.936 -5.642 3.749 1.00 0.00 C ATOM 965 CG ASN A 59 -8.982 -6.496 4.558 1.00 0.00 C ATOM 966 OD1 ASN A 59 -7.814 -6.650 4.203 1.00 0.00 O ATOM 967 ND2 ASN A 59 -9.478 -7.059 5.653 1.00 0.00 N ATOM 0 H ASN A 59 -11.464 -5.185 5.809 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.255 -3.743 4.504 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -10.881 -6.171 3.629 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.527 -5.491 2.750 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -8.884 -7.647 6.238 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -10.453 -6.904 5.909 1.00 0.00 H new ATOM 974 N VAL A 60 -10.531 -2.834 2.501 1.00 0.00 N ATOM 975 CA VAL A 60 -11.277 -2.016 1.556 1.00 0.00 C ATOM 976 C VAL A 60 -10.844 -2.340 0.128 1.00 0.00 C ATOM 977 O VAL A 60 -9.653 -2.353 -0.182 1.00 0.00 O ATOM 978 CB VAL A 60 -11.076 -0.511 1.837 1.00 0.00 C ATOM 979 CG1 VAL A 60 -11.604 0.340 0.689 1.00 0.00 C ATOM 980 CG2 VAL A 60 -11.745 -0.123 3.145 1.00 0.00 C ATOM 0 H VAL A 60 -9.529 -2.879 2.314 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.336 -2.245 1.675 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.006 -0.323 1.924 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -11.448 1.395 0.916 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -11.073 0.084 -0.228 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -12.669 0.151 0.556 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.594 0.941 3.329 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -12.813 -0.333 3.084 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.308 -0.698 3.962 1.00 0.00 H new ATOM 990 N VAL A 61 -11.817 -2.613 -0.733 1.00 0.00 N ATOM 991 CA VAL A 61 -11.536 -2.949 -2.123 1.00 0.00 C ATOM 992 C VAL A 61 -11.882 -1.795 -3.058 1.00 0.00 C ATOM 993 O VAL A 61 -12.837 -1.055 -2.824 1.00 0.00 O ATOM 994 CB VAL A 61 -12.318 -4.205 -2.557 1.00 0.00 C ATOM 995 CG1 VAL A 61 -11.986 -4.580 -3.993 1.00 0.00 C ATOM 996 CG2 VAL A 61 -12.027 -5.363 -1.615 1.00 0.00 C ATOM 0 H VAL A 61 -12.808 -2.608 -0.493 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.467 -3.148 -2.191 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.383 -3.980 -2.507 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.550 -5.469 -4.277 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -12.251 -3.756 -4.655 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.919 -4.785 -4.078 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.587 -6.242 -1.935 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.960 -5.586 -1.632 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.325 -5.092 -0.602 1.00 0.00 H new ATOM 1006 N LEU A 62 -11.099 -1.657 -4.123 1.00 0.00 N ATOM 1007 CA LEU A 62 -11.318 -0.603 -5.106 1.00 0.00 C ATOM 1008 C LEU A 62 -11.351 -1.185 -6.515 1.00 0.00 C ATOM 1009 O LEU A 62 -10.309 -1.423 -7.125 1.00 0.00 O ATOM 1010 CB LEU A 62 -10.222 0.460 -5.002 1.00 0.00 C ATOM 1011 CG LEU A 62 -10.602 1.839 -5.546 1.00 0.00 C ATOM 1012 CD1 LEU A 62 -11.706 2.464 -4.705 1.00 0.00 C ATOM 1013 CD2 LEU A 62 -9.383 2.749 -5.586 1.00 0.00 C ATOM 0 H LEU A 62 -10.305 -2.264 -4.327 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.281 -0.136 -4.899 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.938 0.565 -3.955 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.341 0.105 -5.537 1.00 0.00 H new ATOM 0 HG LEU A 62 -10.976 1.715 -6.562 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.961 3.444 -5.109 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.587 1.822 -4.726 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -11.362 2.574 -3.677 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -9.671 3.726 -5.975 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.981 2.864 -4.579 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.623 2.310 -6.232 1.00 0.00 H new ATOM 1025 N THR A 63 -12.557 -1.407 -7.026 1.00 0.00 N ATOM 1026 CA THR A 63 -12.739 -1.955 -8.364 1.00 0.00 C ATOM 1027 C THR A 63 -13.727 -1.107 -9.159 1.00 0.00 C ATOM 1028 O THR A 63 -14.678 -0.560 -8.601 1.00 0.00 O ATOM 1029 CB THR A 63 -13.238 -3.399 -8.279 1.00 0.00 C ATOM 1030 OG1 THR A 63 -13.318 -3.978 -9.569 1.00 0.00 O ATOM 1031 CG2 THR A 63 -14.602 -3.523 -7.635 1.00 0.00 C ATOM 0 H THR A 63 -13.427 -1.214 -6.530 1.00 0.00 H new ATOM 0 HA THR A 63 -11.777 -1.942 -8.877 1.00 0.00 H new ATOM 0 HB THR A 63 -12.511 -3.920 -7.656 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.637 -4.901 -9.494 1.00 0.00 H new ATOM 0 HG21 THR A 63 -14.897 -4.572 -7.606 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.562 -3.129 -6.619 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.331 -2.957 -8.215 1.00 0.00 H new ATOM 1039 N HIS A 64 -13.496 -0.997 -10.463 1.00 0.00 N ATOM 1040 CA HIS A 64 -14.367 -0.211 -11.328 1.00 0.00 C ATOM 1041 C HIS A 64 -15.740 -0.862 -11.464 1.00 0.00 C ATOM 1042 O HIS A 64 -16.752 -0.176 -11.607 1.00 0.00 O ATOM 1043 CB HIS A 64 -13.731 -0.040 -12.708 1.00 0.00 C ATOM 1044 CG HIS A 64 -12.778 1.112 -12.789 1.00 0.00 C ATOM 1045 ND1 HIS A 64 -12.954 2.286 -12.087 1.00 0.00 N ATOM 1046 CD2 HIS A 64 -11.632 1.266 -13.495 1.00 0.00 C ATOM 1047 CE1 HIS A 64 -11.959 3.112 -12.357 1.00 0.00 C ATOM 1048 NE2 HIS A 64 -11.143 2.517 -13.208 1.00 0.00 N ATOM 0 H HIS A 64 -12.714 -1.442 -10.943 1.00 0.00 H new ATOM 0 HA HIS A 64 -14.497 0.770 -10.871 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.204 -0.957 -12.972 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -14.519 0.098 -13.448 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.186 0.541 -14.159 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -11.834 4.105 -11.951 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -10.288 2.921 -13.590 1.00 0.00 H new ATOM 1057 N GLN A 65 -15.768 -2.192 -11.426 1.00 0.00 N ATOM 1058 CA GLN A 65 -17.015 -2.939 -11.552 1.00 0.00 C ATOM 1059 C GLN A 65 -18.088 -2.378 -10.626 1.00 0.00 C ATOM 1060 O GLN A 65 -17.850 -2.168 -9.437 1.00 0.00 O ATOM 1061 CB GLN A 65 -16.780 -4.418 -11.243 1.00 0.00 C ATOM 1062 CG GLN A 65 -16.391 -5.240 -12.461 1.00 0.00 C ATOM 1063 CD GLN A 65 -15.413 -6.349 -12.127 1.00 0.00 C ATOM 1064 OE1 GLN A 65 -14.123 -6.035 -12.176 1.00 0.00 O flip ATOM 1065 NE2 GLN A 65 -15.811 -7.475 -11.828 1.00 0.00 N flip ATOM 0 H GLN A 65 -14.939 -2.775 -11.309 1.00 0.00 H new ATOM 0 HA GLN A 65 -17.364 -2.839 -12.580 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -15.995 -4.503 -10.492 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -17.686 -4.838 -10.806 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -17.288 -5.673 -12.904 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -15.949 -4.584 -13.211 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -16.811 -7.672 -11.803 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -15.140 -8.211 -11.606 1.00 0.00 H new ATOM 1074 N GLU A 66 -19.273 -2.148 -11.179 1.00 0.00 N ATOM 1075 CA GLU A 66 -20.388 -1.624 -10.402 1.00 0.00 C ATOM 1076 C GLU A 66 -21.098 -2.750 -9.661 1.00 0.00 C ATOM 1077 O GLU A 66 -21.593 -2.564 -8.549 1.00 0.00 O ATOM 1078 CB GLU A 66 -21.377 -0.888 -11.310 1.00 0.00 C ATOM 1079 CG GLU A 66 -21.733 -1.654 -12.574 1.00 0.00 C ATOM 1080 CD GLU A 66 -21.158 -1.017 -13.824 1.00 0.00 C ATOM 1081 OE1 GLU A 66 -19.969 -0.633 -13.802 1.00 0.00 O ATOM 1082 OE2 GLU A 66 -21.895 -0.902 -14.826 1.00 0.00 O ATOM 0 H GLU A 66 -19.486 -2.316 -12.162 1.00 0.00 H new ATOM 0 HA GLU A 66 -19.993 -0.918 -9.671 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -22.290 -0.685 -10.749 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -20.953 0.077 -11.588 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -21.366 -2.677 -12.490 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.818 -1.712 -12.666 1.00 0.00 H new ATOM 1089 N ASP A 67 -21.152 -3.918 -10.294 1.00 0.00 N ATOM 1090 CA ASP A 67 -21.811 -5.077 -9.707 1.00 0.00 C ATOM 1091 C ASP A 67 -20.827 -5.962 -8.945 1.00 0.00 C ATOM 1092 O ASP A 67 -21.110 -7.132 -8.690 1.00 0.00 O ATOM 1093 CB ASP A 67 -22.504 -5.896 -10.797 1.00 0.00 C ATOM 1094 CG ASP A 67 -23.918 -5.419 -11.067 1.00 0.00 C ATOM 1095 OD1 ASP A 67 -24.705 -5.320 -10.103 1.00 0.00 O ATOM 1096 OD2 ASP A 67 -24.237 -5.144 -12.243 1.00 0.00 O ATOM 0 H ASP A 67 -20.746 -4.086 -11.215 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.552 -4.709 -8.997 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -21.922 -5.838 -11.717 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.528 -6.945 -10.500 1.00 0.00 H new ATOM 1101 N TYR A 68 -19.677 -5.405 -8.568 1.00 0.00 N ATOM 1102 CA TYR A 68 -18.682 -6.168 -7.823 1.00 0.00 C ATOM 1103 C TYR A 68 -19.058 -6.233 -6.346 1.00 0.00 C ATOM 1104 O TYR A 68 -19.385 -5.216 -5.735 1.00 0.00 O ATOM 1105 CB TYR A 68 -17.296 -5.544 -7.980 1.00 0.00 C ATOM 1106 CG TYR A 68 -16.200 -6.330 -7.295 1.00 0.00 C ATOM 1107 CD1 TYR A 68 -15.650 -7.458 -7.891 1.00 0.00 C ATOM 1108 CD2 TYR A 68 -15.718 -5.945 -6.050 1.00 0.00 C ATOM 1109 CE1 TYR A 68 -14.651 -8.180 -7.266 1.00 0.00 C ATOM 1110 CE2 TYR A 68 -14.719 -6.661 -5.419 1.00 0.00 C ATOM 1111 CZ TYR A 68 -14.189 -7.777 -6.031 1.00 0.00 C ATOM 1112 OH TYR A 68 -13.195 -8.493 -5.406 1.00 0.00 O ATOM 0 H TYR A 68 -19.415 -4.439 -8.764 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.657 -7.180 -8.227 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.062 -5.459 -9.041 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.314 -4.532 -7.576 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -16.009 -7.776 -8.859 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.131 -5.072 -5.568 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -14.234 -9.055 -7.742 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.355 -6.348 -4.451 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.325 -8.238 -5.778 1.00 0.00 H new ATOM 1122 N GLN A 69 -19.016 -7.434 -5.777 1.00 0.00 N ATOM 1123 CA GLN A 69 -19.360 -7.622 -4.372 1.00 0.00 C ATOM 1124 C GLN A 69 -18.203 -8.244 -3.596 1.00 0.00 C ATOM 1125 O GLN A 69 -17.807 -9.381 -3.854 1.00 0.00 O ATOM 1126 CB GLN A 69 -20.604 -8.502 -4.246 1.00 0.00 C ATOM 1127 CG GLN A 69 -21.829 -7.926 -4.938 1.00 0.00 C ATOM 1128 CD GLN A 69 -22.254 -6.592 -4.356 1.00 0.00 C ATOM 1129 OE1 GLN A 69 -21.932 -5.511 -5.056 1.00 0.00 O flip ATOM 1130 NE2 GLN A 69 -22.866 -6.534 -3.289 1.00 0.00 N flip ATOM 0 H GLN A 69 -18.748 -8.289 -6.265 1.00 0.00 H new ATOM 0 HA GLN A 69 -19.567 -6.641 -3.945 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -20.388 -9.484 -4.666 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.829 -8.649 -3.190 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.618 -7.804 -6.000 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.654 -8.633 -4.856 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -23.093 -7.391 -2.784 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -23.146 -5.629 -2.910 1.00 0.00 H new ATOM 1139 N ALA A 70 -17.668 -7.490 -2.641 1.00 0.00 N ATOM 1140 CA ALA A 70 -16.560 -7.961 -1.820 1.00 0.00 C ATOM 1141 C ALA A 70 -17.009 -8.184 -0.380 1.00 0.00 C ATOM 1142 O ALA A 70 -17.065 -7.247 0.417 1.00 0.00 O ATOM 1143 CB ALA A 70 -15.405 -6.973 -1.869 1.00 0.00 C ATOM 0 H ALA A 70 -17.986 -6.547 -2.417 1.00 0.00 H new ATOM 0 HA ALA A 70 -16.219 -8.915 -2.222 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -14.586 -7.340 -1.251 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.062 -6.865 -2.898 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -15.738 -6.005 -1.494 1.00 0.00 H new ATOM 1149 N GLN A 71 -17.329 -9.431 -0.055 1.00 0.00 N ATOM 1150 CA GLN A 71 -17.777 -9.782 1.286 1.00 0.00 C ATOM 1151 C GLN A 71 -16.624 -9.717 2.277 1.00 0.00 C ATOM 1152 O GLN A 71 -15.568 -10.312 2.058 1.00 0.00 O ATOM 1153 CB GLN A 71 -18.391 -11.183 1.291 1.00 0.00 C ATOM 1154 CG GLN A 71 -19.576 -11.331 0.350 1.00 0.00 C ATOM 1155 CD GLN A 71 -19.199 -11.993 -0.961 1.00 0.00 C ATOM 1156 OE1 GLN A 71 -18.965 -13.200 -1.017 1.00 0.00 O ATOM 1157 NE2 GLN A 71 -19.138 -11.202 -2.026 1.00 0.00 N ATOM 0 H GLN A 71 -17.286 -10.217 -0.704 1.00 0.00 H new ATOM 0 HA GLN A 71 -18.535 -9.060 1.590 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -17.625 -11.907 1.014 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -18.710 -11.428 2.304 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -20.353 -11.918 0.839 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -20.000 -10.347 0.148 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -19.340 -10.206 -1.934 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -18.889 -11.590 -2.936 1.00 0.00 H new ATOM 1166 N GLY A 72 -16.833 -8.991 3.367 1.00 0.00 N ATOM 1167 CA GLY A 72 -15.802 -8.862 4.376 1.00 0.00 C ATOM 1168 C GLY A 72 -15.095 -7.524 4.314 1.00 0.00 C ATOM 1169 O GLY A 72 -14.588 -7.038 5.325 1.00 0.00 O ATOM 0 H GLY A 72 -17.698 -8.490 3.570 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -16.246 -8.989 5.363 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -15.072 -9.661 4.249 1.00 0.00 H new ATOM 1173 N ALA A 73 -15.055 -6.923 3.127 1.00 0.00 N ATOM 1174 CA ALA A 73 -14.397 -5.632 2.950 1.00 0.00 C ATOM 1175 C ALA A 73 -15.341 -4.614 2.314 1.00 0.00 C ATOM 1176 O ALA A 73 -16.417 -4.967 1.833 1.00 0.00 O ATOM 1177 CB ALA A 73 -13.145 -5.793 2.102 1.00 0.00 C ATOM 0 H ALA A 73 -15.468 -7.308 2.278 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.114 -5.259 3.934 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.663 -4.823 1.977 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.457 -6.479 2.596 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.416 -6.192 1.125 1.00 0.00 H new ATOM 1183 N VAL A 74 -14.926 -3.349 2.310 1.00 0.00 N ATOM 1184 CA VAL A 74 -15.732 -2.280 1.727 1.00 0.00 C ATOM 1185 C VAL A 74 -15.456 -2.149 0.233 1.00 0.00 C ATOM 1186 O VAL A 74 -14.303 -2.114 -0.191 1.00 0.00 O ATOM 1187 CB VAL A 74 -15.454 -0.924 2.406 1.00 0.00 C ATOM 1188 CG1 VAL A 74 -16.529 0.087 2.036 1.00 0.00 C ATOM 1189 CG2 VAL A 74 -15.363 -1.087 3.916 1.00 0.00 C ATOM 0 H VAL A 74 -14.037 -3.040 2.704 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.777 -2.547 1.887 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.495 -0.550 2.048 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -16.317 1.038 2.524 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.539 0.228 0.955 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.502 -0.280 2.363 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -15.166 -0.118 4.375 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.304 -1.485 4.296 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.553 -1.775 4.160 1.00 0.00 H new ATOM 1199 N VAL A 75 -16.518 -2.089 -0.564 1.00 0.00 N ATOM 1200 CA VAL A 75 -16.373 -1.977 -2.011 1.00 0.00 C ATOM 1201 C VAL A 75 -16.731 -0.582 -2.516 1.00 0.00 C ATOM 1202 O VAL A 75 -17.741 0.000 -2.121 1.00 0.00 O ATOM 1203 CB VAL A 75 -17.243 -3.018 -2.742 1.00 0.00 C ATOM 1204 CG1 VAL A 75 -17.091 -2.889 -4.251 1.00 0.00 C ATOM 1205 CG2 VAL A 75 -16.882 -4.422 -2.284 1.00 0.00 C ATOM 0 H VAL A 75 -17.483 -2.116 -0.235 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.322 -2.166 -2.230 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.287 -2.829 -2.492 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -17.715 -3.634 -4.745 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.401 -1.892 -4.564 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.049 -3.048 -4.527 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.504 -5.147 -2.808 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -15.833 -4.618 -2.504 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.050 -4.509 -1.211 1.00 0.00 H new ATOM 1215 N VAL A 76 -15.892 -0.067 -3.410 1.00 0.00 N ATOM 1216 CA VAL A 76 -16.097 1.247 -4.007 1.00 0.00 C ATOM 1217 C VAL A 76 -15.355 1.336 -5.338 1.00 0.00 C ATOM 1218 O VAL A 76 -14.389 0.607 -5.564 1.00 0.00 O ATOM 1219 CB VAL A 76 -15.624 2.382 -3.075 1.00 0.00 C ATOM 1220 CG1 VAL A 76 -16.373 2.335 -1.752 1.00 0.00 C ATOM 1221 CG2 VAL A 76 -14.121 2.307 -2.850 1.00 0.00 C ATOM 0 H VAL A 76 -15.055 -0.547 -3.739 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.168 1.370 -4.169 1.00 0.00 H new ATOM 0 HB VAL A 76 -15.844 3.334 -3.558 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -16.026 3.143 -1.108 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.441 2.450 -1.934 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.189 1.378 -1.264 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.811 3.117 -2.190 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -13.869 1.350 -2.393 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.605 2.400 -3.806 1.00 0.00 H new ATOM 1231 N HIS A 77 -15.816 2.211 -6.225 1.00 0.00 N ATOM 1232 CA HIS A 77 -15.188 2.356 -7.537 1.00 0.00 C ATOM 1233 C HIS A 77 -14.668 3.773 -7.770 1.00 0.00 C ATOM 1234 O HIS A 77 -13.941 4.019 -8.732 1.00 0.00 O ATOM 1235 CB HIS A 77 -16.178 1.983 -8.647 1.00 0.00 C ATOM 1236 CG HIS A 77 -17.293 1.090 -8.192 1.00 0.00 C ATOM 1237 ND1 HIS A 77 -17.086 -0.061 -7.461 1.00 0.00 N ATOM 1238 CD2 HIS A 77 -18.633 1.188 -8.364 1.00 0.00 C ATOM 1239 CE1 HIS A 77 -18.249 -0.632 -7.204 1.00 0.00 C ATOM 1240 NE2 HIS A 77 -19.203 0.107 -7.739 1.00 0.00 N ATOM 0 H HIS A 77 -16.614 2.826 -6.064 1.00 0.00 H new ATOM 0 HA HIS A 77 -14.336 1.677 -7.561 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -16.604 2.896 -9.063 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -15.636 1.489 -9.453 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -16.177 -0.416 -7.165 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -19.155 1.971 -8.894 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -18.395 -1.548 -6.650 1.00 0.00 H new ATOM 1249 N ASP A 78 -15.049 4.708 -6.906 1.00 0.00 N ATOM 1250 CA ASP A 78 -14.618 6.093 -7.057 1.00 0.00 C ATOM 1251 C ASP A 78 -13.796 6.557 -5.860 1.00 0.00 C ATOM 1252 O ASP A 78 -13.851 5.961 -4.784 1.00 0.00 O ATOM 1253 CB ASP A 78 -15.831 7.007 -7.242 1.00 0.00 C ATOM 1254 CG ASP A 78 -16.095 7.329 -8.700 1.00 0.00 C ATOM 1255 OD1 ASP A 78 -15.180 7.859 -9.366 1.00 0.00 O ATOM 1256 OD2 ASP A 78 -17.215 7.051 -9.176 1.00 0.00 O ATOM 0 H ASP A 78 -15.650 4.534 -6.101 1.00 0.00 H new ATOM 0 HA ASP A 78 -13.985 6.148 -7.942 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -16.712 6.529 -6.813 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -15.671 7.934 -6.691 1.00 0.00 H new ATOM 1261 N VAL A 79 -13.037 7.630 -6.060 1.00 0.00 N ATOM 1262 CA VAL A 79 -12.202 8.187 -5.004 1.00 0.00 C ATOM 1263 C VAL A 79 -13.044 8.933 -3.980 1.00 0.00 C ATOM 1264 O VAL A 79 -12.767 8.891 -2.782 1.00 0.00 O ATOM 1265 CB VAL A 79 -11.143 9.146 -5.572 1.00 0.00 C ATOM 1266 CG1 VAL A 79 -10.178 9.578 -4.480 1.00 0.00 C ATOM 1267 CG2 VAL A 79 -10.402 8.493 -6.727 1.00 0.00 C ATOM 0 H VAL A 79 -12.984 8.132 -6.947 1.00 0.00 H new ATOM 0 HA VAL A 79 -11.700 7.348 -4.521 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.645 10.036 -5.951 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.435 10.257 -4.899 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -10.728 10.086 -3.688 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -9.678 8.701 -4.069 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.656 9.185 -7.118 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -9.908 7.587 -6.377 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.110 8.239 -7.516 1.00 0.00 H new ATOM 1277 N ALA A 80 -14.084 9.602 -4.460 1.00 0.00 N ATOM 1278 CA ALA A 80 -14.979 10.342 -3.584 1.00 0.00 C ATOM 1279 C ALA A 80 -15.811 9.375 -2.759 1.00 0.00 C ATOM 1280 O ALA A 80 -16.122 9.634 -1.597 1.00 0.00 O ATOM 1281 CB ALA A 80 -15.877 11.265 -4.395 1.00 0.00 C ATOM 0 H ALA A 80 -14.327 9.647 -5.450 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.383 10.956 -2.909 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.540 11.810 -3.723 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.263 11.972 -4.952 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.472 10.674 -5.091 1.00 0.00 H new ATOM 1287 N ALA A 81 -16.158 8.249 -3.374 1.00 0.00 N ATOM 1288 CA ALA A 81 -16.946 7.224 -2.705 1.00 0.00 C ATOM 1289 C ALA A 81 -16.265 6.785 -1.416 1.00 0.00 C ATOM 1290 O ALA A 81 -16.766 7.033 -0.320 1.00 0.00 O ATOM 1291 CB ALA A 81 -17.158 6.032 -3.627 1.00 0.00 C ATOM 0 H ALA A 81 -15.905 8.024 -4.336 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.920 7.645 -2.454 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -17.749 5.274 -3.112 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -17.685 6.355 -4.524 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.192 5.611 -3.906 1.00 0.00 H new ATOM 1297 N VAL A 82 -15.114 6.134 -1.557 1.00 0.00 N ATOM 1298 CA VAL A 82 -14.353 5.660 -0.409 1.00 0.00 C ATOM 1299 C VAL A 82 -14.124 6.781 0.607 1.00 0.00 C ATOM 1300 O VAL A 82 -14.106 6.546 1.814 1.00 0.00 O ATOM 1301 CB VAL A 82 -12.992 5.076 -0.854 1.00 0.00 C ATOM 1302 CG1 VAL A 82 -11.973 6.180 -1.091 1.00 0.00 C ATOM 1303 CG2 VAL A 82 -12.473 4.077 0.167 1.00 0.00 C ATOM 0 H VAL A 82 -14.688 5.923 -2.459 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.939 4.874 0.067 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.146 4.552 -1.797 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -11.026 5.740 -1.403 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.336 6.849 -1.871 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -11.826 6.743 -0.169 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.515 3.680 -0.167 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.344 4.573 1.129 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.187 3.261 0.273 1.00 0.00 H new ATOM 1313 N PHE A 83 -13.949 8.003 0.113 1.00 0.00 N ATOM 1314 CA PHE A 83 -13.721 9.144 0.988 1.00 0.00 C ATOM 1315 C PHE A 83 -14.890 9.330 1.945 1.00 0.00 C ATOM 1316 O PHE A 83 -14.694 9.528 3.144 1.00 0.00 O ATOM 1317 CB PHE A 83 -13.505 10.414 0.164 1.00 0.00 C ATOM 1318 CG PHE A 83 -12.071 10.648 -0.225 1.00 0.00 C ATOM 1319 CD1 PHE A 83 -11.045 10.437 0.683 1.00 0.00 C ATOM 1320 CD2 PHE A 83 -11.751 11.082 -1.502 1.00 0.00 C ATOM 1321 CE1 PHE A 83 -9.728 10.652 0.324 1.00 0.00 C ATOM 1322 CE2 PHE A 83 -10.435 11.298 -1.866 1.00 0.00 C ATOM 1323 CZ PHE A 83 -9.423 11.083 -0.952 1.00 0.00 C ATOM 0 H PHE A 83 -13.961 8.226 -0.882 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.823 8.950 1.574 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -14.112 10.358 -0.739 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -13.862 11.271 0.735 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -11.278 10.101 1.683 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.539 11.253 -2.221 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.938 10.483 1.041 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -10.199 11.635 -2.865 1.00 0.00 H new ATOM 0 HZ PHE A 83 -8.394 11.252 -1.234 1.00 0.00 H new ATOM 1333 N ALA A 84 -16.108 9.248 1.418 1.00 0.00 N ATOM 1334 CA ALA A 84 -17.296 9.391 2.246 1.00 0.00 C ATOM 1335 C ALA A 84 -17.296 8.324 3.325 1.00 0.00 C ATOM 1336 O ALA A 84 -17.630 8.588 4.480 1.00 0.00 O ATOM 1337 CB ALA A 84 -18.558 9.305 1.400 1.00 0.00 C ATOM 0 H ALA A 84 -16.295 9.084 0.429 1.00 0.00 H new ATOM 0 HA ALA A 84 -17.281 10.373 2.720 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -19.433 9.414 2.040 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -18.552 10.101 0.655 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -18.594 8.338 0.898 1.00 0.00 H new ATOM 1343 N TYR A 85 -16.884 7.120 2.944 1.00 0.00 N ATOM 1344 CA TYR A 85 -16.803 6.025 3.889 1.00 0.00 C ATOM 1345 C TYR A 85 -15.804 6.404 4.979 1.00 0.00 C ATOM 1346 O TYR A 85 -16.162 6.500 6.152 1.00 0.00 O ATOM 1347 CB TYR A 85 -16.416 4.720 3.171 1.00 0.00 C ATOM 1348 CG TYR A 85 -15.141 4.070 3.663 1.00 0.00 C ATOM 1349 CD1 TYR A 85 -15.068 3.499 4.926 1.00 0.00 C ATOM 1350 CD2 TYR A 85 -14.013 4.030 2.858 1.00 0.00 C ATOM 1351 CE1 TYR A 85 -13.904 2.906 5.373 1.00 0.00 C ATOM 1352 CE2 TYR A 85 -12.844 3.439 3.296 1.00 0.00 C ATOM 1353 CZ TYR A 85 -12.795 2.878 4.554 1.00 0.00 C ATOM 1354 OH TYR A 85 -11.634 2.288 4.995 1.00 0.00 O ATOM 0 H TYR A 85 -16.604 6.883 1.992 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.774 5.847 4.351 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -17.234 4.008 3.280 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -16.312 4.927 2.106 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -15.935 3.519 5.569 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.049 4.468 1.872 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -13.862 2.467 6.359 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.974 3.417 2.657 1.00 0.00 H new ATOM 0 HH TYR A 85 -10.893 2.542 4.406 1.00 0.00 H new ATOM 1364 N ALA A 86 -14.547 6.619 4.582 1.00 0.00 N ATOM 1365 CA ALA A 86 -13.497 6.991 5.524 1.00 0.00 C ATOM 1366 C ALA A 86 -13.985 8.041 6.519 1.00 0.00 C ATOM 1367 O ALA A 86 -13.559 8.057 7.673 1.00 0.00 O ATOM 1368 CB ALA A 86 -12.272 7.497 4.777 1.00 0.00 C ATOM 0 H ALA A 86 -14.235 6.541 3.614 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.224 6.100 6.089 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.497 7.771 5.493 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.898 6.713 4.119 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.543 8.370 4.184 1.00 0.00 H new ATOM 1374 N LYS A 87 -14.896 8.905 6.075 1.00 0.00 N ATOM 1375 CA LYS A 87 -15.445 9.932 6.951 1.00 0.00 C ATOM 1376 C LYS A 87 -16.286 9.276 8.039 1.00 0.00 C ATOM 1377 O LYS A 87 -16.164 9.597 9.222 1.00 0.00 O ATOM 1378 CB LYS A 87 -16.294 10.921 6.149 1.00 0.00 C ATOM 1379 CG LYS A 87 -16.138 12.363 6.601 1.00 0.00 C ATOM 1380 CD LYS A 87 -14.997 13.058 5.873 1.00 0.00 C ATOM 1381 CE LYS A 87 -15.472 14.312 5.155 1.00 0.00 C ATOM 1382 NZ LYS A 87 -16.250 13.988 3.927 1.00 0.00 N ATOM 0 H LYS A 87 -15.265 8.913 5.124 1.00 0.00 H new ATOM 0 HA LYS A 87 -14.625 10.482 7.413 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -16.024 10.848 5.096 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -17.343 10.635 6.230 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -17.067 12.904 6.422 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -15.955 12.390 7.675 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.216 13.320 6.586 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.553 12.372 5.152 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -16.089 14.905 5.830 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.611 14.926 4.888 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -16.555 14.869 3.467 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -15.653 13.444 3.271 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -17.085 13.424 4.184 1.00 0.00 H new ATOM 1396 N GLN A 88 -17.142 8.353 7.616 1.00 0.00 N ATOM 1397 CA GLN A 88 -18.020 7.634 8.532 1.00 0.00 C ATOM 1398 C GLN A 88 -17.217 6.877 9.590 1.00 0.00 C ATOM 1399 O GLN A 88 -17.754 6.499 10.631 1.00 0.00 O ATOM 1400 CB GLN A 88 -18.907 6.658 7.756 1.00 0.00 C ATOM 1401 CG GLN A 88 -20.204 6.315 8.471 1.00 0.00 C ATOM 1402 CD GLN A 88 -21.233 5.696 7.545 1.00 0.00 C ATOM 1403 OE1 GLN A 88 -21.315 4.474 7.418 1.00 0.00 O ATOM 1404 NE2 GLN A 88 -22.024 6.539 6.892 1.00 0.00 N ATOM 0 H GLN A 88 -17.247 8.084 6.638 1.00 0.00 H new ATOM 0 HA GLN A 88 -18.647 8.367 9.040 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -19.141 7.088 6.782 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.349 5.740 7.573 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -19.993 5.624 9.287 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -20.619 7.219 8.917 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -21.921 7.545 7.028 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -22.735 6.181 6.254 1.00 0.00 H new ATOM 1413 N HIS A 89 -15.931 6.658 9.322 1.00 0.00 N ATOM 1414 CA HIS A 89 -15.067 5.948 10.259 1.00 0.00 C ATOM 1415 C HIS A 89 -14.082 6.904 10.934 1.00 0.00 C ATOM 1416 O HIS A 89 -12.898 6.926 10.597 1.00 0.00 O ATOM 1417 CB HIS A 89 -14.304 4.835 9.536 1.00 0.00 C ATOM 1418 CG HIS A 89 -14.863 3.469 9.782 1.00 0.00 C ATOM 1419 ND1 HIS A 89 -15.111 2.972 11.045 1.00 0.00 N ATOM 1420 CD2 HIS A 89 -15.223 2.491 8.918 1.00 0.00 C ATOM 1421 CE1 HIS A 89 -15.599 1.748 10.946 1.00 0.00 C ATOM 1422 NE2 HIS A 89 -15.677 1.433 9.666 1.00 0.00 N ATOM 0 H HIS A 89 -15.467 6.962 8.466 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.698 5.507 11.031 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -14.314 5.035 8.465 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.262 4.855 9.854 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -15.164 2.535 7.841 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -15.885 1.113 11.772 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -16.019 0.547 9.293 1.00 0.00 H new ATOM 1431 N PRO A 90 -14.559 7.707 11.902 1.00 0.00 N ATOM 1432 CA PRO A 90 -13.715 8.663 12.627 1.00 0.00 C ATOM 1433 C PRO A 90 -12.813 7.988 13.660 1.00 0.00 C ATOM 1434 O PRO A 90 -12.010 8.648 14.319 1.00 0.00 O ATOM 1435 CB PRO A 90 -14.734 9.564 13.322 1.00 0.00 C ATOM 1436 CG PRO A 90 -15.913 8.684 13.546 1.00 0.00 C ATOM 1437 CD PRO A 90 -15.960 7.746 12.370 1.00 0.00 C ATOM 0 HA PRO A 90 -13.032 9.190 11.961 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.344 9.953 14.263 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.992 10.424 12.703 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.816 8.133 14.481 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.830 9.270 13.615 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -16.314 6.757 12.660 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.632 8.110 11.593 1.00 0.00 H new ATOM 1445 N ASP A 91 -12.951 6.672 13.799 1.00 0.00 N ATOM 1446 CA ASP A 91 -12.148 5.916 14.755 1.00 0.00 C ATOM 1447 C ASP A 91 -11.077 5.083 14.052 1.00 0.00 C ATOM 1448 O ASP A 91 -10.380 4.293 14.689 1.00 0.00 O ATOM 1449 CB ASP A 91 -13.047 5.004 15.590 1.00 0.00 C ATOM 1450 CG ASP A 91 -13.543 5.681 16.853 1.00 0.00 C ATOM 1451 OD1 ASP A 91 -12.701 6.072 17.688 1.00 0.00 O ATOM 1452 OD2 ASP A 91 -14.775 5.820 17.007 1.00 0.00 O ATOM 0 H ASP A 91 -13.610 6.108 13.263 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.647 6.631 15.407 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.901 4.691 14.989 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.497 4.101 15.857 1.00 0.00 H new ATOM 1457 N GLN A 92 -10.948 5.258 12.739 1.00 0.00 N ATOM 1458 CA GLN A 92 -9.960 4.515 11.966 1.00 0.00 C ATOM 1459 C GLN A 92 -9.218 5.431 10.997 1.00 0.00 C ATOM 1460 O GLN A 92 -9.563 6.603 10.847 1.00 0.00 O ATOM 1461 CB GLN A 92 -10.635 3.379 11.196 1.00 0.00 C ATOM 1462 CG GLN A 92 -10.752 2.090 11.993 1.00 0.00 C ATOM 1463 CD GLN A 92 -12.017 2.034 12.827 1.00 0.00 C ATOM 1464 OE1 GLN A 92 -13.069 1.447 12.269 1.00 0.00 O flip ATOM 1465 NE2 GLN A 92 -12.048 2.512 13.962 1.00 0.00 N flip ATOM 0 H GLN A 92 -11.514 5.906 12.191 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.235 4.094 12.663 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -11.631 3.700 10.891 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -10.070 3.183 10.285 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.734 1.241 11.309 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -9.885 1.991 12.647 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -11.216 2.954 14.352 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -12.906 2.465 14.512 1.00 0.00 H new ATOM 1474 N GLU A 93 -8.195 4.888 10.343 1.00 0.00 N ATOM 1475 CA GLU A 93 -7.400 5.655 9.389 1.00 0.00 C ATOM 1476 C GLU A 93 -7.377 4.976 8.023 1.00 0.00 C ATOM 1477 O GLU A 93 -7.672 3.786 7.904 1.00 0.00 O ATOM 1478 CB GLU A 93 -5.972 5.831 9.911 1.00 0.00 C ATOM 1479 CG GLU A 93 -5.470 7.263 9.836 1.00 0.00 C ATOM 1480 CD GLU A 93 -4.123 7.445 10.508 1.00 0.00 C ATOM 1481 OE1 GLU A 93 -4.056 7.310 11.748 1.00 0.00 O ATOM 1482 OE2 GLU A 93 -3.136 7.723 9.796 1.00 0.00 O ATOM 0 H GLU A 93 -7.897 3.919 10.456 1.00 0.00 H new ATOM 0 HA GLU A 93 -7.862 6.636 9.275 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.928 5.493 10.946 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.303 5.190 9.338 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -5.394 7.563 8.791 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -6.198 7.924 10.305 1.00 0.00 H new ATOM 1489 N LEU A 94 -7.027 5.742 6.993 1.00 0.00 N ATOM 1490 CA LEU A 94 -6.967 5.219 5.633 1.00 0.00 C ATOM 1491 C LEU A 94 -5.527 4.923 5.222 1.00 0.00 C ATOM 1492 O LEU A 94 -4.654 5.786 5.318 1.00 0.00 O ATOM 1493 CB LEU A 94 -7.590 6.218 4.656 1.00 0.00 C ATOM 1494 CG LEU A 94 -8.424 5.596 3.536 1.00 0.00 C ATOM 1495 CD1 LEU A 94 -9.644 4.893 4.110 1.00 0.00 C ATOM 1496 CD2 LEU A 94 -8.842 6.658 2.531 1.00 0.00 C ATOM 0 H LEU A 94 -6.780 6.728 7.076 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.531 4.287 5.605 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -8.221 6.907 5.218 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -6.792 6.810 4.208 1.00 0.00 H new ATOM 0 HG LEU A 94 -7.812 4.856 3.019 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.227 4.456 3.299 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -9.323 4.106 4.792 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.258 5.613 4.651 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.435 6.198 1.741 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.437 7.421 3.034 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.954 7.118 2.097 1.00 0.00 H new ATOM 1508 N VAL A 95 -5.286 3.699 4.763 1.00 0.00 N ATOM 1509 CA VAL A 95 -3.953 3.292 4.335 1.00 0.00 C ATOM 1510 C VAL A 95 -4.013 2.482 3.043 1.00 0.00 C ATOM 1511 O VAL A 95 -4.750 1.502 2.948 1.00 0.00 O ATOM 1512 CB VAL A 95 -3.245 2.455 5.416 1.00 0.00 C ATOM 1513 CG1 VAL A 95 -1.791 2.214 5.040 1.00 0.00 C ATOM 1514 CG2 VAL A 95 -3.346 3.139 6.772 1.00 0.00 C ATOM 0 H VAL A 95 -5.997 2.972 4.678 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.385 4.207 4.164 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.743 1.488 5.484 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.308 1.621 5.816 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.744 1.678 4.092 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.277 3.170 4.942 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.840 2.533 7.524 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -2.875 4.121 6.720 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.395 3.254 7.044 1.00 0.00 H new ATOM 1524 N ILE A 96 -3.230 2.898 2.052 1.00 0.00 N ATOM 1525 CA ILE A 96 -3.192 2.209 0.767 1.00 0.00 C ATOM 1526 C ILE A 96 -2.095 1.150 0.747 1.00 0.00 C ATOM 1527 O ILE A 96 -0.958 1.414 1.138 1.00 0.00 O ATOM 1528 CB ILE A 96 -2.960 3.192 -0.399 1.00 0.00 C ATOM 1529 CG1 ILE A 96 -3.802 4.457 -0.216 1.00 0.00 C ATOM 1530 CG2 ILE A 96 -3.284 2.523 -1.726 1.00 0.00 C ATOM 1531 CD1 ILE A 96 -5.277 4.183 -0.014 1.00 0.00 C ATOM 0 H ILE A 96 -2.614 3.708 2.114 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.163 1.731 0.638 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.909 3.480 -0.402 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.424 5.013 0.642 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.677 5.096 -1.090 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.116 3.228 -2.540 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.641 1.653 -1.861 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.327 2.208 -1.729 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.809 5.126 0.109 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.671 3.654 -0.882 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.415 3.571 0.877 1.00 0.00 H new ATOM 1543 N ALA A 97 -2.443 -0.050 0.293 1.00 0.00 N ATOM 1544 CA ALA A 97 -1.485 -1.148 0.228 1.00 0.00 C ATOM 1545 C ALA A 97 -1.177 -1.538 -1.215 1.00 0.00 C ATOM 1546 O ALA A 97 -0.105 -2.067 -1.508 1.00 0.00 O ATOM 1547 CB ALA A 97 -2.011 -2.350 0.998 1.00 0.00 C ATOM 0 H ALA A 97 -3.380 -0.286 -0.035 1.00 0.00 H new ATOM 0 HA ALA A 97 -0.556 -0.808 0.686 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -1.287 -3.163 0.942 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -2.167 -2.074 2.041 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -2.956 -2.675 0.563 1.00 0.00 H new ATOM 1553 N GLY A 98 -2.123 -1.278 -2.114 1.00 0.00 N ATOM 1554 CA GLY A 98 -1.926 -1.616 -3.512 1.00 0.00 C ATOM 1555 C GLY A 98 -3.207 -1.506 -4.322 1.00 0.00 C ATOM 1556 O GLY A 98 -4.278 -1.295 -3.756 1.00 0.00 O ATOM 0 H GLY A 98 -3.019 -0.841 -1.900 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.171 -0.956 -3.940 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.539 -2.632 -3.586 1.00 0.00 H new ATOM 1560 N GLY A 99 -3.104 -1.610 -5.654 1.00 0.00 N ATOM 1561 CA GLY A 99 -1.823 -1.821 -6.310 1.00 0.00 C ATOM 1562 C GLY A 99 -1.175 -0.527 -6.758 1.00 0.00 C ATOM 1563 O GLY A 99 -1.415 0.532 -6.177 1.00 0.00 O ATOM 0 H GLY A 99 -3.898 -1.550 -6.292 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -1.151 -2.342 -5.627 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -1.965 -2.470 -7.174 1.00 0.00 H new ATOM 1567 N ALA A 100 -0.349 -0.613 -7.797 1.00 0.00 N ATOM 1568 CA ALA A 100 0.340 0.556 -8.328 1.00 0.00 C ATOM 1569 C ALA A 100 -0.644 1.551 -8.934 1.00 0.00 C ATOM 1570 O ALA A 100 -0.385 2.755 -8.961 1.00 0.00 O ATOM 1571 CB ALA A 100 1.371 0.134 -9.363 1.00 0.00 C ATOM 0 H ALA A 100 -0.141 -1.483 -8.288 1.00 0.00 H new ATOM 0 HA ALA A 100 0.850 1.051 -7.501 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.879 1.017 -9.752 1.00 0.00 H new ATOM 0 HB2 ALA A 100 2.101 -0.530 -8.900 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.873 -0.388 -10.180 1.00 0.00 H new ATOM 1577 N GLN A 101 -1.775 1.046 -9.417 1.00 0.00 N ATOM 1578 CA GLN A 101 -2.792 1.899 -10.019 1.00 0.00 C ATOM 1579 C GLN A 101 -3.551 2.666 -8.943 1.00 0.00 C ATOM 1580 O GLN A 101 -3.985 3.798 -9.159 1.00 0.00 O ATOM 1581 CB GLN A 101 -3.761 1.060 -10.855 1.00 0.00 C ATOM 1582 CG GLN A 101 -3.780 1.441 -12.326 1.00 0.00 C ATOM 1583 CD GLN A 101 -4.129 2.901 -12.545 1.00 0.00 C ATOM 1584 OE1 GLN A 101 -3.340 3.662 -13.106 1.00 0.00 O ATOM 1585 NE2 GLN A 101 -5.316 3.299 -12.103 1.00 0.00 N ATOM 0 H GLN A 101 -2.009 0.053 -9.403 1.00 0.00 H new ATOM 0 HA GLN A 101 -2.298 2.618 -10.672 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.490 0.008 -10.764 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.766 1.167 -10.447 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.803 1.235 -12.764 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.503 0.816 -12.850 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -5.938 2.634 -11.644 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -5.606 4.270 -12.223 1.00 0.00 H new ATOM 1594 N ILE A 102 -3.701 2.042 -7.781 1.00 0.00 N ATOM 1595 CA ILE A 102 -4.401 2.664 -6.667 1.00 0.00 C ATOM 1596 C ILE A 102 -3.583 3.811 -6.088 1.00 0.00 C ATOM 1597 O ILE A 102 -4.128 4.848 -5.712 1.00 0.00 O ATOM 1598 CB ILE A 102 -4.704 1.644 -5.554 1.00 0.00 C ATOM 1599 CG1 ILE A 102 -5.377 0.403 -6.142 1.00 0.00 C ATOM 1600 CG2 ILE A 102 -5.587 2.272 -4.488 1.00 0.00 C ATOM 1601 CD1 ILE A 102 -6.740 0.684 -6.734 1.00 0.00 C ATOM 0 H ILE A 102 -3.347 1.105 -7.587 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.344 3.051 -7.054 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.764 1.343 -5.091 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -4.734 -0.019 -6.914 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.476 -0.352 -5.362 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.793 1.539 -3.708 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.077 3.131 -4.053 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.525 2.596 -4.938 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.161 -0.239 -7.133 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.399 1.078 -5.960 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.644 1.416 -7.536 1.00 0.00 H new ATOM 1613 N PHE A 103 -2.269 3.620 -6.027 1.00 0.00 N ATOM 1614 CA PHE A 103 -1.376 4.644 -5.503 1.00 0.00 C ATOM 1615 C PHE A 103 -1.424 5.889 -6.381 1.00 0.00 C ATOM 1616 O PHE A 103 -1.372 7.014 -5.884 1.00 0.00 O ATOM 1617 CB PHE A 103 0.058 4.115 -5.426 1.00 0.00 C ATOM 1618 CG PHE A 103 0.224 2.955 -4.486 1.00 0.00 C ATOM 1619 CD1 PHE A 103 -0.394 2.957 -3.245 1.00 0.00 C ATOM 1620 CD2 PHE A 103 0.998 1.863 -4.843 1.00 0.00 C ATOM 1621 CE1 PHE A 103 -0.242 1.891 -2.378 1.00 0.00 C ATOM 1622 CE2 PHE A 103 1.154 0.794 -3.980 1.00 0.00 C ATOM 1623 CZ PHE A 103 0.533 0.808 -2.747 1.00 0.00 C ATOM 0 H PHE A 103 -1.801 2.767 -6.334 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.708 4.907 -4.499 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.378 3.812 -6.423 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.718 4.924 -5.111 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -1.001 3.801 -2.952 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.485 1.846 -5.807 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.728 1.905 -1.414 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.761 -0.051 -4.270 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.653 -0.026 -2.072 1.00 0.00 H new ATOM 1633 N THR A 104 -1.524 5.676 -7.690 1.00 0.00 N ATOM 1634 CA THR A 104 -1.580 6.777 -8.645 1.00 0.00 C ATOM 1635 C THR A 104 -2.756 7.703 -8.351 1.00 0.00 C ATOM 1636 O THR A 104 -2.591 8.918 -8.257 1.00 0.00 O ATOM 1637 CB THR A 104 -1.691 6.236 -10.072 1.00 0.00 C ATOM 1638 OG1 THR A 104 -0.577 5.419 -10.387 1.00 0.00 O ATOM 1639 CG2 THR A 104 -1.772 7.325 -11.121 1.00 0.00 C ATOM 0 H THR A 104 -1.568 4.749 -8.114 1.00 0.00 H new ATOM 0 HA THR A 104 -0.658 7.351 -8.548 1.00 0.00 H new ATOM 0 HB THR A 104 -2.619 5.664 -10.092 1.00 0.00 H new ATOM 0 HG1 THR A 104 -0.671 4.552 -9.940 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.849 6.873 -12.110 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.650 7.944 -10.936 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.876 7.943 -11.074 1.00 0.00 H new ATOM 1647 N ALA A 105 -3.946 7.127 -8.212 1.00 0.00 N ATOM 1648 CA ALA A 105 -5.143 7.914 -7.937 1.00 0.00 C ATOM 1649 C ALA A 105 -4.981 8.745 -6.675 1.00 0.00 C ATOM 1650 O ALA A 105 -5.093 9.971 -6.715 1.00 0.00 O ATOM 1651 CB ALA A 105 -6.360 7.008 -7.825 1.00 0.00 C ATOM 0 H ALA A 105 -4.107 6.122 -8.285 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.291 8.600 -8.771 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.245 7.611 -7.620 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.499 6.467 -8.761 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.210 6.296 -7.014 1.00 0.00 H new ATOM 1657 N PHE A 106 -4.719 8.086 -5.554 1.00 0.00 N ATOM 1658 CA PHE A 106 -4.549 8.787 -4.292 1.00 0.00 C ATOM 1659 C PHE A 106 -3.253 9.595 -4.278 1.00 0.00 C ATOM 1660 O PHE A 106 -3.063 10.445 -3.414 1.00 0.00 O ATOM 1661 CB PHE A 106 -4.557 7.792 -3.130 1.00 0.00 C ATOM 1662 CG PHE A 106 -5.899 7.161 -2.885 1.00 0.00 C ATOM 1663 CD1 PHE A 106 -6.371 6.158 -3.717 1.00 0.00 C ATOM 1664 CD2 PHE A 106 -6.686 7.570 -1.821 1.00 0.00 C ATOM 1665 CE1 PHE A 106 -7.604 5.575 -3.491 1.00 0.00 C ATOM 1666 CE2 PHE A 106 -7.919 6.990 -1.590 1.00 0.00 C ATOM 1667 CZ PHE A 106 -8.379 5.992 -2.427 1.00 0.00 C ATOM 0 H PHE A 106 -4.620 7.073 -5.494 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.383 9.480 -4.178 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -3.827 7.007 -3.330 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.235 8.303 -2.223 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -5.769 5.828 -4.551 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.332 8.351 -1.164 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -7.961 4.794 -4.146 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -8.522 7.317 -0.756 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.343 5.539 -2.250 1.00 0.00 H new ATOM 1677 N LYS A 107 -2.359 9.329 -5.231 1.00 0.00 N ATOM 1678 CA LYS A 107 -1.085 10.045 -5.303 1.00 0.00 C ATOM 1679 C LYS A 107 -1.292 11.547 -5.106 1.00 0.00 C ATOM 1680 O LYS A 107 -0.476 12.223 -4.479 1.00 0.00 O ATOM 1681 CB LYS A 107 -0.388 9.770 -6.644 1.00 0.00 C ATOM 1682 CG LYS A 107 -0.697 10.790 -7.733 1.00 0.00 C ATOM 1683 CD LYS A 107 -0.199 10.323 -9.091 1.00 0.00 C ATOM 1684 CE LYS A 107 0.178 11.497 -9.980 1.00 0.00 C ATOM 1685 NZ LYS A 107 0.793 11.050 -11.260 1.00 0.00 N ATOM 0 H LYS A 107 -2.492 8.628 -5.959 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.446 9.681 -4.499 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.690 9.745 -6.481 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.680 8.781 -6.996 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.773 10.961 -7.778 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -0.233 11.744 -7.482 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.666 9.673 -8.959 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.972 9.729 -9.579 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -0.711 12.091 -10.192 1.00 0.00 H new ATOM 0 HE3 LYS A 107 0.875 12.145 -9.449 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 1.035 11.880 -11.837 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 1.655 10.504 -11.059 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 0.118 10.453 -11.779 1.00 0.00 H new ATOM 1699 N ASP A 108 -2.399 12.053 -5.638 1.00 0.00 N ATOM 1700 CA ASP A 108 -2.733 13.465 -5.517 1.00 0.00 C ATOM 1701 C ASP A 108 -3.522 13.728 -4.237 1.00 0.00 C ATOM 1702 O ASP A 108 -3.320 14.740 -3.566 1.00 0.00 O ATOM 1703 CB ASP A 108 -3.540 13.927 -6.732 1.00 0.00 C ATOM 1704 CG ASP A 108 -3.211 15.350 -7.138 1.00 0.00 C ATOM 1705 OD1 ASP A 108 -3.422 16.266 -6.316 1.00 0.00 O ATOM 1706 OD2 ASP A 108 -2.742 15.548 -8.279 1.00 0.00 O ATOM 0 H ASP A 108 -3.082 11.503 -6.159 1.00 0.00 H new ATOM 0 HA ASP A 108 -1.802 14.031 -5.473 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -3.344 13.258 -7.570 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -4.604 13.853 -6.507 1.00 0.00 H new ATOM 1711 N ASP A 109 -4.433 12.813 -3.915 1.00 0.00 N ATOM 1712 CA ASP A 109 -5.271 12.947 -2.723 1.00 0.00 C ATOM 1713 C ASP A 109 -4.610 12.342 -1.480 1.00 0.00 C ATOM 1714 O ASP A 109 -5.249 12.213 -0.436 1.00 0.00 O ATOM 1715 CB ASP A 109 -6.631 12.285 -2.962 1.00 0.00 C ATOM 1716 CG ASP A 109 -7.788 13.214 -2.652 1.00 0.00 C ATOM 1717 OD1 ASP A 109 -7.951 13.586 -1.471 1.00 0.00 O ATOM 1718 OD2 ASP A 109 -8.532 13.570 -3.591 1.00 0.00 O ATOM 0 H ASP A 109 -4.611 11.970 -4.462 1.00 0.00 H new ATOM 0 HA ASP A 109 -5.406 14.013 -2.538 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.697 11.961 -4.001 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.711 11.391 -2.344 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.343 11.958 -1.597 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.622 11.352 -0.480 1.00 0.00 C ATOM 1725 C VAL A 110 -2.000 12.407 0.431 1.00 0.00 C ATOM 1726 O VAL A 110 -1.800 13.553 0.027 1.00 0.00 O ATOM 1727 CB VAL A 110 -1.516 10.402 -0.982 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -0.472 11.167 -1.783 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -0.872 9.663 0.181 1.00 0.00 C ATOM 0 H VAL A 110 -2.794 12.055 -2.451 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.355 10.783 0.093 1.00 0.00 H new ATOM 0 HB VAL A 110 -1.974 9.663 -1.640 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.299 10.478 -2.128 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.947 11.639 -2.643 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.019 11.933 -1.153 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.095 8.998 -0.196 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.431 10.383 0.870 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.628 9.077 0.703 1.00 0.00 H new ATOM 1739 N ASP A 111 -1.699 12.009 1.665 1.00 0.00 N ATOM 1740 CA ASP A 111 -1.102 12.915 2.640 1.00 0.00 C ATOM 1741 C ASP A 111 0.199 12.344 3.202 1.00 0.00 C ATOM 1742 O ASP A 111 1.184 13.066 3.359 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.085 13.187 3.780 1.00 0.00 C ATOM 1744 CG ASP A 111 -1.840 14.527 4.447 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -1.010 14.583 5.379 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -2.479 15.519 4.037 1.00 0.00 O ATOM 0 H ASP A 111 -1.859 11.064 2.013 1.00 0.00 H new ATOM 0 HA ASP A 111 -0.872 13.851 2.131 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.103 13.158 3.393 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.004 12.394 4.523 1.00 0.00 H new ATOM 1751 N THR A 112 0.199 11.047 3.506 1.00 0.00 N ATOM 1752 CA THR A 112 1.386 10.393 4.052 1.00 0.00 C ATOM 1753 C THR A 112 1.919 9.331 3.096 1.00 0.00 C ATOM 1754 O THR A 112 1.188 8.824 2.244 1.00 0.00 O ATOM 1755 CB THR A 112 1.077 9.762 5.413 1.00 0.00 C ATOM 1756 OG1 THR A 112 0.584 10.736 6.316 1.00 0.00 O ATOM 1757 CG2 THR A 112 2.282 9.104 6.058 1.00 0.00 C ATOM 0 H THR A 112 -0.605 10.432 3.384 1.00 0.00 H new ATOM 0 HA THR A 112 2.154 11.156 4.181 1.00 0.00 H new ATOM 0 HB THR A 112 0.330 8.994 5.212 1.00 0.00 H new ATOM 0 HG1 THR A 112 0.391 10.314 7.179 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.993 8.678 7.019 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.656 8.313 5.408 1.00 0.00 H new ATOM 0 HG23 THR A 112 3.064 9.848 6.212 1.00 0.00 H new ATOM 1765 N LEU A 113 3.199 8.998 3.242 1.00 0.00 N ATOM 1766 CA LEU A 113 3.830 8.000 2.393 1.00 0.00 C ATOM 1767 C LEU A 113 4.759 7.098 3.204 1.00 0.00 C ATOM 1768 O LEU A 113 5.570 7.575 3.998 1.00 0.00 O ATOM 1769 CB LEU A 113 4.614 8.690 1.280 1.00 0.00 C ATOM 1770 CG LEU A 113 4.977 7.804 0.091 1.00 0.00 C ATOM 1771 CD1 LEU A 113 3.808 7.699 -0.879 1.00 0.00 C ATOM 1772 CD2 LEU A 113 6.212 8.353 -0.606 1.00 0.00 C ATOM 0 H LEU A 113 3.817 9.407 3.942 1.00 0.00 H new ATOM 0 HA LEU A 113 3.049 7.378 1.956 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.030 9.535 0.917 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.533 9.096 1.703 1.00 0.00 H new ATOM 0 HG LEU A 113 5.199 6.801 0.455 1.00 0.00 H new ATOM 0 HD11 LEU A 113 4.088 7.063 -1.719 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.948 7.266 -0.367 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.550 8.692 -1.246 1.00 0.00 H new ATOM 0 HD21 LEU A 113 6.465 7.716 -1.453 1.00 0.00 H new ATOM 0 HD22 LEU A 113 6.011 9.364 -0.960 1.00 0.00 H new ATOM 0 HD23 LEU A 113 7.047 8.373 0.095 1.00 0.00 H new ATOM 1784 N LEU A 114 4.633 5.793 2.992 1.00 0.00 N ATOM 1785 CA LEU A 114 5.456 4.811 3.691 1.00 0.00 C ATOM 1786 C LEU A 114 5.952 3.748 2.716 1.00 0.00 C ATOM 1787 O LEU A 114 5.167 2.951 2.196 1.00 0.00 O ATOM 1788 CB LEU A 114 4.660 4.155 4.821 1.00 0.00 C ATOM 1789 CG LEU A 114 4.506 5.007 6.083 1.00 0.00 C ATOM 1790 CD1 LEU A 114 3.167 4.734 6.751 1.00 0.00 C ATOM 1791 CD2 LEU A 114 5.650 4.738 7.049 1.00 0.00 C ATOM 0 H LEU A 114 3.964 5.388 2.337 1.00 0.00 H new ATOM 0 HA LEU A 114 6.316 5.324 4.121 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.667 3.903 4.447 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.146 3.217 5.091 1.00 0.00 H new ATOM 0 HG LEU A 114 4.538 6.058 5.796 1.00 0.00 H new ATOM 0 HD11 LEU A 114 3.075 5.349 7.647 1.00 0.00 H new ATOM 0 HD12 LEU A 114 2.360 4.976 6.060 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.105 3.681 7.026 1.00 0.00 H new ATOM 0 HD21 LEU A 114 5.525 5.352 7.941 1.00 0.00 H new ATOM 0 HD22 LEU A 114 5.649 3.685 7.330 1.00 0.00 H new ATOM 0 HD23 LEU A 114 6.597 4.984 6.569 1.00 0.00 H new ATOM 1803 N VAL A 115 7.254 3.750 2.452 1.00 0.00 N ATOM 1804 CA VAL A 115 7.834 2.793 1.518 1.00 0.00 C ATOM 1805 C VAL A 115 8.988 2.008 2.130 1.00 0.00 C ATOM 1806 O VAL A 115 9.711 2.506 2.992 1.00 0.00 O ATOM 1807 CB VAL A 115 8.338 3.500 0.247 1.00 0.00 C ATOM 1808 CG1 VAL A 115 7.189 4.181 -0.476 1.00 0.00 C ATOM 1809 CG2 VAL A 115 9.427 4.505 0.591 1.00 0.00 C ATOM 0 H VAL A 115 7.923 4.398 2.868 1.00 0.00 H new ATOM 0 HA VAL A 115 7.036 2.095 1.266 1.00 0.00 H new ATOM 0 HB VAL A 115 8.764 2.749 -0.419 1.00 0.00 H new ATOM 0 HG11 VAL A 115 7.565 4.675 -1.372 1.00 0.00 H new ATOM 0 HG12 VAL A 115 6.444 3.437 -0.758 1.00 0.00 H new ATOM 0 HG13 VAL A 115 6.732 4.920 0.182 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.771 4.995 -0.320 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.029 5.253 1.277 1.00 0.00 H new ATOM 0 HG23 VAL A 115 10.263 3.989 1.063 1.00 0.00 H new ATOM 1819 N THR A 116 9.159 0.779 1.654 1.00 0.00 N ATOM 1820 CA THR A 116 10.231 -0.091 2.119 1.00 0.00 C ATOM 1821 C THR A 116 11.125 -0.480 0.944 1.00 0.00 C ATOM 1822 O THR A 116 10.793 -1.381 0.174 1.00 0.00 O ATOM 1823 CB THR A 116 9.651 -1.346 2.779 1.00 0.00 C ATOM 1824 OG1 THR A 116 8.966 -1.014 3.974 1.00 0.00 O ATOM 1825 CG2 THR A 116 10.696 -2.385 3.125 1.00 0.00 C ATOM 0 H THR A 116 8.562 0.361 0.940 1.00 0.00 H new ATOM 0 HA THR A 116 10.826 0.445 2.859 1.00 0.00 H new ATOM 0 HB THR A 116 8.974 -1.770 2.038 1.00 0.00 H new ATOM 0 HG1 THR A 116 9.516 -0.403 4.508 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.214 -3.246 3.589 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.209 -2.702 2.217 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.419 -1.957 3.819 1.00 0.00 H new ATOM 1833 N ARG A 117 12.250 0.213 0.804 1.00 0.00 N ATOM 1834 CA ARG A 117 13.177 -0.055 -0.290 1.00 0.00 C ATOM 1835 C ARG A 117 14.174 -1.148 0.076 1.00 0.00 C ATOM 1836 O ARG A 117 15.098 -0.924 0.859 1.00 0.00 O ATOM 1837 CB ARG A 117 13.925 1.223 -0.673 1.00 0.00 C ATOM 1838 CG ARG A 117 13.117 2.162 -1.553 1.00 0.00 C ATOM 1839 CD ARG A 117 13.719 3.557 -1.579 1.00 0.00 C ATOM 1840 NE ARG A 117 15.163 3.527 -1.798 1.00 0.00 N ATOM 1841 CZ ARG A 117 15.978 4.540 -1.515 1.00 0.00 C ATOM 1842 NH1 ARG A 117 15.496 5.666 -1.003 1.00 0.00 N ATOM 1843 NH2 ARG A 117 17.279 4.429 -1.745 1.00 0.00 N ATOM 0 H ARG A 117 12.542 0.962 1.432 1.00 0.00 H new ATOM 0 HA ARG A 117 12.592 -0.403 -1.142 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.215 1.750 0.236 1.00 0.00 H new ATOM 0 HB3 ARG A 117 14.845 0.954 -1.192 1.00 0.00 H new ATOM 0 HG2 ARG A 117 13.073 1.765 -2.567 1.00 0.00 H new ATOM 0 HG3 ARG A 117 12.092 2.214 -1.186 1.00 0.00 H new ATOM 0 HD2 ARG A 117 13.245 4.142 -2.368 1.00 0.00 H new ATOM 0 HD3 ARG A 117 13.506 4.061 -0.636 1.00 0.00 H new ATOM 0 HE ARG A 117 15.571 2.679 -2.191 1.00 0.00 H new ATOM 0 HH11 ARG A 117 14.496 5.758 -0.824 1.00 0.00 H new ATOM 0 HH12 ARG A 117 16.126 6.439 -0.788 1.00 0.00 H new ATOM 0 HH21 ARG A 117 17.655 3.567 -2.139 1.00 0.00 H new ATOM 0 HH22 ARG A 117 17.903 5.206 -1.528 1.00 0.00 H new ATOM 1857 N LEU A 118 13.982 -2.330 -0.501 1.00 0.00 N ATOM 1858 CA LEU A 118 14.865 -3.461 -0.245 1.00 0.00 C ATOM 1859 C LEU A 118 16.276 -3.167 -0.747 1.00 0.00 C ATOM 1860 O LEU A 118 16.490 -2.223 -1.508 1.00 0.00 O ATOM 1861 CB LEU A 118 14.323 -4.720 -0.927 1.00 0.00 C ATOM 1862 CG LEU A 118 13.453 -5.615 -0.045 1.00 0.00 C ATOM 1863 CD1 LEU A 118 12.056 -5.029 0.098 1.00 0.00 C ATOM 1864 CD2 LEU A 118 13.388 -7.025 -0.614 1.00 0.00 C ATOM 0 H LEU A 118 13.221 -2.529 -1.150 1.00 0.00 H new ATOM 0 HA LEU A 118 14.905 -3.627 0.832 1.00 0.00 H new ATOM 0 HB2 LEU A 118 13.741 -4.420 -1.798 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.165 -5.307 -1.293 1.00 0.00 H new ATOM 0 HG LEU A 118 13.905 -5.666 0.945 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.451 -5.680 0.729 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.121 -4.041 0.553 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.594 -4.946 -0.886 1.00 0.00 H new ATOM 0 HD21 LEU A 118 12.764 -7.648 0.027 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.960 -6.994 -1.616 1.00 0.00 H new ATOM 0 HD23 LEU A 118 14.393 -7.445 -0.661 1.00 0.00 H new ATOM 1876 N ALA A 119 17.233 -3.982 -0.319 1.00 0.00 N ATOM 1877 CA ALA A 119 18.621 -3.810 -0.729 1.00 0.00 C ATOM 1878 C ALA A 119 18.903 -4.575 -2.015 1.00 0.00 C ATOM 1879 O ALA A 119 19.534 -4.055 -2.935 1.00 0.00 O ATOM 1880 CB ALA A 119 19.559 -4.270 0.377 1.00 0.00 C ATOM 0 H ALA A 119 17.073 -4.768 0.311 1.00 0.00 H new ATOM 0 HA ALA A 119 18.794 -2.750 -0.917 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.592 -4.136 0.057 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.378 -3.681 1.276 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.380 -5.324 0.592 1.00 0.00 H new ATOM 1886 N GLY A 120 18.432 -5.816 -2.070 1.00 0.00 N ATOM 1887 CA GLY A 120 18.643 -6.637 -3.244 1.00 0.00 C ATOM 1888 C GLY A 120 18.030 -6.036 -4.493 1.00 0.00 C ATOM 1889 O GLY A 120 17.030 -5.319 -4.423 1.00 0.00 O ATOM 0 H GLY A 120 17.907 -6.267 -1.321 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.713 -6.775 -3.399 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.216 -7.625 -3.073 1.00 0.00 H new ATOM 1893 N SER A 121 18.631 -6.331 -5.639 1.00 0.00 N ATOM 1894 CA SER A 121 18.142 -5.821 -6.914 1.00 0.00 C ATOM 1895 C SER A 121 17.279 -6.863 -7.616 1.00 0.00 C ATOM 1896 O SER A 121 17.767 -7.919 -8.019 1.00 0.00 O ATOM 1897 CB SER A 121 19.315 -5.422 -7.809 1.00 0.00 C ATOM 1898 OG SER A 121 19.814 -6.536 -8.529 1.00 0.00 O ATOM 0 H SER A 121 19.459 -6.922 -5.712 1.00 0.00 H new ATOM 0 HA SER A 121 17.530 -4.940 -6.719 1.00 0.00 H new ATOM 0 HB2 SER A 121 18.996 -4.648 -8.507 1.00 0.00 H new ATOM 0 HB3 SER A 121 20.111 -4.993 -7.200 1.00 0.00 H new ATOM 0 HG SER A 121 19.385 -7.355 -8.204 1.00 0.00 H new ATOM 1904 N PHE A 122 15.993 -6.561 -7.754 1.00 0.00 N ATOM 1905 CA PHE A 122 15.059 -7.473 -8.403 1.00 0.00 C ATOM 1906 C PHE A 122 14.472 -6.850 -9.665 1.00 0.00 C ATOM 1907 O PHE A 122 14.549 -5.638 -9.865 1.00 0.00 O ATOM 1908 CB PHE A 122 13.934 -7.854 -7.439 1.00 0.00 C ATOM 1909 CG PHE A 122 14.420 -8.522 -6.185 1.00 0.00 C ATOM 1910 CD1 PHE A 122 15.149 -7.813 -5.244 1.00 0.00 C ATOM 1911 CD2 PHE A 122 14.147 -9.860 -5.946 1.00 0.00 C ATOM 1912 CE1 PHE A 122 15.598 -8.425 -4.089 1.00 0.00 C ATOM 1913 CE2 PHE A 122 14.593 -10.477 -4.793 1.00 0.00 C ATOM 1914 CZ PHE A 122 15.319 -9.759 -3.863 1.00 0.00 C ATOM 0 H PHE A 122 15.573 -5.691 -7.425 1.00 0.00 H new ATOM 0 HA PHE A 122 15.608 -8.371 -8.686 1.00 0.00 H new ATOM 0 HB2 PHE A 122 13.377 -6.956 -7.171 1.00 0.00 H new ATOM 0 HB3 PHE A 122 13.239 -8.520 -7.950 1.00 0.00 H new ATOM 0 HD1 PHE A 122 15.369 -6.770 -5.415 1.00 0.00 H new ATOM 0 HD2 PHE A 122 13.579 -10.427 -6.669 1.00 0.00 H new ATOM 0 HE1 PHE A 122 16.166 -7.861 -3.364 1.00 0.00 H new ATOM 0 HE2 PHE A 122 14.374 -11.520 -4.619 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.668 -10.239 -2.961 1.00 0.00 H new ATOM 1924 N GLU A 123 13.883 -7.688 -10.511 1.00 0.00 N ATOM 1925 CA GLU A 123 13.279 -7.222 -11.753 1.00 0.00 C ATOM 1926 C GLU A 123 11.900 -7.841 -11.948 1.00 0.00 C ATOM 1927 O GLU A 123 11.697 -9.026 -11.683 1.00 0.00 O ATOM 1928 CB GLU A 123 14.179 -7.563 -12.943 1.00 0.00 C ATOM 1929 CG GLU A 123 14.417 -9.055 -13.117 1.00 0.00 C ATOM 1930 CD GLU A 123 15.888 -9.401 -13.239 1.00 0.00 C ATOM 1931 OE1 GLU A 123 16.717 -8.698 -12.623 1.00 0.00 O ATOM 1932 OE2 GLU A 123 16.212 -10.374 -13.952 1.00 0.00 O ATOM 0 H GLU A 123 13.811 -8.694 -10.359 1.00 0.00 H new ATOM 0 HA GLU A 123 13.168 -6.139 -11.692 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.730 -7.166 -13.853 1.00 0.00 H new ATOM 0 HB3 GLU A 123 15.139 -7.062 -12.817 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.991 -9.588 -12.267 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.891 -9.402 -14.007 1.00 0.00 H new ATOM 1939 N GLY A 124 10.954 -7.032 -12.413 1.00 0.00 N ATOM 1940 CA GLY A 124 9.606 -7.518 -12.635 1.00 0.00 C ATOM 1941 C GLY A 124 8.900 -6.777 -13.753 1.00 0.00 C ATOM 1942 O GLY A 124 9.477 -6.548 -14.816 1.00 0.00 O ATOM 0 H GLY A 124 11.097 -6.048 -12.640 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.641 -8.581 -12.873 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.030 -7.416 -11.715 1.00 0.00 H new ATOM 1946 N ASP A 125 7.649 -6.401 -13.513 1.00 0.00 N ATOM 1947 CA ASP A 125 6.865 -5.681 -14.510 1.00 0.00 C ATOM 1948 C ASP A 125 5.899 -4.700 -13.849 1.00 0.00 C ATOM 1949 O ASP A 125 4.894 -4.312 -14.445 1.00 0.00 O ATOM 1950 CB ASP A 125 6.091 -6.667 -15.387 1.00 0.00 C ATOM 1951 CG ASP A 125 6.181 -6.324 -16.861 1.00 0.00 C ATOM 1952 OD1 ASP A 125 5.565 -5.320 -17.276 1.00 0.00 O ATOM 1953 OD2 ASP A 125 6.869 -7.059 -17.600 1.00 0.00 O ATOM 0 H ASP A 125 7.156 -6.582 -12.638 1.00 0.00 H new ATOM 0 HA ASP A 125 7.555 -5.112 -15.133 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.478 -7.673 -15.227 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.045 -6.676 -15.082 1.00 0.00 H new ATOM 1958 N THR A 126 6.207 -4.301 -12.618 1.00 0.00 N ATOM 1959 CA THR A 126 5.359 -3.365 -11.889 1.00 0.00 C ATOM 1960 C THR A 126 6.185 -2.487 -10.954 1.00 0.00 C ATOM 1961 O THR A 126 6.631 -2.935 -9.896 1.00 0.00 O ATOM 1962 CB THR A 126 4.298 -4.123 -11.090 1.00 0.00 C ATOM 1963 OG1 THR A 126 3.529 -4.955 -11.941 1.00 0.00 O ATOM 1964 CG2 THR A 126 3.342 -3.213 -10.351 1.00 0.00 C ATOM 0 H THR A 126 7.034 -4.610 -12.107 1.00 0.00 H new ATOM 0 HA THR A 126 4.867 -2.721 -12.618 1.00 0.00 H new ATOM 0 HB THR A 126 4.852 -4.711 -10.359 1.00 0.00 H new ATOM 0 HG1 THR A 126 3.222 -5.740 -11.441 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.616 -3.815 -9.805 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.899 -2.592 -9.650 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.821 -2.575 -11.065 1.00 0.00 H new ATOM 1972 N LYS A 127 6.377 -1.232 -11.351 1.00 0.00 N ATOM 1973 CA LYS A 127 7.143 -0.279 -10.554 1.00 0.00 C ATOM 1974 C LYS A 127 6.237 0.829 -10.023 1.00 0.00 C ATOM 1975 O LYS A 127 5.105 0.989 -10.480 1.00 0.00 O ATOM 1976 CB LYS A 127 8.270 0.326 -11.393 1.00 0.00 C ATOM 1977 CG LYS A 127 9.494 -0.570 -11.504 1.00 0.00 C ATOM 1978 CD LYS A 127 9.893 -0.797 -12.954 1.00 0.00 C ATOM 1979 CE LYS A 127 11.221 -1.529 -13.059 1.00 0.00 C ATOM 1980 NZ LYS A 127 12.043 -1.028 -14.195 1.00 0.00 N ATOM 0 H LYS A 127 6.011 -0.850 -12.223 1.00 0.00 H new ATOM 0 HA LYS A 127 7.576 -0.810 -9.707 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.893 0.538 -12.394 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.566 1.279 -10.955 1.00 0.00 H new ATOM 0 HG2 LYS A 127 10.326 -0.119 -10.964 1.00 0.00 H new ATOM 0 HG3 LYS A 127 9.288 -1.529 -11.029 1.00 0.00 H new ATOM 0 HD2 LYS A 127 9.118 -1.373 -13.460 1.00 0.00 H new ATOM 0 HD3 LYS A 127 9.963 0.162 -13.467 1.00 0.00 H new ATOM 0 HE2 LYS A 127 11.776 -1.409 -12.129 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.038 -2.596 -13.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 12.940 -1.553 -14.232 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 11.524 -1.165 -15.086 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 12.239 -0.015 -14.061 1.00 0.00 H new ATOM 1994 N MET A 128 6.739 1.588 -9.055 1.00 0.00 N ATOM 1995 CA MET A 128 5.969 2.677 -8.463 1.00 0.00 C ATOM 1996 C MET A 128 5.630 3.742 -9.504 1.00 0.00 C ATOM 1997 O MET A 128 6.220 3.780 -10.584 1.00 0.00 O ATOM 1998 CB MET A 128 6.744 3.306 -7.303 1.00 0.00 C ATOM 1999 CG MET A 128 5.918 4.270 -6.465 1.00 0.00 C ATOM 2000 SD MET A 128 4.391 3.530 -5.851 1.00 0.00 S ATOM 2001 CE MET A 128 3.535 4.979 -5.238 1.00 0.00 C ATOM 0 H MET A 128 7.674 1.470 -8.664 1.00 0.00 H new ATOM 0 HA MET A 128 5.035 2.261 -8.085 1.00 0.00 H new ATOM 0 HB2 MET A 128 7.124 2.513 -6.659 1.00 0.00 H new ATOM 0 HB3 MET A 128 7.610 3.835 -7.701 1.00 0.00 H new ATOM 0 HG2 MET A 128 6.515 4.614 -5.620 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.676 5.149 -7.063 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.841 4.686 -4.450 1.00 0.00 H new ATOM 0 HE2 MET A 128 4.260 5.688 -4.837 1.00 0.00 H new ATOM 0 HE3 MET A 128 2.982 5.447 -6.053 1.00 0.00 H new ATOM 2011 N ILE A 129 4.672 4.602 -9.170 1.00 0.00 N ATOM 2012 CA ILE A 129 4.245 5.668 -10.071 1.00 0.00 C ATOM 2013 C ILE A 129 4.780 7.027 -9.620 1.00 0.00 C ATOM 2014 O ILE A 129 5.131 7.209 -8.454 1.00 0.00 O ATOM 2015 CB ILE A 129 2.707 5.738 -10.168 1.00 0.00 C ATOM 2016 CG1 ILE A 129 2.090 6.006 -8.791 1.00 0.00 C ATOM 2017 CG2 ILE A 129 2.154 4.447 -10.756 1.00 0.00 C ATOM 2018 CD1 ILE A 129 1.979 7.475 -8.452 1.00 0.00 C ATOM 0 H ILE A 129 4.175 4.581 -8.279 1.00 0.00 H new ATOM 0 HA ILE A 129 4.655 5.432 -11.053 1.00 0.00 H new ATOM 0 HB ILE A 129 2.441 6.563 -10.829 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.097 5.557 -8.754 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.693 5.511 -8.030 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.068 4.512 -10.818 1.00 0.00 H new ATOM 0 HG22 ILE A 129 2.566 4.296 -11.754 1.00 0.00 H new ATOM 0 HG23 ILE A 129 2.432 3.608 -10.118 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.534 7.588 -7.463 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.972 7.925 -8.456 1.00 0.00 H new ATOM 0 HD13 ILE A 129 1.352 7.973 -9.191 1.00 0.00 H new ATOM 2030 N PRO A 130 4.848 8.003 -10.544 1.00 0.00 N ATOM 2031 CA PRO A 130 5.343 9.352 -10.240 1.00 0.00 C ATOM 2032 C PRO A 130 4.592 9.997 -9.079 1.00 0.00 C ATOM 2033 O PRO A 130 3.401 9.756 -8.889 1.00 0.00 O ATOM 2034 CB PRO A 130 5.090 10.129 -11.535 1.00 0.00 C ATOM 2035 CG PRO A 130 5.039 9.090 -12.601 1.00 0.00 C ATOM 2036 CD PRO A 130 4.449 7.868 -11.957 1.00 0.00 C ATOM 0 HA PRO A 130 6.389 9.340 -9.933 1.00 0.00 H new ATOM 0 HB2 PRO A 130 4.156 10.689 -11.484 1.00 0.00 H new ATOM 0 HB3 PRO A 130 5.884 10.851 -11.724 1.00 0.00 H new ATOM 0 HG2 PRO A 130 4.429 9.422 -13.441 1.00 0.00 H new ATOM 0 HG3 PRO A 130 6.035 8.883 -12.993 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.365 7.839 -12.068 1.00 0.00 H new ATOM 0 HD3 PRO A 130 4.840 6.952 -12.400 1.00 0.00 H new ATOM 2044 N LEU A 131 5.297 10.814 -8.301 1.00 0.00 N ATOM 2045 CA LEU A 131 4.690 11.485 -7.155 1.00 0.00 C ATOM 2046 C LEU A 131 5.224 12.906 -7.003 1.00 0.00 C ATOM 2047 O LEU A 131 6.367 13.192 -7.357 1.00 0.00 O ATOM 2048 CB LEU A 131 4.959 10.701 -5.861 1.00 0.00 C ATOM 2049 CG LEU A 131 5.302 9.216 -6.035 1.00 0.00 C ATOM 2050 CD1 LEU A 131 6.395 8.804 -5.060 1.00 0.00 C ATOM 2051 CD2 LEU A 131 4.062 8.357 -5.838 1.00 0.00 C ATOM 0 H LEU A 131 6.285 11.027 -8.442 1.00 0.00 H new ATOM 0 HA LEU A 131 3.616 11.529 -7.334 1.00 0.00 H new ATOM 0 HB2 LEU A 131 5.780 11.184 -5.331 1.00 0.00 H new ATOM 0 HB3 LEU A 131 4.079 10.778 -5.223 1.00 0.00 H new ATOM 0 HG LEU A 131 5.670 9.064 -7.050 1.00 0.00 H new ATOM 0 HD11 LEU A 131 6.626 7.748 -5.197 1.00 0.00 H new ATOM 0 HD12 LEU A 131 7.290 9.398 -5.245 1.00 0.00 H new ATOM 0 HD13 LEU A 131 6.053 8.971 -4.039 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.323 7.306 -5.965 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.666 8.514 -4.835 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.307 8.634 -6.573 1.00 0.00 H new ATOM 2063 N ASN A 132 4.394 13.789 -6.453 1.00 0.00 N ATOM 2064 CA ASN A 132 4.793 15.173 -6.230 1.00 0.00 C ATOM 2065 C ASN A 132 5.673 15.258 -4.987 1.00 0.00 C ATOM 2066 O ASN A 132 5.220 15.654 -3.913 1.00 0.00 O ATOM 2067 CB ASN A 132 3.560 16.068 -6.074 1.00 0.00 C ATOM 2068 CG ASN A 132 3.637 17.313 -6.937 1.00 0.00 C ATOM 2069 OD1 ASN A 132 3.377 17.266 -8.139 1.00 0.00 O ATOM 2070 ND2 ASN A 132 3.997 18.435 -6.325 1.00 0.00 N ATOM 0 H ASN A 132 3.444 13.570 -6.155 1.00 0.00 H new ATOM 0 HA ASN A 132 5.360 15.523 -7.093 1.00 0.00 H new ATOM 0 HB2 ASN A 132 2.667 15.501 -6.338 1.00 0.00 H new ATOM 0 HB3 ASN A 132 3.456 16.359 -5.029 1.00 0.00 H new ATOM 0 HD21 ASN A 132 4.067 19.304 -6.854 1.00 0.00 H new ATOM 0 HD22 ASN A 132 4.203 18.427 -5.326 1.00 0.00 H new ATOM 2077 N TRP A 133 6.927 14.855 -5.143 1.00 0.00 N ATOM 2078 CA TRP A 133 7.880 14.849 -4.040 1.00 0.00 C ATOM 2079 C TRP A 133 8.008 16.220 -3.380 1.00 0.00 C ATOM 2080 O TRP A 133 8.110 16.312 -2.157 1.00 0.00 O ATOM 2081 CB TRP A 133 9.243 14.362 -4.531 1.00 0.00 C ATOM 2082 CG TRP A 133 9.194 12.973 -5.093 1.00 0.00 C ATOM 2083 CD1 TRP A 133 8.861 12.617 -6.368 1.00 0.00 C ATOM 2084 CD2 TRP A 133 9.474 11.753 -4.396 1.00 0.00 C ATOM 2085 NE1 TRP A 133 8.917 11.251 -6.507 1.00 0.00 N ATOM 2086 CE2 TRP A 133 9.294 10.699 -5.311 1.00 0.00 C ATOM 2087 CE3 TRP A 133 9.863 11.449 -3.087 1.00 0.00 C ATOM 2088 CZ2 TRP A 133 9.488 9.365 -4.960 1.00 0.00 C ATOM 2089 CZ3 TRP A 133 10.055 10.125 -2.740 1.00 0.00 C ATOM 2090 CH2 TRP A 133 9.868 9.098 -3.673 1.00 0.00 C ATOM 0 H TRP A 133 7.310 14.526 -6.029 1.00 0.00 H new ATOM 0 HA TRP A 133 7.502 14.164 -3.281 1.00 0.00 H new ATOM 0 HB2 TRP A 133 9.615 15.045 -5.294 1.00 0.00 H new ATOM 0 HB3 TRP A 133 9.953 14.390 -3.705 1.00 0.00 H new ATOM 0 HD1 TRP A 133 8.593 13.308 -7.153 1.00 0.00 H new ATOM 0 HE1 TRP A 133 8.711 10.733 -7.361 1.00 0.00 H new ATOM 0 HE3 TRP A 133 10.011 12.235 -2.361 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 9.344 8.571 -5.677 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 10.354 9.878 -1.732 1.00 0.00 H new ATOM 0 HH2 TRP A 133 10.027 8.074 -3.370 1.00 0.00 H new ATOM 2101 N ASP A 134 8.007 17.286 -4.177 1.00 0.00 N ATOM 2102 CA ASP A 134 8.127 18.636 -3.634 1.00 0.00 C ATOM 2103 C ASP A 134 7.014 18.925 -2.631 1.00 0.00 C ATOM 2104 O ASP A 134 7.254 19.515 -1.577 1.00 0.00 O ATOM 2105 CB ASP A 134 8.090 19.667 -4.764 1.00 0.00 C ATOM 2106 CG ASP A 134 9.192 19.449 -5.782 1.00 0.00 C ATOM 2107 OD1 ASP A 134 10.307 19.060 -5.375 1.00 0.00 O ATOM 2108 OD2 ASP A 134 8.940 19.667 -6.985 1.00 0.00 O ATOM 0 H ASP A 134 7.925 17.242 -5.193 1.00 0.00 H new ATOM 0 HA ASP A 134 9.083 18.706 -3.116 1.00 0.00 H new ATOM 0 HB2 ASP A 134 7.123 19.619 -5.264 1.00 0.00 H new ATOM 0 HB3 ASP A 134 8.182 20.668 -4.342 1.00 0.00 H new ATOM 2113 N ASP A 135 5.796 18.512 -2.969 1.00 0.00 N ATOM 2114 CA ASP A 135 4.645 18.735 -2.100 1.00 0.00 C ATOM 2115 C ASP A 135 4.678 17.819 -0.875 1.00 0.00 C ATOM 2116 O ASP A 135 3.810 17.906 -0.006 1.00 0.00 O ATOM 2117 CB ASP A 135 3.347 18.512 -2.877 1.00 0.00 C ATOM 2118 CG ASP A 135 2.876 19.766 -3.588 1.00 0.00 C ATOM 2119 OD1 ASP A 135 3.733 20.504 -4.120 1.00 0.00 O ATOM 2120 OD2 ASP A 135 1.652 20.010 -3.614 1.00 0.00 O ATOM 0 H ASP A 135 5.581 18.022 -3.837 1.00 0.00 H new ATOM 0 HA ASP A 135 4.689 19.767 -1.752 1.00 0.00 H new ATOM 0 HB2 ASP A 135 3.496 17.717 -3.608 1.00 0.00 H new ATOM 0 HB3 ASP A 135 2.570 18.173 -2.192 1.00 0.00 H new ATOM 2125 N PHE A 136 5.682 16.949 -0.802 1.00 0.00 N ATOM 2126 CA PHE A 136 5.814 16.035 0.325 1.00 0.00 C ATOM 2127 C PHE A 136 7.174 16.196 0.994 1.00 0.00 C ATOM 2128 O PHE A 136 8.207 16.244 0.325 1.00 0.00 O ATOM 2129 CB PHE A 136 5.631 14.588 -0.137 1.00 0.00 C ATOM 2130 CG PHE A 136 4.264 14.302 -0.690 1.00 0.00 C ATOM 2131 CD1 PHE A 136 3.141 14.416 0.113 1.00 0.00 C ATOM 2132 CD2 PHE A 136 4.104 13.920 -2.012 1.00 0.00 C ATOM 2133 CE1 PHE A 136 1.882 14.154 -0.394 1.00 0.00 C ATOM 2134 CE2 PHE A 136 2.848 13.657 -2.524 1.00 0.00 C ATOM 2135 CZ PHE A 136 1.735 13.774 -1.714 1.00 0.00 C ATOM 0 H PHE A 136 6.413 16.859 -1.508 1.00 0.00 H new ATOM 0 HA PHE A 136 5.037 16.277 1.050 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.377 14.362 -0.899 1.00 0.00 H new ATOM 0 HB3 PHE A 136 5.821 13.920 0.703 1.00 0.00 H new ATOM 0 HD1 PHE A 136 3.250 14.713 1.146 1.00 0.00 H new ATOM 0 HD2 PHE A 136 4.971 13.827 -2.650 1.00 0.00 H new ATOM 0 HE1 PHE A 136 1.014 14.246 0.242 1.00 0.00 H new ATOM 0 HE2 PHE A 136 2.736 13.360 -3.556 1.00 0.00 H new ATOM 0 HZ PHE A 136 0.752 13.569 -2.112 1.00 0.00 H new ATOM 2145 N THR A 137 7.163 16.288 2.318 1.00 0.00 N ATOM 2146 CA THR A 137 8.392 16.457 3.082 1.00 0.00 C ATOM 2147 C THR A 137 8.657 15.240 3.962 1.00 0.00 C ATOM 2148 O THR A 137 7.784 14.799 4.710 1.00 0.00 O ATOM 2149 CB THR A 137 8.305 17.721 3.943 1.00 0.00 C ATOM 2150 OG1 THR A 137 8.319 18.881 3.130 1.00 0.00 O ATOM 2151 CG2 THR A 137 9.434 17.850 4.945 1.00 0.00 C ATOM 0 H THR A 137 6.316 16.248 2.885 1.00 0.00 H new ATOM 0 HA THR A 137 9.221 16.558 2.381 1.00 0.00 H new ATOM 0 HB THR A 137 7.367 17.630 4.491 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.580 19.656 3.670 1.00 0.00 H new ATOM 0 HG21 THR A 137 9.308 18.768 5.519 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.421 16.995 5.620 1.00 0.00 H new ATOM 0 HG23 THR A 137 10.387 17.881 4.417 1.00 0.00 H new ATOM 2159 N LYS A 138 9.871 14.705 3.869 1.00 0.00 N ATOM 2160 CA LYS A 138 10.250 13.545 4.659 1.00 0.00 C ATOM 2161 C LYS A 138 10.128 13.844 6.143 1.00 0.00 C ATOM 2162 O LYS A 138 10.900 14.628 6.696 1.00 0.00 O ATOM 2163 CB LYS A 138 11.672 13.107 4.334 1.00 0.00 C ATOM 2164 CG LYS A 138 11.979 11.705 4.825 1.00 0.00 C ATOM 2165 CD LYS A 138 12.390 10.789 3.687 1.00 0.00 C ATOM 2166 CE LYS A 138 13.842 11.006 3.290 1.00 0.00 C ATOM 2167 NZ LYS A 138 13.962 11.818 2.048 1.00 0.00 N ATOM 0 H LYS A 138 10.605 15.057 3.255 1.00 0.00 H new ATOM 0 HA LYS A 138 9.569 12.732 4.406 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.824 13.151 3.256 1.00 0.00 H new ATOM 0 HB3 LYS A 138 12.375 13.807 4.784 1.00 0.00 H new ATOM 0 HG2 LYS A 138 12.777 11.746 5.566 1.00 0.00 H new ATOM 0 HG3 LYS A 138 11.102 11.294 5.324 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.245 9.750 3.985 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.746 10.967 2.826 1.00 0.00 H new ATOM 0 HE2 LYS A 138 14.370 11.505 4.103 1.00 0.00 H new ATOM 0 HE3 LYS A 138 14.326 10.041 3.141 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 14.815 11.531 1.526 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 13.124 11.666 1.452 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 14.032 12.825 2.297 1.00 0.00 H new ATOM 2181 N VAL A 139 9.155 13.215 6.783 1.00 0.00 N ATOM 2182 CA VAL A 139 8.934 13.416 8.206 1.00 0.00 C ATOM 2183 C VAL A 139 9.753 12.431 9.026 1.00 0.00 C ATOM 2184 O VAL A 139 10.177 12.742 10.139 1.00 0.00 O ATOM 2185 CB VAL A 139 7.445 13.285 8.587 1.00 0.00 C ATOM 2186 CG1 VAL A 139 6.712 14.590 8.318 1.00 0.00 C ATOM 2187 CG2 VAL A 139 6.788 12.134 7.840 1.00 0.00 C ATOM 0 H VAL A 139 8.507 12.563 6.341 1.00 0.00 H new ATOM 0 HA VAL A 139 9.255 14.433 8.431 1.00 0.00 H new ATOM 0 HB VAL A 139 7.385 13.068 9.653 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.663 14.481 8.592 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.161 15.388 8.910 1.00 0.00 H new ATOM 0 HG13 VAL A 139 6.787 14.838 7.259 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.739 12.065 8.128 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.859 12.309 6.767 1.00 0.00 H new ATOM 0 HG23 VAL A 139 7.295 11.202 8.090 1.00 0.00 H new ATOM 2197 N SER A 140 9.979 11.240 8.476 1.00 0.00 N ATOM 2198 CA SER A 140 10.756 10.227 9.183 1.00 0.00 C ATOM 2199 C SER A 140 11.566 9.374 8.212 1.00 0.00 C ATOM 2200 O SER A 140 11.182 9.193 7.058 1.00 0.00 O ATOM 2201 CB SER A 140 9.834 9.338 10.022 1.00 0.00 C ATOM 2202 OG SER A 140 9.999 9.598 11.406 1.00 0.00 O ATOM 0 H SER A 140 9.641 10.956 7.557 1.00 0.00 H new ATOM 0 HA SER A 140 11.453 10.742 9.845 1.00 0.00 H new ATOM 0 HB2 SER A 140 8.797 9.512 9.737 1.00 0.00 H new ATOM 0 HB3 SER A 140 10.049 8.289 9.817 1.00 0.00 H new ATOM 0 HG SER A 140 9.399 9.020 11.921 1.00 0.00 H new ATOM 2208 N SER A 141 12.691 8.854 8.692 1.00 0.00 N ATOM 2209 CA SER A 141 13.559 8.019 7.871 1.00 0.00 C ATOM 2210 C SER A 141 14.412 7.102 8.741 1.00 0.00 C ATOM 2211 O SER A 141 15.138 7.563 9.621 1.00 0.00 O ATOM 2212 CB SER A 141 14.460 8.892 6.994 1.00 0.00 C ATOM 2213 OG SER A 141 15.157 8.109 6.040 1.00 0.00 O ATOM 0 H SER A 141 13.023 8.997 9.646 1.00 0.00 H new ATOM 0 HA SER A 141 12.929 7.401 7.231 1.00 0.00 H new ATOM 0 HB2 SER A 141 13.858 9.643 6.483 1.00 0.00 H new ATOM 0 HB3 SER A 141 15.173 9.428 7.620 1.00 0.00 H new ATOM 0 HG SER A 141 15.724 8.690 5.491 1.00 0.00 H new ATOM 2219 N ARG A 142 14.318 5.801 8.487 1.00 0.00 N ATOM 2220 CA ARG A 142 15.081 4.815 9.244 1.00 0.00 C ATOM 2221 C ARG A 142 15.569 3.695 8.333 1.00 0.00 C ATOM 2222 O ARG A 142 14.858 3.269 7.423 1.00 0.00 O ATOM 2223 CB ARG A 142 14.228 4.236 10.375 1.00 0.00 C ATOM 2224 CG ARG A 142 15.046 3.678 11.529 1.00 0.00 C ATOM 2225 CD ARG A 142 14.622 4.281 12.859 1.00 0.00 C ATOM 2226 NE ARG A 142 13.282 3.853 13.253 1.00 0.00 N ATOM 2227 CZ ARG A 142 13.014 2.675 13.812 1.00 0.00 C ATOM 2228 NH1 ARG A 142 13.989 1.806 14.046 1.00 0.00 N ATOM 2229 NH2 ARG A 142 11.767 2.365 14.138 1.00 0.00 N ATOM 0 H ARG A 142 13.720 5.404 7.762 1.00 0.00 H new ATOM 0 HA ARG A 142 15.949 5.314 9.675 1.00 0.00 H new ATOM 0 HB2 ARG A 142 13.565 5.014 10.753 1.00 0.00 H new ATOM 0 HB3 ARG A 142 13.595 3.445 9.973 1.00 0.00 H new ATOM 0 HG2 ARG A 142 14.931 2.595 11.567 1.00 0.00 H new ATOM 0 HG3 ARG A 142 16.103 3.880 11.358 1.00 0.00 H new ATOM 0 HD2 ARG A 142 15.336 3.994 13.631 1.00 0.00 H new ATOM 0 HD3 ARG A 142 14.649 5.368 12.789 1.00 0.00 H new ATOM 0 HE ARG A 142 12.506 4.495 13.090 1.00 0.00 H new ATOM 0 HH11 ARG A 142 14.950 2.039 13.797 1.00 0.00 H new ATOM 0 HH12 ARG A 142 13.777 0.905 14.475 1.00 0.00 H new ATOM 0 HH21 ARG A 142 11.013 3.029 13.960 1.00 0.00 H new ATOM 0 HH22 ARG A 142 11.561 1.462 14.566 1.00 0.00 H new ATOM 2243 N THR A 143 16.787 3.224 8.577 1.00 0.00 N ATOM 2244 CA THR A 143 17.365 2.155 7.771 1.00 0.00 C ATOM 2245 C THR A 143 17.469 0.858 8.566 1.00 0.00 C ATOM 2246 O THR A 143 18.342 0.710 9.422 1.00 0.00 O ATOM 2247 CB THR A 143 18.748 2.563 7.260 1.00 0.00 C ATOM 2248 OG1 THR A 143 18.696 3.830 6.630 1.00 0.00 O ATOM 2249 CG2 THR A 143 19.332 1.580 6.269 1.00 0.00 C ATOM 0 H THR A 143 17.392 3.565 9.324 1.00 0.00 H new ATOM 0 HA THR A 143 16.704 1.984 6.921 1.00 0.00 H new ATOM 0 HB THR A 143 19.387 2.588 8.142 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.590 4.074 6.312 1.00 0.00 H new ATOM 0 HG21 THR A 143 20.313 1.928 5.946 1.00 0.00 H new ATOM 0 HG22 THR A 143 19.431 0.603 6.741 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.673 1.500 5.405 1.00 0.00 H new ATOM 2257 N VAL A 144 16.579 -0.081 8.270 1.00 0.00 N ATOM 2258 CA VAL A 144 16.573 -1.372 8.947 1.00 0.00 C ATOM 2259 C VAL A 144 17.265 -2.429 8.095 1.00 0.00 C ATOM 2260 O VAL A 144 16.960 -2.583 6.913 1.00 0.00 O ATOM 2261 CB VAL A 144 15.139 -1.837 9.262 1.00 0.00 C ATOM 2262 CG1 VAL A 144 15.160 -3.086 10.129 1.00 0.00 C ATOM 2263 CG2 VAL A 144 14.352 -0.723 9.937 1.00 0.00 C ATOM 0 H VAL A 144 15.851 0.028 7.564 1.00 0.00 H new ATOM 0 HA VAL A 144 17.114 -1.246 9.885 1.00 0.00 H new ATOM 0 HB VAL A 144 14.643 -2.084 8.323 1.00 0.00 H new ATOM 0 HG11 VAL A 144 14.138 -3.399 10.341 1.00 0.00 H new ATOM 0 HG12 VAL A 144 15.683 -3.885 9.603 1.00 0.00 H new ATOM 0 HG13 VAL A 144 15.675 -2.870 11.065 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.341 -1.070 10.152 1.00 0.00 H new ATOM 0 HG22 VAL A 144 14.845 -0.442 10.868 1.00 0.00 H new ATOM 0 HG23 VAL A 144 14.306 0.142 9.275 1.00 0.00 H new ATOM 2273 N GLU A 145 18.202 -3.154 8.697 1.00 0.00 N ATOM 2274 CA GLU A 145 18.934 -4.190 7.979 1.00 0.00 C ATOM 2275 C GLU A 145 18.896 -5.516 8.730 1.00 0.00 C ATOM 2276 O GLU A 145 18.911 -5.548 9.961 1.00 0.00 O ATOM 2277 CB GLU A 145 20.385 -3.758 7.757 1.00 0.00 C ATOM 2278 CG GLU A 145 21.180 -3.608 9.043 1.00 0.00 C ATOM 2279 CD GLU A 145 22.032 -4.825 9.348 1.00 0.00 C ATOM 2280 OE1 GLU A 145 21.501 -5.788 9.939 1.00 0.00 O ATOM 2281 OE2 GLU A 145 23.230 -4.814 8.995 1.00 0.00 O ATOM 0 H GLU A 145 18.471 -3.044 9.675 1.00 0.00 H new ATOM 0 HA GLU A 145 18.450 -4.332 7.013 1.00 0.00 H new ATOM 0 HB2 GLU A 145 20.879 -4.490 7.118 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.395 -2.809 7.221 1.00 0.00 H new ATOM 0 HG2 GLU A 145 21.821 -2.730 8.969 1.00 0.00 H new ATOM 0 HG3 GLU A 145 20.494 -3.433 9.872 1.00 0.00 H new ATOM 2288 N ASP A 146 18.849 -6.609 7.976 1.00 0.00 N ATOM 2289 CA ASP A 146 18.812 -7.944 8.557 1.00 0.00 C ATOM 2290 C ASP A 146 20.144 -8.656 8.347 1.00 0.00 C ATOM 2291 O ASP A 146 21.093 -8.070 7.825 1.00 0.00 O ATOM 2292 CB ASP A 146 17.679 -8.761 7.932 1.00 0.00 C ATOM 2293 CG ASP A 146 16.371 -8.604 8.681 1.00 0.00 C ATOM 2294 OD1 ASP A 146 16.367 -8.790 9.916 1.00 0.00 O ATOM 2295 OD2 ASP A 146 15.349 -8.294 8.033 1.00 0.00 O ATOM 0 H ASP A 146 18.836 -6.595 6.956 1.00 0.00 H new ATOM 0 HA ASP A 146 18.632 -7.849 9.628 1.00 0.00 H new ATOM 0 HB2 ASP A 146 17.541 -8.452 6.896 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.961 -9.814 7.915 1.00 0.00 H new ATOM 2300 N THR A 147 20.210 -9.922 8.747 1.00 0.00 N ATOM 2301 CA THR A 147 21.431 -10.704 8.589 1.00 0.00 C ATOM 2302 C THR A 147 21.820 -10.792 7.117 1.00 0.00 C ATOM 2303 O THR A 147 22.986 -10.624 6.759 1.00 0.00 O ATOM 2304 CB THR A 147 21.242 -12.108 9.165 1.00 0.00 C ATOM 2305 OG1 THR A 147 22.394 -12.902 8.941 1.00 0.00 O ATOM 2306 CG2 THR A 147 20.057 -12.842 8.576 1.00 0.00 C ATOM 0 H THR A 147 19.437 -10.426 9.181 1.00 0.00 H new ATOM 0 HA THR A 147 22.232 -10.205 9.134 1.00 0.00 H new ATOM 0 HB THR A 147 21.065 -11.961 10.230 1.00 0.00 H new ATOM 0 HG1 THR A 147 22.254 -13.796 9.318 1.00 0.00 H new ATOM 0 HG21 THR A 147 19.980 -13.831 9.028 1.00 0.00 H new ATOM 0 HG22 THR A 147 19.145 -12.280 8.776 1.00 0.00 H new ATOM 0 HG23 THR A 147 20.191 -12.945 7.499 1.00 0.00 H new ATOM 2314 N ASN A 148 20.830 -11.051 6.269 1.00 0.00 N ATOM 2315 CA ASN A 148 21.058 -11.156 4.833 1.00 0.00 C ATOM 2316 C ASN A 148 21.159 -9.768 4.201 1.00 0.00 C ATOM 2317 O ASN A 148 20.397 -8.865 4.548 1.00 0.00 O ATOM 2318 CB ASN A 148 19.930 -11.950 4.173 1.00 0.00 C ATOM 2319 CG ASN A 148 20.441 -12.912 3.118 1.00 0.00 C ATOM 2320 OD1 ASN A 148 21.525 -13.480 3.251 1.00 0.00 O ATOM 2321 ND2 ASN A 148 19.660 -13.100 2.060 1.00 0.00 N ATOM 0 H ASN A 148 19.860 -11.192 6.553 1.00 0.00 H new ATOM 0 HA ASN A 148 22.000 -11.680 4.674 1.00 0.00 H new ATOM 0 HB2 ASN A 148 19.387 -12.507 4.936 1.00 0.00 H new ATOM 0 HB3 ASN A 148 19.221 -11.259 3.718 1.00 0.00 H new ATOM 0 HD21 ASN A 148 19.951 -13.736 1.318 1.00 0.00 H new ATOM 0 HD22 ASN A 148 18.769 -12.609 1.990 1.00 0.00 H new ATOM 2328 N PRO A 149 22.103 -9.576 3.263 1.00 0.00 N ATOM 2329 CA PRO A 149 22.293 -8.287 2.589 1.00 0.00 C ATOM 2330 C PRO A 149 21.063 -7.865 1.792 1.00 0.00 C ATOM 2331 O PRO A 149 20.731 -6.682 1.725 1.00 0.00 O ATOM 2332 CB PRO A 149 23.480 -8.537 1.649 1.00 0.00 C ATOM 2333 CG PRO A 149 23.540 -10.017 1.486 1.00 0.00 C ATOM 2334 CD PRO A 149 23.055 -10.593 2.785 1.00 0.00 C ATOM 0 HA PRO A 149 22.464 -7.480 3.302 1.00 0.00 H new ATOM 0 HB2 PRO A 149 23.335 -8.040 0.690 1.00 0.00 H new ATOM 0 HB3 PRO A 149 24.407 -8.149 2.072 1.00 0.00 H new ATOM 0 HG2 PRO A 149 22.914 -10.344 0.656 1.00 0.00 H new ATOM 0 HG3 PRO A 149 24.556 -10.345 1.268 1.00 0.00 H new ATOM 0 HD2 PRO A 149 22.574 -11.561 2.643 1.00 0.00 H new ATOM 0 HD3 PRO A 149 23.873 -10.744 3.490 1.00 0.00 H new ATOM 2342 N ALA A 150 20.392 -8.841 1.190 1.00 0.00 N ATOM 2343 CA ALA A 150 19.199 -8.571 0.396 1.00 0.00 C ATOM 2344 C ALA A 150 17.990 -8.281 1.283 1.00 0.00 C ATOM 2345 O ALA A 150 16.985 -7.745 0.816 1.00 0.00 O ATOM 2346 CB ALA A 150 18.904 -9.744 -0.526 1.00 0.00 C ATOM 0 H ALA A 150 20.654 -9.826 1.237 1.00 0.00 H new ATOM 0 HA ALA A 150 19.393 -7.683 -0.205 1.00 0.00 H new ATOM 0 HB1 ALA A 150 18.011 -9.530 -1.113 1.00 0.00 H new ATOM 0 HB2 ALA A 150 19.749 -9.902 -1.196 1.00 0.00 H new ATOM 0 HB3 ALA A 150 18.740 -10.642 0.069 1.00 0.00 H new ATOM 2352 N LEU A 151 18.088 -8.639 2.562 1.00 0.00 N ATOM 2353 CA LEU A 151 16.994 -8.416 3.502 1.00 0.00 C ATOM 2354 C LEU A 151 17.089 -7.041 4.162 1.00 0.00 C ATOM 2355 O LEU A 151 16.396 -6.768 5.143 1.00 0.00 O ATOM 2356 CB LEU A 151 16.983 -9.510 4.572 1.00 0.00 C ATOM 2357 CG LEU A 151 16.529 -10.889 4.088 1.00 0.00 C ATOM 2358 CD1 LEU A 151 16.356 -11.837 5.265 1.00 0.00 C ATOM 2359 CD2 LEU A 151 15.234 -10.778 3.296 1.00 0.00 C ATOM 0 H LEU A 151 18.911 -9.083 2.969 1.00 0.00 H new ATOM 0 HA LEU A 151 16.062 -8.453 2.938 1.00 0.00 H new ATOM 0 HB2 LEU A 151 17.987 -9.600 4.987 1.00 0.00 H new ATOM 0 HB3 LEU A 151 16.329 -9.194 5.385 1.00 0.00 H new ATOM 0 HG LEU A 151 17.299 -11.294 3.431 1.00 0.00 H new ATOM 0 HD11 LEU A 151 16.033 -12.813 4.902 1.00 0.00 H new ATOM 0 HD12 LEU A 151 17.305 -11.942 5.791 1.00 0.00 H new ATOM 0 HD13 LEU A 151 15.606 -11.437 5.947 1.00 0.00 H new ATOM 0 HD21 LEU A 151 14.927 -11.768 2.960 1.00 0.00 H new ATOM 0 HD22 LEU A 151 14.456 -10.352 3.929 1.00 0.00 H new ATOM 0 HD23 LEU A 151 15.391 -10.134 2.431 1.00 0.00 H new ATOM 2371 N THR A 152 17.937 -6.174 3.618 1.00 0.00 N ATOM 2372 CA THR A 152 18.102 -4.828 4.155 1.00 0.00 C ATOM 2373 C THR A 152 17.121 -3.869 3.489 1.00 0.00 C ATOM 2374 O THR A 152 17.060 -3.785 2.264 1.00 0.00 O ATOM 2375 CB THR A 152 19.537 -4.340 3.945 1.00 0.00 C ATOM 2376 OG1 THR A 152 20.462 -5.382 4.198 1.00 0.00 O ATOM 2377 CG2 THR A 152 19.908 -3.171 4.832 1.00 0.00 C ATOM 0 H THR A 152 18.520 -6.379 2.807 1.00 0.00 H new ATOM 0 HA THR A 152 17.896 -4.856 5.225 1.00 0.00 H new ATOM 0 HB THR A 152 19.583 -4.015 2.906 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.613 -5.893 3.375 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.938 -2.875 4.632 1.00 0.00 H new ATOM 0 HG22 THR A 152 19.243 -2.332 4.626 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.811 -3.463 5.878 1.00 0.00 H new ATOM 2385 N HIS A 153 16.345 -3.158 4.299 1.00 0.00 N ATOM 2386 CA HIS A 153 15.358 -2.219 3.773 1.00 0.00 C ATOM 2387 C HIS A 153 15.448 -0.870 4.477 1.00 0.00 C ATOM 2388 O HIS A 153 16.084 -0.741 5.522 1.00 0.00 O ATOM 2389 CB HIS A 153 13.942 -2.787 3.925 1.00 0.00 C ATOM 2390 CG HIS A 153 13.895 -4.282 4.019 1.00 0.00 C ATOM 2391 ND1 HIS A 153 14.480 -5.237 3.257 1.00 0.00 N flip ATOM 2392 CD2 HIS A 153 13.183 -4.954 4.990 1.00 0.00 C flip ATOM 2393 CE1 HIS A 153 14.115 -6.453 3.777 1.00 0.00 C flip ATOM 2394 NE2 HIS A 153 13.333 -6.255 4.822 1.00 0.00 N flip ATOM 0 H HIS A 153 16.379 -3.212 5.317 1.00 0.00 H new ATOM 0 HA HIS A 153 15.575 -2.071 2.715 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.484 -2.362 4.818 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.339 -2.467 3.075 1.00 0.00 H new ATOM 0 HD1 HIS A 153 15.080 -5.081 2.447 1.00 0.00 H new ATOM 0 HD2 HIS A 153 12.594 -4.489 5.767 1.00 0.00 H new ATOM 0 HE1 HIS A 153 14.418 -7.416 3.394 1.00 0.00 H new ATOM 2403 N THR A 154 14.802 0.134 3.893 1.00 0.00 N ATOM 2404 CA THR A 154 14.800 1.477 4.460 1.00 0.00 C ATOM 2405 C THR A 154 13.375 1.999 4.612 1.00 0.00 C ATOM 2406 O THR A 154 12.624 2.073 3.640 1.00 0.00 O ATOM 2407 CB THR A 154 15.613 2.426 3.578 1.00 0.00 C ATOM 2408 OG1 THR A 154 16.802 1.801 3.129 1.00 0.00 O ATOM 2409 CG2 THR A 154 16.005 3.708 4.280 1.00 0.00 C ATOM 0 H THR A 154 14.273 0.042 3.026 1.00 0.00 H new ATOM 0 HA THR A 154 15.258 1.430 5.448 1.00 0.00 H new ATOM 0 HB THR A 154 14.958 2.674 2.743 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.306 2.424 2.565 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.579 4.335 3.598 1.00 0.00 H new ATOM 0 HG22 THR A 154 15.107 4.240 4.594 1.00 0.00 H new ATOM 0 HG23 THR A 154 16.612 3.473 5.155 1.00 0.00 H new ATOM 2417 N TYR A 155 13.010 2.361 5.837 1.00 0.00 N ATOM 2418 CA TYR A 155 11.675 2.878 6.116 1.00 0.00 C ATOM 2419 C TYR A 155 11.656 4.399 6.010 1.00 0.00 C ATOM 2420 O TYR A 155 12.233 5.097 6.843 1.00 0.00 O ATOM 2421 CB TYR A 155 11.217 2.444 7.510 1.00 0.00 C ATOM 2422 CG TYR A 155 10.251 1.280 7.496 1.00 0.00 C ATOM 2423 CD1 TYR A 155 9.067 1.343 6.772 1.00 0.00 C ATOM 2424 CD2 TYR A 155 10.524 0.119 8.208 1.00 0.00 C ATOM 2425 CE1 TYR A 155 8.182 0.282 6.758 1.00 0.00 C ATOM 2426 CE2 TYR A 155 9.643 -0.947 8.199 1.00 0.00 C ATOM 2427 CZ TYR A 155 8.475 -0.860 7.473 1.00 0.00 C ATOM 2428 OH TYR A 155 7.596 -1.919 7.461 1.00 0.00 O ATOM 0 H TYR A 155 13.620 2.306 6.653 1.00 0.00 H new ATOM 0 HA TYR A 155 10.988 2.469 5.376 1.00 0.00 H new ATOM 0 HB2 TYR A 155 12.091 2.173 8.102 1.00 0.00 H new ATOM 0 HB3 TYR A 155 10.745 3.291 8.008 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.834 2.236 6.211 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.439 0.048 8.778 1.00 0.00 H new ATOM 0 HE1 TYR A 155 7.266 0.347 6.190 1.00 0.00 H new ATOM 0 HE2 TYR A 155 9.869 -1.843 8.758 1.00 0.00 H new ATOM 0 HH TYR A 155 7.542 -2.309 8.358 1.00 0.00 H new ATOM 2438 N GLU A 156 10.994 4.907 4.976 1.00 0.00 N ATOM 2439 CA GLU A 156 10.907 6.345 4.758 1.00 0.00 C ATOM 2440 C GLU A 156 9.481 6.850 4.957 1.00 0.00 C ATOM 2441 O GLU A 156 8.526 6.274 4.430 1.00 0.00 O ATOM 2442 CB GLU A 156 11.392 6.698 3.351 1.00 0.00 C ATOM 2443 CG GLU A 156 12.903 6.643 3.198 1.00 0.00 C ATOM 2444 CD GLU A 156 13.394 7.403 1.981 1.00 0.00 C ATOM 2445 OE1 GLU A 156 12.693 7.385 0.947 1.00 0.00 O ATOM 2446 OE2 GLU A 156 14.479 8.016 2.062 1.00 0.00 O ATOM 0 H GLU A 156 10.510 4.344 4.276 1.00 0.00 H new ATOM 0 HA GLU A 156 11.547 6.833 5.493 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.937 6.012 2.636 1.00 0.00 H new ATOM 0 HB3 GLU A 156 11.045 7.700 3.097 1.00 0.00 H new ATOM 0 HG2 GLU A 156 13.370 7.055 4.092 1.00 0.00 H new ATOM 0 HG3 GLU A 156 13.219 5.603 3.124 1.00 0.00 H new ATOM 2453 N VAL A 157 9.351 7.936 5.715 1.00 0.00 N ATOM 2454 CA VAL A 157 8.051 8.538 5.986 1.00 0.00 C ATOM 2455 C VAL A 157 7.937 9.900 5.306 1.00 0.00 C ATOM 2456 O VAL A 157 8.924 10.630 5.182 1.00 0.00 O ATOM 2457 CB VAL A 157 7.789 8.692 7.499 1.00 0.00 C ATOM 2458 CG1 VAL A 157 6.301 8.889 7.773 1.00 0.00 C ATOM 2459 CG2 VAL A 157 8.318 7.484 8.258 1.00 0.00 C ATOM 0 H VAL A 157 10.135 8.418 6.154 1.00 0.00 H new ATOM 0 HA VAL A 157 7.297 7.864 5.579 1.00 0.00 H new ATOM 0 HB VAL A 157 8.319 9.578 7.849 1.00 0.00 H new ATOM 0 HG11 VAL A 157 6.140 8.995 8.846 1.00 0.00 H new ATOM 0 HG12 VAL A 157 5.953 9.787 7.263 1.00 0.00 H new ATOM 0 HG13 VAL A 157 5.746 8.025 7.406 1.00 0.00 H new ATOM 0 HG21 VAL A 157 8.124 7.610 9.323 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.818 6.583 7.902 1.00 0.00 H new ATOM 0 HG23 VAL A 157 9.391 7.392 8.093 1.00 0.00 H new ATOM 2469 N TRP A 158 6.718 10.236 4.899 1.00 0.00 N ATOM 2470 CA TRP A 158 6.450 11.512 4.242 1.00 0.00 C ATOM 2471 C TRP A 158 5.082 12.062 4.617 1.00 0.00 C ATOM 2472 O TRP A 158 4.104 11.323 4.689 1.00 0.00 O ATOM 2473 CB TRP A 158 6.537 11.364 2.722 1.00 0.00 C ATOM 2474 CG TRP A 158 7.723 10.575 2.258 1.00 0.00 C ATOM 2475 CD1 TRP A 158 7.923 9.232 2.397 1.00 0.00 C ATOM 2476 CD2 TRP A 158 8.872 11.084 1.571 1.00 0.00 C ATOM 2477 NE1 TRP A 158 9.128 8.875 1.841 1.00 0.00 N ATOM 2478 CE2 TRP A 158 9.729 9.994 1.327 1.00 0.00 C ATOM 2479 CE3 TRP A 158 9.259 12.355 1.139 1.00 0.00 C ATOM 2480 CZ2 TRP A 158 10.948 10.138 0.670 1.00 0.00 C ATOM 2481 CZ3 TRP A 158 10.470 12.497 0.487 1.00 0.00 C ATOM 2482 CH2 TRP A 158 11.302 11.394 0.258 1.00 0.00 C ATOM 0 H TRP A 158 5.897 9.641 5.012 1.00 0.00 H new ATOM 0 HA TRP A 158 7.210 12.215 4.585 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.628 10.883 2.361 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.573 12.356 2.271 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.235 8.550 2.874 1.00 0.00 H new ATOM 0 HE1 TRP A 158 9.512 7.931 1.815 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.624 13.211 1.311 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 11.591 9.289 0.492 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 10.779 13.475 0.149 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.242 11.538 -0.254 1.00 0.00 H new ATOM 2493 N GLN A 159 5.026 13.368 4.852 1.00 0.00 N ATOM 2494 CA GLN A 159 3.779 14.030 5.213 1.00 0.00 C ATOM 2495 C GLN A 159 3.625 15.336 4.441 1.00 0.00 C ATOM 2496 O GLN A 159 4.486 16.213 4.511 1.00 0.00 O ATOM 2497 CB GLN A 159 3.734 14.301 6.718 1.00 0.00 C ATOM 2498 CG GLN A 159 3.785 13.039 7.565 1.00 0.00 C ATOM 2499 CD GLN A 159 2.434 12.671 8.147 1.00 0.00 C ATOM 2500 OE1 GLN A 159 1.463 13.416 8.014 1.00 0.00 O ATOM 2501 NE2 GLN A 159 2.367 11.516 8.799 1.00 0.00 N ATOM 0 H GLN A 159 5.832 13.990 4.799 1.00 0.00 H new ATOM 0 HA GLN A 159 2.952 13.370 4.951 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.572 14.944 6.988 1.00 0.00 H new ATOM 0 HB3 GLN A 159 2.822 14.850 6.953 1.00 0.00 H new ATOM 0 HG2 GLN A 159 4.151 12.212 6.956 1.00 0.00 H new ATOM 0 HG3 GLN A 159 4.500 13.179 8.376 1.00 0.00 H new ATOM 0 HE21 GLN A 159 3.197 10.930 8.885 1.00 0.00 H new ATOM 0 HE22 GLN A 159 1.485 11.215 9.214 1.00 0.00 H new ATOM 2510 N LYS A 160 2.531 15.455 3.695 1.00 0.00 N ATOM 2511 CA LYS A 160 2.274 16.650 2.901 1.00 0.00 C ATOM 2512 C LYS A 160 2.235 17.896 3.778 1.00 0.00 C ATOM 2513 O LYS A 160 1.711 17.870 4.892 1.00 0.00 O ATOM 2514 CB LYS A 160 0.952 16.508 2.146 1.00 0.00 C ATOM 2515 CG LYS A 160 0.761 17.544 1.049 1.00 0.00 C ATOM 2516 CD LYS A 160 -0.143 18.681 1.502 1.00 0.00 C ATOM 2517 CE LYS A 160 -1.388 18.785 0.634 1.00 0.00 C ATOM 2518 NZ LYS A 160 -2.372 19.756 1.188 1.00 0.00 N ATOM 0 H LYS A 160 1.809 14.738 3.624 1.00 0.00 H new ATOM 0 HA LYS A 160 3.089 16.759 2.186 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.900 15.512 1.706 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.128 16.587 2.855 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.731 17.945 0.754 1.00 0.00 H new ATOM 0 HG3 LYS A 160 0.332 17.067 0.168 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.435 18.523 2.540 1.00 0.00 H new ATOM 0 HD3 LYS A 160 0.407 19.621 1.465 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -1.104 19.091 -0.373 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -1.855 17.804 0.550 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -3.206 19.798 0.568 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -2.663 19.451 2.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -1.936 20.698 1.245 1.00 0.00 H new ATOM 2532 N LYS A 161 2.792 18.987 3.263 1.00 0.00 N ATOM 2533 CA LYS A 161 2.821 20.248 3.994 1.00 0.00 C ATOM 2534 C LYS A 161 1.406 20.740 4.284 1.00 0.00 C ATOM 2535 O LYS A 161 0.524 20.660 3.429 1.00 0.00 O ATOM 2536 CB LYS A 161 3.587 21.305 3.197 1.00 0.00 C ATOM 2537 CG LYS A 161 5.086 21.289 3.449 1.00 0.00 C ATOM 2538 CD LYS A 161 5.869 21.550 2.172 1.00 0.00 C ATOM 2539 CE LYS A 161 7.194 22.237 2.461 1.00 0.00 C ATOM 2540 NZ LYS A 161 7.000 23.609 3.008 1.00 0.00 N ATOM 0 H LYS A 161 3.229 19.023 2.342 1.00 0.00 H new ATOM 0 HA LYS A 161 3.330 20.079 4.943 1.00 0.00 H new ATOM 0 HB2 LYS A 161 3.404 21.150 2.134 1.00 0.00 H new ATOM 0 HB3 LYS A 161 3.195 22.291 3.447 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.339 22.045 4.193 1.00 0.00 H new ATOM 0 HG3 LYS A 161 5.376 20.324 3.864 1.00 0.00 H new ATOM 0 HD2 LYS A 161 6.052 20.607 1.657 1.00 0.00 H new ATOM 0 HD3 LYS A 161 5.275 22.170 1.500 1.00 0.00 H new ATOM 0 HE2 LYS A 161 7.765 21.640 3.172 1.00 0.00 H new ATOM 0 HE3 LYS A 161 7.782 22.291 1.545 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 7.840 24.187 2.802 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 6.164 24.043 2.567 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 6.861 23.556 4.037 1.00 0.00 H new ATOM 2554 N ALA A 162 1.198 21.248 5.494 1.00 0.00 N ATOM 2555 CA ALA A 162 -0.110 21.752 5.895 1.00 0.00 C ATOM 2556 C ALA A 162 -1.162 20.649 5.847 1.00 0.00 C ATOM 2557 O ALA A 162 -2.360 20.967 6.003 1.00 0.00 O ATOM 2558 CB ALA A 162 -0.523 22.916 5.007 1.00 0.00 C ATOM 2559 OXT ALA A 162 -0.780 19.476 5.653 1.00 0.00 O ATOM 0 H ALA A 162 1.918 21.322 6.213 1.00 0.00 H new ATOM 0 HA ALA A 162 -0.036 22.103 6.924 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -1.501 23.282 5.318 1.00 0.00 H new ATOM 0 HB2 ALA A 162 0.209 23.719 5.095 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -0.573 22.583 3.970 1.00 0.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 -4.337 -2.698 -8.480 1.00 0.00 P HETATM 2567 O1A NDP A 170 -3.567 -1.443 -8.370 1.00 0.00 O HETATM 2568 O2A NDP A 170 -5.018 -3.188 -7.268 1.00 0.00 O HETATM 2569 O5B NDP A 170 -5.327 -2.666 -9.727 1.00 0.00 O HETATM 2570 C5B NDP A 170 -5.345 -1.545 -10.632 1.00 0.00 C HETATM 2571 C4B NDP A 170 -6.712 -1.403 -11.260 1.00 0.00 C HETATM 2572 O4B NDP A 170 -7.689 -1.114 -10.224 1.00 0.00 O HETATM 2573 C3B NDP A 170 -6.871 -0.260 -12.249 1.00 0.00 C HETATM 2574 O3B NDP A 170 -6.433 -0.647 -13.555 1.00 0.00 O HETATM 2575 C2B NDP A 170 -8.375 -0.017 -12.215 1.00 0.00 C HETATM 2576 O2B NDP A 170 -9.109 -0.922 -13.014 1.00 0.00 O HETATM 2577 C1B NDP A 170 -8.684 -0.241 -10.734 1.00 0.00 C HETATM 2578 N9A NDP A 170 -8.652 0.996 -9.955 1.00 0.00 N HETATM 2579 C8A NDP A 170 -7.552 1.654 -9.463 1.00 0.00 C HETATM 2580 N7A NDP A 170 -7.842 2.750 -8.805 1.00 0.00 N HETATM 2581 C5A NDP A 170 -9.226 2.819 -8.866 1.00 0.00 C HETATM 2582 C6A NDP A 170 -10.154 3.749 -8.358 1.00 0.00 C HETATM 2583 N6A NDP A 170 -9.808 4.834 -7.661 1.00 0.00 N HETATM 2584 N1A NDP A 170 -11.467 3.524 -8.596 1.00 0.00 N HETATM 2585 C2A NDP A 170 -11.814 2.435 -9.297 1.00 0.00 C HETATM 2586 N3A NDP A 170 -11.036 1.490 -9.825 1.00 0.00 N HETATM 2587 C4A NDP A 170 -9.739 1.744 -9.571 1.00 0.00 C HETATM 2588 O3 NDP A 170 -3.323 -3.884 -9.015 1.00 0.00 O HETATM 2589 PN NDP A 170 -2.295 -4.954 -8.295 1.00 0.00 P HETATM 2590 O1N NDP A 170 -2.791 -5.232 -6.934 1.00 0.00 O HETATM 2591 O2N NDP A 170 -2.107 -6.104 -9.202 1.00 0.00 O HETATM 2592 O5D NDP A 170 -1.000 -4.026 -8.265 1.00 0.00 O HETATM 2593 C5D NDP A 170 -0.100 -3.984 -9.385 1.00 0.00 C HETATM 2594 C4D NDP A 170 1.075 -4.902 -9.144 1.00 0.00 C HETATM 2595 O4D NDP A 170 1.888 -4.383 -8.061 1.00 0.00 O HETATM 2596 C3D NDP A 170 0.730 -6.317 -8.711 1.00 0.00 C HETATM 2597 O3D NDP A 170 0.446 -7.145 -9.843 1.00 0.00 O HETATM 2598 C2D NDP A 170 2.010 -6.759 -8.010 1.00 0.00 C HETATM 2599 O2D NDP A 170 3.020 -7.218 -8.910 1.00 0.00 O HETATM 2600 C1D NDP A 170 2.454 -5.459 -7.332 1.00 0.00 C HETATM 2601 N1N NDP A 170 2.032 -5.343 -5.937 1.00 0.00 N HETATM 2602 C2N NDP A 170 2.756 -5.156 -4.839 1.00 0.00 C HETATM 2603 C3N NDP A 170 2.318 -5.038 -3.626 1.00 0.00 C HETATM 2604 C7N NDP A 170 3.420 -4.848 -2.723 1.00 0.00 C HETATM 2605 O7N NDP A 170 2.849 -4.623 -1.560 1.00 0.00 O HETATM 2606 N7N NDP A 170 4.757 -4.822 -2.947 1.00 0.00 N HETATM 2607 C4N NDP A 170 0.831 -5.123 -3.411 1.00 0.00 C HETATM 2608 C5N NDP A 170 -0.015 -5.325 -4.559 1.00 0.00 C HETATM 2609 C6N NDP A 170 0.496 -5.444 -5.844 1.00 0.00 C HETATM 2610 P2B NDP A 170 -9.148 -1.022 -14.681 1.00 0.00 P HETATM 2611 O1X NDP A 170 -8.183 -2.262 -14.837 1.00 0.00 O HETATM 2612 O2X NDP A 170 -10.593 -1.472 -14.895 1.00 0.00 O HETATM 2613 O3X NDP A 170 -8.398 0.257 -15.050 1.00 0.00 O HETATM 0 HO3N NDP A 170 -0.512 -7.104 -10.046 1.00 0.00 H new HETATM 0 HO3A NDP A 170 -6.910 -0.120 -14.230 1.00 0.00 H new HETATM 0 HO2N NDP A 170 3.439 -6.450 -9.351 1.00 0.00 H new HETATM 0 H72N NDP A 170 5.401 -4.672 -2.171 1.00 0.00 H new HETATM 0 H71N NDP A 170 5.118 -4.952 -3.892 1.00 0.00 H new HETATM 0 H62A NDP A 170 -10.527 5.471 -7.319 1.00 0.00 H new HETATM 0 H61A NDP A 170 -8.824 5.026 -7.471 1.00 0.00 H new HETATM 0 H52N NDP A 170 -0.624 -4.282 -10.293 1.00 0.00 H new HETATM 0 H52A NDP A 170 -5.086 -0.632 -10.096 1.00 0.00 H new HETATM 0 H51N NDP A 170 0.252 -2.964 -9.540 1.00 0.00 H new HETATM 0 H51A NDP A 170 -4.593 -1.683 -11.409 1.00 0.00 H new HETATM 0 H42N NDP A 170 0.642 -5.938 -2.712 1.00 0.00 H new HETATM 0 H41N NDP A 170 0.513 -4.203 -2.922 1.00 0.00 H new HETATM 0 H8A NDP A 170 -6.532 1.298 -9.606 1.00 0.00 H new HETATM 0 H6N NDP A 170 -0.138 -5.597 -6.718 1.00 0.00 H new HETATM 0 H5N NDP A 170 -1.094 -5.387 -4.414 1.00 0.00 H new HETATM 0 H4D NDP A 170 1.570 -4.940 -10.115 1.00 0.00 H new HETATM 0 H4B NDP A 170 -6.853 -2.347 -11.786 1.00 0.00 H new HETATM 0 H3D NDP A 170 -0.157 -6.381 -8.081 1.00 0.00 H new HETATM 0 H3B NDP A 170 -6.281 0.623 -12.004 1.00 0.00 H new HETATM 0 H2N NDP A 170 3.836 -5.095 -4.974 1.00 0.00 H new HETATM 0 H2D NDP A 170 1.847 -7.604 -7.341 1.00 0.00 H new HETATM 0 H2B NDP A 170 -8.649 0.962 -12.609 1.00 0.00 H new HETATM 0 H2A NDP A 170 -12.884 2.304 -9.458 1.00 0.00 H new HETATM 0 H1D NDP A 170 3.544 -5.448 -7.329 1.00 0.00 H new HETATM 0 H1B NDP A 170 -9.691 -0.651 -10.651 1.00 0.00 H new