USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1305 hydrogens (45 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 153 HIS : no HE2:sc= -2.05! C(o=-0.85!,f=-12!) USER MOD Set 1.2: A 155 TYR OH : rot 103:sc= 1.21 USER MOD Set 2.1: A 101 GLN :FLIP amide:sc= 0.639 F(o=-3.8!,f=1.9) USER MOD Set 2.2: A 168 NDP O3B : rot -128:sc= 1.21 USER MOD Set 3.1: A 85 TYR OH : rot -140:sc= 0.0862 USER MOD Set 3.2: A 89 HIS : no HD1:sc= -4.41! C(o=-4.3!,f=-7.9!) USER MOD Set 4.1: A 63 THR OG1 : rot 50:sc= 0.415 USER MOD Set 4.2: A 65 GLN : amide:sc= -0.214 X(o=0.2,f=0.49) USER MOD Set 5.1: A 58 THR OG1 : rot 100:sc= -0.0931 USER MOD Set 5.2: A 92 GLN :FLIP amide:sc= 0.571 F(o=-0.27,f=0.48) USER MOD Set 6.1: A 39 MET CE :methyl 157:sc= -4.12 (180deg=-7.35!) USER MOD Set 6.2: A 59 ASN : amide:sc= -3.89 K(o=-8,f=-12!) USER MOD Set 7.1: A 29 TYR OH : rot -124:sc= 1.02 USER MOD Set 7.2: A 33 GLN : amide:sc= -6.22! C(o=-5.2!,f=-16!) USER MOD Single : A 1 THR N :NH3+ -166:sc= -0.319 (180deg=-0.715) USER MOD Single : A 1 THR OG1 : rot 164:sc= 0.25 USER MOD Single : A 7 GLN : amide:sc= -4.55! C(o=-4.5!,f=-9.8!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HE2:sc= -0.251 K(o=-0.25,f=-3) USER MOD Single : A 22 HIS : no HD1:sc= -0.0835 X(o=-0.083,f=0) USER MOD Single : A 28 HIS : no HD1:sc= -0.17 X(o=-0.17,f=-0.14) USER MOD Single : A 34 THR OG1 : rot -75:sc= 1.31 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 45 THR OG1 : rot 61:sc= 0.0284 USER MOD Single : A 46 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ -145:sc= 0 (180deg=-0.0377) USER MOD Single : A 64 HIS : no HD1:sc= -0.193 X(o=-0.19,f=-0.14) USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 69 GLN : amide:sc= -0.27 K(o=-0.27,f=-1.1!) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HD1:sc= -4.74! C(o=-4.7!,f=-6.5!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN :FLIP amide:sc= -0.0216 F(o=-0.99,f=-0.022) USER MOD Single : A 104 THR OG1 : rot 70:sc= -0.428 USER MOD Single : A 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.0154 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot -160:sc= -0.725 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -111:sc= -4.31 (180deg=-12.6!) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 138 LYS NZ :NH3+ -143:sc= -0.428 (180deg=-1.15) USER MOD Single : A 140 SER OG : rot 17:sc= 0.148 USER MOD Single : A 141 SER OG : rot 163:sc= -1.16 USER MOD Single : A 143 THR OG1 : rot 180:sc= -0.208 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.00617 USER MOD Single : A 148 ASN : amide:sc= -1.07 X(o=-1.1,f=-1) USER MOD Single : A 152 THR OG1 : rot 96:sc= 0.0264 USER MOD Single : A 154 THR OG1 : rot -171:sc= -2.64! USER MOD Single : A 159 GLN : amide:sc= -1.2 K(o=-1.2,f=-3.1!) USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 NDP O2D : rot -124:sc= -0.668! USER MOD Single : A 168 NDP O3D : rot -170:sc= -1.37 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.620 10.599 3.198 1.00 0.00 N ATOM 2 CA THR A 1 -5.273 9.288 2.580 1.00 0.00 C ATOM 3 C THR A 1 -3.769 9.037 2.716 1.00 0.00 C ATOM 4 O THR A 1 -2.972 9.946 2.622 1.00 0.00 O ATOM 5 CB THR A 1 -5.656 9.304 1.098 1.00 0.00 C ATOM 6 OG1 THR A 1 -7.001 9.748 0.958 1.00 0.00 O ATOM 7 CG2 THR A 1 -5.517 7.895 0.520 1.00 0.00 C ATOM 0 H1 THR A 1 -6.651 10.663 3.320 1.00 0.00 H new ATOM 0 H2 THR A 1 -5.156 10.679 4.125 1.00 0.00 H new ATOM 0 H3 THR A 1 -5.295 11.371 2.581 1.00 0.00 H new ATOM 0 HA THR A 1 -5.819 8.494 3.088 1.00 0.00 H new ATOM 0 HB THR A 1 -4.995 9.983 0.559 1.00 0.00 H new ATOM 0 HG1 THR A 1 -7.165 10.007 0.027 1.00 0.00 H new ATOM 0 HG21 THR A 1 -5.790 7.906 -0.535 1.00 0.00 H new ATOM 0 HG22 THR A 1 -4.485 7.559 0.625 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.177 7.214 1.058 1.00 0.00 H new ATOM 17 N ALA A 2 -3.374 7.813 2.945 1.00 0.00 N ATOM 18 CA ALA A 2 -1.919 7.518 3.094 1.00 0.00 C ATOM 19 C ALA A 2 -1.507 6.414 2.119 1.00 0.00 C ATOM 20 O ALA A 2 -2.297 5.571 1.754 1.00 0.00 O ATOM 21 CB ALA A 2 -1.641 7.053 4.525 1.00 0.00 C ATOM 0 H ALA A 2 -3.993 7.007 3.035 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.348 8.421 2.878 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.579 6.837 4.637 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.927 7.838 5.225 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -2.219 6.153 4.734 1.00 0.00 H new ATOM 27 N PHE A 3 -0.269 6.408 1.707 1.00 0.00 N ATOM 28 CA PHE A 3 0.206 5.352 0.767 1.00 0.00 C ATOM 29 C PHE A 3 1.073 4.357 1.541 1.00 0.00 C ATOM 30 O PHE A 3 1.917 4.746 2.323 1.00 0.00 O ATOM 31 CB PHE A 3 1.046 5.993 -0.340 1.00 0.00 C ATOM 32 CG PHE A 3 0.160 6.459 -1.474 1.00 0.00 C ATOM 33 CD1 PHE A 3 -1.064 7.080 -1.212 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.575 6.269 -2.792 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.870 7.508 -2.271 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.229 6.695 -3.850 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.452 7.314 -3.590 1.00 0.00 C ATOM 0 H PHE A 3 0.437 7.091 1.982 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.649 4.841 0.324 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.606 6.837 0.063 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.776 5.275 -0.713 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.387 7.229 -0.192 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.522 5.791 -2.994 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.816 7.989 -2.070 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.095 6.546 -4.869 1.00 0.00 H new ATOM 0 HZ PHE A 3 -2.075 7.643 -4.408 1.00 0.00 H new ATOM 47 N LEU A 4 0.876 3.078 1.345 1.00 0.00 N ATOM 48 CA LEU A 4 1.700 2.079 2.087 1.00 0.00 C ATOM 49 C LEU A 4 2.204 1.007 1.112 1.00 0.00 C ATOM 50 O LEU A 4 1.551 0.011 0.888 1.00 0.00 O ATOM 51 CB LEU A 4 0.826 1.432 3.169 1.00 0.00 C ATOM 52 CG LEU A 4 1.593 0.311 3.874 1.00 0.00 C ATOM 53 CD1 LEU A 4 2.786 0.899 4.628 1.00 0.00 C ATOM 54 CD2 LEU A 4 0.660 -0.387 4.866 1.00 0.00 C ATOM 0 H LEU A 4 0.184 2.685 0.707 1.00 0.00 H new ATOM 0 HA LEU A 4 2.558 2.567 2.549 1.00 0.00 H new ATOM 0 HB2 LEU A 4 0.519 2.184 3.896 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.084 1.033 2.720 1.00 0.00 H new ATOM 0 HG LEU A 4 1.952 -0.406 3.136 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.330 0.098 5.129 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.449 1.403 3.924 1.00 0.00 H new ATOM 0 HD13 LEU A 4 2.431 1.615 5.369 1.00 0.00 H new ATOM 0 HD21 LEU A 4 1.200 -1.187 5.372 1.00 0.00 H new ATOM 0 HD22 LEU A 4 0.306 0.335 5.603 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -0.192 -0.806 4.331 1.00 0.00 H new ATOM 66 N TRP A 5 3.359 1.204 0.527 1.00 0.00 N ATOM 67 CA TRP A 5 3.890 0.190 -0.436 1.00 0.00 C ATOM 68 C TRP A 5 5.372 -0.077 -0.160 1.00 0.00 C ATOM 69 O TRP A 5 6.128 0.826 0.140 1.00 0.00 O ATOM 70 CB TRP A 5 3.727 0.711 -1.867 1.00 0.00 C ATOM 71 CG TRP A 5 4.758 1.759 -2.158 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.884 1.563 -2.884 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.777 3.154 -1.743 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.582 2.756 -2.957 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.942 3.765 -2.265 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.903 3.943 -0.975 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.226 5.112 -2.034 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.189 5.296 -0.740 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.347 5.879 -1.269 1.00 0.00 C ATOM 0 H TRP A 5 3.955 2.019 0.673 1.00 0.00 H new ATOM 0 HA TRP A 5 3.332 -0.739 -0.315 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.825 -0.112 -2.575 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.728 1.127 -1.999 1.00 0.00 H new ATOM 0 HD1 TRP A 5 6.188 0.629 -3.333 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.461 2.875 -3.460 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.006 3.505 -0.563 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 7.120 5.557 -2.445 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.511 5.892 -0.147 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.560 6.922 -1.085 1.00 0.00 H new ATOM 90 N ALA A 6 5.796 -1.306 -0.276 1.00 0.00 N ATOM 91 CA ALA A 6 7.230 -1.628 -0.044 1.00 0.00 C ATOM 92 C ALA A 6 7.930 -1.721 -1.401 1.00 0.00 C ATOM 93 O ALA A 6 7.493 -2.436 -2.281 1.00 0.00 O ATOM 94 CB ALA A 6 7.340 -2.971 0.682 1.00 0.00 C ATOM 0 H ALA A 6 5.208 -2.102 -0.522 1.00 0.00 H new ATOM 0 HA ALA A 6 7.696 -0.854 0.566 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.390 -3.208 0.852 1.00 0.00 H new ATOM 0 HB2 ALA A 6 6.822 -2.911 1.639 1.00 0.00 H new ATOM 0 HB3 ALA A 6 6.886 -3.752 0.072 1.00 0.00 H new ATOM 100 N GLN A 7 9.001 -0.998 -1.588 1.00 0.00 N ATOM 101 CA GLN A 7 9.704 -1.048 -2.903 1.00 0.00 C ATOM 102 C GLN A 7 11.189 -1.338 -2.690 1.00 0.00 C ATOM 103 O GLN A 7 11.729 -1.115 -1.624 1.00 0.00 O ATOM 104 CB GLN A 7 9.544 0.292 -3.625 1.00 0.00 C ATOM 105 CG GLN A 7 9.918 1.439 -2.680 1.00 0.00 C ATOM 106 CD GLN A 7 10.918 2.371 -3.367 1.00 0.00 C ATOM 107 OE1 GLN A 7 12.107 2.286 -3.131 1.00 0.00 O ATOM 108 NE2 GLN A 7 10.483 3.264 -4.215 1.00 0.00 N ATOM 0 H GLN A 7 9.418 -0.379 -0.893 1.00 0.00 H new ATOM 0 HA GLN A 7 9.267 -1.842 -3.509 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.179 0.316 -4.511 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.516 0.411 -3.967 1.00 0.00 H new ATOM 0 HG2 GLN A 7 9.024 1.995 -2.396 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.350 1.040 -1.762 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.485 3.335 -4.413 1.00 0.00 H new ATOM 0 HE22 GLN A 7 11.141 3.890 -4.679 1.00 0.00 H new ATOM 117 N ASP A 8 11.852 -1.839 -3.699 1.00 0.00 N ATOM 118 CA ASP A 8 13.301 -2.149 -3.555 1.00 0.00 C ATOM 119 C ASP A 8 14.125 -0.881 -3.792 1.00 0.00 C ATOM 120 O ASP A 8 13.597 0.213 -3.850 1.00 0.00 O ATOM 121 CB ASP A 8 13.702 -3.233 -4.563 1.00 0.00 C ATOM 122 CG ASP A 8 13.327 -2.799 -5.983 1.00 0.00 C ATOM 123 OD1 ASP A 8 13.279 -1.606 -6.227 1.00 0.00 O ATOM 124 OD2 ASP A 8 13.096 -3.672 -6.803 1.00 0.00 O ATOM 0 H ASP A 8 11.452 -2.046 -4.614 1.00 0.00 H new ATOM 0 HA ASP A 8 13.494 -2.515 -2.546 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.775 -3.417 -4.502 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.203 -4.171 -4.318 1.00 0.00 H new ATOM 129 N ARG A 9 15.418 -1.019 -3.909 1.00 0.00 N ATOM 130 CA ARG A 9 16.285 0.176 -4.121 1.00 0.00 C ATOM 131 C ARG A 9 15.870 0.925 -5.395 1.00 0.00 C ATOM 132 O ARG A 9 15.847 2.140 -5.424 1.00 0.00 O ATOM 133 CB ARG A 9 17.749 -0.267 -4.229 1.00 0.00 C ATOM 134 CG ARG A 9 17.911 -1.265 -5.379 1.00 0.00 C ATOM 135 CD ARG A 9 18.432 -0.533 -6.619 1.00 0.00 C ATOM 136 NE ARG A 9 19.805 -0.010 -6.346 1.00 0.00 N ATOM 137 CZ ARG A 9 20.871 -0.709 -6.659 1.00 0.00 C ATOM 138 NH1 ARG A 9 20.766 -1.885 -7.223 1.00 0.00 N ATOM 139 NH2 ARG A 9 22.055 -0.224 -6.402 1.00 0.00 N ATOM 0 H ARG A 9 15.913 -1.910 -3.867 1.00 0.00 H new ATOM 0 HA ARG A 9 16.170 0.850 -3.272 1.00 0.00 H new ATOM 0 HB2 ARG A 9 18.388 0.600 -4.396 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.069 -0.724 -3.293 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.603 -2.057 -5.093 1.00 0.00 H new ATOM 0 HG3 ARG A 9 16.956 -1.741 -5.599 1.00 0.00 H new ATOM 0 HD2 ARG A 9 18.452 -1.210 -7.473 1.00 0.00 H new ATOM 0 HD3 ARG A 9 17.763 0.288 -6.878 1.00 0.00 H new ATOM 0 HE ARG A 9 19.916 0.905 -5.909 1.00 0.00 H new ATOM 0 HH11 ARG A 9 19.845 -2.273 -7.426 1.00 0.00 H new ATOM 0 HH12 ARG A 9 21.605 -2.414 -7.459 1.00 0.00 H new ATOM 0 HH21 ARG A 9 22.147 0.691 -5.961 1.00 0.00 H new ATOM 0 HH22 ARG A 9 22.889 -0.760 -6.642 1.00 0.00 H new ATOM 153 N ASP A 10 15.558 0.220 -6.453 1.00 0.00 N ATOM 154 CA ASP A 10 15.166 0.906 -7.722 1.00 0.00 C ATOM 155 C ASP A 10 13.752 1.479 -7.595 1.00 0.00 C ATOM 156 O ASP A 10 13.421 2.480 -8.201 1.00 0.00 O ATOM 157 CB ASP A 10 15.204 -0.102 -8.874 1.00 0.00 C ATOM 158 CG ASP A 10 16.488 0.092 -9.683 1.00 0.00 C ATOM 159 OD1 ASP A 10 17.477 -0.539 -9.348 1.00 0.00 O ATOM 160 OD2 ASP A 10 16.461 0.868 -10.623 1.00 0.00 O ATOM 0 H ASP A 10 15.558 -0.799 -6.493 1.00 0.00 H new ATOM 0 HA ASP A 10 15.864 1.720 -7.919 1.00 0.00 H new ATOM 0 HB2 ASP A 10 15.159 -1.118 -8.483 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.334 0.032 -9.516 1.00 0.00 H new ATOM 165 N GLY A 11 12.921 0.856 -6.809 1.00 0.00 N ATOM 166 CA GLY A 11 11.529 1.366 -6.638 1.00 0.00 C ATOM 167 C GLY A 11 10.536 0.400 -7.287 1.00 0.00 C ATOM 168 O GLY A 11 9.561 0.807 -7.886 1.00 0.00 O ATOM 0 H GLY A 11 13.143 0.015 -6.276 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.301 1.477 -5.578 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.436 2.354 -7.089 1.00 0.00 H new ATOM 172 N LEU A 12 10.769 -0.877 -7.157 1.00 0.00 N ATOM 173 CA LEU A 12 9.837 -1.878 -7.750 1.00 0.00 C ATOM 174 C LEU A 12 8.719 -2.157 -6.746 1.00 0.00 C ATOM 175 O LEU A 12 8.859 -1.876 -5.574 1.00 0.00 O ATOM 176 CB LEU A 12 10.608 -3.172 -8.023 1.00 0.00 C ATOM 177 CG LEU A 12 9.704 -4.183 -8.728 1.00 0.00 C ATOM 178 CD1 LEU A 12 9.257 -3.615 -10.073 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.479 -5.481 -8.955 1.00 0.00 C ATOM 0 H LEU A 12 11.569 -1.272 -6.663 1.00 0.00 H new ATOM 0 HA LEU A 12 9.415 -1.499 -8.681 1.00 0.00 H new ATOM 0 HB2 LEU A 12 11.481 -2.961 -8.640 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.974 -3.591 -7.086 1.00 0.00 H new ATOM 0 HG LEU A 12 8.828 -4.383 -8.111 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.612 -4.336 -10.576 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.708 -2.687 -9.912 1.00 0.00 H new ATOM 0 HD13 LEU A 12 10.131 -3.416 -10.693 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.837 -6.205 -9.458 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.353 -5.279 -9.574 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.800 -5.886 -7.995 1.00 0.00 H new ATOM 191 N ILE A 13 7.618 -2.722 -7.175 1.00 0.00 N ATOM 192 CA ILE A 13 6.529 -3.030 -6.205 1.00 0.00 C ATOM 193 C ILE A 13 6.137 -4.504 -6.348 1.00 0.00 C ATOM 194 O ILE A 13 6.364 -5.292 -5.451 1.00 0.00 O ATOM 195 CB ILE A 13 5.307 -2.125 -6.430 1.00 0.00 C ATOM 196 CG1 ILE A 13 5.099 -1.843 -7.920 1.00 0.00 C ATOM 197 CG2 ILE A 13 5.518 -0.803 -5.694 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.600 -1.883 -8.230 1.00 0.00 C ATOM 0 H ILE A 13 7.429 -2.980 -8.144 1.00 0.00 H new ATOM 0 HA ILE A 13 6.892 -2.841 -5.195 1.00 0.00 H new ATOM 0 HB ILE A 13 4.423 -2.636 -6.047 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.511 -0.868 -8.180 1.00 0.00 H new ATOM 0 HG13 ILE A 13 5.628 -2.583 -8.521 1.00 0.00 H new ATOM 0 HG21 ILE A 13 4.654 -0.157 -5.851 1.00 0.00 H new ATOM 0 HG22 ILE A 13 5.639 -0.995 -4.628 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.412 -0.312 -6.078 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.442 -1.683 -9.290 1.00 0.00 H new ATOM 0 HD12 ILE A 13 3.204 -2.868 -7.984 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.086 -1.126 -7.638 1.00 0.00 H new ATOM 210 N GLY A 14 5.542 -4.894 -7.450 1.00 0.00 N ATOM 211 CA GLY A 14 5.145 -6.328 -7.601 1.00 0.00 C ATOM 212 C GLY A 14 5.384 -6.784 -9.040 1.00 0.00 C ATOM 213 O GLY A 14 5.016 -6.111 -9.982 1.00 0.00 O ATOM 0 H GLY A 14 5.317 -4.290 -8.241 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.720 -6.948 -6.913 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.094 -6.453 -7.340 1.00 0.00 H new ATOM 217 N LYS A 15 6.011 -7.918 -9.218 1.00 0.00 N ATOM 218 CA LYS A 15 6.288 -8.407 -10.597 1.00 0.00 C ATOM 219 C LYS A 15 5.440 -9.645 -10.890 1.00 0.00 C ATOM 220 O LYS A 15 5.510 -10.637 -10.192 1.00 0.00 O ATOM 221 CB LYS A 15 7.771 -8.774 -10.714 1.00 0.00 C ATOM 222 CG LYS A 15 8.063 -9.311 -12.121 1.00 0.00 C ATOM 223 CD LYS A 15 9.076 -10.458 -12.038 1.00 0.00 C ATOM 224 CE LYS A 15 8.514 -11.694 -12.746 1.00 0.00 C ATOM 225 NZ LYS A 15 8.810 -12.909 -11.936 1.00 0.00 N ATOM 0 H LYS A 15 6.342 -8.524 -8.468 1.00 0.00 H new ATOM 0 HA LYS A 15 6.041 -7.623 -11.313 1.00 0.00 H new ATOM 0 HB2 LYS A 15 8.389 -7.899 -10.513 1.00 0.00 H new ATOM 0 HB3 LYS A 15 8.029 -9.525 -9.967 1.00 0.00 H new ATOM 0 HG2 LYS A 15 7.141 -9.661 -12.586 1.00 0.00 H new ATOM 0 HG3 LYS A 15 8.455 -8.512 -12.751 1.00 0.00 H new ATOM 0 HD2 LYS A 15 10.017 -10.159 -12.499 1.00 0.00 H new ATOM 0 HD3 LYS A 15 9.292 -10.691 -10.995 1.00 0.00 H new ATOM 0 HE2 LYS A 15 7.438 -11.589 -12.884 1.00 0.00 H new ATOM 0 HE3 LYS A 15 8.955 -11.789 -13.738 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 8.428 -13.748 -12.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 9.839 -13.011 -11.826 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 8.369 -12.817 -10.998 1.00 0.00 H new ATOM 239 N ASP A 16 4.652 -9.595 -11.929 1.00 0.00 N ATOM 240 CA ASP A 16 3.807 -10.765 -12.293 1.00 0.00 C ATOM 241 C ASP A 16 2.841 -11.101 -11.155 1.00 0.00 C ATOM 242 O ASP A 16 2.581 -12.256 -10.877 1.00 0.00 O ATOM 243 CB ASP A 16 4.703 -11.974 -12.582 1.00 0.00 C ATOM 244 CG ASP A 16 5.183 -11.917 -14.034 1.00 0.00 C ATOM 245 OD1 ASP A 16 5.896 -10.984 -14.366 1.00 0.00 O ATOM 246 OD2 ASP A 16 4.831 -12.808 -14.789 1.00 0.00 O ATOM 0 H ASP A 16 4.558 -8.787 -12.545 1.00 0.00 H new ATOM 0 HA ASP A 16 3.227 -10.518 -13.182 1.00 0.00 H new ATOM 0 HB2 ASP A 16 5.557 -11.977 -11.905 1.00 0.00 H new ATOM 0 HB3 ASP A 16 4.153 -12.898 -12.405 1.00 0.00 H new ATOM 251 N GLY A 17 2.283 -10.109 -10.509 1.00 0.00 N ATOM 252 CA GLY A 17 1.312 -10.386 -9.412 1.00 0.00 C ATOM 253 C GLY A 17 2.035 -10.617 -8.082 1.00 0.00 C ATOM 254 O GLY A 17 2.063 -9.757 -7.222 1.00 0.00 O ATOM 0 H GLY A 17 2.458 -9.121 -10.695 1.00 0.00 H new ATOM 0 HA2 GLY A 17 0.621 -9.549 -9.313 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.716 -11.263 -9.663 1.00 0.00 H new ATOM 258 N HIS A 18 2.592 -11.781 -7.896 1.00 0.00 N ATOM 259 CA HIS A 18 3.284 -12.094 -6.612 1.00 0.00 C ATOM 260 C HIS A 18 4.485 -11.171 -6.405 1.00 0.00 C ATOM 261 O HIS A 18 5.193 -10.837 -7.335 1.00 0.00 O ATOM 262 CB HIS A 18 3.764 -13.547 -6.639 1.00 0.00 C ATOM 263 CG HIS A 18 4.674 -13.755 -7.820 1.00 0.00 C ATOM 264 ND1 HIS A 18 6.028 -13.460 -7.770 1.00 0.00 N ATOM 265 CD2 HIS A 18 4.440 -14.226 -9.088 1.00 0.00 C ATOM 266 CE1 HIS A 18 6.551 -13.753 -8.974 1.00 0.00 C ATOM 267 NE2 HIS A 18 5.626 -14.223 -9.815 1.00 0.00 N ATOM 0 H HIS A 18 2.598 -12.535 -8.583 1.00 0.00 H new ATOM 0 HA HIS A 18 2.582 -11.944 -5.791 1.00 0.00 H new ATOM 0 HB2 HIS A 18 4.291 -13.784 -5.715 1.00 0.00 H new ATOM 0 HB3 HIS A 18 2.910 -14.222 -6.701 1.00 0.00 H new ATOM 0 HD1 HIS A 18 6.535 -13.089 -6.967 1.00 0.00 H new ATOM 0 HD2 HIS A 18 3.481 -14.550 -9.464 1.00 0.00 H new ATOM 0 HE1 HIS A 18 7.592 -13.624 -9.230 1.00 0.00 H new ATOM 275 N LEU A 19 4.723 -10.768 -5.181 1.00 0.00 N ATOM 276 CA LEU A 19 5.888 -9.880 -4.890 1.00 0.00 C ATOM 277 C LEU A 19 7.145 -10.503 -5.506 1.00 0.00 C ATOM 278 O LEU A 19 7.239 -11.710 -5.608 1.00 0.00 O ATOM 279 CB LEU A 19 6.071 -9.760 -3.375 1.00 0.00 C ATOM 280 CG LEU A 19 5.313 -8.537 -2.857 1.00 0.00 C ATOM 281 CD1 LEU A 19 5.114 -8.662 -1.345 1.00 0.00 C ATOM 282 CD2 LEU A 19 6.120 -7.272 -3.159 1.00 0.00 C ATOM 0 H LEU A 19 4.158 -11.017 -4.369 1.00 0.00 H new ATOM 0 HA LEU A 19 5.716 -8.890 -5.312 1.00 0.00 H new ATOM 0 HB2 LEU A 19 5.705 -10.661 -2.883 1.00 0.00 H new ATOM 0 HB3 LEU A 19 7.130 -9.672 -3.133 1.00 0.00 H new ATOM 0 HG LEU A 19 4.342 -8.477 -3.349 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.574 -7.790 -0.976 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.541 -9.563 -1.127 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.085 -8.722 -0.854 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.581 -6.400 -2.790 1.00 0.00 H new ATOM 0 HD22 LEU A 19 7.091 -7.333 -2.667 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.264 -7.181 -4.236 1.00 0.00 H new ATOM 294 N PRO A 20 8.073 -9.674 -5.907 1.00 0.00 N ATOM 295 CA PRO A 20 9.368 -10.081 -6.544 1.00 0.00 C ATOM 296 C PRO A 20 10.319 -10.613 -5.475 1.00 0.00 C ATOM 297 O PRO A 20 11.152 -11.460 -5.738 1.00 0.00 O ATOM 298 CB PRO A 20 9.947 -8.829 -7.203 1.00 0.00 C ATOM 299 CG PRO A 20 9.011 -7.680 -6.888 1.00 0.00 C ATOM 300 CD PRO A 20 8.050 -8.173 -5.814 1.00 0.00 C ATOM 0 HA PRO A 20 9.221 -10.870 -7.282 1.00 0.00 H new ATOM 0 HB2 PRO A 20 10.948 -8.624 -6.825 1.00 0.00 H new ATOM 0 HB3 PRO A 20 10.036 -8.968 -8.280 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.570 -6.812 -6.537 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.467 -7.370 -7.780 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.362 -7.837 -4.825 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.045 -7.786 -5.980 1.00 0.00 H new ATOM 308 N TRP A 21 10.215 -10.112 -4.275 1.00 0.00 N ATOM 309 CA TRP A 21 11.122 -10.569 -3.187 1.00 0.00 C ATOM 310 C TRP A 21 10.301 -11.155 -2.034 1.00 0.00 C ATOM 311 O TRP A 21 9.222 -10.686 -1.727 1.00 0.00 O ATOM 312 CB TRP A 21 11.905 -9.362 -2.673 1.00 0.00 C ATOM 313 CG TRP A 21 10.939 -8.285 -2.295 1.00 0.00 C ATOM 314 CD1 TRP A 21 10.223 -8.250 -1.147 1.00 0.00 C ATOM 315 CD2 TRP A 21 10.557 -7.101 -3.053 1.00 0.00 C ATOM 316 NE1 TRP A 21 9.424 -7.121 -1.153 1.00 0.00 N ATOM 317 CE2 TRP A 21 9.596 -6.379 -2.305 1.00 0.00 C ATOM 318 CE3 TRP A 21 10.946 -6.588 -4.304 1.00 0.00 C ATOM 319 CZ2 TRP A 21 9.041 -5.190 -2.781 1.00 0.00 C ATOM 320 CZ3 TRP A 21 10.390 -5.390 -4.786 1.00 0.00 C ATOM 321 CH2 TRP A 21 9.439 -4.693 -4.026 1.00 0.00 C ATOM 0 H TRP A 21 9.536 -9.402 -4.001 1.00 0.00 H new ATOM 0 HA TRP A 21 11.799 -11.333 -3.570 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.511 -9.644 -1.812 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.590 -9.002 -3.441 1.00 0.00 H new ATOM 0 HD1 TRP A 21 10.268 -8.984 -0.356 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.786 -6.867 -0.399 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.676 -7.118 -4.898 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.309 -4.657 -2.192 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 10.697 -5.004 -5.747 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.015 -3.774 -4.402 1.00 0.00 H new ATOM 332 N HIS A 22 10.808 -12.169 -1.389 1.00 0.00 N ATOM 333 CA HIS A 22 10.065 -12.776 -0.249 1.00 0.00 C ATOM 334 C HIS A 22 10.552 -12.145 1.059 1.00 0.00 C ATOM 335 O HIS A 22 11.527 -12.579 1.639 1.00 0.00 O ATOM 336 CB HIS A 22 10.320 -14.284 -0.216 1.00 0.00 C ATOM 337 CG HIS A 22 9.251 -14.955 0.603 1.00 0.00 C ATOM 338 ND1 HIS A 22 9.550 -15.847 1.620 1.00 0.00 N ATOM 339 CD2 HIS A 22 7.881 -14.872 0.567 1.00 0.00 C ATOM 340 CE1 HIS A 22 8.385 -16.262 2.151 1.00 0.00 C ATOM 341 NE2 HIS A 22 7.337 -15.699 1.546 1.00 0.00 N ATOM 0 H HIS A 22 11.706 -12.604 -1.602 1.00 0.00 H new ATOM 0 HA HIS A 22 8.997 -12.595 -0.369 1.00 0.00 H new ATOM 0 HB2 HIS A 22 10.323 -14.686 -1.229 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.302 -14.488 0.210 1.00 0.00 H new ATOM 0 HD2 HIS A 22 7.312 -14.259 -0.116 1.00 0.00 H new ATOM 0 HE1 HIS A 22 8.308 -16.965 2.967 1.00 0.00 H new ATOM 0 HE2 HIS A 22 6.349 -15.844 1.756 1.00 0.00 H new ATOM 349 N LEU A 23 9.880 -11.125 1.527 1.00 0.00 N ATOM 350 CA LEU A 23 10.305 -10.467 2.798 1.00 0.00 C ATOM 351 C LEU A 23 9.152 -10.516 3.809 1.00 0.00 C ATOM 352 O LEU A 23 8.224 -9.736 3.721 1.00 0.00 O ATOM 353 CB LEU A 23 10.676 -9.004 2.521 1.00 0.00 C ATOM 354 CG LEU A 23 11.303 -8.386 3.775 1.00 0.00 C ATOM 355 CD1 LEU A 23 12.722 -8.928 3.958 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.359 -6.859 3.629 1.00 0.00 C ATOM 0 H LEU A 23 9.056 -10.720 1.084 1.00 0.00 H new ATOM 0 HA LEU A 23 11.170 -10.991 3.204 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.375 -8.947 1.687 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.788 -8.442 2.231 1.00 0.00 H new ATOM 0 HG LEU A 23 10.697 -8.645 4.643 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.167 -8.488 4.850 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.686 -10.012 4.067 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.325 -8.671 3.087 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.806 -6.424 4.523 1.00 0.00 H new ATOM 0 HD22 LEU A 23 11.962 -6.599 2.759 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.349 -6.468 3.501 1.00 0.00 H new ATOM 368 N PRO A 24 9.244 -11.432 4.743 1.00 0.00 N ATOM 369 CA PRO A 24 8.231 -11.655 5.832 1.00 0.00 C ATOM 370 C PRO A 24 8.189 -10.436 6.757 1.00 0.00 C ATOM 371 O PRO A 24 7.138 -10.029 7.213 1.00 0.00 O ATOM 372 CB PRO A 24 8.666 -12.893 6.612 1.00 0.00 C ATOM 373 CG PRO A 24 9.973 -13.378 6.025 1.00 0.00 C ATOM 374 CD PRO A 24 10.367 -12.422 4.905 1.00 0.00 C ATOM 0 HA PRO A 24 7.235 -11.798 5.414 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.788 -12.655 7.669 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.906 -13.672 6.546 1.00 0.00 H new ATOM 0 HG2 PRO A 24 10.748 -13.408 6.791 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.866 -14.392 5.641 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.298 -11.910 5.147 1.00 0.00 H new ATOM 0 HD3 PRO A 24 10.535 -12.967 3.976 1.00 0.00 H new ATOM 382 N ASP A 25 9.324 -9.851 7.035 1.00 0.00 N ATOM 383 CA ASP A 25 9.353 -8.658 7.929 1.00 0.00 C ATOM 384 C ASP A 25 8.531 -7.526 7.306 1.00 0.00 C ATOM 385 O ASP A 25 7.989 -6.688 8.001 1.00 0.00 O ATOM 386 CB ASP A 25 10.800 -8.196 8.114 1.00 0.00 C ATOM 387 CG ASP A 25 10.981 -7.639 9.528 1.00 0.00 C ATOM 388 OD1 ASP A 25 11.171 -8.432 10.435 1.00 0.00 O ATOM 389 OD2 ASP A 25 10.927 -6.430 9.678 1.00 0.00 O ATOM 0 H ASP A 25 10.233 -10.149 6.681 1.00 0.00 H new ATOM 0 HA ASP A 25 8.927 -8.922 8.897 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.483 -9.030 7.950 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.046 -7.432 7.376 1.00 0.00 H new ATOM 394 N ASP A 26 8.434 -7.493 6.003 1.00 0.00 N ATOM 395 CA ASP A 26 7.645 -6.414 5.343 1.00 0.00 C ATOM 396 C ASP A 26 6.154 -6.712 5.513 1.00 0.00 C ATOM 397 O ASP A 26 5.376 -5.840 5.850 1.00 0.00 O ATOM 398 CB ASP A 26 8.004 -6.354 3.853 1.00 0.00 C ATOM 399 CG ASP A 26 7.088 -5.360 3.132 1.00 0.00 C ATOM 400 OD1 ASP A 26 7.067 -4.201 3.522 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.415 -5.781 2.208 1.00 0.00 O ATOM 0 H ASP A 26 8.866 -8.165 5.369 1.00 0.00 H new ATOM 0 HA ASP A 26 7.876 -5.452 5.800 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.045 -6.054 3.733 1.00 0.00 H new ATOM 0 HB3 ASP A 26 7.904 -7.343 3.406 1.00 0.00 H new ATOM 406 N LEU A 27 5.748 -7.937 5.285 1.00 0.00 N ATOM 407 CA LEU A 27 4.305 -8.291 5.438 1.00 0.00 C ATOM 408 C LEU A 27 3.805 -7.816 6.806 1.00 0.00 C ATOM 409 O LEU A 27 2.725 -7.271 6.929 1.00 0.00 O ATOM 410 CB LEU A 27 4.140 -9.810 5.335 1.00 0.00 C ATOM 411 CG LEU A 27 4.200 -10.233 3.865 1.00 0.00 C ATOM 412 CD1 LEU A 27 4.582 -11.712 3.775 1.00 0.00 C ATOM 413 CD2 LEU A 27 2.831 -10.019 3.216 1.00 0.00 C ATOM 0 H LEU A 27 6.354 -8.706 5.000 1.00 0.00 H new ATOM 0 HA LEU A 27 3.726 -7.807 4.651 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.926 -10.311 5.901 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.189 -10.113 5.773 1.00 0.00 H new ATOM 0 HG LEU A 27 4.946 -9.633 3.344 1.00 0.00 H new ATOM 0 HD11 LEU A 27 4.625 -12.014 2.728 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.557 -11.865 4.237 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.836 -12.313 4.296 1.00 0.00 H new ATOM 0 HD21 LEU A 27 2.873 -10.320 2.169 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.084 -10.619 3.736 1.00 0.00 H new ATOM 0 HD23 LEU A 27 2.559 -8.965 3.280 1.00 0.00 H new ATOM 425 N HIS A 28 4.592 -8.006 7.833 1.00 0.00 N ATOM 426 CA HIS A 28 4.173 -7.554 9.191 1.00 0.00 C ATOM 427 C HIS A 28 4.033 -6.031 9.189 1.00 0.00 C ATOM 428 O HIS A 28 3.125 -5.479 9.779 1.00 0.00 O ATOM 429 CB HIS A 28 5.231 -7.965 10.218 1.00 0.00 C ATOM 430 CG HIS A 28 5.405 -9.459 10.191 1.00 0.00 C ATOM 431 ND1 HIS A 28 4.327 -10.329 10.205 1.00 0.00 N ATOM 432 CD2 HIS A 28 6.526 -10.251 10.152 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.817 -11.582 10.175 1.00 0.00 C ATOM 434 NE2 HIS A 28 6.153 -11.591 10.142 1.00 0.00 N ATOM 0 H HIS A 28 5.507 -8.455 7.789 1.00 0.00 H new ATOM 0 HA HIS A 28 3.220 -8.013 9.452 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.178 -7.474 9.996 1.00 0.00 H new ATOM 0 HB3 HIS A 28 4.930 -7.641 11.215 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.543 -9.888 10.132 1.00 0.00 H new ATOM 0 HE1 HIS A 28 4.205 -12.472 10.177 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.767 -12.405 10.115 1.00 0.00 H new ATOM 442 N TYR A 29 4.925 -5.350 8.518 1.00 0.00 N ATOM 443 CA TYR A 29 4.847 -3.862 8.460 1.00 0.00 C ATOM 444 C TYR A 29 3.537 -3.455 7.785 1.00 0.00 C ATOM 445 O TYR A 29 2.945 -2.443 8.105 1.00 0.00 O ATOM 446 CB TYR A 29 6.027 -3.325 7.647 1.00 0.00 C ATOM 447 CG TYR A 29 6.106 -1.824 7.793 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.501 -1.260 9.012 1.00 0.00 C ATOM 449 CD2 TYR A 29 5.788 -0.997 6.709 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.578 0.131 9.147 1.00 0.00 C ATOM 451 CE2 TYR A 29 5.864 0.394 6.844 1.00 0.00 C ATOM 452 CZ TYR A 29 6.260 0.958 8.063 1.00 0.00 C ATOM 453 OH TYR A 29 6.338 2.330 8.196 1.00 0.00 O ATOM 0 H TYR A 29 5.706 -5.762 8.007 1.00 0.00 H new ATOM 0 HA TYR A 29 4.883 -3.451 9.469 1.00 0.00 H new ATOM 0 HB2 TYR A 29 6.955 -3.783 7.990 1.00 0.00 H new ATOM 0 HB3 TYR A 29 5.909 -3.592 6.597 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.746 -1.898 9.848 1.00 0.00 H new ATOM 0 HD2 TYR A 29 5.484 -1.432 5.769 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.883 0.566 10.087 1.00 0.00 H new ATOM 0 HE2 TYR A 29 5.617 1.032 6.008 1.00 0.00 H new ATOM 0 HH TYR A 29 5.473 2.730 7.968 1.00 0.00 H new ATOM 463 N PHE A 30 3.086 -4.243 6.848 1.00 0.00 N ATOM 464 CA PHE A 30 1.818 -3.918 6.138 1.00 0.00 C ATOM 465 C PHE A 30 0.635 -4.088 7.095 1.00 0.00 C ATOM 466 O PHE A 30 -0.208 -3.221 7.214 1.00 0.00 O ATOM 467 CB PHE A 30 1.648 -4.858 4.944 1.00 0.00 C ATOM 468 CG PHE A 30 0.409 -4.471 4.175 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.325 -3.211 3.572 1.00 0.00 C ATOM 470 CD2 PHE A 30 -0.655 -5.370 4.070 1.00 0.00 C ATOM 471 CE1 PHE A 30 -0.826 -2.852 2.862 1.00 0.00 C ATOM 472 CE2 PHE A 30 -1.805 -5.011 3.361 1.00 0.00 C ATOM 473 CZ PHE A 30 -1.891 -3.753 2.757 1.00 0.00 C ATOM 0 H PHE A 30 3.544 -5.102 6.543 1.00 0.00 H new ATOM 0 HA PHE A 30 1.853 -2.887 5.787 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.523 -4.804 4.297 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.569 -5.890 5.287 1.00 0.00 H new ATOM 0 HD1 PHE A 30 1.148 -2.516 3.655 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.589 -6.342 4.536 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -0.892 -1.880 2.395 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.628 -5.706 3.280 1.00 0.00 H new ATOM 0 HZ PHE A 30 -2.780 -3.477 2.209 1.00 0.00 H new ATOM 483 N ARG A 31 0.566 -5.200 7.776 1.00 0.00 N ATOM 484 CA ARG A 31 -0.562 -5.432 8.723 1.00 0.00 C ATOM 485 C ARG A 31 -0.500 -4.406 9.858 1.00 0.00 C ATOM 486 O ARG A 31 -1.510 -3.887 10.293 1.00 0.00 O ATOM 487 CB ARG A 31 -0.447 -6.849 9.297 1.00 0.00 C ATOM 488 CG ARG A 31 -1.584 -7.109 10.292 1.00 0.00 C ATOM 489 CD ARG A 31 -1.037 -7.849 11.517 1.00 0.00 C ATOM 490 NE ARG A 31 0.013 -7.015 12.179 1.00 0.00 N ATOM 491 CZ ARG A 31 1.287 -7.324 12.086 1.00 0.00 C ATOM 492 NH1 ARG A 31 1.684 -8.364 11.396 1.00 0.00 N ATOM 493 NH2 ARG A 31 2.174 -6.576 12.684 1.00 0.00 N ATOM 0 H ARG A 31 1.244 -5.960 7.717 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.512 -5.325 8.200 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.485 -7.581 8.490 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.516 -6.972 9.793 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -2.037 -6.165 10.597 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.368 -7.700 9.818 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -1.845 -8.059 12.218 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.618 -8.809 11.217 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.265 -6.191 12.713 1.00 0.00 H new ATOM 0 HH11 ARG A 31 1.000 -8.951 10.919 1.00 0.00 H new ATOM 0 HH12 ARG A 31 2.677 -8.587 11.336 1.00 0.00 H new ATOM 0 HH21 ARG A 31 1.876 -5.760 13.218 1.00 0.00 H new ATOM 0 HH22 ARG A 31 3.165 -6.808 12.617 1.00 0.00 H new ATOM 507 N ALA A 32 0.675 -4.121 10.352 1.00 0.00 N ATOM 508 CA ALA A 32 0.803 -3.143 11.469 1.00 0.00 C ATOM 509 C ALA A 32 0.465 -1.727 10.985 1.00 0.00 C ATOM 510 O ALA A 32 -0.173 -0.961 11.680 1.00 0.00 O ATOM 511 CB ALA A 32 2.240 -3.167 11.994 1.00 0.00 C ATOM 0 H ALA A 32 1.554 -4.525 10.028 1.00 0.00 H new ATOM 0 HA ALA A 32 0.108 -3.419 12.262 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.341 -2.453 12.812 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.479 -4.168 12.354 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.925 -2.897 11.191 1.00 0.00 H new ATOM 517 N GLN A 33 0.910 -1.364 9.813 1.00 0.00 N ATOM 518 CA GLN A 33 0.641 0.014 9.298 1.00 0.00 C ATOM 519 C GLN A 33 -0.847 0.208 8.974 1.00 0.00 C ATOM 520 O GLN A 33 -1.300 1.320 8.780 1.00 0.00 O ATOM 521 CB GLN A 33 1.467 0.244 8.032 1.00 0.00 C ATOM 522 CG GLN A 33 2.943 0.389 8.408 1.00 0.00 C ATOM 523 CD GLN A 33 3.288 1.872 8.559 1.00 0.00 C ATOM 524 OE1 GLN A 33 3.940 2.443 7.709 1.00 0.00 O ATOM 525 NE2 GLN A 33 2.877 2.523 9.612 1.00 0.00 N ATOM 0 H GLN A 33 1.450 -1.962 9.187 1.00 0.00 H new ATOM 0 HA GLN A 33 0.918 0.731 10.071 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.336 -0.590 7.343 1.00 0.00 H new ATOM 0 HB3 GLN A 33 1.122 1.140 7.517 1.00 0.00 H new ATOM 0 HG2 GLN A 33 3.145 -0.139 9.340 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.571 -0.065 7.641 1.00 0.00 H new ATOM 0 HE21 GLN A 33 2.329 2.044 10.326 1.00 0.00 H new ATOM 0 HE22 GLN A 33 3.103 3.512 9.721 1.00 0.00 H new ATOM 534 N THR A 34 -1.610 -0.850 8.893 1.00 0.00 N ATOM 535 CA THR A 34 -3.059 -0.689 8.561 1.00 0.00 C ATOM 536 C THR A 34 -3.930 -1.220 9.702 1.00 0.00 C ATOM 537 O THR A 34 -5.042 -1.662 9.488 1.00 0.00 O ATOM 538 CB THR A 34 -3.377 -1.456 7.276 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.864 -2.777 7.375 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.734 -0.743 6.085 1.00 0.00 C ATOM 0 H THR A 34 -1.298 -1.810 9.040 1.00 0.00 H new ATOM 0 HA THR A 34 -3.272 0.371 8.420 1.00 0.00 H new ATOM 0 HB THR A 34 -4.457 -1.497 7.133 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.891 -2.759 7.263 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.960 -1.289 5.169 1.00 0.00 H new ATOM 0 HG22 THR A 34 -3.129 0.270 6.011 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.654 -0.702 6.226 1.00 0.00 H new ATOM 548 N VAL A 35 -3.440 -1.180 10.911 1.00 0.00 N ATOM 549 CA VAL A 35 -4.248 -1.683 12.060 1.00 0.00 C ATOM 550 C VAL A 35 -5.304 -0.646 12.454 1.00 0.00 C ATOM 551 O VAL A 35 -4.987 0.415 12.957 1.00 0.00 O ATOM 552 CB VAL A 35 -3.328 -1.945 13.254 1.00 0.00 C ATOM 553 CG1 VAL A 35 -2.335 -3.049 12.896 1.00 0.00 C ATOM 554 CG2 VAL A 35 -2.562 -0.663 13.606 1.00 0.00 C ATOM 0 H VAL A 35 -2.516 -0.821 11.153 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.745 -2.608 11.767 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.926 -2.255 14.111 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -1.678 -3.237 13.745 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -2.878 -3.961 12.648 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.739 -2.738 12.038 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -1.907 -0.852 14.457 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.964 -0.350 12.750 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.270 0.125 13.861 1.00 0.00 H new ATOM 564 N GLY A 36 -6.558 -0.952 12.247 1.00 0.00 N ATOM 565 CA GLY A 36 -7.637 0.005 12.629 1.00 0.00 C ATOM 566 C GLY A 36 -7.794 1.101 11.569 1.00 0.00 C ATOM 567 O GLY A 36 -8.421 2.113 11.813 1.00 0.00 O ATOM 0 H GLY A 36 -6.881 -1.825 11.829 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.579 -0.531 12.747 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.404 0.456 13.593 1.00 0.00 H new ATOM 571 N LYS A 37 -7.229 0.922 10.403 1.00 0.00 N ATOM 572 CA LYS A 37 -7.355 1.972 9.348 1.00 0.00 C ATOM 573 C LYS A 37 -7.982 1.370 8.085 1.00 0.00 C ATOM 574 O LYS A 37 -8.034 0.167 7.921 1.00 0.00 O ATOM 575 CB LYS A 37 -5.970 2.529 9.019 1.00 0.00 C ATOM 576 CG LYS A 37 -5.441 3.321 10.217 1.00 0.00 C ATOM 577 CD LYS A 37 -4.106 3.971 9.850 1.00 0.00 C ATOM 578 CE LYS A 37 -4.351 5.397 9.350 1.00 0.00 C ATOM 579 NZ LYS A 37 -3.112 6.211 9.526 1.00 0.00 N ATOM 0 H LYS A 37 -6.689 0.099 10.136 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.994 2.776 9.714 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.287 1.715 8.777 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.024 3.171 8.140 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -6.162 4.085 10.508 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -5.312 2.661 11.075 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.447 3.987 10.718 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.604 3.386 9.080 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -4.640 5.380 8.299 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -5.176 5.849 9.900 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -3.281 7.179 9.186 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -2.855 6.238 10.533 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -2.336 5.784 8.982 1.00 0.00 H new ATOM 593 N ILE A 38 -8.463 2.202 7.193 1.00 0.00 N ATOM 594 CA ILE A 38 -9.088 1.683 5.938 1.00 0.00 C ATOM 595 C ILE A 38 -7.985 1.277 4.954 1.00 0.00 C ATOM 596 O ILE A 38 -7.122 2.064 4.626 1.00 0.00 O ATOM 597 CB ILE A 38 -9.959 2.778 5.312 1.00 0.00 C ATOM 598 CG1 ILE A 38 -10.914 3.346 6.368 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.775 2.186 4.164 1.00 0.00 C ATOM 600 CD1 ILE A 38 -11.664 4.548 5.785 1.00 0.00 C ATOM 0 H ILE A 38 -8.449 3.218 7.281 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.708 0.816 6.167 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.318 3.575 4.935 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.622 2.580 6.683 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -10.356 3.647 7.254 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.394 2.964 3.719 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.101 1.782 3.409 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.413 1.388 4.545 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -12.343 4.952 6.536 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -10.948 5.316 5.492 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.235 4.232 4.912 1.00 0.00 H new ATOM 612 N MET A 39 -7.999 0.052 4.491 1.00 0.00 N ATOM 613 CA MET A 39 -6.941 -0.406 3.538 1.00 0.00 C ATOM 614 C MET A 39 -7.514 -0.491 2.119 1.00 0.00 C ATOM 615 O MET A 39 -8.376 -1.300 1.835 1.00 0.00 O ATOM 616 CB MET A 39 -6.441 -1.786 3.970 1.00 0.00 C ATOM 617 CG MET A 39 -5.291 -2.229 3.062 1.00 0.00 C ATOM 618 SD MET A 39 -5.272 -4.035 2.957 1.00 0.00 S ATOM 619 CE MET A 39 -6.879 -4.230 2.149 1.00 0.00 C ATOM 0 H MET A 39 -8.698 -0.651 4.732 1.00 0.00 H new ATOM 0 HA MET A 39 -6.116 0.306 3.545 1.00 0.00 H new ATOM 0 HB2 MET A 39 -6.106 -1.753 5.007 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.255 -2.510 3.921 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.410 -1.797 2.068 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.341 -1.866 3.456 1.00 0.00 H new ATOM 0 HE1 MET A 39 -6.909 -5.185 1.625 1.00 0.00 H new ATOM 0 HE2 MET A 39 -7.669 -4.203 2.899 1.00 0.00 H new ATOM 0 HE3 MET A 39 -7.028 -3.420 1.435 1.00 0.00 H new ATOM 629 N VAL A 40 -7.052 0.352 1.231 1.00 0.00 N ATOM 630 CA VAL A 40 -7.577 0.339 -0.168 1.00 0.00 C ATOM 631 C VAL A 40 -6.712 -0.557 -1.071 1.00 0.00 C ATOM 632 O VAL A 40 -5.537 -0.301 -1.288 1.00 0.00 O ATOM 633 CB VAL A 40 -7.568 1.770 -0.709 1.00 0.00 C ATOM 634 CG1 VAL A 40 -8.226 1.801 -2.087 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.345 2.679 0.248 1.00 0.00 C ATOM 0 H VAL A 40 -6.332 1.051 1.415 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.591 -0.060 -0.163 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.539 2.120 -0.792 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.219 2.821 -2.471 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.674 1.153 -2.768 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.255 1.451 -2.007 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.340 3.699 -0.135 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.373 2.327 0.330 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.875 2.658 1.231 1.00 0.00 H new ATOM 645 N VAL A 41 -7.298 -1.600 -1.609 1.00 0.00 N ATOM 646 CA VAL A 41 -6.542 -2.521 -2.513 1.00 0.00 C ATOM 647 C VAL A 41 -7.321 -2.709 -3.819 1.00 0.00 C ATOM 648 O VAL A 41 -8.485 -3.058 -3.811 1.00 0.00 O ATOM 649 CB VAL A 41 -6.368 -3.885 -1.841 1.00 0.00 C ATOM 650 CG1 VAL A 41 -5.259 -3.803 -0.794 1.00 0.00 C ATOM 651 CG2 VAL A 41 -7.680 -4.297 -1.169 1.00 0.00 C ATOM 0 H VAL A 41 -8.275 -1.854 -1.459 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.563 -2.088 -2.721 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.099 -4.627 -2.593 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.137 -4.775 -0.317 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.325 -3.515 -1.276 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.523 -3.060 -0.041 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -7.555 -5.268 -0.691 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -7.953 -3.556 -0.418 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.469 -4.361 -1.919 1.00 0.00 H new ATOM 661 N GLY A 42 -6.691 -2.475 -4.940 1.00 0.00 N ATOM 662 CA GLY A 42 -7.396 -2.628 -6.247 1.00 0.00 C ATOM 663 C GLY A 42 -7.769 -4.095 -6.494 1.00 0.00 C ATOM 664 O GLY A 42 -7.183 -5.003 -5.938 1.00 0.00 O ATOM 0 H GLY A 42 -5.716 -2.184 -5.007 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.296 -2.013 -6.255 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.758 -2.269 -7.054 1.00 0.00 H new ATOM 668 N ARG A 43 -8.759 -4.319 -7.320 1.00 0.00 N ATOM 669 CA ARG A 43 -9.220 -5.710 -7.620 1.00 0.00 C ATOM 670 C ARG A 43 -8.049 -6.624 -8.004 1.00 0.00 C ATOM 671 O ARG A 43 -8.145 -7.830 -7.889 1.00 0.00 O ATOM 672 CB ARG A 43 -10.213 -5.662 -8.787 1.00 0.00 C ATOM 673 CG ARG A 43 -10.873 -7.034 -8.965 1.00 0.00 C ATOM 674 CD ARG A 43 -10.481 -7.627 -10.322 1.00 0.00 C ATOM 675 NE ARG A 43 -11.011 -6.764 -11.421 1.00 0.00 N ATOM 676 CZ ARG A 43 -11.060 -7.209 -12.656 1.00 0.00 C ATOM 677 NH1 ARG A 43 -10.650 -8.416 -12.950 1.00 0.00 N ATOM 678 NH2 ARG A 43 -11.524 -6.440 -13.601 1.00 0.00 N ATOM 0 H ARG A 43 -9.275 -3.586 -7.807 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.689 -6.114 -6.723 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -10.974 -4.904 -8.598 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.697 -5.375 -9.703 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -10.563 -7.703 -8.162 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -11.957 -6.938 -8.899 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.396 -7.703 -10.397 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -10.878 -8.638 -10.416 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.338 -5.821 -11.210 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -10.287 -9.024 -12.216 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.694 -8.749 -13.913 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -11.847 -5.498 -13.380 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.564 -6.780 -14.562 1.00 0.00 H new ATOM 692 N ARG A 44 -6.955 -6.083 -8.470 1.00 0.00 N ATOM 693 CA ARG A 44 -5.810 -6.957 -8.865 1.00 0.00 C ATOM 694 C ARG A 44 -5.070 -7.450 -7.618 1.00 0.00 C ATOM 695 O ARG A 44 -4.777 -8.625 -7.481 1.00 0.00 O ATOM 696 CB ARG A 44 -4.848 -6.160 -9.752 1.00 0.00 C ATOM 697 CG ARG A 44 -5.083 -6.515 -11.224 1.00 0.00 C ATOM 698 CD ARG A 44 -3.791 -7.059 -11.838 1.00 0.00 C ATOM 699 NE ARG A 44 -3.975 -7.238 -13.309 1.00 0.00 N ATOM 700 CZ ARG A 44 -4.528 -8.326 -13.791 1.00 0.00 C ATOM 701 NH1 ARG A 44 -4.933 -9.285 -12.997 1.00 0.00 N ATOM 702 NH2 ARG A 44 -4.678 -8.453 -15.081 1.00 0.00 N ATOM 0 H ARG A 44 -6.804 -5.082 -8.594 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.189 -7.819 -9.415 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.998 -5.091 -9.598 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -3.817 -6.380 -9.476 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -5.877 -7.258 -11.306 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -5.414 -5.633 -11.772 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -2.967 -6.372 -11.645 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -3.528 -8.010 -11.375 1.00 0.00 H new ATOM 0 HE ARG A 44 -3.667 -6.505 -13.948 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -4.821 -9.193 -11.987 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -5.361 -10.124 -13.388 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -4.366 -7.710 -15.706 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -5.107 -9.295 -15.464 1.00 0.00 H new ATOM 716 N THR A 45 -4.769 -6.569 -6.703 1.00 0.00 N ATOM 717 CA THR A 45 -4.049 -7.000 -5.472 1.00 0.00 C ATOM 718 C THR A 45 -4.988 -7.839 -4.600 1.00 0.00 C ATOM 719 O THR A 45 -4.647 -8.930 -4.184 1.00 0.00 O ATOM 720 CB THR A 45 -3.578 -5.771 -4.691 1.00 0.00 C ATOM 721 OG1 THR A 45 -2.696 -5.006 -5.502 1.00 0.00 O ATOM 722 CG2 THR A 45 -2.850 -6.219 -3.424 1.00 0.00 C ATOM 0 H THR A 45 -4.989 -5.574 -6.754 1.00 0.00 H new ATOM 0 HA THR A 45 -3.182 -7.599 -5.751 1.00 0.00 H new ATOM 0 HB THR A 45 -4.439 -5.162 -4.416 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.170 -4.702 -6.304 1.00 0.00 H new ATOM 0 HG21 THR A 45 -2.515 -5.343 -2.868 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.527 -6.805 -2.803 1.00 0.00 H new ATOM 0 HG23 THR A 45 -1.988 -6.828 -3.696 1.00 0.00 H new ATOM 730 N TYR A 46 -6.168 -7.346 -4.321 1.00 0.00 N ATOM 731 CA TYR A 46 -7.128 -8.123 -3.478 1.00 0.00 C ATOM 732 C TYR A 46 -7.300 -9.529 -4.062 1.00 0.00 C ATOM 733 O TYR A 46 -7.499 -10.489 -3.344 1.00 0.00 O ATOM 734 CB TYR A 46 -8.480 -7.406 -3.464 1.00 0.00 C ATOM 735 CG TYR A 46 -9.418 -8.102 -2.504 1.00 0.00 C ATOM 736 CD1 TYR A 46 -9.429 -7.743 -1.152 1.00 0.00 C ATOM 737 CD2 TYR A 46 -10.282 -9.100 -2.970 1.00 0.00 C ATOM 738 CE1 TYR A 46 -10.301 -8.382 -0.265 1.00 0.00 C ATOM 739 CE2 TYR A 46 -11.156 -9.738 -2.082 1.00 0.00 C ATOM 740 CZ TYR A 46 -11.165 -9.379 -0.730 1.00 0.00 C ATOM 741 OH TYR A 46 -12.027 -10.009 0.145 1.00 0.00 O ATOM 0 H TYR A 46 -6.509 -6.439 -4.640 1.00 0.00 H new ATOM 0 HA TYR A 46 -6.744 -8.200 -2.461 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.347 -6.366 -3.167 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -8.909 -7.400 -4.466 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -8.764 -6.972 -0.793 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.274 -9.377 -4.014 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -10.307 -8.106 0.779 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.823 -10.508 -2.441 1.00 0.00 H new ATOM 0 HH TYR A 46 -12.558 -10.674 -0.341 1.00 0.00 H new ATOM 751 N GLU A 47 -7.215 -9.654 -5.360 1.00 0.00 N ATOM 752 CA GLU A 47 -7.364 -10.995 -5.994 1.00 0.00 C ATOM 753 C GLU A 47 -6.064 -11.787 -5.821 1.00 0.00 C ATOM 754 O GLU A 47 -6.048 -12.999 -5.917 1.00 0.00 O ATOM 755 CB GLU A 47 -7.663 -10.822 -7.486 1.00 0.00 C ATOM 756 CG GLU A 47 -9.179 -10.752 -7.703 1.00 0.00 C ATOM 757 CD GLU A 47 -9.631 -11.929 -8.570 1.00 0.00 C ATOM 758 OE1 GLU A 47 -9.535 -13.053 -8.105 1.00 0.00 O ATOM 759 OE2 GLU A 47 -10.064 -11.686 -9.685 1.00 0.00 O ATOM 0 H GLU A 47 -7.049 -8.884 -6.008 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.184 -11.534 -5.519 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.190 -9.914 -7.859 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.243 -11.655 -8.050 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.695 -10.776 -6.743 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.444 -9.811 -8.184 1.00 0.00 H new ATOM 766 N SER A 48 -4.974 -11.112 -5.559 1.00 0.00 N ATOM 767 CA SER A 48 -3.678 -11.825 -5.369 1.00 0.00 C ATOM 768 C SER A 48 -3.376 -11.976 -3.870 1.00 0.00 C ATOM 769 O SER A 48 -2.536 -12.762 -3.478 1.00 0.00 O ATOM 770 CB SER A 48 -2.556 -11.033 -6.044 1.00 0.00 C ATOM 771 OG SER A 48 -2.077 -11.764 -7.165 1.00 0.00 O ATOM 0 H SER A 48 -4.927 -10.097 -5.469 1.00 0.00 H new ATOM 0 HA SER A 48 -3.745 -12.816 -5.818 1.00 0.00 H new ATOM 0 HB2 SER A 48 -2.923 -10.057 -6.361 1.00 0.00 H new ATOM 0 HB3 SER A 48 -1.745 -10.854 -5.338 1.00 0.00 H new ATOM 0 HG SER A 48 -1.359 -11.260 -7.602 1.00 0.00 H new ATOM 777 N PHE A 49 -4.047 -11.225 -3.028 1.00 0.00 N ATOM 778 CA PHE A 49 -3.792 -11.322 -1.554 1.00 0.00 C ATOM 779 C PHE A 49 -3.869 -12.791 -1.105 1.00 0.00 C ATOM 780 O PHE A 49 -4.506 -13.598 -1.752 1.00 0.00 O ATOM 781 CB PHE A 49 -4.853 -10.511 -0.800 1.00 0.00 C ATOM 782 CG PHE A 49 -4.221 -9.294 -0.164 1.00 0.00 C ATOM 783 CD1 PHE A 49 -4.141 -8.094 -0.875 1.00 0.00 C ATOM 784 CD2 PHE A 49 -3.711 -9.370 1.136 1.00 0.00 C ATOM 785 CE1 PHE A 49 -3.550 -6.971 -0.285 1.00 0.00 C ATOM 786 CE2 PHE A 49 -3.117 -8.250 1.722 1.00 0.00 C ATOM 787 CZ PHE A 49 -3.037 -7.051 1.010 1.00 0.00 C ATOM 0 H PHE A 49 -4.761 -10.548 -3.298 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.799 -10.928 -1.337 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.643 -10.204 -1.486 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.319 -11.131 -0.034 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -4.535 -8.033 -1.879 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -3.777 -10.296 1.688 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -3.491 -6.042 -0.832 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -2.720 -8.311 2.725 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.577 -6.185 1.462 1.00 0.00 H new ATOM 797 N PRO A 50 -3.219 -13.094 -0.004 1.00 0.00 N ATOM 798 CA PRO A 50 -3.150 -14.453 0.630 1.00 0.00 C ATOM 799 C PRO A 50 -4.377 -14.691 1.523 1.00 0.00 C ATOM 800 O PRO A 50 -5.106 -15.646 1.342 1.00 0.00 O ATOM 801 CB PRO A 50 -1.875 -14.463 1.473 1.00 0.00 C ATOM 802 CG PRO A 50 -1.388 -13.030 1.571 1.00 0.00 C ATOM 803 CD PRO A 50 -2.410 -12.160 0.848 1.00 0.00 C ATOM 0 HA PRO A 50 -3.139 -15.241 -0.123 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -2.073 -14.870 2.464 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -1.116 -15.096 1.014 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -1.292 -12.726 2.613 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -0.403 -12.926 1.116 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -3.045 -11.631 1.559 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.916 -11.404 0.238 1.00 0.00 H new ATOM 811 N LYS A 51 -4.602 -13.839 2.493 1.00 0.00 N ATOM 812 CA LYS A 51 -5.775 -14.036 3.400 1.00 0.00 C ATOM 813 C LYS A 51 -6.657 -12.782 3.411 1.00 0.00 C ATOM 814 O LYS A 51 -6.367 -11.815 4.088 1.00 0.00 O ATOM 815 CB LYS A 51 -5.271 -14.311 4.823 1.00 0.00 C ATOM 816 CG LYS A 51 -5.689 -15.718 5.262 1.00 0.00 C ATOM 817 CD LYS A 51 -4.442 -16.551 5.569 1.00 0.00 C ATOM 818 CE LYS A 51 -3.927 -16.202 6.967 1.00 0.00 C ATOM 819 NZ LYS A 51 -4.742 -16.918 7.990 1.00 0.00 N ATOM 0 H LYS A 51 -4.028 -13.020 2.695 1.00 0.00 H new ATOM 0 HA LYS A 51 -6.364 -14.880 3.040 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -4.186 -14.217 4.858 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -5.677 -13.570 5.512 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -6.327 -15.660 6.144 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -6.274 -16.196 4.477 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -4.678 -17.614 5.512 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.669 -16.356 4.826 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -2.878 -16.483 7.060 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -3.984 -15.126 7.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -4.845 -16.319 8.834 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -5.682 -17.130 7.599 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -4.268 -17.806 8.252 1.00 0.00 H new ATOM 833 N ARG A 52 -7.739 -12.797 2.679 1.00 0.00 N ATOM 834 CA ARG A 52 -8.644 -11.610 2.659 1.00 0.00 C ATOM 835 C ARG A 52 -9.965 -11.962 3.357 1.00 0.00 C ATOM 836 O ARG A 52 -10.532 -13.006 3.102 1.00 0.00 O ATOM 837 CB ARG A 52 -8.936 -11.210 1.209 1.00 0.00 C ATOM 838 CG ARG A 52 -7.625 -11.126 0.424 1.00 0.00 C ATOM 839 CD ARG A 52 -7.608 -12.199 -0.669 1.00 0.00 C ATOM 840 NE ARG A 52 -8.818 -12.049 -1.529 1.00 0.00 N ATOM 841 CZ ARG A 52 -8.985 -12.808 -2.585 1.00 0.00 C ATOM 842 NH1 ARG A 52 -8.096 -13.712 -2.907 1.00 0.00 N ATOM 843 NH2 ARG A 52 -10.052 -12.662 -3.324 1.00 0.00 N ATOM 0 H ARG A 52 -8.035 -13.579 2.095 1.00 0.00 H new ATOM 0 HA ARG A 52 -8.161 -10.782 3.178 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.602 -11.939 0.747 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.449 -10.249 1.183 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.520 -10.137 -0.022 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -6.778 -11.264 1.096 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.705 -12.105 -1.273 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -7.589 -13.192 -0.219 1.00 0.00 H new ATOM 0 HE ARG A 52 -9.522 -11.349 -1.293 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -7.261 -13.833 -2.334 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -8.238 -14.296 -3.731 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -10.750 -11.960 -3.079 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -10.187 -13.250 -4.147 1.00 0.00 H new ATOM 857 N PRO A 53 -10.429 -11.074 4.206 1.00 0.00 N ATOM 858 CA PRO A 53 -9.798 -9.762 4.582 1.00 0.00 C ATOM 859 C PRO A 53 -8.847 -9.956 5.770 1.00 0.00 C ATOM 860 O PRO A 53 -8.717 -11.039 6.305 1.00 0.00 O ATOM 861 CB PRO A 53 -10.954 -8.853 4.985 1.00 0.00 C ATOM 862 CG PRO A 53 -12.146 -9.750 5.270 1.00 0.00 C ATOM 863 CD PRO A 53 -11.713 -11.184 4.970 1.00 0.00 C ATOM 0 HA PRO A 53 -9.217 -9.342 3.761 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.694 -8.266 5.866 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.185 -8.146 4.188 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.461 -9.653 6.309 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.997 -9.467 4.651 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.572 -11.750 5.891 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -12.471 -11.707 4.387 1.00 0.00 H new ATOM 871 N LEU A 54 -8.181 -8.909 6.180 1.00 0.00 N ATOM 872 CA LEU A 54 -7.235 -9.024 7.328 1.00 0.00 C ATOM 873 C LEU A 54 -7.972 -8.720 8.640 1.00 0.00 C ATOM 874 O LEU A 54 -8.495 -7.637 8.812 1.00 0.00 O ATOM 875 CB LEU A 54 -6.091 -8.024 7.152 1.00 0.00 C ATOM 876 CG LEU A 54 -5.221 -8.445 5.968 1.00 0.00 C ATOM 877 CD1 LEU A 54 -4.614 -7.201 5.313 1.00 0.00 C ATOM 878 CD2 LEU A 54 -4.100 -9.363 6.463 1.00 0.00 C ATOM 0 H LEU A 54 -8.252 -7.978 5.769 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.835 -10.038 7.361 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.491 -7.024 6.985 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.490 -7.980 8.060 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.831 -8.977 5.238 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.993 -7.501 4.469 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.413 -6.548 4.962 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.003 -6.668 6.041 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.478 -9.665 5.620 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.489 -8.831 7.193 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.533 -10.248 6.929 1.00 0.00 H new ATOM 890 N PRO A 55 -7.986 -9.683 9.532 1.00 0.00 N ATOM 891 CA PRO A 55 -8.643 -9.600 10.884 1.00 0.00 C ATOM 892 C PRO A 55 -8.191 -8.329 11.611 1.00 0.00 C ATOM 893 O PRO A 55 -7.107 -7.828 11.391 1.00 0.00 O ATOM 894 CB PRO A 55 -8.211 -10.833 11.672 1.00 0.00 C ATOM 895 CG PRO A 55 -7.393 -11.710 10.750 1.00 0.00 C ATOM 896 CD PRO A 55 -7.359 -11.044 9.380 1.00 0.00 C ATOM 0 HA PRO A 55 -9.728 -9.564 10.785 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -7.624 -10.543 12.543 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -9.082 -11.375 12.041 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -6.382 -11.835 11.139 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -7.833 -12.705 10.680 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -6.334 -10.958 9.019 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -7.905 -11.640 8.649 1.00 0.00 H new ATOM 904 N GLU A 56 -9.013 -7.817 12.491 1.00 0.00 N ATOM 905 CA GLU A 56 -8.642 -6.587 13.256 1.00 0.00 C ATOM 906 C GLU A 56 -8.170 -5.476 12.307 1.00 0.00 C ATOM 907 O GLU A 56 -7.475 -4.564 12.710 1.00 0.00 O ATOM 908 CB GLU A 56 -7.517 -6.925 14.239 1.00 0.00 C ATOM 909 CG GLU A 56 -8.109 -7.178 15.628 1.00 0.00 C ATOM 910 CD GLU A 56 -7.338 -8.306 16.315 1.00 0.00 C ATOM 911 OE1 GLU A 56 -6.241 -8.048 16.783 1.00 0.00 O ATOM 912 OE2 GLU A 56 -7.858 -9.409 16.362 1.00 0.00 O ATOM 0 H GLU A 56 -9.931 -8.200 12.714 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.520 -6.233 13.796 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.974 -7.807 13.898 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -6.799 -6.106 14.282 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -8.056 -6.270 16.228 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -9.163 -7.443 15.543 1.00 0.00 H new ATOM 919 N ARG A 57 -8.538 -5.541 11.054 1.00 0.00 N ATOM 920 CA ARG A 57 -8.104 -4.484 10.094 1.00 0.00 C ATOM 921 C ARG A 57 -9.219 -4.215 9.084 1.00 0.00 C ATOM 922 O ARG A 57 -9.953 -5.106 8.702 1.00 0.00 O ATOM 923 CB ARG A 57 -6.853 -4.953 9.345 1.00 0.00 C ATOM 924 CG ARG A 57 -5.612 -4.735 10.217 1.00 0.00 C ATOM 925 CD ARG A 57 -4.895 -6.070 10.436 1.00 0.00 C ATOM 926 NE ARG A 57 -4.512 -6.195 11.873 1.00 0.00 N ATOM 927 CZ ARG A 57 -4.232 -7.365 12.395 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.280 -8.453 11.668 1.00 0.00 N ATOM 929 NH2 ARG A 57 -3.894 -7.446 13.653 1.00 0.00 N ATOM 0 H ARG A 57 -9.119 -6.278 10.655 1.00 0.00 H new ATOM 0 HA ARG A 57 -7.882 -3.571 10.646 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -6.947 -6.008 9.087 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.752 -4.404 8.409 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -4.939 -4.024 9.738 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -5.900 -4.304 11.176 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.545 -6.896 10.148 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.008 -6.127 9.805 1.00 0.00 H new ATOM 0 HE ARG A 57 -4.467 -5.360 12.457 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.538 -8.397 10.683 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.060 -9.356 12.087 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -3.849 -6.602 14.224 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -3.675 -8.353 14.065 1.00 0.00 H new ATOM 943 N THR A 58 -9.346 -2.992 8.642 1.00 0.00 N ATOM 944 CA THR A 58 -10.406 -2.661 7.648 1.00 0.00 C ATOM 945 C THR A 58 -9.844 -2.855 6.238 1.00 0.00 C ATOM 946 O THR A 58 -8.807 -2.321 5.895 1.00 0.00 O ATOM 947 CB THR A 58 -10.844 -1.206 7.833 1.00 0.00 C ATOM 948 OG1 THR A 58 -11.064 -0.952 9.213 1.00 0.00 O ATOM 949 CG2 THR A 58 -12.135 -0.954 7.053 1.00 0.00 C ATOM 0 H THR A 58 -8.760 -2.207 8.927 1.00 0.00 H new ATOM 0 HA THR A 58 -11.266 -3.314 7.793 1.00 0.00 H new ATOM 0 HB THR A 58 -10.064 -0.542 7.460 1.00 0.00 H new ATOM 0 HG1 THR A 58 -10.284 -0.493 9.590 1.00 0.00 H new ATOM 0 HG21 THR A 58 -12.444 0.083 7.187 1.00 0.00 H new ATOM 0 HG22 THR A 58 -11.964 -1.148 5.994 1.00 0.00 H new ATOM 0 HG23 THR A 58 -12.918 -1.617 7.422 1.00 0.00 H new ATOM 957 N ASN A 59 -10.515 -3.621 5.421 1.00 0.00 N ATOM 958 CA ASN A 59 -10.015 -3.861 4.037 1.00 0.00 C ATOM 959 C ASN A 59 -11.062 -3.398 3.023 1.00 0.00 C ATOM 960 O ASN A 59 -12.209 -3.797 3.082 1.00 0.00 O ATOM 961 CB ASN A 59 -9.762 -5.358 3.845 1.00 0.00 C ATOM 962 CG ASN A 59 -8.656 -5.825 4.793 1.00 0.00 C ATOM 963 OD1 ASN A 59 -7.607 -6.248 4.353 1.00 0.00 O ATOM 964 ND2 ASN A 59 -8.849 -5.776 6.084 1.00 0.00 N ATOM 0 H ASN A 59 -11.390 -4.092 5.653 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.090 -3.304 3.886 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -10.677 -5.918 4.036 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.476 -5.558 2.812 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -8.118 -6.093 6.721 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -9.730 -5.421 6.455 1.00 0.00 H new ATOM 971 N VAL A 60 -10.681 -2.567 2.088 1.00 0.00 N ATOM 972 CA VAL A 60 -11.657 -2.089 1.067 1.00 0.00 C ATOM 973 C VAL A 60 -11.141 -2.460 -0.326 1.00 0.00 C ATOM 974 O VAL A 60 -9.976 -2.291 -0.628 1.00 0.00 O ATOM 975 CB VAL A 60 -11.798 -0.568 1.169 1.00 0.00 C ATOM 976 CG1 VAL A 60 -12.968 -0.100 0.299 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.054 -0.174 2.627 1.00 0.00 C ATOM 0 H VAL A 60 -9.735 -2.199 1.988 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.628 -2.554 1.238 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.879 -0.096 0.822 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -13.066 0.983 0.373 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -12.783 -0.377 -0.739 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -13.888 -0.572 0.642 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.154 0.909 2.699 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -12.972 -0.647 2.976 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.218 -0.503 3.245 1.00 0.00 H new ATOM 987 N VAL A 61 -11.991 -2.977 -1.173 1.00 0.00 N ATOM 988 CA VAL A 61 -11.542 -3.373 -2.540 1.00 0.00 C ATOM 989 C VAL A 61 -11.999 -2.327 -3.560 1.00 0.00 C ATOM 990 O VAL A 61 -13.028 -1.701 -3.402 1.00 0.00 O ATOM 991 CB VAL A 61 -12.162 -4.726 -2.907 1.00 0.00 C ATOM 992 CG1 VAL A 61 -11.375 -5.355 -4.057 1.00 0.00 C ATOM 993 CG2 VAL A 61 -12.124 -5.660 -1.695 1.00 0.00 C ATOM 0 H VAL A 61 -12.978 -3.142 -0.977 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.454 -3.445 -2.551 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.197 -4.574 -3.213 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -11.817 -6.317 -4.317 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -11.407 -4.695 -4.924 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.339 -5.502 -3.751 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.566 -6.620 -1.962 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -11.090 -5.810 -1.384 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.689 -5.216 -0.875 1.00 0.00 H new ATOM 1003 N LEU A 62 -11.245 -2.146 -4.612 1.00 0.00 N ATOM 1004 CA LEU A 62 -11.635 -1.155 -5.656 1.00 0.00 C ATOM 1005 C LEU A 62 -11.786 -1.881 -6.994 1.00 0.00 C ATOM 1006 O LEU A 62 -10.889 -2.568 -7.443 1.00 0.00 O ATOM 1007 CB LEU A 62 -10.556 -0.070 -5.773 1.00 0.00 C ATOM 1008 CG LEU A 62 -11.126 1.274 -5.308 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -10.919 1.419 -3.805 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -10.401 2.419 -6.019 1.00 0.00 C ATOM 0 H LEU A 62 -10.373 -2.644 -4.793 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.579 -0.684 -5.382 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.690 -0.338 -5.168 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.213 0.006 -6.805 1.00 0.00 H new ATOM 0 HG LEU A 62 -12.189 1.311 -5.544 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.324 2.375 -3.472 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -11.431 0.608 -3.287 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -9.854 1.378 -3.579 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -10.810 3.372 -5.685 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.338 2.378 -5.784 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -10.538 2.323 -7.096 1.00 0.00 H new ATOM 1022 N THR A 63 -12.919 -1.741 -7.629 1.00 0.00 N ATOM 1023 CA THR A 63 -13.133 -2.432 -8.933 1.00 0.00 C ATOM 1024 C THR A 63 -13.991 -1.555 -9.846 1.00 0.00 C ATOM 1025 O THR A 63 -14.704 -0.680 -9.396 1.00 0.00 O ATOM 1026 CB THR A 63 -13.842 -3.768 -8.694 1.00 0.00 C ATOM 1027 OG1 THR A 63 -14.199 -4.342 -9.943 1.00 0.00 O ATOM 1028 CG2 THR A 63 -15.104 -3.541 -7.859 1.00 0.00 C ATOM 0 H THR A 63 -13.704 -1.179 -7.301 1.00 0.00 H new ATOM 0 HA THR A 63 -12.169 -2.612 -9.408 1.00 0.00 H new ATOM 0 HB THR A 63 -13.172 -4.441 -8.159 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.421 -4.338 -10.539 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.606 -4.494 -7.691 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.831 -3.101 -6.900 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.775 -2.866 -8.390 1.00 0.00 H new ATOM 1036 N HIS A 64 -13.916 -1.781 -11.130 1.00 0.00 N ATOM 1037 CA HIS A 64 -14.714 -0.961 -12.086 1.00 0.00 C ATOM 1038 C HIS A 64 -16.061 -1.639 -12.367 1.00 0.00 C ATOM 1039 O HIS A 64 -16.887 -1.111 -13.086 1.00 0.00 O ATOM 1040 CB HIS A 64 -13.937 -0.816 -13.397 1.00 0.00 C ATOM 1041 CG HIS A 64 -13.167 0.476 -13.386 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -13.796 1.711 -13.398 1.00 0.00 N ATOM 1043 CD2 HIS A 64 -11.820 0.742 -13.365 1.00 0.00 C ATOM 1044 CE1 HIS A 64 -12.837 2.655 -13.386 1.00 0.00 C ATOM 1045 NE2 HIS A 64 -11.614 2.118 -13.365 1.00 0.00 N ATOM 0 H HIS A 64 -13.334 -2.501 -11.559 1.00 0.00 H new ATOM 0 HA HIS A 64 -14.894 0.021 -11.650 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.255 -1.657 -13.522 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -14.624 -0.834 -14.243 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.039 -0.004 -13.351 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -13.032 3.717 -13.393 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -10.721 2.611 -13.352 1.00 0.00 H new ATOM 1053 N GLN A 65 -16.292 -2.801 -11.813 1.00 0.00 N ATOM 1054 CA GLN A 65 -17.587 -3.498 -12.058 1.00 0.00 C ATOM 1055 C GLN A 65 -18.639 -2.976 -11.081 1.00 0.00 C ATOM 1056 O GLN A 65 -18.336 -2.248 -10.155 1.00 0.00 O ATOM 1057 CB GLN A 65 -17.413 -5.003 -11.847 1.00 0.00 C ATOM 1058 CG GLN A 65 -16.747 -5.624 -13.076 1.00 0.00 C ATOM 1059 CD GLN A 65 -15.287 -5.943 -12.755 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -14.940 -7.082 -12.511 1.00 0.00 O ATOM 1061 NE2 GLN A 65 -14.410 -4.979 -12.745 1.00 0.00 N ATOM 0 H GLN A 65 -15.641 -3.295 -11.203 1.00 0.00 H new ATOM 0 HA GLN A 65 -17.907 -3.308 -13.083 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.806 -5.188 -10.961 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -18.382 -5.470 -11.672 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -17.273 -6.532 -13.369 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -16.804 -4.937 -13.920 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -14.701 -4.023 -12.950 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -13.433 -5.181 -12.533 1.00 0.00 H new ATOM 1070 N GLU A 66 -19.872 -3.354 -11.274 1.00 0.00 N ATOM 1071 CA GLU A 66 -20.949 -2.894 -10.354 1.00 0.00 C ATOM 1072 C GLU A 66 -21.536 -4.098 -9.606 1.00 0.00 C ATOM 1073 O GLU A 66 -22.330 -3.946 -8.699 1.00 0.00 O ATOM 1074 CB GLU A 66 -22.053 -2.197 -11.158 1.00 0.00 C ATOM 1075 CG GLU A 66 -22.627 -3.158 -12.203 1.00 0.00 C ATOM 1076 CD GLU A 66 -22.965 -2.383 -13.478 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -22.061 -2.153 -14.265 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -24.121 -2.033 -13.646 1.00 0.00 O ATOM 0 H GLU A 66 -20.181 -3.963 -12.031 1.00 0.00 H new ATOM 0 HA GLU A 66 -20.531 -2.191 -9.634 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -22.844 -1.860 -10.488 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -21.652 -1.310 -11.649 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -21.906 -3.945 -12.424 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -23.521 -3.645 -11.813 1.00 0.00 H new ATOM 1085 N ASP A 67 -21.154 -5.293 -9.981 1.00 0.00 N ATOM 1086 CA ASP A 67 -21.693 -6.500 -9.292 1.00 0.00 C ATOM 1087 C ASP A 67 -20.577 -7.194 -8.502 1.00 0.00 C ATOM 1088 O ASP A 67 -20.676 -8.360 -8.176 1.00 0.00 O ATOM 1089 CB ASP A 67 -22.260 -7.469 -10.334 1.00 0.00 C ATOM 1090 CG ASP A 67 -23.783 -7.534 -10.202 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -24.418 -6.509 -10.385 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -24.288 -8.608 -9.920 1.00 0.00 O ATOM 0 H ASP A 67 -20.493 -5.483 -10.734 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.482 -6.198 -8.604 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -21.986 -7.141 -11.337 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -21.830 -8.461 -10.194 1.00 0.00 H new ATOM 1097 N TYR A 68 -19.518 -6.491 -8.188 1.00 0.00 N ATOM 1098 CA TYR A 68 -18.407 -7.121 -7.414 1.00 0.00 C ATOM 1099 C TYR A 68 -18.943 -7.596 -6.059 1.00 0.00 C ATOM 1100 O TYR A 68 -19.435 -6.814 -5.270 1.00 0.00 O ATOM 1101 CB TYR A 68 -17.288 -6.099 -7.196 1.00 0.00 C ATOM 1102 CG TYR A 68 -15.992 -6.822 -6.912 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -15.298 -7.449 -7.954 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -15.486 -6.866 -5.607 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -14.098 -8.121 -7.691 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -14.286 -7.538 -5.344 1.00 0.00 C ATOM 1107 CZ TYR A 68 -13.592 -8.166 -6.386 1.00 0.00 C ATOM 1108 OH TYR A 68 -12.409 -8.827 -6.127 1.00 0.00 O ATOM 0 H TYR A 68 -19.376 -5.511 -8.433 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.011 -7.972 -7.969 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.179 -5.469 -8.079 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.539 -5.441 -6.364 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -15.688 -7.414 -8.960 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.021 -6.382 -4.804 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.563 -8.605 -8.495 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -13.896 -7.572 -4.338 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.200 -8.761 -5.172 1.00 0.00 H new ATOM 1118 N GLN A 69 -18.852 -8.871 -5.784 1.00 0.00 N ATOM 1119 CA GLN A 69 -19.360 -9.394 -4.482 1.00 0.00 C ATOM 1120 C GLN A 69 -18.184 -9.729 -3.561 1.00 0.00 C ATOM 1121 O GLN A 69 -17.416 -10.634 -3.826 1.00 0.00 O ATOM 1122 CB GLN A 69 -20.188 -10.659 -4.724 1.00 0.00 C ATOM 1123 CG GLN A 69 -21.262 -10.381 -5.779 1.00 0.00 C ATOM 1124 CD GLN A 69 -22.607 -10.133 -5.094 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -22.944 -10.797 -4.134 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -23.395 -9.199 -5.551 1.00 0.00 N ATOM 0 H GLN A 69 -18.448 -9.572 -6.405 1.00 0.00 H new ATOM 0 HA GLN A 69 -19.982 -8.633 -4.012 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -19.541 -11.471 -5.056 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.654 -10.983 -3.794 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -20.982 -9.513 -6.377 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -21.342 -11.227 -6.462 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -23.112 -8.642 -6.357 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -24.294 -9.026 -5.102 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.042 -9.013 -2.478 1.00 0.00 N ATOM 1136 CA ALA A 70 -16.921 -9.297 -1.535 1.00 0.00 C ATOM 1137 C ALA A 70 -17.439 -9.239 -0.096 1.00 0.00 C ATOM 1138 O ALA A 70 -17.399 -8.207 0.545 1.00 0.00 O ATOM 1139 CB ALA A 70 -15.817 -8.255 -1.720 1.00 0.00 C ATOM 0 H ALA A 70 -18.654 -8.244 -2.205 1.00 0.00 H new ATOM 0 HA ALA A 70 -16.520 -10.290 -1.739 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.000 -8.465 -1.030 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.447 -8.295 -2.744 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -16.217 -7.261 -1.517 1.00 0.00 H new ATOM 1145 N GLN A 71 -17.923 -10.339 0.417 1.00 0.00 N ATOM 1146 CA GLN A 71 -18.441 -10.347 1.815 1.00 0.00 C ATOM 1147 C GLN A 71 -17.263 -10.345 2.790 1.00 0.00 C ATOM 1148 O GLN A 71 -16.386 -11.184 2.721 1.00 0.00 O ATOM 1149 CB GLN A 71 -19.289 -11.600 2.041 1.00 0.00 C ATOM 1150 CG GLN A 71 -20.539 -11.534 1.163 1.00 0.00 C ATOM 1151 CD GLN A 71 -21.579 -12.529 1.680 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -21.350 -13.722 1.676 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -22.722 -12.086 2.127 1.00 0.00 N ATOM 0 H GLN A 71 -17.982 -11.232 -0.072 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.055 -9.462 1.981 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -18.710 -12.492 1.802 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -19.572 -11.676 3.091 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -20.950 -10.524 1.172 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -20.283 -11.764 0.129 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -22.915 -11.084 2.131 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -23.423 -12.741 2.473 1.00 0.00 H new ATOM 1162 N GLY A 72 -17.233 -9.403 3.692 1.00 0.00 N ATOM 1163 CA GLY A 72 -16.110 -9.336 4.667 1.00 0.00 C ATOM 1164 C GLY A 72 -15.218 -8.146 4.317 1.00 0.00 C ATOM 1165 O GLY A 72 -14.710 -7.462 5.184 1.00 0.00 O ATOM 0 H GLY A 72 -17.940 -8.675 3.795 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -16.497 -9.231 5.681 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -15.533 -10.260 4.640 1.00 0.00 H new ATOM 1169 N ALA A 73 -15.028 -7.890 3.048 1.00 0.00 N ATOM 1170 CA ALA A 73 -14.173 -6.744 2.635 1.00 0.00 C ATOM 1171 C ALA A 73 -15.048 -5.650 2.012 1.00 0.00 C ATOM 1172 O ALA A 73 -15.950 -5.922 1.244 1.00 0.00 O ATOM 1173 CB ALA A 73 -13.140 -7.221 1.611 1.00 0.00 C ATOM 0 H ALA A 73 -15.430 -8.428 2.281 1.00 0.00 H new ATOM 0 HA ALA A 73 -13.659 -6.341 3.508 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.514 -6.382 1.308 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.517 -7.997 2.057 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.653 -7.625 0.738 1.00 0.00 H new ATOM 1179 N VAL A 74 -14.775 -4.416 2.337 1.00 0.00 N ATOM 1180 CA VAL A 74 -15.580 -3.291 1.772 1.00 0.00 C ATOM 1181 C VAL A 74 -15.390 -3.235 0.254 1.00 0.00 C ATOM 1182 O VAL A 74 -14.325 -3.520 -0.255 1.00 0.00 O ATOM 1183 CB VAL A 74 -15.122 -1.968 2.385 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -16.054 -0.844 1.927 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -15.159 -2.070 3.911 1.00 0.00 C ATOM 0 H VAL A 74 -14.027 -4.136 2.971 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.632 -3.454 2.004 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.104 -1.752 2.061 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -15.728 0.100 2.364 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.027 -0.769 0.840 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.072 -1.061 2.251 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -14.832 -1.126 4.347 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.176 -2.287 4.237 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.495 -2.870 4.238 1.00 0.00 H new ATOM 1195 N VAL A 75 -16.420 -2.882 -0.473 1.00 0.00 N ATOM 1196 CA VAL A 75 -16.297 -2.817 -1.960 1.00 0.00 C ATOM 1197 C VAL A 75 -16.716 -1.430 -2.461 1.00 0.00 C ATOM 1198 O VAL A 75 -17.769 -0.928 -2.120 1.00 0.00 O ATOM 1199 CB VAL A 75 -17.206 -3.873 -2.594 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -16.960 -3.918 -4.103 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -16.901 -5.247 -1.986 1.00 0.00 C ATOM 0 H VAL A 75 -17.338 -2.637 -0.102 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.260 -3.004 -2.238 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.248 -3.615 -2.402 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -17.607 -4.670 -4.555 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.179 -2.942 -4.537 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -15.918 -4.174 -4.294 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.549 -5.997 -2.439 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -15.859 -5.506 -2.176 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.077 -5.216 -0.911 1.00 0.00 H new ATOM 1211 N VAL A 76 -15.900 -0.814 -3.277 1.00 0.00 N ATOM 1212 CA VAL A 76 -16.246 0.535 -3.813 1.00 0.00 C ATOM 1213 C VAL A 76 -15.918 0.579 -5.309 1.00 0.00 C ATOM 1214 O VAL A 76 -15.044 -0.122 -5.779 1.00 0.00 O ATOM 1215 CB VAL A 76 -15.428 1.604 -3.084 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -15.772 1.587 -1.593 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -13.934 1.318 -3.267 1.00 0.00 C ATOM 0 H VAL A 76 -15.007 -1.189 -3.596 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.308 0.727 -3.660 1.00 0.00 H new ATOM 0 HB VAL A 76 -15.664 2.584 -3.498 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.188 2.349 -1.076 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -16.834 1.793 -1.462 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -15.539 0.607 -1.177 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.352 2.079 -2.748 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -13.698 0.337 -2.855 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.688 1.334 -4.329 1.00 0.00 H new ATOM 1227 N HIS A 77 -16.611 1.392 -6.062 1.00 0.00 N ATOM 1228 CA HIS A 77 -16.333 1.471 -7.526 1.00 0.00 C ATOM 1229 C HIS A 77 -16.077 2.925 -7.918 1.00 0.00 C ATOM 1230 O HIS A 77 -16.297 3.316 -9.048 1.00 0.00 O ATOM 1231 CB HIS A 77 -17.541 0.956 -8.313 1.00 0.00 C ATOM 1232 CG HIS A 77 -17.992 -0.362 -7.748 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -17.111 -1.405 -7.527 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -19.225 -0.821 -7.356 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -17.817 -2.434 -7.024 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -19.112 -2.131 -6.900 1.00 0.00 N ATOM 0 H HIS A 77 -17.356 2.003 -5.727 1.00 0.00 H new ATOM 0 HA HIS A 77 -15.458 0.862 -7.754 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -18.354 1.680 -8.264 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -17.279 0.841 -9.365 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -20.142 -0.252 -7.395 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -17.389 -3.388 -6.754 1.00 0.00 H new ATOM 0 HE2 HIS A 77 -19.858 -2.731 -6.547 1.00 0.00 H new ATOM 1244 N ASP A 78 -15.613 3.732 -7.002 1.00 0.00 N ATOM 1245 CA ASP A 78 -15.347 5.157 -7.342 1.00 0.00 C ATOM 1246 C ASP A 78 -14.589 5.832 -6.199 1.00 0.00 C ATOM 1247 O ASP A 78 -15.113 6.001 -5.116 1.00 0.00 O ATOM 1248 CB ASP A 78 -16.675 5.882 -7.576 1.00 0.00 C ATOM 1249 CG ASP A 78 -16.577 6.734 -8.844 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -16.448 6.159 -9.912 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -16.634 7.947 -8.724 1.00 0.00 O ATOM 0 H ASP A 78 -15.408 3.467 -6.039 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.742 5.203 -8.247 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -17.484 5.158 -7.673 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -16.913 6.513 -6.719 1.00 0.00 H new ATOM 1256 N VAL A 79 -13.356 6.207 -6.429 1.00 0.00 N ATOM 1257 CA VAL A 79 -12.545 6.874 -5.361 1.00 0.00 C ATOM 1258 C VAL A 79 -13.407 7.882 -4.586 1.00 0.00 C ATOM 1259 O VAL A 79 -13.199 8.113 -3.410 1.00 0.00 O ATOM 1260 CB VAL A 79 -11.373 7.613 -6.012 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -10.569 8.350 -4.938 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -10.469 6.605 -6.729 1.00 0.00 C ATOM 0 H VAL A 79 -12.871 6.079 -7.317 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.177 6.117 -4.669 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.756 8.335 -6.733 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.735 8.875 -5.404 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.213 9.069 -4.431 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.186 7.632 -4.213 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.634 7.131 -7.193 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.087 5.882 -6.008 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -11.042 6.085 -7.497 1.00 0.00 H new ATOM 1272 N ALA A 80 -14.375 8.476 -5.233 1.00 0.00 N ATOM 1273 CA ALA A 80 -15.251 9.459 -4.534 1.00 0.00 C ATOM 1274 C ALA A 80 -15.915 8.785 -3.329 1.00 0.00 C ATOM 1275 O ALA A 80 -15.992 9.349 -2.255 1.00 0.00 O ATOM 1276 CB ALA A 80 -16.330 9.955 -5.498 1.00 0.00 C ATOM 0 H ALA A 80 -14.596 8.322 -6.217 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.651 10.303 -4.194 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.971 10.674 -4.988 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.859 10.434 -6.356 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.930 9.111 -5.838 1.00 0.00 H new ATOM 1282 N ALA A 81 -16.387 7.578 -3.500 1.00 0.00 N ATOM 1283 CA ALA A 81 -17.039 6.860 -2.370 1.00 0.00 C ATOM 1284 C ALA A 81 -15.994 6.547 -1.297 1.00 0.00 C ATOM 1285 O ALA A 81 -16.210 6.774 -0.123 1.00 0.00 O ATOM 1286 CB ALA A 81 -17.655 5.554 -2.882 1.00 0.00 C ATOM 0 H ALA A 81 -16.348 7.059 -4.377 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.822 7.486 -1.943 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.132 5.028 -2.055 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.398 5.778 -3.647 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.873 4.926 -3.309 1.00 0.00 H new ATOM 1292 N VAL A 82 -14.863 6.021 -1.692 1.00 0.00 N ATOM 1293 CA VAL A 82 -13.799 5.686 -0.695 1.00 0.00 C ATOM 1294 C VAL A 82 -13.495 6.918 0.163 1.00 0.00 C ATOM 1295 O VAL A 82 -13.354 6.830 1.369 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.525 5.253 -1.430 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.523 4.684 -0.425 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -12.860 4.176 -2.463 1.00 0.00 C ATOM 0 H VAL A 82 -14.629 5.809 -2.662 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.146 4.873 -0.057 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.095 6.119 -1.933 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.618 4.376 -0.948 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.274 5.447 0.313 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -11.962 3.822 0.078 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.950 3.873 -2.981 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.296 3.313 -1.960 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.573 4.574 -3.185 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.393 8.066 -0.453 1.00 0.00 N ATOM 1309 CA PHE A 83 -13.099 9.307 0.317 1.00 0.00 C ATOM 1310 C PHE A 83 -14.216 9.557 1.331 1.00 0.00 C ATOM 1311 O PHE A 83 -13.990 10.090 2.400 1.00 0.00 O ATOM 1312 CB PHE A 83 -13.012 10.494 -0.646 1.00 0.00 C ATOM 1313 CG PHE A 83 -11.588 10.654 -1.120 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -10.581 10.982 -0.207 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -11.274 10.473 -2.472 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -9.261 11.129 -0.643 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -9.953 10.619 -2.908 1.00 0.00 C ATOM 1318 CZ PHE A 83 -8.947 10.948 -1.993 1.00 0.00 C ATOM 0 H PHE A 83 -13.501 8.197 -1.459 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.151 9.192 0.842 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.674 10.335 -1.497 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -13.346 11.405 -0.149 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.823 11.122 0.836 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.051 10.221 -3.178 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.484 11.382 0.063 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -9.710 10.478 -3.951 1.00 0.00 H new ATOM 0 HZ PHE A 83 -7.927 11.062 -2.330 1.00 0.00 H new ATOM 1328 N ALA A 84 -15.422 9.174 1.005 1.00 0.00 N ATOM 1329 CA ALA A 84 -16.556 9.389 1.950 1.00 0.00 C ATOM 1330 C ALA A 84 -16.304 8.608 3.242 1.00 0.00 C ATOM 1331 O ALA A 84 -16.281 9.170 4.319 1.00 0.00 O ATOM 1332 CB ALA A 84 -17.858 8.903 1.308 1.00 0.00 C ATOM 0 H ALA A 84 -15.671 8.722 0.125 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.637 10.452 2.178 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.686 9.061 2.000 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -18.041 9.461 0.390 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -17.775 7.841 1.077 1.00 0.00 H new ATOM 1338 N TYR A 85 -16.144 7.312 3.142 1.00 0.00 N ATOM 1339 CA TYR A 85 -15.919 6.471 4.360 1.00 0.00 C ATOM 1340 C TYR A 85 -14.886 7.127 5.285 1.00 0.00 C ATOM 1341 O TYR A 85 -15.151 7.365 6.448 1.00 0.00 O ATOM 1342 CB TYR A 85 -15.410 5.092 3.929 1.00 0.00 C ATOM 1343 CG TYR A 85 -15.892 4.046 4.906 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -17.227 3.624 4.876 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -15.006 3.494 5.839 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -17.675 2.651 5.778 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -15.454 2.522 6.742 1.00 0.00 C ATOM 1348 CZ TYR A 85 -16.789 2.100 6.711 1.00 0.00 C ATOM 1349 OH TYR A 85 -17.231 1.140 7.599 1.00 0.00 O ATOM 0 H TYR A 85 -16.160 6.796 2.262 1.00 0.00 H new ATOM 0 HA TYR A 85 -16.860 6.373 4.901 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -15.767 4.859 2.926 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.321 5.092 3.888 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -17.911 4.049 4.157 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -13.976 3.818 5.862 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -18.705 2.326 5.754 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.770 2.098 7.462 1.00 0.00 H new ATOM 0 HH TYR A 85 -16.831 1.300 8.479 1.00 0.00 H new ATOM 1359 N ALA A 86 -13.713 7.424 4.784 1.00 0.00 N ATOM 1360 CA ALA A 86 -12.672 8.064 5.645 1.00 0.00 C ATOM 1361 C ALA A 86 -13.232 9.343 6.271 1.00 0.00 C ATOM 1362 O ALA A 86 -13.096 9.578 7.456 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.449 8.413 4.796 1.00 0.00 C ATOM 0 H ALA A 86 -13.432 7.252 3.819 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.385 7.369 6.434 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.691 8.880 5.425 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.043 7.504 4.352 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.740 9.104 4.005 1.00 0.00 H new ATOM 1369 N LYS A 87 -13.872 10.166 5.484 1.00 0.00 N ATOM 1370 CA LYS A 87 -14.451 11.425 6.030 1.00 0.00 C ATOM 1371 C LYS A 87 -15.527 11.079 7.062 1.00 0.00 C ATOM 1372 O LYS A 87 -15.813 11.850 7.958 1.00 0.00 O ATOM 1373 CB LYS A 87 -15.078 12.231 4.888 1.00 0.00 C ATOM 1374 CG LYS A 87 -14.642 13.695 4.988 1.00 0.00 C ATOM 1375 CD LYS A 87 -14.550 14.297 3.584 1.00 0.00 C ATOM 1376 CE LYS A 87 -15.942 14.734 3.122 1.00 0.00 C ATOM 1377 NZ LYS A 87 -15.987 14.779 1.630 1.00 0.00 N ATOM 0 H LYS A 87 -14.018 10.019 4.485 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.667 12.016 6.504 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -14.773 11.816 3.927 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -16.165 12.161 4.935 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -15.355 14.258 5.590 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.677 13.765 5.489 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -13.872 15.150 3.587 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -14.138 13.565 2.889 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -16.694 14.040 3.497 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -16.180 15.715 3.532 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -16.934 15.076 1.320 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -15.280 15.457 1.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -15.778 13.835 1.248 1.00 0.00 H new ATOM 1391 N GLN A 88 -16.139 9.932 6.928 1.00 0.00 N ATOM 1392 CA GLN A 88 -17.211 9.541 7.885 1.00 0.00 C ATOM 1393 C GLN A 88 -16.652 8.639 8.993 1.00 0.00 C ATOM 1394 O GLN A 88 -17.391 8.167 9.834 1.00 0.00 O ATOM 1395 CB GLN A 88 -18.312 8.791 7.130 1.00 0.00 C ATOM 1396 CG GLN A 88 -19.451 9.757 6.793 1.00 0.00 C ATOM 1397 CD GLN A 88 -20.049 9.389 5.434 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -19.385 9.669 4.346 1.00 0.00 O flip ATOM 1399 NE2 GLN A 88 -21.131 8.841 5.361 1.00 0.00 N flip ATOM 0 H GLN A 88 -15.941 9.250 6.196 1.00 0.00 H new ATOM 0 HA GLN A 88 -17.615 10.444 8.343 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.909 8.355 6.216 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.687 7.967 7.737 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.220 9.712 7.564 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.079 10.781 6.773 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -21.650 8.622 6.211 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -21.520 8.600 4.449 1.00 0.00 H new ATOM 1408 N HIS A 89 -15.364 8.393 9.020 1.00 0.00 N ATOM 1409 CA HIS A 89 -14.801 7.525 10.095 1.00 0.00 C ATOM 1410 C HIS A 89 -13.758 8.315 10.900 1.00 0.00 C ATOM 1411 O HIS A 89 -12.700 8.626 10.392 1.00 0.00 O ATOM 1412 CB HIS A 89 -14.133 6.301 9.462 1.00 0.00 C ATOM 1413 CG HIS A 89 -15.094 5.144 9.473 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -15.059 4.165 10.453 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -16.127 4.801 8.636 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -16.043 3.288 10.185 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -16.725 3.628 9.088 1.00 0.00 N ATOM 0 H HIS A 89 -14.685 8.753 8.349 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.603 7.202 10.758 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -13.830 6.527 8.439 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.229 6.042 10.012 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -16.429 5.356 7.761 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.256 2.415 10.784 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -17.514 3.134 8.671 1.00 0.00 H new ATOM 1425 N PRO A 90 -14.085 8.614 12.138 1.00 0.00 N ATOM 1426 CA PRO A 90 -13.223 9.375 13.108 1.00 0.00 C ATOM 1427 C PRO A 90 -12.164 8.451 13.727 1.00 0.00 C ATOM 1428 O PRO A 90 -11.392 8.861 14.573 1.00 0.00 O ATOM 1429 CB PRO A 90 -14.156 9.904 14.193 1.00 0.00 C ATOM 1430 CG PRO A 90 -15.486 9.196 14.035 1.00 0.00 C ATOM 1431 CD PRO A 90 -15.372 8.264 12.832 1.00 0.00 C ATOM 0 HA PRO A 90 -12.695 10.187 12.607 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.738 9.718 15.182 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.282 10.982 14.098 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.729 8.631 14.935 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.289 9.918 13.885 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -15.370 7.221 13.149 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.221 8.392 12.161 1.00 0.00 H new ATOM 1439 N ASP A 91 -12.112 7.215 13.306 1.00 0.00 N ATOM 1440 CA ASP A 91 -11.096 6.272 13.859 1.00 0.00 C ATOM 1441 C ASP A 91 -10.557 5.385 12.730 1.00 0.00 C ATOM 1442 O ASP A 91 -9.868 4.412 12.966 1.00 0.00 O ATOM 1443 CB ASP A 91 -11.741 5.398 14.937 1.00 0.00 C ATOM 1444 CG ASP A 91 -11.403 5.960 16.320 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -11.881 7.038 16.632 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -10.672 5.302 17.042 1.00 0.00 O ATOM 0 H ASP A 91 -12.732 6.817 12.600 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.275 6.838 14.299 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.822 5.370 14.799 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -11.382 4.372 14.852 1.00 0.00 H new ATOM 1451 N GLN A 92 -10.865 5.721 11.505 1.00 0.00 N ATOM 1452 CA GLN A 92 -10.379 4.919 10.350 1.00 0.00 C ATOM 1453 C GLN A 92 -10.149 5.871 9.177 1.00 0.00 C ATOM 1454 O GLN A 92 -11.080 6.245 8.491 1.00 0.00 O ATOM 1455 CB GLN A 92 -11.446 3.884 9.969 1.00 0.00 C ATOM 1456 CG GLN A 92 -10.824 2.486 9.903 1.00 0.00 C ATOM 1457 CD GLN A 92 -11.597 1.535 10.820 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -12.746 1.058 10.425 1.00 0.00 O flip ATOM 1459 NE2 GLN A 92 -11.151 1.223 11.906 1.00 0.00 N flip ATOM 0 H GLN A 92 -11.439 6.526 11.256 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.454 4.401 10.604 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -12.254 3.897 10.701 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -11.885 4.141 9.005 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.845 2.116 8.878 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -9.778 2.528 10.205 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -10.253 1.596 12.215 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -11.674 0.588 12.509 1.00 0.00 H new ATOM 1468 N GLU A 93 -8.930 6.271 8.929 1.00 0.00 N ATOM 1469 CA GLU A 93 -8.676 7.206 7.798 1.00 0.00 C ATOM 1470 C GLU A 93 -8.577 6.419 6.490 1.00 0.00 C ATOM 1471 O GLU A 93 -9.025 5.295 6.398 1.00 0.00 O ATOM 1472 CB GLU A 93 -7.368 7.962 8.056 1.00 0.00 C ATOM 1473 CG GLU A 93 -7.590 9.009 9.152 1.00 0.00 C ATOM 1474 CD GLU A 93 -6.653 8.731 10.329 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -6.892 7.764 11.034 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -5.714 9.489 10.505 1.00 0.00 O ATOM 0 H GLU A 93 -8.104 5.992 9.458 1.00 0.00 H new ATOM 0 HA GLU A 93 -9.497 7.919 7.718 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.586 7.265 8.357 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -7.028 8.445 7.140 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -7.406 10.008 8.757 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -8.627 8.985 9.487 1.00 0.00 H new ATOM 1483 N LEU A 94 -7.996 7.004 5.478 1.00 0.00 N ATOM 1484 CA LEU A 94 -7.867 6.296 4.175 1.00 0.00 C ATOM 1485 C LEU A 94 -6.424 5.817 3.997 1.00 0.00 C ATOM 1486 O LEU A 94 -5.509 6.609 3.891 1.00 0.00 O ATOM 1487 CB LEU A 94 -8.229 7.260 3.043 1.00 0.00 C ATOM 1488 CG LEU A 94 -9.061 6.534 1.987 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -10.480 6.319 2.518 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -9.111 7.389 0.719 1.00 0.00 C ATOM 0 H LEU A 94 -7.604 7.945 5.499 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.538 5.437 4.154 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -8.789 8.107 3.440 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.322 7.661 2.591 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.611 5.567 1.760 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -11.075 5.801 1.766 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.441 5.719 3.427 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.936 7.284 2.740 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.703 6.879 -0.041 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.567 8.352 0.948 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -8.099 7.546 0.346 1.00 0.00 H new ATOM 1502 N VAL A 95 -6.210 4.531 3.952 1.00 0.00 N ATOM 1503 CA VAL A 95 -4.823 4.017 3.761 1.00 0.00 C ATOM 1504 C VAL A 95 -4.767 3.248 2.446 1.00 0.00 C ATOM 1505 O VAL A 95 -5.559 2.360 2.201 1.00 0.00 O ATOM 1506 CB VAL A 95 -4.430 3.096 4.918 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -2.969 2.671 4.757 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -4.595 3.848 6.238 1.00 0.00 C ATOM 0 H VAL A 95 -6.932 3.816 4.039 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.124 4.853 3.737 1.00 0.00 H new ATOM 0 HB VAL A 95 -5.069 2.213 4.915 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.688 2.015 5.581 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.846 2.141 3.813 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.330 3.554 4.763 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.316 3.196 7.066 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.953 4.729 6.238 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.634 4.157 6.353 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.855 3.602 1.587 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.758 2.910 0.275 1.00 0.00 C ATOM 1520 C ILE A 96 -2.881 1.666 0.413 1.00 0.00 C ATOM 1521 O ILE A 96 -1.919 1.645 1.160 1.00 0.00 O ATOM 1522 CB ILE A 96 -3.145 3.856 -0.758 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -3.881 5.201 -0.726 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.268 3.238 -2.152 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.342 5.004 -1.130 1.00 0.00 C ATOM 0 H ILE A 96 -3.171 4.343 1.738 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.755 2.614 -0.051 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.093 4.015 -0.523 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.826 5.632 0.274 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.399 5.906 -1.404 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.831 3.912 -2.889 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.741 2.284 -2.175 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.320 3.077 -2.387 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.859 5.963 -1.105 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.388 4.593 -2.138 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.822 4.315 -0.435 1.00 0.00 H new ATOM 1537 N ALA A 97 -3.192 0.643 -0.335 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.379 -0.603 -0.293 1.00 0.00 C ATOM 1539 C ALA A 97 -1.989 -0.990 -1.726 1.00 0.00 C ATOM 1540 O ALA A 97 -1.257 -1.935 -1.948 1.00 0.00 O ATOM 1541 CB ALA A 97 -3.193 -1.727 0.348 1.00 0.00 C ATOM 0 H ALA A 97 -3.982 0.618 -0.979 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.479 -0.439 0.299 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.595 -2.638 0.377 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.470 -1.442 1.363 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.095 -1.903 -0.239 1.00 0.00 H new ATOM 1547 N GLY A 98 -2.443 -0.235 -2.697 1.00 0.00 N ATOM 1548 CA GLY A 98 -2.073 -0.519 -4.113 1.00 0.00 C ATOM 1549 C GLY A 98 -3.168 -1.337 -4.811 1.00 0.00 C ATOM 1550 O GLY A 98 -4.302 -1.363 -4.378 1.00 0.00 O ATOM 0 H GLY A 98 -3.057 0.569 -2.566 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.917 0.418 -4.647 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.130 -1.065 -4.144 1.00 0.00 H new ATOM 1554 N GLY A 99 -2.844 -1.990 -5.908 1.00 0.00 N ATOM 1555 CA GLY A 99 -1.447 -1.959 -6.442 1.00 0.00 C ATOM 1556 C GLY A 99 -1.098 -0.582 -7.030 1.00 0.00 C ATOM 1557 O GLY A 99 -1.481 0.450 -6.519 1.00 0.00 O ATOM 0 H GLY A 99 -3.498 -2.547 -6.458 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -0.746 -2.203 -5.644 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -1.333 -2.723 -7.211 1.00 0.00 H new ATOM 1561 N ALA A 100 -0.368 -0.572 -8.114 1.00 0.00 N ATOM 1562 CA ALA A 100 0.035 0.721 -8.744 1.00 0.00 C ATOM 1563 C ALA A 100 -1.201 1.499 -9.194 1.00 0.00 C ATOM 1564 O ALA A 100 -1.248 2.710 -9.098 1.00 0.00 O ATOM 1565 CB ALA A 100 0.925 0.436 -9.956 1.00 0.00 C ATOM 0 H ALA A 100 -0.032 -1.408 -8.593 1.00 0.00 H new ATOM 0 HA ALA A 100 0.581 1.318 -8.013 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.222 1.377 -10.419 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.814 -0.106 -9.635 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.374 -0.166 -10.679 1.00 0.00 H new ATOM 1571 N GLN A 101 -2.190 0.822 -9.703 1.00 0.00 N ATOM 1572 CA GLN A 101 -3.410 1.534 -10.178 1.00 0.00 C ATOM 1573 C GLN A 101 -4.014 2.359 -9.036 1.00 0.00 C ATOM 1574 O GLN A 101 -4.486 3.461 -9.249 1.00 0.00 O ATOM 1575 CB GLN A 101 -4.441 0.514 -10.674 1.00 0.00 C ATOM 1576 CG GLN A 101 -4.717 0.738 -12.166 1.00 0.00 C ATOM 1577 CD GLN A 101 -4.502 -0.570 -12.931 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -5.537 -1.234 -13.366 1.00 0.00 O flip ATOM 1579 NE2 GLN A 101 -3.381 -0.990 -13.135 1.00 0.00 N flip ATOM 0 H GLN A 101 -2.208 -0.192 -9.811 1.00 0.00 H new ATOM 0 HA GLN A 101 -3.136 2.202 -10.995 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -4.072 -0.499 -10.511 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -5.366 0.612 -10.105 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -5.739 1.090 -12.308 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -4.056 1.512 -12.556 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -2.572 -0.470 -12.795 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -3.248 -1.862 -13.647 1.00 0.00 H new ATOM 1588 N ILE A 102 -4.032 1.842 -7.832 1.00 0.00 N ATOM 1589 CA ILE A 102 -4.642 2.613 -6.711 1.00 0.00 C ATOM 1590 C ILE A 102 -3.702 3.730 -6.257 1.00 0.00 C ATOM 1591 O ILE A 102 -4.140 4.730 -5.724 1.00 0.00 O ATOM 1592 CB ILE A 102 -4.913 1.667 -5.538 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -5.763 0.483 -6.017 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -5.658 2.418 -4.432 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -7.082 0.993 -6.606 1.00 0.00 C ATOM 0 H ILE A 102 -3.654 0.928 -7.581 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.576 3.059 -7.054 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.965 1.297 -5.148 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.216 -0.088 -6.767 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.963 -0.192 -5.185 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.849 1.742 -3.599 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.051 3.255 -4.088 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.605 2.792 -4.821 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.681 0.147 -6.944 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.632 1.545 -5.844 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.873 1.650 -7.450 1.00 0.00 H new ATOM 1607 N PHE A 103 -2.419 3.583 -6.451 1.00 0.00 N ATOM 1608 CA PHE A 103 -1.483 4.658 -6.016 1.00 0.00 C ATOM 1609 C PHE A 103 -1.587 5.847 -6.975 1.00 0.00 C ATOM 1610 O PHE A 103 -1.234 6.957 -6.635 1.00 0.00 O ATOM 1611 CB PHE A 103 -0.043 4.129 -6.039 1.00 0.00 C ATOM 1612 CG PHE A 103 0.148 3.051 -4.992 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -0.458 3.165 -3.733 1.00 0.00 C ATOM 1614 CD2 PHE A 103 0.942 1.934 -5.285 1.00 0.00 C ATOM 1615 CE1 PHE A 103 -0.269 2.165 -2.771 1.00 0.00 C ATOM 1616 CE2 PHE A 103 1.129 0.934 -4.322 1.00 0.00 C ATOM 1617 CZ PHE A 103 0.524 1.050 -3.066 1.00 0.00 C ATOM 0 H PHE A 103 -1.982 2.772 -6.888 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.746 4.971 -5.006 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.187 3.729 -7.026 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.653 4.947 -5.857 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -1.071 4.024 -3.505 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.410 1.844 -6.254 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.735 2.254 -1.801 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.740 0.073 -4.549 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.669 0.279 -2.324 1.00 0.00 H new ATOM 1627 N THR A 104 -2.048 5.618 -8.176 1.00 0.00 N ATOM 1628 CA THR A 104 -2.150 6.730 -9.166 1.00 0.00 C ATOM 1629 C THR A 104 -3.415 7.559 -8.922 1.00 0.00 C ATOM 1630 O THR A 104 -3.360 8.769 -8.823 1.00 0.00 O ATOM 1631 CB THR A 104 -2.191 6.147 -10.580 1.00 0.00 C ATOM 1632 OG1 THR A 104 -1.241 5.095 -10.683 1.00 0.00 O ATOM 1633 CG2 THR A 104 -1.856 7.240 -11.597 1.00 0.00 C ATOM 0 H THR A 104 -2.359 4.707 -8.515 1.00 0.00 H new ATOM 0 HA THR A 104 -1.281 7.378 -9.054 1.00 0.00 H new ATOM 0 HB THR A 104 -3.189 5.759 -10.784 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.543 4.328 -10.153 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.886 6.822 -12.603 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.585 8.047 -11.517 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.859 7.631 -11.396 1.00 0.00 H new ATOM 1641 N ALA A 105 -4.557 6.927 -8.839 1.00 0.00 N ATOM 1642 CA ALA A 105 -5.818 7.698 -8.618 1.00 0.00 C ATOM 1643 C ALA A 105 -5.761 8.428 -7.272 1.00 0.00 C ATOM 1644 O ALA A 105 -6.385 9.455 -7.089 1.00 0.00 O ATOM 1645 CB ALA A 105 -7.015 6.742 -8.625 1.00 0.00 C ATOM 0 H ALA A 105 -4.672 5.916 -8.914 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.928 8.430 -9.418 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.933 7.307 -8.464 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -7.067 6.232 -9.587 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.897 6.006 -7.830 1.00 0.00 H new ATOM 1651 N PHE A 106 -5.038 7.897 -6.324 1.00 0.00 N ATOM 1652 CA PHE A 106 -4.962 8.553 -4.984 1.00 0.00 C ATOM 1653 C PHE A 106 -3.682 9.393 -4.864 1.00 0.00 C ATOM 1654 O PHE A 106 -3.470 10.072 -3.878 1.00 0.00 O ATOM 1655 CB PHE A 106 -4.961 7.474 -3.899 1.00 0.00 C ATOM 1656 CG PHE A 106 -6.352 6.904 -3.753 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -6.799 5.911 -4.631 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -7.193 7.370 -2.738 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -8.087 5.385 -4.494 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -8.481 6.844 -2.601 1.00 0.00 C ATOM 1661 CZ PHE A 106 -8.928 5.852 -3.479 1.00 0.00 C ATOM 0 H PHE A 106 -4.496 7.038 -6.418 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.823 9.210 -4.863 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.258 6.683 -4.159 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.629 7.897 -2.951 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -6.149 5.551 -5.415 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.848 8.136 -2.060 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -8.432 4.618 -5.172 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -9.131 7.204 -1.817 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.923 5.446 -3.373 1.00 0.00 H new ATOM 1671 N LYS A 107 -2.811 9.334 -5.839 1.00 0.00 N ATOM 1672 CA LYS A 107 -1.542 10.115 -5.746 1.00 0.00 C ATOM 1673 C LYS A 107 -1.836 11.614 -5.571 1.00 0.00 C ATOM 1674 O LYS A 107 -1.131 12.302 -4.862 1.00 0.00 O ATOM 1675 CB LYS A 107 -0.686 9.886 -7.001 1.00 0.00 C ATOM 1676 CG LYS A 107 -1.342 10.518 -8.233 1.00 0.00 C ATOM 1677 CD LYS A 107 -0.522 11.731 -8.680 1.00 0.00 C ATOM 1678 CE LYS A 107 -1.039 12.230 -10.031 1.00 0.00 C ATOM 1679 NZ LYS A 107 -0.327 11.517 -11.131 1.00 0.00 N ATOM 0 H LYS A 107 -2.923 8.783 -6.690 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.989 9.769 -4.872 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.306 10.313 -6.853 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.551 8.817 -7.164 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -1.403 9.789 -9.041 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -2.363 10.821 -8.000 1.00 0.00 H new ATOM 0 HD2 LYS A 107 -0.593 12.525 -7.936 1.00 0.00 H new ATOM 0 HD3 LYS A 107 0.531 11.462 -8.759 1.00 0.00 H new ATOM 0 HE2 LYS A 107 -2.113 12.058 -10.107 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -0.881 13.305 -10.118 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 -0.678 11.856 -12.049 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 0.694 11.702 -11.061 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 -0.499 10.495 -11.051 1.00 0.00 H new ATOM 1693 N ASP A 108 -2.859 12.133 -6.199 1.00 0.00 N ATOM 1694 CA ASP A 108 -3.165 13.589 -6.055 1.00 0.00 C ATOM 1695 C ASP A 108 -3.567 13.912 -4.611 1.00 0.00 C ATOM 1696 O ASP A 108 -3.251 14.965 -4.092 1.00 0.00 O ATOM 1697 CB ASP A 108 -4.322 13.949 -6.990 1.00 0.00 C ATOM 1698 CG ASP A 108 -4.213 15.419 -7.400 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -3.223 15.768 -8.022 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -5.122 16.170 -7.086 1.00 0.00 O ATOM 0 H ASP A 108 -3.495 11.614 -6.804 1.00 0.00 H new ATOM 0 HA ASP A 108 -2.276 14.166 -6.311 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.300 13.312 -7.874 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.275 13.770 -6.492 1.00 0.00 H new ATOM 1705 N ASP A 109 -4.279 13.027 -3.971 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.725 13.286 -2.570 1.00 0.00 C ATOM 1707 C ASP A 109 -3.944 12.399 -1.600 1.00 0.00 C ATOM 1708 O ASP A 109 -4.387 11.323 -1.246 1.00 0.00 O ATOM 1709 CB ASP A 109 -6.216 12.973 -2.449 1.00 0.00 C ATOM 1710 CG ASP A 109 -7.031 14.121 -3.048 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -6.863 14.389 -4.226 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -7.809 14.713 -2.318 1.00 0.00 O ATOM 0 H ASP A 109 -4.573 12.131 -4.358 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.544 14.332 -2.325 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.446 12.042 -2.967 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.484 12.830 -1.402 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.794 12.837 -1.152 1.00 0.00 N ATOM 1718 CA VAL A 110 -2.009 12.010 -0.191 1.00 0.00 C ATOM 1719 C VAL A 110 -1.864 12.772 1.129 1.00 0.00 C ATOM 1720 O VAL A 110 -1.830 13.987 1.155 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.613 11.726 -0.753 1.00 0.00 C ATOM 1722 CG1 VAL A 110 0.039 10.601 0.056 1.00 0.00 C ATOM 1723 CG2 VAL A 110 -0.719 11.309 -2.221 1.00 0.00 C ATOM 0 H VAL A 110 -2.368 13.727 -1.410 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.531 11.067 -0.029 1.00 0.00 H new ATOM 0 HB VAL A 110 -0.004 12.627 -0.682 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.033 10.396 -0.341 1.00 0.00 H new ATOM 0 HG12 VAL A 110 0.121 10.904 1.100 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.572 9.701 -0.014 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.277 11.108 -2.615 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.329 10.409 -2.300 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.181 12.112 -2.795 1.00 0.00 H new ATOM 1733 N ASP A 111 -1.781 12.066 2.222 1.00 0.00 N ATOM 1734 CA ASP A 111 -1.637 12.738 3.546 1.00 0.00 C ATOM 1735 C ASP A 111 -0.427 12.152 4.280 1.00 0.00 C ATOM 1736 O ASP A 111 0.288 12.847 4.975 1.00 0.00 O ATOM 1737 CB ASP A 111 -2.904 12.505 4.375 1.00 0.00 C ATOM 1738 CG ASP A 111 -3.261 13.783 5.136 1.00 0.00 C ATOM 1739 OD1 ASP A 111 -2.535 14.125 6.056 1.00 0.00 O ATOM 1740 OD2 ASP A 111 -4.255 14.399 4.787 1.00 0.00 O ATOM 0 H ASP A 111 -1.807 11.047 2.256 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.492 13.809 3.402 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.729 12.215 3.724 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.747 11.685 5.075 1.00 0.00 H new ATOM 1745 N THR A 112 -0.197 10.874 4.130 1.00 0.00 N ATOM 1746 CA THR A 112 0.964 10.233 4.812 1.00 0.00 C ATOM 1747 C THR A 112 1.530 9.131 3.911 1.00 0.00 C ATOM 1748 O THR A 112 0.805 8.288 3.419 1.00 0.00 O ATOM 1749 CB THR A 112 0.506 9.631 6.143 1.00 0.00 C ATOM 1750 OG1 THR A 112 -0.148 10.631 6.912 1.00 0.00 O ATOM 1751 CG2 THR A 112 1.716 9.102 6.914 1.00 0.00 C ATOM 0 H THR A 112 -0.765 10.245 3.563 1.00 0.00 H new ATOM 0 HA THR A 112 1.736 10.978 5.004 1.00 0.00 H new ATOM 0 HB THR A 112 -0.184 8.809 5.950 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.443 10.247 7.764 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.386 8.674 7.861 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.216 8.334 6.324 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.410 9.920 7.108 1.00 0.00 H new ATOM 1759 N LEU A 113 2.817 9.137 3.680 1.00 0.00 N ATOM 1760 CA LEU A 113 3.421 8.094 2.798 1.00 0.00 C ATOM 1761 C LEU A 113 4.216 7.091 3.635 1.00 0.00 C ATOM 1762 O LEU A 113 5.034 7.459 4.455 1.00 0.00 O ATOM 1763 CB LEU A 113 4.364 8.754 1.789 1.00 0.00 C ATOM 1764 CG LEU A 113 3.564 9.646 0.840 1.00 0.00 C ATOM 1765 CD1 LEU A 113 4.396 10.875 0.471 1.00 0.00 C ATOM 1766 CD2 LEU A 113 3.231 8.861 -0.430 1.00 0.00 C ATOM 0 H LEU A 113 3.474 9.817 4.062 1.00 0.00 H new ATOM 0 HA LEU A 113 2.619 7.575 2.273 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.115 9.346 2.312 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.897 7.991 1.222 1.00 0.00 H new ATOM 0 HG LEU A 113 2.643 9.964 1.328 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.825 11.511 -0.206 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.640 11.434 1.375 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.316 10.558 -0.019 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.660 9.494 -1.110 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.155 8.547 -0.916 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.641 7.982 -0.170 1.00 0.00 H new ATOM 1778 N LEU A 114 3.991 5.823 3.419 1.00 0.00 N ATOM 1779 CA LEU A 114 4.737 4.780 4.179 1.00 0.00 C ATOM 1780 C LEU A 114 5.411 3.850 3.169 1.00 0.00 C ATOM 1781 O LEU A 114 4.811 2.912 2.680 1.00 0.00 O ATOM 1782 CB LEU A 114 3.763 3.975 5.044 1.00 0.00 C ATOM 1783 CG LEU A 114 2.824 4.921 5.798 1.00 0.00 C ATOM 1784 CD1 LEU A 114 1.469 4.241 5.999 1.00 0.00 C ATOM 1785 CD2 LEU A 114 3.430 5.262 7.161 1.00 0.00 C ATOM 0 H LEU A 114 3.317 5.463 2.743 1.00 0.00 H new ATOM 0 HA LEU A 114 5.481 5.244 4.826 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.183 3.297 4.418 1.00 0.00 H new ATOM 0 HB3 LEU A 114 4.317 3.359 5.752 1.00 0.00 H new ATOM 0 HG LEU A 114 2.690 5.836 5.221 1.00 0.00 H new ATOM 0 HD11 LEU A 114 0.800 4.914 6.536 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.037 3.997 5.029 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.603 3.326 6.576 1.00 0.00 H new ATOM 0 HD21 LEU A 114 2.762 5.935 7.698 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.564 4.347 7.739 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.396 5.747 7.019 1.00 0.00 H new ATOM 1797 N VAL A 115 6.641 4.122 2.827 1.00 0.00 N ATOM 1798 CA VAL A 115 7.332 3.269 1.816 1.00 0.00 C ATOM 1799 C VAL A 115 8.513 2.515 2.437 1.00 0.00 C ATOM 1800 O VAL A 115 9.216 3.022 3.288 1.00 0.00 O ATOM 1801 CB VAL A 115 7.831 4.156 0.671 1.00 0.00 C ATOM 1802 CG1 VAL A 115 8.933 5.094 1.175 1.00 0.00 C ATOM 1803 CG2 VAL A 115 8.385 3.273 -0.447 1.00 0.00 C ATOM 0 H VAL A 115 7.195 4.893 3.201 1.00 0.00 H new ATOM 0 HA VAL A 115 6.623 2.531 1.441 1.00 0.00 H new ATOM 0 HB VAL A 115 7.002 4.754 0.293 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.281 5.720 0.354 1.00 0.00 H new ATOM 0 HG12 VAL A 115 8.538 5.725 1.971 1.00 0.00 H new ATOM 0 HG13 VAL A 115 9.765 4.504 1.560 1.00 0.00 H new ATOM 0 HG21 VAL A 115 8.741 3.901 -1.264 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.211 2.675 -0.063 1.00 0.00 H new ATOM 0 HG23 VAL A 115 7.598 2.613 -0.813 1.00 0.00 H new ATOM 1813 N THR A 116 8.738 1.306 1.988 1.00 0.00 N ATOM 1814 CA THR A 116 9.876 0.500 2.514 1.00 0.00 C ATOM 1815 C THR A 116 10.921 0.345 1.405 1.00 0.00 C ATOM 1816 O THR A 116 10.604 -0.044 0.299 1.00 0.00 O ATOM 1817 CB THR A 116 9.381 -0.888 2.933 1.00 0.00 C ATOM 1818 OG1 THR A 116 8.087 -0.784 3.511 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.350 -1.486 3.952 1.00 0.00 C ATOM 0 H THR A 116 8.177 0.841 1.274 1.00 0.00 H new ATOM 0 HA THR A 116 10.311 1.002 3.378 1.00 0.00 H new ATOM 0 HB THR A 116 9.330 -1.533 2.056 1.00 0.00 H new ATOM 0 HG1 THR A 116 7.774 -1.674 3.776 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.999 -2.474 4.251 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.340 -1.573 3.505 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.402 -0.839 4.828 1.00 0.00 H new ATOM 1827 N ARG A 117 12.160 0.649 1.687 1.00 0.00 N ATOM 1828 CA ARG A 117 13.214 0.518 0.640 1.00 0.00 C ATOM 1829 C ARG A 117 14.108 -0.685 0.955 1.00 0.00 C ATOM 1830 O ARG A 117 14.786 -0.718 1.963 1.00 0.00 O ATOM 1831 CB ARG A 117 14.061 1.794 0.606 1.00 0.00 C ATOM 1832 CG ARG A 117 13.575 2.701 -0.528 1.00 0.00 C ATOM 1833 CD ARG A 117 14.394 3.994 -0.543 1.00 0.00 C ATOM 1834 NE ARG A 117 13.472 5.167 -0.484 1.00 0.00 N ATOM 1835 CZ ARG A 117 12.698 5.462 -1.501 1.00 0.00 C ATOM 1836 NH1 ARG A 117 12.721 4.740 -2.591 1.00 0.00 N ATOM 1837 NH2 ARG A 117 11.898 6.491 -1.425 1.00 0.00 N ATOM 0 H ARG A 117 12.487 0.981 2.594 1.00 0.00 H new ATOM 0 HA ARG A 117 12.742 0.370 -0.331 1.00 0.00 H new ATOM 0 HB2 ARG A 117 13.989 2.316 1.560 1.00 0.00 H new ATOM 0 HB3 ARG A 117 15.111 1.542 0.459 1.00 0.00 H new ATOM 0 HG2 ARG A 117 13.672 2.187 -1.484 1.00 0.00 H new ATOM 0 HG3 ARG A 117 12.518 2.931 -0.395 1.00 0.00 H new ATOM 0 HD2 ARG A 117 15.079 4.013 0.305 1.00 0.00 H new ATOM 0 HD3 ARG A 117 15.003 4.041 -1.446 1.00 0.00 H new ATOM 0 HE ARG A 117 13.444 5.745 0.356 1.00 0.00 H new ATOM 0 HH11 ARG A 117 13.346 3.937 -2.657 1.00 0.00 H new ATOM 0 HH12 ARG A 117 12.114 4.980 -3.375 1.00 0.00 H new ATOM 0 HH21 ARG A 117 11.878 7.060 -0.579 1.00 0.00 H new ATOM 0 HH22 ARG A 117 11.293 6.726 -2.212 1.00 0.00 H new ATOM 1851 N LEU A 118 14.116 -1.672 0.095 1.00 0.00 N ATOM 1852 CA LEU A 118 14.969 -2.870 0.342 1.00 0.00 C ATOM 1853 C LEU A 118 16.380 -2.603 -0.184 1.00 0.00 C ATOM 1854 O LEU A 118 16.584 -1.771 -1.047 1.00 0.00 O ATOM 1855 CB LEU A 118 14.378 -4.089 -0.375 1.00 0.00 C ATOM 1856 CG LEU A 118 13.177 -4.619 0.412 1.00 0.00 C ATOM 1857 CD1 LEU A 118 12.037 -3.602 0.355 1.00 0.00 C ATOM 1858 CD2 LEU A 118 12.709 -5.941 -0.201 1.00 0.00 C ATOM 0 H LEU A 118 13.569 -1.699 -0.766 1.00 0.00 H new ATOM 0 HA LEU A 118 15.007 -3.070 1.413 1.00 0.00 H new ATOM 0 HB2 LEU A 118 14.071 -3.816 -1.385 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.134 -4.868 -0.471 1.00 0.00 H new ATOM 0 HG LEU A 118 13.468 -4.780 1.450 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.183 -3.981 0.916 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.368 -2.660 0.791 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.746 -3.439 -0.683 1.00 0.00 H new ATOM 0 HD21 LEU A 118 11.854 -6.319 0.359 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.420 -5.778 -1.239 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.520 -6.668 -0.160 1.00 0.00 H new ATOM 1870 N ALA A 119 17.357 -3.299 0.333 1.00 0.00 N ATOM 1871 CA ALA A 119 18.757 -3.082 -0.132 1.00 0.00 C ATOM 1872 C ALA A 119 19.014 -3.901 -1.399 1.00 0.00 C ATOM 1873 O ALA A 119 19.859 -3.560 -2.204 1.00 0.00 O ATOM 1874 CB ALA A 119 19.732 -3.517 0.964 1.00 0.00 C ATOM 0 H ALA A 119 17.246 -4.008 1.057 1.00 0.00 H new ATOM 0 HA ALA A 119 18.904 -2.024 -0.351 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.756 -3.358 0.624 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.553 -2.929 1.864 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.583 -4.574 1.185 1.00 0.00 H new ATOM 1880 N GLY A 120 18.298 -4.979 -1.584 1.00 0.00 N ATOM 1881 CA GLY A 120 18.509 -5.815 -2.801 1.00 0.00 C ATOM 1882 C GLY A 120 17.865 -5.134 -4.009 1.00 0.00 C ATOM 1883 O GLY A 120 17.117 -4.185 -3.872 1.00 0.00 O ATOM 0 H GLY A 120 17.577 -5.316 -0.946 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.575 -5.957 -2.977 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.076 -6.804 -2.655 1.00 0.00 H new ATOM 1887 N SER A 121 18.150 -5.609 -5.193 1.00 0.00 N ATOM 1888 CA SER A 121 17.557 -4.988 -6.412 1.00 0.00 C ATOM 1889 C SER A 121 16.804 -6.050 -7.214 1.00 0.00 C ATOM 1890 O SER A 121 17.382 -7.010 -7.684 1.00 0.00 O ATOM 1891 CB SER A 121 18.674 -4.403 -7.274 1.00 0.00 C ATOM 1892 OG SER A 121 18.151 -3.346 -8.067 1.00 0.00 O ATOM 0 H SER A 121 18.769 -6.401 -5.368 1.00 0.00 H new ATOM 0 HA SER A 121 16.866 -4.198 -6.118 1.00 0.00 H new ATOM 0 HB2 SER A 121 19.481 -4.033 -6.642 1.00 0.00 H new ATOM 0 HB3 SER A 121 19.099 -5.177 -7.913 1.00 0.00 H new ATOM 0 HG SER A 121 18.747 -3.182 -8.827 1.00 0.00 H new ATOM 1898 N PHE A 122 15.518 -5.887 -7.372 1.00 0.00 N ATOM 1899 CA PHE A 122 14.724 -6.887 -8.140 1.00 0.00 C ATOM 1900 C PHE A 122 14.254 -6.260 -9.455 1.00 0.00 C ATOM 1901 O PHE A 122 14.244 -5.054 -9.609 1.00 0.00 O ATOM 1902 CB PHE A 122 13.516 -7.321 -7.308 1.00 0.00 C ATOM 1903 CG PHE A 122 13.990 -7.789 -5.951 1.00 0.00 C ATOM 1904 CD1 PHE A 122 14.140 -6.868 -4.907 1.00 0.00 C ATOM 1905 CD2 PHE A 122 14.284 -9.141 -5.739 1.00 0.00 C ATOM 1906 CE1 PHE A 122 14.582 -7.300 -3.650 1.00 0.00 C ATOM 1907 CE2 PHE A 122 14.727 -9.573 -4.483 1.00 0.00 C ATOM 1908 CZ PHE A 122 14.876 -8.652 -3.438 1.00 0.00 C ATOM 0 H PHE A 122 14.982 -5.102 -7.001 1.00 0.00 H new ATOM 0 HA PHE A 122 15.341 -7.759 -8.359 1.00 0.00 H new ATOM 0 HB2 PHE A 122 12.819 -6.491 -7.197 1.00 0.00 H new ATOM 0 HB3 PHE A 122 12.979 -8.122 -7.815 1.00 0.00 H new ATOM 0 HD1 PHE A 122 13.915 -5.825 -5.071 1.00 0.00 H new ATOM 0 HD2 PHE A 122 14.169 -9.851 -6.545 1.00 0.00 H new ATOM 0 HE1 PHE A 122 14.696 -6.590 -2.844 1.00 0.00 H new ATOM 0 HE2 PHE A 122 14.954 -10.616 -4.320 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.218 -8.985 -2.469 1.00 0.00 H new ATOM 1918 N GLU A 123 13.864 -7.069 -10.404 1.00 0.00 N ATOM 1919 CA GLU A 123 13.394 -6.521 -11.710 1.00 0.00 C ATOM 1920 C GLU A 123 11.925 -6.892 -11.926 1.00 0.00 C ATOM 1921 O GLU A 123 11.403 -7.792 -11.297 1.00 0.00 O ATOM 1922 CB GLU A 123 14.243 -7.104 -12.843 1.00 0.00 C ATOM 1923 CG GLU A 123 15.289 -6.075 -13.284 1.00 0.00 C ATOM 1924 CD GLU A 123 14.872 -5.457 -14.620 1.00 0.00 C ATOM 1925 OE1 GLU A 123 15.176 -6.048 -15.644 1.00 0.00 O ATOM 1926 OE2 GLU A 123 14.256 -4.404 -14.597 1.00 0.00 O ATOM 0 H GLU A 123 13.851 -8.086 -10.331 1.00 0.00 H new ATOM 0 HA GLU A 123 13.493 -5.436 -11.704 1.00 0.00 H new ATOM 0 HB2 GLU A 123 14.735 -8.017 -12.509 1.00 0.00 H new ATOM 0 HB3 GLU A 123 13.607 -7.375 -13.686 1.00 0.00 H new ATOM 0 HG2 GLU A 123 15.389 -5.297 -12.528 1.00 0.00 H new ATOM 0 HG3 GLU A 123 16.264 -6.552 -13.381 1.00 0.00 H new ATOM 1933 N GLY A 124 11.257 -6.208 -12.818 1.00 0.00 N ATOM 1934 CA GLY A 124 9.822 -6.521 -13.083 1.00 0.00 C ATOM 1935 C GLY A 124 9.285 -5.572 -14.154 1.00 0.00 C ATOM 1936 O GLY A 124 10.032 -5.057 -14.963 1.00 0.00 O ATOM 0 H GLY A 124 11.644 -5.446 -13.375 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.719 -7.555 -13.413 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.241 -6.419 -12.167 1.00 0.00 H new ATOM 1940 N ASP A 125 7.998 -5.329 -14.172 1.00 0.00 N ATOM 1941 CA ASP A 125 7.422 -4.404 -15.191 1.00 0.00 C ATOM 1942 C ASP A 125 6.439 -3.444 -14.500 1.00 0.00 C ATOM 1943 O ASP A 125 6.090 -2.410 -15.035 1.00 0.00 O ATOM 1944 CB ASP A 125 6.680 -5.216 -16.257 1.00 0.00 C ATOM 1945 CG ASP A 125 7.192 -4.832 -17.647 1.00 0.00 C ATOM 1946 OD1 ASP A 125 7.018 -3.685 -18.025 1.00 0.00 O ATOM 1947 OD2 ASP A 125 7.749 -5.692 -18.310 1.00 0.00 O ATOM 0 H ASP A 125 7.322 -5.733 -13.523 1.00 0.00 H new ATOM 0 HA ASP A 125 8.222 -3.834 -15.664 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.830 -6.282 -16.085 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.608 -5.030 -16.189 1.00 0.00 H new ATOM 1952 N THR A 126 6.002 -3.777 -13.309 1.00 0.00 N ATOM 1953 CA THR A 126 5.059 -2.888 -12.573 1.00 0.00 C ATOM 1954 C THR A 126 5.834 -2.186 -11.462 1.00 0.00 C ATOM 1955 O THR A 126 6.333 -2.817 -10.545 1.00 0.00 O ATOM 1956 CB THR A 126 3.927 -3.719 -11.965 1.00 0.00 C ATOM 1957 OG1 THR A 126 3.425 -4.620 -12.941 1.00 0.00 O ATOM 1958 CG2 THR A 126 2.804 -2.789 -11.499 1.00 0.00 C ATOM 0 H THR A 126 6.261 -4.631 -12.816 1.00 0.00 H new ATOM 0 HA THR A 126 4.627 -2.155 -13.254 1.00 0.00 H new ATOM 0 HB THR A 126 4.306 -4.283 -11.113 1.00 0.00 H new ATOM 0 HG1 THR A 126 2.701 -5.154 -12.552 1.00 0.00 H new ATOM 0 HG21 THR A 126 1.998 -3.381 -11.066 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.191 -2.099 -10.749 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.423 -2.224 -12.350 1.00 0.00 H new ATOM 1966 N LYS A 127 5.935 -0.886 -11.535 1.00 0.00 N ATOM 1967 CA LYS A 127 6.681 -0.132 -10.492 1.00 0.00 C ATOM 1968 C LYS A 127 5.764 0.907 -9.854 1.00 0.00 C ATOM 1969 O LYS A 127 4.749 1.282 -10.409 1.00 0.00 O ATOM 1970 CB LYS A 127 7.881 0.571 -11.130 1.00 0.00 C ATOM 1971 CG LYS A 127 8.972 -0.458 -11.437 1.00 0.00 C ATOM 1972 CD LYS A 127 10.274 0.266 -11.784 1.00 0.00 C ATOM 1973 CE LYS A 127 11.315 -0.752 -12.253 1.00 0.00 C ATOM 1974 NZ LYS A 127 11.220 -0.922 -13.731 1.00 0.00 N ATOM 0 H LYS A 127 5.531 -0.313 -12.276 1.00 0.00 H new ATOM 0 HA LYS A 127 7.029 -0.825 -9.726 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.575 1.077 -12.046 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.267 1.337 -10.457 1.00 0.00 H new ATOM 0 HG2 LYS A 127 9.124 -1.110 -10.577 1.00 0.00 H new ATOM 0 HG3 LYS A 127 8.664 -1.093 -12.268 1.00 0.00 H new ATOM 0 HD2 LYS A 127 10.095 1.005 -12.565 1.00 0.00 H new ATOM 0 HD3 LYS A 127 10.645 0.807 -10.913 1.00 0.00 H new ATOM 0 HE2 LYS A 127 12.315 -0.416 -11.979 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.152 -1.708 -11.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 11.929 -1.614 -14.047 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 10.269 -1.261 -13.981 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 11.396 -0.009 -14.197 1.00 0.00 H new ATOM 1988 N MET A 128 6.117 1.376 -8.691 1.00 0.00 N ATOM 1989 CA MET A 128 5.271 2.387 -8.005 1.00 0.00 C ATOM 1990 C MET A 128 5.241 3.684 -8.813 1.00 0.00 C ATOM 1991 O MET A 128 6.113 3.952 -9.617 1.00 0.00 O ATOM 1992 CB MET A 128 5.840 2.669 -6.617 1.00 0.00 C ATOM 1993 CG MET A 128 4.690 2.973 -5.658 1.00 0.00 C ATOM 1994 SD MET A 128 4.603 4.752 -5.360 1.00 0.00 S ATOM 1995 CE MET A 128 3.250 4.698 -4.163 1.00 0.00 C ATOM 0 H MET A 128 6.959 1.101 -8.185 1.00 0.00 H new ATOM 0 HA MET A 128 4.256 1.999 -7.916 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.409 1.810 -6.262 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.529 3.513 -6.657 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.749 2.618 -6.079 1.00 0.00 H new ATOM 0 HG3 MET A 128 4.838 2.443 -4.717 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.357 5.142 -4.603 1.00 0.00 H new ATOM 0 HE2 MET A 128 3.045 3.662 -3.892 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.531 5.257 -3.271 1.00 0.00 H new ATOM 2005 N ILE A 129 4.232 4.486 -8.605 1.00 0.00 N ATOM 2006 CA ILE A 129 4.113 5.772 -9.352 1.00 0.00 C ATOM 2007 C ILE A 129 5.125 6.788 -8.803 1.00 0.00 C ATOM 2008 O ILE A 129 5.718 6.569 -7.765 1.00 0.00 O ATOM 2009 CB ILE A 129 2.694 6.314 -9.170 1.00 0.00 C ATOM 2010 CG1 ILE A 129 2.374 6.402 -7.674 1.00 0.00 C ATOM 2011 CG2 ILE A 129 1.697 5.372 -9.847 1.00 0.00 C ATOM 2012 CD1 ILE A 129 1.498 7.626 -7.410 1.00 0.00 C ATOM 0 H ILE A 129 3.478 4.304 -7.943 1.00 0.00 H new ATOM 0 HA ILE A 129 4.317 5.605 -10.410 1.00 0.00 H new ATOM 0 HB ILE A 129 2.621 7.304 -9.620 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.861 5.497 -7.347 1.00 0.00 H new ATOM 0 HG13 ILE A 129 3.297 6.471 -7.098 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.686 5.758 -9.717 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.926 5.304 -10.911 1.00 0.00 H new ATOM 0 HG23 ILE A 129 1.768 4.382 -9.396 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.271 7.688 -6.346 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.028 8.526 -7.721 1.00 0.00 H new ATOM 0 HD13 ILE A 129 0.570 7.538 -7.975 1.00 0.00 H new ATOM 2024 N PRO A 130 5.291 7.873 -9.523 1.00 0.00 N ATOM 2025 CA PRO A 130 6.224 9.007 -9.196 1.00 0.00 C ATOM 2026 C PRO A 130 5.609 9.907 -8.119 1.00 0.00 C ATOM 2027 O PRO A 130 4.726 10.698 -8.389 1.00 0.00 O ATOM 2028 CB PRO A 130 6.421 9.795 -10.489 1.00 0.00 C ATOM 2029 CG PRO A 130 5.411 9.284 -11.496 1.00 0.00 C ATOM 2030 CD PRO A 130 4.587 8.200 -10.810 1.00 0.00 C ATOM 0 HA PRO A 130 7.174 8.635 -8.812 1.00 0.00 H new ATOM 0 HB2 PRO A 130 6.280 10.861 -10.313 1.00 0.00 H new ATOM 0 HB3 PRO A 130 7.436 9.666 -10.865 1.00 0.00 H new ATOM 0 HG2 PRO A 130 4.768 10.095 -11.839 1.00 0.00 H new ATOM 0 HG3 PRO A 130 5.915 8.883 -12.375 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.572 8.548 -10.618 1.00 0.00 H new ATOM 0 HD3 PRO A 130 4.507 7.316 -11.443 1.00 0.00 H new ATOM 2038 N LEU A 131 6.064 9.787 -6.899 1.00 0.00 N ATOM 2039 CA LEU A 131 5.504 10.630 -5.803 1.00 0.00 C ATOM 2040 C LEU A 131 6.341 11.902 -5.643 1.00 0.00 C ATOM 2041 O LEU A 131 7.472 11.972 -6.083 1.00 0.00 O ATOM 2042 CB LEU A 131 5.516 9.836 -4.499 1.00 0.00 C ATOM 2043 CG LEU A 131 4.209 9.054 -4.381 1.00 0.00 C ATOM 2044 CD1 LEU A 131 4.392 7.884 -3.410 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.108 9.986 -3.870 1.00 0.00 C ATOM 0 H LEU A 131 6.800 9.141 -6.615 1.00 0.00 H new ATOM 0 HA LEU A 131 4.480 10.910 -6.050 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.366 9.154 -4.481 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.630 10.509 -3.649 1.00 0.00 H new ATOM 0 HG LEU A 131 3.928 8.662 -5.359 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.457 7.329 -3.329 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.176 7.223 -3.780 1.00 0.00 H new ATOM 0 HD13 LEU A 131 4.673 8.266 -2.429 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.173 9.432 -3.784 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.388 10.379 -2.892 1.00 0.00 H new ATOM 0 HD23 LEU A 131 2.977 10.812 -4.569 1.00 0.00 H new ATOM 2057 N ASN A 132 5.783 12.917 -5.033 1.00 0.00 N ATOM 2058 CA ASN A 132 6.533 14.197 -4.861 1.00 0.00 C ATOM 2059 C ASN A 132 7.172 14.261 -3.467 1.00 0.00 C ATOM 2060 O ASN A 132 6.764 15.030 -2.620 1.00 0.00 O ATOM 2061 CB ASN A 132 5.564 15.372 -5.040 1.00 0.00 C ATOM 2062 CG ASN A 132 6.107 16.330 -6.102 1.00 0.00 C ATOM 2063 OD1 ASN A 132 5.659 16.322 -7.231 1.00 0.00 O ATOM 2064 ND2 ASN A 132 7.061 17.162 -5.785 1.00 0.00 N ATOM 0 H ASN A 132 4.839 12.914 -4.646 1.00 0.00 H new ATOM 0 HA ASN A 132 7.325 14.251 -5.608 1.00 0.00 H new ATOM 0 HB2 ASN A 132 4.582 15.004 -5.336 1.00 0.00 H new ATOM 0 HB3 ASN A 132 5.435 15.898 -4.094 1.00 0.00 H new ATOM 0 HD21 ASN A 132 7.430 17.805 -6.485 1.00 0.00 H new ATOM 0 HD22 ASN A 132 7.437 17.169 -4.837 1.00 0.00 H new ATOM 2071 N TRP A 133 8.175 13.457 -3.224 1.00 0.00 N ATOM 2072 CA TRP A 133 8.846 13.468 -1.886 1.00 0.00 C ATOM 2073 C TRP A 133 9.259 14.899 -1.523 1.00 0.00 C ATOM 2074 O TRP A 133 9.339 15.257 -0.364 1.00 0.00 O ATOM 2075 CB TRP A 133 10.095 12.582 -1.933 1.00 0.00 C ATOM 2076 CG TRP A 133 9.718 11.223 -2.420 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.832 10.796 -3.698 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.165 10.109 -1.664 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.376 9.494 -3.776 1.00 0.00 N ATOM 2080 CE2 TRP A 133 8.957 9.026 -2.547 1.00 0.00 C ATOM 2081 CE3 TRP A 133 8.826 9.936 -0.311 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.430 7.815 -2.105 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 8.296 8.717 0.138 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.098 7.659 -0.758 1.00 0.00 C ATOM 0 H TRP A 133 8.560 12.792 -3.894 1.00 0.00 H new ATOM 0 HA TRP A 133 8.152 13.089 -1.136 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.843 13.023 -2.592 1.00 0.00 H new ATOM 0 HB3 TRP A 133 10.544 12.514 -0.942 1.00 0.00 H new ATOM 0 HD1 TRP A 133 10.217 11.378 -4.523 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.352 8.946 -4.636 1.00 0.00 H new ATOM 0 HE3 TRP A 133 8.974 10.746 0.387 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.279 7.002 -2.800 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.039 8.594 1.180 1.00 0.00 H new ATOM 0 HH2 TRP A 133 7.689 6.723 -0.407 1.00 0.00 H new ATOM 2095 N ASP A 134 9.521 15.716 -2.507 1.00 0.00 N ATOM 2096 CA ASP A 134 9.930 17.123 -2.227 1.00 0.00 C ATOM 2097 C ASP A 134 8.778 17.879 -1.553 1.00 0.00 C ATOM 2098 O ASP A 134 8.992 18.839 -0.838 1.00 0.00 O ATOM 2099 CB ASP A 134 10.300 17.818 -3.540 1.00 0.00 C ATOM 2100 CG ASP A 134 11.570 18.649 -3.339 1.00 0.00 C ATOM 2101 OD1 ASP A 134 11.448 19.788 -2.920 1.00 0.00 O ATOM 2102 OD2 ASP A 134 12.642 18.131 -3.606 1.00 0.00 O ATOM 0 H ASP A 134 9.469 15.469 -3.495 1.00 0.00 H new ATOM 0 HA ASP A 134 10.792 17.119 -1.560 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.458 17.077 -4.324 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.481 18.459 -3.868 1.00 0.00 H new ATOM 2107 N ASP A 135 7.561 17.458 -1.777 1.00 0.00 N ATOM 2108 CA ASP A 135 6.396 18.155 -1.154 1.00 0.00 C ATOM 2109 C ASP A 135 6.068 17.520 0.204 1.00 0.00 C ATOM 2110 O ASP A 135 5.288 18.049 0.972 1.00 0.00 O ATOM 2111 CB ASP A 135 5.182 18.028 -2.079 1.00 0.00 C ATOM 2112 CG ASP A 135 4.398 19.342 -2.083 1.00 0.00 C ATOM 2113 OD1 ASP A 135 3.816 19.664 -1.061 1.00 0.00 O ATOM 2114 OD2 ASP A 135 4.392 20.002 -3.109 1.00 0.00 O ATOM 0 H ASP A 135 7.323 16.660 -2.366 1.00 0.00 H new ATOM 0 HA ASP A 135 6.643 19.206 -1.005 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.507 17.784 -3.090 1.00 0.00 H new ATOM 0 HB3 ASP A 135 4.541 17.212 -1.745 1.00 0.00 H new ATOM 2119 N PHE A 136 6.658 16.393 0.505 1.00 0.00 N ATOM 2120 CA PHE A 136 6.379 15.729 1.811 1.00 0.00 C ATOM 2121 C PHE A 136 7.654 15.695 2.653 1.00 0.00 C ATOM 2122 O PHE A 136 8.740 15.933 2.162 1.00 0.00 O ATOM 2123 CB PHE A 136 5.909 14.294 1.570 1.00 0.00 C ATOM 2124 CG PHE A 136 4.534 14.298 0.948 1.00 0.00 C ATOM 2125 CD1 PHE A 136 4.396 14.404 -0.440 1.00 0.00 C ATOM 2126 CD2 PHE A 136 3.399 14.180 1.758 1.00 0.00 C ATOM 2127 CE1 PHE A 136 3.123 14.392 -1.019 1.00 0.00 C ATOM 2128 CE2 PHE A 136 2.125 14.169 1.178 1.00 0.00 C ATOM 2129 CZ PHE A 136 1.988 14.275 -0.210 1.00 0.00 C ATOM 0 H PHE A 136 7.321 15.904 -0.097 1.00 0.00 H new ATOM 0 HA PHE A 136 5.604 16.289 2.335 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.611 13.778 0.916 1.00 0.00 H new ATOM 0 HB3 PHE A 136 5.889 13.746 2.512 1.00 0.00 H new ATOM 0 HD1 PHE A 136 5.272 14.495 -1.064 1.00 0.00 H new ATOM 0 HD2 PHE A 136 3.506 14.098 2.830 1.00 0.00 H new ATOM 0 HE1 PHE A 136 3.016 14.473 -2.091 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.248 14.079 1.802 1.00 0.00 H new ATOM 0 HZ PHE A 136 1.005 14.266 -0.657 1.00 0.00 H new ATOM 2139 N THR A 137 7.530 15.388 3.917 1.00 0.00 N ATOM 2140 CA THR A 137 8.736 15.322 4.791 1.00 0.00 C ATOM 2141 C THR A 137 8.684 14.044 5.631 1.00 0.00 C ATOM 2142 O THR A 137 7.675 13.729 6.232 1.00 0.00 O ATOM 2143 CB THR A 137 8.770 16.542 5.715 1.00 0.00 C ATOM 2144 OG1 THR A 137 8.465 17.710 4.966 1.00 0.00 O ATOM 2145 CG2 THR A 137 10.163 16.677 6.331 1.00 0.00 C ATOM 0 H THR A 137 6.646 15.180 4.381 1.00 0.00 H new ATOM 0 HA THR A 137 9.633 15.315 4.172 1.00 0.00 H new ATOM 0 HB THR A 137 8.034 16.418 6.510 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.485 18.492 5.557 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.187 17.546 6.989 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.395 15.780 6.905 1.00 0.00 H new ATOM 0 HG23 THR A 137 10.901 16.801 5.538 1.00 0.00 H new ATOM 2153 N LYS A 138 9.761 13.301 5.680 1.00 0.00 N ATOM 2154 CA LYS A 138 9.769 12.041 6.478 1.00 0.00 C ATOM 2155 C LYS A 138 9.789 12.387 7.969 1.00 0.00 C ATOM 2156 O LYS A 138 10.688 13.049 8.450 1.00 0.00 O ATOM 2157 CB LYS A 138 11.021 11.235 6.118 1.00 0.00 C ATOM 2158 CG LYS A 138 10.938 9.838 6.737 1.00 0.00 C ATOM 2159 CD LYS A 138 11.789 9.791 8.007 1.00 0.00 C ATOM 2160 CE LYS A 138 13.264 9.991 7.646 1.00 0.00 C ATOM 2161 NZ LYS A 138 13.726 11.317 8.147 1.00 0.00 N ATOM 0 H LYS A 138 10.636 13.515 5.200 1.00 0.00 H new ATOM 0 HA LYS A 138 8.878 11.453 6.258 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.115 11.157 5.035 1.00 0.00 H new ATOM 0 HB3 LYS A 138 11.911 11.750 6.479 1.00 0.00 H new ATOM 0 HG2 LYS A 138 9.902 9.594 6.972 1.00 0.00 H new ATOM 0 HG3 LYS A 138 11.288 9.091 6.024 1.00 0.00 H new ATOM 0 HD2 LYS A 138 11.466 10.566 8.702 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.654 8.834 8.512 1.00 0.00 H new ATOM 0 HE2 LYS A 138 13.867 9.195 8.084 1.00 0.00 H new ATOM 0 HE3 LYS A 138 13.396 9.933 6.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 14.389 11.735 7.463 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 12.908 11.948 8.266 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 14.204 11.195 9.062 1.00 0.00 H new ATOM 2175 N VAL A 139 8.793 11.956 8.700 1.00 0.00 N ATOM 2176 CA VAL A 139 8.740 12.274 10.158 1.00 0.00 C ATOM 2177 C VAL A 139 9.233 11.083 10.987 1.00 0.00 C ATOM 2178 O VAL A 139 9.667 11.244 12.111 1.00 0.00 O ATOM 2179 CB VAL A 139 7.299 12.604 10.554 1.00 0.00 C ATOM 2180 CG1 VAL A 139 6.848 13.876 9.834 1.00 0.00 C ATOM 2181 CG2 VAL A 139 6.380 11.444 10.160 1.00 0.00 C ATOM 0 H VAL A 139 8.014 11.398 8.350 1.00 0.00 H new ATOM 0 HA VAL A 139 9.386 13.130 10.353 1.00 0.00 H new ATOM 0 HB VAL A 139 7.248 12.759 11.632 1.00 0.00 H new ATOM 0 HG11 VAL A 139 5.822 14.110 10.117 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.499 14.704 10.115 1.00 0.00 H new ATOM 0 HG13 VAL A 139 6.901 13.722 8.756 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.354 11.680 10.443 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.433 11.288 9.083 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.698 10.537 10.674 1.00 0.00 H new ATOM 2191 N SER A 140 9.165 9.890 10.456 1.00 0.00 N ATOM 2192 CA SER A 140 9.624 8.706 11.241 1.00 0.00 C ATOM 2193 C SER A 140 10.277 7.681 10.312 1.00 0.00 C ATOM 2194 O SER A 140 9.792 7.407 9.232 1.00 0.00 O ATOM 2195 CB SER A 140 8.425 8.064 11.939 1.00 0.00 C ATOM 2196 OG SER A 140 8.154 8.764 13.145 1.00 0.00 O ATOM 0 H SER A 140 8.814 9.685 9.520 1.00 0.00 H new ATOM 0 HA SER A 140 10.353 9.032 11.983 1.00 0.00 H new ATOM 0 HB2 SER A 140 7.553 8.090 11.286 1.00 0.00 H new ATOM 0 HB3 SER A 140 8.632 7.015 12.152 1.00 0.00 H new ATOM 0 HG SER A 140 8.603 9.635 13.126 1.00 0.00 H new ATOM 2202 N SER A 141 11.374 7.109 10.734 1.00 0.00 N ATOM 2203 CA SER A 141 12.063 6.095 9.888 1.00 0.00 C ATOM 2204 C SER A 141 12.812 5.099 10.778 1.00 0.00 C ATOM 2205 O SER A 141 13.477 5.477 11.723 1.00 0.00 O ATOM 2206 CB SER A 141 13.058 6.795 8.961 1.00 0.00 C ATOM 2207 OG SER A 141 12.593 6.707 7.621 1.00 0.00 O ATOM 0 H SER A 141 11.822 7.302 11.630 1.00 0.00 H new ATOM 0 HA SER A 141 11.322 5.561 9.294 1.00 0.00 H new ATOM 0 HB2 SER A 141 13.170 7.840 9.251 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.041 6.333 9.048 1.00 0.00 H new ATOM 0 HG SER A 141 13.058 7.370 7.069 1.00 0.00 H new ATOM 2213 N ARG A 142 12.722 3.833 10.474 1.00 0.00 N ATOM 2214 CA ARG A 142 13.441 2.810 11.285 1.00 0.00 C ATOM 2215 C ARG A 142 14.231 1.915 10.332 1.00 0.00 C ATOM 2216 O ARG A 142 13.690 1.400 9.374 1.00 0.00 O ATOM 2217 CB ARG A 142 12.429 1.963 12.061 1.00 0.00 C ATOM 2218 CG ARG A 142 13.112 1.334 13.278 1.00 0.00 C ATOM 2219 CD ARG A 142 12.725 2.110 14.538 1.00 0.00 C ATOM 2220 NE ARG A 142 11.440 1.574 15.076 1.00 0.00 N ATOM 2221 CZ ARG A 142 11.412 0.452 15.754 1.00 0.00 C ATOM 2222 NH1 ARG A 142 12.509 -0.228 15.972 1.00 0.00 N ATOM 2223 NH2 ARG A 142 10.275 0.005 16.214 1.00 0.00 N ATOM 0 H ARG A 142 12.179 3.462 9.695 1.00 0.00 H new ATOM 0 HA ARG A 142 14.112 3.295 11.994 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.591 2.582 12.381 1.00 0.00 H new ATOM 0 HB3 ARG A 142 12.022 1.184 11.417 1.00 0.00 H new ATOM 0 HG2 ARG A 142 12.815 0.290 13.376 1.00 0.00 H new ATOM 0 HG3 ARG A 142 14.194 1.347 13.148 1.00 0.00 H new ATOM 0 HD2 ARG A 142 13.511 2.022 15.288 1.00 0.00 H new ATOM 0 HD3 ARG A 142 12.621 3.170 14.308 1.00 0.00 H new ATOM 0 HE ARG A 142 10.573 2.087 14.914 1.00 0.00 H new ATOM 0 HH11 ARG A 142 13.401 0.113 15.613 1.00 0.00 H new ATOM 0 HH12 ARG A 142 12.472 -1.099 16.501 1.00 0.00 H new ATOM 0 HH21 ARG A 142 9.416 0.528 16.045 1.00 0.00 H new ATOM 0 HH22 ARG A 142 10.246 -0.867 16.742 1.00 0.00 H new ATOM 2237 N THR A 143 15.500 1.718 10.579 1.00 0.00 N ATOM 2238 CA THR A 143 16.308 0.853 9.672 1.00 0.00 C ATOM 2239 C THR A 143 16.520 -0.511 10.330 1.00 0.00 C ATOM 2240 O THR A 143 16.951 -0.602 11.463 1.00 0.00 O ATOM 2241 CB THR A 143 17.667 1.512 9.416 1.00 0.00 C ATOM 2242 OG1 THR A 143 17.483 2.906 9.210 1.00 0.00 O ATOM 2243 CG2 THR A 143 18.319 0.894 8.175 1.00 0.00 C ATOM 0 H THR A 143 16.009 2.118 11.367 1.00 0.00 H new ATOM 0 HA THR A 143 15.782 0.725 8.726 1.00 0.00 H new ATOM 0 HB THR A 143 18.314 1.351 10.278 1.00 0.00 H new ATOM 0 HG1 THR A 143 18.351 3.330 9.048 1.00 0.00 H new ATOM 0 HG21 THR A 143 19.285 1.367 7.998 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.462 -0.175 8.333 1.00 0.00 H new ATOM 0 HG23 THR A 143 17.675 1.050 7.310 1.00 0.00 H new ATOM 2251 N VAL A 144 16.226 -1.571 9.628 1.00 0.00 N ATOM 2252 CA VAL A 144 16.412 -2.927 10.217 1.00 0.00 C ATOM 2253 C VAL A 144 17.219 -3.806 9.255 1.00 0.00 C ATOM 2254 O VAL A 144 16.922 -3.895 8.076 1.00 0.00 O ATOM 2255 CB VAL A 144 15.041 -3.560 10.476 1.00 0.00 C ATOM 2256 CG1 VAL A 144 14.275 -3.693 9.158 1.00 0.00 C ATOM 2257 CG2 VAL A 144 15.226 -4.946 11.101 1.00 0.00 C ATOM 0 H VAL A 144 15.866 -1.557 8.674 1.00 0.00 H new ATOM 0 HA VAL A 144 16.956 -2.843 11.158 1.00 0.00 H new ATOM 0 HB VAL A 144 14.476 -2.925 11.159 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.301 -4.144 9.347 1.00 0.00 H new ATOM 0 HG12 VAL A 144 14.139 -2.706 8.715 1.00 0.00 H new ATOM 0 HG13 VAL A 144 14.839 -4.324 8.471 1.00 0.00 H new ATOM 0 HG21 VAL A 144 14.250 -5.395 11.285 1.00 0.00 H new ATOM 0 HG22 VAL A 144 15.795 -5.579 10.420 1.00 0.00 H new ATOM 0 HG23 VAL A 144 15.765 -4.851 12.044 1.00 0.00 H new ATOM 2267 N GLU A 145 18.239 -4.453 9.754 1.00 0.00 N ATOM 2268 CA GLU A 145 19.080 -5.326 8.887 1.00 0.00 C ATOM 2269 C GLU A 145 18.483 -6.734 8.852 1.00 0.00 C ATOM 2270 O GLU A 145 17.685 -7.103 9.692 1.00 0.00 O ATOM 2271 CB GLU A 145 20.502 -5.386 9.450 1.00 0.00 C ATOM 2272 CG GLU A 145 21.409 -4.444 8.655 1.00 0.00 C ATOM 2273 CD GLU A 145 22.574 -3.991 9.537 1.00 0.00 C ATOM 2274 OE1 GLU A 145 23.252 -4.849 10.077 1.00 0.00 O ATOM 2275 OE2 GLU A 145 22.768 -2.792 9.657 1.00 0.00 O ATOM 0 H GLU A 145 18.527 -4.413 10.732 1.00 0.00 H new ATOM 0 HA GLU A 145 19.108 -4.918 7.876 1.00 0.00 H new ATOM 0 HB2 GLU A 145 20.500 -5.102 10.502 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.883 -6.406 9.395 1.00 0.00 H new ATOM 0 HG2 GLU A 145 21.787 -4.950 7.767 1.00 0.00 H new ATOM 0 HG3 GLU A 145 20.841 -3.579 8.312 1.00 0.00 H new ATOM 2282 N ASP A 146 18.865 -7.523 7.884 1.00 0.00 N ATOM 2283 CA ASP A 146 18.325 -8.909 7.790 1.00 0.00 C ATOM 2284 C ASP A 146 19.461 -9.877 7.449 1.00 0.00 C ATOM 2285 O ASP A 146 20.455 -9.498 6.860 1.00 0.00 O ATOM 2286 CB ASP A 146 17.257 -8.963 6.692 1.00 0.00 C ATOM 2287 CG ASP A 146 16.024 -9.706 7.211 1.00 0.00 C ATOM 2288 OD1 ASP A 146 15.244 -9.096 7.923 1.00 0.00 O ATOM 2289 OD2 ASP A 146 15.879 -10.873 6.884 1.00 0.00 O ATOM 0 H ASP A 146 19.529 -7.267 7.153 1.00 0.00 H new ATOM 0 HA ASP A 146 17.881 -9.195 8.744 1.00 0.00 H new ATOM 0 HB2 ASP A 146 16.984 -7.953 6.387 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.653 -9.466 5.810 1.00 0.00 H new ATOM 2294 N THR A 147 19.320 -11.126 7.809 1.00 0.00 N ATOM 2295 CA THR A 147 20.388 -12.122 7.501 1.00 0.00 C ATOM 2296 C THR A 147 20.576 -12.227 5.982 1.00 0.00 C ATOM 2297 O THR A 147 21.576 -12.728 5.505 1.00 0.00 O ATOM 2298 CB THR A 147 19.988 -13.490 8.060 1.00 0.00 C ATOM 2299 OG1 THR A 147 18.627 -13.754 7.739 1.00 0.00 O ATOM 2300 CG2 THR A 147 20.171 -13.496 9.580 1.00 0.00 C ATOM 0 H THR A 147 18.510 -11.500 8.304 1.00 0.00 H new ATOM 0 HA THR A 147 21.323 -11.800 7.959 1.00 0.00 H new ATOM 0 HB THR A 147 20.619 -14.262 7.619 1.00 0.00 H new ATOM 0 HG1 THR A 147 18.371 -14.630 8.095 1.00 0.00 H new ATOM 0 HG21 THR A 147 19.886 -14.470 9.977 1.00 0.00 H new ATOM 0 HG22 THR A 147 21.215 -13.297 9.822 1.00 0.00 H new ATOM 0 HG23 THR A 147 19.542 -12.725 10.025 1.00 0.00 H new ATOM 2308 N ASN A 148 19.623 -11.754 5.221 1.00 0.00 N ATOM 2309 CA ASN A 148 19.750 -11.821 3.738 1.00 0.00 C ATOM 2310 C ASN A 148 20.087 -10.427 3.192 1.00 0.00 C ATOM 2311 O ASN A 148 19.482 -9.450 3.584 1.00 0.00 O ATOM 2312 CB ASN A 148 18.435 -12.310 3.131 1.00 0.00 C ATOM 2313 CG ASN A 148 18.730 -13.178 1.906 1.00 0.00 C ATOM 2314 OD1 ASN A 148 19.420 -14.173 2.005 1.00 0.00 O ATOM 2315 ND2 ASN A 148 18.234 -12.841 0.747 1.00 0.00 N ATOM 0 H ASN A 148 18.764 -11.325 5.564 1.00 0.00 H new ATOM 0 HA ASN A 148 20.546 -12.516 3.472 1.00 0.00 H new ATOM 0 HB2 ASN A 148 17.872 -12.882 3.869 1.00 0.00 H new ATOM 0 HB3 ASN A 148 17.815 -11.460 2.847 1.00 0.00 H new ATOM 0 HD21 ASN A 148 18.426 -13.413 -0.076 1.00 0.00 H new ATOM 0 HD22 ASN A 148 17.655 -12.006 0.664 1.00 0.00 H new ATOM 2322 N PRO A 149 21.054 -10.378 2.307 1.00 0.00 N ATOM 2323 CA PRO A 149 21.563 -9.126 1.644 1.00 0.00 C ATOM 2324 C PRO A 149 20.400 -8.318 1.061 1.00 0.00 C ATOM 2325 O PRO A 149 20.296 -7.125 1.269 1.00 0.00 O ATOM 2326 CB PRO A 149 22.501 -9.562 0.520 1.00 0.00 C ATOM 2327 CG PRO A 149 22.606 -11.071 0.562 1.00 0.00 C ATOM 2328 CD PRO A 149 21.838 -11.553 1.785 1.00 0.00 C ATOM 0 HA PRO A 149 22.080 -8.495 2.367 1.00 0.00 H new ATOM 0 HB2 PRO A 149 22.118 -9.233 -0.446 1.00 0.00 H new ATOM 0 HB3 PRO A 149 23.484 -9.107 0.645 1.00 0.00 H new ATOM 0 HG2 PRO A 149 22.193 -11.509 -0.347 1.00 0.00 H new ATOM 0 HG3 PRO A 149 23.650 -11.381 0.619 1.00 0.00 H new ATOM 0 HD2 PRO A 149 21.172 -12.375 1.522 1.00 0.00 H new ATOM 0 HD3 PRO A 149 22.522 -11.928 2.546 1.00 0.00 H new ATOM 2336 N ALA A 150 19.545 -8.953 0.306 1.00 0.00 N ATOM 2337 CA ALA A 150 18.410 -8.216 -0.322 1.00 0.00 C ATOM 2338 C ALA A 150 17.266 -8.014 0.678 1.00 0.00 C ATOM 2339 O ALA A 150 16.542 -7.040 0.599 1.00 0.00 O ATOM 2340 CB ALA A 150 17.898 -9.008 -1.525 1.00 0.00 C ATOM 0 H ALA A 150 19.583 -9.951 0.097 1.00 0.00 H new ATOM 0 HA ALA A 150 18.767 -7.236 -0.641 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.068 -8.473 -1.987 1.00 0.00 H new ATOM 0 HB2 ALA A 150 18.702 -9.127 -2.251 1.00 0.00 H new ATOM 0 HB3 ALA A 150 17.558 -9.990 -1.196 1.00 0.00 H new ATOM 2346 N LEU A 151 17.070 -8.922 1.600 1.00 0.00 N ATOM 2347 CA LEU A 151 15.943 -8.757 2.566 1.00 0.00 C ATOM 2348 C LEU A 151 16.203 -7.572 3.505 1.00 0.00 C ATOM 2349 O LEU A 151 15.329 -7.163 4.244 1.00 0.00 O ATOM 2350 CB LEU A 151 15.770 -10.035 3.395 1.00 0.00 C ATOM 2351 CG LEU A 151 15.378 -11.208 2.487 1.00 0.00 C ATOM 2352 CD1 LEU A 151 15.187 -12.465 3.338 1.00 0.00 C ATOM 2353 CD2 LEU A 151 14.064 -10.899 1.758 1.00 0.00 C ATOM 0 H LEU A 151 17.635 -9.762 1.725 1.00 0.00 H new ATOM 0 HA LEU A 151 15.033 -8.564 1.998 1.00 0.00 H new ATOM 0 HB2 LEU A 151 16.698 -10.266 3.919 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.004 -9.883 4.155 1.00 0.00 H new ATOM 0 HG LEU A 151 16.169 -11.365 1.754 1.00 0.00 H new ATOM 0 HD11 LEU A 151 14.908 -13.300 2.696 1.00 0.00 H new ATOM 0 HD12 LEU A 151 16.118 -12.699 3.855 1.00 0.00 H new ATOM 0 HD13 LEU A 151 14.399 -12.292 4.071 1.00 0.00 H new ATOM 0 HD21 LEU A 151 13.797 -11.739 1.117 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.272 -10.734 2.489 1.00 0.00 H new ATOM 0 HD23 LEU A 151 14.188 -10.003 1.149 1.00 0.00 H new ATOM 2365 N THR A 152 17.379 -6.999 3.476 1.00 0.00 N ATOM 2366 CA THR A 152 17.648 -5.827 4.359 1.00 0.00 C ATOM 2367 C THR A 152 16.796 -4.658 3.863 1.00 0.00 C ATOM 2368 O THR A 152 16.575 -4.516 2.675 1.00 0.00 O ATOM 2369 CB THR A 152 19.133 -5.455 4.279 1.00 0.00 C ATOM 2370 OG1 THR A 152 19.921 -6.624 4.455 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.473 -4.438 5.372 1.00 0.00 C ATOM 0 H THR A 152 18.158 -7.289 2.884 1.00 0.00 H new ATOM 0 HA THR A 152 17.401 -6.064 5.394 1.00 0.00 H new ATOM 0 HB THR A 152 19.343 -5.015 3.304 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.172 -6.984 3.579 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.530 -4.177 5.310 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.869 -3.541 5.235 1.00 0.00 H new ATOM 0 HG23 THR A 152 19.263 -4.871 6.350 1.00 0.00 H new ATOM 2379 N HIS A 153 16.312 -3.815 4.740 1.00 0.00 N ATOM 2380 CA HIS A 153 15.475 -2.676 4.258 1.00 0.00 C ATOM 2381 C HIS A 153 15.243 -1.652 5.370 1.00 0.00 C ATOM 2382 O HIS A 153 15.562 -1.875 6.522 1.00 0.00 O ATOM 2383 CB HIS A 153 14.126 -3.211 3.770 1.00 0.00 C ATOM 2384 CG HIS A 153 13.470 -4.010 4.861 1.00 0.00 C ATOM 2385 ND1 HIS A 153 13.968 -5.233 5.284 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.349 -3.779 5.620 1.00 0.00 C ATOM 2387 CE1 HIS A 153 13.155 -5.687 6.256 1.00 0.00 C ATOM 2388 NE2 HIS A 153 12.152 -4.839 6.500 1.00 0.00 N ATOM 0 H HIS A 153 16.456 -3.864 5.749 1.00 0.00 H new ATOM 0 HA HIS A 153 16.002 -2.182 3.442 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.481 -2.383 3.475 1.00 0.00 H new ATOM 0 HB3 HIS A 153 14.269 -3.833 2.887 1.00 0.00 H new ATOM 0 HD1 HIS A 153 14.799 -5.703 4.924 1.00 0.00 H new ATOM 0 HD2 HIS A 153 11.716 -2.907 5.545 1.00 0.00 H new ATOM 0 HE1 HIS A 153 13.296 -6.623 6.776 1.00 0.00 H new ATOM 2396 N THR A 154 14.673 -0.529 5.018 1.00 0.00 N ATOM 2397 CA THR A 154 14.395 0.537 6.022 1.00 0.00 C ATOM 2398 C THR A 154 12.944 1.009 5.857 1.00 0.00 C ATOM 2399 O THR A 154 12.367 0.889 4.795 1.00 0.00 O ATOM 2400 CB THR A 154 15.350 1.711 5.778 1.00 0.00 C ATOM 2401 OG1 THR A 154 16.668 1.213 5.592 1.00 0.00 O ATOM 2402 CG2 THR A 154 15.329 2.657 6.978 1.00 0.00 C ATOM 0 H THR A 154 14.385 -0.304 4.066 1.00 0.00 H new ATOM 0 HA THR A 154 14.541 0.152 7.031 1.00 0.00 H new ATOM 0 HB THR A 154 15.032 2.255 4.888 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.301 1.961 5.578 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.010 3.489 6.798 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.319 3.040 7.122 1.00 0.00 H new ATOM 0 HG23 THR A 154 15.643 2.118 7.872 1.00 0.00 H new ATOM 2410 N TYR A 155 12.345 1.533 6.896 1.00 0.00 N ATOM 2411 CA TYR A 155 10.929 2.000 6.788 1.00 0.00 C ATOM 2412 C TYR A 155 10.897 3.530 6.758 1.00 0.00 C ATOM 2413 O TYR A 155 11.404 4.181 7.648 1.00 0.00 O ATOM 2414 CB TYR A 155 10.137 1.519 8.007 1.00 0.00 C ATOM 2415 CG TYR A 155 10.039 0.012 8.001 1.00 0.00 C ATOM 2416 CD1 TYR A 155 9.143 -0.628 7.138 1.00 0.00 C ATOM 2417 CD2 TYR A 155 10.838 -0.744 8.867 1.00 0.00 C ATOM 2418 CE1 TYR A 155 9.045 -2.024 7.140 1.00 0.00 C ATOM 2419 CE2 TYR A 155 10.741 -2.140 8.869 1.00 0.00 C ATOM 2420 CZ TYR A 155 9.844 -2.781 8.006 1.00 0.00 C ATOM 2421 OH TYR A 155 9.747 -4.158 8.007 1.00 0.00 O ATOM 0 H TYR A 155 12.774 1.658 7.813 1.00 0.00 H new ATOM 0 HA TYR A 155 10.489 1.599 5.875 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.623 1.856 8.922 1.00 0.00 H new ATOM 0 HB3 TYR A 155 9.139 1.956 7.997 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.527 -0.045 6.470 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.529 -0.250 9.534 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.353 -2.518 6.474 1.00 0.00 H new ATOM 0 HE2 TYR A 155 11.358 -2.723 9.536 1.00 0.00 H new ATOM 0 HH TYR A 155 10.508 -4.540 7.522 1.00 0.00 H new ATOM 2431 N GLU A 156 10.315 4.115 5.742 1.00 0.00 N ATOM 2432 CA GLU A 156 10.265 5.605 5.670 1.00 0.00 C ATOM 2433 C GLU A 156 8.811 6.086 5.752 1.00 0.00 C ATOM 2434 O GLU A 156 7.982 5.727 4.940 1.00 0.00 O ATOM 2435 CB GLU A 156 10.874 6.070 4.346 1.00 0.00 C ATOM 2436 CG GLU A 156 12.395 5.885 4.380 1.00 0.00 C ATOM 2437 CD GLU A 156 13.079 7.220 4.074 1.00 0.00 C ATOM 2438 OE1 GLU A 156 13.071 8.079 4.939 1.00 0.00 O ATOM 2439 OE2 GLU A 156 13.598 7.359 2.978 1.00 0.00 O ATOM 0 H GLU A 156 9.874 3.627 4.962 1.00 0.00 H new ATOM 0 HA GLU A 156 10.829 6.021 6.505 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.448 5.501 3.520 1.00 0.00 H new ATOM 0 HB3 GLU A 156 10.630 7.118 4.171 1.00 0.00 H new ATOM 0 HG2 GLU A 156 12.706 5.521 5.359 1.00 0.00 H new ATOM 0 HG3 GLU A 156 12.697 5.134 3.650 1.00 0.00 H new ATOM 2446 N VAL A 157 8.499 6.900 6.729 1.00 0.00 N ATOM 2447 CA VAL A 157 7.103 7.413 6.871 1.00 0.00 C ATOM 2448 C VAL A 157 7.093 8.925 6.613 1.00 0.00 C ATOM 2449 O VAL A 157 7.838 9.666 7.221 1.00 0.00 O ATOM 2450 CB VAL A 157 6.610 7.136 8.297 1.00 0.00 C ATOM 2451 CG1 VAL A 157 5.187 7.679 8.474 1.00 0.00 C ATOM 2452 CG2 VAL A 157 6.623 5.625 8.558 1.00 0.00 C ATOM 0 H VAL A 157 9.154 7.232 7.437 1.00 0.00 H new ATOM 0 HA VAL A 157 6.450 6.916 6.154 1.00 0.00 H new ATOM 0 HB VAL A 157 7.270 7.633 9.008 1.00 0.00 H new ATOM 0 HG11 VAL A 157 4.845 7.478 9.489 1.00 0.00 H new ATOM 0 HG12 VAL A 157 5.183 8.754 8.296 1.00 0.00 H new ATOM 0 HG13 VAL A 157 4.520 7.191 7.763 1.00 0.00 H new ATOM 0 HG21 VAL A 157 6.273 5.428 9.571 1.00 0.00 H new ATOM 0 HG22 VAL A 157 5.967 5.127 7.844 1.00 0.00 H new ATOM 0 HG23 VAL A 157 7.638 5.245 8.445 1.00 0.00 H new ATOM 2462 N TRP A 158 6.254 9.393 5.724 1.00 0.00 N ATOM 2463 CA TRP A 158 6.215 10.860 5.445 1.00 0.00 C ATOM 2464 C TRP A 158 4.848 11.438 5.818 1.00 0.00 C ATOM 2465 O TRP A 158 3.868 10.730 5.944 1.00 0.00 O ATOM 2466 CB TRP A 158 6.460 11.115 3.956 1.00 0.00 C ATOM 2467 CG TRP A 158 7.802 10.593 3.553 1.00 0.00 C ATOM 2468 CD1 TRP A 158 8.164 9.291 3.552 1.00 0.00 C ATOM 2469 CD2 TRP A 158 8.961 11.341 3.084 1.00 0.00 C ATOM 2470 NE1 TRP A 158 9.472 9.193 3.111 1.00 0.00 N ATOM 2471 CE2 TRP A 158 10.006 10.430 2.813 1.00 0.00 C ATOM 2472 CE3 TRP A 158 9.202 12.708 2.872 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 11.249 10.860 2.346 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 10.451 13.147 2.403 1.00 0.00 C ATOM 2475 CH2 TRP A 158 11.472 12.224 2.140 1.00 0.00 C ATOM 0 H TRP A 158 5.599 8.828 5.183 1.00 0.00 H new ATOM 0 HA TRP A 158 6.991 11.341 6.040 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.682 10.632 3.365 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.401 12.183 3.749 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.536 8.463 3.847 1.00 0.00 H new ATOM 0 HE1 TRP A 158 9.980 8.313 3.018 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.421 13.427 3.071 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 12.032 10.144 2.145 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 10.625 14.201 2.244 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.430 12.566 1.778 1.00 0.00 H new ATOM 2486 N GLN A 159 4.782 12.735 5.958 1.00 0.00 N ATOM 2487 CA GLN A 159 3.493 13.407 6.288 1.00 0.00 C ATOM 2488 C GLN A 159 3.391 14.672 5.434 1.00 0.00 C ATOM 2489 O GLN A 159 4.390 15.314 5.159 1.00 0.00 O ATOM 2490 CB GLN A 159 3.473 13.785 7.772 1.00 0.00 C ATOM 2491 CG GLN A 159 2.959 12.602 8.595 1.00 0.00 C ATOM 2492 CD GLN A 159 2.804 13.026 10.057 1.00 0.00 C ATOM 2493 OE1 GLN A 159 3.289 12.360 10.950 1.00 0.00 O ATOM 2494 NE2 GLN A 159 2.147 14.117 10.342 1.00 0.00 N ATOM 0 H GLN A 159 5.578 13.365 5.856 1.00 0.00 H new ATOM 0 HA GLN A 159 2.654 12.741 6.086 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.475 14.062 8.101 1.00 0.00 H new ATOM 0 HB3 GLN A 159 2.834 14.654 7.928 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.002 12.260 8.201 1.00 0.00 H new ATOM 0 HG3 GLN A 159 3.652 11.764 8.520 1.00 0.00 H new ATOM 0 HE21 GLN A 159 1.739 14.677 9.593 1.00 0.00 H new ATOM 0 HE22 GLN A 159 2.041 14.410 11.313 1.00 0.00 H new ATOM 2503 N LYS A 160 2.214 15.038 4.992 1.00 0.00 N ATOM 2504 CA LYS A 160 2.084 16.258 4.144 1.00 0.00 C ATOM 2505 C LYS A 160 2.175 17.515 5.011 1.00 0.00 C ATOM 2506 O LYS A 160 1.426 17.687 5.953 1.00 0.00 O ATOM 2507 CB LYS A 160 0.723 16.233 3.444 1.00 0.00 C ATOM 2508 CG LYS A 160 0.751 17.154 2.223 1.00 0.00 C ATOM 2509 CD LYS A 160 -0.625 17.801 2.036 1.00 0.00 C ATOM 2510 CE LYS A 160 -1.225 17.362 0.697 1.00 0.00 C ATOM 2511 NZ LYS A 160 -2.525 18.060 0.475 1.00 0.00 N ATOM 0 H LYS A 160 1.341 14.545 5.182 1.00 0.00 H new ATOM 0 HA LYS A 160 2.889 16.272 3.409 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.480 15.215 3.138 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -0.057 16.553 4.135 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.511 17.924 2.353 1.00 0.00 H new ATOM 0 HG3 LYS A 160 1.021 16.586 1.333 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -1.287 17.514 2.853 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.534 18.887 2.066 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -0.535 17.592 -0.115 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -1.375 16.282 0.691 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -2.929 17.760 -0.435 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -3.184 17.819 1.243 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -2.369 19.088 0.462 1.00 0.00 H new ATOM 2525 N LYS A 161 3.084 18.397 4.695 1.00 0.00 N ATOM 2526 CA LYS A 161 3.222 19.648 5.492 1.00 0.00 C ATOM 2527 C LYS A 161 2.134 20.640 5.073 1.00 0.00 C ATOM 2528 O LYS A 161 1.544 20.518 4.017 1.00 0.00 O ATOM 2529 CB LYS A 161 4.599 20.264 5.239 1.00 0.00 C ATOM 2530 CG LYS A 161 5.683 19.223 5.520 1.00 0.00 C ATOM 2531 CD LYS A 161 5.799 19.002 7.030 1.00 0.00 C ATOM 2532 CE LYS A 161 6.487 20.207 7.676 1.00 0.00 C ATOM 2533 NZ LYS A 161 5.610 20.766 8.743 1.00 0.00 N ATOM 0 H LYS A 161 3.738 18.304 3.918 1.00 0.00 H new ATOM 0 HA LYS A 161 3.117 19.418 6.552 1.00 0.00 H new ATOM 0 HB2 LYS A 161 4.671 20.610 4.208 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.742 21.135 5.878 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.439 18.285 5.022 1.00 0.00 H new ATOM 0 HG3 LYS A 161 6.638 19.559 5.116 1.00 0.00 H new ATOM 0 HD2 LYS A 161 4.809 18.860 7.464 1.00 0.00 H new ATOM 0 HD3 LYS A 161 6.368 18.095 7.232 1.00 0.00 H new ATOM 0 HE2 LYS A 161 7.446 19.908 8.098 1.00 0.00 H new ATOM 0 HE3 LYS A 161 6.693 20.968 6.924 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 6.077 21.585 9.182 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 4.705 21.065 8.327 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 5.435 20.038 9.465 1.00 0.00 H new ATOM 2547 N ALA A 162 1.867 21.621 5.892 1.00 0.00 N ATOM 2548 CA ALA A 162 0.819 22.623 5.543 1.00 0.00 C ATOM 2549 C ALA A 162 1.126 23.949 6.242 1.00 0.00 C ATOM 2550 O ALA A 162 1.473 23.914 7.411 1.00 0.00 O ATOM 2551 CB ALA A 162 -0.549 22.111 5.999 1.00 0.00 C ATOM 2552 OXT ALA A 162 1.009 24.977 5.595 1.00 0.00 O ATOM 0 H ALA A 162 2.330 21.772 6.788 1.00 0.00 H new ATOM 0 HA ALA A 162 0.809 22.776 4.464 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -1.315 22.843 5.744 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -0.769 21.167 5.500 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -0.539 21.957 7.078 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 PA NDP A 168 -3.574 -2.974 -9.271 1.00 0.00 P HETATM 2560 O1A NDP A 168 -3.042 -1.722 -8.701 1.00 0.00 O HETATM 2561 O2A NDP A 168 -3.555 -4.175 -8.411 1.00 0.00 O HETATM 2562 O5B NDP A 168 -5.007 -2.751 -9.930 1.00 0.00 O HETATM 2563 C5B NDP A 168 -5.981 -1.897 -9.305 1.00 0.00 C HETATM 2564 C4B NDP A 168 -7.364 -2.222 -9.816 1.00 0.00 C HETATM 2565 O4B NDP A 168 -8.350 -1.453 -9.077 1.00 0.00 O HETATM 2566 C3B NDP A 168 -7.628 -1.874 -11.271 1.00 0.00 C HETATM 2567 O3B NDP A 168 -7.178 -2.920 -12.138 1.00 0.00 O HETATM 2568 C2B NDP A 168 -9.145 -1.739 -11.300 1.00 0.00 C HETATM 2569 O2B NDP A 168 -9.816 -2.976 -11.405 1.00 0.00 O HETATM 2570 C1B NDP A 168 -9.421 -1.100 -9.937 1.00 0.00 C HETATM 2571 N9A NDP A 168 -9.503 0.359 -9.987 1.00 0.00 N HETATM 2572 C8A NDP A 168 -8.469 1.256 -10.082 1.00 0.00 C HETATM 2573 N7A NDP A 168 -8.855 2.509 -10.097 1.00 0.00 N HETATM 2574 C5A NDP A 168 -10.237 2.431 -10.008 1.00 0.00 C HETATM 2575 C6A NDP A 168 -11.242 3.416 -9.973 1.00 0.00 C HETATM 2576 N6A NDP A 168 -10.991 4.728 -10.022 1.00 0.00 N HETATM 2577 N1A NDP A 168 -12.527 3.004 -9.884 1.00 0.00 N HETATM 2578 C2A NDP A 168 -12.776 1.688 -9.830 1.00 0.00 C HETATM 2579 N3A NDP A 168 -11.918 0.668 -9.855 1.00 0.00 N HETATM 2580 C4A NDP A 168 -10.652 1.112 -9.944 1.00 0.00 C HETATM 2581 O3 NDP A 168 -2.743 -3.310 -10.656 1.00 0.00 O HETATM 2582 PN NDP A 168 -1.255 -2.924 -11.254 1.00 0.00 P HETATM 2583 O1N NDP A 168 -0.996 -3.771 -12.435 1.00 0.00 O HETATM 2584 O2N NDP A 168 -1.191 -1.461 -11.434 1.00 0.00 O HETATM 2585 O5D NDP A 168 -0.395 -3.395 -10.000 1.00 0.00 O HETATM 2586 C5D NDP A 168 -0.795 -4.536 -9.220 1.00 0.00 C HETATM 2587 C4D NDP A 168 0.416 -5.347 -8.819 1.00 0.00 C HETATM 2588 O4D NDP A 168 1.340 -4.510 -8.074 1.00 0.00 O HETATM 2589 C3D NDP A 168 0.156 -6.525 -7.895 1.00 0.00 C HETATM 2590 O3D NDP A 168 -0.250 -7.678 -8.639 1.00 0.00 O HETATM 2591 C2D NDP A 168 1.522 -6.735 -7.251 1.00 0.00 C HETATM 2592 O2D NDP A 168 2.421 -7.490 -8.066 1.00 0.00 O HETATM 2593 C1D NDP A 168 2.017 -5.293 -7.105 1.00 0.00 C HETATM 2594 N1N NDP A 168 1.780 -4.706 -5.786 1.00 0.00 N HETATM 2595 C2N NDP A 168 2.595 -3.998 -5.011 1.00 0.00 C HETATM 2596 C3N NDP A 168 2.309 -3.450 -3.872 1.00 0.00 C HETATM 2597 C7N NDP A 168 3.478 -2.837 -3.311 1.00 0.00 C HETATM 2598 O7N NDP A 168 3.043 -2.281 -2.202 1.00 0.00 O HETATM 2599 N7N NDP A 168 4.759 -2.783 -3.755 1.00 0.00 N HETATM 2600 C4N NDP A 168 0.912 -3.612 -3.351 1.00 0.00 C HETATM 2601 C5N NDP A 168 -0.028 -4.374 -4.128 1.00 0.00 C HETATM 2602 C6N NDP A 168 0.322 -4.960 -5.350 1.00 0.00 C HETATM 2603 P2B NDP A 168 -10.675 -3.567 -12.707 1.00 0.00 P HETATM 2604 O1X NDP A 168 -11.880 -4.185 -11.898 1.00 0.00 O HETATM 2605 O2X NDP A 168 -11.118 -2.258 -13.360 1.00 0.00 O HETATM 2606 O3X NDP A 168 -9.745 -4.689 -13.164 1.00 0.00 O HETATM 0 HO3N NDP A 168 -0.563 -8.372 -8.022 1.00 0.00 H new HETATM 0 HO3A NDP A 168 -6.593 -2.544 -12.829 1.00 0.00 H new HETATM 0 HO2N NDP A 168 2.740 -8.270 -7.565 1.00 0.00 H new HETATM 0 H72N NDP A 168 5.467 -2.292 -3.210 1.00 0.00 H new HETATM 0 H71N NDP A 168 5.014 -3.234 -4.634 1.00 0.00 H new HETATM 0 H62A NDP A 168 -11.761 5.396 -9.993 1.00 0.00 H new HETATM 0 H61A NDP A 168 -10.029 5.061 -10.088 1.00 0.00 H new HETATM 0 H52N NDP A 168 -1.332 -4.207 -8.330 1.00 0.00 H new HETATM 0 H52A NDP A 168 -5.946 -2.024 -8.223 1.00 0.00 H new HETATM 0 H51N NDP A 168 -1.482 -5.156 -9.796 1.00 0.00 H new HETATM 0 H51A NDP A 168 -5.745 -0.853 -9.511 1.00 0.00 H new HETATM 0 H42N NDP A 168 0.978 -4.073 -2.365 1.00 0.00 H new HETATM 0 H41N NDP A 168 0.494 -2.615 -3.210 1.00 0.00 H new HETATM 0 H8A NDP A 168 -7.423 0.955 -10.140 1.00 0.00 H new HETATM 0 H6N NDP A 168 -0.378 -5.547 -5.945 1.00 0.00 H new HETATM 0 H5N NDP A 168 -1.044 -4.499 -3.754 1.00 0.00 H new HETATM 0 H4D NDP A 168 0.790 -5.723 -9.771 1.00 0.00 H new HETATM 0 H4B NDP A 168 -7.434 -3.303 -9.693 1.00 0.00 H new HETATM 0 H3D NDP A 168 -0.644 -6.353 -7.175 1.00 0.00 H new HETATM 0 H3B NDP A 168 -7.107 -0.980 -11.613 1.00 0.00 H new HETATM 0 H2N NDP A 168 3.614 -3.864 -5.373 1.00 0.00 H new HETATM 0 H2D NDP A 168 1.464 -7.305 -6.323 1.00 0.00 H new HETATM 0 H2B NDP A 168 -9.496 -1.173 -12.163 1.00 0.00 H new HETATM 0 H2A NDP A 168 -13.828 1.413 -9.755 1.00 0.00 H new HETATM 0 H1D NDP A 168 3.098 -5.306 -7.243 1.00 0.00 H new HETATM 0 H1B NDP A 168 -10.387 -1.464 -9.587 1.00 0.00 H new HETATM 2633 N1 TRR A 170 3.689 -4.778 1.385 1.00 0.00 N HETATM 2634 C2 TRR A 170 3.639 -3.437 1.693 1.00 0.00 C HETATM 2635 N2 TRR A 170 4.697 -2.843 2.347 1.00 0.00 N HETATM 2636 N3 TRR A 170 2.531 -2.690 1.347 1.00 0.00 N HETATM 2637 C4 TRR A 170 1.470 -3.284 0.691 1.00 0.00 C HETATM 2638 N4 TRR A 170 0.365 -2.539 0.345 1.00 0.00 N HETATM 2639 C5 TRR A 170 1.517 -4.635 0.379 1.00 0.00 C HETATM 2640 C6 TRR A 170 2.639 -5.381 0.732 1.00 0.00 C HETATM 2641 C7 TRR A 170 0.353 -5.277 -0.334 1.00 0.00 C HETATM 2642 C11 TRR A 170 0.462 -6.770 -0.449 1.00 0.00 C HETATM 2643 C12 TRR A 170 0.875 -7.346 -1.648 1.00 0.00 C HETATM 2644 C13 TRR A 170 0.974 -8.738 -1.759 1.00 0.00 C HETATM 2645 C14 TRR A 170 0.658 -9.545 -0.665 1.00 0.00 C HETATM 2646 C15 TRR A 170 0.244 -8.970 0.538 1.00 0.00 C HETATM 2647 C16 TRR A 170 0.147 -7.573 0.642 1.00 0.00 C HETATM 2648 O13 TRR A 170 1.386 -9.329 -2.952 1.00 0.00 O HETATM 2649 O14 TRR A 170 0.755 -10.917 -0.773 1.00 0.00 O HETATM 2650 O15 TRR A 170 -0.062 -9.799 1.621 1.00 0.00 O HETATM 2651 C17 TRR A 170 1.701 -8.506 -4.048 1.00 0.00 C HETATM 2652 C18 TRR A 170 2.005 -11.506 -0.547 1.00 0.00 C HETATM 2653 C19 TRR A 170 -0.468 -9.233 2.846 1.00 0.00 C HETATM 0 H193 TRR A 170 0.320 -8.583 3.225 1.00 0.00 H new HETATM 0 H192 TRR A 170 -1.377 -8.651 2.694 1.00 0.00 H new HETATM 0 H191 TRR A 170 -0.662 -10.027 3.567 1.00 0.00 H new HETATM 0 H183 TRR A 170 2.727 -11.114 -1.263 1.00 0.00 H new HETATM 0 H182 TRR A 170 2.337 -11.277 0.466 1.00 0.00 H new HETATM 0 H181 TRR A 170 1.925 -12.586 -0.667 1.00 0.00 H new HETATM 0 H173 TRR A 170 0.827 -7.916 -4.323 1.00 0.00 H new HETATM 0 H172 TRR A 170 2.519 -7.838 -3.778 1.00 0.00 H new HETATM 0 H171 TRR A 170 2.002 -9.125 -4.893 1.00 0.00 H new HETATM 0 H72 TRR A 170 -0.567 -5.029 0.195 1.00 0.00 H new HETATM 0 H71 TRR A 170 0.271 -4.850 -1.333 1.00 0.00 H new HETATM 0 H6 TRR A 170 2.685 -6.443 0.491 1.00 0.00 H new HETATM 0 H42 TRR A 170 -0.417 -2.981 -0.139 1.00 0.00 H new HETATM 0 H41 TRR A 170 0.328 -1.545 0.573 1.00 0.00 H new HETATM 0 H22 TRR A 170 4.662 -1.850 2.576 1.00 0.00 H new HETATM 0 H21 TRR A 170 5.515 -3.397 2.602 1.00 0.00 H new HETATM 0 H16 TRR A 170 -0.175 -7.118 1.578 1.00 0.00 H new HETATM 0 H12 TRR A 170 1.121 -6.713 -2.500 1.00 0.00 H new HETATM 0 H1 TRR A 170 4.509 -5.327 1.642 1.00 0.00 H new