USER MOD reduce.3.24.130724 H: found=0, std=0, add=1293, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 1293 hydrogens (26 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 138 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 141 SER OG : rot -170:sc= -0.112 USER MOD Set 2.1: A 137 THR OG1 : rot -90:sc= 0.899 USER MOD Set 2.2: A 161 LYS NZ :NH3+ -105:sc= 1.04 (180deg=0) USER MOD Set 3.1: A 116 THR OG1 : rot -89:sc=-0.000168 USER MOD Set 3.2: A 155 TYR OH : rot -62:sc= 0.0699 USER MOD Set 4.1: A 112 THR OG1 : rot -4:sc= 1.27 USER MOD Set 4.2: A 159 GLN :FLIP amide:sc= 0.964 F(o=-0.9,f=2.2) USER MOD Set 5.1: A 39 MET CE :methyl 173:sc= -2.29! (180deg=-2.67!) USER MOD Set 5.2: A 59 ASN : amide:sc= -5.06! C(o=-7.4!,f=-15!) USER MOD Set 6.1: A 58 THR OG1 : rot 128:sc= 0.00776 USER MOD Set 6.2: A 92 GLN :FLIP amide:sc= -0.717 F(o=-2.3,f=-0.71) USER MOD Set 7.1: A 48 SER OG : rot 105:sc= 1.22 USER MOD Set 7.2: A 170 NDP O3D : rot -70:sc= -1.27 USER MOD Single : A 1 THR N :NH3+ -151:sc= 0.0316 (180deg=-0.2) USER MOD Single : A 1 THR OG1 : rot 38:sc= 0.0262 USER MOD Single : A 7 GLN :FLIP amide:sc= -3.68! C(o=-7.2!,f=-3.7!) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS :FLIP no HD1:sc= -0.514 F(o=-1.2,f=-0.51) USER MOD Single : A 22 HIS : no HD1:sc= -0.141 X(o=-0.14,f=-0.34) USER MOD Single : A 28 HIS : no HD1:sc= -0.0028 X(o=-0.0028,f=-0.4) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 THR OG1 : rot -106:sc= 0.0117 USER MOD Single : A 37 LYS NZ :NH3+ -153:sc= -0.829 (180deg=-3.03!) USER MOD Single : A 45 THR OG1 : rot -70:sc= -0.811 USER MOD Single : A 46 TYR OH : rot 99:sc= 0.725 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 63 THR OG1 : rot 180:sc= -1.15 USER MOD Single : A 64 HIS :FLIP no HD1:sc= -6.1! C(o=-9.6!,f=-6.1!) USER MOD Single : A 65 GLN :FLIP amide:sc=-0.00491 F(o=-0.71,f=-0.0049) USER MOD Single : A 68 TYR OH : rot 85:sc= 1.36 USER MOD Single : A 69 GLN :FLIP amide:sc= -0.438 F(o=-1.9,f=-0.44) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HE2:sc= -2.86 K(o=-2.9,f=-5.9!) USER MOD Single : A 85 TYR OH : rot 180:sc= -4.05! USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.0584 X(o=-0.058,f=-0.034) USER MOD Single : A 89 HIS : no HD1:sc= -0.133 X(o=-0.13,f=-0.26) USER MOD Single : A 101 GLN : amide:sc= -0.0222 X(o=-0.022,f=0) USER MOD Single : A 104 THR OG1 : rot 67:sc= -5.52! USER MOD Single : A 107 LYS NZ :NH3+ -167:sc=0.000461 (180deg=-0.262) USER MOD Single : A 121 SER OG : rot 180:sc= 0 USER MOD Single : A 126 THR OG1 : rot 180:sc= -0.0928 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 MET CE :methyl -162:sc= -3.79! (180deg=-5.01!) USER MOD Single : A 132 ASN :FLIP amide:sc= 0 F(o=-0.55,f=0) USER MOD Single : A 140 SER OG : rot 180:sc= 0 USER MOD Single : A 143 THR OG1 : rot 180:sc= 0 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0711 USER MOD Single : A 148 ASN : amide:sc= -0.287 K(o=-0.29,f=-3!) USER MOD Single : A 152 THR OG1 : rot 92:sc= 0.49 USER MOD Single : A 153 HIS : no HE2:sc= -7.66! C(o=-7.7!,f=-7.8!) USER MOD Single : A 154 THR OG1 : rot -173:sc= -2.81! USER MOD Single : A 160 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 170 NDP O2D : rot 85:sc= -1.06 USER MOD Single : A 170 NDP O3B : rot -85:sc= 0.881 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.300 9.276 5.052 1.00 0.00 N ATOM 2 CA THR A 1 -4.682 8.829 3.776 1.00 0.00 C ATOM 3 C THR A 1 -3.187 8.578 3.946 1.00 0.00 C ATOM 4 O THR A 1 -2.393 9.517 4.012 1.00 0.00 O ATOM 5 CB THR A 1 -4.919 9.906 2.716 1.00 0.00 C ATOM 6 OG1 THR A 1 -4.455 11.165 3.168 1.00 0.00 O ATOM 7 CG2 THR A 1 -6.376 10.063 2.338 1.00 0.00 C ATOM 0 H1 THR A 1 -6.296 8.979 5.078 1.00 0.00 H new ATOM 0 H2 THR A 1 -4.791 8.850 5.852 1.00 0.00 H new ATOM 0 H3 THR A 1 -5.246 10.312 5.120 1.00 0.00 H new ATOM 0 HA THR A 1 -5.140 7.889 3.466 1.00 0.00 H new ATOM 0 HB THR A 1 -4.366 9.573 1.838 1.00 0.00 H new ATOM 0 HG1 THR A 1 -3.623 11.045 3.672 1.00 0.00 H new ATOM 0 HG21 THR A 1 -6.474 10.842 1.582 1.00 0.00 H new ATOM 0 HG22 THR A 1 -6.752 9.121 1.938 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.953 10.339 3.221 1.00 0.00 H new ATOM 17 N ALA A 2 -2.810 7.306 4.016 1.00 0.00 N ATOM 18 CA ALA A 2 -1.411 6.932 4.177 1.00 0.00 C ATOM 19 C ALA A 2 -1.017 5.843 3.184 1.00 0.00 C ATOM 20 O ALA A 2 -1.793 4.929 2.909 1.00 0.00 O ATOM 21 CB ALA A 2 -1.150 6.471 5.604 1.00 0.00 C ATOM 0 H ALA A 2 -3.454 6.517 3.964 1.00 0.00 H new ATOM 0 HA ALA A 2 -0.798 7.810 3.974 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.101 6.194 5.711 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.384 7.280 6.296 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.777 5.608 5.828 1.00 0.00 H new ATOM 27 N PHE A 3 0.193 5.948 2.648 1.00 0.00 N ATOM 28 CA PHE A 3 0.691 4.972 1.684 1.00 0.00 C ATOM 29 C PHE A 3 1.692 4.029 2.341 1.00 0.00 C ATOM 30 O PHE A 3 2.592 4.468 3.053 1.00 0.00 O ATOM 31 CB PHE A 3 1.354 5.685 0.503 1.00 0.00 C ATOM 32 CG PHE A 3 0.392 6.133 -0.563 1.00 0.00 C ATOM 33 CD1 PHE A 3 -0.893 6.539 -0.237 1.00 0.00 C ATOM 34 CD2 PHE A 3 0.778 6.151 -1.894 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.773 6.954 -1.219 1.00 0.00 C ATOM 36 CE2 PHE A 3 -0.098 6.564 -2.879 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.375 6.966 -2.541 1.00 0.00 C ATOM 0 H PHE A 3 0.848 6.699 2.864 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.156 4.389 1.322 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.897 6.554 0.875 1.00 0.00 H new ATOM 0 HB3 PHE A 3 2.090 5.017 0.056 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.210 6.531 0.795 1.00 0.00 H new ATOM 0 HD2 PHE A 3 1.776 5.838 -2.164 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.771 7.269 -0.952 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.216 6.572 -3.912 1.00 0.00 H new ATOM 0 HZ PHE A 3 -2.061 7.289 -3.310 1.00 0.00 H new ATOM 47 N LEU A 4 1.530 2.732 2.101 1.00 0.00 N ATOM 48 CA LEU A 4 2.425 1.738 2.676 1.00 0.00 C ATOM 49 C LEU A 4 2.635 0.570 1.716 1.00 0.00 C ATOM 50 O LEU A 4 1.703 -0.178 1.423 1.00 0.00 O ATOM 51 CB LEU A 4 1.861 1.229 4.003 1.00 0.00 C ATOM 52 CG LEU A 4 2.595 0.031 4.608 1.00 0.00 C ATOM 53 CD1 LEU A 4 3.956 0.450 5.142 1.00 0.00 C ATOM 54 CD2 LEU A 4 1.755 -0.598 5.707 1.00 0.00 C ATOM 0 H LEU A 4 0.790 2.347 1.514 1.00 0.00 H new ATOM 0 HA LEU A 4 3.390 2.212 2.854 1.00 0.00 H new ATOM 0 HB2 LEU A 4 1.878 2.047 4.724 1.00 0.00 H new ATOM 0 HB3 LEU A 4 0.816 0.957 3.854 1.00 0.00 H new ATOM 0 HG LEU A 4 2.754 -0.712 3.826 1.00 0.00 H new ATOM 0 HD11 LEU A 4 4.462 -0.416 5.568 1.00 0.00 H new ATOM 0 HD12 LEU A 4 4.556 0.857 4.328 1.00 0.00 H new ATOM 0 HD13 LEU A 4 3.826 1.210 5.913 1.00 0.00 H new ATOM 0 HD21 LEU A 4 2.288 -1.450 6.130 1.00 0.00 H new ATOM 0 HD22 LEU A 4 1.569 0.138 6.489 1.00 0.00 H new ATOM 0 HD23 LEU A 4 0.805 -0.934 5.292 1.00 0.00 H new ATOM 66 N TRP A 5 3.865 0.415 1.231 1.00 0.00 N ATOM 67 CA TRP A 5 4.187 -0.669 0.310 1.00 0.00 C ATOM 68 C TRP A 5 5.691 -0.939 0.283 1.00 0.00 C ATOM 69 O TRP A 5 6.492 -0.072 0.630 1.00 0.00 O ATOM 70 CB TRP A 5 3.671 -0.343 -1.099 1.00 0.00 C ATOM 71 CG TRP A 5 4.596 0.522 -1.903 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.563 0.099 -2.769 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.642 1.954 -1.918 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.209 1.179 -3.320 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.663 2.328 -2.813 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.921 2.956 -1.262 1.00 0.00 C ATOM 77 CZ2 TRP A 5 5.979 3.660 -3.066 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.236 4.278 -1.517 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.257 4.619 -2.412 1.00 0.00 C ATOM 0 H TRP A 5 4.651 1.024 1.460 1.00 0.00 H new ATOM 0 HA TRP A 5 3.691 -1.573 0.663 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.502 -1.275 -1.638 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.705 0.156 -1.015 1.00 0.00 H new ATOM 0 HD1 TRP A 5 5.787 -0.934 -2.989 1.00 0.00 H new ATOM 0 HE1 TRP A 5 6.971 1.133 -3.996 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.133 2.702 -0.569 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 6.767 3.926 -3.755 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.685 5.061 -1.017 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.479 5.661 -2.589 1.00 0.00 H new ATOM 90 N ALA A 6 6.067 -2.143 -0.140 1.00 0.00 N ATOM 91 CA ALA A 6 7.474 -2.519 -0.221 1.00 0.00 C ATOM 92 C ALA A 6 7.971 -2.409 -1.656 1.00 0.00 C ATOM 93 O ALA A 6 7.206 -2.606 -2.600 1.00 0.00 O ATOM 94 CB ALA A 6 7.677 -3.932 0.305 1.00 0.00 C ATOM 0 H ALA A 6 5.417 -2.873 -0.431 1.00 0.00 H new ATOM 0 HA ALA A 6 8.052 -1.833 0.399 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.732 -4.197 0.238 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.356 -3.983 1.345 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.089 -4.630 -0.291 1.00 0.00 H new ATOM 100 N GLN A 7 9.249 -2.081 -1.824 1.00 0.00 N ATOM 101 CA GLN A 7 9.813 -1.938 -3.161 1.00 0.00 C ATOM 102 C GLN A 7 11.314 -2.209 -3.180 1.00 0.00 C ATOM 103 O GLN A 7 11.984 -2.154 -2.149 1.00 0.00 O ATOM 104 CB GLN A 7 9.537 -0.531 -3.692 1.00 0.00 C ATOM 105 CG GLN A 7 9.975 0.571 -2.740 1.00 0.00 C ATOM 106 CD GLN A 7 8.830 1.473 -2.318 1.00 0.00 C ATOM 107 OE1 GLN A 7 8.032 1.012 -1.360 1.00 0.00 O flip ATOM 108 NE2 GLN A 7 8.665 2.572 -2.847 1.00 0.00 N flip ATOM 0 H GLN A 7 9.905 -1.911 -1.062 1.00 0.00 H new ATOM 0 HA GLN A 7 9.334 -2.679 -3.801 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.051 -0.403 -4.645 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.470 -0.428 -3.889 1.00 0.00 H new ATOM 0 HG2 GLN A 7 10.424 0.122 -1.854 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.748 1.172 -3.219 1.00 0.00 H new ATOM 0 HE21 GLN A 7 9.302 2.886 -3.579 1.00 0.00 H new ATOM 0 HE22 GLN A 7 7.891 3.168 -2.553 1.00 0.00 H new ATOM 117 N ASP A 8 11.831 -2.492 -4.373 1.00 0.00 N ATOM 118 CA ASP A 8 13.252 -2.763 -4.560 1.00 0.00 C ATOM 119 C ASP A 8 13.966 -1.514 -5.072 1.00 0.00 C ATOM 120 O ASP A 8 13.408 -0.417 -5.039 1.00 0.00 O ATOM 121 CB ASP A 8 13.446 -3.927 -5.539 1.00 0.00 C ATOM 122 CG ASP A 8 12.999 -3.590 -6.950 1.00 0.00 C ATOM 123 OD1 ASP A 8 12.568 -2.441 -7.181 1.00 0.00 O ATOM 124 OD2 ASP A 8 13.081 -4.477 -7.826 1.00 0.00 O ATOM 0 H ASP A 8 11.281 -2.540 -5.231 1.00 0.00 H new ATOM 0 HA ASP A 8 13.684 -3.041 -3.599 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.498 -4.211 -5.554 1.00 0.00 H new ATOM 0 HB3 ASP A 8 12.887 -4.792 -5.183 1.00 0.00 H new ATOM 129 N ARG A 9 15.195 -1.680 -5.553 1.00 0.00 N ATOM 130 CA ARG A 9 15.961 -0.553 -6.077 1.00 0.00 C ATOM 131 C ARG A 9 15.347 -0.043 -7.380 1.00 0.00 C ATOM 132 O ARG A 9 15.457 1.138 -7.711 1.00 0.00 O ATOM 133 CB ARG A 9 17.417 -0.960 -6.309 1.00 0.00 C ATOM 134 CG ARG A 9 18.210 -1.140 -5.025 1.00 0.00 C ATOM 135 CD ARG A 9 18.467 0.192 -4.338 1.00 0.00 C ATOM 136 NE ARG A 9 19.471 0.987 -5.042 1.00 0.00 N ATOM 137 CZ ARG A 9 19.886 2.185 -4.635 1.00 0.00 C ATOM 138 NH1 ARG A 9 19.388 2.729 -3.532 1.00 0.00 N ATOM 139 NH2 ARG A 9 20.802 2.841 -5.335 1.00 0.00 N ATOM 0 H ARG A 9 15.679 -2.577 -5.591 1.00 0.00 H new ATOM 0 HA ARG A 9 15.932 0.250 -5.341 1.00 0.00 H new ATOM 0 HB2 ARG A 9 17.439 -1.892 -6.874 1.00 0.00 H new ATOM 0 HB3 ARG A 9 17.904 -0.203 -6.924 1.00 0.00 H new ATOM 0 HG2 ARG A 9 17.666 -1.800 -4.349 1.00 0.00 H new ATOM 0 HG3 ARG A 9 19.160 -1.625 -5.248 1.00 0.00 H new ATOM 0 HD2 ARG A 9 17.535 0.755 -4.279 1.00 0.00 H new ATOM 0 HD3 ARG A 9 18.798 0.014 -3.315 1.00 0.00 H new ATOM 0 HE ARG A 9 19.877 0.602 -5.895 1.00 0.00 H new ATOM 0 HH11 ARG A 9 18.683 2.229 -2.990 1.00 0.00 H new ATOM 0 HH12 ARG A 9 19.710 3.647 -3.226 1.00 0.00 H new ATOM 0 HH21 ARG A 9 21.188 2.428 -6.184 1.00 0.00 H new ATOM 0 HH22 ARG A 9 21.121 3.759 -5.024 1.00 0.00 H new ATOM 153 N ASP A 10 14.699 -0.945 -8.111 1.00 0.00 N ATOM 154 CA ASP A 10 14.060 -0.602 -9.378 1.00 0.00 C ATOM 155 C ASP A 10 12.652 -0.043 -9.159 1.00 0.00 C ATOM 156 O ASP A 10 11.942 0.263 -10.117 1.00 0.00 O ATOM 157 CB ASP A 10 13.994 -1.831 -10.286 1.00 0.00 C ATOM 158 CG ASP A 10 13.967 -1.463 -11.756 1.00 0.00 C ATOM 159 OD1 ASP A 10 12.905 -1.016 -12.237 1.00 0.00 O ATOM 160 OD2 ASP A 10 15.008 -1.623 -12.428 1.00 0.00 O ATOM 0 H ASP A 10 14.602 -1.925 -7.846 1.00 0.00 H new ATOM 0 HA ASP A 10 14.662 0.170 -9.857 1.00 0.00 H new ATOM 0 HB2 ASP A 10 14.855 -2.471 -10.090 1.00 0.00 H new ATOM 0 HB3 ASP A 10 13.104 -2.411 -10.043 1.00 0.00 H new ATOM 165 N GLY A 11 12.255 0.087 -7.896 1.00 0.00 N ATOM 166 CA GLY A 11 10.935 0.607 -7.584 1.00 0.00 C ATOM 167 C GLY A 11 9.860 -0.466 -7.617 1.00 0.00 C ATOM 168 O GLY A 11 8.693 -0.191 -7.339 1.00 0.00 O ATOM 0 H GLY A 11 12.823 -0.158 -7.085 1.00 0.00 H new ATOM 0 HA2 GLY A 11 10.954 1.066 -6.596 1.00 0.00 H new ATOM 0 HA3 GLY A 11 10.681 1.392 -8.296 1.00 0.00 H new ATOM 172 N LEU A 12 10.255 -1.692 -7.956 1.00 0.00 N ATOM 173 CA LEU A 12 9.325 -2.816 -8.022 1.00 0.00 C ATOM 174 C LEU A 12 8.440 -2.864 -6.780 1.00 0.00 C ATOM 175 O LEU A 12 8.680 -2.153 -5.806 1.00 0.00 O ATOM 176 CB LEU A 12 10.113 -4.127 -8.153 1.00 0.00 C ATOM 177 CG LEU A 12 9.317 -5.354 -8.617 1.00 0.00 C ATOM 178 CD1 LEU A 12 8.735 -5.128 -10.005 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.212 -6.584 -8.610 1.00 0.00 C ATOM 0 H LEU A 12 11.218 -1.932 -8.190 1.00 0.00 H new ATOM 0 HA LEU A 12 8.683 -2.686 -8.893 1.00 0.00 H new ATOM 0 HB2 LEU A 12 10.932 -3.965 -8.854 1.00 0.00 H new ATOM 0 HB3 LEU A 12 10.561 -4.355 -7.186 1.00 0.00 H new ATOM 0 HG LEU A 12 8.489 -5.513 -7.926 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.175 -6.011 -10.313 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.069 -4.265 -9.984 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.543 -4.946 -10.713 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.641 -7.452 -8.940 1.00 0.00 H new ATOM 0 HD22 LEU A 12 11.054 -6.425 -9.284 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.584 -6.758 -7.600 1.00 0.00 H new ATOM 191 N ILE A 13 7.432 -3.724 -6.816 1.00 0.00 N ATOM 192 CA ILE A 13 6.522 -3.897 -5.692 1.00 0.00 C ATOM 193 C ILE A 13 5.966 -5.315 -5.679 1.00 0.00 C ATOM 194 O ILE A 13 5.729 -5.891 -4.621 1.00 0.00 O ATOM 195 CB ILE A 13 5.355 -2.884 -5.719 1.00 0.00 C ATOM 196 CG1 ILE A 13 4.440 -3.115 -6.925 1.00 0.00 C ATOM 197 CG2 ILE A 13 5.883 -1.459 -5.726 1.00 0.00 C ATOM 198 CD1 ILE A 13 2.973 -3.092 -6.565 1.00 0.00 C ATOM 0 H ILE A 13 7.223 -4.318 -7.619 1.00 0.00 H new ATOM 0 HA ILE A 13 7.098 -3.715 -4.785 1.00 0.00 H new ATOM 0 HB ILE A 13 4.766 -3.037 -4.815 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.637 -2.349 -7.675 1.00 0.00 H new ATOM 0 HG13 ILE A 13 4.682 -4.076 -7.379 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.046 -0.761 -5.745 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.478 -1.287 -4.829 1.00 0.00 H new ATOM 0 HG23 ILE A 13 6.504 -1.305 -6.609 1.00 0.00 H new ATOM 0 HD11 ILE A 13 2.376 -3.261 -7.461 1.00 0.00 H new ATOM 0 HD12 ILE A 13 2.765 -3.876 -5.837 1.00 0.00 H new ATOM 0 HD13 ILE A 13 2.718 -2.122 -6.137 1.00 0.00 H new ATOM 210 N GLY A 14 5.764 -5.875 -6.868 1.00 0.00 N ATOM 211 CA GLY A 14 5.238 -7.216 -6.971 1.00 0.00 C ATOM 212 C GLY A 14 5.771 -7.962 -8.176 1.00 0.00 C ATOM 213 O GLY A 14 6.534 -7.416 -8.972 1.00 0.00 O ATOM 0 H GLY A 14 5.957 -5.420 -7.760 1.00 0.00 H new ATOM 0 HA2 GLY A 14 5.488 -7.770 -6.066 1.00 0.00 H new ATOM 0 HA3 GLY A 14 4.150 -7.172 -7.028 1.00 0.00 H new ATOM 217 N LYS A 15 5.353 -9.212 -8.308 1.00 0.00 N ATOM 218 CA LYS A 15 5.767 -10.056 -9.421 1.00 0.00 C ATOM 219 C LYS A 15 4.549 -10.700 -10.078 1.00 0.00 C ATOM 220 O LYS A 15 4.488 -11.920 -10.239 1.00 0.00 O ATOM 221 CB LYS A 15 6.736 -11.136 -8.935 1.00 0.00 C ATOM 222 CG LYS A 15 6.086 -12.174 -8.031 1.00 0.00 C ATOM 223 CD LYS A 15 6.291 -13.586 -8.558 1.00 0.00 C ATOM 224 CE LYS A 15 5.029 -14.423 -8.422 1.00 0.00 C ATOM 225 NZ LYS A 15 4.674 -15.104 -9.698 1.00 0.00 N ATOM 0 H LYS A 15 4.721 -9.669 -7.651 1.00 0.00 H new ATOM 0 HA LYS A 15 6.275 -9.435 -10.158 1.00 0.00 H new ATOM 0 HB2 LYS A 15 7.170 -11.639 -9.799 1.00 0.00 H new ATOM 0 HB3 LYS A 15 7.557 -10.661 -8.398 1.00 0.00 H new ATOM 0 HG2 LYS A 15 6.504 -12.096 -7.028 1.00 0.00 H new ATOM 0 HG3 LYS A 15 5.019 -11.968 -7.948 1.00 0.00 H new ATOM 0 HD2 LYS A 15 6.589 -13.544 -9.606 1.00 0.00 H new ATOM 0 HD3 LYS A 15 7.105 -14.064 -8.013 1.00 0.00 H new ATOM 0 HE2 LYS A 15 5.171 -15.169 -7.640 1.00 0.00 H new ATOM 0 HE3 LYS A 15 4.202 -13.785 -8.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 3.808 -15.664 -9.563 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 4.514 -14.392 -10.439 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 5.452 -15.732 -9.984 1.00 0.00 H new ATOM 239 N ASP A 16 3.573 -9.871 -10.443 1.00 0.00 N ATOM 240 CA ASP A 16 2.342 -10.354 -11.071 1.00 0.00 C ATOM 241 C ASP A 16 1.424 -10.989 -10.030 1.00 0.00 C ATOM 242 O ASP A 16 0.660 -11.905 -10.333 1.00 0.00 O ATOM 243 CB ASP A 16 2.658 -11.364 -12.180 1.00 0.00 C ATOM 244 CG ASP A 16 1.758 -11.195 -13.388 1.00 0.00 C ATOM 245 OD1 ASP A 16 1.541 -10.040 -13.811 1.00 0.00 O ATOM 246 OD2 ASP A 16 1.269 -12.219 -13.911 1.00 0.00 O ATOM 0 H ASP A 16 3.610 -8.860 -10.315 1.00 0.00 H new ATOM 0 HA ASP A 16 1.831 -9.500 -11.515 1.00 0.00 H new ATOM 0 HB2 ASP A 16 3.698 -11.250 -12.486 1.00 0.00 H new ATOM 0 HB3 ASP A 16 2.550 -12.375 -11.788 1.00 0.00 H new ATOM 251 N GLY A 17 1.511 -10.490 -8.800 1.00 0.00 N ATOM 252 CA GLY A 17 0.694 -11.005 -7.717 1.00 0.00 C ATOM 253 C GLY A 17 1.013 -10.328 -6.398 1.00 0.00 C ATOM 254 O GLY A 17 0.114 -9.894 -5.678 1.00 0.00 O ATOM 0 H GLY A 17 2.139 -9.732 -8.534 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -0.359 -10.858 -7.955 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.852 -12.079 -7.622 1.00 0.00 H new ATOM 258 N HIS A 18 2.303 -10.232 -6.088 1.00 0.00 N ATOM 259 CA HIS A 18 2.759 -9.598 -4.855 1.00 0.00 C ATOM 260 C HIS A 18 4.282 -9.517 -4.829 1.00 0.00 C ATOM 261 O HIS A 18 4.942 -9.814 -5.825 1.00 0.00 O ATOM 262 CB HIS A 18 2.250 -10.373 -3.638 1.00 0.00 C ATOM 263 CG HIS A 18 2.813 -11.756 -3.529 1.00 0.00 C ATOM 264 ND1 HIS A 18 3.712 -12.411 -4.302 1.00 0.00 N flip ATOM 265 CD2 HIS A 18 2.457 -12.637 -2.529 1.00 0.00 C flip ATOM 266 CE1 HIS A 18 3.880 -13.661 -3.760 1.00 0.00 C flip ATOM 267 NE2 HIS A 18 3.113 -13.773 -2.692 1.00 0.00 N flip ATOM 0 H HIS A 18 3.055 -10.588 -6.678 1.00 0.00 H new ATOM 0 HA HIS A 18 2.356 -8.586 -4.818 1.00 0.00 H new ATOM 0 HB2 HIS A 18 2.498 -9.817 -2.734 1.00 0.00 H new ATOM 0 HB3 HIS A 18 1.163 -10.435 -3.686 1.00 0.00 H new ATOM 0 HD2 HIS A 18 1.752 -12.431 -1.737 1.00 0.00 H new ATOM 0 HE1 HIS A 18 4.534 -14.429 -4.145 1.00 0.00 H new ATOM 0 HE2 HIS A 18 3.039 -14.596 -2.094 1.00 0.00 H new ATOM 276 N LEU A 19 4.836 -9.116 -3.691 1.00 0.00 N ATOM 277 CA LEU A 19 6.283 -9.000 -3.554 1.00 0.00 C ATOM 278 C LEU A 19 6.950 -10.372 -3.664 1.00 0.00 C ATOM 279 O LEU A 19 6.660 -11.274 -2.878 1.00 0.00 O ATOM 280 CB LEU A 19 6.646 -8.349 -2.219 1.00 0.00 C ATOM 281 CG LEU A 19 5.921 -8.915 -0.995 1.00 0.00 C ATOM 282 CD1 LEU A 19 6.852 -9.804 -0.187 1.00 0.00 C ATOM 283 CD2 LEU A 19 5.377 -7.787 -0.132 1.00 0.00 C ATOM 0 H LEU A 19 4.309 -8.867 -2.854 1.00 0.00 H new ATOM 0 HA LEU A 19 6.648 -8.369 -4.364 1.00 0.00 H new ATOM 0 HB2 LEU A 19 7.720 -8.452 -2.064 1.00 0.00 H new ATOM 0 HB3 LEU A 19 6.434 -7.282 -2.285 1.00 0.00 H new ATOM 0 HG LEU A 19 5.083 -9.521 -1.340 1.00 0.00 H new ATOM 0 HD11 LEU A 19 6.319 -10.197 0.679 1.00 0.00 H new ATOM 0 HD12 LEU A 19 7.195 -10.631 -0.808 1.00 0.00 H new ATOM 0 HD13 LEU A 19 7.710 -9.222 0.149 1.00 0.00 H new ATOM 0 HD21 LEU A 19 4.864 -8.206 0.734 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.200 -7.156 0.204 1.00 0.00 H new ATOM 0 HD23 LEU A 19 4.676 -7.189 -0.714 1.00 0.00 H new ATOM 295 N PRO A 20 7.850 -10.552 -4.650 1.00 0.00 N ATOM 296 CA PRO A 20 8.547 -11.826 -4.860 1.00 0.00 C ATOM 297 C PRO A 20 9.643 -12.082 -3.828 1.00 0.00 C ATOM 298 O PRO A 20 10.222 -13.168 -3.787 1.00 0.00 O ATOM 299 CB PRO A 20 9.159 -11.663 -6.251 1.00 0.00 C ATOM 300 CG PRO A 20 9.372 -10.197 -6.397 1.00 0.00 C ATOM 301 CD PRO A 20 8.253 -9.534 -5.641 1.00 0.00 C ATOM 0 HA PRO A 20 7.870 -12.675 -4.764 1.00 0.00 H new ATOM 0 HB2 PRO A 20 10.097 -12.211 -6.338 1.00 0.00 H new ATOM 0 HB3 PRO A 20 8.493 -12.046 -7.025 1.00 0.00 H new ATOM 0 HG2 PRO A 20 10.342 -9.902 -5.995 1.00 0.00 H new ATOM 0 HG3 PRO A 20 9.360 -9.904 -7.447 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.585 -8.615 -5.159 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.427 -9.268 -6.300 1.00 0.00 H new ATOM 309 N TRP A 21 9.931 -11.082 -3.000 1.00 0.00 N ATOM 310 CA TRP A 21 10.963 -11.215 -1.979 1.00 0.00 C ATOM 311 C TRP A 21 10.362 -11.662 -0.651 1.00 0.00 C ATOM 312 O TRP A 21 9.264 -11.247 -0.283 1.00 0.00 O ATOM 313 CB TRP A 21 11.706 -9.891 -1.799 1.00 0.00 C ATOM 314 CG TRP A 21 10.796 -8.706 -1.688 1.00 0.00 C ATOM 315 CD1 TRP A 21 9.934 -8.429 -0.668 1.00 0.00 C ATOM 316 CD2 TRP A 21 10.654 -7.642 -2.635 1.00 0.00 C ATOM 317 NE1 TRP A 21 9.268 -7.254 -0.918 1.00 0.00 N ATOM 318 CE2 TRP A 21 9.692 -6.752 -2.121 1.00 0.00 C ATOM 319 CE3 TRP A 21 11.248 -7.354 -3.867 1.00 0.00 C ATOM 320 CZ2 TRP A 21 9.312 -5.594 -2.797 1.00 0.00 C ATOM 321 CZ3 TRP A 21 10.869 -6.206 -4.537 1.00 0.00 C ATOM 322 CH2 TRP A 21 9.910 -5.338 -4.001 1.00 0.00 C ATOM 0 H TRP A 21 9.466 -10.174 -3.016 1.00 0.00 H new ATOM 0 HA TRP A 21 11.669 -11.976 -2.310 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.325 -9.949 -0.903 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.380 -9.744 -2.643 1.00 0.00 H new ATOM 0 HD1 TRP A 21 9.795 -9.044 0.209 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.572 -6.825 -0.308 1.00 0.00 H new ATOM 0 HE3 TRP A 21 11.990 -8.017 -4.288 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.572 -4.923 -2.386 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 11.320 -5.975 -5.490 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.637 -4.448 -4.549 1.00 0.00 H new ATOM 333 N HIS A 22 11.091 -12.512 0.065 1.00 0.00 N ATOM 334 CA HIS A 22 10.632 -13.018 1.353 1.00 0.00 C ATOM 335 C HIS A 22 10.965 -12.036 2.472 1.00 0.00 C ATOM 336 O HIS A 22 12.057 -12.074 3.038 1.00 0.00 O ATOM 337 CB HIS A 22 11.270 -14.378 1.645 1.00 0.00 C ATOM 338 CG HIS A 22 10.317 -15.374 2.229 1.00 0.00 C ATOM 339 ND1 HIS A 22 9.064 -15.616 1.705 1.00 0.00 N ATOM 340 CD2 HIS A 22 10.440 -16.197 3.298 1.00 0.00 C ATOM 341 CE1 HIS A 22 8.458 -16.542 2.425 1.00 0.00 C ATOM 342 NE2 HIS A 22 9.271 -16.912 3.398 1.00 0.00 N ATOM 0 H HIS A 22 12.003 -12.865 -0.226 1.00 0.00 H new ATOM 0 HA HIS A 22 9.549 -13.134 1.306 1.00 0.00 H new ATOM 0 HB2 HIS A 22 11.684 -14.782 0.721 1.00 0.00 H new ATOM 0 HB3 HIS A 22 12.104 -14.239 2.333 1.00 0.00 H new ATOM 0 HD2 HIS A 22 11.297 -16.276 3.950 1.00 0.00 H new ATOM 0 HE1 HIS A 22 7.466 -16.931 2.248 1.00 0.00 H new ATOM 0 HE2 HIS A 22 9.065 -17.614 4.108 1.00 0.00 H new ATOM 351 N LEU A 23 10.017 -11.156 2.781 1.00 0.00 N ATOM 352 CA LEU A 23 10.209 -10.162 3.831 1.00 0.00 C ATOM 353 C LEU A 23 9.257 -10.408 5.003 1.00 0.00 C ATOM 354 O LEU A 23 8.181 -9.814 5.071 1.00 0.00 O ATOM 355 CB LEU A 23 9.990 -8.755 3.269 1.00 0.00 C ATOM 356 CG LEU A 23 11.268 -8.000 2.906 1.00 0.00 C ATOM 357 CD1 LEU A 23 11.996 -8.693 1.764 1.00 0.00 C ATOM 358 CD2 LEU A 23 10.948 -6.557 2.543 1.00 0.00 C ATOM 0 H LEU A 23 9.109 -11.111 2.319 1.00 0.00 H new ATOM 0 HA LEU A 23 11.232 -10.250 4.197 1.00 0.00 H new ATOM 0 HB2 LEU A 23 9.364 -8.828 2.380 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.435 -8.169 4.002 1.00 0.00 H new ATOM 0 HG LEU A 23 11.925 -7.998 3.776 1.00 0.00 H new ATOM 0 HD11 LEU A 23 12.903 -8.139 1.521 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.259 -9.708 2.063 1.00 0.00 H new ATOM 0 HD13 LEU A 23 11.348 -8.729 0.888 1.00 0.00 H new ATOM 0 HD21 LEU A 23 11.869 -6.033 2.287 1.00 0.00 H new ATOM 0 HD22 LEU A 23 10.271 -6.538 1.689 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.475 -6.065 3.392 1.00 0.00 H new ATOM 370 N PRO A 24 9.642 -11.285 5.946 1.00 0.00 N ATOM 371 CA PRO A 24 8.815 -11.600 7.116 1.00 0.00 C ATOM 372 C PRO A 24 8.548 -10.373 7.983 1.00 0.00 C ATOM 373 O PRO A 24 7.540 -10.305 8.685 1.00 0.00 O ATOM 374 CB PRO A 24 9.650 -12.626 7.892 1.00 0.00 C ATOM 375 CG PRO A 24 10.633 -13.159 6.906 1.00 0.00 C ATOM 376 CD PRO A 24 10.908 -12.037 5.948 1.00 0.00 C ATOM 0 HA PRO A 24 7.832 -11.969 6.825 1.00 0.00 H new ATOM 0 HB2 PRO A 24 10.155 -12.162 8.739 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.022 -13.423 8.292 1.00 0.00 H new ATOM 0 HG2 PRO A 24 11.548 -13.481 7.403 1.00 0.00 H new ATOM 0 HG3 PRO A 24 10.231 -14.028 6.385 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.743 -11.420 6.279 1.00 0.00 H new ATOM 0 HD3 PRO A 24 11.159 -12.407 4.954 1.00 0.00 H new ATOM 384 N ASP A 25 9.463 -9.410 7.934 1.00 0.00 N ATOM 385 CA ASP A 25 9.338 -8.192 8.714 1.00 0.00 C ATOM 386 C ASP A 25 8.208 -7.308 8.192 1.00 0.00 C ATOM 387 O ASP A 25 7.460 -6.719 8.972 1.00 0.00 O ATOM 388 CB ASP A 25 10.657 -7.424 8.684 1.00 0.00 C ATOM 389 CG ASP A 25 11.215 -7.276 7.282 1.00 0.00 C ATOM 390 OD1 ASP A 25 11.399 -8.309 6.604 1.00 0.00 O ATOM 391 OD2 ASP A 25 11.469 -6.128 6.862 1.00 0.00 O ATOM 0 H ASP A 25 10.303 -9.454 7.357 1.00 0.00 H new ATOM 0 HA ASP A 25 9.098 -8.470 9.740 1.00 0.00 H new ATOM 0 HB2 ASP A 25 10.507 -6.435 9.117 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.387 -7.939 9.309 1.00 0.00 H new ATOM 396 N ASP A 26 8.094 -7.213 6.871 1.00 0.00 N ATOM 397 CA ASP A 26 7.057 -6.391 6.254 1.00 0.00 C ATOM 398 C ASP A 26 5.669 -6.958 6.531 1.00 0.00 C ATOM 399 O ASP A 26 4.801 -6.263 7.060 1.00 0.00 O ATOM 400 CB ASP A 26 7.289 -6.281 4.747 1.00 0.00 C ATOM 401 CG ASP A 26 8.114 -5.062 4.381 1.00 0.00 C ATOM 402 OD1 ASP A 26 9.255 -4.947 4.876 1.00 0.00 O ATOM 403 OD2 ASP A 26 7.619 -4.221 3.601 1.00 0.00 O ATOM 0 H ASP A 26 8.704 -7.693 6.209 1.00 0.00 H new ATOM 0 HA ASP A 26 7.113 -5.395 6.694 1.00 0.00 H new ATOM 0 HB2 ASP A 26 7.795 -7.179 4.393 1.00 0.00 H new ATOM 0 HB3 ASP A 26 6.328 -6.234 4.236 1.00 0.00 H new ATOM 408 N LEU A 27 5.461 -8.222 6.174 1.00 0.00 N ATOM 409 CA LEU A 27 4.179 -8.874 6.389 1.00 0.00 C ATOM 410 C LEU A 27 3.769 -8.794 7.856 1.00 0.00 C ATOM 411 O LEU A 27 2.627 -8.465 8.175 1.00 0.00 O ATOM 412 CB LEU A 27 4.243 -10.334 5.936 1.00 0.00 C ATOM 413 CG LEU A 27 5.575 -11.052 6.192 1.00 0.00 C ATOM 414 CD1 LEU A 27 5.400 -12.154 7.224 1.00 0.00 C ATOM 415 CD2 LEU A 27 6.132 -11.620 4.893 1.00 0.00 C ATOM 0 H LEU A 27 6.166 -8.813 5.734 1.00 0.00 H new ATOM 0 HA LEU A 27 3.428 -8.354 5.795 1.00 0.00 H new ATOM 0 HB2 LEU A 27 3.450 -10.887 6.440 1.00 0.00 H new ATOM 0 HB3 LEU A 27 4.029 -10.374 4.868 1.00 0.00 H new ATOM 0 HG LEU A 27 6.287 -10.326 6.585 1.00 0.00 H new ATOM 0 HD11 LEU A 27 6.356 -12.651 7.391 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.046 -11.723 8.160 1.00 0.00 H new ATOM 0 HD13 LEU A 27 4.672 -12.880 6.861 1.00 0.00 H new ATOM 0 HD21 LEU A 27 7.077 -12.126 5.093 1.00 0.00 H new ATOM 0 HD22 LEU A 27 5.421 -12.331 4.473 1.00 0.00 H new ATOM 0 HD23 LEU A 27 6.297 -10.810 4.183 1.00 0.00 H new ATOM 427 N HIS A 28 4.711 -9.090 8.746 1.00 0.00 N ATOM 428 CA HIS A 28 4.449 -9.042 10.179 1.00 0.00 C ATOM 429 C HIS A 28 4.208 -7.606 10.633 1.00 0.00 C ATOM 430 O HIS A 28 3.444 -7.357 11.566 1.00 0.00 O ATOM 431 CB HIS A 28 5.623 -9.646 10.954 1.00 0.00 C ATOM 432 CG HIS A 28 5.435 -9.628 12.439 1.00 0.00 C ATOM 433 ND1 HIS A 28 4.205 -9.778 13.044 1.00 0.00 N ATOM 434 CD2 HIS A 28 6.330 -9.475 13.444 1.00 0.00 C ATOM 435 CE1 HIS A 28 4.351 -9.718 14.356 1.00 0.00 C ATOM 436 NE2 HIS A 28 5.631 -9.535 14.624 1.00 0.00 N ATOM 0 H HIS A 28 5.662 -9.365 8.500 1.00 0.00 H new ATOM 0 HA HIS A 28 3.552 -9.627 10.383 1.00 0.00 H new ATOM 0 HB2 HIS A 28 5.771 -10.675 10.628 1.00 0.00 H new ATOM 0 HB3 HIS A 28 6.532 -9.098 10.705 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.395 -9.332 13.337 1.00 0.00 H new ATOM 0 HE1 HIS A 28 3.559 -9.804 15.085 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.035 -9.452 15.557 1.00 0.00 H new ATOM 445 N TYR A 29 4.863 -6.664 9.961 1.00 0.00 N ATOM 446 CA TYR A 29 4.722 -5.250 10.287 1.00 0.00 C ATOM 447 C TYR A 29 3.447 -4.673 9.676 1.00 0.00 C ATOM 448 O TYR A 29 2.914 -3.674 10.158 1.00 0.00 O ATOM 449 CB TYR A 29 5.940 -4.470 9.786 1.00 0.00 C ATOM 450 CG TYR A 29 5.904 -2.997 10.126 1.00 0.00 C ATOM 451 CD1 TYR A 29 6.407 -2.531 11.334 1.00 0.00 C ATOM 452 CD2 TYR A 29 5.368 -2.073 9.238 1.00 0.00 C ATOM 453 CE1 TYR A 29 6.376 -1.185 11.648 1.00 0.00 C ATOM 454 CE2 TYR A 29 5.334 -0.726 9.544 1.00 0.00 C ATOM 455 CZ TYR A 29 5.839 -0.287 10.750 1.00 0.00 C ATOM 456 OH TYR A 29 5.808 1.054 11.058 1.00 0.00 O ATOM 0 H TYR A 29 5.498 -6.856 9.186 1.00 0.00 H new ATOM 0 HA TYR A 29 4.656 -5.156 11.371 1.00 0.00 H new ATOM 0 HB2 TYR A 29 6.842 -4.910 10.212 1.00 0.00 H new ATOM 0 HB3 TYR A 29 6.011 -4.582 8.704 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.829 -3.231 12.039 1.00 0.00 H new ATOM 0 HD2 TYR A 29 4.971 -2.413 8.293 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.770 -0.839 12.592 1.00 0.00 H new ATOM 0 HE2 TYR A 29 4.914 -0.020 8.842 1.00 0.00 H new ATOM 0 HH TYR A 29 5.399 1.550 10.318 1.00 0.00 H new ATOM 466 N PHE A 30 2.964 -5.308 8.612 1.00 0.00 N ATOM 467 CA PHE A 30 1.753 -4.859 7.935 1.00 0.00 C ATOM 468 C PHE A 30 0.514 -5.149 8.778 1.00 0.00 C ATOM 469 O PHE A 30 -0.345 -4.286 8.955 1.00 0.00 O ATOM 470 CB PHE A 30 1.628 -5.545 6.571 1.00 0.00 C ATOM 471 CG PHE A 30 1.580 -4.586 5.416 1.00 0.00 C ATOM 472 CD1 PHE A 30 2.749 -4.089 4.863 1.00 0.00 C ATOM 473 CD2 PHE A 30 0.367 -4.183 4.883 1.00 0.00 C ATOM 474 CE1 PHE A 30 2.709 -3.208 3.799 1.00 0.00 C ATOM 475 CE2 PHE A 30 0.320 -3.303 3.818 1.00 0.00 C ATOM 476 CZ PHE A 30 1.492 -2.815 3.276 1.00 0.00 C ATOM 0 H PHE A 30 3.394 -6.136 8.200 1.00 0.00 H new ATOM 0 HA PHE A 30 1.825 -3.781 7.791 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.472 -6.221 6.436 1.00 0.00 H new ATOM 0 HB3 PHE A 30 0.725 -6.156 6.563 1.00 0.00 H new ATOM 0 HD1 PHE A 30 3.703 -4.394 5.268 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.553 -4.561 5.304 1.00 0.00 H new ATOM 0 HE1 PHE A 30 3.627 -2.827 3.377 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -0.632 -2.998 3.411 1.00 0.00 H new ATOM 0 HZ PHE A 30 1.458 -2.127 2.444 1.00 0.00 H new ATOM 486 N ARG A 31 0.427 -6.372 9.289 1.00 0.00 N ATOM 487 CA ARG A 31 -0.708 -6.783 10.108 1.00 0.00 C ATOM 488 C ARG A 31 -0.668 -6.115 11.480 1.00 0.00 C ATOM 489 O ARG A 31 -1.708 -5.800 12.057 1.00 0.00 O ATOM 490 CB ARG A 31 -0.716 -8.304 10.273 1.00 0.00 C ATOM 491 CG ARG A 31 -1.399 -9.038 9.130 1.00 0.00 C ATOM 492 CD ARG A 31 -2.900 -9.148 9.347 1.00 0.00 C ATOM 493 NE ARG A 31 -3.230 -9.742 10.642 1.00 0.00 N ATOM 494 CZ ARG A 31 -3.562 -9.040 11.726 1.00 0.00 C ATOM 495 NH1 ARG A 31 -3.580 -7.713 11.692 1.00 0.00 N ATOM 496 NH2 ARG A 31 -3.868 -9.669 12.853 1.00 0.00 N ATOM 0 H ARG A 31 1.130 -7.098 9.150 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.620 -6.469 9.600 1.00 0.00 H new ATOM 0 HB2 ARG A 31 0.312 -8.657 10.357 1.00 0.00 H new ATOM 0 HB3 ARG A 31 -1.218 -8.557 11.207 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.204 -8.515 8.194 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -0.972 -10.036 9.032 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -3.349 -8.157 9.279 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -3.337 -9.751 8.551 1.00 0.00 H new ATOM 0 HE ARG A 31 -3.205 -10.759 10.721 1.00 0.00 H new ATOM 0 HH11 ARG A 31 -3.339 -7.222 10.831 1.00 0.00 H new ATOM 0 HH12 ARG A 31 -3.835 -7.185 12.526 1.00 0.00 H new ATOM 0 HH21 ARG A 31 -3.849 -10.688 12.890 1.00 0.00 H new ATOM 0 HH22 ARG A 31 -4.122 -9.134 13.683 1.00 0.00 H new ATOM 510 N ALA A 32 0.538 -5.911 11.999 1.00 0.00 N ATOM 511 CA ALA A 32 0.712 -5.289 13.307 1.00 0.00 C ATOM 512 C ALA A 32 0.300 -3.820 13.289 1.00 0.00 C ATOM 513 O ALA A 32 -0.222 -3.302 14.276 1.00 0.00 O ATOM 514 CB ALA A 32 2.156 -5.426 13.765 1.00 0.00 C ATOM 0 H ALA A 32 1.409 -6.167 11.534 1.00 0.00 H new ATOM 0 HA ALA A 32 0.062 -5.807 14.012 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.274 -4.958 14.742 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.417 -6.482 13.834 1.00 0.00 H new ATOM 0 HB3 ALA A 32 2.814 -4.936 13.047 1.00 0.00 H new ATOM 520 N GLN A 33 0.542 -3.152 12.167 1.00 0.00 N ATOM 521 CA GLN A 33 0.200 -1.740 12.030 1.00 0.00 C ATOM 522 C GLN A 33 -1.253 -1.560 11.598 1.00 0.00 C ATOM 523 O GLN A 33 -1.871 -0.534 11.882 1.00 0.00 O ATOM 524 CB GLN A 33 1.134 -1.065 11.023 1.00 0.00 C ATOM 525 CG GLN A 33 2.046 -0.021 11.645 1.00 0.00 C ATOM 526 CD GLN A 33 1.441 1.369 11.627 1.00 0.00 C ATOM 527 OE1 GLN A 33 0.717 1.755 12.545 1.00 0.00 O ATOM 528 NE2 GLN A 33 1.735 2.129 10.579 1.00 0.00 N ATOM 0 H GLN A 33 0.973 -3.564 11.340 1.00 0.00 H new ATOM 0 HA GLN A 33 0.323 -1.269 13.005 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.745 -1.827 10.539 1.00 0.00 H new ATOM 0 HB3 GLN A 33 0.535 -0.594 10.243 1.00 0.00 H new ATOM 0 HG2 GLN A 33 2.266 -0.304 12.674 1.00 0.00 H new ATOM 0 HG3 GLN A 33 2.995 -0.007 11.108 1.00 0.00 H new ATOM 0 HE21 GLN A 33 2.340 1.768 9.841 1.00 0.00 H new ATOM 0 HE22 GLN A 33 1.356 3.074 10.512 1.00 0.00 H new ATOM 537 N THR A 34 -1.794 -2.558 10.908 1.00 0.00 N ATOM 538 CA THR A 34 -3.173 -2.498 10.434 1.00 0.00 C ATOM 539 C THR A 34 -4.155 -3.012 11.485 1.00 0.00 C ATOM 540 O THR A 34 -5.249 -3.468 11.152 1.00 0.00 O ATOM 541 CB THR A 34 -3.320 -3.307 9.145 1.00 0.00 C ATOM 542 OG1 THR A 34 -2.887 -4.644 9.344 1.00 0.00 O ATOM 543 CG2 THR A 34 -2.533 -2.728 7.987 1.00 0.00 C ATOM 0 H THR A 34 -1.300 -3.417 10.665 1.00 0.00 H new ATOM 0 HA THR A 34 -3.410 -1.452 10.238 1.00 0.00 H new ATOM 0 HB THR A 34 -4.380 -3.272 8.893 1.00 0.00 H new ATOM 0 HG1 THR A 34 -2.021 -4.776 8.904 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.679 -3.347 7.102 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.879 -1.715 7.782 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.474 -2.704 8.243 1.00 0.00 H new ATOM 551 N VAL A 35 -3.767 -2.932 12.755 1.00 0.00 N ATOM 552 CA VAL A 35 -4.625 -3.387 13.841 1.00 0.00 C ATOM 553 C VAL A 35 -5.454 -2.236 14.398 1.00 0.00 C ATOM 554 O VAL A 35 -5.048 -1.565 15.347 1.00 0.00 O ATOM 555 CB VAL A 35 -3.807 -4.018 14.983 1.00 0.00 C ATOM 556 CG1 VAL A 35 -4.729 -4.642 16.019 1.00 0.00 C ATOM 557 CG2 VAL A 35 -2.835 -5.051 14.434 1.00 0.00 C ATOM 0 H VAL A 35 -2.867 -2.557 13.055 1.00 0.00 H new ATOM 0 HA VAL A 35 -5.289 -4.145 13.424 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.231 -3.232 15.470 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -4.133 -5.083 16.818 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -5.382 -3.874 16.434 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -5.334 -5.417 15.548 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -2.265 -5.487 15.255 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -3.390 -5.836 13.921 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -2.152 -4.571 13.733 1.00 0.00 H new ATOM 567 N GLY A 36 -6.617 -2.011 13.798 1.00 0.00 N ATOM 568 CA GLY A 36 -7.488 -0.939 14.240 1.00 0.00 C ATOM 569 C GLY A 36 -7.623 0.164 13.207 1.00 0.00 C ATOM 570 O GLY A 36 -8.069 1.267 13.524 1.00 0.00 O ATOM 0 H GLY A 36 -6.973 -2.554 13.011 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.474 -1.346 14.464 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.099 -0.518 15.167 1.00 0.00 H new ATOM 574 N LYS A 37 -7.238 -0.132 11.968 1.00 0.00 N ATOM 575 CA LYS A 37 -7.321 0.845 10.890 1.00 0.00 C ATOM 576 C LYS A 37 -7.976 0.236 9.655 1.00 0.00 C ATOM 577 O LYS A 37 -8.403 -0.918 9.673 1.00 0.00 O ATOM 578 CB LYS A 37 -5.927 1.367 10.537 1.00 0.00 C ATOM 579 CG LYS A 37 -5.215 2.036 11.702 1.00 0.00 C ATOM 580 CD LYS A 37 -4.301 3.154 11.228 1.00 0.00 C ATOM 581 CE LYS A 37 -4.262 4.302 12.224 1.00 0.00 C ATOM 582 NZ LYS A 37 -5.621 4.848 12.494 1.00 0.00 N ATOM 0 H LYS A 37 -6.866 -1.040 11.688 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.936 1.677 11.234 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.318 0.538 10.178 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -6.012 2.079 9.716 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -5.952 2.437 12.398 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -4.632 1.294 12.248 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.294 2.764 11.081 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -4.645 3.521 10.261 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -3.817 3.958 13.158 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.622 5.096 11.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -5.544 5.846 12.775 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -6.202 4.774 11.635 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -6.067 4.306 13.261 1.00 0.00 H new ATOM 596 N ILE A 38 -8.051 1.019 8.584 1.00 0.00 N ATOM 597 CA ILE A 38 -8.654 0.554 7.339 1.00 0.00 C ATOM 598 C ILE A 38 -7.626 0.531 6.212 1.00 0.00 C ATOM 599 O ILE A 38 -6.775 1.416 6.119 1.00 0.00 O ATOM 600 CB ILE A 38 -9.854 1.431 6.905 1.00 0.00 C ATOM 601 CG1 ILE A 38 -10.356 2.300 8.064 1.00 0.00 C ATOM 602 CG2 ILE A 38 -10.979 0.554 6.377 1.00 0.00 C ATOM 603 CD1 ILE A 38 -11.266 3.425 7.622 1.00 0.00 C ATOM 0 H ILE A 38 -7.703 1.977 8.552 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.016 -0.456 7.532 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.517 2.096 6.110 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.889 1.670 8.776 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.499 2.721 8.590 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.818 1.181 6.075 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -10.624 -0.016 5.518 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.303 -0.133 7.159 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -11.584 3.999 8.492 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -10.730 4.077 6.933 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.141 3.010 7.122 1.00 0.00 H new ATOM 615 N MET A 39 -7.706 -0.487 5.361 1.00 0.00 N ATOM 616 CA MET A 39 -6.777 -0.624 4.244 1.00 0.00 C ATOM 617 C MET A 39 -7.520 -0.708 2.912 1.00 0.00 C ATOM 618 O MET A 39 -8.470 -1.476 2.766 1.00 0.00 O ATOM 619 CB MET A 39 -5.902 -1.866 4.437 1.00 0.00 C ATOM 620 CG MET A 39 -4.928 -2.117 3.296 1.00 0.00 C ATOM 621 SD MET A 39 -4.540 -3.866 3.089 1.00 0.00 S ATOM 622 CE MET A 39 -6.182 -4.556 2.892 1.00 0.00 C ATOM 0 H MET A 39 -8.404 -1.229 5.423 1.00 0.00 H new ATOM 0 HA MET A 39 -6.143 0.263 4.222 1.00 0.00 H new ATOM 0 HB2 MET A 39 -5.340 -1.762 5.365 1.00 0.00 H new ATOM 0 HB3 MET A 39 -6.546 -2.738 4.550 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.352 -1.730 2.369 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.007 -1.564 3.481 1.00 0.00 H new ATOM 0 HE1 MET A 39 -6.104 -5.611 2.630 1.00 0.00 H new ATOM 0 HE2 MET A 39 -6.734 -4.453 3.826 1.00 0.00 H new ATOM 0 HE3 MET A 39 -6.708 -4.024 2.099 1.00 0.00 H new ATOM 632 N VAL A 40 -7.071 0.085 1.943 1.00 0.00 N ATOM 633 CA VAL A 40 -7.680 0.103 0.617 1.00 0.00 C ATOM 634 C VAL A 40 -6.825 -0.673 -0.378 1.00 0.00 C ATOM 635 O VAL A 40 -5.617 -0.455 -0.476 1.00 0.00 O ATOM 636 CB VAL A 40 -7.873 1.545 0.110 1.00 0.00 C ATOM 637 CG1 VAL A 40 -8.673 1.556 -1.183 1.00 0.00 C ATOM 638 CG2 VAL A 40 -8.550 2.396 1.175 1.00 0.00 C ATOM 0 H VAL A 40 -6.285 0.726 2.052 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.657 -0.372 0.701 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.892 1.974 -0.097 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.798 2.583 -1.525 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -8.143 0.983 -1.944 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.652 1.110 -1.009 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.679 3.412 0.801 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.525 1.971 1.415 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -7.932 2.415 2.072 1.00 0.00 H new ATOM 648 N VAL A 41 -7.455 -1.591 -1.104 1.00 0.00 N ATOM 649 CA VAL A 41 -6.744 -2.413 -2.076 1.00 0.00 C ATOM 650 C VAL A 41 -7.299 -2.221 -3.493 1.00 0.00 C ATOM 651 O VAL A 41 -8.380 -1.662 -3.676 1.00 0.00 O ATOM 652 CB VAL A 41 -6.804 -3.905 -1.670 1.00 0.00 C ATOM 653 CG1 VAL A 41 -7.892 -4.653 -2.429 1.00 0.00 C ATOM 654 CG2 VAL A 41 -5.448 -4.566 -1.868 1.00 0.00 C ATOM 0 H VAL A 41 -8.454 -1.784 -1.038 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.703 -2.090 -2.082 1.00 0.00 H new ATOM 0 HB VAL A 41 -7.060 -3.951 -0.612 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -7.902 -5.697 -2.116 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -8.861 -4.201 -2.216 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -7.693 -4.597 -3.499 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -5.509 -5.615 -1.578 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -5.159 -4.496 -2.917 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -4.704 -4.061 -1.252 1.00 0.00 H new ATOM 664 N GLY A 42 -6.544 -2.686 -4.488 1.00 0.00 N ATOM 665 CA GLY A 42 -6.966 -2.556 -5.875 1.00 0.00 C ATOM 666 C GLY A 42 -7.645 -3.808 -6.401 1.00 0.00 C ATOM 667 O GLY A 42 -7.618 -4.853 -5.752 1.00 0.00 O ATOM 0 H GLY A 42 -5.646 -3.151 -4.358 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -7.650 -1.712 -5.965 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.098 -2.331 -6.495 1.00 0.00 H new ATOM 671 N ARG A 43 -8.258 -3.704 -7.582 1.00 0.00 N ATOM 672 CA ARG A 43 -8.946 -4.842 -8.187 1.00 0.00 C ATOM 673 C ARG A 43 -8.016 -6.049 -8.293 1.00 0.00 C ATOM 674 O ARG A 43 -8.262 -7.096 -7.692 1.00 0.00 O ATOM 675 CB ARG A 43 -9.471 -4.468 -9.576 1.00 0.00 C ATOM 676 CG ARG A 43 -9.975 -5.659 -10.381 1.00 0.00 C ATOM 677 CD ARG A 43 -11.350 -5.395 -10.968 1.00 0.00 C ATOM 678 NE ARG A 43 -11.371 -4.179 -11.778 1.00 0.00 N ATOM 679 CZ ARG A 43 -11.429 -4.168 -13.111 1.00 0.00 C ATOM 680 NH1 ARG A 43 -11.455 -5.305 -13.797 1.00 0.00 N ATOM 681 NH2 ARG A 43 -11.456 -3.013 -13.761 1.00 0.00 N ATOM 0 H ARG A 43 -8.291 -2.847 -8.135 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.786 -5.108 -7.546 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -10.280 -3.746 -9.467 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -8.676 -3.974 -10.134 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -9.272 -5.880 -11.184 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -10.015 -6.541 -9.741 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -11.653 -6.245 -11.580 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -12.078 -5.307 -10.162 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.339 -3.282 -11.294 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -11.431 -6.198 -13.305 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -11.499 -5.285 -14.816 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -11.432 -2.135 -13.242 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.500 -3.002 -14.780 1.00 0.00 H new ATOM 695 N ARG A 44 -6.942 -5.892 -9.057 1.00 0.00 N ATOM 696 CA ARG A 44 -5.974 -6.965 -9.234 1.00 0.00 C ATOM 697 C ARG A 44 -5.322 -7.326 -7.903 1.00 0.00 C ATOM 698 O ARG A 44 -4.728 -8.395 -7.763 1.00 0.00 O ATOM 699 CB ARG A 44 -4.904 -6.556 -10.248 1.00 0.00 C ATOM 700 CG ARG A 44 -5.417 -6.475 -11.676 1.00 0.00 C ATOM 701 CD ARG A 44 -5.867 -7.834 -12.187 1.00 0.00 C ATOM 702 NE ARG A 44 -7.322 -7.947 -12.236 1.00 0.00 N ATOM 703 CZ ARG A 44 -7.968 -9.002 -12.725 1.00 0.00 C ATOM 704 NH1 ARG A 44 -7.293 -10.037 -13.208 1.00 0.00 N ATOM 705 NH2 ARG A 44 -9.294 -9.022 -12.731 1.00 0.00 N ATOM 0 H ARG A 44 -6.720 -5.034 -9.562 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.501 -7.841 -9.612 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -4.496 -5.586 -9.962 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.083 -7.272 -10.206 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -6.250 -5.773 -11.725 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -4.632 -6.084 -12.323 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -5.457 -8.000 -13.183 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -5.464 -8.615 -11.542 1.00 0.00 H new ATOM 0 HE ARG A 44 -7.876 -7.171 -11.874 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -6.273 -10.027 -13.206 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -7.794 -10.843 -13.582 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -9.818 -8.229 -12.361 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -9.790 -9.831 -13.106 1.00 0.00 H new ATOM 719 N THR A 45 -5.432 -6.426 -6.930 1.00 0.00 N ATOM 720 CA THR A 45 -4.849 -6.647 -5.614 1.00 0.00 C ATOM 721 C THR A 45 -5.697 -7.607 -4.782 1.00 0.00 C ATOM 722 O THR A 45 -5.190 -8.607 -4.273 1.00 0.00 O ATOM 723 CB THR A 45 -4.689 -5.318 -4.878 1.00 0.00 C ATOM 724 OG1 THR A 45 -4.672 -4.234 -5.792 1.00 0.00 O ATOM 725 CG2 THR A 45 -3.424 -5.244 -4.052 1.00 0.00 C ATOM 0 H THR A 45 -5.921 -5.536 -7.030 1.00 0.00 H new ATOM 0 HA THR A 45 -3.868 -7.100 -5.756 1.00 0.00 H new ATOM 0 HB THR A 45 -5.547 -5.253 -4.209 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.838 -4.253 -6.307 1.00 0.00 H new ATOM 0 HG21 THR A 45 -3.370 -4.275 -3.555 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.431 -6.036 -3.303 1.00 0.00 H new ATOM 0 HG23 THR A 45 -2.557 -5.367 -4.702 1.00 0.00 H new ATOM 733 N TYR A 46 -6.989 -7.303 -4.637 1.00 0.00 N ATOM 734 CA TYR A 46 -7.881 -8.157 -3.854 1.00 0.00 C ATOM 735 C TYR A 46 -7.763 -9.612 -4.300 1.00 0.00 C ATOM 736 O TYR A 46 -7.755 -10.526 -3.475 1.00 0.00 O ATOM 737 CB TYR A 46 -9.341 -7.672 -3.951 1.00 0.00 C ATOM 738 CG TYR A 46 -10.020 -7.955 -5.279 1.00 0.00 C ATOM 739 CD1 TYR A 46 -10.254 -9.258 -5.704 1.00 0.00 C ATOM 740 CD2 TYR A 46 -10.427 -6.917 -6.109 1.00 0.00 C ATOM 741 CE1 TYR A 46 -10.865 -9.518 -6.911 1.00 0.00 C ATOM 742 CE2 TYR A 46 -11.042 -7.172 -7.321 1.00 0.00 C ATOM 743 CZ TYR A 46 -11.256 -8.473 -7.718 1.00 0.00 C ATOM 744 OH TYR A 46 -11.867 -8.730 -8.924 1.00 0.00 O ATOM 0 H TYR A 46 -7.435 -6.482 -5.046 1.00 0.00 H new ATOM 0 HA TYR A 46 -7.576 -8.093 -2.809 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -9.919 -8.143 -3.156 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.365 -6.598 -3.769 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -9.951 -10.082 -5.076 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.260 -5.895 -5.802 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -11.037 -10.538 -7.223 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.353 -6.354 -7.954 1.00 0.00 H new ATOM 0 HH TYR A 46 -12.838 -8.643 -8.824 1.00 0.00 H new ATOM 754 N GLU A 47 -7.669 -9.818 -5.611 1.00 0.00 N ATOM 755 CA GLU A 47 -7.549 -11.160 -6.168 1.00 0.00 C ATOM 756 C GLU A 47 -6.115 -11.664 -6.055 1.00 0.00 C ATOM 757 O GLU A 47 -5.866 -12.870 -6.050 1.00 0.00 O ATOM 758 CB GLU A 47 -7.994 -11.168 -7.632 1.00 0.00 C ATOM 759 CG GLU A 47 -9.201 -12.050 -7.894 1.00 0.00 C ATOM 760 CD GLU A 47 -8.816 -13.460 -8.298 1.00 0.00 C ATOM 761 OE1 GLU A 47 -8.231 -14.179 -7.461 1.00 0.00 O ATOM 762 OE2 GLU A 47 -9.101 -13.845 -9.452 1.00 0.00 O ATOM 0 H GLU A 47 -7.674 -9.072 -6.307 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.196 -11.826 -5.597 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -8.226 -10.148 -7.938 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.165 -11.507 -8.253 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -9.819 -12.089 -6.997 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.809 -11.604 -8.681 1.00 0.00 H new ATOM 769 N SER A 48 -5.177 -10.729 -5.963 1.00 0.00 N ATOM 770 CA SER A 48 -3.763 -11.073 -5.849 1.00 0.00 C ATOM 771 C SER A 48 -3.261 -10.888 -4.418 1.00 0.00 C ATOM 772 O SER A 48 -2.061 -10.730 -4.190 1.00 0.00 O ATOM 773 CB SER A 48 -2.929 -10.220 -6.806 1.00 0.00 C ATOM 774 OG SER A 48 -3.338 -10.410 -8.149 1.00 0.00 O ATOM 0 H SER A 48 -5.369 -9.727 -5.965 1.00 0.00 H new ATOM 0 HA SER A 48 -3.654 -12.124 -6.117 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.026 -9.168 -6.539 1.00 0.00 H new ATOM 0 HB3 SER A 48 -1.875 -10.479 -6.704 1.00 0.00 H new ATOM 0 HG SER A 48 -3.851 -9.630 -8.448 1.00 0.00 H new ATOM 780 N PHE A 49 -4.180 -10.910 -3.457 1.00 0.00 N ATOM 781 CA PHE A 49 -3.818 -10.747 -2.053 1.00 0.00 C ATOM 782 C PHE A 49 -3.753 -12.103 -1.349 1.00 0.00 C ATOM 783 O PHE A 49 -4.654 -12.928 -1.496 1.00 0.00 O ATOM 784 CB PHE A 49 -4.824 -9.837 -1.346 1.00 0.00 C ATOM 785 CG PHE A 49 -4.209 -8.971 -0.283 1.00 0.00 C ATOM 786 CD1 PHE A 49 -3.313 -7.968 -0.618 1.00 0.00 C ATOM 787 CD2 PHE A 49 -4.528 -9.161 1.052 1.00 0.00 C ATOM 788 CE1 PHE A 49 -2.747 -7.171 0.359 1.00 0.00 C ATOM 789 CE2 PHE A 49 -3.965 -8.368 2.033 1.00 0.00 C ATOM 790 CZ PHE A 49 -3.073 -7.371 1.686 1.00 0.00 C ATOM 0 H PHE A 49 -5.178 -11.039 -3.624 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.831 -10.286 -2.008 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.308 -9.200 -2.086 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.603 -10.452 -0.896 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.054 -7.807 -1.654 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -5.225 -9.938 1.329 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.050 -6.393 0.085 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -4.222 -8.527 3.070 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.632 -6.749 2.451 1.00 0.00 H new ATOM 800 N PRO A 50 -2.678 -12.357 -0.578 1.00 0.00 N ATOM 801 CA PRO A 50 -2.500 -13.622 0.136 1.00 0.00 C ATOM 802 C PRO A 50 -3.282 -13.683 1.446 1.00 0.00 C ATOM 803 O PRO A 50 -3.676 -14.761 1.892 1.00 0.00 O ATOM 804 CB PRO A 50 -0.999 -13.645 0.412 1.00 0.00 C ATOM 805 CG PRO A 50 -0.626 -12.209 0.558 1.00 0.00 C ATOM 806 CD PRO A 50 -1.545 -11.435 -0.353 1.00 0.00 C ATOM 0 HA PRO A 50 -2.867 -14.471 -0.442 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -0.770 -14.209 1.316 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.452 -14.116 -0.405 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -0.738 -11.882 1.592 1.00 0.00 H new ATOM 0 HG3 PRO A 50 0.417 -12.049 0.284 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -1.873 -10.503 0.108 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.052 -11.172 -1.289 1.00 0.00 H new ATOM 814 N LYS A 51 -3.499 -12.526 2.062 1.00 0.00 N ATOM 815 CA LYS A 51 -4.229 -12.460 3.325 1.00 0.00 C ATOM 816 C LYS A 51 -5.478 -11.594 3.196 1.00 0.00 C ATOM 817 O LYS A 51 -5.575 -10.531 3.810 1.00 0.00 O ATOM 818 CB LYS A 51 -3.323 -11.913 4.431 1.00 0.00 C ATOM 819 CG LYS A 51 -3.768 -12.303 5.831 1.00 0.00 C ATOM 820 CD LYS A 51 -3.314 -13.708 6.189 1.00 0.00 C ATOM 821 CE LYS A 51 -1.997 -13.692 6.948 1.00 0.00 C ATOM 822 NZ LYS A 51 -1.978 -14.692 8.050 1.00 0.00 N ATOM 0 H LYS A 51 -3.181 -11.623 1.709 1.00 0.00 H new ATOM 0 HA LYS A 51 -4.543 -13.471 3.586 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -2.307 -12.273 4.268 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -3.291 -10.826 4.359 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -3.363 -11.594 6.553 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -4.854 -12.242 5.899 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -4.078 -14.195 6.795 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -3.204 -14.299 5.280 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -1.178 -13.897 6.258 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -1.827 -12.697 7.358 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -1.063 -14.649 8.542 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -2.743 -14.482 8.722 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -2.115 -15.645 7.656 1.00 0.00 H new ATOM 836 N ARG A 52 -6.435 -12.055 2.397 1.00 0.00 N ATOM 837 CA ARG A 52 -7.679 -11.322 2.192 1.00 0.00 C ATOM 838 C ARG A 52 -8.886 -12.169 2.601 1.00 0.00 C ATOM 839 O ARG A 52 -9.074 -13.271 2.086 1.00 0.00 O ATOM 840 CB ARG A 52 -7.811 -10.904 0.726 1.00 0.00 C ATOM 841 CG ARG A 52 -7.729 -12.069 -0.248 1.00 0.00 C ATOM 842 CD ARG A 52 -8.876 -12.047 -1.246 1.00 0.00 C ATOM 843 NE ARG A 52 -10.146 -12.425 -0.630 1.00 0.00 N ATOM 844 CZ ARG A 52 -10.448 -13.667 -0.256 1.00 0.00 C ATOM 845 NH1 ARG A 52 -9.573 -14.650 -0.428 1.00 0.00 N ATOM 846 NH2 ARG A 52 -11.627 -13.926 0.292 1.00 0.00 N ATOM 0 H ARG A 52 -6.373 -12.933 1.881 1.00 0.00 H new ATOM 0 HA ARG A 52 -7.654 -10.430 2.819 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -8.763 -10.391 0.587 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -7.025 -10.187 0.489 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -6.780 -12.031 -0.783 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -7.745 -13.008 0.305 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -8.964 -11.049 -1.675 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -8.655 -12.728 -2.067 1.00 0.00 H new ATOM 0 HE ARG A 52 -10.842 -11.695 -0.478 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -8.664 -14.456 -0.848 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -9.809 -15.599 -0.140 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -12.303 -13.174 0.427 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -11.858 -14.877 0.578 1.00 0.00 H new ATOM 860 N PRO A 53 -9.730 -11.676 3.531 1.00 0.00 N ATOM 861 CA PRO A 53 -9.570 -10.378 4.184 1.00 0.00 C ATOM 862 C PRO A 53 -8.652 -10.458 5.401 1.00 0.00 C ATOM 863 O PRO A 53 -8.529 -11.511 6.027 1.00 0.00 O ATOM 864 CB PRO A 53 -11.001 -10.011 4.615 1.00 0.00 C ATOM 865 CG PRO A 53 -11.854 -11.213 4.325 1.00 0.00 C ATOM 866 CD PRO A 53 -10.924 -12.356 4.025 1.00 0.00 C ATOM 0 HA PRO A 53 -9.111 -9.643 3.523 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -11.034 -9.758 5.675 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.360 -9.139 4.068 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.490 -11.448 5.178 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.514 -11.021 3.479 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -10.713 -12.951 4.914 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -11.342 -13.033 3.280 1.00 0.00 H new ATOM 874 N LEU A 54 -8.008 -9.343 5.731 1.00 0.00 N ATOM 875 CA LEU A 54 -7.102 -9.294 6.874 1.00 0.00 C ATOM 876 C LEU A 54 -7.880 -9.349 8.192 1.00 0.00 C ATOM 877 O LEU A 54 -8.883 -8.653 8.358 1.00 0.00 O ATOM 878 CB LEU A 54 -6.249 -8.026 6.819 1.00 0.00 C ATOM 879 CG LEU A 54 -5.117 -8.054 5.789 1.00 0.00 C ATOM 880 CD1 LEU A 54 -4.777 -6.646 5.328 1.00 0.00 C ATOM 881 CD2 LEU A 54 -3.889 -8.739 6.369 1.00 0.00 C ATOM 0 H LEU A 54 -8.096 -8.462 5.224 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.448 -10.164 6.827 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -6.898 -7.178 6.600 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.819 -7.852 7.805 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.453 -8.624 4.923 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -3.970 -6.688 4.596 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -5.656 -6.190 4.873 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.460 -6.050 6.184 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.093 -8.751 5.624 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.552 -8.195 7.252 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.141 -9.762 6.647 1.00 0.00 H new ATOM 893 N PRO A 55 -7.436 -10.186 9.150 1.00 0.00 N ATOM 894 CA PRO A 55 -8.105 -10.331 10.447 1.00 0.00 C ATOM 895 C PRO A 55 -7.919 -9.116 11.354 1.00 0.00 C ATOM 896 O PRO A 55 -6.956 -8.362 11.218 1.00 0.00 O ATOM 897 CB PRO A 55 -7.436 -11.564 11.077 1.00 0.00 C ATOM 898 CG PRO A 55 -6.605 -12.177 9.998 1.00 0.00 C ATOM 899 CD PRO A 55 -6.264 -11.067 9.049 1.00 0.00 C ATOM 0 HA PRO A 55 -9.183 -10.429 10.320 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -6.820 -11.281 11.930 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -8.183 -12.269 11.443 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -5.702 -12.627 10.411 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -7.152 -12.970 9.489 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.346 -10.555 9.338 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -6.119 -11.433 8.033 1.00 0.00 H new ATOM 907 N GLU A 56 -8.851 -8.952 12.289 1.00 0.00 N ATOM 908 CA GLU A 56 -8.817 -7.851 13.249 1.00 0.00 C ATOM 909 C GLU A 56 -8.577 -6.501 12.575 1.00 0.00 C ATOM 910 O GLU A 56 -8.024 -5.587 13.187 1.00 0.00 O ATOM 911 CB GLU A 56 -7.734 -8.104 14.299 1.00 0.00 C ATOM 912 CG GLU A 56 -8.226 -8.896 15.500 1.00 0.00 C ATOM 913 CD GLU A 56 -8.716 -8.005 16.624 1.00 0.00 C ATOM 914 OE1 GLU A 56 -9.764 -7.348 16.448 1.00 0.00 O ATOM 915 OE2 GLU A 56 -8.051 -7.962 17.681 1.00 0.00 O ATOM 0 H GLU A 56 -9.649 -9.577 12.403 1.00 0.00 H new ATOM 0 HA GLU A 56 -9.796 -7.810 13.727 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -6.907 -8.641 13.834 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -7.341 -7.147 14.641 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -9.033 -9.558 15.188 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -7.419 -9.529 15.869 1.00 0.00 H new ATOM 922 N ARG A 57 -9.005 -6.370 11.325 1.00 0.00 N ATOM 923 CA ARG A 57 -8.841 -5.116 10.598 1.00 0.00 C ATOM 924 C ARG A 57 -9.951 -4.932 9.566 1.00 0.00 C ATOM 925 O ARG A 57 -10.622 -5.891 9.185 1.00 0.00 O ATOM 926 CB ARG A 57 -7.460 -5.058 9.929 1.00 0.00 C ATOM 927 CG ARG A 57 -7.377 -5.782 8.590 1.00 0.00 C ATOM 928 CD ARG A 57 -7.858 -4.912 7.435 1.00 0.00 C ATOM 929 NE ARG A 57 -7.521 -3.501 7.621 1.00 0.00 N ATOM 930 CZ ARG A 57 -6.338 -2.972 7.316 1.00 0.00 C ATOM 931 NH1 ARG A 57 -5.377 -3.729 6.802 1.00 0.00 N ATOM 932 NH2 ARG A 57 -6.116 -1.683 7.526 1.00 0.00 N ATOM 0 H ARG A 57 -9.465 -7.111 10.796 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.911 -4.297 11.314 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.185 -4.014 9.781 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -6.723 -5.488 10.607 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -6.347 -6.088 8.408 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -7.977 -6.691 8.632 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -7.414 -5.269 6.506 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -8.938 -5.014 7.332 1.00 0.00 H new ATOM 0 HE ARG A 57 -8.236 -2.885 8.008 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -5.543 -4.722 6.638 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.473 -3.318 6.570 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -6.851 -1.097 7.921 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -5.210 -1.277 7.293 1.00 0.00 H new ATOM 946 N THR A 58 -10.135 -3.695 9.114 1.00 0.00 N ATOM 947 CA THR A 58 -11.158 -3.390 8.121 1.00 0.00 C ATOM 948 C THR A 58 -10.529 -3.234 6.741 1.00 0.00 C ATOM 949 O THR A 58 -9.740 -2.320 6.507 1.00 0.00 O ATOM 950 CB THR A 58 -11.913 -2.116 8.505 1.00 0.00 C ATOM 951 OG1 THR A 58 -12.542 -2.268 9.765 1.00 0.00 O ATOM 952 CG2 THR A 58 -12.981 -1.727 7.504 1.00 0.00 C ATOM 0 H THR A 58 -9.589 -2.889 9.420 1.00 0.00 H new ATOM 0 HA THR A 58 -11.866 -4.218 8.090 1.00 0.00 H new ATOM 0 HB THR A 58 -11.158 -1.330 8.531 1.00 0.00 H new ATOM 0 HG1 THR A 58 -12.295 -1.519 10.346 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.477 -0.816 7.837 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.522 -1.555 6.530 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.713 -2.530 7.423 1.00 0.00 H new ATOM 960 N ASN A 59 -10.876 -4.140 5.834 1.00 0.00 N ATOM 961 CA ASN A 59 -10.334 -4.109 4.481 1.00 0.00 C ATOM 962 C ASN A 59 -11.252 -3.348 3.531 1.00 0.00 C ATOM 963 O ASN A 59 -12.456 -3.239 3.762 1.00 0.00 O ATOM 964 CB ASN A 59 -10.119 -5.533 3.965 1.00 0.00 C ATOM 965 CG ASN A 59 -9.105 -6.297 4.791 1.00 0.00 C ATOM 966 OD1 ASN A 59 -7.954 -6.461 4.386 1.00 0.00 O ATOM 967 ND2 ASN A 59 -9.528 -6.770 5.957 1.00 0.00 N ATOM 0 H ASN A 59 -11.529 -4.904 6.011 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.377 -3.589 4.518 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -11.069 -6.068 3.974 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.785 -5.495 2.928 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -8.890 -7.293 6.557 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -10.491 -6.610 6.253 1.00 0.00 H new ATOM 974 N VAL A 60 -10.667 -2.831 2.456 1.00 0.00 N ATOM 975 CA VAL A 60 -11.415 -2.085 1.455 1.00 0.00 C ATOM 976 C VAL A 60 -10.963 -2.481 0.051 1.00 0.00 C ATOM 977 O VAL A 60 -9.767 -2.574 -0.223 1.00 0.00 O ATOM 978 CB VAL A 60 -11.247 -0.562 1.650 1.00 0.00 C ATOM 979 CG1 VAL A 60 -11.752 0.209 0.438 1.00 0.00 C ATOM 980 CG2 VAL A 60 -11.965 -0.108 2.912 1.00 0.00 C ATOM 0 H VAL A 60 -9.670 -2.917 2.256 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.470 -2.331 1.576 1.00 0.00 H new ATOM 0 HB VAL A 60 -10.183 -0.351 1.758 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -11.620 1.278 0.606 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -11.189 -0.092 -0.445 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -12.809 -0.006 0.284 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -11.838 0.967 3.036 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.027 -0.341 2.830 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.546 -0.625 3.775 1.00 0.00 H new ATOM 990 N VAL A 61 -11.928 -2.722 -0.830 1.00 0.00 N ATOM 991 CA VAL A 61 -11.631 -3.118 -2.202 1.00 0.00 C ATOM 992 C VAL A 61 -11.980 -2.008 -3.190 1.00 0.00 C ATOM 993 O VAL A 61 -13.002 -1.336 -3.052 1.00 0.00 O ATOM 994 CB VAL A 61 -12.397 -4.405 -2.583 1.00 0.00 C ATOM 995 CG1 VAL A 61 -12.227 -4.733 -4.062 1.00 0.00 C ATOM 996 CG2 VAL A 61 -11.938 -5.570 -1.719 1.00 0.00 C ATOM 0 H VAL A 61 -12.923 -2.650 -0.618 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.559 -3.310 -2.256 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.458 -4.232 -2.401 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -12.778 -5.644 -4.298 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -12.612 -3.910 -4.664 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -11.170 -4.881 -4.283 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.487 -6.469 -1.999 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.871 -5.735 -1.868 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.127 -5.342 -0.670 1.00 0.00 H new ATOM 1006 N LEU A 62 -11.123 -1.830 -4.192 1.00 0.00 N ATOM 1007 CA LEU A 62 -11.336 -0.813 -5.214 1.00 0.00 C ATOM 1008 C LEU A 62 -11.372 -1.448 -6.601 1.00 0.00 C ATOM 1009 O LEU A 62 -10.330 -1.751 -7.186 1.00 0.00 O ATOM 1010 CB LEU A 62 -10.235 0.248 -5.153 1.00 0.00 C ATOM 1011 CG LEU A 62 -10.608 1.603 -5.760 1.00 0.00 C ATOM 1012 CD1 LEU A 62 -11.637 2.314 -4.894 1.00 0.00 C ATOM 1013 CD2 LEU A 62 -9.369 2.468 -5.932 1.00 0.00 C ATOM 0 H LEU A 62 -10.273 -2.379 -4.317 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.296 -0.333 -5.023 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.954 0.399 -4.111 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -9.354 -0.134 -5.669 1.00 0.00 H new ATOM 0 HG LEU A 62 -11.048 1.429 -6.742 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.889 3.275 -5.343 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.536 1.702 -4.820 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -11.225 2.476 -3.898 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -9.652 3.427 -6.365 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -8.902 2.632 -4.961 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -8.664 1.966 -6.594 1.00 0.00 H new ATOM 1025 N THR A 63 -12.579 -1.646 -7.121 1.00 0.00 N ATOM 1026 CA THR A 63 -12.761 -2.242 -8.439 1.00 0.00 C ATOM 1027 C THR A 63 -13.712 -1.401 -9.286 1.00 0.00 C ATOM 1028 O THR A 63 -14.603 -0.736 -8.759 1.00 0.00 O ATOM 1029 CB THR A 63 -13.300 -3.670 -8.307 1.00 0.00 C ATOM 1030 OG1 THR A 63 -13.828 -4.125 -9.542 1.00 0.00 O ATOM 1031 CG2 THR A 63 -14.393 -3.804 -7.268 1.00 0.00 C ATOM 0 H THR A 63 -13.449 -1.401 -6.647 1.00 0.00 H new ATOM 0 HA THR A 63 -11.791 -2.274 -8.935 1.00 0.00 H new ATOM 0 HB THR A 63 -12.446 -4.271 -7.996 1.00 0.00 H new ATOM 0 HG1 THR A 63 -14.165 -5.039 -9.437 1.00 0.00 H new ATOM 0 HG21 THR A 63 -14.730 -4.840 -7.226 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.006 -3.508 -6.293 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.231 -3.161 -7.536 1.00 0.00 H new ATOM 1039 N HIS A 64 -13.520 -1.437 -10.601 1.00 0.00 N ATOM 1040 CA HIS A 64 -14.366 -0.679 -11.517 1.00 0.00 C ATOM 1041 C HIS A 64 -15.746 -1.318 -11.641 1.00 0.00 C ATOM 1042 O HIS A 64 -16.743 -0.629 -11.857 1.00 0.00 O ATOM 1043 CB HIS A 64 -13.713 -0.592 -12.898 1.00 0.00 C ATOM 1044 CG HIS A 64 -12.577 0.380 -12.968 1.00 0.00 C ATOM 1045 ND1 HIS A 64 -11.275 0.248 -12.622 1.00 0.00 N flip ATOM 1046 CD2 HIS A 64 -12.715 1.667 -13.447 1.00 0.00 C flip ATOM 1047 CE1 HIS A 64 -10.657 1.443 -12.895 1.00 0.00 C flip ATOM 1048 NE2 HIS A 64 -11.547 2.282 -13.393 1.00 0.00 N flip ATOM 0 H HIS A 64 -12.787 -1.982 -11.056 1.00 0.00 H new ATOM 0 HA HIS A 64 -14.482 0.326 -11.111 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.351 -1.580 -13.182 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -14.469 -0.307 -13.630 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -13.634 2.103 -13.809 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -9.612 1.662 -12.729 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -11.364 3.242 -13.686 1.00 0.00 H new ATOM 1057 N GLN A 65 -15.794 -2.640 -11.510 1.00 0.00 N ATOM 1058 CA GLN A 65 -17.047 -3.378 -11.616 1.00 0.00 C ATOM 1059 C GLN A 65 -18.107 -2.795 -10.689 1.00 0.00 C ATOM 1060 O GLN A 65 -17.866 -2.599 -9.498 1.00 0.00 O ATOM 1061 CB GLN A 65 -16.823 -4.856 -11.293 1.00 0.00 C ATOM 1062 CG GLN A 65 -16.441 -5.692 -12.504 1.00 0.00 C ATOM 1063 CD GLN A 65 -15.397 -6.744 -12.181 1.00 0.00 C ATOM 1064 OE1 GLN A 65 -14.136 -6.331 -12.136 1.00 0.00 O flip ATOM 1065 NE2 GLN A 65 -15.721 -7.913 -11.973 1.00 0.00 N flip ATOM 0 H GLN A 65 -14.977 -3.223 -11.330 1.00 0.00 H new ATOM 0 HA GLN A 65 -17.404 -3.289 -12.642 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.038 -4.940 -10.541 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -17.732 -5.265 -10.852 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -17.332 -6.179 -12.900 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -16.061 -5.037 -13.288 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -16.703 -8.186 -12.018 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -15.008 -8.609 -11.756 1.00 0.00 H new ATOM 1074 N GLU A 66 -19.282 -2.526 -11.245 1.00 0.00 N ATOM 1075 CA GLU A 66 -20.384 -1.973 -10.470 1.00 0.00 C ATOM 1076 C GLU A 66 -21.129 -3.077 -9.730 1.00 0.00 C ATOM 1077 O GLU A 66 -21.646 -2.866 -8.633 1.00 0.00 O ATOM 1078 CB GLU A 66 -21.346 -1.209 -11.382 1.00 0.00 C ATOM 1079 CG GLU A 66 -21.991 -2.075 -12.452 1.00 0.00 C ATOM 1080 CD GLU A 66 -22.935 -1.293 -13.343 1.00 0.00 C ATOM 1081 OE1 GLU A 66 -23.972 -0.816 -12.836 1.00 0.00 O ATOM 1082 OE2 GLU A 66 -22.637 -1.156 -14.549 1.00 0.00 O ATOM 0 H GLU A 66 -19.496 -2.682 -12.230 1.00 0.00 H new ATOM 0 HA GLU A 66 -19.971 -1.281 -9.735 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -22.128 -0.757 -10.773 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -20.806 -0.394 -11.864 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -21.212 -2.530 -13.064 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.538 -2.889 -11.975 1.00 0.00 H new ATOM 1089 N ASP A 67 -21.189 -4.253 -10.345 1.00 0.00 N ATOM 1090 CA ASP A 67 -21.880 -5.391 -9.753 1.00 0.00 C ATOM 1091 C ASP A 67 -20.918 -6.311 -9.005 1.00 0.00 C ATOM 1092 O ASP A 67 -21.228 -7.479 -8.770 1.00 0.00 O ATOM 1093 CB ASP A 67 -22.617 -6.183 -10.835 1.00 0.00 C ATOM 1094 CG ASP A 67 -23.834 -5.448 -11.362 1.00 0.00 C ATOM 1095 OD1 ASP A 67 -24.914 -5.571 -10.748 1.00 0.00 O ATOM 1096 OD2 ASP A 67 -23.706 -4.748 -12.389 1.00 0.00 O ATOM 0 H ASP A 67 -20.767 -4.443 -11.254 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.599 -5.000 -9.033 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -21.934 -6.388 -11.660 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.925 -7.147 -10.429 1.00 0.00 H new ATOM 1101 N TYR A 68 -19.755 -5.788 -8.621 1.00 0.00 N ATOM 1102 CA TYR A 68 -18.777 -6.586 -7.890 1.00 0.00 C ATOM 1103 C TYR A 68 -19.175 -6.711 -6.424 1.00 0.00 C ATOM 1104 O TYR A 68 -19.701 -5.768 -5.832 1.00 0.00 O ATOM 1105 CB TYR A 68 -17.382 -5.970 -8.000 1.00 0.00 C ATOM 1106 CG TYR A 68 -16.295 -6.842 -7.412 1.00 0.00 C ATOM 1107 CD1 TYR A 68 -15.668 -7.816 -8.180 1.00 0.00 C ATOM 1108 CD2 TYR A 68 -15.900 -6.695 -6.089 1.00 0.00 C ATOM 1109 CE1 TYR A 68 -14.679 -8.619 -7.644 1.00 0.00 C ATOM 1110 CE2 TYR A 68 -14.910 -7.493 -5.547 1.00 0.00 C ATOM 1111 CZ TYR A 68 -14.304 -8.453 -6.328 1.00 0.00 C ATOM 1112 OH TYR A 68 -13.321 -9.250 -5.790 1.00 0.00 O ATOM 0 H TYR A 68 -19.470 -4.825 -8.802 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.755 -7.581 -8.335 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.158 -5.780 -9.050 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.378 -5.005 -7.494 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -15.958 -7.947 -9.212 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.374 -5.945 -5.473 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -14.202 -9.373 -8.253 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.613 -7.365 -4.517 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.442 -8.868 -5.994 1.00 0.00 H new ATOM 1122 N GLN A 69 -18.927 -7.880 -5.842 1.00 0.00 N ATOM 1123 CA GLN A 69 -19.267 -8.123 -4.445 1.00 0.00 C ATOM 1124 C GLN A 69 -18.060 -8.629 -3.662 1.00 0.00 C ATOM 1125 O GLN A 69 -17.618 -9.763 -3.847 1.00 0.00 O ATOM 1126 CB GLN A 69 -20.411 -9.133 -4.346 1.00 0.00 C ATOM 1127 CG GLN A 69 -21.597 -8.798 -5.236 1.00 0.00 C ATOM 1128 CD GLN A 69 -22.251 -7.482 -4.863 1.00 0.00 C ATOM 1129 OE1 GLN A 69 -22.185 -6.511 -5.767 1.00 0.00 O flip ATOM 1130 NE2 GLN A 69 -22.809 -7.339 -3.776 1.00 0.00 N flip ATOM 0 H GLN A 69 -18.493 -8.672 -6.315 1.00 0.00 H new ATOM 0 HA GLN A 69 -19.584 -7.176 -4.009 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -20.036 -10.121 -4.611 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.748 -9.187 -3.311 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.267 -8.754 -6.274 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -22.334 -9.598 -5.169 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -22.836 -8.112 -3.111 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -23.245 -6.447 -3.540 1.00 0.00 H new ATOM 1139 N ALA A 70 -17.536 -7.782 -2.782 1.00 0.00 N ATOM 1140 CA ALA A 70 -16.386 -8.143 -1.962 1.00 0.00 C ATOM 1141 C ALA A 70 -16.823 -8.502 -0.547 1.00 0.00 C ATOM 1142 O ALA A 70 -17.001 -7.627 0.301 1.00 0.00 O ATOM 1143 CB ALA A 70 -15.377 -7.005 -1.931 1.00 0.00 C ATOM 0 H ALA A 70 -17.890 -6.840 -2.619 1.00 0.00 H new ATOM 0 HA ALA A 70 -15.911 -9.018 -2.407 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -14.525 -7.291 -1.315 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.037 -6.793 -2.945 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -15.846 -6.115 -1.512 1.00 0.00 H new ATOM 1149 N GLN A 71 -16.995 -9.794 -0.300 1.00 0.00 N ATOM 1150 CA GLN A 71 -17.415 -10.272 1.010 1.00 0.00 C ATOM 1151 C GLN A 71 -16.295 -10.120 2.031 1.00 0.00 C ATOM 1152 O GLN A 71 -15.193 -10.635 1.841 1.00 0.00 O ATOM 1153 CB GLN A 71 -17.848 -11.737 0.925 1.00 0.00 C ATOM 1154 CG GLN A 71 -18.832 -12.015 -0.200 1.00 0.00 C ATOM 1155 CD GLN A 71 -18.472 -13.253 -0.999 1.00 0.00 C ATOM 1156 OE1 GLN A 71 -18.534 -14.373 -0.491 1.00 0.00 O ATOM 1157 NE2 GLN A 71 -18.094 -13.057 -2.256 1.00 0.00 N ATOM 0 H GLN A 71 -16.850 -10.530 -0.991 1.00 0.00 H new ATOM 0 HA GLN A 71 -18.261 -9.667 1.335 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -16.965 -12.361 0.787 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -18.300 -12.029 1.873 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -19.831 -12.135 0.218 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -18.867 -11.154 -0.868 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -18.057 -12.111 -2.636 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -17.840 -13.852 -2.842 1.00 0.00 H new ATOM 1166 N GLY A 72 -16.587 -9.415 3.118 1.00 0.00 N ATOM 1167 CA GLY A 72 -15.596 -9.214 4.156 1.00 0.00 C ATOM 1168 C GLY A 72 -14.985 -7.827 4.135 1.00 0.00 C ATOM 1169 O GLY A 72 -14.537 -7.331 5.168 1.00 0.00 O ATOM 0 H GLY A 72 -17.492 -8.980 3.298 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -16.057 -9.387 5.128 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -14.805 -9.955 4.043 1.00 0.00 H new ATOM 1173 N ALA A 73 -14.954 -7.194 2.963 1.00 0.00 N ATOM 1174 CA ALA A 73 -14.380 -5.858 2.837 1.00 0.00 C ATOM 1175 C ALA A 73 -15.353 -4.898 2.157 1.00 0.00 C ATOM 1176 O ALA A 73 -16.384 -5.315 1.629 1.00 0.00 O ATOM 1177 CB ALA A 73 -13.070 -5.921 2.065 1.00 0.00 C ATOM 0 H ALA A 73 -15.318 -7.583 2.093 1.00 0.00 H new ATOM 0 HA ALA A 73 -14.183 -5.478 3.840 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -12.651 -4.919 1.977 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.366 -6.563 2.594 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -13.253 -6.326 1.070 1.00 0.00 H new ATOM 1183 N VAL A 74 -15.021 -3.609 2.177 1.00 0.00 N ATOM 1184 CA VAL A 74 -15.870 -2.591 1.564 1.00 0.00 C ATOM 1185 C VAL A 74 -15.617 -2.506 0.063 1.00 0.00 C ATOM 1186 O VAL A 74 -14.490 -2.681 -0.396 1.00 0.00 O ATOM 1187 CB VAL A 74 -15.636 -1.199 2.186 1.00 0.00 C ATOM 1188 CG1 VAL A 74 -16.793 -0.268 1.859 1.00 0.00 C ATOM 1189 CG2 VAL A 74 -15.438 -1.306 3.692 1.00 0.00 C ATOM 0 H VAL A 74 -14.172 -3.246 2.610 1.00 0.00 H new ATOM 0 HA VAL A 74 -16.901 -2.891 1.749 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.727 -0.780 1.755 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -16.611 0.709 2.306 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.880 -0.162 0.778 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.718 -0.683 2.259 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -15.275 -0.312 4.109 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.325 -1.748 4.145 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.572 -1.934 3.901 1.00 0.00 H new ATOM 1199 N VAL A 75 -16.677 -2.256 -0.698 1.00 0.00 N ATOM 1200 CA VAL A 75 -16.567 -2.173 -2.150 1.00 0.00 C ATOM 1201 C VAL A 75 -16.883 -0.776 -2.676 1.00 0.00 C ATOM 1202 O VAL A 75 -17.859 -0.147 -2.270 1.00 0.00 O ATOM 1203 CB VAL A 75 -17.500 -3.187 -2.836 1.00 0.00 C ATOM 1204 CG1 VAL A 75 -17.287 -3.183 -4.343 1.00 0.00 C ATOM 1205 CG2 VAL A 75 -17.281 -4.579 -2.264 1.00 0.00 C ATOM 0 H VAL A 75 -17.619 -2.108 -0.335 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.530 -2.406 -2.389 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.531 -2.893 -2.641 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -17.957 -3.907 -4.807 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.498 -2.189 -4.738 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.254 -3.450 -4.565 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -17.948 -5.285 -2.759 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.247 -4.881 -2.428 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.491 -4.570 -1.195 1.00 0.00 H new ATOM 1215 N VAL A 76 -16.049 -0.318 -3.604 1.00 0.00 N ATOM 1216 CA VAL A 76 -16.215 0.987 -4.232 1.00 0.00 C ATOM 1217 C VAL A 76 -15.490 1.006 -5.574 1.00 0.00 C ATOM 1218 O VAL A 76 -14.610 0.181 -5.818 1.00 0.00 O ATOM 1219 CB VAL A 76 -15.685 2.129 -3.341 1.00 0.00 C ATOM 1220 CG1 VAL A 76 -16.408 2.145 -2.003 1.00 0.00 C ATOM 1221 CG2 VAL A 76 -14.182 2.006 -3.141 1.00 0.00 C ATOM 0 H VAL A 76 -15.240 -0.840 -3.941 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.283 1.150 -4.379 1.00 0.00 H new ATOM 0 HB VAL A 76 -15.882 3.074 -3.847 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -16.020 2.958 -1.389 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.475 2.293 -2.168 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.248 1.196 -1.492 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.831 2.822 -2.510 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -13.955 1.053 -2.662 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -13.681 2.054 -4.108 1.00 0.00 H new ATOM 1231 N HIS A 77 -15.868 1.928 -6.453 1.00 0.00 N ATOM 1232 CA HIS A 77 -15.244 2.006 -7.772 1.00 0.00 C ATOM 1233 C HIS A 77 -14.653 3.387 -8.053 1.00 0.00 C ATOM 1234 O HIS A 77 -13.902 3.556 -9.012 1.00 0.00 O ATOM 1235 CB HIS A 77 -16.257 1.643 -8.866 1.00 0.00 C ATOM 1236 CG HIS A 77 -17.400 0.804 -8.380 1.00 0.00 C ATOM 1237 ND1 HIS A 77 -17.226 -0.394 -7.718 1.00 0.00 N ATOM 1238 CD2 HIS A 77 -18.738 0.996 -8.458 1.00 0.00 C ATOM 1239 CE1 HIS A 77 -18.406 -0.901 -7.411 1.00 0.00 C ATOM 1240 NE2 HIS A 77 -19.340 -0.077 -7.848 1.00 0.00 N ATOM 0 H HIS A 77 -16.594 2.624 -6.281 1.00 0.00 H new ATOM 0 HA HIS A 77 -14.424 1.288 -7.779 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -16.652 2.561 -9.301 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -15.740 1.109 -9.663 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -16.326 -0.821 -7.500 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -19.239 1.837 -8.915 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -18.578 -1.832 -6.891 1.00 0.00 H new ATOM 1249 N ASP A 78 -15.000 4.379 -7.239 1.00 0.00 N ATOM 1250 CA ASP A 78 -14.495 5.734 -7.447 1.00 0.00 C ATOM 1251 C ASP A 78 -13.805 6.273 -6.199 1.00 0.00 C ATOM 1252 O ASP A 78 -14.093 5.845 -5.081 1.00 0.00 O ATOM 1253 CB ASP A 78 -15.638 6.665 -7.853 1.00 0.00 C ATOM 1254 CG ASP A 78 -15.244 7.611 -8.970 1.00 0.00 C ATOM 1255 OD1 ASP A 78 -14.261 8.361 -8.794 1.00 0.00 O ATOM 1256 OD2 ASP A 78 -15.919 7.602 -10.021 1.00 0.00 O ATOM 0 H ASP A 78 -15.622 4.274 -6.437 1.00 0.00 H new ATOM 0 HA ASP A 78 -13.757 5.694 -8.248 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -16.493 6.069 -8.170 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -15.957 7.244 -6.986 1.00 0.00 H new ATOM 1261 N VAL A 79 -12.894 7.223 -6.400 1.00 0.00 N ATOM 1262 CA VAL A 79 -12.164 7.831 -5.303 1.00 0.00 C ATOM 1263 C VAL A 79 -13.104 8.598 -4.383 1.00 0.00 C ATOM 1264 O VAL A 79 -12.945 8.585 -3.163 1.00 0.00 O ATOM 1265 CB VAL A 79 -11.067 8.783 -5.816 1.00 0.00 C ATOM 1266 CG1 VAL A 79 -9.807 8.008 -6.170 1.00 0.00 C ATOM 1267 CG2 VAL A 79 -11.557 9.595 -7.009 1.00 0.00 C ATOM 0 H VAL A 79 -12.647 7.586 -7.320 1.00 0.00 H new ATOM 0 HA VAL A 79 -11.694 7.022 -4.745 1.00 0.00 H new ATOM 0 HB VAL A 79 -10.826 9.481 -5.015 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.044 8.698 -6.530 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -9.438 7.489 -5.285 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.034 7.280 -6.949 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -10.761 10.258 -7.349 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -11.838 8.920 -7.818 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -12.423 10.188 -6.714 1.00 0.00 H new ATOM 1277 N ALA A 80 -14.087 9.261 -4.977 1.00 0.00 N ATOM 1278 CA ALA A 80 -15.058 10.030 -4.211 1.00 0.00 C ATOM 1279 C ALA A 80 -15.931 9.105 -3.375 1.00 0.00 C ATOM 1280 O ALA A 80 -16.211 9.383 -2.209 1.00 0.00 O ATOM 1281 CB ALA A 80 -15.914 10.880 -5.139 1.00 0.00 C ATOM 0 H ALA A 80 -14.233 9.282 -5.986 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.518 10.694 -3.536 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.634 11.448 -4.551 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.276 11.568 -5.694 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.445 10.234 -5.838 1.00 0.00 H new ATOM 1287 N ALA A 81 -16.351 7.996 -3.975 1.00 0.00 N ATOM 1288 CA ALA A 81 -17.181 7.023 -3.278 1.00 0.00 C ATOM 1289 C ALA A 81 -16.510 6.585 -1.982 1.00 0.00 C ATOM 1290 O ALA A 81 -17.001 6.867 -0.888 1.00 0.00 O ATOM 1291 CB ALA A 81 -17.452 5.821 -4.171 1.00 0.00 C ATOM 0 H ALA A 81 -16.130 7.750 -4.940 1.00 0.00 H new ATOM 0 HA ALA A 81 -18.134 7.492 -3.032 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.073 5.103 -3.636 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -17.969 6.147 -5.073 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.508 5.351 -4.444 1.00 0.00 H new ATOM 1297 N VAL A 82 -15.379 5.896 -2.113 1.00 0.00 N ATOM 1298 CA VAL A 82 -14.629 5.419 -0.960 1.00 0.00 C ATOM 1299 C VAL A 82 -14.381 6.546 0.046 1.00 0.00 C ATOM 1300 O VAL A 82 -14.345 6.317 1.254 1.00 0.00 O ATOM 1301 CB VAL A 82 -13.280 4.801 -1.405 1.00 0.00 C ATOM 1302 CG1 VAL A 82 -12.250 5.880 -1.694 1.00 0.00 C ATOM 1303 CG2 VAL A 82 -12.752 3.825 -0.366 1.00 0.00 C ATOM 0 H VAL A 82 -14.962 5.656 -3.012 1.00 0.00 H new ATOM 0 HA VAL A 82 -15.228 4.650 -0.472 1.00 0.00 H new ATOM 0 HB VAL A 82 -13.462 4.249 -2.327 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -11.314 5.416 -2.004 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -12.615 6.528 -2.491 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.081 6.472 -0.794 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -11.804 3.408 -0.707 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -12.600 4.347 0.579 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.473 3.020 -0.224 1.00 0.00 H new ATOM 1313 N PHE A 83 -14.214 7.768 -0.456 1.00 0.00 N ATOM 1314 CA PHE A 83 -13.975 8.914 0.413 1.00 0.00 C ATOM 1315 C PHE A 83 -15.129 9.103 1.389 1.00 0.00 C ATOM 1316 O PHE A 83 -14.915 9.376 2.570 1.00 0.00 O ATOM 1317 CB PHE A 83 -13.768 10.185 -0.414 1.00 0.00 C ATOM 1318 CG PHE A 83 -12.326 10.477 -0.718 1.00 0.00 C ATOM 1319 CD1 PHE A 83 -11.361 10.375 0.271 1.00 0.00 C ATOM 1320 CD2 PHE A 83 -11.936 10.852 -1.994 1.00 0.00 C ATOM 1321 CE1 PHE A 83 -10.033 10.642 -0.006 1.00 0.00 C ATOM 1322 CE2 PHE A 83 -10.610 11.121 -2.277 1.00 0.00 C ATOM 1323 CZ PHE A 83 -9.657 11.015 -1.282 1.00 0.00 C ATOM 0 H PHE A 83 -14.240 7.987 -1.452 1.00 0.00 H new ATOM 0 HA PHE A 83 -13.068 8.720 0.985 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -14.317 10.092 -1.351 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -14.196 11.031 0.123 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -11.650 10.083 1.270 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.676 10.935 -2.776 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -9.291 10.559 0.774 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -10.319 11.414 -3.275 1.00 0.00 H new ATOM 0 HZ PHE A 83 -8.620 11.223 -1.501 1.00 0.00 H new ATOM 1333 N ALA A 84 -16.354 8.940 0.898 1.00 0.00 N ATOM 1334 CA ALA A 84 -17.531 9.078 1.745 1.00 0.00 C ATOM 1335 C ALA A 84 -17.480 8.056 2.869 1.00 0.00 C ATOM 1336 O ALA A 84 -17.809 8.357 4.016 1.00 0.00 O ATOM 1337 CB ALA A 84 -18.803 8.918 0.927 1.00 0.00 C ATOM 0 H ALA A 84 -16.556 8.714 -0.076 1.00 0.00 H new ATOM 0 HA ALA A 84 -17.537 10.077 2.180 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -19.670 9.025 1.578 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -18.836 9.683 0.151 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -18.816 7.931 0.464 1.00 0.00 H new ATOM 1343 N TYR A 85 -17.033 6.852 2.532 1.00 0.00 N ATOM 1344 CA TYR A 85 -16.904 5.798 3.524 1.00 0.00 C ATOM 1345 C TYR A 85 -15.939 6.270 4.609 1.00 0.00 C ATOM 1346 O TYR A 85 -16.309 6.369 5.778 1.00 0.00 O ATOM 1347 CB TYR A 85 -16.447 4.479 2.870 1.00 0.00 C ATOM 1348 CG TYR A 85 -15.103 3.958 3.337 1.00 0.00 C ATOM 1349 CD1 TYR A 85 -14.912 3.519 4.642 1.00 0.00 C ATOM 1350 CD2 TYR A 85 -14.026 3.907 2.466 1.00 0.00 C ATOM 1351 CE1 TYR A 85 -13.684 3.045 5.062 1.00 0.00 C ATOM 1352 CE2 TYR A 85 -12.795 3.435 2.877 1.00 0.00 C ATOM 1353 CZ TYR A 85 -12.628 3.006 4.175 1.00 0.00 C ATOM 1354 OH TYR A 85 -11.402 2.536 4.589 1.00 0.00 O ATOM 0 H TYR A 85 -16.757 6.585 1.587 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.872 5.592 3.981 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -17.201 3.716 3.063 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -16.408 4.622 1.790 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -15.737 3.549 5.339 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.152 4.243 1.447 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -13.551 2.707 6.079 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -11.967 3.402 2.184 1.00 0.00 H new ATOM 0 HH TYR A 85 -10.768 2.574 3.843 1.00 0.00 H new ATOM 1364 N ALA A 86 -14.697 6.553 4.212 1.00 0.00 N ATOM 1365 CA ALA A 86 -13.675 7.010 5.149 1.00 0.00 C ATOM 1366 C ALA A 86 -14.235 8.040 6.127 1.00 0.00 C ATOM 1367 O ALA A 86 -13.873 8.047 7.303 1.00 0.00 O ATOM 1368 CB ALA A 86 -12.485 7.584 4.396 1.00 0.00 C ATOM 0 H ALA A 86 -14.377 6.473 3.247 1.00 0.00 H new ATOM 0 HA ALA A 86 -13.343 6.148 5.728 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -11.732 7.920 5.108 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -12.058 6.816 3.751 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -12.812 8.428 3.788 1.00 0.00 H new ATOM 1374 N LYS A 87 -15.136 8.892 5.646 1.00 0.00 N ATOM 1375 CA LYS A 87 -15.751 9.894 6.505 1.00 0.00 C ATOM 1376 C LYS A 87 -16.614 9.201 7.551 1.00 0.00 C ATOM 1377 O LYS A 87 -16.555 9.515 8.740 1.00 0.00 O ATOM 1378 CB LYS A 87 -16.599 10.862 5.677 1.00 0.00 C ATOM 1379 CG LYS A 87 -16.566 12.292 6.189 1.00 0.00 C ATOM 1380 CD LYS A 87 -15.155 12.858 6.175 1.00 0.00 C ATOM 1381 CE LYS A 87 -14.805 13.517 7.500 1.00 0.00 C ATOM 1382 NZ LYS A 87 -13.475 14.185 7.455 1.00 0.00 N ATOM 0 H LYS A 87 -15.453 8.908 4.677 1.00 0.00 H new ATOM 0 HA LYS A 87 -14.968 10.466 7.003 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -16.249 10.847 4.645 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -17.631 10.512 5.669 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -17.215 12.915 5.573 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -16.962 12.325 7.204 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -14.444 12.059 5.966 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -15.062 13.586 5.370 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -15.571 14.250 7.754 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -14.807 12.766 8.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.274 14.622 8.377 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -12.740 13.482 7.238 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -13.480 14.919 6.718 1.00 0.00 H new ATOM 1396 N GLN A 88 -17.415 8.251 7.083 1.00 0.00 N ATOM 1397 CA GLN A 88 -18.303 7.488 7.953 1.00 0.00 C ATOM 1398 C GLN A 88 -17.514 6.741 9.028 1.00 0.00 C ATOM 1399 O GLN A 88 -18.076 6.325 10.042 1.00 0.00 O ATOM 1400 CB GLN A 88 -19.127 6.497 7.129 1.00 0.00 C ATOM 1401 CG GLN A 88 -20.310 5.913 7.884 1.00 0.00 C ATOM 1402 CD GLN A 88 -21.427 6.918 8.083 1.00 0.00 C ATOM 1403 OE1 GLN A 88 -21.785 7.250 9.214 1.00 0.00 O ATOM 1404 NE2 GLN A 88 -21.986 7.408 6.983 1.00 0.00 N ATOM 0 H GLN A 88 -17.468 7.989 6.099 1.00 0.00 H new ATOM 0 HA GLN A 88 -18.974 8.190 8.447 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -19.491 6.998 6.232 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -18.480 5.684 6.800 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.695 5.051 7.339 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.974 5.552 8.856 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -21.658 7.105 6.066 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -22.743 8.087 7.055 1.00 0.00 H new ATOM 1413 N HIS A 89 -16.212 6.572 8.804 1.00 0.00 N ATOM 1414 CA HIS A 89 -15.357 5.875 9.759 1.00 0.00 C ATOM 1415 C HIS A 89 -14.432 6.852 10.488 1.00 0.00 C ATOM 1416 O HIS A 89 -13.234 6.910 10.208 1.00 0.00 O ATOM 1417 CB HIS A 89 -14.526 4.808 9.041 1.00 0.00 C ATOM 1418 CG HIS A 89 -15.060 3.419 9.206 1.00 0.00 C ATOM 1419 ND1 HIS A 89 -15.394 2.880 10.430 1.00 0.00 N ATOM 1420 CD2 HIS A 89 -15.316 2.455 8.290 1.00 0.00 C ATOM 1421 CE1 HIS A 89 -15.830 1.644 10.261 1.00 0.00 C ATOM 1422 NE2 HIS A 89 -15.793 1.363 8.972 1.00 0.00 N ATOM 0 H HIS A 89 -15.728 6.908 7.971 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.998 5.396 10.499 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -14.483 5.048 7.979 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.504 4.842 9.417 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -15.172 2.531 7.222 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.160 0.978 11.044 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -16.073 0.478 8.551 1.00 0.00 H new ATOM 1431 N PRO A 90 -14.977 7.631 11.440 1.00 0.00 N ATOM 1432 CA PRO A 90 -14.194 8.603 12.212 1.00 0.00 C ATOM 1433 C PRO A 90 -13.320 7.942 13.278 1.00 0.00 C ATOM 1434 O PRO A 90 -12.567 8.616 13.979 1.00 0.00 O ATOM 1435 CB PRO A 90 -15.269 9.466 12.869 1.00 0.00 C ATOM 1436 CG PRO A 90 -16.429 8.548 13.033 1.00 0.00 C ATOM 1437 CD PRO A 90 -16.397 7.627 11.842 1.00 0.00 C ATOM 0 HA PRO A 90 -13.497 9.157 11.583 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -14.933 9.857 13.829 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -15.525 10.324 12.247 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -16.354 7.986 13.964 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -17.365 9.105 13.072 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -16.738 6.625 12.101 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -17.042 7.986 11.040 1.00 0.00 H new ATOM 1445 N ASP A 91 -13.428 6.621 13.398 1.00 0.00 N ATOM 1446 CA ASP A 91 -12.650 5.877 14.382 1.00 0.00 C ATOM 1447 C ASP A 91 -11.493 5.120 13.727 1.00 0.00 C ATOM 1448 O ASP A 91 -10.801 4.345 14.387 1.00 0.00 O ATOM 1449 CB ASP A 91 -13.551 4.896 15.131 1.00 0.00 C ATOM 1450 CG ASP A 91 -13.186 4.779 16.598 1.00 0.00 C ATOM 1451 OD1 ASP A 91 -11.978 4.701 16.904 1.00 0.00 O ATOM 1452 OD2 ASP A 91 -14.109 4.766 17.440 1.00 0.00 O ATOM 0 H ASP A 91 -14.046 6.045 12.826 1.00 0.00 H new ATOM 0 HA ASP A 91 -12.229 6.596 15.085 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.588 5.219 15.042 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -13.482 3.914 14.663 1.00 0.00 H new ATOM 1457 N GLN A 92 -11.287 5.345 12.432 1.00 0.00 N ATOM 1458 CA GLN A 92 -10.213 4.676 11.707 1.00 0.00 C ATOM 1459 C GLN A 92 -9.649 5.573 10.609 1.00 0.00 C ATOM 1460 O GLN A 92 -10.290 6.537 10.190 1.00 0.00 O ATOM 1461 CB GLN A 92 -10.719 3.366 11.101 1.00 0.00 C ATOM 1462 CG GLN A 92 -11.396 2.452 12.109 1.00 0.00 C ATOM 1463 CD GLN A 92 -11.952 1.193 11.472 1.00 0.00 C ATOM 1464 OE1 GLN A 92 -11.101 0.468 10.756 1.00 0.00 O flip ATOM 1465 NE2 GLN A 92 -13.131 0.876 11.622 1.00 0.00 N flip ATOM 0 H GLN A 92 -11.847 5.983 11.866 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.414 4.458 12.416 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -11.422 3.594 10.300 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -9.880 2.837 10.649 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.680 2.177 12.883 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -12.204 2.994 12.600 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -13.750 1.463 12.181 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -13.490 0.026 11.187 1.00 0.00 H new ATOM 1474 N GLU A 93 -8.446 5.247 10.147 1.00 0.00 N ATOM 1475 CA GLU A 93 -7.792 6.021 9.097 1.00 0.00 C ATOM 1476 C GLU A 93 -7.715 5.222 7.801 1.00 0.00 C ATOM 1477 O GLU A 93 -7.846 3.998 7.806 1.00 0.00 O ATOM 1478 CB GLU A 93 -6.388 6.437 9.540 1.00 0.00 C ATOM 1479 CG GLU A 93 -6.382 7.438 10.684 1.00 0.00 C ATOM 1480 CD GLU A 93 -4.987 7.720 11.205 1.00 0.00 C ATOM 1481 OE1 GLU A 93 -4.026 7.619 10.415 1.00 0.00 O ATOM 1482 OE2 GLU A 93 -4.856 8.042 12.405 1.00 0.00 O ATOM 0 H GLU A 93 -7.904 4.451 10.483 1.00 0.00 H new ATOM 0 HA GLU A 93 -8.387 6.916 8.915 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -5.834 5.549 9.843 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -5.860 6.867 8.689 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -6.836 8.370 10.348 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -7.000 7.058 11.498 1.00 0.00 H new ATOM 1489 N LEU A 94 -7.504 5.921 6.690 1.00 0.00 N ATOM 1490 CA LEU A 94 -7.412 5.274 5.386 1.00 0.00 C ATOM 1491 C LEU A 94 -5.957 5.132 4.948 1.00 0.00 C ATOM 1492 O LEU A 94 -5.188 6.092 4.995 1.00 0.00 O ATOM 1493 CB LEU A 94 -8.200 6.073 4.343 1.00 0.00 C ATOM 1494 CG LEU A 94 -9.487 5.407 3.855 1.00 0.00 C ATOM 1495 CD1 LEU A 94 -10.487 5.280 4.993 1.00 0.00 C ATOM 1496 CD2 LEU A 94 -10.088 6.194 2.700 1.00 0.00 C ATOM 0 H LEU A 94 -7.394 6.935 6.667 1.00 0.00 H new ATOM 0 HA LEU A 94 -7.842 4.276 5.470 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -8.450 7.046 4.766 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.555 6.255 3.484 1.00 0.00 H new ATOM 0 HG LEU A 94 -9.244 4.406 3.500 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -11.397 4.804 4.627 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.056 4.674 5.790 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.726 6.271 5.379 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -11.003 5.706 2.365 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -10.317 7.207 3.030 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -9.375 6.233 1.876 1.00 0.00 H new ATOM 1508 N VAL A 95 -5.589 3.929 4.519 1.00 0.00 N ATOM 1509 CA VAL A 95 -4.227 3.661 4.071 1.00 0.00 C ATOM 1510 C VAL A 95 -4.223 2.818 2.800 1.00 0.00 C ATOM 1511 O VAL A 95 -4.912 1.801 2.715 1.00 0.00 O ATOM 1512 CB VAL A 95 -3.407 2.936 5.154 1.00 0.00 C ATOM 1513 CG1 VAL A 95 -1.941 2.857 4.754 1.00 0.00 C ATOM 1514 CG2 VAL A 95 -3.565 3.631 6.498 1.00 0.00 C ATOM 0 H VAL A 95 -6.214 3.125 4.472 1.00 0.00 H new ATOM 0 HA VAL A 95 -3.768 4.628 3.867 1.00 0.00 H new ATOM 0 HB VAL A 95 -3.787 1.919 5.250 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -1.379 2.341 5.532 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -1.849 2.309 3.816 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -1.544 3.864 4.626 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -2.978 3.105 7.251 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.214 4.660 6.419 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -4.616 3.627 6.788 1.00 0.00 H new ATOM 1524 N ILE A 96 -3.441 3.246 1.814 1.00 0.00 N ATOM 1525 CA ILE A 96 -3.344 2.531 0.548 1.00 0.00 C ATOM 1526 C ILE A 96 -2.267 1.453 0.609 1.00 0.00 C ATOM 1527 O ILE A 96 -1.148 1.705 1.056 1.00 0.00 O ATOM 1528 CB ILE A 96 -3.031 3.487 -0.619 1.00 0.00 C ATOM 1529 CG1 ILE A 96 -3.922 4.729 -0.547 1.00 0.00 C ATOM 1530 CG2 ILE A 96 -3.213 2.775 -1.950 1.00 0.00 C ATOM 1531 CD1 ILE A 96 -5.402 4.412 -0.558 1.00 0.00 C ATOM 0 H ILE A 96 -2.865 4.086 1.868 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.314 2.066 0.374 1.00 0.00 H new ATOM 0 HB ILE A 96 -1.992 3.805 -0.538 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.684 5.285 0.360 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.692 5.381 -1.390 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -2.988 3.463 -2.765 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.538 1.920 -2.001 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.243 2.430 -2.040 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.973 5.339 -0.505 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.654 3.883 -1.477 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.646 3.785 0.300 1.00 0.00 H new ATOM 1543 N ALA A 97 -2.613 0.251 0.160 1.00 0.00 N ATOM 1544 CA ALA A 97 -1.676 -0.867 0.166 1.00 0.00 C ATOM 1545 C ALA A 97 -1.402 -1.382 -1.247 1.00 0.00 C ATOM 1546 O ALA A 97 -0.432 -2.105 -1.473 1.00 0.00 O ATOM 1547 CB ALA A 97 -2.207 -1.992 1.041 1.00 0.00 C ATOM 0 H ALA A 97 -3.535 0.026 -0.213 1.00 0.00 H new ATOM 0 HA ALA A 97 -0.733 -0.507 0.576 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -1.499 -2.821 1.038 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -2.336 -1.630 2.061 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -3.167 -2.333 0.653 1.00 0.00 H new ATOM 1553 N GLY A 98 -2.261 -1.013 -2.195 1.00 0.00 N ATOM 1554 CA GLY A 98 -2.087 -1.458 -3.565 1.00 0.00 C ATOM 1555 C GLY A 98 -3.406 -1.546 -4.315 1.00 0.00 C ATOM 1556 O GLY A 98 -4.464 -1.325 -3.727 1.00 0.00 O ATOM 0 H GLY A 98 -3.072 -0.415 -2.038 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -1.421 -0.771 -4.086 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.604 -2.435 -3.569 1.00 0.00 H new ATOM 1560 N GLY A 99 -3.351 -1.768 -5.632 1.00 0.00 N ATOM 1561 CA GLY A 99 -2.079 -1.923 -6.323 1.00 0.00 C ATOM 1562 C GLY A 99 -1.446 -0.596 -6.698 1.00 0.00 C ATOM 1563 O GLY A 99 -1.775 0.443 -6.126 1.00 0.00 O ATOM 0 H GLY A 99 -4.171 -1.843 -6.233 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -1.392 -2.481 -5.687 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -2.231 -2.515 -7.225 1.00 0.00 H new ATOM 1567 N ALA A 100 -0.530 -0.637 -7.661 1.00 0.00 N ATOM 1568 CA ALA A 100 0.165 0.562 -8.117 1.00 0.00 C ATOM 1569 C ALA A 100 -0.801 1.577 -8.720 1.00 0.00 C ATOM 1570 O ALA A 100 -0.638 2.784 -8.539 1.00 0.00 O ATOM 1571 CB ALA A 100 1.238 0.192 -9.128 1.00 0.00 C ATOM 0 H ALA A 100 -0.251 -1.492 -8.142 1.00 0.00 H new ATOM 0 HA ALA A 100 0.633 1.026 -7.249 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.750 1.094 -9.462 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.957 -0.483 -8.665 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.777 -0.301 -9.984 1.00 0.00 H new ATOM 1577 N GLN A 101 -1.806 1.085 -9.438 1.00 0.00 N ATOM 1578 CA GLN A 101 -2.791 1.960 -10.065 1.00 0.00 C ATOM 1579 C GLN A 101 -3.609 2.691 -9.008 1.00 0.00 C ATOM 1580 O GLN A 101 -3.997 3.846 -9.193 1.00 0.00 O ATOM 1581 CB GLN A 101 -3.716 1.152 -10.980 1.00 0.00 C ATOM 1582 CG GLN A 101 -3.584 1.514 -12.450 1.00 0.00 C ATOM 1583 CD GLN A 101 -4.854 2.118 -13.019 1.00 0.00 C ATOM 1584 OE1 GLN A 101 -5.382 1.647 -14.026 1.00 0.00 O ATOM 1585 NE2 GLN A 101 -5.350 3.168 -12.375 1.00 0.00 N ATOM 0 H GLN A 101 -1.960 0.090 -9.600 1.00 0.00 H new ATOM 0 HA GLN A 101 -2.260 2.699 -10.665 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.501 0.091 -10.855 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -4.749 1.307 -10.667 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -2.763 2.220 -12.574 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -3.325 0.621 -13.018 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -4.879 3.525 -11.544 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -6.202 3.617 -12.712 1.00 0.00 H new ATOM 1594 N ILE A 102 -3.857 2.012 -7.896 1.00 0.00 N ATOM 1595 CA ILE A 102 -4.619 2.595 -6.803 1.00 0.00 C ATOM 1596 C ILE A 102 -3.767 3.614 -6.059 1.00 0.00 C ATOM 1597 O ILE A 102 -4.263 4.646 -5.611 1.00 0.00 O ATOM 1598 CB ILE A 102 -5.120 1.511 -5.822 1.00 0.00 C ATOM 1599 CG1 ILE A 102 -6.125 0.589 -6.517 1.00 0.00 C ATOM 1600 CG2 ILE A 102 -5.755 2.148 -4.593 1.00 0.00 C ATOM 1601 CD1 ILE A 102 -5.526 -0.236 -7.636 1.00 0.00 C ATOM 0 H ILE A 102 -3.541 1.057 -7.728 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.490 3.092 -7.230 1.00 0.00 H new ATOM 0 HB ILE A 102 -4.263 0.919 -5.500 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -6.560 -0.082 -5.777 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -6.939 1.192 -6.919 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -6.101 1.367 -3.916 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.019 2.770 -4.084 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.601 2.764 -4.898 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -6.299 -0.864 -8.079 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -5.116 0.427 -8.398 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -4.731 -0.867 -7.238 1.00 0.00 H new ATOM 1613 N PHE A 103 -2.476 3.322 -5.947 1.00 0.00 N ATOM 1614 CA PHE A 103 -1.549 4.221 -5.276 1.00 0.00 C ATOM 1615 C PHE A 103 -1.507 5.562 -5.997 1.00 0.00 C ATOM 1616 O PHE A 103 -1.479 6.620 -5.368 1.00 0.00 O ATOM 1617 CB PHE A 103 -0.148 3.606 -5.234 1.00 0.00 C ATOM 1618 CG PHE A 103 0.069 2.681 -4.071 1.00 0.00 C ATOM 1619 CD1 PHE A 103 -0.155 3.114 -2.774 1.00 0.00 C ATOM 1620 CD2 PHE A 103 0.499 1.380 -4.275 1.00 0.00 C ATOM 1621 CE1 PHE A 103 0.046 2.266 -1.702 1.00 0.00 C ATOM 1622 CE2 PHE A 103 0.701 0.527 -3.206 1.00 0.00 C ATOM 1623 CZ PHE A 103 0.474 0.971 -1.918 1.00 0.00 C ATOM 0 H PHE A 103 -2.050 2.470 -6.312 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.894 4.378 -4.254 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.027 3.059 -6.160 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.590 4.407 -5.193 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.490 4.126 -2.599 1.00 0.00 H new ATOM 0 HD2 PHE A 103 0.678 1.028 -5.280 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.131 2.616 -0.696 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.036 -0.485 -3.378 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.631 0.307 -1.081 1.00 0.00 H new ATOM 1633 N THR A 104 -1.506 5.506 -7.326 1.00 0.00 N ATOM 1634 CA THR A 104 -1.471 6.710 -8.145 1.00 0.00 C ATOM 1635 C THR A 104 -2.659 7.617 -7.845 1.00 0.00 C ATOM 1636 O THR A 104 -2.494 8.811 -7.603 1.00 0.00 O ATOM 1637 CB THR A 104 -1.469 6.343 -9.629 1.00 0.00 C ATOM 1638 OG1 THR A 104 -0.524 5.322 -9.894 1.00 0.00 O ATOM 1639 CG2 THR A 104 -1.148 7.515 -10.528 1.00 0.00 C ATOM 0 H THR A 104 -1.529 4.636 -7.858 1.00 0.00 H new ATOM 0 HA THR A 104 -0.555 7.249 -7.903 1.00 0.00 H new ATOM 0 HB THR A 104 -2.482 6.003 -9.847 1.00 0.00 H new ATOM 0 HG1 THR A 104 -0.812 4.490 -9.464 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.162 7.190 -11.568 1.00 0.00 H new ATOM 0 HG22 THR A 104 -1.891 8.299 -10.383 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.159 7.902 -10.282 1.00 0.00 H new ATOM 1647 N ALA A 105 -3.860 7.049 -7.869 1.00 0.00 N ATOM 1648 CA ALA A 105 -5.071 7.822 -7.607 1.00 0.00 C ATOM 1649 C ALA A 105 -4.931 8.673 -6.353 1.00 0.00 C ATOM 1650 O ALA A 105 -5.067 9.895 -6.409 1.00 0.00 O ATOM 1651 CB ALA A 105 -6.273 6.898 -7.490 1.00 0.00 C ATOM 0 H ALA A 105 -4.022 6.061 -8.066 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.224 8.497 -8.449 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.168 7.488 -7.295 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -6.399 6.345 -8.421 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.115 6.197 -6.670 1.00 0.00 H new ATOM 1657 N PHE A 106 -4.667 8.034 -5.221 1.00 0.00 N ATOM 1658 CA PHE A 106 -4.522 8.753 -3.965 1.00 0.00 C ATOM 1659 C PHE A 106 -3.170 9.456 -3.871 1.00 0.00 C ATOM 1660 O PHE A 106 -2.973 10.302 -3.004 1.00 0.00 O ATOM 1661 CB PHE A 106 -4.704 7.796 -2.786 1.00 0.00 C ATOM 1662 CG PHE A 106 -6.061 7.151 -2.746 1.00 0.00 C ATOM 1663 CD1 PHE A 106 -6.343 6.053 -3.542 1.00 0.00 C ATOM 1664 CD2 PHE A 106 -7.054 7.644 -1.915 1.00 0.00 C ATOM 1665 CE1 PHE A 106 -7.590 5.458 -3.511 1.00 0.00 C ATOM 1666 CE2 PHE A 106 -8.304 7.053 -1.880 1.00 0.00 C ATOM 1667 CZ PHE A 106 -8.572 5.958 -2.679 1.00 0.00 C ATOM 0 H PHE A 106 -4.550 7.023 -5.148 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.297 9.519 -3.929 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -3.942 7.019 -2.837 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.541 8.341 -1.856 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -5.579 5.657 -4.195 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -6.850 8.499 -1.288 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -7.796 4.603 -4.137 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -9.070 7.447 -1.229 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.547 5.494 -2.653 1.00 0.00 H new ATOM 1677 N LYS A 107 -2.234 9.109 -4.757 1.00 0.00 N ATOM 1678 CA LYS A 107 -0.909 9.730 -4.738 1.00 0.00 C ATOM 1679 C LYS A 107 -1.026 11.250 -4.625 1.00 0.00 C ATOM 1680 O LYS A 107 -0.200 11.904 -3.988 1.00 0.00 O ATOM 1681 CB LYS A 107 -0.105 9.334 -5.989 1.00 0.00 C ATOM 1682 CG LYS A 107 -0.314 10.244 -7.197 1.00 0.00 C ATOM 1683 CD LYS A 107 0.885 11.151 -7.429 1.00 0.00 C ATOM 1684 CE LYS A 107 0.456 12.566 -7.787 1.00 0.00 C ATOM 1685 NZ LYS A 107 0.875 13.555 -6.755 1.00 0.00 N ATOM 0 H LYS A 107 -2.366 8.410 -5.488 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.373 9.366 -3.861 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.955 9.327 -5.736 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.372 8.315 -6.268 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -0.489 9.636 -8.085 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -1.206 10.851 -7.046 1.00 0.00 H new ATOM 0 HD2 LYS A 107 1.504 11.174 -6.532 1.00 0.00 H new ATOM 0 HD3 LYS A 107 1.501 10.743 -8.231 1.00 0.00 H new ATOM 0 HE2 LYS A 107 0.886 12.842 -8.750 1.00 0.00 H new ATOM 0 HE3 LYS A 107 -0.628 12.598 -7.901 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 0.383 14.457 -6.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 0.633 13.194 -5.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 1.902 13.706 -6.815 1.00 0.00 H new ATOM 1699 N ASP A 108 -2.070 11.797 -5.238 1.00 0.00 N ATOM 1700 CA ASP A 108 -2.320 13.226 -5.205 1.00 0.00 C ATOM 1701 C ASP A 108 -3.156 13.597 -3.985 1.00 0.00 C ATOM 1702 O ASP A 108 -2.905 14.609 -3.330 1.00 0.00 O ATOM 1703 CB ASP A 108 -3.036 13.668 -6.483 1.00 0.00 C ATOM 1704 CG ASP A 108 -4.110 12.693 -6.929 1.00 0.00 C ATOM 1705 OD1 ASP A 108 -5.070 12.475 -6.161 1.00 0.00 O ATOM 1706 OD2 ASP A 108 -3.989 12.147 -8.046 1.00 0.00 O ATOM 0 H ASP A 108 -2.760 11.264 -5.767 1.00 0.00 H new ATOM 0 HA ASP A 108 -1.361 13.740 -5.139 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -3.487 14.647 -6.320 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -2.303 13.783 -7.282 1.00 0.00 H new ATOM 1711 N ASP A 109 -4.159 12.772 -3.692 1.00 0.00 N ATOM 1712 CA ASP A 109 -5.047 13.014 -2.556 1.00 0.00 C ATOM 1713 C ASP A 109 -4.478 12.450 -1.250 1.00 0.00 C ATOM 1714 O ASP A 109 -5.168 12.422 -0.231 1.00 0.00 O ATOM 1715 CB ASP A 109 -6.424 12.405 -2.826 1.00 0.00 C ATOM 1716 CG ASP A 109 -7.554 13.309 -2.373 1.00 0.00 C ATOM 1717 OD1 ASP A 109 -7.863 13.313 -1.163 1.00 0.00 O ATOM 1718 OD2 ASP A 109 -8.130 14.013 -3.229 1.00 0.00 O ATOM 0 H ASP A 109 -4.377 11.930 -4.225 1.00 0.00 H new ATOM 0 HA ASP A 109 -5.138 14.094 -2.439 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.527 12.205 -3.893 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.501 11.446 -2.313 1.00 0.00 H new ATOM 1723 N VAL A 110 -3.231 11.989 -1.284 1.00 0.00 N ATOM 1724 CA VAL A 110 -2.596 11.416 -0.100 1.00 0.00 C ATOM 1725 C VAL A 110 -1.952 12.493 0.770 1.00 0.00 C ATOM 1726 O VAL A 110 -1.654 13.591 0.300 1.00 0.00 O ATOM 1727 CB VAL A 110 -1.527 10.374 -0.490 1.00 0.00 C ATOM 1728 CG1 VAL A 110 -0.419 11.020 -1.310 1.00 0.00 C ATOM 1729 CG2 VAL A 110 -0.957 9.699 0.749 1.00 0.00 C ATOM 0 H VAL A 110 -2.641 12.001 -2.116 1.00 0.00 H new ATOM 0 HA VAL A 110 -3.384 10.926 0.472 1.00 0.00 H new ATOM 0 HB VAL A 110 -2.004 9.610 -1.105 1.00 0.00 H new ATOM 0 HG11 VAL A 110 0.324 10.268 -1.574 1.00 0.00 H new ATOM 0 HG12 VAL A 110 -0.841 11.448 -2.219 1.00 0.00 H new ATOM 0 HG13 VAL A 110 0.055 11.808 -0.724 1.00 0.00 H new ATOM 0 HG21 VAL A 110 -0.205 8.968 0.452 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -0.499 10.449 1.394 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.758 9.196 1.290 1.00 0.00 H new ATOM 1739 N ASP A 111 -1.744 12.167 2.044 1.00 0.00 N ATOM 1740 CA ASP A 111 -1.138 13.101 2.989 1.00 0.00 C ATOM 1741 C ASP A 111 0.153 12.532 3.574 1.00 0.00 C ATOM 1742 O ASP A 111 1.129 13.258 3.768 1.00 0.00 O ATOM 1743 CB ASP A 111 -2.123 13.429 4.115 1.00 0.00 C ATOM 1744 CG ASP A 111 -2.352 14.920 4.269 1.00 0.00 C ATOM 1745 OD1 ASP A 111 -2.454 15.615 3.236 1.00 0.00 O ATOM 1746 OD2 ASP A 111 -2.429 15.393 5.422 1.00 0.00 O ATOM 0 H ASP A 111 -1.987 11.261 2.446 1.00 0.00 H new ATOM 0 HA ASP A 111 -0.894 14.016 2.449 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.075 12.937 3.916 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -1.745 13.024 5.054 1.00 0.00 H new ATOM 1751 N THR A 112 0.155 11.230 3.853 1.00 0.00 N ATOM 1752 CA THR A 112 1.331 10.571 4.415 1.00 0.00 C ATOM 1753 C THR A 112 1.889 9.537 3.442 1.00 0.00 C ATOM 1754 O THR A 112 1.176 9.052 2.564 1.00 0.00 O ATOM 1755 CB THR A 112 0.988 9.901 5.748 1.00 0.00 C ATOM 1756 OG1 THR A 112 0.478 10.849 6.668 1.00 0.00 O ATOM 1757 CG2 THR A 112 2.173 9.218 6.401 1.00 0.00 C ATOM 0 H THR A 112 -0.642 10.613 3.699 1.00 0.00 H new ATOM 0 HA THR A 112 2.091 11.332 4.589 1.00 0.00 H new ATOM 0 HB THR A 112 0.243 9.143 5.506 1.00 0.00 H new ATOM 0 HG1 THR A 112 0.512 11.743 6.269 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.859 8.764 7.341 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.559 8.445 5.736 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.954 9.953 6.596 1.00 0.00 H new ATOM 1765 N LEU A 113 3.167 9.205 3.604 1.00 0.00 N ATOM 1766 CA LEU A 113 3.823 8.234 2.740 1.00 0.00 C ATOM 1767 C LEU A 113 4.758 7.326 3.537 1.00 0.00 C ATOM 1768 O LEU A 113 5.565 7.795 4.340 1.00 0.00 O ATOM 1769 CB LEU A 113 4.614 8.965 1.659 1.00 0.00 C ATOM 1770 CG LEU A 113 4.347 8.523 0.222 1.00 0.00 C ATOM 1771 CD1 LEU A 113 2.868 8.632 -0.117 1.00 0.00 C ATOM 1772 CD2 LEU A 113 5.176 9.365 -0.729 1.00 0.00 C ATOM 0 H LEU A 113 3.769 9.597 4.329 1.00 0.00 H new ATOM 0 HA LEU A 113 3.055 7.611 2.281 1.00 0.00 H new ATOM 0 HB2 LEU A 113 4.399 10.031 1.737 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.677 8.839 1.866 1.00 0.00 H new ATOM 0 HG LEU A 113 4.633 7.476 0.118 1.00 0.00 H new ATOM 0 HD11 LEU A 113 2.706 8.311 -1.146 1.00 0.00 H new ATOM 0 HD12 LEU A 113 2.293 7.996 0.556 1.00 0.00 H new ATOM 0 HD13 LEU A 113 2.544 9.667 -0.004 1.00 0.00 H new ATOM 0 HD21 LEU A 113 4.985 9.049 -1.755 1.00 0.00 H new ATOM 0 HD22 LEU A 113 4.905 10.415 -0.616 1.00 0.00 H new ATOM 0 HD23 LEU A 113 6.234 9.237 -0.501 1.00 0.00 H new ATOM 1784 N LEU A 114 4.651 6.026 3.293 1.00 0.00 N ATOM 1785 CA LEU A 114 5.490 5.037 3.963 1.00 0.00 C ATOM 1786 C LEU A 114 5.967 4.003 2.952 1.00 0.00 C ATOM 1787 O LEU A 114 5.157 3.350 2.292 1.00 0.00 O ATOM 1788 CB LEU A 114 4.720 4.354 5.095 1.00 0.00 C ATOM 1789 CG LEU A 114 4.090 5.305 6.114 1.00 0.00 C ATOM 1790 CD1 LEU A 114 2.886 4.655 6.780 1.00 0.00 C ATOM 1791 CD2 LEU A 114 5.117 5.723 7.155 1.00 0.00 C ATOM 0 H LEU A 114 3.986 5.628 2.630 1.00 0.00 H new ATOM 0 HA LEU A 114 6.353 5.543 4.395 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.933 3.739 4.659 1.00 0.00 H new ATOM 0 HB3 LEU A 114 5.397 3.680 5.620 1.00 0.00 H new ATOM 0 HG LEU A 114 3.749 6.197 5.589 1.00 0.00 H new ATOM 0 HD11 LEU A 114 2.452 5.347 7.501 1.00 0.00 H new ATOM 0 HD12 LEU A 114 2.142 4.406 6.023 1.00 0.00 H new ATOM 0 HD13 LEU A 114 3.201 3.746 7.293 1.00 0.00 H new ATOM 0 HD21 LEU A 114 4.653 6.400 7.873 1.00 0.00 H new ATOM 0 HD22 LEU A 114 5.487 4.840 7.676 1.00 0.00 H new ATOM 0 HD23 LEU A 114 5.948 6.229 6.664 1.00 0.00 H new ATOM 1803 N VAL A 115 7.281 3.871 2.805 1.00 0.00 N ATOM 1804 CA VAL A 115 7.829 2.929 1.838 1.00 0.00 C ATOM 1805 C VAL A 115 9.025 2.153 2.377 1.00 0.00 C ATOM 1806 O VAL A 115 9.859 2.690 3.106 1.00 0.00 O ATOM 1807 CB VAL A 115 8.256 3.656 0.550 1.00 0.00 C ATOM 1808 CG1 VAL A 115 7.074 4.382 -0.069 1.00 0.00 C ATOM 1809 CG2 VAL A 115 9.392 4.628 0.830 1.00 0.00 C ATOM 0 H VAL A 115 7.977 4.396 3.335 1.00 0.00 H new ATOM 0 HA VAL A 115 7.030 2.219 1.627 1.00 0.00 H new ATOM 0 HB VAL A 115 8.613 2.910 -0.160 1.00 0.00 H new ATOM 0 HG11 VAL A 115 7.395 4.890 -0.978 1.00 0.00 H new ATOM 0 HG12 VAL A 115 6.292 3.663 -0.312 1.00 0.00 H new ATOM 0 HG13 VAL A 115 6.686 5.115 0.638 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.677 5.130 -0.094 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.065 5.369 1.560 1.00 0.00 H new ATOM 0 HG23 VAL A 115 10.249 4.082 1.226 1.00 0.00 H new ATOM 1819 N THR A 116 9.109 0.888 1.977 1.00 0.00 N ATOM 1820 CA THR A 116 10.209 0.021 2.374 1.00 0.00 C ATOM 1821 C THR A 116 11.127 -0.206 1.177 1.00 0.00 C ATOM 1822 O THR A 116 10.836 -1.031 0.310 1.00 0.00 O ATOM 1823 CB THR A 116 9.675 -1.318 2.889 1.00 0.00 C ATOM 1824 OG1 THR A 116 8.916 -1.138 4.071 1.00 0.00 O ATOM 1825 CG2 THR A 116 10.765 -2.324 3.193 1.00 0.00 C ATOM 0 H THR A 116 8.421 0.439 1.373 1.00 0.00 H new ATOM 0 HA THR A 116 10.769 0.498 3.178 1.00 0.00 H new ATOM 0 HB THR A 116 9.058 -1.709 2.080 1.00 0.00 H new ATOM 0 HG1 THR A 116 9.507 -1.191 4.851 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.316 -3.249 3.553 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.336 -2.527 2.287 1.00 0.00 H new ATOM 0 HG23 THR A 116 11.429 -1.921 3.958 1.00 0.00 H new ATOM 1833 N ARG A 117 12.221 0.544 1.118 1.00 0.00 N ATOM 1834 CA ARG A 117 13.157 0.434 0.006 1.00 0.00 C ATOM 1835 C ARG A 117 14.162 -0.692 0.221 1.00 0.00 C ATOM 1836 O ARG A 117 15.087 -0.571 1.024 1.00 0.00 O ATOM 1837 CB ARG A 117 13.895 1.759 -0.193 1.00 0.00 C ATOM 1838 CG ARG A 117 13.300 2.628 -1.289 1.00 0.00 C ATOM 1839 CD ARG A 117 13.875 2.282 -2.653 1.00 0.00 C ATOM 1840 NE ARG A 117 14.301 3.473 -3.386 1.00 0.00 N ATOM 1841 CZ ARG A 117 13.461 4.321 -3.975 1.00 0.00 C ATOM 1842 NH1 ARG A 117 12.151 4.114 -3.921 1.00 0.00 N ATOM 1843 NH2 ARG A 117 13.932 5.380 -4.619 1.00 0.00 N ATOM 0 H ARG A 117 12.481 1.232 1.824 1.00 0.00 H new ATOM 0 HA ARG A 117 12.580 0.199 -0.888 1.00 0.00 H new ATOM 0 HB2 ARG A 117 13.886 2.315 0.745 1.00 0.00 H new ATOM 0 HB3 ARG A 117 14.938 1.552 -0.431 1.00 0.00 H new ATOM 0 HG2 ARG A 117 12.218 2.501 -1.307 1.00 0.00 H new ATOM 0 HG3 ARG A 117 13.494 3.677 -1.067 1.00 0.00 H new ATOM 0 HD2 ARG A 117 14.724 1.610 -2.529 1.00 0.00 H new ATOM 0 HD3 ARG A 117 13.127 1.746 -3.236 1.00 0.00 H new ATOM 0 HE ARG A 117 15.301 3.665 -3.450 1.00 0.00 H new ATOM 0 HH11 ARG A 117 11.783 3.302 -3.426 1.00 0.00 H new ATOM 0 HH12 ARG A 117 11.512 4.767 -4.374 1.00 0.00 H new ATOM 0 HH21 ARG A 117 14.938 5.545 -4.663 1.00 0.00 H new ATOM 0 HH22 ARG A 117 13.289 6.030 -5.071 1.00 0.00 H new ATOM 1857 N LEU A 118 13.973 -1.786 -0.511 1.00 0.00 N ATOM 1858 CA LEU A 118 14.861 -2.937 -0.417 1.00 0.00 C ATOM 1859 C LEU A 118 16.205 -2.630 -1.070 1.00 0.00 C ATOM 1860 O LEU A 118 16.283 -1.836 -2.008 1.00 0.00 O ATOM 1861 CB LEU A 118 14.222 -4.154 -1.092 1.00 0.00 C ATOM 1862 CG LEU A 118 13.573 -5.161 -0.142 1.00 0.00 C ATOM 1863 CD1 LEU A 118 12.228 -4.644 0.348 1.00 0.00 C ATOM 1864 CD2 LEU A 118 13.412 -6.510 -0.826 1.00 0.00 C ATOM 0 H LEU A 118 13.209 -1.898 -1.178 1.00 0.00 H new ATOM 0 HA LEU A 118 15.026 -3.159 0.637 1.00 0.00 H new ATOM 0 HB2 LEU A 118 13.467 -3.804 -1.796 1.00 0.00 H new ATOM 0 HB3 LEU A 118 14.986 -4.669 -1.675 1.00 0.00 H new ATOM 0 HG LEU A 118 14.225 -5.290 0.722 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.781 -5.374 1.023 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.371 -3.701 0.876 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.567 -4.485 -0.504 1.00 0.00 H new ATOM 0 HD21 LEU A 118 12.949 -7.215 -0.136 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.781 -6.398 -1.708 1.00 0.00 H new ATOM 0 HD23 LEU A 118 14.391 -6.885 -1.125 1.00 0.00 H new ATOM 1876 N ALA A 119 17.260 -3.265 -0.573 1.00 0.00 N ATOM 1877 CA ALA A 119 18.596 -3.059 -1.116 1.00 0.00 C ATOM 1878 C ALA A 119 18.784 -3.845 -2.407 1.00 0.00 C ATOM 1879 O ALA A 119 19.363 -3.347 -3.372 1.00 0.00 O ATOM 1880 CB ALA A 119 19.650 -3.462 -0.098 1.00 0.00 C ATOM 0 H ALA A 119 17.216 -3.925 0.203 1.00 0.00 H new ATOM 0 HA ALA A 119 18.711 -1.999 -1.340 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.643 -3.302 -0.519 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.536 -2.858 0.802 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.528 -4.515 0.154 1.00 0.00 H new ATOM 1886 N GLY A 120 18.292 -5.079 -2.414 1.00 0.00 N ATOM 1887 CA GLY A 120 18.415 -5.918 -3.589 1.00 0.00 C ATOM 1888 C GLY A 120 17.689 -5.350 -4.792 1.00 0.00 C ATOM 1889 O GLY A 120 16.651 -4.700 -4.654 1.00 0.00 O ATOM 0 H GLY A 120 17.810 -5.512 -1.626 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.470 -6.043 -3.832 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.020 -6.909 -3.366 1.00 0.00 H new ATOM 1893 N SER A 121 18.237 -5.596 -5.976 1.00 0.00 N ATOM 1894 CA SER A 121 17.638 -5.110 -7.213 1.00 0.00 C ATOM 1895 C SER A 121 16.838 -6.215 -7.896 1.00 0.00 C ATOM 1896 O SER A 121 17.402 -7.204 -8.363 1.00 0.00 O ATOM 1897 CB SER A 121 18.721 -4.587 -8.158 1.00 0.00 C ATOM 1898 OG SER A 121 19.386 -3.466 -7.602 1.00 0.00 O ATOM 0 H SER A 121 19.096 -6.130 -6.106 1.00 0.00 H new ATOM 0 HA SER A 121 16.960 -4.293 -6.965 1.00 0.00 H new ATOM 0 HB2 SER A 121 19.443 -5.378 -8.362 1.00 0.00 H new ATOM 0 HB3 SER A 121 18.273 -4.311 -9.113 1.00 0.00 H new ATOM 0 HG SER A 121 20.074 -3.152 -8.225 1.00 0.00 H new ATOM 1904 N PHE A 122 15.522 -6.041 -7.948 1.00 0.00 N ATOM 1905 CA PHE A 122 14.645 -7.026 -8.572 1.00 0.00 C ATOM 1906 C PHE A 122 13.986 -6.457 -9.824 1.00 0.00 C ATOM 1907 O PHE A 122 13.971 -5.245 -10.035 1.00 0.00 O ATOM 1908 CB PHE A 122 13.574 -7.487 -7.582 1.00 0.00 C ATOM 1909 CG PHE A 122 14.138 -8.073 -6.319 1.00 0.00 C ATOM 1910 CD1 PHE A 122 14.644 -7.251 -5.325 1.00 0.00 C ATOM 1911 CD2 PHE A 122 14.162 -9.445 -6.127 1.00 0.00 C ATOM 1912 CE1 PHE A 122 15.164 -7.787 -4.162 1.00 0.00 C ATOM 1913 CE2 PHE A 122 14.682 -9.987 -4.967 1.00 0.00 C ATOM 1914 CZ PHE A 122 15.183 -9.157 -3.983 1.00 0.00 C ATOM 0 H PHE A 122 15.039 -5.228 -7.566 1.00 0.00 H new ATOM 0 HA PHE A 122 15.254 -7.882 -8.863 1.00 0.00 H new ATOM 0 HB2 PHE A 122 12.937 -6.640 -7.327 1.00 0.00 H new ATOM 0 HB3 PHE A 122 12.939 -8.229 -8.066 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.632 -6.180 -5.460 1.00 0.00 H new ATOM 0 HD2 PHE A 122 13.770 -10.098 -6.893 1.00 0.00 H new ATOM 0 HE1 PHE A 122 15.555 -7.136 -3.394 1.00 0.00 H new ATOM 0 HE2 PHE A 122 14.697 -11.058 -4.830 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.589 -9.578 -3.075 1.00 0.00 H new ATOM 1924 N GLU A 123 13.442 -7.344 -10.651 1.00 0.00 N ATOM 1925 CA GLU A 123 12.779 -6.934 -11.883 1.00 0.00 C ATOM 1926 C GLU A 123 11.421 -7.614 -12.024 1.00 0.00 C ATOM 1927 O GLU A 123 11.289 -8.814 -11.784 1.00 0.00 O ATOM 1928 CB GLU A 123 13.655 -7.263 -13.093 1.00 0.00 C ATOM 1929 CG GLU A 123 13.890 -8.753 -13.285 1.00 0.00 C ATOM 1930 CD GLU A 123 15.354 -9.092 -13.486 1.00 0.00 C ATOM 1931 OE1 GLU A 123 16.118 -9.032 -12.499 1.00 0.00 O ATOM 1932 OE2 GLU A 123 15.737 -9.419 -14.629 1.00 0.00 O ATOM 0 H GLU A 123 13.447 -8.351 -10.490 1.00 0.00 H new ATOM 0 HA GLU A 123 12.622 -5.856 -11.839 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.187 -6.858 -13.991 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.617 -6.763 -12.982 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.512 -9.291 -12.416 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.319 -9.099 -14.147 1.00 0.00 H new ATOM 1939 N GLY A 124 10.414 -6.839 -12.413 1.00 0.00 N ATOM 1940 CA GLY A 124 9.079 -7.383 -12.579 1.00 0.00 C ATOM 1941 C GLY A 124 8.236 -6.569 -13.541 1.00 0.00 C ATOM 1942 O GLY A 124 8.726 -6.116 -14.575 1.00 0.00 O ATOM 0 H GLY A 124 10.499 -5.843 -12.616 1.00 0.00 H new ATOM 0 HA2 GLY A 124 9.150 -8.408 -12.942 1.00 0.00 H new ATOM 0 HA3 GLY A 124 8.583 -7.422 -11.609 1.00 0.00 H new ATOM 1946 N ASP A 125 6.964 -6.385 -13.200 1.00 0.00 N ATOM 1947 CA ASP A 125 6.051 -5.621 -14.043 1.00 0.00 C ATOM 1948 C ASP A 125 5.129 -4.745 -13.198 1.00 0.00 C ATOM 1949 O ASP A 125 4.000 -4.453 -13.594 1.00 0.00 O ATOM 1950 CB ASP A 125 5.220 -6.564 -14.914 1.00 0.00 C ATOM 1951 CG ASP A 125 4.510 -7.628 -14.100 1.00 0.00 C ATOM 1952 OD1 ASP A 125 3.863 -7.272 -13.093 1.00 0.00 O ATOM 1953 OD2 ASP A 125 4.600 -8.817 -14.471 1.00 0.00 O ATOM 0 H ASP A 125 6.543 -6.754 -12.347 1.00 0.00 H new ATOM 0 HA ASP A 125 6.647 -4.973 -14.685 1.00 0.00 H new ATOM 0 HB2 ASP A 125 4.483 -5.985 -15.471 1.00 0.00 H new ATOM 0 HB3 ASP A 125 5.869 -7.044 -15.647 1.00 0.00 H new ATOM 1958 N THR A 126 5.616 -4.329 -12.033 1.00 0.00 N ATOM 1959 CA THR A 126 4.836 -3.486 -11.135 1.00 0.00 C ATOM 1960 C THR A 126 5.745 -2.547 -10.348 1.00 0.00 C ATOM 1961 O THR A 126 6.452 -2.974 -9.433 1.00 0.00 O ATOM 1962 CB THR A 126 4.018 -4.350 -10.174 1.00 0.00 C ATOM 1963 OG1 THR A 126 3.814 -5.644 -10.712 1.00 0.00 O ATOM 1964 CG2 THR A 126 2.659 -3.765 -9.852 1.00 0.00 C ATOM 0 H THR A 126 6.548 -4.562 -11.689 1.00 0.00 H new ATOM 0 HA THR A 126 4.156 -2.884 -11.738 1.00 0.00 H new ATOM 0 HB THR A 126 4.603 -4.393 -9.255 1.00 0.00 H new ATOM 0 HG1 THR A 126 3.290 -6.181 -10.082 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.131 -4.427 -9.166 1.00 0.00 H new ATOM 0 HG22 THR A 126 2.785 -2.787 -9.388 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.082 -3.659 -10.770 1.00 0.00 H new ATOM 1972 N LYS A 127 5.723 -1.267 -10.710 1.00 0.00 N ATOM 1973 CA LYS A 127 6.548 -0.266 -10.040 1.00 0.00 C ATOM 1974 C LYS A 127 5.704 0.906 -9.548 1.00 0.00 C ATOM 1975 O LYS A 127 4.551 1.067 -9.948 1.00 0.00 O ATOM 1976 CB LYS A 127 7.647 0.239 -10.980 1.00 0.00 C ATOM 1977 CG LYS A 127 7.166 0.530 -12.393 1.00 0.00 C ATOM 1978 CD LYS A 127 6.619 1.944 -12.518 1.00 0.00 C ATOM 1979 CE LYS A 127 7.705 2.929 -12.921 1.00 0.00 C ATOM 1980 NZ LYS A 127 7.498 3.450 -14.301 1.00 0.00 N ATOM 0 H LYS A 127 5.143 -0.899 -11.464 1.00 0.00 H new ATOM 0 HA LYS A 127 7.010 -0.741 -9.175 1.00 0.00 H new ATOM 0 HB2 LYS A 127 8.081 1.147 -10.561 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.443 -0.504 -11.024 1.00 0.00 H new ATOM 0 HG2 LYS A 127 7.990 0.395 -13.094 1.00 0.00 H new ATOM 0 HG3 LYS A 127 6.392 -0.186 -12.669 1.00 0.00 H new ATOM 0 HD2 LYS A 127 5.818 1.961 -13.257 1.00 0.00 H new ATOM 0 HD3 LYS A 127 6.182 2.251 -11.568 1.00 0.00 H new ATOM 0 HE2 LYS A 127 7.720 3.761 -12.217 1.00 0.00 H new ATOM 0 HE3 LYS A 127 8.678 2.442 -12.859 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 8.259 4.118 -14.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 7.509 2.659 -14.976 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 6.581 3.937 -14.354 1.00 0.00 H new ATOM 1994 N MET A 128 6.290 1.722 -8.675 1.00 0.00 N ATOM 1995 CA MET A 128 5.599 2.882 -8.120 1.00 0.00 C ATOM 1996 C MET A 128 5.436 3.981 -9.167 1.00 0.00 C ATOM 1997 O MET A 128 6.117 3.984 -10.192 1.00 0.00 O ATOM 1998 CB MET A 128 6.364 3.426 -6.912 1.00 0.00 C ATOM 1999 CG MET A 128 5.633 4.537 -6.174 1.00 0.00 C ATOM 2000 SD MET A 128 4.032 4.008 -5.533 1.00 0.00 S ATOM 2001 CE MET A 128 3.315 5.582 -5.069 1.00 0.00 C ATOM 0 H MET A 128 7.244 1.600 -8.336 1.00 0.00 H new ATOM 0 HA MET A 128 4.607 2.560 -7.804 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.559 2.608 -6.218 1.00 0.00 H new ATOM 0 HB3 MET A 128 7.333 3.799 -7.245 1.00 0.00 H new ATOM 0 HG2 MET A 128 6.252 4.889 -5.349 1.00 0.00 H new ATOM 0 HG3 MET A 128 5.489 5.382 -6.847 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.487 5.416 -4.380 1.00 0.00 H new ATOM 0 HE2 MET A 128 4.072 6.198 -4.585 1.00 0.00 H new ATOM 0 HE3 MET A 128 2.948 6.092 -5.960 1.00 0.00 H new ATOM 2011 N ILE A 129 4.527 4.914 -8.898 1.00 0.00 N ATOM 2012 CA ILE A 129 4.268 6.022 -9.810 1.00 0.00 C ATOM 2013 C ILE A 129 4.892 7.320 -9.290 1.00 0.00 C ATOM 2014 O ILE A 129 5.148 7.457 -8.094 1.00 0.00 O ATOM 2015 CB ILE A 129 2.753 6.229 -10.014 1.00 0.00 C ATOM 2016 CG1 ILE A 129 2.086 6.631 -8.697 1.00 0.00 C ATOM 2017 CG2 ILE A 129 2.113 4.964 -10.567 1.00 0.00 C ATOM 2018 CD1 ILE A 129 1.967 8.125 -8.514 1.00 0.00 C ATOM 0 H ILE A 129 3.956 4.924 -8.053 1.00 0.00 H new ATOM 0 HA ILE A 129 4.724 5.767 -10.767 1.00 0.00 H new ATOM 0 HB ILE A 129 2.609 7.034 -10.735 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.092 6.187 -8.652 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.658 6.216 -7.867 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.044 5.127 -10.705 1.00 0.00 H new ATOM 0 HG22 ILE A 129 2.569 4.715 -11.525 1.00 0.00 H new ATOM 0 HG23 ILE A 129 2.267 4.142 -9.867 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.485 8.337 -7.560 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.960 8.573 -8.527 1.00 0.00 H new ATOM 0 HD13 ILE A 129 1.369 8.544 -9.323 1.00 0.00 H new ATOM 2030 N PRO A 130 5.148 8.292 -10.185 1.00 0.00 N ATOM 2031 CA PRO A 130 5.747 9.581 -9.808 1.00 0.00 C ATOM 2032 C PRO A 130 4.971 10.282 -8.697 1.00 0.00 C ATOM 2033 O PRO A 130 3.761 10.106 -8.568 1.00 0.00 O ATOM 2034 CB PRO A 130 5.681 10.398 -11.101 1.00 0.00 C ATOM 2035 CG PRO A 130 5.635 9.384 -12.191 1.00 0.00 C ATOM 2036 CD PRO A 130 4.878 8.211 -11.632 1.00 0.00 C ATOM 0 HA PRO A 130 6.756 9.458 -9.416 1.00 0.00 H new ATOM 0 HB2 PRO A 130 4.799 11.039 -11.119 1.00 0.00 H new ATOM 0 HB3 PRO A 130 6.550 11.048 -11.202 1.00 0.00 H new ATOM 0 HG2 PRO A 130 5.139 9.784 -13.075 1.00 0.00 H new ATOM 0 HG3 PRO A 130 6.640 9.091 -12.495 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.812 8.281 -11.847 1.00 0.00 H new ATOM 0 HD3 PRO A 130 5.227 7.269 -12.054 1.00 0.00 H new ATOM 2044 N LEU A 131 5.672 11.078 -7.894 1.00 0.00 N ATOM 2045 CA LEU A 131 5.038 11.799 -6.793 1.00 0.00 C ATOM 2046 C LEU A 131 5.667 13.176 -6.597 1.00 0.00 C ATOM 2047 O LEU A 131 6.838 13.385 -6.914 1.00 0.00 O ATOM 2048 CB LEU A 131 5.149 11.001 -5.486 1.00 0.00 C ATOM 2049 CG LEU A 131 5.303 9.485 -5.641 1.00 0.00 C ATOM 2050 CD1 LEU A 131 6.152 8.919 -4.513 1.00 0.00 C ATOM 2051 CD2 LEU A 131 3.939 8.814 -5.669 1.00 0.00 C ATOM 0 H LEU A 131 6.675 11.240 -7.984 1.00 0.00 H new ATOM 0 HA LEU A 131 3.987 11.926 -7.052 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.003 11.378 -4.924 1.00 0.00 H new ATOM 0 HB3 LEU A 131 4.260 11.197 -4.886 1.00 0.00 H new ATOM 0 HG LEU A 131 5.807 9.283 -6.586 1.00 0.00 H new ATOM 0 HD11 LEU A 131 6.251 7.841 -4.638 1.00 0.00 H new ATOM 0 HD12 LEU A 131 7.140 9.379 -4.535 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.674 9.131 -3.556 1.00 0.00 H new ATOM 0 HD21 LEU A 131 4.066 7.737 -5.780 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.411 9.024 -4.739 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.361 9.200 -6.509 1.00 0.00 H new ATOM 2063 N ASN A 132 4.885 14.106 -6.054 1.00 0.00 N ATOM 2064 CA ASN A 132 5.372 15.457 -5.793 1.00 0.00 C ATOM 2065 C ASN A 132 6.212 15.466 -4.521 1.00 0.00 C ATOM 2066 O ASN A 132 5.752 15.882 -3.457 1.00 0.00 O ATOM 2067 CB ASN A 132 4.199 16.433 -5.666 1.00 0.00 C ATOM 2068 CG ASN A 132 4.395 17.685 -6.498 1.00 0.00 C ATOM 2069 OD1 ASN A 132 5.025 18.695 -5.908 1.00 0.00 O flip ATOM 2070 ND2 ASN A 132 3.986 17.745 -7.657 1.00 0.00 N flip ATOM 0 H ASN A 132 3.913 13.949 -5.787 1.00 0.00 H new ATOM 0 HA ASN A 132 5.993 15.777 -6.630 1.00 0.00 H new ATOM 0 HB2 ASN A 132 3.280 15.935 -5.976 1.00 0.00 H new ATOM 0 HB3 ASN A 132 4.074 16.712 -4.620 1.00 0.00 H new ATOM 0 HD21 ASN A 132 3.507 16.945 -8.071 1.00 0.00 H new ATOM 0 HD22 ASN A 132 4.126 18.595 -8.204 1.00 0.00 H new ATOM 2077 N TRP A 133 7.439 14.977 -4.640 1.00 0.00 N ATOM 2078 CA TRP A 133 8.352 14.893 -3.507 1.00 0.00 C ATOM 2079 C TRP A 133 8.581 16.250 -2.846 1.00 0.00 C ATOM 2080 O TRP A 133 8.647 16.338 -1.621 1.00 0.00 O ATOM 2081 CB TRP A 133 9.682 14.288 -3.953 1.00 0.00 C ATOM 2082 CG TRP A 133 9.542 12.885 -4.460 1.00 0.00 C ATOM 2083 CD1 TRP A 133 9.284 12.500 -5.744 1.00 0.00 C ATOM 2084 CD2 TRP A 133 9.641 11.681 -3.691 1.00 0.00 C ATOM 2085 NE1 TRP A 133 9.218 11.129 -5.820 1.00 0.00 N ATOM 2086 CE2 TRP A 133 9.436 10.604 -4.573 1.00 0.00 C ATOM 2087 CE3 TRP A 133 9.886 11.409 -2.341 1.00 0.00 C ATOM 2088 CZ2 TRP A 133 9.468 9.278 -4.150 1.00 0.00 C ATOM 2089 CZ3 TRP A 133 9.918 10.092 -1.923 1.00 0.00 C ATOM 2090 CH2 TRP A 133 9.710 9.041 -2.824 1.00 0.00 C ATOM 0 H TRP A 133 7.828 14.630 -5.517 1.00 0.00 H new ATOM 0 HA TRP A 133 7.890 14.247 -2.760 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.115 14.911 -4.736 1.00 0.00 H new ATOM 0 HB3 TRP A 133 10.380 14.299 -3.116 1.00 0.00 H new ATOM 0 HD1 TRP A 133 9.151 13.174 -6.578 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.036 10.590 -6.667 1.00 0.00 H new ATOM 0 HE3 TRP A 133 10.047 12.213 -1.638 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 9.308 8.466 -4.843 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 10.107 9.870 -0.883 1.00 0.00 H new ATOM 0 HH2 TRP A 133 9.741 8.023 -2.466 1.00 0.00 H new ATOM 2101 N ASP A 134 8.706 17.309 -3.643 1.00 0.00 N ATOM 2102 CA ASP A 134 8.932 18.644 -3.095 1.00 0.00 C ATOM 2103 C ASP A 134 7.829 19.032 -2.116 1.00 0.00 C ATOM 2104 O ASP A 134 8.099 19.583 -1.049 1.00 0.00 O ATOM 2105 CB ASP A 134 9.011 19.674 -4.224 1.00 0.00 C ATOM 2106 CG ASP A 134 9.615 20.987 -3.765 1.00 0.00 C ATOM 2107 OD1 ASP A 134 10.832 21.017 -3.490 1.00 0.00 O ATOM 2108 OD2 ASP A 134 8.869 21.986 -3.681 1.00 0.00 O ATOM 0 H ASP A 134 8.655 17.270 -4.661 1.00 0.00 H new ATOM 0 HA ASP A 134 9.879 18.628 -2.555 1.00 0.00 H new ATOM 0 HB2 ASP A 134 9.607 19.269 -5.041 1.00 0.00 H new ATOM 0 HB3 ASP A 134 8.011 19.855 -4.618 1.00 0.00 H new ATOM 2113 N ASP A 135 6.586 18.740 -2.486 1.00 0.00 N ATOM 2114 CA ASP A 135 5.441 19.059 -1.639 1.00 0.00 C ATOM 2115 C ASP A 135 5.351 18.114 -0.438 1.00 0.00 C ATOM 2116 O ASP A 135 4.460 18.249 0.399 1.00 0.00 O ATOM 2117 CB ASP A 135 4.147 18.990 -2.452 1.00 0.00 C ATOM 2118 CG ASP A 135 3.725 20.346 -2.984 1.00 0.00 C ATOM 2119 OD1 ASP A 135 3.109 21.118 -2.219 1.00 0.00 O ATOM 2120 OD2 ASP A 135 4.009 20.635 -4.165 1.00 0.00 O ATOM 0 H ASP A 135 6.346 18.283 -3.366 1.00 0.00 H new ATOM 0 HA ASP A 135 5.579 20.073 -1.263 1.00 0.00 H new ATOM 0 HB2 ASP A 135 4.282 18.301 -3.286 1.00 0.00 H new ATOM 0 HB3 ASP A 135 3.351 18.584 -1.828 1.00 0.00 H new ATOM 2125 N PHE A 136 6.275 17.159 -0.358 1.00 0.00 N ATOM 2126 CA PHE A 136 6.288 16.200 0.739 1.00 0.00 C ATOM 2127 C PHE A 136 7.625 16.230 1.471 1.00 0.00 C ATOM 2128 O PHE A 136 8.688 16.235 0.849 1.00 0.00 O ATOM 2129 CB PHE A 136 6.013 14.790 0.215 1.00 0.00 C ATOM 2130 CG PHE A 136 4.554 14.497 0.012 1.00 0.00 C ATOM 2131 CD1 PHE A 136 3.786 15.284 -0.831 1.00 0.00 C ATOM 2132 CD2 PHE A 136 3.950 13.433 0.664 1.00 0.00 C ATOM 2133 CE1 PHE A 136 2.444 15.016 -1.021 1.00 0.00 C ATOM 2134 CE2 PHE A 136 2.608 13.160 0.478 1.00 0.00 C ATOM 2135 CZ PHE A 136 1.854 13.953 -0.366 1.00 0.00 C ATOM 0 H PHE A 136 7.023 17.030 -1.040 1.00 0.00 H new ATOM 0 HA PHE A 136 5.502 16.479 1.441 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.537 14.655 -0.731 1.00 0.00 H new ATOM 0 HB3 PHE A 136 6.427 14.064 0.915 1.00 0.00 H new ATOM 0 HD1 PHE A 136 4.242 16.117 -1.346 1.00 0.00 H new ATOM 0 HD2 PHE A 136 4.535 12.810 1.325 1.00 0.00 H new ATOM 0 HE1 PHE A 136 1.857 15.637 -1.681 1.00 0.00 H new ATOM 0 HE2 PHE A 136 2.149 12.328 0.992 1.00 0.00 H new ATOM 0 HZ PHE A 136 0.805 13.742 -0.513 1.00 0.00 H new ATOM 2145 N THR A 137 7.562 16.262 2.797 1.00 0.00 N ATOM 2146 CA THR A 137 8.764 16.305 3.619 1.00 0.00 C ATOM 2147 C THR A 137 8.909 15.030 4.443 1.00 0.00 C ATOM 2148 O THR A 137 7.963 14.584 5.092 1.00 0.00 O ATOM 2149 CB THR A 137 8.725 17.526 4.543 1.00 0.00 C ATOM 2150 OG1 THR A 137 8.821 18.724 3.793 1.00 0.00 O ATOM 2151 CG2 THR A 137 9.835 17.541 5.573 1.00 0.00 C ATOM 0 H THR A 137 6.690 16.259 3.326 1.00 0.00 H new ATOM 0 HA THR A 137 9.627 16.383 2.957 1.00 0.00 H new ATOM 0 HB THR A 137 7.771 17.459 5.066 1.00 0.00 H new ATOM 0 HG1 THR A 137 9.763 18.975 3.696 1.00 0.00 H new ATOM 0 HG21 THR A 137 9.745 18.434 6.192 1.00 0.00 H new ATOM 0 HG22 THR A 137 9.760 16.654 6.202 1.00 0.00 H new ATOM 0 HG23 THR A 137 10.801 17.546 5.067 1.00 0.00 H new ATOM 2159 N LYS A 138 10.105 14.450 4.410 1.00 0.00 N ATOM 2160 CA LYS A 138 10.383 13.227 5.152 1.00 0.00 C ATOM 2161 C LYS A 138 10.139 13.430 6.642 1.00 0.00 C ATOM 2162 O LYS A 138 10.694 14.343 7.255 1.00 0.00 O ATOM 2163 CB LYS A 138 11.827 12.779 4.916 1.00 0.00 C ATOM 2164 CG LYS A 138 12.160 11.442 5.558 1.00 0.00 C ATOM 2165 CD LYS A 138 13.112 10.632 4.693 1.00 0.00 C ATOM 2166 CE LYS A 138 14.562 10.968 5.000 1.00 0.00 C ATOM 2167 NZ LYS A 138 15.506 10.232 4.113 1.00 0.00 N ATOM 0 H LYS A 138 10.897 14.808 3.877 1.00 0.00 H new ATOM 0 HA LYS A 138 9.707 12.451 4.793 1.00 0.00 H new ATOM 0 HB2 LYS A 138 12.008 12.713 3.843 1.00 0.00 H new ATOM 0 HB3 LYS A 138 12.503 13.539 5.307 1.00 0.00 H new ATOM 0 HG2 LYS A 138 12.609 11.609 6.537 1.00 0.00 H new ATOM 0 HG3 LYS A 138 11.243 10.876 5.720 1.00 0.00 H new ATOM 0 HD2 LYS A 138 12.941 9.568 4.858 1.00 0.00 H new ATOM 0 HD3 LYS A 138 12.906 10.828 3.641 1.00 0.00 H new ATOM 0 HE2 LYS A 138 14.718 12.041 4.884 1.00 0.00 H new ATOM 0 HE3 LYS A 138 14.778 10.725 6.040 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 16.484 10.490 4.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 15.376 9.208 4.241 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 15.318 10.483 3.121 1.00 0.00 H new ATOM 2181 N VAL A 139 9.305 12.574 7.218 1.00 0.00 N ATOM 2182 CA VAL A 139 8.985 12.657 8.637 1.00 0.00 C ATOM 2183 C VAL A 139 9.891 11.746 9.454 1.00 0.00 C ATOM 2184 O VAL A 139 10.237 12.059 10.593 1.00 0.00 O ATOM 2185 CB VAL A 139 7.517 12.275 8.916 1.00 0.00 C ATOM 2186 CG1 VAL A 139 7.060 12.855 10.245 1.00 0.00 C ATOM 2187 CG2 VAL A 139 6.612 12.737 7.784 1.00 0.00 C ATOM 0 H VAL A 139 8.838 11.814 6.724 1.00 0.00 H new ATOM 0 HA VAL A 139 9.143 13.695 8.932 1.00 0.00 H new ATOM 0 HB VAL A 139 7.451 11.189 8.975 1.00 0.00 H new ATOM 0 HG11 VAL A 139 6.022 12.576 10.426 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.686 12.464 11.047 1.00 0.00 H new ATOM 0 HG13 VAL A 139 7.144 13.941 10.216 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.582 12.456 8.004 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.679 13.820 7.684 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.925 12.266 6.852 1.00 0.00 H new ATOM 2197 N SER A 140 10.269 10.614 8.869 1.00 0.00 N ATOM 2198 CA SER A 140 11.133 9.660 9.556 1.00 0.00 C ATOM 2199 C SER A 140 11.883 8.777 8.565 1.00 0.00 C ATOM 2200 O SER A 140 11.481 8.640 7.410 1.00 0.00 O ATOM 2201 CB SER A 140 10.309 8.792 10.508 1.00 0.00 C ATOM 2202 OG SER A 140 11.016 8.539 11.710 1.00 0.00 O ATOM 0 H SER A 140 9.993 10.336 7.927 1.00 0.00 H new ATOM 0 HA SER A 140 11.867 10.226 10.129 1.00 0.00 H new ATOM 0 HB2 SER A 140 9.366 9.290 10.735 1.00 0.00 H new ATOM 0 HB3 SER A 140 10.062 7.848 10.022 1.00 0.00 H new ATOM 0 HG SER A 140 10.467 7.984 12.302 1.00 0.00 H new ATOM 2208 N SER A 141 12.978 8.182 9.027 1.00 0.00 N ATOM 2209 CA SER A 141 13.790 7.310 8.187 1.00 0.00 C ATOM 2210 C SER A 141 14.594 6.333 9.039 1.00 0.00 C ATOM 2211 O SER A 141 15.350 6.740 9.921 1.00 0.00 O ATOM 2212 CB SER A 141 14.733 8.141 7.316 1.00 0.00 C ATOM 2213 OG SER A 141 15.107 7.431 6.148 1.00 0.00 O ATOM 0 H SER A 141 13.324 8.288 9.981 1.00 0.00 H new ATOM 0 HA SER A 141 13.121 6.739 7.543 1.00 0.00 H new ATOM 0 HB2 SER A 141 14.246 9.076 7.037 1.00 0.00 H new ATOM 0 HB3 SER A 141 15.624 8.403 7.887 1.00 0.00 H new ATOM 0 HG SER A 141 15.827 7.912 5.689 1.00 0.00 H new ATOM 2219 N ARG A 142 14.425 5.042 8.770 1.00 0.00 N ATOM 2220 CA ARG A 142 15.136 4.007 9.513 1.00 0.00 C ATOM 2221 C ARG A 142 15.611 2.897 8.579 1.00 0.00 C ATOM 2222 O ARG A 142 14.821 2.324 7.829 1.00 0.00 O ATOM 2223 CB ARG A 142 14.237 3.423 10.605 1.00 0.00 C ATOM 2224 CG ARG A 142 14.939 2.407 11.490 1.00 0.00 C ATOM 2225 CD ARG A 142 14.022 1.898 12.591 1.00 0.00 C ATOM 2226 NE ARG A 142 14.761 1.196 13.637 1.00 0.00 N ATOM 2227 CZ ARG A 142 14.255 0.900 14.831 1.00 0.00 C ATOM 2228 NH1 ARG A 142 13.009 1.242 15.135 1.00 0.00 N ATOM 2229 NH2 ARG A 142 14.996 0.259 15.725 1.00 0.00 N ATOM 0 H ARG A 142 13.803 4.688 8.044 1.00 0.00 H new ATOM 0 HA ARG A 142 16.009 4.464 9.979 1.00 0.00 H new ATOM 0 HB2 ARG A 142 13.860 4.235 11.227 1.00 0.00 H new ATOM 0 HB3 ARG A 142 13.372 2.951 10.139 1.00 0.00 H new ATOM 0 HG2 ARG A 142 15.280 1.569 10.883 1.00 0.00 H new ATOM 0 HG3 ARG A 142 15.825 2.861 11.934 1.00 0.00 H new ATOM 0 HD2 ARG A 142 13.482 2.737 13.030 1.00 0.00 H new ATOM 0 HD3 ARG A 142 13.277 1.228 12.162 1.00 0.00 H new ATOM 0 HE ARG A 142 15.722 0.916 13.440 1.00 0.00 H new ATOM 0 HH11 ARG A 142 12.434 1.734 14.451 1.00 0.00 H new ATOM 0 HH12 ARG A 142 12.626 1.012 16.052 1.00 0.00 H new ATOM 0 HH21 ARG A 142 15.954 -0.007 15.497 1.00 0.00 H new ATOM 0 HH22 ARG A 142 14.608 0.032 16.641 1.00 0.00 H new ATOM 2243 N THR A 143 16.906 2.601 8.629 1.00 0.00 N ATOM 2244 CA THR A 143 17.485 1.563 7.786 1.00 0.00 C ATOM 2245 C THR A 143 17.657 0.259 8.559 1.00 0.00 C ATOM 2246 O THR A 143 18.433 0.188 9.512 1.00 0.00 O ATOM 2247 CB THR A 143 18.836 2.021 7.233 1.00 0.00 C ATOM 2248 OG1 THR A 143 18.937 3.433 7.258 1.00 0.00 O ATOM 2249 CG2 THR A 143 19.085 1.567 5.810 1.00 0.00 C ATOM 0 H THR A 143 17.574 3.066 9.245 1.00 0.00 H new ATOM 0 HA THR A 143 16.800 1.383 6.957 1.00 0.00 H new ATOM 0 HB THR A 143 19.583 1.561 7.880 1.00 0.00 H new ATOM 0 HG1 THR A 143 19.809 3.705 6.902 1.00 0.00 H new ATOM 0 HG21 THR A 143 20.060 1.925 5.479 1.00 0.00 H new ATOM 0 HG22 THR A 143 19.065 0.478 5.767 1.00 0.00 H new ATOM 0 HG23 THR A 143 18.310 1.970 5.158 1.00 0.00 H new ATOM 2257 N VAL A 144 16.930 -0.771 8.140 1.00 0.00 N ATOM 2258 CA VAL A 144 17.003 -2.074 8.787 1.00 0.00 C ATOM 2259 C VAL A 144 17.728 -3.079 7.900 1.00 0.00 C ATOM 2260 O VAL A 144 17.425 -3.207 6.714 1.00 0.00 O ATOM 2261 CB VAL A 144 15.602 -2.628 9.129 1.00 0.00 C ATOM 2262 CG1 VAL A 144 15.257 -2.349 10.584 1.00 0.00 C ATOM 2263 CG2 VAL A 144 14.538 -2.052 8.203 1.00 0.00 C ATOM 0 H VAL A 144 16.282 -0.728 7.353 1.00 0.00 H new ATOM 0 HA VAL A 144 17.558 -1.932 9.715 1.00 0.00 H new ATOM 0 HB VAL A 144 15.623 -3.707 8.980 1.00 0.00 H new ATOM 0 HG11 VAL A 144 14.267 -2.747 10.806 1.00 0.00 H new ATOM 0 HG12 VAL A 144 15.993 -2.827 11.231 1.00 0.00 H new ATOM 0 HG13 VAL A 144 15.264 -1.273 10.760 1.00 0.00 H new ATOM 0 HG21 VAL A 144 13.564 -2.461 8.469 1.00 0.00 H new ATOM 0 HG22 VAL A 144 14.516 -0.967 8.305 1.00 0.00 H new ATOM 0 HG23 VAL A 144 14.772 -2.315 7.171 1.00 0.00 H new ATOM 2273 N GLU A 145 18.689 -3.791 8.479 1.00 0.00 N ATOM 2274 CA GLU A 145 19.455 -4.783 7.735 1.00 0.00 C ATOM 2275 C GLU A 145 19.310 -6.168 8.357 1.00 0.00 C ATOM 2276 O GLU A 145 19.215 -6.309 9.576 1.00 0.00 O ATOM 2277 CB GLU A 145 20.933 -4.389 7.679 1.00 0.00 C ATOM 2278 CG GLU A 145 21.457 -3.803 8.978 1.00 0.00 C ATOM 2279 CD GLU A 145 22.972 -3.738 9.021 1.00 0.00 C ATOM 2280 OE1 GLU A 145 23.620 -4.677 8.513 1.00 0.00 O ATOM 2281 OE2 GLU A 145 23.509 -2.748 9.560 1.00 0.00 O ATOM 0 H GLU A 145 18.955 -3.700 9.459 1.00 0.00 H new ATOM 0 HA GLU A 145 19.058 -4.817 6.720 1.00 0.00 H new ATOM 0 HB2 GLU A 145 21.525 -5.268 7.422 1.00 0.00 H new ATOM 0 HB3 GLU A 145 21.076 -3.663 6.879 1.00 0.00 H new ATOM 0 HG2 GLU A 145 21.050 -2.800 9.110 1.00 0.00 H new ATOM 0 HG3 GLU A 145 21.099 -4.404 9.814 1.00 0.00 H new ATOM 2288 N ASP A 146 19.297 -7.186 7.505 1.00 0.00 N ATOM 2289 CA ASP A 146 19.168 -8.566 7.958 1.00 0.00 C ATOM 2290 C ASP A 146 20.432 -9.354 7.632 1.00 0.00 C ATOM 2291 O ASP A 146 21.431 -8.784 7.192 1.00 0.00 O ATOM 2292 CB ASP A 146 17.953 -9.227 7.301 1.00 0.00 C ATOM 2293 CG ASP A 146 16.747 -9.264 8.221 1.00 0.00 C ATOM 2294 OD1 ASP A 146 16.933 -9.487 9.435 1.00 0.00 O ATOM 2295 OD2 ASP A 146 15.617 -9.072 7.725 1.00 0.00 O ATOM 0 H ASP A 146 19.374 -7.081 6.493 1.00 0.00 H new ATOM 0 HA ASP A 146 19.027 -8.564 9.039 1.00 0.00 H new ATOM 0 HB2 ASP A 146 17.696 -8.685 6.391 1.00 0.00 H new ATOM 0 HB3 ASP A 146 18.212 -10.243 7.004 1.00 0.00 H new ATOM 2300 N THR A 147 20.386 -10.664 7.849 1.00 0.00 N ATOM 2301 CA THR A 147 21.535 -11.519 7.574 1.00 0.00 C ATOM 2302 C THR A 147 21.938 -11.426 6.106 1.00 0.00 C ATOM 2303 O THR A 147 23.123 -11.345 5.782 1.00 0.00 O ATOM 2304 CB THR A 147 21.215 -12.970 7.937 1.00 0.00 C ATOM 2305 OG1 THR A 147 19.833 -13.234 7.775 1.00 0.00 O ATOM 2306 CG2 THR A 147 21.587 -13.326 9.360 1.00 0.00 C ATOM 0 H THR A 147 19.569 -11.155 8.213 1.00 0.00 H new ATOM 0 HA THR A 147 22.370 -11.176 8.185 1.00 0.00 H new ATOM 0 HB THR A 147 21.815 -13.577 7.259 1.00 0.00 H new ATOM 0 HG1 THR A 147 19.648 -14.167 8.010 1.00 0.00 H new ATOM 0 HG21 THR A 147 21.334 -14.369 9.552 1.00 0.00 H new ATOM 0 HG22 THR A 147 22.658 -13.180 9.504 1.00 0.00 H new ATOM 0 HG23 THR A 147 21.038 -12.686 10.051 1.00 0.00 H new ATOM 2314 N ASN A 148 20.945 -11.434 5.224 1.00 0.00 N ATOM 2315 CA ASN A 148 21.197 -11.347 3.791 1.00 0.00 C ATOM 2316 C ASN A 148 21.391 -9.891 3.364 1.00 0.00 C ATOM 2317 O ASN A 148 20.669 -9.004 3.820 1.00 0.00 O ATOM 2318 CB ASN A 148 20.039 -11.974 3.009 1.00 0.00 C ATOM 2319 CG ASN A 148 20.442 -13.255 2.305 1.00 0.00 C ATOM 2320 OD1 ASN A 148 21.628 -13.533 2.129 1.00 0.00 O ATOM 2321 ND2 ASN A 148 19.453 -14.043 1.898 1.00 0.00 N ATOM 0 H ASN A 148 19.959 -11.500 5.476 1.00 0.00 H new ATOM 0 HA ASN A 148 22.112 -11.897 3.571 1.00 0.00 H new ATOM 0 HB2 ASN A 148 19.214 -12.182 3.691 1.00 0.00 H new ATOM 0 HB3 ASN A 148 19.672 -11.259 2.273 1.00 0.00 H new ATOM 0 HD21 ASN A 148 19.663 -14.918 1.418 1.00 0.00 H new ATOM 0 HD22 ASN A 148 18.484 -13.773 2.065 1.00 0.00 H new ATOM 2328 N PRO A 149 22.367 -9.622 2.476 1.00 0.00 N ATOM 2329 CA PRO A 149 22.640 -8.263 1.993 1.00 0.00 C ATOM 2330 C PRO A 149 21.460 -7.687 1.221 1.00 0.00 C ATOM 2331 O PRO A 149 21.266 -6.473 1.169 1.00 0.00 O ATOM 2332 CB PRO A 149 23.845 -8.437 1.060 1.00 0.00 C ATOM 2333 CG PRO A 149 24.423 -9.766 1.408 1.00 0.00 C ATOM 2334 CD PRO A 149 23.273 -10.609 1.871 1.00 0.00 C ATOM 0 HA PRO A 149 22.823 -7.571 2.815 1.00 0.00 H new ATOM 0 HB2 PRO A 149 23.541 -8.402 0.014 1.00 0.00 H new ATOM 0 HB3 PRO A 149 24.574 -7.640 1.207 1.00 0.00 H new ATOM 0 HG2 PRO A 149 24.914 -10.216 0.545 1.00 0.00 H new ATOM 0 HG3 PRO A 149 25.177 -9.671 2.190 1.00 0.00 H new ATOM 0 HD2 PRO A 149 22.800 -11.138 1.043 1.00 0.00 H new ATOM 0 HD3 PRO A 149 23.589 -11.363 2.592 1.00 0.00 H new ATOM 2342 N ALA A 150 20.673 -8.574 0.627 1.00 0.00 N ATOM 2343 CA ALA A 150 19.504 -8.167 -0.144 1.00 0.00 C ATOM 2344 C ALA A 150 18.287 -7.962 0.754 1.00 0.00 C ATOM 2345 O ALA A 150 17.296 -7.361 0.337 1.00 0.00 O ATOM 2346 CB ALA A 150 19.198 -9.199 -1.219 1.00 0.00 C ATOM 0 H ALA A 150 20.823 -9.582 0.664 1.00 0.00 H new ATOM 0 HA ALA A 150 19.732 -7.213 -0.620 1.00 0.00 H new ATOM 0 HB1 ALA A 150 18.323 -8.884 -1.788 1.00 0.00 H new ATOM 0 HB2 ALA A 150 20.053 -9.291 -1.889 1.00 0.00 H new ATOM 0 HB3 ALA A 150 18.999 -10.163 -0.751 1.00 0.00 H new ATOM 2352 N LEU A 151 18.362 -8.465 1.985 1.00 0.00 N ATOM 2353 CA LEU A 151 17.257 -8.333 2.928 1.00 0.00 C ATOM 2354 C LEU A 151 17.305 -6.999 3.674 1.00 0.00 C ATOM 2355 O LEU A 151 16.523 -6.771 4.596 1.00 0.00 O ATOM 2356 CB LEU A 151 17.268 -9.492 3.930 1.00 0.00 C ATOM 2357 CG LEU A 151 16.824 -10.849 3.371 1.00 0.00 C ATOM 2358 CD1 LEU A 151 16.547 -11.825 4.504 1.00 0.00 C ATOM 2359 CD2 LEU A 151 15.592 -10.696 2.490 1.00 0.00 C ATOM 0 H LEU A 151 19.173 -8.965 2.350 1.00 0.00 H new ATOM 0 HA LEU A 151 16.332 -8.363 2.352 1.00 0.00 H new ATOM 0 HB2 LEU A 151 18.277 -9.595 4.329 1.00 0.00 H new ATOM 0 HB3 LEU A 151 16.619 -9.233 4.767 1.00 0.00 H new ATOM 0 HG LEU A 151 17.634 -11.246 2.759 1.00 0.00 H new ATOM 0 HD11 LEU A 151 16.233 -12.783 4.090 1.00 0.00 H new ATOM 0 HD12 LEU A 151 17.453 -11.964 5.094 1.00 0.00 H new ATOM 0 HD13 LEU A 151 15.756 -11.428 5.141 1.00 0.00 H new ATOM 0 HD21 LEU A 151 15.296 -11.672 2.105 1.00 0.00 H new ATOM 0 HD22 LEU A 151 14.776 -10.274 3.076 1.00 0.00 H new ATOM 0 HD23 LEU A 151 15.821 -10.032 1.657 1.00 0.00 H new ATOM 2371 N THR A 152 18.219 -6.119 3.277 1.00 0.00 N ATOM 2372 CA THR A 152 18.340 -4.815 3.919 1.00 0.00 C ATOM 2373 C THR A 152 17.284 -3.855 3.378 1.00 0.00 C ATOM 2374 O THR A 152 17.233 -3.587 2.177 1.00 0.00 O ATOM 2375 CB THR A 152 19.738 -4.234 3.699 1.00 0.00 C ATOM 2376 OG1 THR A 152 20.727 -5.238 3.844 1.00 0.00 O ATOM 2377 CG2 THR A 152 20.075 -3.113 4.659 1.00 0.00 C ATOM 0 H THR A 152 18.882 -6.283 2.520 1.00 0.00 H new ATOM 0 HA THR A 152 18.181 -4.946 4.989 1.00 0.00 H new ATOM 0 HB THR A 152 19.730 -3.833 2.685 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.919 -5.637 2.970 1.00 0.00 H new ATOM 0 HG21 THR A 152 21.079 -2.745 4.450 1.00 0.00 H new ATOM 0 HG22 THR A 152 19.358 -2.301 4.536 1.00 0.00 H new ATOM 0 HG23 THR A 152 20.030 -3.485 5.683 1.00 0.00 H new ATOM 2385 N HIS A 153 16.437 -3.344 4.268 1.00 0.00 N ATOM 2386 CA HIS A 153 15.378 -2.419 3.872 1.00 0.00 C ATOM 2387 C HIS A 153 15.501 -1.094 4.613 1.00 0.00 C ATOM 2388 O HIS A 153 16.231 -0.984 5.597 1.00 0.00 O ATOM 2389 CB HIS A 153 13.995 -3.024 4.140 1.00 0.00 C ATOM 2390 CG HIS A 153 13.972 -4.522 4.147 1.00 0.00 C ATOM 2391 ND1 HIS A 153 13.338 -5.259 5.124 1.00 0.00 N ATOM 2392 CD2 HIS A 153 14.504 -5.419 3.285 1.00 0.00 C ATOM 2393 CE1 HIS A 153 13.480 -6.546 4.862 1.00 0.00 C ATOM 2394 NE2 HIS A 153 14.182 -6.670 3.752 1.00 0.00 N ATOM 0 H HIS A 153 16.463 -3.554 5.266 1.00 0.00 H new ATOM 0 HA HIS A 153 15.488 -2.238 2.803 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.632 -2.662 5.102 1.00 0.00 H new ATOM 0 HB3 HIS A 153 13.300 -2.664 3.381 1.00 0.00 H new ATOM 0 HD1 HIS A 153 12.838 -4.871 5.924 1.00 0.00 H new ATOM 0 HD2 HIS A 153 15.075 -5.194 2.396 1.00 0.00 H new ATOM 0 HE1 HIS A 153 13.088 -7.359 5.456 1.00 0.00 H new ATOM 2403 N THR A 154 14.774 -0.091 4.134 1.00 0.00 N ATOM 2404 CA THR A 154 14.790 1.230 4.750 1.00 0.00 C ATOM 2405 C THR A 154 13.377 1.798 4.850 1.00 0.00 C ATOM 2406 O THR A 154 12.713 2.019 3.837 1.00 0.00 O ATOM 2407 CB THR A 154 15.681 2.181 3.947 1.00 0.00 C ATOM 2408 OG1 THR A 154 16.965 1.617 3.750 1.00 0.00 O ATOM 2409 CG2 THR A 154 15.869 3.529 4.609 1.00 0.00 C ATOM 0 H THR A 154 14.165 -0.168 3.319 1.00 0.00 H new ATOM 0 HA THR A 154 15.195 1.130 5.757 1.00 0.00 H new ATOM 0 HB THR A 154 15.164 2.329 2.999 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.553 2.281 3.333 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.511 4.153 3.987 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.900 4.013 4.731 1.00 0.00 H new ATOM 0 HG23 THR A 154 16.332 3.393 5.586 1.00 0.00 H new ATOM 2417 N TYR A 155 12.923 2.033 6.077 1.00 0.00 N ATOM 2418 CA TYR A 155 11.589 2.577 6.309 1.00 0.00 C ATOM 2419 C TYR A 155 11.640 4.097 6.377 1.00 0.00 C ATOM 2420 O TYR A 155 12.393 4.667 7.166 1.00 0.00 O ATOM 2421 CB TYR A 155 11.004 2.017 7.606 1.00 0.00 C ATOM 2422 CG TYR A 155 10.199 0.753 7.414 1.00 0.00 C ATOM 2423 CD1 TYR A 155 8.900 0.802 6.925 1.00 0.00 C ATOM 2424 CD2 TYR A 155 10.737 -0.489 7.726 1.00 0.00 C ATOM 2425 CE1 TYR A 155 8.159 -0.353 6.752 1.00 0.00 C ATOM 2426 CE2 TYR A 155 10.004 -1.648 7.555 1.00 0.00 C ATOM 2427 CZ TYR A 155 8.716 -1.575 7.069 1.00 0.00 C ATOM 2428 OH TYR A 155 7.982 -2.727 6.899 1.00 0.00 O ATOM 0 H TYR A 155 13.459 1.855 6.926 1.00 0.00 H new ATOM 0 HA TYR A 155 10.949 2.283 5.477 1.00 0.00 H new ATOM 0 HB2 TYR A 155 11.817 1.817 8.304 1.00 0.00 H new ATOM 0 HB3 TYR A 155 10.369 2.775 8.065 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.462 1.757 6.676 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.745 -0.550 8.109 1.00 0.00 H new ATOM 0 HE1 TYR A 155 7.150 -0.299 6.371 1.00 0.00 H new ATOM 0 HE2 TYR A 155 10.438 -2.606 7.801 1.00 0.00 H new ATOM 0 HH TYR A 155 7.192 -2.700 7.479 1.00 0.00 H new ATOM 2438 N GLU A 156 10.846 4.752 5.538 1.00 0.00 N ATOM 2439 CA GLU A 156 10.819 6.210 5.503 1.00 0.00 C ATOM 2440 C GLU A 156 9.397 6.749 5.605 1.00 0.00 C ATOM 2441 O GLU A 156 8.461 6.179 5.042 1.00 0.00 O ATOM 2442 CB GLU A 156 11.471 6.716 4.214 1.00 0.00 C ATOM 2443 CG GLU A 156 12.902 6.237 4.027 1.00 0.00 C ATOM 2444 CD GLU A 156 13.170 5.735 2.622 1.00 0.00 C ATOM 2445 OE1 GLU A 156 12.732 6.401 1.660 1.00 0.00 O ATOM 2446 OE2 GLU A 156 13.817 4.675 2.482 1.00 0.00 O ATOM 0 H GLU A 156 10.215 4.300 4.876 1.00 0.00 H new ATOM 0 HA GLU A 156 11.380 6.572 6.365 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.874 6.390 3.362 1.00 0.00 H new ATOM 0 HB3 GLU A 156 11.459 7.806 4.214 1.00 0.00 H new ATOM 0 HG2 GLU A 156 13.587 7.054 4.254 1.00 0.00 H new ATOM 0 HG3 GLU A 156 13.110 5.439 4.740 1.00 0.00 H new ATOM 2453 N VAL A 157 9.250 7.865 6.317 1.00 0.00 N ATOM 2454 CA VAL A 157 7.954 8.505 6.487 1.00 0.00 C ATOM 2455 C VAL A 157 7.922 9.839 5.755 1.00 0.00 C ATOM 2456 O VAL A 157 8.939 10.528 5.653 1.00 0.00 O ATOM 2457 CB VAL A 157 7.606 8.732 7.970 1.00 0.00 C ATOM 2458 CG1 VAL A 157 6.174 9.233 8.110 1.00 0.00 C ATOM 2459 CG2 VAL A 157 7.812 7.455 8.770 1.00 0.00 C ATOM 0 H VAL A 157 10.019 8.344 6.786 1.00 0.00 H new ATOM 0 HA VAL A 157 7.210 7.830 6.065 1.00 0.00 H new ATOM 0 HB VAL A 157 8.276 9.494 8.369 1.00 0.00 H new ATOM 0 HG11 VAL A 157 5.944 9.388 9.164 1.00 0.00 H new ATOM 0 HG12 VAL A 157 6.064 10.175 7.572 1.00 0.00 H new ATOM 0 HG13 VAL A 157 5.488 8.495 7.694 1.00 0.00 H new ATOM 0 HG21 VAL A 157 7.561 7.636 9.815 1.00 0.00 H new ATOM 0 HG22 VAL A 157 7.169 6.669 8.373 1.00 0.00 H new ATOM 0 HG23 VAL A 157 8.854 7.143 8.696 1.00 0.00 H new ATOM 2469 N TRP A 158 6.746 10.200 5.262 1.00 0.00 N ATOM 2470 CA TRP A 158 6.573 11.459 4.546 1.00 0.00 C ATOM 2471 C TRP A 158 5.192 12.055 4.782 1.00 0.00 C ATOM 2472 O TRP A 158 4.189 11.345 4.774 1.00 0.00 O ATOM 2473 CB TRP A 158 6.802 11.258 3.048 1.00 0.00 C ATOM 2474 CG TRP A 158 8.160 10.717 2.720 1.00 0.00 C ATOM 2475 CD1 TRP A 158 8.590 9.430 2.875 1.00 0.00 C ATOM 2476 CD2 TRP A 158 9.266 11.448 2.180 1.00 0.00 C ATOM 2477 NE1 TRP A 158 9.897 9.317 2.466 1.00 0.00 N ATOM 2478 CE2 TRP A 158 10.334 10.542 2.034 1.00 0.00 C ATOM 2479 CE3 TRP A 158 9.457 12.781 1.805 1.00 0.00 C ATOM 2480 CZ2 TRP A 158 11.574 10.928 1.530 1.00 0.00 C ATOM 2481 CZ3 TRP A 158 10.688 13.162 1.305 1.00 0.00 C ATOM 2482 CH2 TRP A 158 11.732 12.238 1.170 1.00 0.00 C ATOM 0 H TRP A 158 5.897 9.640 5.344 1.00 0.00 H new ATOM 0 HA TRP A 158 7.314 12.159 4.933 1.00 0.00 H new ATOM 0 HB2 TRP A 158 6.045 10.577 2.661 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.665 12.211 2.536 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.990 8.620 3.262 1.00 0.00 H new ATOM 0 HE1 TRP A 158 10.451 8.461 2.481 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.657 13.500 1.904 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 12.382 10.218 1.427 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 10.848 14.190 1.013 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.681 12.567 0.773 1.00 0.00 H new ATOM 2493 N GLN A 159 5.153 13.367 4.983 1.00 0.00 N ATOM 2494 CA GLN A 159 3.899 14.073 5.210 1.00 0.00 C ATOM 2495 C GLN A 159 3.875 15.376 4.417 1.00 0.00 C ATOM 2496 O GLN A 159 4.797 16.185 4.513 1.00 0.00 O ATOM 2497 CB GLN A 159 3.710 14.361 6.702 1.00 0.00 C ATOM 2498 CG GLN A 159 2.738 13.413 7.385 1.00 0.00 C ATOM 2499 CD GLN A 159 1.336 13.984 7.479 1.00 0.00 C ATOM 2500 OE1 GLN A 159 0.422 13.445 6.682 1.00 0.00 O flip ATOM 2501 NE2 GLN A 159 1.078 14.900 8.261 1.00 0.00 N flip ATOM 0 H GLN A 159 5.979 13.965 4.993 1.00 0.00 H new ATOM 0 HA GLN A 159 3.079 13.440 4.871 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.677 14.299 7.201 1.00 0.00 H new ATOM 0 HB3 GLN A 159 3.354 15.384 6.824 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.707 12.472 6.836 1.00 0.00 H new ATOM 0 HG3 GLN A 159 3.102 13.185 8.387 1.00 0.00 H new ATOM 0 HE21 GLN A 159 1.812 15.285 8.856 1.00 0.00 H new ATOM 0 HE22 GLN A 159 0.130 15.274 8.314 1.00 0.00 H new ATOM 2510 N LYS A 160 2.825 15.569 3.624 1.00 0.00 N ATOM 2511 CA LYS A 160 2.700 16.770 2.806 1.00 0.00 C ATOM 2512 C LYS A 160 2.740 18.028 3.666 1.00 0.00 C ATOM 2513 O LYS A 160 2.216 18.050 4.780 1.00 0.00 O ATOM 2514 CB LYS A 160 1.395 16.729 2.007 1.00 0.00 C ATOM 2515 CG LYS A 160 1.513 17.335 0.618 1.00 0.00 C ATOM 2516 CD LYS A 160 1.229 18.830 0.634 1.00 0.00 C ATOM 2517 CE LYS A 160 -0.103 19.152 -0.025 1.00 0.00 C ATOM 2518 NZ LYS A 160 -1.255 18.806 0.853 1.00 0.00 N ATOM 0 H LYS A 160 2.051 14.911 3.531 1.00 0.00 H new ATOM 0 HA LYS A 160 3.545 16.799 2.118 1.00 0.00 H new ATOM 0 HB2 LYS A 160 1.067 15.694 1.916 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.622 17.261 2.562 1.00 0.00 H new ATOM 0 HG2 LYS A 160 2.515 17.158 0.227 1.00 0.00 H new ATOM 0 HG3 LYS A 160 0.816 16.839 -0.057 1.00 0.00 H new ATOM 0 HD2 LYS A 160 1.223 19.189 1.663 1.00 0.00 H new ATOM 0 HD3 LYS A 160 2.029 19.359 0.116 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -0.139 20.213 -0.270 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -0.185 18.605 -0.964 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -2.144 19.041 0.367 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -1.235 17.788 1.067 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -1.191 19.347 1.739 1.00 0.00 H new ATOM 2532 N LYS A 161 3.370 19.072 3.139 1.00 0.00 N ATOM 2533 CA LYS A 161 3.485 20.337 3.855 1.00 0.00 C ATOM 2534 C LYS A 161 2.187 21.132 3.770 1.00 0.00 C ATOM 2535 O LYS A 161 1.534 21.164 2.726 1.00 0.00 O ATOM 2536 CB LYS A 161 4.643 21.163 3.290 1.00 0.00 C ATOM 2537 CG LYS A 161 5.965 20.923 4.000 1.00 0.00 C ATOM 2538 CD LYS A 161 7.066 21.810 3.441 1.00 0.00 C ATOM 2539 CE LYS A 161 7.979 22.327 4.542 1.00 0.00 C ATOM 2540 NZ LYS A 161 8.756 21.229 5.180 1.00 0.00 N ATOM 0 H LYS A 161 3.809 19.067 2.218 1.00 0.00 H new ATOM 0 HA LYS A 161 3.684 20.115 4.904 1.00 0.00 H new ATOM 0 HB2 LYS A 161 4.761 20.931 2.232 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.391 22.221 3.358 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.847 21.116 5.066 1.00 0.00 H new ATOM 0 HG3 LYS A 161 6.251 19.876 3.895 1.00 0.00 H new ATOM 0 HD2 LYS A 161 7.653 21.249 2.714 1.00 0.00 H new ATOM 0 HD3 LYS A 161 6.622 22.652 2.910 1.00 0.00 H new ATOM 0 HE2 LYS A 161 8.666 23.065 4.127 1.00 0.00 H new ATOM 0 HE3 LYS A 161 7.383 22.837 5.299 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 8.355 21.018 6.116 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 8.709 20.378 4.583 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 9.748 21.522 5.287 1.00 0.00 H new ATOM 2554 N ALA A 162 1.818 21.773 4.874 1.00 0.00 N ATOM 2555 CA ALA A 162 0.597 22.569 4.925 1.00 0.00 C ATOM 2556 C ALA A 162 -0.628 21.716 4.616 1.00 0.00 C ATOM 2557 O ALA A 162 -0.893 21.472 3.420 1.00 0.00 O ATOM 2558 CB ALA A 162 0.688 23.736 3.954 1.00 0.00 C ATOM 2559 OXT ALA A 162 -1.314 21.298 5.573 1.00 0.00 O ATOM 0 H ALA A 162 2.347 21.757 5.746 1.00 0.00 H new ATOM 0 HA ALA A 162 0.489 22.959 5.937 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -0.230 24.322 4.002 1.00 0.00 H new ATOM 0 HB2 ALA A 162 1.536 24.367 4.222 1.00 0.00 H new ATOM 0 HB3 ALA A 162 0.824 23.357 2.941 1.00 0.00 H new TER 2565 ALA A 162 HETATM 2566 PA NDP A 170 -3.509 -2.425 -10.847 1.00 0.00 P HETATM 2567 O1A NDP A 170 -3.496 -1.702 -12.134 1.00 0.00 O HETATM 2568 O2A NDP A 170 -3.105 -1.680 -9.640 1.00 0.00 O HETATM 2569 O5B NDP A 170 -4.890 -3.187 -10.622 1.00 0.00 O HETATM 2570 C5B NDP A 170 -5.955 -2.575 -9.871 1.00 0.00 C HETATM 2571 C4B NDP A 170 -7.096 -2.208 -10.788 1.00 0.00 C HETATM 2572 O4B NDP A 170 -8.175 -1.631 -10.005 1.00 0.00 O HETATM 2573 C3B NDP A 170 -6.786 -1.151 -11.836 1.00 0.00 C HETATM 2574 O3B NDP A 170 -6.195 -1.740 -12.999 1.00 0.00 O HETATM 2575 C2B NDP A 170 -8.168 -0.586 -12.138 1.00 0.00 C HETATM 2576 O2B NDP A 170 -8.913 -1.380 -13.038 1.00 0.00 O HETATM 2577 C1B NDP A 170 -8.812 -0.606 -10.750 1.00 0.00 C HETATM 2578 N9A NDP A 170 -8.653 0.653 -10.024 1.00 0.00 N HETATM 2579 C8A NDP A 170 -7.525 1.130 -9.404 1.00 0.00 C HETATM 2580 N7A NDP A 170 -7.688 2.300 -8.835 1.00 0.00 N HETATM 2581 C5A NDP A 170 -9.014 2.615 -9.097 1.00 0.00 C HETATM 2582 C6A NDP A 170 -9.809 3.729 -8.764 1.00 0.00 C HETATM 2583 N6A NDP A 170 -9.363 4.775 -8.065 1.00 0.00 N HETATM 2584 N1A NDP A 170 -11.097 3.730 -9.179 1.00 0.00 N HETATM 2585 C2A NDP A 170 -11.545 2.679 -9.881 1.00 0.00 C HETATM 2586 N3A NDP A 170 -10.896 1.578 -10.256 1.00 0.00 N HETATM 2587 C4A NDP A 170 -9.620 1.608 -9.828 1.00 0.00 C HETATM 2588 O3 NDP A 170 -2.536 -3.749 -10.986 1.00 0.00 O HETATM 2589 PN NDP A 170 -1.007 -4.130 -10.502 1.00 0.00 P HETATM 2590 O1N NDP A 170 -0.686 -5.483 -10.997 1.00 0.00 O HETATM 2591 O2N NDP A 170 -0.107 -3.028 -10.896 1.00 0.00 O HETATM 2592 O5D NDP A 170 -1.272 -4.132 -8.932 1.00 0.00 O HETATM 2593 C5D NDP A 170 -1.458 -5.367 -8.217 1.00 0.00 C HETATM 2594 C4D NDP A 170 -0.133 -6.066 -8.031 1.00 0.00 C HETATM 2595 O4D NDP A 170 0.772 -5.198 -7.298 1.00 0.00 O HETATM 2596 C3D NDP A 170 -0.174 -7.344 -7.210 1.00 0.00 C HETATM 2597 O3D NDP A 170 -0.521 -8.466 -8.028 1.00 0.00 O HETATM 2598 C2D NDP A 170 1.260 -7.448 -6.707 1.00 0.00 C HETATM 2599 O2D NDP A 170 2.164 -8.009 -7.658 1.00 0.00 O HETATM 2600 C1D NDP A 170 1.605 -5.979 -6.457 1.00 0.00 C HETATM 2601 N1N NDP A 170 1.398 -5.553 -5.073 1.00 0.00 N HETATM 2602 C2N NDP A 170 2.281 -5.346 -4.104 1.00 0.00 C HETATM 2603 C3N NDP A 170 2.036 -4.940 -2.901 1.00 0.00 C HETATM 2604 C7N NDP A 170 3.264 -4.802 -2.172 1.00 0.00 C HETATM 2605 O7N NDP A 170 2.894 -4.301 -1.013 1.00 0.00 O HETATM 2606 N7N NDP A 170 4.548 -5.044 -2.541 1.00 0.00 N HETATM 2607 C4N NDP A 170 0.604 -4.675 -2.532 1.00 0.00 C HETATM 2608 C5N NDP A 170 -0.408 -4.881 -3.535 1.00 0.00 C HETATM 2609 C6N NDP A 170 -0.103 -5.314 -4.817 1.00 0.00 C HETATM 2610 P2B NDP A 170 -8.888 -1.339 -14.708 1.00 0.00 P HETATM 2611 O1X NDP A 170 -10.397 -0.931 -14.928 1.00 0.00 O HETATM 2612 O2X NDP A 170 -7.994 -0.122 -14.939 1.00 0.00 O HETATM 2613 O3X NDP A 170 -8.713 -2.825 -15.015 1.00 0.00 O HETATM 0 HO3N NDP A 170 -1.461 -8.397 -8.295 1.00 0.00 H new HETATM 0 HO3A NDP A 170 -5.227 -1.822 -12.868 1.00 0.00 H new HETATM 0 HO2N NDP A 170 2.489 -7.304 -8.256 1.00 0.00 H new HETATM 0 H72N NDP A 170 5.307 -4.886 -1.879 1.00 0.00 H new HETATM 0 H71N NDP A 170 4.753 -5.383 -3.481 1.00 0.00 H new HETATM 0 H62A NDP A 170 -9.989 5.553 -7.856 1.00 0.00 H new HETATM 0 H61A NDP A 170 -8.396 4.797 -7.740 1.00 0.00 H new HETATM 0 H52N NDP A 170 -1.912 -5.169 -7.246 1.00 0.00 H new HETATM 0 H52A NDP A 170 -6.305 -3.260 -9.099 1.00 0.00 H new HETATM 0 H51N NDP A 170 -2.145 -6.013 -8.764 1.00 0.00 H new HETATM 0 H51A NDP A 170 -5.586 -1.684 -9.363 1.00 0.00 H new HETATM 0 H42N NDP A 170 0.359 -5.306 -1.677 1.00 0.00 H new HETATM 0 H41N NDP A 170 0.533 -3.641 -2.196 1.00 0.00 H new HETATM 0 H8A NDP A 170 -6.581 0.586 -9.386 1.00 0.00 H new HETATM 0 H6N NDP A 170 -0.863 -5.472 -5.582 1.00 0.00 H new HETATM 0 H5N NDP A 170 -1.450 -4.690 -3.278 1.00 0.00 H new HETATM 0 H4D NDP A 170 0.178 -6.308 -9.047 1.00 0.00 H new HETATM 0 H4B NDP A 170 -7.335 -3.144 -11.292 1.00 0.00 H new HETATM 0 H3D NDP A 170 -0.916 -7.333 -6.411 1.00 0.00 H new HETATM 0 H3B NDP A 170 -6.071 -0.397 -11.507 1.00 0.00 H new HETATM 0 H2N NDP A 170 3.325 -5.539 -4.349 1.00 0.00 H new HETATM 0 H2D NDP A 170 1.345 -8.107 -5.843 1.00 0.00 H new HETATM 0 H2B NDP A 170 -8.126 0.390 -12.621 1.00 0.00 H new HETATM 0 H2A NDP A 170 -12.589 2.733 -10.189 1.00 0.00 H new HETATM 0 H1D NDP A 170 2.666 -5.847 -6.668 1.00 0.00 H new HETATM 0 H1B NDP A 170 -9.882 -0.772 -10.876 1.00 0.00 H new