USER MOD reduce.3.24.130724 H: found=0, std=0, add=982, rem=0, adj=32 USER MOD reduce.3.24.130724 removed 983 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 14 TYR OH : rot 79:sc= 0.547 USER MOD Set 1.2: A 115 GLN : amide:sc= -7.91! C(o=-5.5!,f=-16!) USER MOD Set 1.3: A 117 TYR OH : rot 61:sc= 1.89 USER MOD Single : A 1 ALA N :NH3+ -129:sc= 0.297 (180deg=0) USER MOD Single : A 5 THR OG1 : rot -93:sc= -8.11! USER MOD Single : A 7 LYS NZ :NH3+ -152:sc= -0.0133 (180deg=-1.13) USER MOD Single : A 11 ASN :FLIP amide:sc= -1.29 F(o=-4!,f=-1.3) USER MOD Single : A 13 ASN : amide:sc= -2.37 K(o=-2.4,f=-7.7!) USER MOD Single : A 16 LYS NZ :NH3+ 163:sc= -0.157 (180deg=-0.765) USER MOD Single : A 18 MET CE :methyl 150:sc= -1.08 (180deg=-4.34!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 21 MET CE :methyl -124:sc= -5.55! (180deg=-9.07!) USER MOD Single : A 24 ASN : amide:sc= -0.461 K(o=-0.46,f=-6.6!) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 LYS NZ :NH3+ 134:sc= -1.2 (180deg=-4.39!) USER MOD Single : A 39 THR OG1 : rot -161:sc= -4.33 USER MOD Single : A 41 THR OG1 : rot 180:sc= 0 USER MOD Single : A 42 GLN : amide:sc= -1.22 X(o=-1.2,f=-1.1) USER MOD Single : A 45 ASN : amide:sc=-0.00501 X(o=-0.005,f=-0.33) USER MOD Single : A 46 LYS NZ :NH3+ -126:sc= -0.123 (180deg=-1.49!) USER MOD Single : A 48 THR OG1 : rot 57:sc= 0.76 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot -1:sc= 0.00393 USER MOD Single : A 53 SER OG : rot 45:sc= 0.0653 USER MOD Single : A 54 ASN : amide:sc= -0.322 K(o=-0.32,f=-1.6) USER MOD Single : A 57 ASN :FLIP amide:sc= -0.547 F(o=-2.7!,f=-0.55) USER MOD Single : A 70 TYR OH : rot 180:sc= 0 USER MOD Single : A 71 SER OG : rot 180:sc= 0.0538 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 THR OG1 : rot 180:sc= 0 USER MOD Single : A 81 THR OG1 : rot -28:sc= -0.537! USER MOD Single : A 83 THR OG1 : rot 53:sc= 0.792 USER MOD Single : A 84 MET CE :methyl -139:sc= -0.803 (180deg=-1.15) USER MOD Single : A 87 ASN : amide:sc= -0.458 K(o=-0.46,f=-1.2) USER MOD Single : A 88 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.0348) USER MOD Single : A 92 LYS NZ :NH3+ 157:sc= -0.0197 (180deg=-0.237) USER MOD Single : A 94 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 ASN : amide:sc= -0.026 X(o=-0.026,f=0) USER MOD Single : A 100 LYS NZ :NH3+ 168:sc= 0 (180deg=-0.08) USER MOD Single : A 109 SER OG : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 116 THR OG1 : rot 175:sc= -2.58 USER MOD Single : A 118 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 TYR OH : rot -87:sc= -1.03 USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 130 LYS NZ :NH3+ -157:sc= -0.0279 (180deg=-0.264) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 2.744 7.961 3.392 1.00 0.00 N ATOM 2 CA ALA A 1 3.457 9.083 3.920 1.00 0.00 C ATOM 3 C ALA A 1 4.899 9.017 3.356 1.00 0.00 C ATOM 4 O ALA A 1 5.060 8.332 2.366 1.00 0.00 O ATOM 5 CB ALA A 1 3.508 8.798 5.415 1.00 0.00 C ATOM 0 H1 ALA A 1 1.850 8.285 2.970 1.00 0.00 H new ATOM 0 H2 ALA A 1 3.321 7.494 2.664 1.00 0.00 H new ATOM 0 H3 ALA A 1 2.541 7.287 4.158 1.00 0.00 H new ATOM 0 HA ALA A 1 3.013 10.050 3.683 1.00 0.00 H new ATOM 0 HB1 ALA A 1 4.039 9.604 5.921 1.00 0.00 H new ATOM 0 HB2 ALA A 1 2.493 8.729 5.807 1.00 0.00 H new ATOM 0 HB3 ALA A 1 4.029 7.856 5.588 1.00 0.00 H new ATOM 13 N PHE A 2 5.868 9.703 4.010 1.00 0.00 N ATOM 14 CA PHE A 2 7.273 9.658 3.579 1.00 0.00 C ATOM 15 C PHE A 2 7.537 9.748 2.054 1.00 0.00 C ATOM 16 O PHE A 2 7.901 10.837 1.614 1.00 0.00 O ATOM 17 CB PHE A 2 7.948 8.315 4.012 1.00 0.00 C ATOM 18 CG PHE A 2 8.301 8.222 5.468 1.00 0.00 C ATOM 19 CD1 PHE A 2 9.124 9.121 6.105 1.00 0.00 C ATOM 20 CD2 PHE A 2 7.781 7.169 6.210 1.00 0.00 C ATOM 21 CE1 PHE A 2 9.417 8.964 7.441 1.00 0.00 C ATOM 22 CE2 PHE A 2 8.043 6.980 7.540 1.00 0.00 C ATOM 23 CZ PHE A 2 8.893 7.917 8.170 1.00 0.00 C ATOM 0 H PHE A 2 5.698 10.287 4.829 1.00 0.00 H new ATOM 0 HA PHE A 2 7.682 10.548 4.057 1.00 0.00 H new ATOM 0 HB2 PHE A 2 7.278 7.492 3.763 1.00 0.00 H new ATOM 0 HB3 PHE A 2 8.855 8.176 3.424 1.00 0.00 H new ATOM 0 HD1 PHE A 2 9.541 9.952 5.556 1.00 0.00 H new ATOM 0 HD2 PHE A 2 7.135 6.462 5.711 1.00 0.00 H new ATOM 0 HE1 PHE A 2 10.069 9.674 7.927 1.00 0.00 H new ATOM 0 HE2 PHE A 2 7.618 6.150 8.085 1.00 0.00 H new ATOM 0 HZ PHE A 2 9.131 7.814 9.218 1.00 0.00 H new ATOM 33 N ASP A 3 7.378 8.661 1.318 1.00 0.00 N ATOM 34 CA ASP A 3 7.632 8.554 -0.140 1.00 0.00 C ATOM 35 C ASP A 3 8.059 9.845 -0.793 1.00 0.00 C ATOM 36 O ASP A 3 7.228 10.716 -1.056 1.00 0.00 O ATOM 37 CB ASP A 3 6.516 7.868 -0.937 1.00 0.00 C ATOM 38 CG ASP A 3 6.364 6.424 -0.558 1.00 0.00 C ATOM 39 OD1 ASP A 3 5.917 6.207 0.646 1.00 0.00 O ATOM 40 OD2 ASP A 3 6.653 5.535 -1.371 1.00 0.00 O ATOM 0 H ASP A 3 7.055 7.782 1.722 1.00 0.00 H new ATOM 0 HA ASP A 3 8.491 7.884 -0.182 1.00 0.00 H new ATOM 0 HB2 ASP A 3 5.574 8.389 -0.766 1.00 0.00 H new ATOM 0 HB3 ASP A 3 6.732 7.943 -2.003 1.00 0.00 H new ATOM 45 N GLY A 4 9.348 9.971 -1.016 1.00 0.00 N ATOM 46 CA GLY A 4 9.870 11.176 -1.564 1.00 0.00 C ATOM 47 C GLY A 4 11.208 11.616 -0.931 1.00 0.00 C ATOM 48 O GLY A 4 11.915 10.722 -0.537 1.00 0.00 O ATOM 0 H GLY A 4 10.042 9.249 -0.823 1.00 0.00 H new ATOM 0 HA2 GLY A 4 10.011 11.046 -2.637 1.00 0.00 H new ATOM 0 HA3 GLY A 4 9.137 11.972 -1.433 1.00 0.00 H new ATOM 52 N THR A 5 11.327 12.907 -0.911 1.00 0.00 N ATOM 53 CA THR A 5 12.346 13.702 -0.338 1.00 0.00 C ATOM 54 C THR A 5 11.908 14.120 1.034 1.00 0.00 C ATOM 55 O THR A 5 10.730 14.013 1.284 1.00 0.00 O ATOM 56 CB THR A 5 12.570 14.981 -1.186 1.00 0.00 C ATOM 57 OG1 THR A 5 11.262 15.553 -1.021 1.00 0.00 O ATOM 58 CG2 THR A 5 12.905 14.696 -2.627 1.00 0.00 C ATOM 0 H THR A 5 10.618 13.492 -1.354 1.00 0.00 H new ATOM 0 HA THR A 5 13.270 13.126 -0.298 1.00 0.00 H new ATOM 0 HB THR A 5 13.413 15.605 -0.887 1.00 0.00 H new ATOM 0 HG1 THR A 5 10.687 15.274 -1.764 1.00 0.00 H new ATOM 0 HG21 THR A 5 13.048 15.636 -3.160 1.00 0.00 H new ATOM 0 HG22 THR A 5 13.821 14.107 -2.678 1.00 0.00 H new ATOM 0 HG23 THR A 5 12.089 14.139 -3.087 1.00 0.00 H new ATOM 66 N TRP A 6 12.925 14.533 1.728 1.00 0.00 N ATOM 67 CA TRP A 6 12.917 14.913 3.110 1.00 0.00 C ATOM 68 C TRP A 6 14.298 15.434 3.457 1.00 0.00 C ATOM 69 O TRP A 6 15.147 15.153 2.642 1.00 0.00 O ATOM 70 CB TRP A 6 12.949 13.483 3.748 1.00 0.00 C ATOM 71 CG TRP A 6 11.591 12.913 3.672 1.00 0.00 C ATOM 72 CD1 TRP A 6 11.264 11.648 3.394 1.00 0.00 C ATOM 73 CD2 TRP A 6 10.277 13.496 3.797 1.00 0.00 C ATOM 74 NE1 TRP A 6 9.936 11.370 3.315 1.00 0.00 N ATOM 75 CE2 TRP A 6 9.267 12.515 3.555 1.00 0.00 C ATOM 76 CE3 TRP A 6 9.782 14.778 4.079 1.00 0.00 C ATOM 77 CZ2 TRP A 6 7.915 12.750 3.566 1.00 0.00 C ATOM 78 CZ3 TRP A 6 8.421 15.010 4.100 1.00 0.00 C ATOM 79 CH2 TRP A 6 7.486 14.028 3.848 1.00 0.00 C ATOM 0 H TRP A 6 13.852 14.620 1.312 1.00 0.00 H new ATOM 0 HA TRP A 6 12.130 15.614 3.386 1.00 0.00 H new ATOM 0 HB2 TRP A 6 13.658 12.847 3.219 1.00 0.00 H new ATOM 0 HB3 TRP A 6 13.281 13.537 4.785 1.00 0.00 H new ATOM 0 HD1 TRP A 6 12.015 10.887 3.240 1.00 0.00 H new ATOM 0 HE1 TRP A 6 9.521 10.461 3.111 1.00 0.00 H new ATOM 0 HE3 TRP A 6 10.468 15.587 4.281 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 7.210 11.958 3.360 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 8.072 16.007 4.324 1.00 0.00 H new ATOM 0 HH2 TRP A 6 6.431 14.258 3.871 1.00 0.00 H new ATOM 90 N LYS A 7 14.534 16.083 4.565 1.00 0.00 N ATOM 91 CA LYS A 7 15.877 16.651 4.764 1.00 0.00 C ATOM 92 C LYS A 7 16.061 16.728 6.243 1.00 0.00 C ATOM 93 O LYS A 7 15.584 15.838 6.955 1.00 0.00 O ATOM 94 CB LYS A 7 15.850 18.004 4.020 1.00 0.00 C ATOM 95 CG LYS A 7 15.038 17.929 2.757 1.00 0.00 C ATOM 96 CD LYS A 7 14.943 19.037 1.726 1.00 0.00 C ATOM 97 CE LYS A 7 16.100 19.169 0.703 1.00 0.00 C ATOM 98 NZ LYS A 7 17.122 20.146 1.059 1.00 0.00 N ATOM 0 H LYS A 7 13.865 16.237 5.320 1.00 0.00 H new ATOM 0 HA LYS A 7 16.721 16.084 4.372 1.00 0.00 H new ATOM 0 HB2 LYS A 7 15.435 18.771 4.674 1.00 0.00 H new ATOM 0 HB3 LYS A 7 16.869 18.307 3.780 1.00 0.00 H new ATOM 0 HG2 LYS A 7 15.395 17.049 2.221 1.00 0.00 H new ATOM 0 HG3 LYS A 7 14.015 17.719 3.069 1.00 0.00 H new ATOM 0 HD2 LYS A 7 14.017 18.898 1.169 1.00 0.00 H new ATOM 0 HD3 LYS A 7 14.856 19.984 2.258 1.00 0.00 H new ATOM 0 HE2 LYS A 7 16.574 18.195 0.584 1.00 0.00 H new ATOM 0 HE3 LYS A 7 15.680 19.440 -0.266 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 17.562 20.519 0.194 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 16.686 20.927 1.590 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 17.848 19.690 1.648 1.00 0.00 H new ATOM 112 N VAL A 8 16.726 17.777 6.665 1.00 0.00 N ATOM 113 CA VAL A 8 16.877 17.938 8.076 1.00 0.00 C ATOM 114 C VAL A 8 17.022 19.444 8.358 1.00 0.00 C ATOM 115 O VAL A 8 18.059 19.880 8.836 1.00 0.00 O ATOM 116 CB VAL A 8 17.901 17.059 8.774 1.00 0.00 C ATOM 117 CG1 VAL A 8 18.020 17.432 10.249 1.00 0.00 C ATOM 118 CG2 VAL A 8 17.628 15.532 8.645 1.00 0.00 C ATOM 0 H VAL A 8 17.150 18.496 6.079 1.00 0.00 H new ATOM 0 HA VAL A 8 15.975 17.547 8.546 1.00 0.00 H new ATOM 0 HB VAL A 8 18.841 17.252 8.257 1.00 0.00 H new ATOM 0 HG11 VAL A 8 18.759 16.790 10.728 1.00 0.00 H new ATOM 0 HG12 VAL A 8 18.332 18.473 10.337 1.00 0.00 H new ATOM 0 HG13 VAL A 8 17.054 17.301 10.737 1.00 0.00 H new ATOM 0 HG21 VAL A 8 18.405 14.978 9.171 1.00 0.00 H new ATOM 0 HG22 VAL A 8 16.657 15.298 9.081 1.00 0.00 H new ATOM 0 HG23 VAL A 8 17.630 15.250 7.592 1.00 0.00 H new ATOM 128 N ASP A 9 15.947 20.124 8.002 1.00 0.00 N ATOM 129 CA ASP A 9 15.806 21.553 8.079 1.00 0.00 C ATOM 130 C ASP A 9 16.363 22.179 9.369 1.00 0.00 C ATOM 131 O ASP A 9 16.971 23.225 9.331 1.00 0.00 O ATOM 132 CB ASP A 9 14.289 21.829 8.140 1.00 0.00 C ATOM 133 CG ASP A 9 13.786 23.148 7.673 1.00 0.00 C ATOM 134 OD1 ASP A 9 14.437 24.028 7.147 1.00 0.00 O ATOM 135 OD2 ASP A 9 12.500 23.336 7.873 1.00 0.00 O ATOM 0 H ASP A 9 15.113 19.666 7.635 1.00 0.00 H new ATOM 0 HA ASP A 9 16.345 21.973 7.230 1.00 0.00 H new ATOM 0 HB2 ASP A 9 13.788 21.058 7.555 1.00 0.00 H new ATOM 0 HB3 ASP A 9 13.971 21.701 9.175 1.00 0.00 H new ATOM 140 N ARG A 10 16.070 21.456 10.424 1.00 0.00 N ATOM 141 CA ARG A 10 16.493 21.962 11.674 1.00 0.00 C ATOM 142 C ARG A 10 17.134 20.919 12.538 1.00 0.00 C ATOM 143 O ARG A 10 17.161 19.740 12.141 1.00 0.00 O ATOM 144 CB ARG A 10 15.287 22.643 12.309 1.00 0.00 C ATOM 145 CG ARG A 10 13.922 22.343 11.688 1.00 0.00 C ATOM 146 CD ARG A 10 13.334 23.464 10.833 1.00 0.00 C ATOM 147 NE ARG A 10 11.984 23.123 10.399 1.00 0.00 N ATOM 148 CZ ARG A 10 10.860 23.402 11.096 1.00 0.00 C ATOM 149 NH1 ARG A 10 10.880 24.024 12.255 1.00 0.00 N ATOM 150 NH2 ARG A 10 9.693 23.041 10.600 1.00 0.00 N ATOM 0 H ARG A 10 15.569 20.568 10.432 1.00 0.00 H new ATOM 0 HA ARG A 10 17.291 22.693 11.543 1.00 0.00 H new ATOM 0 HB2 ARG A 10 15.252 22.360 13.361 1.00 0.00 H new ATOM 0 HB3 ARG A 10 15.447 23.721 12.274 1.00 0.00 H new ATOM 0 HG2 ARG A 10 14.010 21.447 11.073 1.00 0.00 H new ATOM 0 HG3 ARG A 10 13.219 22.112 12.489 1.00 0.00 H new ATOM 0 HD2 ARG A 10 13.315 24.392 11.404 1.00 0.00 H new ATOM 0 HD3 ARG A 10 13.969 23.637 9.964 1.00 0.00 H new ATOM 0 HE ARG A 10 11.881 22.640 9.507 1.00 0.00 H new ATOM 0 HH11 ARG A 10 11.769 24.316 12.662 1.00 0.00 H new ATOM 0 HH12 ARG A 10 10.007 24.214 12.747 1.00 0.00 H new ATOM 0 HH21 ARG A 10 9.648 22.558 9.703 1.00 0.00 H new ATOM 0 HH22 ARG A 10 8.836 23.244 11.114 1.00 0.00 H new ATOM 164 N ASN A 11 17.660 21.282 13.673 1.00 0.00 N ATOM 165 CA ASN A 11 18.286 20.267 14.492 1.00 0.00 C ATOM 166 C ASN A 11 18.221 20.543 15.966 1.00 0.00 C ATOM 167 O ASN A 11 18.984 21.375 16.505 1.00 0.00 O ATOM 168 CB ASN A 11 19.766 20.188 14.067 1.00 0.00 C ATOM 169 CG ASN A 11 20.439 21.527 14.011 1.00 0.00 C ATOM 170 OD1 ASN A 11 19.913 22.463 13.239 1.00 0.00 O flip ATOM 171 ND2 ASN A 11 21.460 21.736 14.676 1.00 0.00 N flip ATOM 0 H ASN A 11 17.673 22.231 14.047 1.00 0.00 H new ATOM 0 HA ASN A 11 17.745 19.334 14.335 1.00 0.00 H new ATOM 0 HB2 ASN A 11 20.304 19.548 14.766 1.00 0.00 H new ATOM 0 HB3 ASN A 11 19.831 19.715 13.087 1.00 0.00 H new ATOM 0 HD21 ASN A 11 21.846 20.997 15.264 1.00 0.00 H new ATOM 0 HD22 ASN A 11 21.916 22.647 14.637 1.00 0.00 H new ATOM 178 N GLU A 12 17.314 19.857 16.653 1.00 0.00 N ATOM 179 CA GLU A 12 17.128 20.014 18.086 1.00 0.00 C ATOM 180 C GLU A 12 17.916 18.838 18.703 1.00 0.00 C ATOM 181 O GLU A 12 17.846 17.778 18.074 1.00 0.00 O ATOM 182 CB GLU A 12 15.679 19.937 18.636 1.00 0.00 C ATOM 183 CG GLU A 12 15.196 21.279 19.210 1.00 0.00 C ATOM 184 CD GLU A 12 15.888 21.729 20.507 1.00 0.00 C ATOM 185 OE1 GLU A 12 16.692 21.039 21.074 1.00 0.00 O ATOM 186 OE2 GLU A 12 15.552 22.904 20.963 1.00 0.00 O ATOM 0 H GLU A 12 16.686 19.175 16.228 1.00 0.00 H new ATOM 0 HA GLU A 12 17.452 21.023 18.341 1.00 0.00 H new ATOM 0 HB2 GLU A 12 15.007 19.624 17.837 1.00 0.00 H new ATOM 0 HB3 GLU A 12 15.628 19.174 19.413 1.00 0.00 H new ATOM 0 HG2 GLU A 12 15.341 22.051 18.454 1.00 0.00 H new ATOM 0 HG3 GLU A 12 14.124 21.211 19.395 1.00 0.00 H new ATOM 193 N ASN A 13 18.587 19.019 19.818 1.00 0.00 N ATOM 194 CA ASN A 13 19.358 17.953 20.477 1.00 0.00 C ATOM 195 C ASN A 13 20.602 17.609 19.673 1.00 0.00 C ATOM 196 O ASN A 13 21.674 17.652 20.251 1.00 0.00 O ATOM 197 CB ASN A 13 18.456 16.756 20.794 1.00 0.00 C ATOM 198 CG ASN A 13 17.840 16.901 22.181 1.00 0.00 C ATOM 199 OD1 ASN A 13 17.891 16.016 23.019 1.00 0.00 O ATOM 200 ND2 ASN A 13 17.254 18.086 22.356 1.00 0.00 N ATOM 0 H ASN A 13 18.622 19.913 20.309 1.00 0.00 H new ATOM 0 HA ASN A 13 19.727 18.307 21.440 1.00 0.00 H new ATOM 0 HB2 ASN A 13 17.667 16.680 20.046 1.00 0.00 H new ATOM 0 HB3 ASN A 13 19.035 15.834 20.742 1.00 0.00 H new ATOM 0 HD21 ASN A 13 16.804 18.306 23.244 1.00 0.00 H new ATOM 0 HD22 ASN A 13 17.256 18.772 21.602 1.00 0.00 H new ATOM 207 N TYR A 14 20.392 17.300 18.398 1.00 0.00 N ATOM 208 CA TYR A 14 21.436 16.964 17.446 1.00 0.00 C ATOM 209 C TYR A 14 22.874 17.246 17.827 1.00 0.00 C ATOM 210 O TYR A 14 23.781 16.419 17.702 1.00 0.00 O ATOM 211 CB TYR A 14 20.945 17.540 16.099 1.00 0.00 C ATOM 212 CG TYR A 14 21.170 16.695 14.898 1.00 0.00 C ATOM 213 CD1 TYR A 14 22.327 15.925 14.788 1.00 0.00 C ATOM 214 CD2 TYR A 14 20.268 16.623 13.840 1.00 0.00 C ATOM 215 CE1 TYR A 14 22.588 15.119 13.687 1.00 0.00 C ATOM 216 CE2 TYR A 14 20.490 15.819 12.703 1.00 0.00 C ATOM 217 CZ TYR A 14 21.660 15.082 12.663 1.00 0.00 C ATOM 218 OH TYR A 14 21.950 14.268 11.582 1.00 0.00 O ATOM 0 H TYR A 14 19.458 17.277 17.989 1.00 0.00 H new ATOM 0 HA TYR A 14 21.555 15.882 17.398 1.00 0.00 H new ATOM 0 HB2 TYR A 14 19.876 17.739 16.182 1.00 0.00 H new ATOM 0 HB3 TYR A 14 21.436 18.500 15.938 1.00 0.00 H new ATOM 0 HD1 TYR A 14 23.049 15.956 15.591 1.00 0.00 H new ATOM 0 HD2 TYR A 14 19.361 17.207 13.892 1.00 0.00 H new ATOM 0 HE1 TYR A 14 23.495 14.535 13.632 1.00 0.00 H new ATOM 0 HE2 TYR A 14 19.775 15.780 11.895 1.00 0.00 H new ATOM 0 HH TYR A 14 21.751 13.336 11.812 1.00 0.00 H new ATOM 228 N GLU A 15 23.200 18.444 18.335 1.00 0.00 N ATOM 229 CA GLU A 15 24.565 18.750 18.714 1.00 0.00 C ATOM 230 C GLU A 15 25.071 17.883 19.892 1.00 0.00 C ATOM 231 O GLU A 15 26.132 17.302 19.786 1.00 0.00 O ATOM 232 CB GLU A 15 24.761 20.232 19.046 1.00 0.00 C ATOM 233 CG GLU A 15 26.271 20.561 19.026 1.00 0.00 C ATOM 234 CD GLU A 15 26.542 22.026 19.275 1.00 0.00 C ATOM 235 OE1 GLU A 15 25.647 22.789 18.711 1.00 0.00 O ATOM 236 OE2 GLU A 15 27.482 22.442 19.924 1.00 0.00 O ATOM 0 H GLU A 15 22.536 19.203 18.487 1.00 0.00 H new ATOM 0 HA GLU A 15 25.163 18.509 17.835 1.00 0.00 H new ATOM 0 HB2 GLU A 15 24.232 20.852 18.323 1.00 0.00 H new ATOM 0 HB3 GLU A 15 24.341 20.456 20.026 1.00 0.00 H new ATOM 0 HG2 GLU A 15 26.780 19.966 19.784 1.00 0.00 H new ATOM 0 HG3 GLU A 15 26.690 20.275 18.061 1.00 0.00 H new ATOM 243 N LYS A 16 24.315 17.808 20.979 1.00 0.00 N ATOM 244 CA LYS A 16 24.716 17.020 22.123 1.00 0.00 C ATOM 245 C LYS A 16 24.449 15.551 21.893 1.00 0.00 C ATOM 246 O LYS A 16 25.175 14.710 22.363 1.00 0.00 O ATOM 247 CB LYS A 16 24.003 17.535 23.390 1.00 0.00 C ATOM 248 CG LYS A 16 24.886 17.546 24.625 1.00 0.00 C ATOM 249 CD LYS A 16 24.069 17.863 25.867 1.00 0.00 C ATOM 250 CE LYS A 16 24.246 19.249 26.444 1.00 0.00 C ATOM 251 NZ LYS A 16 24.343 20.252 25.381 1.00 0.00 N ATOM 0 H LYS A 16 23.420 18.286 21.087 1.00 0.00 H new ATOM 0 HA LYS A 16 25.791 17.130 22.266 1.00 0.00 H new ATOM 0 HB2 LYS A 16 23.639 18.546 23.206 1.00 0.00 H new ATOM 0 HB3 LYS A 16 23.130 16.912 23.584 1.00 0.00 H new ATOM 0 HG2 LYS A 16 25.371 16.577 24.740 1.00 0.00 H new ATOM 0 HG3 LYS A 16 25.677 18.286 24.506 1.00 0.00 H new ATOM 0 HD2 LYS A 16 23.015 17.723 25.629 1.00 0.00 H new ATOM 0 HD3 LYS A 16 24.321 17.135 26.638 1.00 0.00 H new ATOM 0 HE2 LYS A 16 23.405 19.485 27.096 1.00 0.00 H new ATOM 0 HE3 LYS A 16 25.145 19.278 27.060 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 24.175 21.198 25.780 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 25.292 20.218 24.957 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 23.631 20.053 24.650 1.00 0.00 H new ATOM 265 N PHE A 17 23.393 15.150 21.155 1.00 0.00 N ATOM 266 CA PHE A 17 22.948 13.812 20.825 1.00 0.00 C ATOM 267 C PHE A 17 24.047 12.871 20.279 1.00 0.00 C ATOM 268 O PHE A 17 24.140 11.658 20.484 1.00 0.00 O ATOM 269 CB PHE A 17 21.744 13.855 19.852 1.00 0.00 C ATOM 270 CG PHE A 17 21.959 12.940 18.671 1.00 0.00 C ATOM 271 CD1 PHE A 17 21.707 11.598 18.809 1.00 0.00 C ATOM 272 CD2 PHE A 17 22.403 13.417 17.456 1.00 0.00 C ATOM 273 CE1 PHE A 17 21.882 10.704 17.779 1.00 0.00 C ATOM 274 CE2 PHE A 17 22.582 12.520 16.404 1.00 0.00 C ATOM 275 CZ PHE A 17 22.333 11.168 16.539 1.00 0.00 C ATOM 0 H PHE A 17 22.774 15.845 20.738 1.00 0.00 H new ATOM 0 HA PHE A 17 22.644 13.378 21.778 1.00 0.00 H new ATOM 0 HB2 PHE A 17 20.836 13.563 20.380 1.00 0.00 H new ATOM 0 HB3 PHE A 17 21.594 14.876 19.501 1.00 0.00 H new ATOM 0 HD1 PHE A 17 21.358 11.230 19.763 1.00 0.00 H new ATOM 0 HD2 PHE A 17 22.609 14.469 17.321 1.00 0.00 H new ATOM 0 HE1 PHE A 17 21.673 9.655 17.926 1.00 0.00 H new ATOM 0 HE2 PHE A 17 22.927 12.895 15.452 1.00 0.00 H new ATOM 0 HZ PHE A 17 22.482 10.490 15.712 1.00 0.00 H new ATOM 285 N MET A 18 24.931 13.510 19.543 1.00 0.00 N ATOM 286 CA MET A 18 26.063 12.874 18.936 1.00 0.00 C ATOM 287 C MET A 18 27.132 12.724 20.030 1.00 0.00 C ATOM 288 O MET A 18 27.551 11.622 20.275 1.00 0.00 O ATOM 289 CB MET A 18 26.593 13.797 17.814 1.00 0.00 C ATOM 290 CG MET A 18 25.991 13.359 16.509 1.00 0.00 C ATOM 291 SD MET A 18 26.523 14.261 15.060 1.00 0.00 S ATOM 292 CE MET A 18 28.273 14.016 15.295 1.00 0.00 C ATOM 0 H MET A 18 24.874 14.510 19.350 1.00 0.00 H new ATOM 0 HA MET A 18 25.807 11.902 18.514 1.00 0.00 H new ATOM 0 HB2 MET A 18 26.331 14.834 18.022 1.00 0.00 H new ATOM 0 HB3 MET A 18 27.681 13.747 17.765 1.00 0.00 H new ATOM 0 HG2 MET A 18 26.221 12.304 16.361 1.00 0.00 H new ATOM 0 HG3 MET A 18 24.907 13.441 16.586 1.00 0.00 H new ATOM 0 HE1 MET A 18 28.772 14.000 14.326 1.00 0.00 H new ATOM 0 HE2 MET A 18 28.677 14.830 15.898 1.00 0.00 H new ATOM 0 HE3 MET A 18 28.442 13.068 15.805 1.00 0.00 H new ATOM 302 N GLU A 19 27.449 13.874 20.578 1.00 0.00 N ATOM 303 CA GLU A 19 28.461 14.042 21.601 1.00 0.00 C ATOM 304 C GLU A 19 28.461 12.985 22.702 1.00 0.00 C ATOM 305 O GLU A 19 29.478 12.441 23.104 1.00 0.00 O ATOM 306 CB GLU A 19 28.139 15.359 22.348 1.00 0.00 C ATOM 307 CG GLU A 19 29.377 16.215 22.659 1.00 0.00 C ATOM 308 CD GLU A 19 29.659 17.224 21.597 1.00 0.00 C ATOM 309 OE1 GLU A 19 28.753 17.824 21.071 1.00 0.00 O ATOM 310 OE2 GLU A 19 30.901 17.406 21.292 1.00 0.00 O ATOM 0 H GLU A 19 26.995 14.749 20.317 1.00 0.00 H new ATOM 0 HA GLU A 19 29.416 13.997 21.077 1.00 0.00 H new ATOM 0 HB2 GLU A 19 27.445 15.946 21.747 1.00 0.00 H new ATOM 0 HB3 GLU A 19 27.630 15.121 23.282 1.00 0.00 H new ATOM 0 HG2 GLU A 19 29.231 16.726 23.611 1.00 0.00 H new ATOM 0 HG3 GLU A 19 30.244 15.564 22.776 1.00 0.00 H new ATOM 317 N LYS A 20 27.244 12.740 23.193 1.00 0.00 N ATOM 318 CA LYS A 20 27.137 11.779 24.306 1.00 0.00 C ATOM 319 C LYS A 20 27.409 10.338 23.959 1.00 0.00 C ATOM 320 O LYS A 20 27.874 9.590 24.839 1.00 0.00 O ATOM 321 CB LYS A 20 25.809 12.019 25.040 1.00 0.00 C ATOM 322 CG LYS A 20 25.511 13.454 25.352 1.00 0.00 C ATOM 323 CD LYS A 20 24.545 13.559 26.488 1.00 0.00 C ATOM 324 CE LYS A 20 24.392 12.394 27.399 1.00 0.00 C ATOM 325 NZ LYS A 20 23.560 12.726 28.549 1.00 0.00 N ATOM 0 H LYS A 20 26.371 13.157 22.870 1.00 0.00 H new ATOM 0 HA LYS A 20 27.962 11.979 24.990 1.00 0.00 H new ATOM 0 HB2 LYS A 20 24.997 11.618 24.433 1.00 0.00 H new ATOM 0 HB3 LYS A 20 25.819 11.454 25.972 1.00 0.00 H new ATOM 0 HG2 LYS A 20 26.434 13.976 25.604 1.00 0.00 H new ATOM 0 HG3 LYS A 20 25.098 13.945 24.471 1.00 0.00 H new ATOM 0 HD2 LYS A 20 24.837 14.417 27.093 1.00 0.00 H new ATOM 0 HD3 LYS A 20 23.564 13.784 26.069 1.00 0.00 H new ATOM 0 HE2 LYS A 20 23.948 11.560 26.855 1.00 0.00 H new ATOM 0 HE3 LYS A 20 25.374 12.065 27.740 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 23.472 11.893 29.166 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 23.997 13.506 29.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 22.616 13.016 28.222 1.00 0.00 H new ATOM 339 N MET A 21 27.149 9.889 22.712 1.00 0.00 N ATOM 340 CA MET A 21 27.414 8.505 22.374 1.00 0.00 C ATOM 341 C MET A 21 28.867 8.161 21.979 1.00 0.00 C ATOM 342 O MET A 21 29.104 7.076 21.446 1.00 0.00 O ATOM 343 CB MET A 21 26.375 7.855 21.423 1.00 0.00 C ATOM 344 CG MET A 21 26.003 8.714 20.225 1.00 0.00 C ATOM 345 SD MET A 21 24.917 7.896 19.022 1.00 0.00 S ATOM 346 CE MET A 21 25.375 9.061 17.696 1.00 0.00 C ATOM 0 H MET A 21 26.768 10.457 21.955 1.00 0.00 H new ATOM 0 HA MET A 21 27.280 8.027 23.344 1.00 0.00 H new ATOM 0 HB2 MET A 21 26.771 6.905 21.065 1.00 0.00 H new ATOM 0 HB3 MET A 21 25.471 7.631 21.990 1.00 0.00 H new ATOM 0 HG2 MET A 21 25.513 9.620 20.581 1.00 0.00 H new ATOM 0 HG3 MET A 21 26.917 9.025 19.718 1.00 0.00 H new ATOM 0 HE1 MET A 21 24.476 9.531 17.298 1.00 0.00 H new ATOM 0 HE2 MET A 21 26.038 9.827 18.098 1.00 0.00 H new ATOM 0 HE3 MET A 21 25.886 8.522 16.898 1.00 0.00 H new ATOM 356 N GLY A 22 29.737 9.121 22.281 1.00 0.00 N ATOM 357 CA GLY A 22 31.194 9.039 22.015 1.00 0.00 C ATOM 358 C GLY A 22 31.643 9.866 20.830 1.00 0.00 C ATOM 359 O GLY A 22 32.617 9.556 20.132 1.00 0.00 O ATOM 0 H GLY A 22 29.458 9.996 22.724 1.00 0.00 H new ATOM 0 HA2 GLY A 22 31.735 9.367 22.902 1.00 0.00 H new ATOM 0 HA3 GLY A 22 31.465 7.997 21.844 1.00 0.00 H new ATOM 363 N ILE A 23 30.913 10.965 20.585 1.00 0.00 N ATOM 364 CA ILE A 23 31.296 11.791 19.460 1.00 0.00 C ATOM 365 C ILE A 23 32.317 12.790 19.898 1.00 0.00 C ATOM 366 O ILE A 23 31.973 13.729 20.615 1.00 0.00 O ATOM 367 CB ILE A 23 30.040 12.460 18.893 1.00 0.00 C ATOM 368 CG1 ILE A 23 29.272 11.518 18.001 1.00 0.00 C ATOM 369 CG2 ILE A 23 30.411 13.703 18.073 1.00 0.00 C ATOM 370 CD1 ILE A 23 29.315 10.079 18.507 1.00 0.00 C ATOM 0 H ILE A 23 30.104 11.279 21.121 1.00 0.00 H new ATOM 0 HA ILE A 23 31.748 11.189 18.671 1.00 0.00 H new ATOM 0 HB ILE A 23 29.419 12.743 19.743 1.00 0.00 H new ATOM 0 HG12 ILE A 23 28.235 11.847 17.936 1.00 0.00 H new ATOM 0 HG13 ILE A 23 29.684 11.559 16.993 1.00 0.00 H new ATOM 0 HG21 ILE A 23 29.505 14.163 17.679 1.00 0.00 H new ATOM 0 HG22 ILE A 23 30.933 14.417 18.710 1.00 0.00 H new ATOM 0 HG23 ILE A 23 31.059 13.413 17.246 1.00 0.00 H new ATOM 0 HD11 ILE A 23 28.748 9.439 17.831 1.00 0.00 H new ATOM 0 HD12 ILE A 23 30.350 9.738 18.547 1.00 0.00 H new ATOM 0 HD13 ILE A 23 28.878 10.031 19.505 1.00 0.00 H new ATOM 382 N ASN A 24 33.564 12.588 19.471 1.00 0.00 N ATOM 383 CA ASN A 24 34.604 13.506 19.850 1.00 0.00 C ATOM 384 C ASN A 24 34.375 14.929 19.459 1.00 0.00 C ATOM 385 O ASN A 24 33.610 15.214 18.547 1.00 0.00 O ATOM 386 CB ASN A 24 36.017 12.949 19.500 1.00 0.00 C ATOM 387 CG ASN A 24 37.170 13.852 19.823 1.00 0.00 C ATOM 388 OD1 ASN A 24 37.352 14.902 19.191 1.00 0.00 O ATOM 389 ND2 ASN A 24 37.973 13.472 20.815 1.00 0.00 N ATOM 0 H ASN A 24 33.860 11.813 18.878 1.00 0.00 H new ATOM 0 HA ASN A 24 34.560 13.568 20.937 1.00 0.00 H new ATOM 0 HB2 ASN A 24 36.158 12.007 20.030 1.00 0.00 H new ATOM 0 HB3 ASN A 24 36.044 12.722 18.434 1.00 0.00 H new ATOM 0 HD21 ASN A 24 38.770 14.053 21.077 1.00 0.00 H new ATOM 0 HD22 ASN A 24 37.791 12.600 21.313 1.00 0.00 H new ATOM 396 N VAL A 25 35.024 15.866 20.132 1.00 0.00 N ATOM 397 CA VAL A 25 34.908 17.296 19.869 1.00 0.00 C ATOM 398 C VAL A 25 35.350 17.823 18.522 1.00 0.00 C ATOM 399 O VAL A 25 34.949 18.923 18.099 1.00 0.00 O ATOM 400 CB VAL A 25 35.232 18.207 21.063 1.00 0.00 C ATOM 401 CG1 VAL A 25 34.485 17.747 22.310 1.00 0.00 C ATOM 402 CG2 VAL A 25 36.701 18.188 21.369 1.00 0.00 C ATOM 0 H VAL A 25 35.663 15.650 20.897 1.00 0.00 H new ATOM 0 HA VAL A 25 33.827 17.368 19.745 1.00 0.00 H new ATOM 0 HB VAL A 25 34.923 19.216 20.791 1.00 0.00 H new ATOM 0 HG11 VAL A 25 34.729 18.406 23.144 1.00 0.00 H new ATOM 0 HG12 VAL A 25 33.412 17.779 22.124 1.00 0.00 H new ATOM 0 HG13 VAL A 25 34.780 16.727 22.555 1.00 0.00 H new ATOM 0 HG21 VAL A 25 36.904 18.841 22.218 1.00 0.00 H new ATOM 0 HG22 VAL A 25 37.009 17.171 21.611 1.00 0.00 H new ATOM 0 HG23 VAL A 25 37.258 18.539 20.500 1.00 0.00 H new ATOM 412 N VAL A 26 36.180 17.121 17.752 1.00 0.00 N ATOM 413 CA VAL A 26 36.667 17.530 16.449 1.00 0.00 C ATOM 414 C VAL A 26 35.576 17.855 15.471 1.00 0.00 C ATOM 415 O VAL A 26 35.705 18.586 14.490 1.00 0.00 O ATOM 416 CB VAL A 26 37.675 16.503 15.906 1.00 0.00 C ATOM 417 CG1 VAL A 26 37.838 16.574 14.400 1.00 0.00 C ATOM 418 CG2 VAL A 26 39.000 16.874 16.511 1.00 0.00 C ATOM 0 H VAL A 26 36.544 16.212 18.038 1.00 0.00 H new ATOM 0 HA VAL A 26 37.192 18.475 16.586 1.00 0.00 H new ATOM 0 HB VAL A 26 37.327 15.500 16.154 1.00 0.00 H new ATOM 0 HG11 VAL A 26 38.562 15.826 14.077 1.00 0.00 H new ATOM 0 HG12 VAL A 26 36.878 16.382 13.921 1.00 0.00 H new ATOM 0 HG13 VAL A 26 38.192 17.566 14.119 1.00 0.00 H new ATOM 0 HG21 VAL A 26 39.765 16.180 16.164 1.00 0.00 H new ATOM 0 HG22 VAL A 26 39.266 17.887 16.210 1.00 0.00 H new ATOM 0 HG23 VAL A 26 38.930 16.824 17.598 1.00 0.00 H new ATOM 428 N LYS A 27 34.416 17.258 15.782 1.00 0.00 N ATOM 429 CA LYS A 27 33.222 17.426 15.040 1.00 0.00 C ATOM 430 C LYS A 27 32.574 18.774 15.461 1.00 0.00 C ATOM 431 O LYS A 27 31.861 19.388 14.655 1.00 0.00 O ATOM 432 CB LYS A 27 32.203 16.305 15.235 1.00 0.00 C ATOM 433 CG LYS A 27 32.841 14.921 15.187 1.00 0.00 C ATOM 434 CD LYS A 27 33.993 14.723 14.188 1.00 0.00 C ATOM 435 CE LYS A 27 33.658 14.957 12.714 1.00 0.00 C ATOM 436 NZ LYS A 27 34.794 15.039 11.761 1.00 0.00 N ATOM 0 H LYS A 27 34.311 16.635 16.583 1.00 0.00 H new ATOM 0 HA LYS A 27 33.497 17.409 13.985 1.00 0.00 H new ATOM 0 HB2 LYS A 27 31.701 16.437 16.194 1.00 0.00 H new ATOM 0 HB3 LYS A 27 31.438 16.376 14.462 1.00 0.00 H new ATOM 0 HG2 LYS A 27 33.211 14.683 16.184 1.00 0.00 H new ATOM 0 HG3 LYS A 27 32.061 14.195 14.955 1.00 0.00 H new ATOM 0 HD2 LYS A 27 34.806 15.394 14.465 1.00 0.00 H new ATOM 0 HD3 LYS A 27 34.369 13.706 14.296 1.00 0.00 H new ATOM 0 HE2 LYS A 27 33.000 14.152 12.386 1.00 0.00 H new ATOM 0 HE3 LYS A 27 33.089 15.884 12.641 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 34.430 15.199 10.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 35.417 15.827 12.031 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 35.331 14.149 11.784 1.00 0.00 H new ATOM 595 N LYS A 37 19.040 16.062 2.497 1.00 0.00 N ATOM 596 CA LYS A 37 17.936 15.266 2.049 1.00 0.00 C ATOM 597 C LYS A 37 18.106 13.801 2.473 1.00 0.00 C ATOM 598 O LYS A 37 18.740 13.048 1.751 1.00 0.00 O ATOM 599 CB LYS A 37 17.724 15.268 0.559 1.00 0.00 C ATOM 600 CG LYS A 37 16.236 15.177 0.210 1.00 0.00 C ATOM 601 CD LYS A 37 16.132 15.025 -1.274 1.00 0.00 C ATOM 602 CE LYS A 37 17.260 15.699 -2.065 1.00 0.00 C ATOM 603 NZ LYS A 37 17.294 17.147 -2.108 1.00 0.00 N ATOM 0 HA LYS A 37 17.069 15.732 2.518 1.00 0.00 H new ATOM 0 HB2 LYS A 37 18.146 16.177 0.131 1.00 0.00 H new ATOM 0 HB3 LYS A 37 18.257 14.428 0.112 1.00 0.00 H new ATOM 0 HG2 LYS A 37 15.775 14.329 0.716 1.00 0.00 H new ATOM 0 HG3 LYS A 37 15.709 16.071 0.542 1.00 0.00 H new ATOM 0 HD2 LYS A 37 16.120 13.963 -1.517 1.00 0.00 H new ATOM 0 HD3 LYS A 37 15.178 15.438 -1.603 1.00 0.00 H new ATOM 0 HE2 LYS A 37 18.208 15.356 -1.651 1.00 0.00 H new ATOM 0 HE3 LYS A 37 17.210 15.336 -3.092 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 18.263 17.477 -1.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 16.987 17.474 -3.046 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 16.656 17.531 -1.382 1.00 0.00 H new ATOM 617 N LEU A 38 17.504 13.525 3.615 1.00 0.00 N ATOM 618 CA LEU A 38 17.511 12.154 4.054 1.00 0.00 C ATOM 619 C LEU A 38 16.827 11.414 2.912 1.00 0.00 C ATOM 620 O LEU A 38 17.304 10.309 2.679 1.00 0.00 O ATOM 621 CB LEU A 38 16.536 11.940 5.190 1.00 0.00 C ATOM 622 CG LEU A 38 17.026 12.429 6.548 1.00 0.00 C ATOM 623 CD1 LEU A 38 15.925 11.956 7.513 1.00 0.00 C ATOM 624 CD2 LEU A 38 18.221 11.582 6.920 1.00 0.00 C ATOM 0 H LEU A 38 17.030 14.194 4.222 1.00 0.00 H new ATOM 0 HA LEU A 38 18.521 11.855 4.333 1.00 0.00 H new ATOM 0 HB2 LEU A 38 15.602 12.449 4.951 1.00 0.00 H new ATOM 0 HB3 LEU A 38 16.310 10.876 5.262 1.00 0.00 H new ATOM 0 HG LEU A 38 17.247 13.496 6.564 1.00 0.00 H new ATOM 0 HD11 LEU A 38 16.178 12.258 8.529 1.00 0.00 H new ATOM 0 HD12 LEU A 38 14.974 12.405 7.228 1.00 0.00 H new ATOM 0 HD13 LEU A 38 15.842 10.870 7.467 1.00 0.00 H new ATOM 0 HD21 LEU A 38 18.605 11.900 7.889 1.00 0.00 H new ATOM 0 HD22 LEU A 38 17.922 10.535 6.973 1.00 0.00 H new ATOM 0 HD23 LEU A 38 18.999 11.699 6.166 1.00 0.00 H new ATOM 636 N THR A 39 15.864 12.101 2.395 1.00 0.00 N ATOM 637 CA THR A 39 14.926 11.697 1.314 1.00 0.00 C ATOM 638 C THR A 39 14.342 10.364 1.678 1.00 0.00 C ATOM 639 O THR A 39 15.074 9.498 2.135 1.00 0.00 O ATOM 640 CB THR A 39 15.657 11.565 -0.027 1.00 0.00 C ATOM 641 OG1 THR A 39 16.836 12.365 -0.060 1.00 0.00 O ATOM 642 CG2 THR A 39 14.847 11.924 -1.273 1.00 0.00 C ATOM 0 H THR A 39 15.667 13.047 2.722 1.00 0.00 H new ATOM 0 HA THR A 39 14.150 12.456 1.212 1.00 0.00 H new ATOM 0 HB THR A 39 15.874 10.498 -0.071 1.00 0.00 H new ATOM 0 HG1 THR A 39 17.111 12.504 -0.990 1.00 0.00 H new ATOM 0 HG21 THR A 39 15.467 11.793 -2.160 1.00 0.00 H new ATOM 0 HG22 THR A 39 13.975 11.274 -1.340 1.00 0.00 H new ATOM 0 HG23 THR A 39 14.521 12.962 -1.208 1.00 0.00 H new ATOM 650 N ILE A 40 13.075 10.051 1.479 1.00 0.00 N ATOM 651 CA ILE A 40 12.571 8.704 1.786 1.00 0.00 C ATOM 652 C ILE A 40 11.598 8.141 0.762 1.00 0.00 C ATOM 653 O ILE A 40 10.485 8.605 0.734 1.00 0.00 O ATOM 654 CB ILE A 40 11.956 8.608 3.166 1.00 0.00 C ATOM 655 CG1 ILE A 40 12.930 8.952 4.296 1.00 0.00 C ATOM 656 CG2 ILE A 40 11.381 7.191 3.407 1.00 0.00 C ATOM 657 CD1 ILE A 40 12.283 9.661 5.516 1.00 0.00 C ATOM 0 H ILE A 40 12.375 10.695 1.111 1.00 0.00 H new ATOM 0 HA ILE A 40 13.469 8.088 1.748 1.00 0.00 H new ATOM 0 HB ILE A 40 11.160 9.352 3.187 1.00 0.00 H new ATOM 0 HG12 ILE A 40 13.408 8.034 4.638 1.00 0.00 H new ATOM 0 HG13 ILE A 40 13.717 9.591 3.897 1.00 0.00 H new ATOM 0 HG21 ILE A 40 10.943 7.141 4.404 1.00 0.00 H new ATOM 0 HG22 ILE A 40 10.614 6.978 2.663 1.00 0.00 H new ATOM 0 HG23 ILE A 40 12.181 6.455 3.324 1.00 0.00 H new ATOM 0 HD11 ILE A 40 13.048 9.866 6.266 1.00 0.00 H new ATOM 0 HD12 ILE A 40 11.830 10.599 5.194 1.00 0.00 H new ATOM 0 HD13 ILE A 40 11.516 9.017 5.946 1.00 0.00 H new ATOM 669 N THR A 41 12.050 7.169 -0.019 1.00 0.00 N ATOM 670 CA THR A 41 11.248 6.524 -1.041 1.00 0.00 C ATOM 671 C THR A 41 11.058 5.056 -0.716 1.00 0.00 C ATOM 672 O THR A 41 11.922 4.242 -1.025 1.00 0.00 O ATOM 673 CB THR A 41 11.806 6.616 -2.460 1.00 0.00 C ATOM 674 OG1 THR A 41 12.016 7.947 -2.809 1.00 0.00 O ATOM 675 CG2 THR A 41 10.908 5.961 -3.478 1.00 0.00 C ATOM 0 H THR A 41 13.000 6.803 0.044 1.00 0.00 H new ATOM 0 HA THR A 41 10.307 7.074 -1.029 1.00 0.00 H new ATOM 0 HB THR A 41 12.753 6.077 -2.463 1.00 0.00 H new ATOM 0 HG1 THR A 41 12.375 7.994 -3.720 1.00 0.00 H new ATOM 0 HG21 THR A 41 11.352 6.055 -4.469 1.00 0.00 H new ATOM 0 HG22 THR A 41 10.789 4.906 -3.233 1.00 0.00 H new ATOM 0 HG23 THR A 41 9.933 6.448 -3.469 1.00 0.00 H new ATOM 683 N GLN A 42 9.972 4.675 -0.109 1.00 0.00 N ATOM 684 CA GLN A 42 9.679 3.315 0.250 1.00 0.00 C ATOM 685 C GLN A 42 9.830 2.376 -0.895 1.00 0.00 C ATOM 686 O GLN A 42 9.654 2.730 -2.058 1.00 0.00 O ATOM 687 CB GLN A 42 8.182 3.287 0.667 1.00 0.00 C ATOM 688 CG GLN A 42 7.791 2.088 1.503 1.00 0.00 C ATOM 689 CD GLN A 42 6.785 1.161 0.800 1.00 0.00 C ATOM 690 OE1 GLN A 42 5.902 1.599 0.029 1.00 0.00 O ATOM 691 NE2 GLN A 42 6.987 -0.127 1.122 1.00 0.00 N ATOM 0 H GLN A 42 9.236 5.328 0.161 1.00 0.00 H new ATOM 0 HA GLN A 42 10.367 3.003 1.036 1.00 0.00 H new ATOM 0 HB2 GLN A 42 7.956 4.195 1.226 1.00 0.00 H new ATOM 0 HB3 GLN A 42 7.566 3.305 -0.232 1.00 0.00 H new ATOM 0 HG2 GLN A 42 8.687 1.519 1.752 1.00 0.00 H new ATOM 0 HG3 GLN A 42 7.361 2.433 2.443 1.00 0.00 H new ATOM 0 HE21 GLN A 42 7.738 -0.381 1.763 1.00 0.00 H new ATOM 0 HE22 GLN A 42 6.389 -0.852 0.725 1.00 0.00 H new ATOM 700 N GLU A 43 10.164 1.150 -0.580 1.00 0.00 N ATOM 701 CA GLU A 43 10.363 0.076 -1.538 1.00 0.00 C ATOM 702 C GLU A 43 9.830 -1.163 -0.860 1.00 0.00 C ATOM 703 O GLU A 43 9.282 -1.009 0.225 1.00 0.00 O ATOM 704 CB GLU A 43 11.864 0.001 -1.812 1.00 0.00 C ATOM 705 CG GLU A 43 12.286 0.280 -3.246 1.00 0.00 C ATOM 706 CD GLU A 43 11.582 -0.715 -4.078 1.00 0.00 C ATOM 707 OE1 GLU A 43 11.356 -1.852 -3.759 1.00 0.00 O ATOM 708 OE2 GLU A 43 11.230 -0.205 -5.217 1.00 0.00 O ATOM 0 H GLU A 43 10.312 0.855 0.385 1.00 0.00 H new ATOM 0 HA GLU A 43 9.856 0.210 -2.494 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.370 0.712 -1.159 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.216 -0.993 -1.536 1.00 0.00 H new ATOM 0 HG2 GLU A 43 12.019 1.295 -3.541 1.00 0.00 H new ATOM 0 HG3 GLU A 43 13.366 0.189 -3.360 1.00 0.00 H new ATOM 715 N GLY A 44 9.993 -2.327 -1.486 1.00 0.00 N ATOM 716 CA GLY A 44 9.518 -3.595 -0.931 1.00 0.00 C ATOM 717 C GLY A 44 10.323 -3.802 0.336 1.00 0.00 C ATOM 718 O GLY A 44 11.460 -4.265 0.294 1.00 0.00 O ATOM 0 H GLY A 44 10.457 -2.419 -2.390 1.00 0.00 H new ATOM 0 HA2 GLY A 44 8.450 -3.555 -0.717 1.00 0.00 H new ATOM 0 HA3 GLY A 44 9.672 -4.414 -1.633 1.00 0.00 H new ATOM 722 N ASN A 45 9.657 -3.425 1.436 1.00 0.00 N ATOM 723 CA ASN A 45 10.206 -3.520 2.753 1.00 0.00 C ATOM 724 C ASN A 45 11.347 -2.479 2.822 1.00 0.00 C ATOM 725 O ASN A 45 11.299 -1.546 3.586 1.00 0.00 O ATOM 726 CB ASN A 45 10.742 -4.923 3.140 1.00 0.00 C ATOM 727 CG ASN A 45 9.599 -5.839 3.568 1.00 0.00 C ATOM 728 OD1 ASN A 45 8.536 -5.900 2.909 1.00 0.00 O ATOM 729 ND2 ASN A 45 9.854 -6.529 4.665 1.00 0.00 N ATOM 0 H ASN A 45 8.711 -3.044 1.413 1.00 0.00 H new ATOM 0 HA ASN A 45 9.406 -3.332 3.469 1.00 0.00 H new ATOM 0 HB2 ASN A 45 11.269 -5.363 2.293 1.00 0.00 H new ATOM 0 HB3 ASN A 45 11.464 -4.831 3.952 1.00 0.00 H new ATOM 0 HD21 ASN A 45 9.156 -7.173 5.036 1.00 0.00 H new ATOM 0 HD22 ASN A 45 10.749 -6.418 5.141 1.00 0.00 H new ATOM 736 N LYS A 46 12.380 -2.617 2.031 1.00 0.00 N ATOM 737 CA LYS A 46 13.457 -1.631 2.109 1.00 0.00 C ATOM 738 C LYS A 46 12.946 -0.247 1.783 1.00 0.00 C ATOM 739 O LYS A 46 11.839 -0.039 1.295 1.00 0.00 O ATOM 740 CB LYS A 46 14.494 -1.864 0.990 1.00 0.00 C ATOM 741 CG LYS A 46 14.857 -0.686 0.106 1.00 0.00 C ATOM 742 CD LYS A 46 15.602 -1.194 -1.150 1.00 0.00 C ATOM 743 CE LYS A 46 16.533 -2.327 -0.793 1.00 0.00 C ATOM 744 NZ LYS A 46 17.432 -2.703 -1.912 1.00 0.00 N ATOM 0 H LYS A 46 12.509 -3.364 1.349 1.00 0.00 H new ATOM 0 HA LYS A 46 13.865 -1.723 3.116 1.00 0.00 H new ATOM 0 HB2 LYS A 46 15.410 -2.230 1.453 1.00 0.00 H new ATOM 0 HB3 LYS A 46 14.121 -2.662 0.348 1.00 0.00 H new ATOM 0 HG2 LYS A 46 13.956 -0.146 -0.186 1.00 0.00 H new ATOM 0 HG3 LYS A 46 15.485 0.015 0.656 1.00 0.00 H new ATOM 0 HD2 LYS A 46 14.882 -1.529 -1.896 1.00 0.00 H new ATOM 0 HD3 LYS A 46 16.169 -0.378 -1.598 1.00 0.00 H new ATOM 0 HE2 LYS A 46 17.134 -2.040 0.070 1.00 0.00 H new ATOM 0 HE3 LYS A 46 15.945 -3.196 -0.497 1.00 0.00 H new ATOM 0 HZ1 LYS A 46 17.343 -3.722 -2.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 46 17.168 -2.168 -2.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 46 18.416 -2.483 -1.656 1.00 0.00 H new ATOM 758 N PHE A 47 13.867 0.691 2.044 1.00 0.00 N ATOM 759 CA PHE A 47 13.556 2.048 1.676 1.00 0.00 C ATOM 760 C PHE A 47 14.788 2.774 1.064 1.00 0.00 C ATOM 761 O PHE A 47 15.740 2.986 1.771 1.00 0.00 O ATOM 762 CB PHE A 47 12.915 2.985 2.726 1.00 0.00 C ATOM 763 CG PHE A 47 11.795 2.404 3.559 1.00 0.00 C ATOM 764 CD1 PHE A 47 11.859 1.234 4.272 1.00 0.00 C ATOM 765 CD2 PHE A 47 10.579 3.133 3.601 1.00 0.00 C ATOM 766 CE1 PHE A 47 10.757 0.811 4.997 1.00 0.00 C ATOM 767 CE2 PHE A 47 9.469 2.708 4.328 1.00 0.00 C ATOM 768 CZ PHE A 47 9.549 1.523 5.045 1.00 0.00 C ATOM 0 H PHE A 47 14.775 0.536 2.482 1.00 0.00 H new ATOM 0 HA PHE A 47 12.761 1.873 0.951 1.00 0.00 H new ATOM 0 HB2 PHE A 47 13.699 3.327 3.401 1.00 0.00 H new ATOM 0 HB3 PHE A 47 12.533 3.865 2.209 1.00 0.00 H new ATOM 0 HD1 PHE A 47 12.764 0.645 4.268 1.00 0.00 H new ATOM 0 HD2 PHE A 47 10.511 4.057 3.046 1.00 0.00 H new ATOM 0 HE1 PHE A 47 10.831 -0.112 5.553 1.00 0.00 H new ATOM 0 HE2 PHE A 47 8.560 3.292 4.333 1.00 0.00 H new ATOM 0 HZ PHE A 47 8.710 1.161 5.621 1.00 0.00 H new ATOM 778 N THR A 48 14.652 3.088 -0.208 1.00 0.00 N ATOM 779 CA THR A 48 15.608 3.760 -1.015 1.00 0.00 C ATOM 780 C THR A 48 15.589 5.114 -0.370 1.00 0.00 C ATOM 781 O THR A 48 14.903 6.050 -0.801 1.00 0.00 O ATOM 782 CB THR A 48 15.275 3.906 -2.532 1.00 0.00 C ATOM 783 OG1 THR A 48 14.004 3.393 -2.811 1.00 0.00 O ATOM 784 CG2 THR A 48 16.388 3.196 -3.330 1.00 0.00 C ATOM 0 H THR A 48 13.805 2.857 -0.727 1.00 0.00 H new ATOM 0 HA THR A 48 16.550 3.212 -1.042 1.00 0.00 H new ATOM 0 HB THR A 48 15.245 4.956 -2.824 1.00 0.00 H new ATOM 0 HG1 THR A 48 13.337 3.852 -2.259 1.00 0.00 H new ATOM 0 HG21 THR A 48 16.182 3.282 -4.397 1.00 0.00 H new ATOM 0 HG22 THR A 48 17.348 3.661 -3.108 1.00 0.00 H new ATOM 0 HG23 THR A 48 16.421 2.143 -3.050 1.00 0.00 H new ATOM 792 N VAL A 49 16.360 5.180 0.690 1.00 0.00 N ATOM 793 CA VAL A 49 16.431 6.432 1.441 1.00 0.00 C ATOM 794 C VAL A 49 17.710 7.047 0.997 1.00 0.00 C ATOM 795 O VAL A 49 18.669 6.341 0.646 1.00 0.00 O ATOM 796 CB VAL A 49 16.451 6.145 2.938 1.00 0.00 C ATOM 797 CG1 VAL A 49 17.648 6.781 3.620 1.00 0.00 C ATOM 798 CG2 VAL A 49 15.190 6.658 3.638 1.00 0.00 C ATOM 0 H VAL A 49 16.932 4.416 1.050 1.00 0.00 H new ATOM 0 HA VAL A 49 15.577 7.086 1.265 1.00 0.00 H new ATOM 0 HB VAL A 49 16.506 5.060 3.025 1.00 0.00 H new ATOM 0 HG11 VAL A 49 17.624 6.552 4.685 1.00 0.00 H new ATOM 0 HG12 VAL A 49 18.566 6.387 3.185 1.00 0.00 H new ATOM 0 HG13 VAL A 49 17.615 7.861 3.480 1.00 0.00 H new ATOM 0 HG21 VAL A 49 15.247 6.432 4.703 1.00 0.00 H new ATOM 0 HG22 VAL A 49 15.110 7.736 3.500 1.00 0.00 H new ATOM 0 HG23 VAL A 49 14.313 6.172 3.211 1.00 0.00 H new ATOM 808 N LYS A 50 17.731 8.353 1.011 1.00 0.00 N ATOM 809 CA LYS A 50 18.960 9.021 0.597 1.00 0.00 C ATOM 810 C LYS A 50 19.742 9.167 1.846 1.00 0.00 C ATOM 811 O LYS A 50 19.821 8.165 2.559 1.00 0.00 O ATOM 812 CB LYS A 50 18.683 10.384 0.000 1.00 0.00 C ATOM 813 CG LYS A 50 19.764 10.878 -0.915 1.00 0.00 C ATOM 814 CD LYS A 50 19.215 11.492 -2.170 1.00 0.00 C ATOM 815 CE LYS A 50 19.905 10.868 -3.325 1.00 0.00 C ATOM 816 NZ LYS A 50 19.698 11.728 -4.492 1.00 0.00 N ATOM 0 H LYS A 50 16.960 8.960 1.288 1.00 0.00 H new ATOM 0 HA LYS A 50 19.482 8.453 -0.173 1.00 0.00 H new ATOM 0 HB2 LYS A 50 17.744 10.344 -0.552 1.00 0.00 H new ATOM 0 HB3 LYS A 50 18.548 11.103 0.808 1.00 0.00 H new ATOM 0 HG2 LYS A 50 20.373 11.614 -0.390 1.00 0.00 H new ATOM 0 HG3 LYS A 50 20.422 10.049 -1.177 1.00 0.00 H new ATOM 0 HD2 LYS A 50 18.139 11.329 -2.235 1.00 0.00 H new ATOM 0 HD3 LYS A 50 19.374 12.570 -2.168 1.00 0.00 H new ATOM 0 HE2 LYS A 50 20.969 10.755 -3.118 1.00 0.00 H new ATOM 0 HE3 LYS A 50 19.509 9.870 -3.512 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 20.173 11.312 -5.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 18.679 11.813 -4.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 20.094 12.671 -4.303 1.00 0.00 H new ATOM 830 N GLU A 51 20.226 10.365 2.026 1.00 0.00 N ATOM 831 CA GLU A 51 20.971 10.823 3.184 1.00 0.00 C ATOM 832 C GLU A 51 22.236 11.427 2.606 1.00 0.00 C ATOM 833 O GLU A 51 23.328 10.910 2.743 1.00 0.00 O ATOM 834 CB GLU A 51 21.405 9.714 4.091 1.00 0.00 C ATOM 835 CG GLU A 51 22.265 10.103 5.285 1.00 0.00 C ATOM 836 CD GLU A 51 22.441 8.958 6.210 1.00 0.00 C ATOM 837 OE1 GLU A 51 21.423 8.428 6.530 1.00 0.00 O ATOM 838 OE2 GLU A 51 23.705 8.609 6.613 1.00 0.00 O ATOM 0 H GLU A 51 20.107 11.100 1.328 1.00 0.00 H new ATOM 0 HA GLU A 51 20.346 11.496 3.771 1.00 0.00 H new ATOM 0 HB2 GLU A 51 20.513 9.211 4.464 1.00 0.00 H new ATOM 0 HB3 GLU A 51 21.957 8.985 3.497 1.00 0.00 H new ATOM 0 HG2 GLU A 51 23.239 10.448 4.939 1.00 0.00 H new ATOM 0 HG3 GLU A 51 21.802 10.935 5.815 1.00 0.00 H new ATOM 845 N SER A 52 22.027 12.538 1.935 1.00 0.00 N ATOM 846 CA SER A 52 23.166 13.152 1.319 1.00 0.00 C ATOM 847 C SER A 52 23.866 14.107 2.291 1.00 0.00 C ATOM 848 O SER A 52 24.933 14.581 1.935 1.00 0.00 O ATOM 849 CB SER A 52 22.736 13.845 0.050 1.00 0.00 C ATOM 850 OG SER A 52 22.511 12.782 -0.878 1.00 0.00 O ATOM 0 H SER A 52 21.131 13.008 1.809 1.00 0.00 H new ATOM 0 HA SER A 52 23.896 12.386 1.058 1.00 0.00 H new ATOM 0 HB2 SER A 52 21.832 14.434 0.206 1.00 0.00 H new ATOM 0 HB3 SER A 52 23.505 14.529 -0.309 1.00 0.00 H new ATOM 0 HG SER A 52 22.716 11.925 -0.449 1.00 0.00 H new ATOM 856 N SER A 53 23.225 14.319 3.420 1.00 0.00 N ATOM 857 CA SER A 53 23.650 15.200 4.472 1.00 0.00 C ATOM 858 C SER A 53 25.099 15.648 4.292 1.00 0.00 C ATOM 859 O SER A 53 25.918 14.777 4.417 1.00 0.00 O ATOM 860 CB SER A 53 23.504 14.647 5.897 1.00 0.00 C ATOM 861 OG SER A 53 23.899 13.302 5.989 1.00 0.00 O ATOM 0 H SER A 53 22.344 13.852 3.635 1.00 0.00 H new ATOM 0 HA SER A 53 22.961 16.040 4.376 1.00 0.00 H new ATOM 0 HB2 SER A 53 24.104 15.247 6.581 1.00 0.00 H new ATOM 0 HB3 SER A 53 22.466 14.741 6.217 1.00 0.00 H new ATOM 0 HG SER A 53 24.745 13.176 5.510 1.00 0.00 H new ATOM 867 N ASN A 54 25.208 16.917 4.014 1.00 0.00 N ATOM 868 CA ASN A 54 26.472 17.604 3.736 1.00 0.00 C ATOM 869 C ASN A 54 27.706 16.938 4.234 1.00 0.00 C ATOM 870 O ASN A 54 28.512 17.640 4.889 1.00 0.00 O ATOM 871 CB ASN A 54 26.409 19.024 4.374 1.00 0.00 C ATOM 872 CG ASN A 54 27.395 19.995 3.806 1.00 0.00 C ATOM 873 OD1 ASN A 54 27.817 19.818 2.653 1.00 0.00 O ATOM 874 ND2 ASN A 54 27.792 21.024 4.556 1.00 0.00 N ATOM 0 H ASN A 54 24.400 17.538 3.969 1.00 0.00 H new ATOM 0 HA ASN A 54 26.558 17.610 2.649 1.00 0.00 H new ATOM 0 HB2 ASN A 54 25.404 19.425 4.243 1.00 0.00 H new ATOM 0 HB3 ASN A 54 26.579 18.936 5.447 1.00 0.00 H new ATOM 0 HD21 ASN A 54 28.464 21.696 4.185 1.00 0.00 H new ATOM 0 HD22 ASN A 54 27.424 21.139 5.500 1.00 0.00 H new ATOM 881 N PHE A 55 27.974 15.678 4.003 1.00 0.00 N ATOM 882 CA PHE A 55 29.137 14.995 4.485 1.00 0.00 C ATOM 883 C PHE A 55 29.253 13.589 4.006 1.00 0.00 C ATOM 884 O PHE A 55 30.349 13.160 3.674 1.00 0.00 O ATOM 885 CB PHE A 55 28.946 14.688 5.989 1.00 0.00 C ATOM 886 CG PHE A 55 28.829 15.879 6.844 1.00 0.00 C ATOM 887 CD1 PHE A 55 29.957 16.642 7.089 1.00 0.00 C ATOM 888 CD2 PHE A 55 27.620 16.287 7.421 1.00 0.00 C ATOM 889 CE1 PHE A 55 29.959 17.782 7.869 1.00 0.00 C ATOM 890 CE2 PHE A 55 27.609 17.424 8.205 1.00 0.00 C ATOM 891 CZ PHE A 55 28.753 18.162 8.430 1.00 0.00 C ATOM 0 H PHE A 55 27.360 15.080 3.451 1.00 0.00 H new ATOM 0 HA PHE A 55 29.964 15.637 4.182 1.00 0.00 H new ATOM 0 HB2 PHE A 55 28.051 14.079 6.112 1.00 0.00 H new ATOM 0 HB3 PHE A 55 29.789 14.089 6.335 1.00 0.00 H new ATOM 0 HD1 PHE A 55 30.890 16.328 6.645 1.00 0.00 H new ATOM 0 HD2 PHE A 55 26.714 15.723 7.256 1.00 0.00 H new ATOM 0 HE1 PHE A 55 30.862 18.351 8.034 1.00 0.00 H new ATOM 0 HE2 PHE A 55 26.680 17.744 8.654 1.00 0.00 H new ATOM 0 HZ PHE A 55 28.706 19.045 9.050 1.00 0.00 H new ATOM 901 N ARG A 56 28.098 12.936 3.996 1.00 0.00 N ATOM 902 CA ARG A 56 28.134 11.558 3.545 1.00 0.00 C ATOM 903 C ARG A 56 27.238 11.435 2.336 1.00 0.00 C ATOM 904 O ARG A 56 26.446 10.517 2.297 1.00 0.00 O ATOM 905 CB ARG A 56 27.595 10.642 4.628 1.00 0.00 C ATOM 906 CG ARG A 56 28.233 10.821 6.006 1.00 0.00 C ATOM 907 CD ARG A 56 29.516 10.028 6.160 1.00 0.00 C ATOM 908 NE ARG A 56 30.567 10.858 6.765 1.00 0.00 N ATOM 909 CZ ARG A 56 31.855 10.619 6.535 1.00 0.00 C ATOM 910 NH1 ARG A 56 32.315 9.645 5.763 1.00 0.00 N ATOM 911 NH2 ARG A 56 32.772 11.404 7.113 1.00 0.00 N ATOM 0 H ARG A 56 27.189 13.306 4.273 1.00 0.00 H new ATOM 0 HA ARG A 56 29.161 11.279 3.309 1.00 0.00 H new ATOM 0 HB2 ARG A 56 26.521 10.804 4.718 1.00 0.00 H new ATOM 0 HB3 ARG A 56 27.736 9.609 4.311 1.00 0.00 H new ATOM 0 HG2 ARG A 56 28.441 11.878 6.172 1.00 0.00 H new ATOM 0 HG3 ARG A 56 27.524 10.511 6.774 1.00 0.00 H new ATOM 0 HD2 ARG A 56 29.335 9.151 6.781 1.00 0.00 H new ATOM 0 HD3 ARG A 56 29.846 9.667 5.186 1.00 0.00 H new ATOM 0 HE ARG A 56 30.303 11.633 7.374 1.00 0.00 H new ATOM 0 HH11 ARG A 56 31.664 9.014 5.296 1.00 0.00 H new ATOM 0 HH12 ARG A 56 33.320 9.526 5.636 1.00 0.00 H new ATOM 0 HH21 ARG A 56 32.478 12.171 7.718 1.00 0.00 H new ATOM 0 HH22 ARG A 56 33.764 11.236 6.948 1.00 0.00 H new ATOM 925 N ASN A 57 27.475 12.384 1.497 1.00 0.00 N ATOM 926 CA ASN A 57 26.821 12.592 0.238 1.00 0.00 C ATOM 927 C ASN A 57 26.683 11.253 -0.443 1.00 0.00 C ATOM 928 O ASN A 57 27.450 10.802 -1.274 1.00 0.00 O ATOM 929 CB ASN A 57 27.541 13.684 -0.578 1.00 0.00 C ATOM 930 CG ASN A 57 28.837 13.195 -1.191 1.00 0.00 C ATOM 931 OD1 ASN A 57 29.553 12.361 -0.493 1.00 0.00 O flip ATOM 932 ND2 ASN A 57 29.202 13.578 -2.334 1.00 0.00 N flip ATOM 0 H ASN A 57 28.185 13.093 1.682 1.00 0.00 H new ATOM 0 HA ASN A 57 25.812 12.985 0.363 1.00 0.00 H new ATOM 0 HB2 ASN A 57 26.879 14.036 -1.369 1.00 0.00 H new ATOM 0 HB3 ASN A 57 27.748 14.537 0.068 1.00 0.00 H new ATOM 0 HD21 ASN A 57 28.624 14.232 -2.861 1.00 0.00 H new ATOM 0 HD22 ASN A 57 30.076 13.234 -2.732 1.00 0.00 H new ATOM 939 N ILE A 58 25.618 10.544 -0.071 1.00 0.00 N ATOM 940 CA ILE A 58 25.301 9.269 -0.580 1.00 0.00 C ATOM 941 C ILE A 58 23.816 8.978 -0.290 1.00 0.00 C ATOM 942 O ILE A 58 23.106 9.838 0.282 1.00 0.00 O ATOM 943 CB ILE A 58 26.148 8.200 0.082 1.00 0.00 C ATOM 944 CG1 ILE A 58 26.469 7.047 -0.847 1.00 0.00 C ATOM 945 CG2 ILE A 58 25.547 7.687 1.364 1.00 0.00 C ATOM 946 CD1 ILE A 58 27.898 6.557 -0.695 1.00 0.00 C ATOM 0 H ILE A 58 24.947 10.880 0.620 1.00 0.00 H new ATOM 0 HA ILE A 58 25.497 9.257 -1.652 1.00 0.00 H new ATOM 0 HB ILE A 58 27.085 8.698 0.331 1.00 0.00 H new ATOM 0 HG12 ILE A 58 25.783 6.223 -0.649 1.00 0.00 H new ATOM 0 HG13 ILE A 58 26.303 7.359 -1.878 1.00 0.00 H new ATOM 0 HG21 ILE A 58 26.198 6.924 1.791 1.00 0.00 H new ATOM 0 HG22 ILE A 58 25.440 8.510 2.070 1.00 0.00 H new ATOM 0 HG23 ILE A 58 24.568 7.255 1.159 1.00 0.00 H new ATOM 0 HD11 ILE A 58 28.074 5.731 -1.383 1.00 0.00 H new ATOM 0 HD12 ILE A 58 28.588 7.371 -0.920 1.00 0.00 H new ATOM 0 HD13 ILE A 58 28.059 6.218 0.328 1.00 0.00 H new ATOM 958 N ASP A 59 23.430 7.794 -0.693 1.00 0.00 N ATOM 959 CA ASP A 59 22.069 7.397 -0.477 1.00 0.00 C ATOM 960 C ASP A 59 22.182 6.172 0.411 1.00 0.00 C ATOM 961 O ASP A 59 23.252 5.537 0.339 1.00 0.00 O ATOM 962 CB ASP A 59 21.428 6.942 -1.795 1.00 0.00 C ATOM 963 CG ASP A 59 22.364 6.515 -2.881 1.00 0.00 C ATOM 964 OD1 ASP A 59 23.310 5.807 -2.616 1.00 0.00 O ATOM 965 OD2 ASP A 59 22.026 6.993 -4.059 1.00 0.00 O ATOM 0 H ASP A 59 24.022 7.107 -1.160 1.00 0.00 H new ATOM 0 HA ASP A 59 21.474 8.210 -0.060 1.00 0.00 H new ATOM 0 HB2 ASP A 59 20.756 6.112 -1.578 1.00 0.00 H new ATOM 0 HB3 ASP A 59 20.814 7.758 -2.175 1.00 0.00 H new ATOM 970 N VAL A 60 21.171 5.863 1.184 1.00 0.00 N ATOM 971 CA VAL A 60 21.260 4.708 2.033 1.00 0.00 C ATOM 972 C VAL A 60 20.015 3.875 1.883 1.00 0.00 C ATOM 973 O VAL A 60 18.899 4.237 2.299 1.00 0.00 O ATOM 974 CB VAL A 60 21.532 5.165 3.466 1.00 0.00 C ATOM 975 CG1 VAL A 60 21.462 3.997 4.428 1.00 0.00 C ATOM 976 CG2 VAL A 60 22.888 5.812 3.594 1.00 0.00 C ATOM 0 H VAL A 60 20.296 6.384 1.242 1.00 0.00 H new ATOM 0 HA VAL A 60 22.091 4.065 1.744 1.00 0.00 H new ATOM 0 HB VAL A 60 20.762 5.896 3.714 1.00 0.00 H new ATOM 0 HG11 VAL A 60 21.659 4.348 5.441 1.00 0.00 H new ATOM 0 HG12 VAL A 60 20.469 3.550 4.386 1.00 0.00 H new ATOM 0 HG13 VAL A 60 22.208 3.252 4.151 1.00 0.00 H new ATOM 0 HG21 VAL A 60 23.046 6.124 4.626 1.00 0.00 H new ATOM 0 HG22 VAL A 60 23.660 5.098 3.308 1.00 0.00 H new ATOM 0 HG23 VAL A 60 22.939 6.682 2.940 1.00 0.00 H new ATOM 986 N VAL A 61 20.168 2.701 1.269 1.00 0.00 N ATOM 987 CA VAL A 61 19.085 1.771 1.033 1.00 0.00 C ATOM 988 C VAL A 61 19.287 0.559 1.890 1.00 0.00 C ATOM 989 O VAL A 61 20.404 0.017 1.906 1.00 0.00 O ATOM 990 CB VAL A 61 19.010 1.396 -0.440 1.00 0.00 C ATOM 991 CG1 VAL A 61 20.401 1.446 -1.085 1.00 0.00 C ATOM 992 CG2 VAL A 61 18.478 -0.023 -0.567 1.00 0.00 C ATOM 0 H VAL A 61 21.068 2.372 0.919 1.00 0.00 H new ATOM 0 HA VAL A 61 18.137 2.240 1.297 1.00 0.00 H new ATOM 0 HB VAL A 61 18.353 2.105 -0.943 1.00 0.00 H new ATOM 0 HG11 VAL A 61 20.324 1.174 -2.138 1.00 0.00 H new ATOM 0 HG12 VAL A 61 20.806 2.454 -0.999 1.00 0.00 H new ATOM 0 HG13 VAL A 61 21.063 0.745 -0.577 1.00 0.00 H new ATOM 0 HG21 VAL A 61 18.422 -0.298 -1.620 1.00 0.00 H new ATOM 0 HG22 VAL A 61 19.146 -0.710 -0.048 1.00 0.00 H new ATOM 0 HG23 VAL A 61 17.484 -0.080 -0.124 1.00 0.00 H new ATOM 1002 N PHE A 62 18.240 0.172 2.560 1.00 0.00 N ATOM 1003 CA PHE A 62 18.340 -0.977 3.403 1.00 0.00 C ATOM 1004 C PHE A 62 16.967 -1.625 3.510 1.00 0.00 C ATOM 1005 O PHE A 62 15.986 -0.878 3.684 1.00 0.00 O ATOM 1006 CB PHE A 62 18.738 -0.571 4.837 1.00 0.00 C ATOM 1007 CG PHE A 62 17.951 0.633 5.362 1.00 0.00 C ATOM 1008 CD1 PHE A 62 18.397 1.928 5.062 1.00 0.00 C ATOM 1009 CD2 PHE A 62 16.824 0.478 6.117 1.00 0.00 C ATOM 1010 CE1 PHE A 62 17.738 3.075 5.500 1.00 0.00 C ATOM 1011 CE2 PHE A 62 16.121 1.591 6.586 1.00 0.00 C ATOM 1012 CZ PHE A 62 16.589 2.871 6.270 1.00 0.00 C ATOM 0 H PHE A 62 17.327 0.626 2.539 1.00 0.00 H new ATOM 0 HA PHE A 62 19.086 -1.647 2.975 1.00 0.00 H new ATOM 0 HB2 PHE A 62 18.582 -1.418 5.504 1.00 0.00 H new ATOM 0 HB3 PHE A 62 19.803 -0.339 4.860 1.00 0.00 H new ATOM 0 HD1 PHE A 62 19.290 2.041 4.465 1.00 0.00 H new ATOM 0 HD2 PHE A 62 16.472 -0.515 6.354 1.00 0.00 H new ATOM 0 HE1 PHE A 62 18.095 4.065 5.258 1.00 0.00 H new ATOM 0 HE2 PHE A 62 15.230 1.465 7.183 1.00 0.00 H new ATOM 0 HZ PHE A 62 16.045 3.730 6.633 1.00 0.00 H new ATOM 1022 N GLU A 63 16.917 -2.931 3.412 1.00 0.00 N ATOM 1023 CA GLU A 63 15.720 -3.750 3.489 1.00 0.00 C ATOM 1024 C GLU A 63 15.270 -3.745 4.948 1.00 0.00 C ATOM 1025 O GLU A 63 15.180 -4.807 5.575 1.00 0.00 O ATOM 1026 CB GLU A 63 15.873 -5.186 2.932 1.00 0.00 C ATOM 1027 CG GLU A 63 14.603 -5.505 2.081 1.00 0.00 C ATOM 1028 CD GLU A 63 14.312 -6.965 1.848 1.00 0.00 C ATOM 1029 OE1 GLU A 63 15.376 -7.661 1.565 1.00 0.00 O ATOM 1030 OE2 GLU A 63 13.178 -7.393 1.929 1.00 0.00 O ATOM 0 H GLU A 63 17.758 -3.489 3.268 1.00 0.00 H new ATOM 0 HA GLU A 63 14.963 -3.316 2.835 1.00 0.00 H new ATOM 0 HB2 GLU A 63 16.772 -5.265 2.321 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.977 -5.903 3.747 1.00 0.00 H new ATOM 0 HG2 GLU A 63 13.739 -5.057 2.572 1.00 0.00 H new ATOM 0 HG3 GLU A 63 14.708 -5.017 1.112 1.00 0.00 H new ATOM 1037 N LEU A 64 14.986 -2.529 5.479 1.00 0.00 N ATOM 1038 CA LEU A 64 14.549 -2.335 6.825 1.00 0.00 C ATOM 1039 C LEU A 64 15.337 -3.160 7.863 1.00 0.00 C ATOM 1040 O LEU A 64 14.942 -4.300 8.173 1.00 0.00 O ATOM 1041 CB LEU A 64 13.098 -2.832 6.997 1.00 0.00 C ATOM 1042 CG LEU A 64 11.955 -1.886 6.638 1.00 0.00 C ATOM 1043 CD1 LEU A 64 10.744 -2.630 6.062 1.00 0.00 C ATOM 1044 CD2 LEU A 64 11.450 -1.244 7.949 1.00 0.00 C ATOM 0 H LEU A 64 15.066 -1.661 4.949 1.00 0.00 H new ATOM 0 HA LEU A 64 14.682 -1.267 6.995 1.00 0.00 H new ATOM 0 HB2 LEU A 64 12.983 -3.733 6.395 1.00 0.00 H new ATOM 0 HB3 LEU A 64 12.970 -3.126 8.039 1.00 0.00 H new ATOM 0 HG LEU A 64 12.335 -1.174 5.906 1.00 0.00 H new ATOM 0 HD11 LEU A 64 9.958 -1.914 5.822 1.00 0.00 H new ATOM 0 HD12 LEU A 64 11.040 -3.161 5.157 1.00 0.00 H new ATOM 0 HD13 LEU A 64 10.373 -3.344 6.797 1.00 0.00 H new ATOM 0 HD21 LEU A 64 10.631 -0.560 7.727 1.00 0.00 H new ATOM 0 HD22 LEU A 64 11.099 -2.024 8.625 1.00 0.00 H new ATOM 0 HD23 LEU A 64 12.264 -0.694 8.422 1.00 0.00 H new ATOM 1056 N GLY A 65 16.396 -2.592 8.389 1.00 0.00 N ATOM 1057 CA GLY A 65 17.163 -3.318 9.419 1.00 0.00 C ATOM 1058 C GLY A 65 18.106 -4.356 8.865 1.00 0.00 C ATOM 1059 O GLY A 65 17.755 -5.545 8.946 1.00 0.00 O ATOM 0 H GLY A 65 16.750 -1.667 8.146 1.00 0.00 H new ATOM 0 HA2 GLY A 65 17.735 -2.599 10.005 1.00 0.00 H new ATOM 0 HA3 GLY A 65 16.466 -3.803 10.102 1.00 0.00 H new ATOM 1063 N VAL A 66 19.240 -3.931 8.335 1.00 0.00 N ATOM 1064 CA VAL A 66 20.169 -4.904 7.795 1.00 0.00 C ATOM 1065 C VAL A 66 21.550 -4.803 8.452 1.00 0.00 C ATOM 1066 O VAL A 66 22.525 -4.737 7.727 1.00 0.00 O ATOM 1067 CB VAL A 66 20.269 -4.688 6.290 1.00 0.00 C ATOM 1068 CG1 VAL A 66 18.911 -4.917 5.643 1.00 0.00 C ATOM 1069 CG2 VAL A 66 20.763 -3.280 6.025 1.00 0.00 C ATOM 0 H VAL A 66 19.532 -2.956 8.268 1.00 0.00 H new ATOM 0 HA VAL A 66 19.797 -5.906 8.008 1.00 0.00 H new ATOM 0 HB VAL A 66 20.974 -5.398 5.858 1.00 0.00 H new ATOM 0 HG11 VAL A 66 18.990 -4.761 4.567 1.00 0.00 H new ATOM 0 HG12 VAL A 66 18.582 -5.938 5.839 1.00 0.00 H new ATOM 0 HG13 VAL A 66 18.187 -4.217 6.059 1.00 0.00 H new ATOM 0 HG21 VAL A 66 20.838 -3.117 4.950 1.00 0.00 H new ATOM 0 HG22 VAL A 66 20.063 -2.562 6.453 1.00 0.00 H new ATOM 0 HG23 VAL A 66 21.744 -3.147 6.481 1.00 0.00 H new ATOM 1079 N ASP A 67 21.552 -4.801 9.761 1.00 0.00 N ATOM 1080 CA ASP A 67 22.753 -4.713 10.550 1.00 0.00 C ATOM 1081 C ASP A 67 23.815 -3.808 10.013 1.00 0.00 C ATOM 1082 O ASP A 67 24.696 -4.187 9.207 1.00 0.00 O ATOM 1083 CB ASP A 67 23.181 -6.126 11.021 1.00 0.00 C ATOM 1084 CG ASP A 67 22.191 -7.212 10.754 1.00 0.00 C ATOM 1085 OD1 ASP A 67 22.047 -7.749 9.683 1.00 0.00 O ATOM 1086 OD2 ASP A 67 21.502 -7.498 11.827 1.00 0.00 O ATOM 0 H ASP A 67 20.700 -4.862 10.319 1.00 0.00 H new ATOM 0 HA ASP A 67 22.523 -4.159 11.460 1.00 0.00 H new ATOM 0 HB2 ASP A 67 24.121 -6.385 10.533 1.00 0.00 H new ATOM 0 HB3 ASP A 67 23.377 -6.090 12.093 1.00 0.00 H new ATOM 1091 N PHE A 68 23.802 -2.544 10.426 1.00 0.00 N ATOM 1092 CA PHE A 68 24.800 -1.605 9.941 1.00 0.00 C ATOM 1093 C PHE A 68 26.127 -1.697 10.641 1.00 0.00 C ATOM 1094 O PHE A 68 27.140 -2.003 10.004 1.00 0.00 O ATOM 1095 CB PHE A 68 24.296 -0.116 9.949 1.00 0.00 C ATOM 1096 CG PHE A 68 23.456 0.305 8.799 1.00 0.00 C ATOM 1097 CD1 PHE A 68 22.110 -0.054 8.719 1.00 0.00 C ATOM 1098 CD2 PHE A 68 23.962 1.079 7.741 1.00 0.00 C ATOM 1099 CE1 PHE A 68 21.307 0.341 7.624 1.00 0.00 C ATOM 1100 CE2 PHE A 68 23.179 1.469 6.669 1.00 0.00 C ATOM 1101 CZ PHE A 68 21.858 1.108 6.598 1.00 0.00 C ATOM 0 H PHE A 68 23.125 -2.155 11.082 1.00 0.00 H new ATOM 0 HA PHE A 68 24.960 -1.913 8.908 1.00 0.00 H new ATOM 0 HB2 PHE A 68 23.727 0.047 10.865 1.00 0.00 H new ATOM 0 HB3 PHE A 68 25.166 0.539 9.994 1.00 0.00 H new ATOM 0 HD1 PHE A 68 21.672 -0.646 9.510 1.00 0.00 H new ATOM 0 HD2 PHE A 68 24.999 1.380 7.765 1.00 0.00 H new ATOM 0 HE1 PHE A 68 20.268 0.049 7.582 1.00 0.00 H new ATOM 0 HE2 PHE A 68 23.613 2.064 5.879 1.00 0.00 H new ATOM 0 HZ PHE A 68 21.252 1.414 5.758 1.00 0.00 H new ATOM 1111 N ALA A 69 26.137 -1.437 11.927 1.00 0.00 N ATOM 1112 CA ALA A 69 27.378 -1.489 12.700 1.00 0.00 C ATOM 1113 C ALA A 69 28.357 -0.512 12.030 1.00 0.00 C ATOM 1114 O ALA A 69 29.558 -0.707 12.013 1.00 0.00 O ATOM 1115 CB ALA A 69 27.954 -2.870 12.755 1.00 0.00 C ATOM 0 H ALA A 69 25.309 -1.187 12.468 1.00 0.00 H new ATOM 0 HA ALA A 69 27.184 -1.209 13.735 1.00 0.00 H new ATOM 0 HB1 ALA A 69 28.874 -2.857 13.339 1.00 0.00 H new ATOM 0 HB2 ALA A 69 27.237 -3.545 13.222 1.00 0.00 H new ATOM 0 HB3 ALA A 69 28.171 -3.214 11.744 1.00 0.00 H new ATOM 1121 N TYR A 70 27.723 0.526 11.502 1.00 0.00 N ATOM 1122 CA TYR A 70 28.374 1.618 10.815 1.00 0.00 C ATOM 1123 C TYR A 70 28.082 2.842 11.670 1.00 0.00 C ATOM 1124 O TYR A 70 26.933 3.194 11.696 1.00 0.00 O ATOM 1125 CB TYR A 70 27.772 1.833 9.418 1.00 0.00 C ATOM 1126 CG TYR A 70 27.632 3.297 8.995 1.00 0.00 C ATOM 1127 CD1 TYR A 70 28.713 4.163 8.898 1.00 0.00 C ATOM 1128 CD2 TYR A 70 26.369 3.810 8.689 1.00 0.00 C ATOM 1129 CE1 TYR A 70 28.563 5.508 8.508 1.00 0.00 C ATOM 1130 CE2 TYR A 70 26.162 5.148 8.294 1.00 0.00 C ATOM 1131 CZ TYR A 70 27.275 5.995 8.206 1.00 0.00 C ATOM 1132 OH TYR A 70 27.097 7.307 7.819 1.00 0.00 O ATOM 0 H TYR A 70 26.709 0.628 11.545 1.00 0.00 H new ATOM 0 HA TYR A 70 29.438 1.424 10.683 1.00 0.00 H new ATOM 0 HB2 TYR A 70 28.394 1.317 8.687 1.00 0.00 H new ATOM 0 HB3 TYR A 70 26.788 1.365 9.386 1.00 0.00 H new ATOM 0 HD1 TYR A 70 29.701 3.793 9.129 1.00 0.00 H new ATOM 0 HD2 TYR A 70 25.514 3.154 8.758 1.00 0.00 H new ATOM 0 HE1 TYR A 70 29.423 6.158 8.441 1.00 0.00 H new ATOM 0 HE2 TYR A 70 25.171 5.511 8.065 1.00 0.00 H new ATOM 0 HH TYR A 70 26.146 7.472 7.649 1.00 0.00 H new ATOM 1142 N SER A 71 29.141 3.354 12.285 1.00 0.00 N ATOM 1143 CA SER A 71 29.005 4.495 13.129 1.00 0.00 C ATOM 1144 C SER A 71 28.081 5.563 12.611 1.00 0.00 C ATOM 1145 O SER A 71 27.931 5.739 11.407 1.00 0.00 O ATOM 1146 CB SER A 71 30.334 5.195 13.413 1.00 0.00 C ATOM 1147 OG SER A 71 30.582 6.353 12.667 1.00 0.00 O ATOM 0 H SER A 71 30.090 2.988 12.205 1.00 0.00 H new ATOM 0 HA SER A 71 28.583 4.053 14.032 1.00 0.00 H new ATOM 0 HB2 SER A 71 30.369 5.453 14.472 1.00 0.00 H new ATOM 0 HB3 SER A 71 31.143 4.487 13.230 1.00 0.00 H new ATOM 0 HG SER A 71 31.452 6.726 12.921 1.00 0.00 H new ATOM 1153 N LEU A 72 27.494 6.236 13.563 1.00 0.00 N ATOM 1154 CA LEU A 72 26.552 7.317 13.340 1.00 0.00 C ATOM 1155 C LEU A 72 27.429 8.558 13.247 1.00 0.00 C ATOM 1156 O LEU A 72 27.867 9.110 14.286 1.00 0.00 O ATOM 1157 CB LEU A 72 25.653 7.376 14.565 1.00 0.00 C ATOM 1158 CG LEU A 72 24.569 8.465 14.533 1.00 0.00 C ATOM 1159 CD1 LEU A 72 25.134 9.865 14.385 1.00 0.00 C ATOM 1160 CD2 LEU A 72 23.551 8.170 13.440 1.00 0.00 C ATOM 0 H LEU A 72 27.659 6.046 14.551 1.00 0.00 H new ATOM 0 HA LEU A 72 25.926 7.209 12.454 1.00 0.00 H new ATOM 0 HB2 LEU A 72 25.168 6.407 14.686 1.00 0.00 H new ATOM 0 HB3 LEU A 72 26.276 7.533 15.445 1.00 0.00 H new ATOM 0 HG LEU A 72 24.070 8.440 15.502 1.00 0.00 H new ATOM 0 HD11 LEU A 72 24.318 10.587 14.369 1.00 0.00 H new ATOM 0 HD12 LEU A 72 25.794 10.082 15.225 1.00 0.00 H new ATOM 0 HD13 LEU A 72 25.697 9.934 13.454 1.00 0.00 H new ATOM 0 HD21 LEU A 72 22.790 8.951 13.431 1.00 0.00 H new ATOM 0 HD22 LEU A 72 24.053 8.141 12.473 1.00 0.00 H new ATOM 0 HD23 LEU A 72 23.079 7.206 13.632 1.00 0.00 H new ATOM 1172 N ALA A 73 27.652 8.948 11.995 1.00 0.00 N ATOM 1173 CA ALA A 73 28.449 10.097 11.568 1.00 0.00 C ATOM 1174 C ALA A 73 29.559 10.469 12.518 1.00 0.00 C ATOM 1175 O ALA A 73 29.589 11.592 13.033 1.00 0.00 O ATOM 1176 CB ALA A 73 27.513 11.253 11.196 1.00 0.00 C ATOM 0 H ALA A 73 27.258 8.440 11.203 1.00 0.00 H new ATOM 0 HA ALA A 73 29.002 9.814 10.672 1.00 0.00 H new ATOM 0 HB1 ALA A 73 28.104 12.112 10.877 1.00 0.00 H new ATOM 0 HB2 ALA A 73 26.856 10.942 10.383 1.00 0.00 H new ATOM 0 HB3 ALA A 73 26.912 11.528 12.063 1.00 0.00 H new ATOM 1182 N ASP A 74 30.458 9.496 12.730 1.00 0.00 N ATOM 1183 CA ASP A 74 31.612 9.599 13.595 1.00 0.00 C ATOM 1184 C ASP A 74 31.305 9.109 15.008 1.00 0.00 C ATOM 1185 O ASP A 74 31.999 9.492 15.946 1.00 0.00 O ATOM 1186 CB ASP A 74 32.268 10.930 13.742 1.00 0.00 C ATOM 1187 CG ASP A 74 33.790 10.747 13.842 1.00 0.00 C ATOM 1188 OD1 ASP A 74 34.545 10.742 12.794 1.00 0.00 O ATOM 1189 OD2 ASP A 74 34.372 10.591 14.989 1.00 0.00 O ATOM 0 H ASP A 74 30.385 8.584 12.279 1.00 0.00 H new ATOM 0 HA ASP A 74 32.318 8.967 13.057 1.00 0.00 H new ATOM 0 HB2 ASP A 74 32.023 11.563 12.889 1.00 0.00 H new ATOM 0 HB3 ASP A 74 31.893 11.435 14.632 1.00 0.00 H new ATOM 1194 N GLY A 75 30.283 8.276 15.164 1.00 0.00 N ATOM 1195 CA GLY A 75 29.928 7.764 16.478 1.00 0.00 C ATOM 1196 C GLY A 75 30.338 6.314 16.822 1.00 0.00 C ATOM 1197 O GLY A 75 29.620 5.590 17.491 1.00 0.00 O ATOM 0 H GLY A 75 29.691 7.944 14.403 1.00 0.00 H new ATOM 0 HA2 GLY A 75 30.370 8.423 17.225 1.00 0.00 H new ATOM 0 HA3 GLY A 75 28.846 7.841 16.586 1.00 0.00 H new ATOM 1201 N THR A 76 31.479 5.887 16.378 1.00 0.00 N ATOM 1202 CA THR A 76 31.973 4.554 16.632 1.00 0.00 C ATOM 1203 C THR A 76 31.172 3.449 15.954 1.00 0.00 C ATOM 1204 O THR A 76 31.805 2.671 15.237 1.00 0.00 O ATOM 1205 CB THR A 76 32.075 4.353 18.159 1.00 0.00 C ATOM 1206 OG1 THR A 76 33.336 3.750 18.357 1.00 0.00 O ATOM 1207 CG2 THR A 76 31.095 3.400 18.786 1.00 0.00 C ATOM 0 H THR A 76 32.111 6.459 15.818 1.00 0.00 H new ATOM 0 HA THR A 76 32.960 4.471 16.178 1.00 0.00 H new ATOM 0 HB THR A 76 31.891 5.327 18.611 1.00 0.00 H new ATOM 0 HG1 THR A 76 33.476 3.591 19.314 1.00 0.00 H new ATOM 0 HG21 THR A 76 31.273 3.349 19.860 1.00 0.00 H new ATOM 0 HG22 THR A 76 30.079 3.750 18.603 1.00 0.00 H new ATOM 0 HG23 THR A 76 31.221 2.409 18.350 1.00 0.00 H new ATOM 1215 N GLU A 77 29.865 3.367 16.155 1.00 0.00 N ATOM 1216 CA GLU A 77 29.132 2.264 15.481 1.00 0.00 C ATOM 1217 C GLU A 77 27.622 2.378 15.564 1.00 0.00 C ATOM 1218 O GLU A 77 27.017 3.327 16.018 1.00 0.00 O ATOM 1219 CB GLU A 77 29.410 0.971 16.294 1.00 0.00 C ATOM 1220 CG GLU A 77 30.471 -0.006 15.788 1.00 0.00 C ATOM 1221 CD GLU A 77 31.813 0.170 16.462 1.00 0.00 C ATOM 1222 OE1 GLU A 77 31.802 0.474 17.721 1.00 0.00 O ATOM 1223 OE2 GLU A 77 32.826 0.031 15.841 1.00 0.00 O ATOM 0 H GLU A 77 29.306 3.994 16.734 1.00 0.00 H new ATOM 0 HA GLU A 77 29.458 2.280 14.441 1.00 0.00 H new ATOM 0 HB2 GLU A 77 29.693 1.271 17.303 1.00 0.00 H new ATOM 0 HB3 GLU A 77 28.471 0.424 16.375 1.00 0.00 H new ATOM 0 HG2 GLU A 77 30.122 -1.026 15.948 1.00 0.00 H new ATOM 0 HG3 GLU A 77 30.592 0.124 14.713 1.00 0.00 H new ATOM 1230 N LEU A 78 26.903 1.335 15.109 1.00 0.00 N ATOM 1231 CA LEU A 78 25.441 1.302 15.158 1.00 0.00 C ATOM 1232 C LEU A 78 25.020 0.018 14.423 1.00 0.00 C ATOM 1233 O LEU A 78 24.480 -0.046 13.317 1.00 0.00 O ATOM 1234 CB LEU A 78 24.905 2.514 14.366 1.00 0.00 C ATOM 1235 CG LEU A 78 23.948 3.498 15.069 1.00 0.00 C ATOM 1236 CD1 LEU A 78 23.094 4.226 14.017 1.00 0.00 C ATOM 1237 CD2 LEU A 78 22.946 2.728 15.892 1.00 0.00 C ATOM 0 H LEU A 78 27.322 0.499 14.701 1.00 0.00 H new ATOM 0 HA LEU A 78 25.063 1.329 16.180 1.00 0.00 H new ATOM 0 HB2 LEU A 78 25.765 3.084 14.014 1.00 0.00 H new ATOM 0 HB3 LEU A 78 24.394 2.131 13.483 1.00 0.00 H new ATOM 0 HG LEU A 78 24.552 4.179 15.668 1.00 0.00 H new ATOM 0 HD11 LEU A 78 22.418 4.921 14.515 1.00 0.00 H new ATOM 0 HD12 LEU A 78 23.745 4.776 13.338 1.00 0.00 H new ATOM 0 HD13 LEU A 78 22.513 3.497 13.452 1.00 0.00 H new ATOM 0 HD21 LEU A 78 22.270 3.425 16.388 1.00 0.00 H new ATOM 0 HD22 LEU A 78 22.372 2.067 15.242 1.00 0.00 H new ATOM 0 HD23 LEU A 78 23.470 2.135 16.641 1.00 0.00 H new ATOM 1249 N THR A 79 25.305 -1.058 15.113 1.00 0.00 N ATOM 1250 CA THR A 79 25.019 -2.421 14.658 1.00 0.00 C ATOM 1251 C THR A 79 23.496 -2.478 14.416 1.00 0.00 C ATOM 1252 O THR A 79 23.045 -3.285 13.610 1.00 0.00 O ATOM 1253 CB THR A 79 25.424 -3.564 15.613 1.00 0.00 C ATOM 1254 OG1 THR A 79 25.291 -4.779 14.957 1.00 0.00 O ATOM 1255 CG2 THR A 79 24.644 -3.479 16.936 1.00 0.00 C ATOM 0 H THR A 79 25.753 -1.024 16.029 1.00 0.00 H new ATOM 0 HA THR A 79 25.627 -2.597 13.771 1.00 0.00 H new ATOM 0 HB THR A 79 26.473 -3.467 15.894 1.00 0.00 H new ATOM 0 HG1 THR A 79 25.549 -5.507 15.561 1.00 0.00 H new ATOM 0 HG21 THR A 79 24.948 -4.296 17.591 1.00 0.00 H new ATOM 0 HG22 THR A 79 24.855 -2.526 17.422 1.00 0.00 H new ATOM 0 HG23 THR A 79 23.576 -3.555 16.734 1.00 0.00 H new ATOM 1263 N GLY A 80 22.831 -1.612 15.137 1.00 0.00 N ATOM 1264 CA GLY A 80 21.410 -1.463 15.094 1.00 0.00 C ATOM 1265 C GLY A 80 21.006 -1.456 13.607 1.00 0.00 C ATOM 1266 O GLY A 80 21.745 -1.102 12.700 1.00 0.00 O ATOM 0 H GLY A 80 23.285 -0.973 15.790 1.00 0.00 H new ATOM 0 HA2 GLY A 80 20.920 -2.280 15.624 1.00 0.00 H new ATOM 0 HA3 GLY A 80 21.104 -0.538 15.582 1.00 0.00 H new ATOM 1270 N THR A 81 19.778 -1.871 13.452 1.00 0.00 N ATOM 1271 CA THR A 81 19.109 -1.967 12.146 1.00 0.00 C ATOM 1272 C THR A 81 17.844 -1.153 12.121 1.00 0.00 C ATOM 1273 O THR A 81 16.775 -1.497 12.629 1.00 0.00 O ATOM 1274 CB THR A 81 18.716 -3.443 11.955 1.00 0.00 C ATOM 1275 OG1 THR A 81 17.360 -3.748 12.168 1.00 0.00 O ATOM 1276 CG2 THR A 81 19.540 -4.356 12.882 1.00 0.00 C ATOM 0 H THR A 81 19.189 -2.161 14.232 1.00 0.00 H new ATOM 0 HA THR A 81 19.777 -1.600 11.367 1.00 0.00 H new ATOM 0 HB THR A 81 18.925 -3.622 10.900 1.00 0.00 H new ATOM 0 HG1 THR A 81 16.981 -3.118 12.815 1.00 0.00 H new ATOM 0 HG21 THR A 81 19.244 -5.394 12.728 1.00 0.00 H new ATOM 0 HG22 THR A 81 20.600 -4.244 12.655 1.00 0.00 H new ATOM 0 HG23 THR A 81 19.360 -4.078 13.920 1.00 0.00 H new ATOM 1284 N TRP A 82 18.005 0.016 11.523 1.00 0.00 N ATOM 1285 CA TRP A 82 16.869 0.891 11.484 1.00 0.00 C ATOM 1286 C TRP A 82 15.784 0.178 10.630 1.00 0.00 C ATOM 1287 O TRP A 82 16.113 -0.498 9.654 1.00 0.00 O ATOM 1288 CB TRP A 82 16.962 2.287 10.931 1.00 0.00 C ATOM 1289 CG TRP A 82 17.759 2.636 9.743 1.00 0.00 C ATOM 1290 CD1 TRP A 82 18.545 1.903 8.944 1.00 0.00 C ATOM 1291 CD2 TRP A 82 17.792 3.981 9.247 1.00 0.00 C ATOM 1292 NE1 TRP A 82 19.048 2.757 7.990 1.00 0.00 N ATOM 1293 CE2 TRP A 82 18.626 4.046 8.120 1.00 0.00 C ATOM 1294 CE3 TRP A 82 17.190 5.196 9.640 1.00 0.00 C ATOM 1295 CZ2 TRP A 82 18.831 5.235 7.455 1.00 0.00 C ATOM 1296 CZ3 TRP A 82 17.391 6.370 8.977 1.00 0.00 C ATOM 1297 CH2 TRP A 82 18.220 6.395 7.875 1.00 0.00 C ATOM 0 H TRP A 82 18.860 0.358 11.085 1.00 0.00 H new ATOM 0 HA TRP A 82 16.684 1.059 12.545 1.00 0.00 H new ATOM 0 HB2 TRP A 82 15.940 2.603 10.720 1.00 0.00 H new ATOM 0 HB3 TRP A 82 17.328 2.916 11.743 1.00 0.00 H new ATOM 0 HD1 TRP A 82 18.745 0.845 9.032 1.00 0.00 H new ATOM 0 HE1 TRP A 82 19.681 2.452 7.251 1.00 0.00 H new ATOM 0 HE3 TRP A 82 16.542 5.195 10.504 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 19.480 5.257 6.592 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 16.905 7.274 9.312 1.00 0.00 H new ATOM 0 HH2 TRP A 82 18.389 7.320 7.344 1.00 0.00 H new ATOM 1308 N THR A 83 14.559 0.393 11.101 1.00 0.00 N ATOM 1309 CA THR A 83 13.452 -0.253 10.501 1.00 0.00 C ATOM 1310 C THR A 83 12.138 0.425 10.652 1.00 0.00 C ATOM 1311 O THR A 83 11.539 0.201 11.703 1.00 0.00 O ATOM 1312 CB THR A 83 13.099 -1.701 11.001 1.00 0.00 C ATOM 1313 OG1 THR A 83 13.234 -1.613 12.385 1.00 0.00 O ATOM 1314 CG2 THR A 83 14.022 -2.791 10.519 1.00 0.00 C ATOM 0 H THR A 83 14.334 1.005 11.886 1.00 0.00 H new ATOM 0 HA THR A 83 13.845 -0.243 9.484 1.00 0.00 H new ATOM 0 HB THR A 83 12.113 -1.977 10.626 1.00 0.00 H new ATOM 0 HG1 THR A 83 12.696 -0.865 12.719 1.00 0.00 H new ATOM 0 HG21 THR A 83 13.693 -3.750 10.919 1.00 0.00 H new ATOM 0 HG22 THR A 83 14.005 -2.827 9.430 1.00 0.00 H new ATOM 0 HG23 THR A 83 15.037 -2.585 10.859 1.00 0.00 H new ATOM 1322 N MET A 84 11.606 1.200 9.697 1.00 0.00 N ATOM 1323 CA MET A 84 10.338 1.641 9.960 1.00 0.00 C ATOM 1324 C MET A 84 9.249 1.998 9.073 1.00 0.00 C ATOM 1325 O MET A 84 9.421 2.145 7.884 1.00 0.00 O ATOM 1326 CB MET A 84 10.190 2.385 11.327 1.00 0.00 C ATOM 1327 CG MET A 84 9.376 1.553 12.345 1.00 0.00 C ATOM 1328 SD MET A 84 8.165 2.379 13.351 1.00 0.00 S ATOM 1329 CE MET A 84 7.390 1.018 14.224 1.00 0.00 C ATOM 0 H MET A 84 12.036 1.488 8.818 1.00 0.00 H new ATOM 0 HA MET A 84 10.125 0.588 9.775 1.00 0.00 H new ATOM 0 HB2 MET A 84 11.178 2.595 11.736 1.00 0.00 H new ATOM 0 HB3 MET A 84 9.700 3.346 11.167 1.00 0.00 H new ATOM 0 HG2 MET A 84 8.864 0.764 11.793 1.00 0.00 H new ATOM 0 HG3 MET A 84 10.084 1.065 13.015 1.00 0.00 H new ATOM 0 HE1 MET A 84 6.313 1.182 14.271 1.00 0.00 H new ATOM 0 HE2 MET A 84 7.593 0.085 13.697 1.00 0.00 H new ATOM 0 HE3 MET A 84 7.792 0.958 15.235 1.00 0.00 H new ATOM 1339 N GLU A 85 8.080 2.048 9.721 1.00 0.00 N ATOM 1340 CA GLU A 85 6.764 2.254 9.196 1.00 0.00 C ATOM 1341 C GLU A 85 6.639 2.973 7.956 1.00 0.00 C ATOM 1342 O GLU A 85 7.464 3.656 7.364 1.00 0.00 O ATOM 1343 CB GLU A 85 5.895 2.803 10.367 1.00 0.00 C ATOM 1344 CG GLU A 85 5.477 1.635 11.269 1.00 0.00 C ATOM 1345 CD GLU A 85 4.104 1.625 11.890 1.00 0.00 C ATOM 1346 OE1 GLU A 85 3.184 2.042 11.049 1.00 0.00 O ATOM 1347 OE2 GLU A 85 3.889 1.276 13.029 1.00 0.00 O ATOM 0 H GLU A 85 8.052 1.930 10.734 1.00 0.00 H new ATOM 0 HA GLU A 85 6.391 1.291 8.847 1.00 0.00 H new ATOM 0 HB2 GLU A 85 6.458 3.539 10.941 1.00 0.00 H new ATOM 0 HB3 GLU A 85 5.013 3.311 9.976 1.00 0.00 H new ATOM 0 HG2 GLU A 85 5.577 0.720 10.684 1.00 0.00 H new ATOM 0 HG3 GLU A 85 6.202 1.575 12.081 1.00 0.00 H new ATOM 1354 N GLY A 86 5.400 2.881 7.456 1.00 0.00 N ATOM 1355 CA GLY A 86 4.998 3.595 6.268 1.00 0.00 C ATOM 1356 C GLY A 86 4.738 4.946 6.920 1.00 0.00 C ATOM 1357 O GLY A 86 4.995 5.970 6.337 1.00 0.00 O ATOM 0 H GLY A 86 4.663 2.310 7.870 1.00 0.00 H new ATOM 0 HA2 GLY A 86 5.778 3.631 5.508 1.00 0.00 H new ATOM 0 HA3 GLY A 86 4.112 3.172 5.795 1.00 0.00 H new ATOM 1361 N ASN A 87 4.230 4.821 8.149 1.00 0.00 N ATOM 1362 CA ASN A 87 3.935 5.956 8.955 1.00 0.00 C ATOM 1363 C ASN A 87 5.008 6.282 10.004 1.00 0.00 C ATOM 1364 O ASN A 87 4.737 7.115 10.845 1.00 0.00 O ATOM 1365 CB ASN A 87 2.483 6.242 9.320 1.00 0.00 C ATOM 1366 CG ASN A 87 2.139 5.569 10.629 1.00 0.00 C ATOM 1367 OD1 ASN A 87 2.419 6.070 11.740 1.00 0.00 O ATOM 1368 ND2 ASN A 87 1.514 4.416 10.509 1.00 0.00 N ATOM 0 H ASN A 87 4.021 3.925 8.590 1.00 0.00 H new ATOM 0 HA ASN A 87 4.030 6.765 8.231 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.325 7.317 9.401 1.00 0.00 H new ATOM 0 HB3 ASN A 87 1.823 5.881 8.531 1.00 0.00 H new ATOM 0 HD21 ASN A 87 1.239 3.896 11.342 1.00 0.00 H new ATOM 0 HD22 ASN A 87 1.305 4.043 9.583 1.00 0.00 H new ATOM 1375 N LYS A 88 6.142 5.633 9.907 1.00 0.00 N ATOM 1376 CA LYS A 88 7.228 5.900 10.794 1.00 0.00 C ATOM 1377 C LYS A 88 8.515 5.133 10.426 1.00 0.00 C ATOM 1378 O LYS A 88 8.358 4.225 9.679 1.00 0.00 O ATOM 1379 CB LYS A 88 7.081 5.419 12.218 1.00 0.00 C ATOM 1380 CG LYS A 88 5.823 4.743 12.646 1.00 0.00 C ATOM 1381 CD LYS A 88 5.095 5.688 13.596 1.00 0.00 C ATOM 1382 CE LYS A 88 5.404 5.396 15.032 1.00 0.00 C ATOM 1383 NZ LYS A 88 6.512 6.228 15.524 1.00 0.00 N ATOM 0 H LYS A 88 6.330 4.910 9.212 1.00 0.00 H new ATOM 0 HA LYS A 88 7.254 6.986 10.704 1.00 0.00 H new ATOM 0 HB2 LYS A 88 7.903 4.731 12.415 1.00 0.00 H new ATOM 0 HB3 LYS A 88 7.224 6.282 12.869 1.00 0.00 H new ATOM 0 HG2 LYS A 88 5.199 4.512 11.783 1.00 0.00 H new ATOM 0 HG3 LYS A 88 6.045 3.798 13.141 1.00 0.00 H new ATOM 0 HD2 LYS A 88 5.375 6.716 13.368 1.00 0.00 H new ATOM 0 HD3 LYS A 88 4.020 5.607 13.434 1.00 0.00 H new ATOM 0 HE2 LYS A 88 4.517 5.573 15.640 1.00 0.00 H new ATOM 0 HE3 LYS A 88 5.661 4.343 15.143 1.00 0.00 H new ATOM 0 HZ1 LYS A 88 6.656 6.050 16.538 1.00 0.00 H new ATOM 0 HZ2 LYS A 88 7.381 5.991 15.004 1.00 0.00 H new ATOM 0 HZ3 LYS A 88 6.284 7.232 15.378 1.00 0.00 H new ATOM 1397 N LEU A 89 9.567 5.669 10.976 1.00 0.00 N ATOM 1398 CA LEU A 89 10.883 5.090 10.883 1.00 0.00 C ATOM 1399 C LEU A 89 11.228 4.712 12.334 1.00 0.00 C ATOM 1400 O LEU A 89 10.358 4.888 13.166 1.00 0.00 O ATOM 1401 CB LEU A 89 11.922 6.180 10.491 1.00 0.00 C ATOM 1402 CG LEU A 89 12.765 5.787 9.296 1.00 0.00 C ATOM 1403 CD1 LEU A 89 12.471 6.774 8.156 1.00 0.00 C ATOM 1404 CD2 LEU A 89 14.262 5.806 9.577 1.00 0.00 C ATOM 0 H LEU A 89 9.537 6.536 11.512 1.00 0.00 H new ATOM 0 HA LEU A 89 10.903 4.273 10.162 1.00 0.00 H new ATOM 0 HB2 LEU A 89 11.399 7.111 10.270 1.00 0.00 H new ATOM 0 HB3 LEU A 89 12.575 6.375 11.342 1.00 0.00 H new ATOM 0 HG LEU A 89 12.502 4.762 9.036 1.00 0.00 H new ATOM 0 HD11 LEU A 89 13.068 6.510 7.283 1.00 0.00 H new ATOM 0 HD12 LEU A 89 11.413 6.728 7.899 1.00 0.00 H new ATOM 0 HD13 LEU A 89 12.723 7.785 8.476 1.00 0.00 H new ATOM 0 HD21 LEU A 89 14.805 5.514 8.678 1.00 0.00 H new ATOM 0 HD22 LEU A 89 14.564 6.811 9.873 1.00 0.00 H new ATOM 0 HD23 LEU A 89 14.490 5.107 10.381 1.00 0.00 H new ATOM 1416 N VAL A 90 12.428 4.205 12.525 1.00 0.00 N ATOM 1417 CA VAL A 90 13.067 3.799 13.734 1.00 0.00 C ATOM 1418 C VAL A 90 14.545 3.529 13.357 1.00 0.00 C ATOM 1419 O VAL A 90 14.889 2.452 12.889 1.00 0.00 O ATOM 1420 CB VAL A 90 12.500 2.555 14.388 1.00 0.00 C ATOM 1421 CG1 VAL A 90 12.764 2.592 15.892 1.00 0.00 C ATOM 1422 CG2 VAL A 90 10.980 2.497 14.399 1.00 0.00 C ATOM 0 H VAL A 90 13.045 4.054 11.727 1.00 0.00 H new ATOM 0 HA VAL A 90 12.920 4.591 14.469 1.00 0.00 H new ATOM 0 HB VAL A 90 12.956 1.742 13.823 1.00 0.00 H new ATOM 0 HG11 VAL A 90 12.354 1.695 16.356 1.00 0.00 H new ATOM 0 HG12 VAL A 90 13.838 2.635 16.072 1.00 0.00 H new ATOM 0 HG13 VAL A 90 12.289 3.473 16.323 1.00 0.00 H new ATOM 0 HG21 VAL A 90 10.655 1.577 14.884 1.00 0.00 H new ATOM 0 HG22 VAL A 90 10.587 3.354 14.946 1.00 0.00 H new ATOM 0 HG23 VAL A 90 10.608 2.519 13.375 1.00 0.00 H new ATOM 1432 N GLY A 91 15.345 4.553 13.586 1.00 0.00 N ATOM 1433 CA GLY A 91 16.755 4.623 13.361 1.00 0.00 C ATOM 1434 C GLY A 91 17.456 3.454 14.071 1.00 0.00 C ATOM 1435 O GLY A 91 18.568 3.061 13.745 1.00 0.00 O ATOM 0 H GLY A 91 14.982 5.427 13.967 1.00 0.00 H new ATOM 0 HA2 GLY A 91 16.964 4.588 12.292 1.00 0.00 H new ATOM 0 HA3 GLY A 91 17.145 5.571 13.731 1.00 0.00 H new ATOM 1439 N LYS A 92 16.726 2.944 15.013 1.00 0.00 N ATOM 1440 CA LYS A 92 17.092 1.806 15.822 1.00 0.00 C ATOM 1441 C LYS A 92 18.474 1.912 16.358 1.00 0.00 C ATOM 1442 O LYS A 92 18.920 3.048 16.469 1.00 0.00 O ATOM 1443 CB LYS A 92 16.806 0.455 15.174 1.00 0.00 C ATOM 1444 CG LYS A 92 15.275 0.336 15.172 1.00 0.00 C ATOM 1445 CD LYS A 92 14.848 -0.101 16.561 1.00 0.00 C ATOM 1446 CE LYS A 92 13.763 -1.151 16.526 1.00 0.00 C ATOM 1447 NZ LYS A 92 14.285 -2.411 15.990 1.00 0.00 N ATOM 0 H LYS A 92 15.811 3.324 15.257 1.00 0.00 H new ATOM 0 HA LYS A 92 16.421 1.842 16.680 1.00 0.00 H new ATOM 0 HB2 LYS A 92 17.207 0.409 14.162 1.00 0.00 H new ATOM 0 HB3 LYS A 92 17.265 -0.358 15.736 1.00 0.00 H new ATOM 0 HG2 LYS A 92 14.817 1.291 14.913 1.00 0.00 H new ATOM 0 HG3 LYS A 92 14.948 -0.388 14.425 1.00 0.00 H new ATOM 0 HD2 LYS A 92 15.712 -0.493 17.097 1.00 0.00 H new ATOM 0 HD3 LYS A 92 14.493 0.766 17.119 1.00 0.00 H new ATOM 0 HE2 LYS A 92 13.371 -1.311 17.530 1.00 0.00 H new ATOM 0 HE3 LYS A 92 12.933 -0.804 15.911 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 13.692 -3.200 16.318 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 14.273 -2.378 14.951 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 15.261 -2.551 16.320 1.00 0.00 H new ATOM 1461 N PHE A 93 19.115 0.789 16.714 1.00 0.00 N ATOM 1462 CA PHE A 93 20.409 0.893 17.339 1.00 0.00 C ATOM 1463 C PHE A 93 20.924 -0.406 17.980 1.00 0.00 C ATOM 1464 O PHE A 93 20.425 -1.478 17.659 1.00 0.00 O ATOM 1465 CB PHE A 93 20.063 1.670 18.656 1.00 0.00 C ATOM 1466 CG PHE A 93 18.726 1.269 19.194 1.00 0.00 C ATOM 1467 CD1 PHE A 93 18.600 -0.075 19.578 1.00 0.00 C ATOM 1468 CD2 PHE A 93 17.628 2.066 19.368 1.00 0.00 C ATOM 1469 CE1 PHE A 93 17.456 -0.641 20.110 1.00 0.00 C ATOM 1470 CE2 PHE A 93 16.473 1.517 19.913 1.00 0.00 C ATOM 1471 CZ PHE A 93 16.369 0.168 20.284 1.00 0.00 C ATOM 0 H PHE A 93 18.763 -0.159 16.580 1.00 0.00 H new ATOM 0 HA PHE A 93 21.114 1.272 16.599 1.00 0.00 H new ATOM 0 HB2 PHE A 93 20.831 1.478 19.406 1.00 0.00 H new ATOM 0 HB3 PHE A 93 20.071 2.742 18.460 1.00 0.00 H new ATOM 0 HD1 PHE A 93 19.460 -0.715 19.448 1.00 0.00 H new ATOM 0 HD2 PHE A 93 17.658 3.108 19.086 1.00 0.00 H new ATOM 0 HE1 PHE A 93 17.423 -1.687 20.379 1.00 0.00 H new ATOM 0 HE2 PHE A 93 15.616 2.159 20.057 1.00 0.00 H new ATOM 0 HZ PHE A 93 15.451 -0.222 20.698 1.00 0.00 H new ATOM 1481 N LYS A 94 21.826 -0.030 18.842 1.00 0.00 N ATOM 1482 CA LYS A 94 22.617 -0.740 19.839 1.00 0.00 C ATOM 1483 C LYS A 94 24.022 -0.569 19.363 1.00 0.00 C ATOM 1484 O LYS A 94 24.648 -1.565 19.091 1.00 0.00 O ATOM 1485 CB LYS A 94 22.274 -2.152 20.085 1.00 0.00 C ATOM 1486 CG LYS A 94 21.527 -1.924 21.397 1.00 0.00 C ATOM 1487 CD LYS A 94 20.814 -3.019 22.102 1.00 0.00 C ATOM 1488 CE LYS A 94 19.336 -3.120 21.761 1.00 0.00 C ATOM 1489 NZ LYS A 94 18.649 -4.061 22.654 1.00 0.00 N ATOM 0 H LYS A 94 22.072 0.959 18.872 1.00 0.00 H new ATOM 0 HA LYS A 94 22.422 -0.319 20.825 1.00 0.00 H new ATOM 0 HB2 LYS A 94 21.651 -2.587 19.304 1.00 0.00 H new ATOM 0 HB3 LYS A 94 23.147 -2.796 20.192 1.00 0.00 H new ATOM 0 HG2 LYS A 94 22.251 -1.516 22.103 1.00 0.00 H new ATOM 0 HG3 LYS A 94 20.791 -1.142 21.207 1.00 0.00 H new ATOM 0 HD2 LYS A 94 21.297 -3.966 21.861 1.00 0.00 H new ATOM 0 HD3 LYS A 94 20.918 -2.873 23.177 1.00 0.00 H new ATOM 0 HE2 LYS A 94 18.874 -2.136 21.840 1.00 0.00 H new ATOM 0 HE3 LYS A 94 19.220 -3.445 20.727 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 17.642 -4.110 22.398 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 19.077 -5.004 22.560 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 18.741 -3.736 23.638 1.00 0.00 H new ATOM 1503 N ARG A 95 24.359 0.689 19.313 1.00 0.00 N ATOM 1504 CA ARG A 95 25.639 1.186 18.912 1.00 0.00 C ATOM 1505 C ARG A 95 26.640 0.041 18.736 1.00 0.00 C ATOM 1506 O ARG A 95 26.772 -0.351 17.598 1.00 0.00 O ATOM 1507 CB ARG A 95 26.142 1.891 20.195 1.00 0.00 C ATOM 1508 CG ARG A 95 25.835 3.362 20.283 1.00 0.00 C ATOM 1509 CD ARG A 95 24.822 3.805 19.260 1.00 0.00 C ATOM 1510 NE ARG A 95 25.508 4.259 18.037 1.00 0.00 N ATOM 1511 CZ ARG A 95 26.453 5.219 17.971 1.00 0.00 C ATOM 1512 NH1 ARG A 95 26.891 5.883 19.060 1.00 0.00 N ATOM 1513 NH2 ARG A 95 27.029 5.593 16.833 1.00 0.00 N ATOM 0 H ARG A 95 23.710 1.434 19.566 1.00 0.00 H new ATOM 0 HA ARG A 95 25.562 1.774 17.998 1.00 0.00 H new ATOM 0 HB2 ARG A 95 25.703 1.393 21.059 1.00 0.00 H new ATOM 0 HB3 ARG A 95 27.222 1.757 20.264 1.00 0.00 H new ATOM 0 HG2 ARG A 95 25.462 3.592 21.281 1.00 0.00 H new ATOM 0 HG3 ARG A 95 26.755 3.930 20.147 1.00 0.00 H new ATOM 0 HD2 ARG A 95 24.147 2.982 19.024 1.00 0.00 H new ATOM 0 HD3 ARG A 95 24.212 4.612 19.666 1.00 0.00 H new ATOM 0 HE ARG A 95 25.244 3.806 17.162 1.00 0.00 H new ATOM 0 HH11 ARG A 95 26.505 5.666 19.979 1.00 0.00 H new ATOM 0 HH12 ARG A 95 27.608 6.602 18.965 1.00 0.00 H new ATOM 0 HH21 ARG A 95 26.761 5.148 15.955 1.00 0.00 H new ATOM 0 HH22 ARG A 95 27.739 6.325 16.837 1.00 0.00 H new ATOM 1527 N VAL A 96 27.233 -0.393 19.773 1.00 0.00 N ATOM 1528 CA VAL A 96 28.268 -1.407 19.813 1.00 0.00 C ATOM 1529 C VAL A 96 29.292 -0.915 20.869 1.00 0.00 C ATOM 1530 O VAL A 96 29.824 -1.736 21.593 1.00 0.00 O ATOM 1531 CB VAL A 96 29.009 -1.587 18.527 1.00 0.00 C ATOM 1532 CG1 VAL A 96 30.492 -1.893 18.854 1.00 0.00 C ATOM 1533 CG2 VAL A 96 28.375 -2.626 17.610 1.00 0.00 C ATOM 0 H VAL A 96 27.009 -0.037 20.702 1.00 0.00 H new ATOM 0 HA VAL A 96 27.796 -2.364 20.034 1.00 0.00 H new ATOM 0 HB VAL A 96 28.953 -0.661 17.954 1.00 0.00 H new ATOM 0 HG11 VAL A 96 31.049 -2.028 17.927 1.00 0.00 H new ATOM 0 HG12 VAL A 96 30.919 -1.063 19.417 1.00 0.00 H new ATOM 0 HG13 VAL A 96 30.553 -2.804 19.449 1.00 0.00 H new ATOM 0 HG21 VAL A 96 28.960 -2.709 16.694 1.00 0.00 H new ATOM 0 HG22 VAL A 96 28.353 -3.592 18.115 1.00 0.00 H new ATOM 0 HG23 VAL A 96 27.358 -2.322 17.364 1.00 0.00 H new ATOM 1543 N ASP A 97 29.467 0.407 20.887 1.00 0.00 N ATOM 1544 CA ASP A 97 30.418 0.899 21.954 1.00 0.00 C ATOM 1545 C ASP A 97 29.896 0.447 23.316 1.00 0.00 C ATOM 1546 O ASP A 97 30.577 0.284 24.351 1.00 0.00 O ATOM 1547 CB ASP A 97 30.677 2.395 21.958 1.00 0.00 C ATOM 1548 CG ASP A 97 30.581 3.072 23.329 1.00 0.00 C ATOM 1549 OD1 ASP A 97 31.351 2.899 24.252 1.00 0.00 O ATOM 1550 OD2 ASP A 97 29.581 3.881 23.449 1.00 0.00 O ATOM 0 H ASP A 97 29.039 1.101 20.274 1.00 0.00 H new ATOM 0 HA ASP A 97 31.388 0.458 21.725 1.00 0.00 H new ATOM 0 HB2 ASP A 97 31.672 2.576 21.551 1.00 0.00 H new ATOM 0 HB3 ASP A 97 29.965 2.872 21.285 1.00 0.00 H new ATOM 1555 N ASN A 98 28.580 0.223 23.287 1.00 0.00 N ATOM 1556 CA ASN A 98 27.776 -0.224 24.388 1.00 0.00 C ATOM 1557 C ASN A 98 26.382 -0.706 24.072 1.00 0.00 C ATOM 1558 O ASN A 98 25.909 -1.753 24.521 1.00 0.00 O ATOM 1559 CB ASN A 98 27.855 0.880 25.495 1.00 0.00 C ATOM 1560 CG ASN A 98 26.872 0.804 26.645 1.00 0.00 C ATOM 1561 OD1 ASN A 98 26.883 -0.114 27.522 1.00 0.00 O ATOM 1562 ND2 ASN A 98 25.983 1.783 26.671 1.00 0.00 N ATOM 0 H ASN A 98 28.032 0.362 22.438 1.00 0.00 H new ATOM 0 HA ASN A 98 28.197 -1.162 24.751 1.00 0.00 H new ATOM 0 HB2 ASN A 98 28.861 0.862 25.914 1.00 0.00 H new ATOM 0 HB3 ASN A 98 27.729 1.848 25.011 1.00 0.00 H new ATOM 0 HD21 ASN A 98 25.281 1.815 27.410 1.00 0.00 H new ATOM 0 HD22 ASN A 98 26.000 2.506 25.952 1.00 0.00 H new ATOM 1569 N GLY A 99 25.714 0.117 23.255 1.00 0.00 N ATOM 1570 CA GLY A 99 24.378 -0.170 22.841 1.00 0.00 C ATOM 1571 C GLY A 99 23.375 0.951 23.124 1.00 0.00 C ATOM 1572 O GLY A 99 22.433 0.715 23.896 1.00 0.00 O ATOM 0 H GLY A 99 26.097 0.984 22.878 1.00 0.00 H new ATOM 0 HA2 GLY A 99 24.379 -0.379 21.771 1.00 0.00 H new ATOM 0 HA3 GLY A 99 24.042 -1.077 23.343 1.00 0.00 H new ATOM 1576 N LYS A 100 23.600 2.109 22.503 1.00 0.00 N ATOM 1577 CA LYS A 100 22.662 3.200 22.726 1.00 0.00 C ATOM 1578 C LYS A 100 21.326 2.855 22.016 1.00 0.00 C ATOM 1579 O LYS A 100 21.266 1.743 21.563 1.00 0.00 O ATOM 1580 CB LYS A 100 23.121 4.511 22.156 1.00 0.00 C ATOM 1581 CG LYS A 100 23.423 5.516 23.264 1.00 0.00 C ATOM 1582 CD LYS A 100 24.716 4.978 23.890 1.00 0.00 C ATOM 1583 CE LYS A 100 25.473 5.819 24.866 1.00 0.00 C ATOM 1584 NZ LYS A 100 24.603 6.639 25.721 1.00 0.00 N ATOM 0 H LYS A 100 24.379 2.308 21.876 1.00 0.00 H new ATOM 0 HA LYS A 100 22.565 3.307 23.806 1.00 0.00 H new ATOM 0 HB2 LYS A 100 24.013 4.355 21.549 1.00 0.00 H new ATOM 0 HB3 LYS A 100 22.353 4.913 21.496 1.00 0.00 H new ATOM 0 HG2 LYS A 100 23.557 6.523 22.868 1.00 0.00 H new ATOM 0 HG3 LYS A 100 22.614 5.565 23.993 1.00 0.00 H new ATOM 0 HD2 LYS A 100 24.470 4.041 24.390 1.00 0.00 H new ATOM 0 HD3 LYS A 100 25.396 4.735 23.074 1.00 0.00 H new ATOM 0 HE2 LYS A 100 26.085 5.172 25.495 1.00 0.00 H new ATOM 0 HE3 LYS A 100 26.155 6.471 24.321 1.00 0.00 H new ATOM 0 HZ1 LYS A 100 25.161 7.039 26.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 100 24.191 7.411 25.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 100 23.840 6.048 26.109 1.00 0.00 H new ATOM 1598 N GLU A 101 20.472 3.840 21.974 1.00 0.00 N ATOM 1599 CA GLU A 101 19.223 3.588 21.239 1.00 0.00 C ATOM 1600 C GLU A 101 18.698 4.802 20.463 1.00 0.00 C ATOM 1601 O GLU A 101 17.608 5.236 20.695 1.00 0.00 O ATOM 1602 CB GLU A 101 18.202 2.807 22.047 1.00 0.00 C ATOM 1603 CG GLU A 101 18.636 1.339 22.311 1.00 0.00 C ATOM 1604 CD GLU A 101 19.331 1.107 23.642 1.00 0.00 C ATOM 1605 OE1 GLU A 101 19.455 2.031 24.458 1.00 0.00 O ATOM 1606 OE2 GLU A 101 19.749 -0.116 23.782 1.00 0.00 O ATOM 0 H GLU A 101 20.582 4.762 22.397 1.00 0.00 H new ATOM 0 HA GLU A 101 19.477 2.900 20.433 1.00 0.00 H new ATOM 0 HB2 GLU A 101 18.039 3.310 23.000 1.00 0.00 H new ATOM 0 HB3 GLU A 101 17.249 2.809 21.518 1.00 0.00 H new ATOM 0 HG2 GLU A 101 17.754 0.700 22.262 1.00 0.00 H new ATOM 0 HG3 GLU A 101 19.303 1.023 21.509 1.00 0.00 H new ATOM 1613 N LEU A 102 19.625 5.226 19.609 1.00 0.00 N ATOM 1614 CA LEU A 102 19.572 6.387 18.749 1.00 0.00 C ATOM 1615 C LEU A 102 18.112 6.392 18.284 1.00 0.00 C ATOM 1616 O LEU A 102 17.469 7.375 18.541 1.00 0.00 O ATOM 1617 CB LEU A 102 20.426 6.155 17.465 1.00 0.00 C ATOM 1618 CG LEU A 102 21.887 6.445 17.754 1.00 0.00 C ATOM 1619 CD1 LEU A 102 22.717 5.259 17.251 1.00 0.00 C ATOM 1620 CD2 LEU A 102 22.235 7.630 16.868 1.00 0.00 C ATOM 0 H LEU A 102 20.503 4.718 19.497 1.00 0.00 H new ATOM 0 HA LEU A 102 19.922 7.287 19.254 1.00 0.00 H new ATOM 0 HB2 LEU A 102 20.312 5.126 17.123 1.00 0.00 H new ATOM 0 HB3 LEU A 102 20.071 6.799 16.661 1.00 0.00 H new ATOM 0 HG LEU A 102 22.072 6.623 18.813 1.00 0.00 H new ATOM 0 HD11 LEU A 102 23.773 5.444 17.448 1.00 0.00 H new ATOM 0 HD12 LEU A 102 22.405 4.351 17.768 1.00 0.00 H new ATOM 0 HD13 LEU A 102 22.564 5.136 16.179 1.00 0.00 H new ATOM 0 HD21 LEU A 102 23.280 7.903 17.019 1.00 0.00 H new ATOM 0 HD22 LEU A 102 22.077 7.362 15.823 1.00 0.00 H new ATOM 0 HD23 LEU A 102 21.598 8.476 17.126 1.00 0.00 H new ATOM 1632 N ILE A 103 17.760 5.303 17.647 1.00 0.00 N ATOM 1633 CA ILE A 103 16.406 5.125 17.188 1.00 0.00 C ATOM 1634 C ILE A 103 16.099 6.065 16.024 1.00 0.00 C ATOM 1635 O ILE A 103 14.956 5.921 15.562 1.00 0.00 O ATOM 1636 CB ILE A 103 15.469 5.416 18.379 1.00 0.00 C ATOM 1637 CG1 ILE A 103 15.092 4.073 18.974 1.00 0.00 C ATOM 1638 CG2 ILE A 103 14.285 6.275 18.091 1.00 0.00 C ATOM 1639 CD1 ILE A 103 14.668 2.974 18.004 1.00 0.00 C ATOM 0 H ILE A 103 18.390 4.529 17.435 1.00 0.00 H new ATOM 0 HA ILE A 103 16.262 4.107 16.828 1.00 0.00 H new ATOM 0 HB ILE A 103 16.012 6.036 19.092 1.00 0.00 H new ATOM 0 HG12 ILE A 103 15.943 3.707 19.548 1.00 0.00 H new ATOM 0 HG13 ILE A 103 14.277 4.233 19.680 1.00 0.00 H new ATOM 0 HG21 ILE A 103 13.702 6.409 19.002 1.00 0.00 H new ATOM 0 HG22 ILE A 103 14.620 7.247 17.728 1.00 0.00 H new ATOM 0 HG23 ILE A 103 13.666 5.798 17.331 1.00 0.00 H new ATOM 0 HD11 ILE A 103 14.427 2.069 18.562 1.00 0.00 H new ATOM 0 HD12 ILE A 103 13.791 3.300 17.445 1.00 0.00 H new ATOM 0 HD13 ILE A 103 15.483 2.766 17.311 1.00 0.00 H new ATOM 1651 N ALA A 104 17.010 6.909 15.608 1.00 0.00 N ATOM 1652 CA ALA A 104 16.879 7.872 14.529 1.00 0.00 C ATOM 1653 C ALA A 104 15.664 7.579 13.710 1.00 0.00 C ATOM 1654 O ALA A 104 15.790 7.057 12.622 1.00 0.00 O ATOM 1655 CB ALA A 104 18.144 7.905 13.647 1.00 0.00 C ATOM 0 H ALA A 104 17.932 6.948 16.043 1.00 0.00 H new ATOM 0 HA ALA A 104 16.764 8.861 14.974 1.00 0.00 H new ATOM 0 HB1 ALA A 104 18.012 8.636 12.849 1.00 0.00 H new ATOM 0 HB2 ALA A 104 19.005 8.183 14.255 1.00 0.00 H new ATOM 0 HB3 ALA A 104 18.310 6.919 13.212 1.00 0.00 H new ATOM 1661 N VAL A 105 14.520 7.905 14.289 1.00 0.00 N ATOM 1662 CA VAL A 105 13.219 7.670 13.710 1.00 0.00 C ATOM 1663 C VAL A 105 13.064 8.598 12.494 1.00 0.00 C ATOM 1664 O VAL A 105 14.033 8.623 11.739 1.00 0.00 O ATOM 1665 CB VAL A 105 12.022 7.809 14.645 1.00 0.00 C ATOM 1666 CG1 VAL A 105 10.718 7.302 13.987 1.00 0.00 C ATOM 1667 CG2 VAL A 105 12.145 7.021 15.932 1.00 0.00 C ATOM 0 H VAL A 105 14.476 8.354 15.204 1.00 0.00 H new ATOM 0 HA VAL A 105 13.200 6.615 13.435 1.00 0.00 H new ATOM 0 HB VAL A 105 11.996 8.877 14.859 1.00 0.00 H new ATOM 0 HG11 VAL A 105 9.889 7.418 14.685 1.00 0.00 H new ATOM 0 HG12 VAL A 105 10.517 7.880 13.085 1.00 0.00 H new ATOM 0 HG13 VAL A 105 10.828 6.249 13.726 1.00 0.00 H new ATOM 0 HG21 VAL A 105 11.253 7.175 16.539 1.00 0.00 H new ATOM 0 HG22 VAL A 105 12.249 5.961 15.701 1.00 0.00 H new ATOM 0 HG23 VAL A 105 13.022 7.360 16.483 1.00 0.00 H new ATOM 1677 N ARG A 106 11.957 9.284 12.344 1.00 0.00 N ATOM 1678 CA ARG A 106 11.600 10.141 11.232 1.00 0.00 C ATOM 1679 C ARG A 106 10.064 10.152 11.295 1.00 0.00 C ATOM 1680 O ARG A 106 9.570 11.159 10.877 1.00 0.00 O ATOM 1681 CB ARG A 106 11.991 9.571 9.931 1.00 0.00 C ATOM 1682 CG ARG A 106 12.410 10.730 9.041 1.00 0.00 C ATOM 1683 CD ARG A 106 13.597 10.350 8.210 1.00 0.00 C ATOM 1684 NE ARG A 106 14.725 10.219 9.134 1.00 0.00 N ATOM 1685 CZ ARG A 106 15.816 9.496 8.969 1.00 0.00 C ATOM 1686 NH1 ARG A 106 15.907 8.806 7.835 1.00 0.00 N ATOM 1687 NH2 ARG A 106 16.783 9.451 9.866 1.00 0.00 N ATOM 0 H ARG A 106 11.222 9.257 13.051 1.00 0.00 H new ATOM 0 HA ARG A 106 12.088 11.113 11.307 1.00 0.00 H new ATOM 0 HB2 ARG A 106 12.811 8.863 10.052 1.00 0.00 H new ATOM 0 HB3 ARG A 106 11.160 9.024 9.485 1.00 0.00 H new ATOM 0 HG2 ARG A 106 11.582 11.017 8.393 1.00 0.00 H new ATOM 0 HG3 ARG A 106 12.651 11.599 9.654 1.00 0.00 H new ATOM 0 HD2 ARG A 106 13.417 9.414 7.682 1.00 0.00 H new ATOM 0 HD3 ARG A 106 13.800 11.108 7.454 1.00 0.00 H new ATOM 0 HE ARG A 106 14.660 10.747 10.004 1.00 0.00 H new ATOM 0 HH11 ARG A 106 15.155 8.854 7.147 1.00 0.00 H new ATOM 0 HH12 ARG A 106 16.729 8.229 7.653 1.00 0.00 H new ATOM 0 HH21 ARG A 106 16.704 9.989 10.729 1.00 0.00 H new ATOM 0 HH22 ARG A 106 17.610 8.878 9.697 1.00 0.00 H new ATOM 1701 N GLU A 107 9.572 9.044 11.774 1.00 0.00 N ATOM 1702 CA GLU A 107 8.203 8.742 11.901 1.00 0.00 C ATOM 1703 C GLU A 107 7.367 9.305 10.722 1.00 0.00 C ATOM 1704 O GLU A 107 6.717 8.604 9.971 1.00 0.00 O ATOM 1705 CB GLU A 107 7.525 9.437 13.086 1.00 0.00 C ATOM 1706 CG GLU A 107 8.168 9.235 14.447 1.00 0.00 C ATOM 1707 CD GLU A 107 7.377 9.694 15.691 1.00 0.00 C ATOM 1708 OE1 GLU A 107 6.248 10.329 15.421 1.00 0.00 O ATOM 1709 OE2 GLU A 107 7.710 9.523 16.838 1.00 0.00 O ATOM 0 H GLU A 107 10.171 8.287 12.104 1.00 0.00 H new ATOM 0 HA GLU A 107 8.212 7.655 11.982 1.00 0.00 H new ATOM 0 HB2 GLU A 107 7.491 10.507 12.880 1.00 0.00 H new ATOM 0 HB3 GLU A 107 6.493 9.090 13.141 1.00 0.00 H new ATOM 0 HG2 GLU A 107 8.385 8.173 14.561 1.00 0.00 H new ATOM 0 HG3 GLU A 107 9.125 9.757 14.447 1.00 0.00 H new ATOM 1716 N ILE A 108 7.404 10.614 10.701 1.00 0.00 N ATOM 1717 CA ILE A 108 6.639 11.409 9.782 1.00 0.00 C ATOM 1718 C ILE A 108 5.178 11.462 10.126 1.00 0.00 C ATOM 1719 O ILE A 108 4.598 10.442 10.418 1.00 0.00 O ATOM 1720 CB ILE A 108 6.877 10.755 8.405 1.00 0.00 C ATOM 1721 CG1 ILE A 108 6.844 12.018 7.554 1.00 0.00 C ATOM 1722 CG2 ILE A 108 5.763 9.869 7.913 1.00 0.00 C ATOM 1723 CD1 ILE A 108 7.003 11.772 6.098 1.00 0.00 C ATOM 0 H ILE A 108 7.980 11.165 11.337 1.00 0.00 H new ATOM 0 HA ILE A 108 6.955 12.452 9.808 1.00 0.00 H new ATOM 0 HB ILE A 108 7.759 10.115 8.398 1.00 0.00 H new ATOM 0 HG12 ILE A 108 5.898 12.533 7.724 1.00 0.00 H new ATOM 0 HG13 ILE A 108 7.636 12.689 7.887 1.00 0.00 H new ATOM 0 HG21 ILE A 108 6.028 9.459 6.939 1.00 0.00 H new ATOM 0 HG22 ILE A 108 5.607 9.054 8.620 1.00 0.00 H new ATOM 0 HG23 ILE A 108 4.846 10.452 7.824 1.00 0.00 H new ATOM 0 HD11 ILE A 108 6.968 12.721 5.563 1.00 0.00 H new ATOM 0 HD12 ILE A 108 7.961 11.286 5.914 1.00 0.00 H new ATOM 0 HD13 ILE A 108 6.196 11.128 5.748 1.00 0.00 H new ATOM 1735 N SER A 109 4.670 12.675 10.069 1.00 0.00 N ATOM 1736 CA SER A 109 3.247 12.847 10.375 1.00 0.00 C ATOM 1737 C SER A 109 2.951 14.293 10.313 1.00 0.00 C ATOM 1738 O SER A 109 3.274 15.100 11.153 1.00 0.00 O ATOM 1739 CB SER A 109 2.985 12.263 11.748 1.00 0.00 C ATOM 1740 OG SER A 109 1.730 12.665 12.228 1.00 0.00 O ATOM 0 H SER A 109 5.182 13.524 9.828 1.00 0.00 H new ATOM 0 HA SER A 109 2.600 12.332 9.665 1.00 0.00 H new ATOM 0 HB2 SER A 109 3.030 11.175 11.700 1.00 0.00 H new ATOM 0 HB3 SER A 109 3.764 12.584 12.440 1.00 0.00 H new ATOM 0 HG SER A 109 1.579 12.276 13.115 1.00 0.00 H new ATOM 1746 N GLY A 110 2.247 14.640 9.241 1.00 0.00 N ATOM 1747 CA GLY A 110 1.792 15.960 8.950 1.00 0.00 C ATOM 1748 C GLY A 110 2.914 16.959 9.006 1.00 0.00 C ATOM 1749 O GLY A 110 3.188 17.539 10.053 1.00 0.00 O ATOM 0 H GLY A 110 1.974 13.963 8.528 1.00 0.00 H new ATOM 0 HA2 GLY A 110 1.337 15.978 7.960 1.00 0.00 H new ATOM 0 HA3 GLY A 110 1.017 16.243 9.662 1.00 0.00 H new ATOM 1753 N ASN A 111 3.550 17.158 7.873 1.00 0.00 N ATOM 1754 CA ASN A 111 4.624 18.090 7.819 1.00 0.00 C ATOM 1755 C ASN A 111 5.700 17.852 8.897 1.00 0.00 C ATOM 1756 O ASN A 111 6.202 18.730 9.574 1.00 0.00 O ATOM 1757 CB ASN A 111 4.158 19.556 7.735 1.00 0.00 C ATOM 1758 CG ASN A 111 3.703 20.037 6.366 1.00 0.00 C ATOM 1759 OD1 ASN A 111 2.563 19.830 5.909 1.00 0.00 O ATOM 1760 ND2 ASN A 111 4.590 20.701 5.671 1.00 0.00 N ATOM 0 H ASN A 111 3.337 16.688 6.993 1.00 0.00 H new ATOM 0 HA ASN A 111 5.123 17.892 6.870 1.00 0.00 H new ATOM 0 HB2 ASN A 111 3.337 19.696 8.438 1.00 0.00 H new ATOM 0 HB3 ASN A 111 4.975 20.195 8.069 1.00 0.00 H new ATOM 0 HD21 ASN A 111 4.351 21.055 4.745 1.00 0.00 H new ATOM 0 HD22 ASN A 111 5.521 20.865 6.055 1.00 0.00 H new ATOM 1767 N GLU A 112 6.038 16.583 9.027 1.00 0.00 N ATOM 1768 CA GLU A 112 7.021 16.133 9.966 1.00 0.00 C ATOM 1769 C GLU A 112 7.959 15.169 9.188 1.00 0.00 C ATOM 1770 O GLU A 112 7.737 14.963 8.019 1.00 0.00 O ATOM 1771 CB GLU A 112 6.396 15.249 11.101 1.00 0.00 C ATOM 1772 CG GLU A 112 6.141 15.961 12.423 1.00 0.00 C ATOM 1773 CD GLU A 112 5.984 17.481 12.378 1.00 0.00 C ATOM 1774 OE1 GLU A 112 4.880 17.959 12.200 1.00 0.00 O ATOM 1775 OE2 GLU A 112 7.080 18.185 12.539 1.00 0.00 O ATOM 0 H GLU A 112 5.626 15.834 8.471 1.00 0.00 H new ATOM 0 HA GLU A 112 7.505 17.007 10.401 1.00 0.00 H new ATOM 0 HB2 GLU A 112 5.452 14.840 10.741 1.00 0.00 H new ATOM 0 HB3 GLU A 112 7.059 14.404 11.286 1.00 0.00 H new ATOM 0 HG2 GLU A 112 5.237 15.541 12.864 1.00 0.00 H new ATOM 0 HG3 GLU A 112 6.964 15.726 13.098 1.00 0.00 H new ATOM 1782 N LEU A 113 8.885 14.664 9.968 1.00 0.00 N ATOM 1783 CA LEU A 113 9.908 13.677 9.614 1.00 0.00 C ATOM 1784 C LEU A 113 10.748 13.639 10.918 1.00 0.00 C ATOM 1785 O LEU A 113 11.956 13.735 10.913 1.00 0.00 O ATOM 1786 CB LEU A 113 10.845 14.066 8.479 1.00 0.00 C ATOM 1787 CG LEU A 113 10.478 13.622 7.078 1.00 0.00 C ATOM 1788 CD1 LEU A 113 11.795 13.697 6.299 1.00 0.00 C ATOM 1789 CD2 LEU A 113 10.094 12.170 6.968 1.00 0.00 C ATOM 0 H LEU A 113 8.958 14.947 10.945 1.00 0.00 H new ATOM 0 HA LEU A 113 9.440 12.754 9.271 1.00 0.00 H new ATOM 0 HB2 LEU A 113 10.933 15.152 8.474 1.00 0.00 H new ATOM 0 HB3 LEU A 113 11.833 13.668 8.709 1.00 0.00 H new ATOM 0 HG LEU A 113 9.643 14.235 6.739 1.00 0.00 H new ATOM 0 HD11 LEU A 113 11.625 13.391 5.267 1.00 0.00 H new ATOM 0 HD12 LEU A 113 12.171 14.720 6.317 1.00 0.00 H new ATOM 0 HD13 LEU A 113 12.528 13.033 6.758 1.00 0.00 H new ATOM 0 HD21 LEU A 113 9.846 11.937 5.932 1.00 0.00 H new ATOM 0 HD22 LEU A 113 10.928 11.547 7.291 1.00 0.00 H new ATOM 0 HD23 LEU A 113 9.229 11.974 7.601 1.00 0.00 H new ATOM 1801 N ILE A 114 10.022 13.541 11.980 1.00 0.00 N ATOM 1802 CA ILE A 114 10.545 13.540 13.309 1.00 0.00 C ATOM 1803 C ILE A 114 11.602 12.458 13.376 1.00 0.00 C ATOM 1804 O ILE A 114 11.413 11.297 13.722 1.00 0.00 O ATOM 1805 CB ILE A 114 9.529 13.024 14.336 1.00 0.00 C ATOM 1806 CG1 ILE A 114 8.454 12.194 13.657 1.00 0.00 C ATOM 1807 CG2 ILE A 114 9.091 14.143 15.242 1.00 0.00 C ATOM 1808 CD1 ILE A 114 7.221 12.966 13.115 1.00 0.00 C ATOM 0 H ILE A 114 9.006 13.456 11.947 1.00 0.00 H new ATOM 0 HA ILE A 114 10.866 14.560 13.520 1.00 0.00 H new ATOM 0 HB ILE A 114 9.980 12.310 15.025 1.00 0.00 H new ATOM 0 HG12 ILE A 114 8.912 11.656 12.827 1.00 0.00 H new ATOM 0 HG13 ILE A 114 8.102 11.445 14.367 1.00 0.00 H new ATOM 0 HG21 ILE A 114 8.370 13.764 15.966 1.00 0.00 H new ATOM 0 HG22 ILE A 114 9.957 14.545 15.768 1.00 0.00 H new ATOM 0 HG23 ILE A 114 8.629 14.932 14.649 1.00 0.00 H new ATOM 0 HD11 ILE A 114 6.526 12.264 12.653 1.00 0.00 H new ATOM 0 HD12 ILE A 114 6.724 13.481 13.937 1.00 0.00 H new ATOM 0 HD13 ILE A 114 7.546 13.696 12.373 1.00 0.00 H new ATOM 1820 N GLN A 115 12.782 12.933 13.033 1.00 0.00 N ATOM 1821 CA GLN A 115 14.031 12.212 13.019 1.00 0.00 C ATOM 1822 C GLN A 115 14.189 11.466 14.322 1.00 0.00 C ATOM 1823 O GLN A 115 14.903 10.456 14.307 1.00 0.00 O ATOM 1824 CB GLN A 115 15.062 13.316 12.795 1.00 0.00 C ATOM 1825 CG GLN A 115 15.075 13.695 11.297 1.00 0.00 C ATOM 1826 CD GLN A 115 16.331 12.961 10.828 1.00 0.00 C ATOM 1827 OE1 GLN A 115 16.230 11.762 10.659 1.00 0.00 O ATOM 1828 NE2 GLN A 115 17.402 13.721 10.707 1.00 0.00 N ATOM 0 H GLN A 115 12.897 13.902 12.736 1.00 0.00 H new ATOM 0 HA GLN A 115 14.122 11.443 12.252 1.00 0.00 H new ATOM 0 HB2 GLN A 115 14.818 14.188 13.402 1.00 0.00 H new ATOM 0 HB3 GLN A 115 16.050 12.977 13.106 1.00 0.00 H new ATOM 0 HG2 GLN A 115 14.179 13.356 10.777 1.00 0.00 H new ATOM 0 HG3 GLN A 115 15.144 14.772 11.144 1.00 0.00 H new ATOM 0 HE21 GLN A 115 17.338 14.724 10.882 1.00 0.00 H new ATOM 0 HE22 GLN A 115 18.294 13.306 10.438 1.00 0.00 H new ATOM 1837 N THR A 116 13.494 11.954 15.316 1.00 0.00 N ATOM 1838 CA THR A 116 13.357 11.416 16.647 1.00 0.00 C ATOM 1839 C THR A 116 14.328 10.345 17.002 1.00 0.00 C ATOM 1840 O THR A 116 13.899 9.211 17.171 1.00 0.00 O ATOM 1841 CB THR A 116 11.910 10.908 16.865 1.00 0.00 C ATOM 1842 OG1 THR A 116 11.109 12.091 16.976 1.00 0.00 O ATOM 1843 CG2 THR A 116 11.772 10.193 18.182 1.00 0.00 C ATOM 0 H THR A 116 12.961 12.816 15.206 1.00 0.00 H new ATOM 0 HA THR A 116 13.587 12.245 17.316 1.00 0.00 H new ATOM 0 HB THR A 116 11.628 10.233 16.057 1.00 0.00 H new ATOM 0 HG1 THR A 116 10.163 11.841 17.035 1.00 0.00 H new ATOM 0 HG21 THR A 116 10.745 9.849 18.304 1.00 0.00 H new ATOM 0 HG22 THR A 116 12.446 9.337 18.203 1.00 0.00 H new ATOM 0 HG23 THR A 116 12.025 10.874 18.994 1.00 0.00 H new ATOM 1851 N TYR A 117 15.607 10.704 17.140 1.00 0.00 N ATOM 1852 CA TYR A 117 16.503 9.711 17.583 1.00 0.00 C ATOM 1853 C TYR A 117 16.822 9.875 19.086 1.00 0.00 C ATOM 1854 O TYR A 117 17.589 10.799 19.448 1.00 0.00 O ATOM 1855 CB TYR A 117 17.910 9.785 16.979 1.00 0.00 C ATOM 1856 CG TYR A 117 18.387 10.536 15.770 1.00 0.00 C ATOM 1857 CD1 TYR A 117 17.704 11.396 14.947 1.00 0.00 C ATOM 1858 CD2 TYR A 117 19.737 10.346 15.408 1.00 0.00 C ATOM 1859 CE1 TYR A 117 18.316 12.018 13.844 1.00 0.00 C ATOM 1860 CE2 TYR A 117 20.369 10.942 14.332 1.00 0.00 C ATOM 1861 CZ TYR A 117 19.667 11.796 13.520 1.00 0.00 C ATOM 1862 OH TYR A 117 20.289 12.387 12.450 1.00 0.00 O ATOM 0 H TYR A 117 16.000 11.627 16.956 1.00 0.00 H new ATOM 0 HA TYR A 117 15.983 8.796 17.301 1.00 0.00 H new ATOM 0 HB2 TYR A 117 18.543 10.138 17.793 1.00 0.00 H new ATOM 0 HB3 TYR A 117 18.185 8.748 16.788 1.00 0.00 H new ATOM 0 HD1 TYR A 117 16.664 11.602 15.153 1.00 0.00 H new ATOM 0 HD2 TYR A 117 20.326 9.680 16.022 1.00 0.00 H new ATOM 0 HE1 TYR A 117 17.732 12.685 13.228 1.00 0.00 H new ATOM 0 HE2 TYR A 117 21.410 10.736 14.132 1.00 0.00 H new ATOM 0 HH TYR A 117 20.271 13.361 12.558 1.00 0.00 H new ATOM 1872 N THR A 118 16.256 8.986 19.850 1.00 0.00 N ATOM 1873 CA THR A 118 16.337 9.009 21.298 1.00 0.00 C ATOM 1874 C THR A 118 17.256 7.980 21.837 1.00 0.00 C ATOM 1875 O THR A 118 16.819 6.995 22.422 1.00 0.00 O ATOM 1876 CB THR A 118 14.980 8.815 22.016 1.00 0.00 C ATOM 1877 OG1 THR A 118 14.024 9.427 21.126 1.00 0.00 O ATOM 1878 CG2 THR A 118 15.084 9.552 23.304 1.00 0.00 C ATOM 0 H THR A 118 15.712 8.205 19.485 1.00 0.00 H new ATOM 0 HA THR A 118 16.712 10.012 21.502 1.00 0.00 H new ATOM 0 HB THR A 118 14.700 7.783 22.228 1.00 0.00 H new ATOM 0 HG1 THR A 118 13.125 9.347 21.507 1.00 0.00 H new ATOM 0 HG21 THR A 118 14.151 9.451 23.858 1.00 0.00 H new ATOM 0 HG22 THR A 118 15.902 9.140 23.894 1.00 0.00 H new ATOM 0 HG23 THR A 118 15.275 10.607 23.105 1.00 0.00 H new ATOM 1886 N TYR A 119 18.587 8.152 21.714 1.00 0.00 N ATOM 1887 CA TYR A 119 19.558 7.230 22.227 1.00 0.00 C ATOM 1888 C TYR A 119 19.469 7.136 23.747 1.00 0.00 C ATOM 1889 O TYR A 119 19.938 6.108 24.230 1.00 0.00 O ATOM 1890 CB TYR A 119 21.013 7.611 21.831 1.00 0.00 C ATOM 1891 CG TYR A 119 21.528 8.880 22.401 1.00 0.00 C ATOM 1892 CD1 TYR A 119 21.099 10.064 21.820 1.00 0.00 C ATOM 1893 CD2 TYR A 119 22.405 8.874 23.478 1.00 0.00 C ATOM 1894 CE1 TYR A 119 21.530 11.271 22.291 1.00 0.00 C ATOM 1895 CE2 TYR A 119 22.852 10.104 23.967 1.00 0.00 C ATOM 1896 CZ TYR A 119 22.407 11.290 23.367 1.00 0.00 C ATOM 1897 OH TYR A 119 22.869 12.470 23.881 1.00 0.00 O ATOM 0 H TYR A 119 19.001 8.957 21.243 1.00 0.00 H new ATOM 0 HA TYR A 119 19.324 6.265 21.778 1.00 0.00 H new ATOM 0 HB2 TYR A 119 21.676 6.802 22.137 1.00 0.00 H new ATOM 0 HB3 TYR A 119 21.069 7.674 20.744 1.00 0.00 H new ATOM 0 HD1 TYR A 119 20.415 10.031 20.985 1.00 0.00 H new ATOM 0 HD2 TYR A 119 22.732 7.946 23.924 1.00 0.00 H new ATOM 0 HE1 TYR A 119 21.196 12.192 21.836 1.00 0.00 H new ATOM 0 HE2 TYR A 119 23.536 10.141 24.802 1.00 0.00 H new ATOM 0 HH TYR A 119 23.669 12.750 23.390 1.00 0.00 H new ATOM 1907 N GLU A 120 18.920 8.123 24.430 1.00 0.00 N ATOM 1908 CA GLU A 120 18.883 7.980 25.891 1.00 0.00 C ATOM 1909 C GLU A 120 18.120 9.027 26.624 1.00 0.00 C ATOM 1910 O GLU A 120 18.253 9.375 27.779 1.00 0.00 O ATOM 1911 CB GLU A 120 20.373 7.845 26.304 1.00 0.00 C ATOM 1912 CG GLU A 120 20.864 8.922 27.275 1.00 0.00 C ATOM 1913 CD GLU A 120 20.739 8.535 28.724 1.00 0.00 C ATOM 1914 OE1 GLU A 120 20.139 7.529 29.105 1.00 0.00 O ATOM 1915 OE2 GLU A 120 21.308 9.327 29.553 1.00 0.00 O ATOM 0 H GLU A 120 18.518 8.977 24.043 1.00 0.00 H new ATOM 0 HA GLU A 120 18.303 7.104 26.181 1.00 0.00 H new ATOM 0 HB2 GLU A 120 20.523 6.867 26.761 1.00 0.00 H new ATOM 0 HB3 GLU A 120 20.990 7.875 25.406 1.00 0.00 H new ATOM 0 HG2 GLU A 120 21.908 9.146 27.057 1.00 0.00 H new ATOM 0 HG3 GLU A 120 20.299 9.838 27.103 1.00 0.00 H new ATOM 1922 N GLY A 121 17.183 9.624 25.892 1.00 0.00 N ATOM 1923 CA GLY A 121 16.381 10.696 26.433 1.00 0.00 C ATOM 1924 C GLY A 121 16.735 12.053 25.825 1.00 0.00 C ATOM 1925 O GLY A 121 16.361 13.079 26.338 1.00 0.00 O ATOM 0 H GLY A 121 16.967 9.378 24.926 1.00 0.00 H new ATOM 0 HA2 GLY A 121 15.327 10.484 26.253 1.00 0.00 H new ATOM 0 HA3 GLY A 121 16.517 10.738 27.514 1.00 0.00 H new ATOM 1929 N VAL A 122 17.492 11.934 24.703 1.00 0.00 N ATOM 1930 CA VAL A 122 17.966 13.065 23.971 1.00 0.00 C ATOM 1931 C VAL A 122 17.569 12.974 22.495 1.00 0.00 C ATOM 1932 O VAL A 122 18.429 13.299 21.670 1.00 0.00 O ATOM 1933 CB VAL A 122 19.505 13.168 24.178 1.00 0.00 C ATOM 1934 CG1 VAL A 122 20.108 14.489 23.759 1.00 0.00 C ATOM 1935 CG2 VAL A 122 19.782 12.990 25.675 1.00 0.00 C ATOM 0 H VAL A 122 17.773 11.037 24.307 1.00 0.00 H new ATOM 0 HA VAL A 122 17.503 13.979 24.342 1.00 0.00 H new ATOM 0 HB VAL A 122 19.959 12.401 23.550 1.00 0.00 H new ATOM 0 HG11 VAL A 122 21.183 14.472 23.939 1.00 0.00 H new ATOM 0 HG12 VAL A 122 19.920 14.655 22.698 1.00 0.00 H new ATOM 0 HG13 VAL A 122 19.657 15.295 24.338 1.00 0.00 H new ATOM 0 HG21 VAL A 122 20.855 13.057 25.857 1.00 0.00 H new ATOM 0 HG22 VAL A 122 19.270 13.772 26.235 1.00 0.00 H new ATOM 0 HG23 VAL A 122 19.419 12.015 25.999 1.00 0.00 H new ATOM 1945 N GLU A 123 16.359 12.588 22.184 1.00 0.00 N ATOM 1946 CA GLU A 123 15.775 12.529 20.888 1.00 0.00 C ATOM 1947 C GLU A 123 16.237 13.746 20.130 1.00 0.00 C ATOM 1948 O GLU A 123 16.126 14.837 20.674 1.00 0.00 O ATOM 1949 CB GLU A 123 14.246 12.864 21.035 1.00 0.00 C ATOM 1950 CG GLU A 123 13.517 12.573 19.687 1.00 0.00 C ATOM 1951 CD GLU A 123 12.033 12.714 19.635 1.00 0.00 C ATOM 1952 OE1 GLU A 123 11.492 11.812 20.427 1.00 0.00 O ATOM 1953 OE2 GLU A 123 11.275 13.485 19.061 1.00 0.00 O ATOM 0 H GLU A 123 15.706 12.281 22.905 1.00 0.00 H new ATOM 0 HA GLU A 123 16.007 11.566 20.434 1.00 0.00 H new ATOM 0 HB2 GLU A 123 13.807 12.267 21.834 1.00 0.00 H new ATOM 0 HB3 GLU A 123 14.117 13.910 21.312 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.940 13.236 18.932 1.00 0.00 H new ATOM 0 HG3 GLU A 123 13.764 11.554 19.390 1.00 0.00 H new ATOM 1960 N ALA A 124 16.732 13.483 18.913 1.00 0.00 N ATOM 1961 CA ALA A 124 17.217 14.595 18.083 1.00 0.00 C ATOM 1962 C ALA A 124 16.404 14.622 16.795 1.00 0.00 C ATOM 1963 O ALA A 124 16.426 13.708 16.015 1.00 0.00 O ATOM 1964 CB ALA A 124 18.691 14.575 17.811 1.00 0.00 C ATOM 0 H ALA A 124 16.806 12.555 18.495 1.00 0.00 H new ATOM 0 HA ALA A 124 17.071 15.515 18.649 1.00 0.00 H new ATOM 0 HB1 ALA A 124 18.958 15.432 17.192 1.00 0.00 H new ATOM 0 HB2 ALA A 124 19.236 14.624 18.754 1.00 0.00 H new ATOM 0 HB3 ALA A 124 18.952 13.655 17.289 1.00 0.00 H new ATOM 1970 N LYS A 125 15.672 15.741 16.669 1.00 0.00 N ATOM 1971 CA LYS A 125 14.811 15.851 15.496 1.00 0.00 C ATOM 1972 C LYS A 125 14.756 17.295 15.157 1.00 0.00 C ATOM 1973 O LYS A 125 15.740 18.005 15.489 1.00 0.00 O ATOM 1974 CB LYS A 125 13.387 15.296 15.816 1.00 0.00 C ATOM 1975 CG LYS A 125 13.375 14.586 17.160 1.00 0.00 C ATOM 1976 CD LYS A 125 13.254 15.596 18.337 1.00 0.00 C ATOM 1977 CE LYS A 125 12.233 16.722 18.162 1.00 0.00 C ATOM 1978 NZ LYS A 125 12.154 17.487 19.395 1.00 0.00 N ATOM 0 H LYS A 125 15.659 16.528 17.318 1.00 0.00 H new ATOM 0 HA LYS A 125 15.196 15.269 14.659 1.00 0.00 H new ATOM 0 HB2 LYS A 125 12.666 16.114 15.825 1.00 0.00 H new ATOM 0 HB3 LYS A 125 13.076 14.606 15.032 1.00 0.00 H new ATOM 0 HG2 LYS A 125 12.542 13.884 17.194 1.00 0.00 H new ATOM 0 HG3 LYS A 125 14.289 14.002 17.273 1.00 0.00 H new ATOM 0 HD2 LYS A 125 12.999 15.041 19.240 1.00 0.00 H new ATOM 0 HD3 LYS A 125 14.233 16.045 18.505 1.00 0.00 H new ATOM 0 HE2 LYS A 125 12.525 17.370 17.336 1.00 0.00 H new ATOM 0 HE3 LYS A 125 11.256 16.308 17.913 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 11.461 18.255 19.283 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 11.857 16.863 20.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 13.087 17.891 19.613 1.00 0.00 H new ATOM 1992 N ARG A 126 13.694 17.769 14.545 1.00 0.00 N ATOM 1993 CA ARG A 126 13.487 19.182 14.181 1.00 0.00 C ATOM 1994 C ARG A 126 12.638 19.076 12.933 1.00 0.00 C ATOM 1995 O ARG A 126 11.615 19.711 12.937 1.00 0.00 O ATOM 1996 CB ARG A 126 14.672 20.035 13.921 1.00 0.00 C ATOM 1997 CG ARG A 126 15.052 20.658 15.228 1.00 0.00 C ATOM 1998 CD ARG A 126 14.145 21.864 15.417 1.00 0.00 C ATOM 1999 NE ARG A 126 13.141 21.569 16.401 1.00 0.00 N ATOM 2000 CZ ARG A 126 12.381 22.470 16.997 1.00 0.00 C ATOM 2001 NH1 ARG A 126 12.496 23.776 16.719 1.00 0.00 N ATOM 2002 NH2 ARG A 126 11.470 22.141 17.892 1.00 0.00 N ATOM 0 H ARG A 126 12.914 17.172 14.270 1.00 0.00 H new ATOM 0 HA ARG A 126 13.056 19.699 15.039 1.00 0.00 H new ATOM 0 HB2 ARG A 126 15.495 19.442 13.522 1.00 0.00 H new ATOM 0 HB3 ARG A 126 14.442 20.801 13.180 1.00 0.00 H new ATOM 0 HG2 ARG A 126 14.928 19.948 16.046 1.00 0.00 H new ATOM 0 HG3 ARG A 126 16.100 20.959 15.223 1.00 0.00 H new ATOM 0 HD2 ARG A 126 14.733 22.727 15.731 1.00 0.00 H new ATOM 0 HD3 ARG A 126 13.673 22.127 14.470 1.00 0.00 H new ATOM 0 HE ARG A 126 13.005 20.591 16.659 1.00 0.00 H new ATOM 0 HH11 ARG A 126 13.182 24.093 16.034 1.00 0.00 H new ATOM 0 HH12 ARG A 126 11.898 24.453 17.192 1.00 0.00 H new ATOM 0 HH21 ARG A 126 11.334 21.162 18.145 1.00 0.00 H new ATOM 0 HH22 ARG A 126 10.902 22.865 18.331 1.00 0.00 H new ATOM 2016 N ILE A 127 13.121 18.283 11.987 1.00 0.00 N ATOM 2017 CA ILE A 127 12.489 17.922 10.763 1.00 0.00 C ATOM 2018 C ILE A 127 13.176 18.362 9.529 1.00 0.00 C ATOM 2019 O ILE A 127 13.979 19.283 9.496 1.00 0.00 O ATOM 2020 CB ILE A 127 10.999 18.347 10.644 1.00 0.00 C ATOM 2021 CG1 ILE A 127 10.165 17.389 11.487 1.00 0.00 C ATOM 2022 CG2 ILE A 127 10.390 18.402 9.241 1.00 0.00 C ATOM 2023 CD1 ILE A 127 10.687 17.024 12.875 1.00 0.00 C ATOM 0 H ILE A 127 14.040 17.850 12.081 1.00 0.00 H new ATOM 0 HA ILE A 127 12.556 16.836 10.830 1.00 0.00 H new ATOM 0 HB ILE A 127 10.982 19.381 10.987 1.00 0.00 H new ATOM 0 HG12 ILE A 127 9.173 17.824 11.606 1.00 0.00 H new ATOM 0 HG13 ILE A 127 10.042 16.465 10.922 1.00 0.00 H new ATOM 0 HG21 ILE A 127 9.347 18.713 9.309 1.00 0.00 H new ATOM 0 HG22 ILE A 127 10.943 19.117 8.632 1.00 0.00 H new ATOM 0 HG23 ILE A 127 10.445 17.415 8.781 1.00 0.00 H new ATOM 0 HD11 ILE A 127 9.991 16.337 13.356 1.00 0.00 H new ATOM 0 HD12 ILE A 127 11.663 16.547 12.783 1.00 0.00 H new ATOM 0 HD13 ILE A 127 10.780 17.927 13.478 1.00 0.00 H new ATOM 2035 N PHE A 128 12.741 17.618 8.485 1.00 0.00 N ATOM 2036 CA PHE A 128 13.021 17.679 7.133 1.00 0.00 C ATOM 2037 C PHE A 128 12.948 19.064 6.473 1.00 0.00 C ATOM 2038 O PHE A 128 12.295 19.963 6.974 1.00 0.00 O ATOM 2039 CB PHE A 128 11.920 16.902 6.345 1.00 0.00 C ATOM 2040 CG PHE A 128 10.527 17.558 6.271 1.00 0.00 C ATOM 2041 CD1 PHE A 128 10.275 18.764 5.651 1.00 0.00 C ATOM 2042 CD2 PHE A 128 9.389 16.965 6.828 1.00 0.00 C ATOM 2043 CE1 PHE A 128 9.054 19.398 5.547 1.00 0.00 C ATOM 2044 CE2 PHE A 128 8.142 17.573 6.743 1.00 0.00 C ATOM 2045 CZ PHE A 128 7.938 18.804 6.102 1.00 0.00 C ATOM 0 H PHE A 128 12.085 16.858 8.664 1.00 0.00 H new ATOM 0 HA PHE A 128 14.040 17.295 7.086 1.00 0.00 H new ATOM 0 HB2 PHE A 128 12.277 16.746 5.327 1.00 0.00 H new ATOM 0 HB3 PHE A 128 11.808 15.917 6.798 1.00 0.00 H new ATOM 0 HD1 PHE A 128 11.120 19.263 5.201 1.00 0.00 H new ATOM 0 HD2 PHE A 128 9.481 16.016 7.334 1.00 0.00 H new ATOM 0 HE1 PHE A 128 8.972 20.347 5.038 1.00 0.00 H new ATOM 0 HE2 PHE A 128 7.293 17.076 7.190 1.00 0.00 H new ATOM 0 HZ PHE A 128 6.962 19.262 6.046 1.00 0.00 H new ATOM 2055 N LYS A 129 13.595 19.003 5.310 1.00 0.00 N ATOM 2056 CA LYS A 129 13.686 20.060 4.357 1.00 0.00 C ATOM 2057 C LYS A 129 12.806 19.688 3.169 1.00 0.00 C ATOM 2058 O LYS A 129 12.582 20.617 2.406 1.00 0.00 O ATOM 2059 CB LYS A 129 14.971 20.730 4.013 1.00 0.00 C ATOM 2060 CG LYS A 129 15.636 21.425 5.200 1.00 0.00 C ATOM 2061 CD LYS A 129 16.971 22.046 4.779 1.00 0.00 C ATOM 2062 CE LYS A 129 18.022 21.056 4.257 1.00 0.00 C ATOM 2063 NZ LYS A 129 19.029 21.704 3.367 1.00 0.00 N ATOM 0 H LYS A 129 14.089 18.162 5.011 1.00 0.00 H new ATOM 0 HA LYS A 129 13.327 20.927 4.911 1.00 0.00 H new ATOM 0 HB2 LYS A 129 15.659 19.990 3.604 1.00 0.00 H new ATOM 0 HB3 LYS A 129 14.789 21.464 3.228 1.00 0.00 H new ATOM 0 HG2 LYS A 129 14.976 22.199 5.592 1.00 0.00 H new ATOM 0 HG3 LYS A 129 15.799 20.708 6.004 1.00 0.00 H new ATOM 0 HD2 LYS A 129 16.779 22.788 4.004 1.00 0.00 H new ATOM 0 HD3 LYS A 129 17.390 22.578 5.633 1.00 0.00 H new ATOM 0 HE2 LYS A 129 18.533 20.595 5.102 1.00 0.00 H new ATOM 0 HE3 LYS A 129 17.522 20.255 3.712 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 19.715 20.992 3.043 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 18.548 22.121 2.545 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 19.527 22.450 3.892 1.00 0.00 H new ATOM 2077 N LYS A 130 12.374 18.472 3.147 1.00 0.00 N ATOM 2078 CA LYS A 130 11.634 17.871 2.107 1.00 0.00 C ATOM 2079 C LYS A 130 11.941 18.501 0.761 1.00 0.00 C ATOM 2080 O LYS A 130 12.105 19.703 0.511 1.00 0.00 O ATOM 2081 CB LYS A 130 10.134 17.765 2.272 1.00 0.00 C ATOM 2082 CG LYS A 130 9.309 17.678 0.953 1.00 0.00 C ATOM 2083 CD LYS A 130 8.582 18.935 0.538 1.00 0.00 C ATOM 2084 CE LYS A 130 7.057 18.788 0.768 1.00 0.00 C ATOM 2085 NZ LYS A 130 6.458 17.808 -0.156 1.00 0.00 N ATOM 0 H LYS A 130 12.547 17.829 3.920 1.00 0.00 H new ATOM 0 HA LYS A 130 11.988 16.841 2.161 1.00 0.00 H new ATOM 0 HB2 LYS A 130 9.915 16.883 2.873 1.00 0.00 H new ATOM 0 HB3 LYS A 130 9.788 18.630 2.838 1.00 0.00 H new ATOM 0 HG2 LYS A 130 9.982 17.389 0.146 1.00 0.00 H new ATOM 0 HG3 LYS A 130 8.577 16.878 1.059 1.00 0.00 H new ATOM 0 HD2 LYS A 130 8.960 19.784 1.107 1.00 0.00 H new ATOM 0 HD3 LYS A 130 8.778 19.144 -0.514 1.00 0.00 H new ATOM 0 HE2 LYS A 130 6.872 18.478 1.797 1.00 0.00 H new ATOM 0 HE3 LYS A 130 6.574 19.756 0.635 1.00 0.00 H new ATOM 0 HZ1 LYS A 130 5.442 18.003 -0.258 1.00 0.00 H new ATOM 0 HZ2 LYS A 130 6.919 17.880 -1.085 1.00 0.00 H new ATOM 0 HZ3 LYS A 130 6.590 16.848 0.223 1.00 0.00 H new ATOM 2099 N GLU A 131 11.971 17.520 -0.170 1.00 0.00 N ATOM 2100 CA GLU A 131 12.326 17.856 -1.586 1.00 0.00 C ATOM 2101 C GLU A 131 11.548 17.180 -2.675 1.00 0.00 C ATOM 2102 O GLU A 131 11.932 17.026 -3.835 1.00 0.00 O ATOM 2103 CB GLU A 131 13.852 17.971 -1.548 1.00 0.00 C ATOM 2104 CG GLU A 131 14.706 18.731 -2.550 1.00 0.00 C ATOM 2105 CD GLU A 131 13.991 19.997 -3.075 1.00 0.00 C ATOM 2106 OE1 GLU A 131 13.555 20.877 -2.240 1.00 0.00 O ATOM 2107 OE2 GLU A 131 13.838 20.150 -4.340 1.00 0.00 O ATOM 2108 OXT GLU A 131 10.523 18.023 -1.867 1.00 0.00 O ATOM 0 H GLU A 131 11.767 16.537 0.009 1.00 0.00 H new ATOM 0 HA GLU A 131 11.946 18.802 -1.971 1.00 0.00 H new ATOM 0 HB2 GLU A 131 14.094 18.393 -0.572 1.00 0.00 H new ATOM 0 HB3 GLU A 131 14.227 16.948 -1.555 1.00 0.00 H new ATOM 0 HG2 GLU A 131 15.649 19.014 -2.082 1.00 0.00 H new ATOM 0 HG3 GLU A 131 14.950 18.078 -3.388 1.00 0.00 H new