USER MOD reduce.3.24.130724 H: found=0, std=0, add=888, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 889 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: B 111 LYS NZ :NH3+ 176:sc= 0.0949 (180deg=-0.0459) USER MOD Set 1.2: B 115 GLN : amide:sc= -0.776 K(o=-0.68,f=-5.4!) USER MOD Set 2.1: B 106 GLN : amide:sc= 0.43 K(o=1.7,f=-2.3) USER MOD Set 2.2: B 110 TYR OH : rot -131:sc= 1.23 USER MOD Single : A 1 MET CE :methyl -154:sc= -0.104 (180deg=-0.698) USER MOD Single : A 1 MET N :NH3+ -129:sc= 0 (180deg=-0.0155) USER MOD Single : A 3 SER OG : rot 180:sc= 0.0198 USER MOD Single : A 6 SER OG : rot 180:sc= -0.232 USER MOD Single : A 7 LYS NZ :NH3+ 163:sc= -0.0596 (180deg=-0.359) USER MOD Single : A 13 TYR OH : rot 180:sc= -0.644 USER MOD Single : A 14 GLN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 THR OG1 : rot 75:sc= 0.251 USER MOD Single : A 20 ASN : amide:sc= -1.62 K(o=-1.6,f=-3.8!) USER MOD Single : A 22 GLN : amide:sc= -1.09 K(o=-1.1,f=-5.4!) USER MOD Single : A 24 GLN : amide:sc= -0.779 K(o=-0.78,f=0) USER MOD Single : A 28 THR OG1 : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= -0.591 K(o=-0.59,f=-0.0043) USER MOD Single : A 30 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0594) USER MOD Single : A 33 LYS NZ :NH3+ -162:sc= -0.0748 (180deg=-0.447) USER MOD Single : A 39 GLN : amide:sc= -0.0687 X(o=-0.069,f=-0.21) USER MOD Single : A 48 LYS NZ :NH3+ -168:sc= -0.0186 (180deg=-0.174) USER MOD Single : A 50 THR OG1 : rot 180:sc= 0 USER MOD Single : A 53 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 88 SER OG : rot 180:sc= 0.0362 USER MOD Single : B 100 GLN : amide:sc= -2.35! C(o=-2.3!,f=-6.4!) USER MOD Single : B 101 TYR OH : rot 180:sc= 0 USER MOD Single : B 107 ASN : amide:sc= -2.2! K(o=-2.2!,f=-0.71) USER MOD Single : B 112 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0387) USER MOD Single : B 123 LYS NZ :NH3+ 172:sc= -0.0985 (180deg=-0.449) USER MOD Single : B 130 SER OG : rot -25:sc= 0.289 USER MOD Single : B 133 THR OG1 : rot 48:sc= 0.316 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 27.327 -5.051 4.310 1.00 0.00 N ATOM 2 CA MET A 1 28.456 -4.607 3.459 1.00 0.00 C ATOM 3 C MET A 1 28.812 -3.152 3.744 1.00 0.00 C ATOM 4 O MET A 1 28.797 -2.307 2.847 1.00 0.00 O ATOM 5 CB MET A 1 28.115 -4.772 1.975 1.00 0.00 C ATOM 6 CG MET A 1 28.003 -6.219 1.527 1.00 0.00 C ATOM 7 SD MET A 1 27.674 -6.372 -0.239 1.00 0.00 S ATOM 8 CE MET A 1 27.691 -8.151 -0.428 1.00 0.00 C ATOM 0 H1 MET A 1 27.580 -5.940 4.787 1.00 0.00 H new ATOM 0 H2 MET A 1 27.122 -4.322 5.023 1.00 0.00 H new ATOM 0 H3 MET A 1 26.485 -5.203 3.718 1.00 0.00 H new ATOM 0 HA MET A 1 29.316 -5.233 3.697 1.00 0.00 H new ATOM 0 HB2 MET A 1 27.172 -4.264 1.770 1.00 0.00 H new ATOM 0 HB3 MET A 1 28.881 -4.275 1.379 1.00 0.00 H new ATOM 0 HG2 MET A 1 28.928 -6.743 1.768 1.00 0.00 H new ATOM 0 HG3 MET A 1 27.205 -6.708 2.086 1.00 0.00 H new ATOM 0 HE1 MET A 1 27.964 -8.405 -1.452 1.00 0.00 H new ATOM 0 HE2 MET A 1 28.418 -8.583 0.259 1.00 0.00 H new ATOM 0 HE3 MET A 1 26.701 -8.550 -0.206 1.00 0.00 H new ATOM 20 N ASP A 2 29.166 -2.867 4.991 1.00 0.00 N ATOM 21 CA ASP A 2 29.500 -1.508 5.408 1.00 0.00 C ATOM 22 C ASP A 2 30.956 -1.183 5.086 1.00 0.00 C ATOM 23 O ASP A 2 31.620 -0.448 5.817 1.00 0.00 O ATOM 24 CB ASP A 2 29.238 -1.329 6.908 1.00 0.00 C ATOM 25 CG ASP A 2 27.763 -1.389 7.254 1.00 0.00 C ATOM 26 OD1 ASP A 2 27.232 -2.511 7.440 1.00 0.00 O ATOM 27 OD2 ASP A 2 27.125 -0.322 7.343 1.00 0.00 O ATOM 0 H ASP A 2 29.230 -3.561 5.735 1.00 0.00 H new ATOM 0 HA ASP A 2 28.863 -0.818 4.855 1.00 0.00 H new ATOM 0 HB2 ASP A 2 29.769 -2.104 7.461 1.00 0.00 H new ATOM 0 HB3 ASP A 2 29.645 -0.371 7.232 1.00 0.00 H new ATOM 32 N SER A 3 31.448 -1.747 3.994 1.00 0.00 N ATOM 33 CA SER A 3 32.796 -1.478 3.530 1.00 0.00 C ATOM 34 C SER A 3 32.782 -0.310 2.550 1.00 0.00 C ATOM 35 O SER A 3 33.548 0.642 2.683 1.00 0.00 O ATOM 36 CB SER A 3 33.368 -2.732 2.867 1.00 0.00 C ATOM 37 OG SER A 3 32.440 -3.284 1.942 1.00 0.00 O ATOM 0 H SER A 3 30.926 -2.400 3.409 1.00 0.00 H new ATOM 0 HA SER A 3 33.428 -1.210 4.377 1.00 0.00 H new ATOM 0 HB2 SER A 3 34.297 -2.485 2.353 1.00 0.00 H new ATOM 0 HB3 SER A 3 33.612 -3.472 3.629 1.00 0.00 H new ATOM 0 HG SER A 3 32.827 -4.084 1.528 1.00 0.00 H new ATOM 43 N ALA A 4 31.896 -0.395 1.565 1.00 0.00 N ATOM 44 CA ALA A 4 31.714 0.681 0.605 1.00 0.00 C ATOM 45 C ALA A 4 30.719 1.699 1.145 1.00 0.00 C ATOM 46 O ALA A 4 30.841 2.901 0.902 1.00 0.00 O ATOM 47 CB ALA A 4 31.244 0.127 -0.732 1.00 0.00 C ATOM 0 H ALA A 4 31.291 -1.202 1.412 1.00 0.00 H new ATOM 0 HA ALA A 4 32.671 1.179 0.449 1.00 0.00 H new ATOM 0 HB1 ALA A 4 31.113 0.946 -1.439 1.00 0.00 H new ATOM 0 HB2 ALA A 4 31.987 -0.570 -1.118 1.00 0.00 H new ATOM 0 HB3 ALA A 4 30.295 -0.392 -0.597 1.00 0.00 H new ATOM 53 N ILE A 5 29.741 1.205 1.890 1.00 0.00 N ATOM 54 CA ILE A 5 28.732 2.053 2.506 1.00 0.00 C ATOM 55 C ILE A 5 29.230 2.547 3.859 1.00 0.00 C ATOM 56 O ILE A 5 29.841 1.786 4.610 1.00 0.00 O ATOM 57 CB ILE A 5 27.414 1.275 2.719 1.00 0.00 C ATOM 58 CG1 ILE A 5 27.018 0.535 1.438 1.00 0.00 C ATOM 59 CG2 ILE A 5 26.300 2.219 3.150 1.00 0.00 C ATOM 60 CD1 ILE A 5 25.824 -0.381 1.610 1.00 0.00 C ATOM 0 H ILE A 5 29.625 0.210 2.084 1.00 0.00 H new ATOM 0 HA ILE A 5 28.547 2.896 1.840 1.00 0.00 H new ATOM 0 HB ILE A 5 27.571 0.542 3.510 1.00 0.00 H new ATOM 0 HG12 ILE A 5 26.795 1.266 0.661 1.00 0.00 H new ATOM 0 HG13 ILE A 5 27.868 -0.052 1.090 1.00 0.00 H new ATOM 0 HG21 ILE A 5 25.380 1.653 3.295 1.00 0.00 H new ATOM 0 HG22 ILE A 5 26.578 2.707 4.085 1.00 0.00 H new ATOM 0 HG23 ILE A 5 26.144 2.974 2.379 1.00 0.00 H new ATOM 0 HD11 ILE A 5 25.602 -0.871 0.662 1.00 0.00 H new ATOM 0 HD12 ILE A 5 26.050 -1.135 2.364 1.00 0.00 H new ATOM 0 HD13 ILE A 5 24.960 0.203 1.928 1.00 0.00 H new ATOM 72 N SER A 6 29.001 3.816 4.162 1.00 0.00 N ATOM 73 CA SER A 6 29.336 4.342 5.469 1.00 0.00 C ATOM 74 C SER A 6 28.054 4.574 6.258 1.00 0.00 C ATOM 75 O SER A 6 26.956 4.433 5.709 1.00 0.00 O ATOM 76 CB SER A 6 30.134 5.648 5.331 1.00 0.00 C ATOM 77 OG SER A 6 30.473 6.197 6.595 1.00 0.00 O ATOM 0 H SER A 6 28.587 4.494 3.522 1.00 0.00 H new ATOM 0 HA SER A 6 29.959 3.624 6.002 1.00 0.00 H new ATOM 0 HB2 SER A 6 31.044 5.459 4.761 1.00 0.00 H new ATOM 0 HB3 SER A 6 29.549 6.373 4.765 1.00 0.00 H new ATOM 0 HG SER A 6 30.981 7.025 6.466 1.00 0.00 H new ATOM 83 N LYS A 7 28.179 4.931 7.529 1.00 0.00 N ATOM 84 CA LYS A 7 27.033 5.274 8.342 1.00 0.00 C ATOM 85 C LYS A 7 26.255 6.404 7.670 1.00 0.00 C ATOM 86 O LYS A 7 25.034 6.496 7.787 1.00 0.00 O ATOM 87 CB LYS A 7 27.518 5.698 9.725 1.00 0.00 C ATOM 88 CG LYS A 7 26.412 5.899 10.734 1.00 0.00 C ATOM 89 CD LYS A 7 25.705 4.597 11.082 1.00 0.00 C ATOM 90 CE LYS A 7 26.610 3.651 11.859 1.00 0.00 C ATOM 91 NZ LYS A 7 27.064 4.244 13.145 1.00 0.00 N ATOM 0 H LYS A 7 29.073 4.989 8.017 1.00 0.00 H new ATOM 0 HA LYS A 7 26.371 4.414 8.447 1.00 0.00 H new ATOM 0 HB2 LYS A 7 28.207 4.943 10.103 1.00 0.00 H new ATOM 0 HB3 LYS A 7 28.082 6.626 9.631 1.00 0.00 H new ATOM 0 HG2 LYS A 7 26.826 6.339 11.641 1.00 0.00 H new ATOM 0 HG3 LYS A 7 25.686 6.609 10.338 1.00 0.00 H new ATOM 0 HD2 LYS A 7 24.814 4.814 11.672 1.00 0.00 H new ATOM 0 HD3 LYS A 7 25.370 4.109 10.166 1.00 0.00 H new ATOM 0 HE2 LYS A 7 26.077 2.721 12.057 1.00 0.00 H new ATOM 0 HE3 LYS A 7 27.478 3.398 11.250 1.00 0.00 H new ATOM 0 HZ1 LYS A 7 27.426 3.492 13.765 1.00 0.00 H new ATOM 0 HZ2 LYS A 7 27.819 4.935 12.961 1.00 0.00 H new ATOM 0 HZ3 LYS A 7 26.264 4.720 13.609 1.00 0.00 H new ATOM 105 N GLU A 8 26.997 7.226 6.930 1.00 0.00 N ATOM 106 CA GLU A 8 26.446 8.324 6.147 1.00 0.00 C ATOM 107 C GLU A 8 25.247 7.881 5.314 1.00 0.00 C ATOM 108 O GLU A 8 24.165 8.468 5.388 1.00 0.00 O ATOM 109 CB GLU A 8 27.524 8.861 5.207 1.00 0.00 C ATOM 110 CG GLU A 8 28.737 9.430 5.922 1.00 0.00 C ATOM 111 CD GLU A 8 28.379 10.539 6.888 1.00 0.00 C ATOM 112 OE1 GLU A 8 28.426 10.303 8.112 1.00 0.00 O ATOM 113 OE2 GLU A 8 28.045 11.653 6.427 1.00 0.00 O ATOM 0 H GLU A 8 28.011 7.145 6.858 1.00 0.00 H new ATOM 0 HA GLU A 8 26.114 9.095 6.842 1.00 0.00 H new ATOM 0 HB2 GLU A 8 27.848 8.058 4.546 1.00 0.00 H new ATOM 0 HB3 GLU A 8 27.089 9.637 4.577 1.00 0.00 H new ATOM 0 HG2 GLU A 8 29.242 8.631 6.464 1.00 0.00 H new ATOM 0 HG3 GLU A 8 29.443 9.810 5.184 1.00 0.00 H new ATOM 120 N ASP A 9 25.451 6.844 4.518 1.00 0.00 N ATOM 121 CA ASP A 9 24.427 6.378 3.596 1.00 0.00 C ATOM 122 C ASP A 9 23.447 5.443 4.293 1.00 0.00 C ATOM 123 O ASP A 9 22.271 5.380 3.931 1.00 0.00 O ATOM 124 CB ASP A 9 25.075 5.678 2.403 1.00 0.00 C ATOM 125 CG ASP A 9 24.068 5.288 1.346 1.00 0.00 C ATOM 126 OD1 ASP A 9 23.826 4.081 1.166 1.00 0.00 O ATOM 127 OD2 ASP A 9 23.508 6.193 0.689 1.00 0.00 O ATOM 0 H ASP A 9 26.318 6.308 4.492 1.00 0.00 H new ATOM 0 HA ASP A 9 23.869 7.243 3.239 1.00 0.00 H new ATOM 0 HB2 ASP A 9 25.824 6.336 1.962 1.00 0.00 H new ATOM 0 HB3 ASP A 9 25.598 4.786 2.749 1.00 0.00 H new ATOM 132 N GLU A 10 23.930 4.736 5.306 1.00 0.00 N ATOM 133 CA GLU A 10 23.090 3.814 6.059 1.00 0.00 C ATOM 134 C GLU A 10 21.963 4.556 6.767 1.00 0.00 C ATOM 135 O GLU A 10 20.788 4.235 6.580 1.00 0.00 O ATOM 136 CB GLU A 10 23.914 3.033 7.080 1.00 0.00 C ATOM 137 CG GLU A 10 23.052 2.213 8.019 1.00 0.00 C ATOM 138 CD GLU A 10 23.848 1.248 8.858 1.00 0.00 C ATOM 139 OE1 GLU A 10 24.489 1.687 9.835 1.00 0.00 O ATOM 140 OE2 GLU A 10 23.819 0.038 8.554 1.00 0.00 O ATOM 0 H GLU A 10 24.898 4.783 5.625 1.00 0.00 H new ATOM 0 HA GLU A 10 22.655 3.112 5.347 1.00 0.00 H new ATOM 0 HB2 GLU A 10 24.604 2.372 6.556 1.00 0.00 H new ATOM 0 HB3 GLU A 10 24.519 3.728 7.662 1.00 0.00 H new ATOM 0 HG2 GLU A 10 22.498 2.885 8.675 1.00 0.00 H new ATOM 0 HG3 GLU A 10 22.316 1.658 7.437 1.00 0.00 H new ATOM 147 N GLU A 11 22.330 5.546 7.577 1.00 0.00 N ATOM 148 CA GLU A 11 21.358 6.364 8.292 1.00 0.00 C ATOM 149 C GLU A 11 20.350 6.963 7.323 1.00 0.00 C ATOM 150 O GLU A 11 19.153 7.028 7.607 1.00 0.00 O ATOM 151 CB GLU A 11 22.070 7.482 9.051 1.00 0.00 C ATOM 152 CG GLU A 11 23.016 6.977 10.125 1.00 0.00 C ATOM 153 CD GLU A 11 22.287 6.362 11.297 1.00 0.00 C ATOM 154 OE1 GLU A 11 21.899 5.180 11.218 1.00 0.00 O ATOM 155 OE2 GLU A 11 22.095 7.064 12.312 1.00 0.00 O ATOM 0 H GLU A 11 23.302 5.801 7.754 1.00 0.00 H new ATOM 0 HA GLU A 11 20.829 5.728 9.002 1.00 0.00 H new ATOM 0 HB2 GLU A 11 22.630 8.092 8.342 1.00 0.00 H new ATOM 0 HB3 GLU A 11 21.324 8.131 9.511 1.00 0.00 H new ATOM 0 HG2 GLU A 11 23.690 6.238 9.692 1.00 0.00 H new ATOM 0 HG3 GLU A 11 23.633 7.803 10.478 1.00 0.00 H new ATOM 162 N ARG A 12 20.853 7.378 6.167 1.00 0.00 N ATOM 163 CA ARG A 12 20.021 7.958 5.127 1.00 0.00 C ATOM 164 C ARG A 12 19.008 6.943 4.610 1.00 0.00 C ATOM 165 O ARG A 12 17.836 7.266 4.415 1.00 0.00 O ATOM 166 CB ARG A 12 20.900 8.451 3.976 1.00 0.00 C ATOM 167 CG ARG A 12 20.120 9.084 2.837 1.00 0.00 C ATOM 168 CD ARG A 12 19.424 10.356 3.281 1.00 0.00 C ATOM 169 NE ARG A 12 18.634 10.943 2.206 1.00 0.00 N ATOM 170 CZ ARG A 12 18.437 12.247 2.050 1.00 0.00 C ATOM 171 NH1 ARG A 12 18.961 13.109 2.911 1.00 0.00 N ATOM 172 NH2 ARG A 12 17.708 12.687 1.034 1.00 0.00 N ATOM 0 H ARG A 12 21.843 7.322 5.927 1.00 0.00 H new ATOM 0 HA ARG A 12 19.474 8.799 5.552 1.00 0.00 H new ATOM 0 HB2 ARG A 12 21.615 9.178 4.362 1.00 0.00 H new ATOM 0 HB3 ARG A 12 21.477 7.612 3.587 1.00 0.00 H new ATOM 0 HG2 ARG A 12 20.796 9.307 2.011 1.00 0.00 H new ATOM 0 HG3 ARG A 12 19.381 8.375 2.462 1.00 0.00 H new ATOM 0 HD2 ARG A 12 18.777 10.139 4.131 1.00 0.00 H new ATOM 0 HD3 ARG A 12 20.167 11.077 3.622 1.00 0.00 H new ATOM 0 HE ARG A 12 18.205 10.311 1.530 1.00 0.00 H new ATOM 0 HH11 ARG A 12 19.517 12.771 3.696 1.00 0.00 H new ATOM 0 HH12 ARG A 12 18.808 14.110 2.788 1.00 0.00 H new ATOM 0 HH21 ARG A 12 17.300 12.025 0.374 1.00 0.00 H new ATOM 0 HH22 ARG A 12 17.555 13.688 0.912 1.00 0.00 H new ATOM 186 N TYR A 13 19.464 5.713 4.397 1.00 0.00 N ATOM 187 CA TYR A 13 18.607 4.664 3.877 1.00 0.00 C ATOM 188 C TYR A 13 17.584 4.220 4.917 1.00 0.00 C ATOM 189 O TYR A 13 16.395 4.147 4.625 1.00 0.00 O ATOM 190 CB TYR A 13 19.438 3.465 3.407 1.00 0.00 C ATOM 191 CG TYR A 13 18.603 2.241 3.130 1.00 0.00 C ATOM 192 CD1 TYR A 13 17.548 2.292 2.232 1.00 0.00 C ATOM 193 CD2 TYR A 13 18.856 1.045 3.784 1.00 0.00 C ATOM 194 CE1 TYR A 13 16.762 1.186 1.997 1.00 0.00 C ATOM 195 CE2 TYR A 13 18.079 -0.070 3.550 1.00 0.00 C ATOM 196 CZ TYR A 13 17.030 0.006 2.656 1.00 0.00 C ATOM 197 OH TYR A 13 16.242 -1.098 2.430 1.00 0.00 O ATOM 0 H TYR A 13 20.425 5.422 4.578 1.00 0.00 H new ATOM 0 HA TYR A 13 18.069 5.072 3.022 1.00 0.00 H new ATOM 0 HB2 TYR A 13 19.982 3.739 2.503 1.00 0.00 H new ATOM 0 HB3 TYR A 13 20.182 3.226 4.167 1.00 0.00 H new ATOM 0 HD1 TYR A 13 17.339 3.213 1.709 1.00 0.00 H new ATOM 0 HD2 TYR A 13 19.674 0.986 4.487 1.00 0.00 H new ATOM 0 HE1 TYR A 13 15.939 1.243 1.299 1.00 0.00 H new ATOM 0 HE2 TYR A 13 18.290 -0.997 4.063 1.00 0.00 H new ATOM 0 HH TYR A 13 16.566 -1.848 2.972 1.00 0.00 H new ATOM 207 N GLN A 14 18.050 3.923 6.122 1.00 0.00 N ATOM 208 CA GLN A 14 17.176 3.462 7.198 1.00 0.00 C ATOM 209 C GLN A 14 15.996 4.403 7.411 1.00 0.00 C ATOM 210 O GLN A 14 14.838 3.985 7.398 1.00 0.00 O ATOM 211 CB GLN A 14 17.963 3.339 8.496 1.00 0.00 C ATOM 212 CG GLN A 14 19.084 2.317 8.434 1.00 0.00 C ATOM 213 CD GLN A 14 19.455 1.774 9.798 1.00 0.00 C ATOM 214 OE1 GLN A 14 19.298 2.450 10.815 1.00 0.00 O ATOM 215 NE2 GLN A 14 19.954 0.549 9.831 1.00 0.00 N ATOM 0 H GLN A 14 19.034 3.993 6.382 1.00 0.00 H new ATOM 0 HA GLN A 14 16.786 2.487 6.906 1.00 0.00 H new ATOM 0 HB2 GLN A 14 18.384 4.312 8.749 1.00 0.00 H new ATOM 0 HB3 GLN A 14 17.280 3.068 9.301 1.00 0.00 H new ATOM 0 HG2 GLN A 14 18.783 1.492 7.789 1.00 0.00 H new ATOM 0 HG3 GLN A 14 19.962 2.774 7.978 1.00 0.00 H new ATOM 0 HE21 GLN A 14 20.068 0.021 8.966 1.00 0.00 H new ATOM 0 HE22 GLN A 14 20.224 0.132 10.722 1.00 0.00 H new ATOM 224 N LYS A 15 16.289 5.673 7.618 1.00 0.00 N ATOM 225 CA LYS A 15 15.247 6.664 7.801 1.00 0.00 C ATOM 226 C LYS A 15 14.406 6.830 6.537 1.00 0.00 C ATOM 227 O LYS A 15 13.246 7.225 6.606 1.00 0.00 O ATOM 228 CB LYS A 15 15.840 8.001 8.238 1.00 0.00 C ATOM 229 CG LYS A 15 16.487 7.935 9.609 1.00 0.00 C ATOM 230 CD LYS A 15 15.451 7.693 10.697 1.00 0.00 C ATOM 231 CE LYS A 15 16.085 7.124 11.952 1.00 0.00 C ATOM 232 NZ LYS A 15 15.108 7.004 13.065 1.00 0.00 N ATOM 0 H LYS A 15 17.239 6.042 7.663 1.00 0.00 H new ATOM 0 HA LYS A 15 14.587 6.307 8.592 1.00 0.00 H new ATOM 0 HB2 LYS A 15 16.581 8.321 7.506 1.00 0.00 H new ATOM 0 HB3 LYS A 15 15.054 8.756 8.248 1.00 0.00 H new ATOM 0 HG2 LYS A 15 17.229 7.136 9.626 1.00 0.00 H new ATOM 0 HG3 LYS A 15 17.017 8.866 9.809 1.00 0.00 H new ATOM 0 HD2 LYS A 15 14.947 8.629 10.935 1.00 0.00 H new ATOM 0 HD3 LYS A 15 14.689 7.006 10.329 1.00 0.00 H new ATOM 0 HE2 LYS A 15 16.506 6.143 11.732 1.00 0.00 H new ATOM 0 HE3 LYS A 15 16.911 7.764 12.262 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 15.583 6.611 13.903 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 14.724 7.943 13.293 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 14.332 6.373 12.779 1.00 0.00 H new ATOM 246 N LEU A 16 14.985 6.501 5.389 1.00 0.00 N ATOM 247 CA LEU A 16 14.261 6.565 4.127 1.00 0.00 C ATOM 248 C LEU A 16 13.181 5.495 4.085 1.00 0.00 C ATOM 249 O LEU A 16 12.045 5.765 3.697 1.00 0.00 O ATOM 250 CB LEU A 16 15.217 6.387 2.948 1.00 0.00 C ATOM 251 CG LEU A 16 14.653 6.750 1.577 1.00 0.00 C ATOM 252 CD1 LEU A 16 14.068 8.153 1.596 1.00 0.00 C ATOM 253 CD2 LEU A 16 15.749 6.639 0.537 1.00 0.00 C ATOM 0 H LEU A 16 15.952 6.188 5.306 1.00 0.00 H new ATOM 0 HA LEU A 16 13.792 7.546 4.050 1.00 0.00 H new ATOM 0 HB2 LEU A 16 16.104 6.995 3.128 1.00 0.00 H new ATOM 0 HB3 LEU A 16 15.543 5.347 2.922 1.00 0.00 H new ATOM 0 HG LEU A 16 13.851 6.057 1.323 1.00 0.00 H new ATOM 0 HD11 LEU A 16 13.671 8.395 0.610 1.00 0.00 H new ATOM 0 HD12 LEU A 16 13.266 8.203 2.333 1.00 0.00 H new ATOM 0 HD13 LEU A 16 14.847 8.869 1.859 1.00 0.00 H new ATOM 0 HD21 LEU A 16 15.348 6.898 -0.443 1.00 0.00 H new ATOM 0 HD22 LEU A 16 16.560 7.322 0.789 1.00 0.00 H new ATOM 0 HD23 LEU A 16 16.128 5.617 0.516 1.00 0.00 H new ATOM 265 N VAL A 17 13.536 4.277 4.494 1.00 0.00 N ATOM 266 CA VAL A 17 12.561 3.194 4.567 1.00 0.00 C ATOM 267 C VAL A 17 11.484 3.568 5.569 1.00 0.00 C ATOM 268 O VAL A 17 10.321 3.231 5.401 1.00 0.00 O ATOM 269 CB VAL A 17 13.193 1.831 4.959 1.00 0.00 C ATOM 270 CG1 VAL A 17 14.604 1.734 4.428 1.00 0.00 C ATOM 271 CG2 VAL A 17 13.168 1.590 6.464 1.00 0.00 C ATOM 0 H VAL A 17 14.482 4.019 4.777 1.00 0.00 H new ATOM 0 HA VAL A 17 12.138 3.066 3.570 1.00 0.00 H new ATOM 0 HB VAL A 17 12.585 1.050 4.502 1.00 0.00 H new ATOM 0 HG11 VAL A 17 15.034 0.773 4.711 1.00 0.00 H new ATOM 0 HG12 VAL A 17 14.591 1.820 3.341 1.00 0.00 H new ATOM 0 HG13 VAL A 17 15.207 2.539 4.848 1.00 0.00 H new ATOM 0 HG21 VAL A 17 13.621 0.624 6.685 1.00 0.00 H new ATOM 0 HG22 VAL A 17 13.728 2.378 6.968 1.00 0.00 H new ATOM 0 HG23 VAL A 17 12.137 1.596 6.816 1.00 0.00 H new ATOM 281 N THR A 18 11.891 4.302 6.594 1.00 0.00 N ATOM 282 CA THR A 18 10.992 4.795 7.588 1.00 0.00 C ATOM 283 C THR A 18 9.941 5.684 6.935 1.00 0.00 C ATOM 284 O THR A 18 8.744 5.407 7.013 1.00 0.00 O ATOM 285 CB THR A 18 11.796 5.573 8.636 1.00 0.00 C ATOM 286 OG1 THR A 18 12.598 4.673 9.409 1.00 0.00 O ATOM 287 CG2 THR A 18 10.892 6.365 9.533 1.00 0.00 C ATOM 0 H THR A 18 12.864 4.566 6.747 1.00 0.00 H new ATOM 0 HA THR A 18 10.477 3.968 8.077 1.00 0.00 H new ATOM 0 HB THR A 18 12.449 6.272 8.113 1.00 0.00 H new ATOM 0 HG1 THR A 18 13.361 4.372 8.873 1.00 0.00 H new ATOM 0 HG21 THR A 18 11.490 6.906 10.266 1.00 0.00 H new ATOM 0 HG22 THR A 18 10.319 7.075 8.937 1.00 0.00 H new ATOM 0 HG23 THR A 18 10.209 5.690 10.049 1.00 0.00 H new ATOM 295 N GLU A 19 10.415 6.714 6.241 1.00 0.00 N ATOM 296 CA GLU A 19 9.547 7.639 5.525 1.00 0.00 C ATOM 297 C GLU A 19 8.641 6.897 4.560 1.00 0.00 C ATOM 298 O GLU A 19 7.478 7.254 4.386 1.00 0.00 O ATOM 299 CB GLU A 19 10.394 8.651 4.758 1.00 0.00 C ATOM 300 CG GLU A 19 11.282 9.476 5.674 1.00 0.00 C ATOM 301 CD GLU A 19 12.101 10.515 4.940 1.00 0.00 C ATOM 302 OE1 GLU A 19 13.256 10.223 4.570 1.00 0.00 O ATOM 303 OE2 GLU A 19 11.602 11.643 4.746 1.00 0.00 O ATOM 0 H GLU A 19 11.409 6.929 6.160 1.00 0.00 H new ATOM 0 HA GLU A 19 8.924 8.158 6.253 1.00 0.00 H new ATOM 0 HB2 GLU A 19 11.014 8.125 4.032 1.00 0.00 H new ATOM 0 HB3 GLU A 19 9.739 9.316 4.195 1.00 0.00 H new ATOM 0 HG2 GLU A 19 10.661 9.973 6.419 1.00 0.00 H new ATOM 0 HG3 GLU A 19 11.954 8.809 6.214 1.00 0.00 H new ATOM 310 N ASN A 20 9.192 5.857 3.963 1.00 0.00 N ATOM 311 CA ASN A 20 8.506 5.074 2.949 1.00 0.00 C ATOM 312 C ASN A 20 7.394 4.210 3.552 1.00 0.00 C ATOM 313 O ASN A 20 6.337 4.057 2.957 1.00 0.00 O ATOM 314 CB ASN A 20 9.532 4.202 2.228 1.00 0.00 C ATOM 315 CG ASN A 20 9.005 3.561 0.963 1.00 0.00 C ATOM 316 OD1 ASN A 20 8.081 4.064 0.329 1.00 0.00 O ATOM 317 ND2 ASN A 20 9.616 2.452 0.578 1.00 0.00 N ATOM 0 H ASN A 20 10.135 5.528 4.169 1.00 0.00 H new ATOM 0 HA ASN A 20 8.029 5.754 2.243 1.00 0.00 H new ATOM 0 HB2 ASN A 20 10.403 4.810 1.981 1.00 0.00 H new ATOM 0 HB3 ASN A 20 9.872 3.420 2.907 1.00 0.00 H new ATOM 0 HD21 ASN A 20 9.324 1.979 -0.277 1.00 0.00 H new ATOM 0 HD22 ASN A 20 10.379 2.070 1.136 1.00 0.00 H new ATOM 324 N GLU A 21 7.626 3.639 4.726 1.00 0.00 N ATOM 325 CA GLU A 21 6.626 2.789 5.359 1.00 0.00 C ATOM 326 C GLU A 21 5.541 3.597 6.070 1.00 0.00 C ATOM 327 O GLU A 21 4.380 3.177 6.103 1.00 0.00 O ATOM 328 CB GLU A 21 7.309 1.867 6.350 1.00 0.00 C ATOM 329 CG GLU A 21 8.441 1.085 5.727 1.00 0.00 C ATOM 330 CD GLU A 21 7.985 -0.152 4.992 1.00 0.00 C ATOM 331 OE1 GLU A 21 8.529 -0.431 3.905 1.00 0.00 O ATOM 332 OE2 GLU A 21 7.090 -0.857 5.499 1.00 0.00 O ATOM 0 H GLU A 21 8.491 3.747 5.256 1.00 0.00 H new ATOM 0 HA GLU A 21 6.137 2.211 4.575 1.00 0.00 H new ATOM 0 HB2 GLU A 21 7.693 2.455 7.183 1.00 0.00 H new ATOM 0 HB3 GLU A 21 6.576 1.173 6.761 1.00 0.00 H new ATOM 0 HG2 GLU A 21 8.981 1.731 5.035 1.00 0.00 H new ATOM 0 HG3 GLU A 21 9.145 0.796 6.507 1.00 0.00 H new ATOM 339 N GLN A 22 5.916 4.742 6.642 1.00 0.00 N ATOM 340 CA GLN A 22 4.965 5.580 7.382 1.00 0.00 C ATOM 341 C GLN A 22 3.757 5.911 6.529 1.00 0.00 C ATOM 342 O GLN A 22 2.616 5.612 6.891 1.00 0.00 O ATOM 343 CB GLN A 22 5.603 6.897 7.825 1.00 0.00 C ATOM 344 CG GLN A 22 6.811 6.737 8.736 1.00 0.00 C ATOM 345 CD GLN A 22 7.463 8.064 9.075 1.00 0.00 C ATOM 346 OE1 GLN A 22 8.359 8.526 8.371 1.00 0.00 O ATOM 347 NE2 GLN A 22 7.021 8.683 10.158 1.00 0.00 N ATOM 0 H GLN A 22 6.866 5.111 6.609 1.00 0.00 H new ATOM 0 HA GLN A 22 4.663 5.006 8.258 1.00 0.00 H new ATOM 0 HB2 GLN A 22 5.903 7.457 6.939 1.00 0.00 H new ATOM 0 HB3 GLN A 22 4.852 7.495 8.341 1.00 0.00 H new ATOM 0 HG2 GLN A 22 6.504 6.241 9.657 1.00 0.00 H new ATOM 0 HG3 GLN A 22 7.543 6.089 8.253 1.00 0.00 H new ATOM 0 HE21 GLN A 22 6.275 8.266 10.715 1.00 0.00 H new ATOM 0 HE22 GLN A 22 7.426 9.577 10.435 1.00 0.00 H new ATOM 356 N LEU A 23 4.015 6.517 5.384 1.00 0.00 N ATOM 357 CA LEU A 23 2.950 7.026 4.551 1.00 0.00 C ATOM 358 C LEU A 23 2.264 5.902 3.781 1.00 0.00 C ATOM 359 O LEU A 23 1.143 6.071 3.323 1.00 0.00 O ATOM 360 CB LEU A 23 3.465 8.151 3.643 1.00 0.00 C ATOM 361 CG LEU A 23 4.162 7.768 2.334 1.00 0.00 C ATOM 362 CD1 LEU A 23 4.744 9.012 1.698 1.00 0.00 C ATOM 363 CD2 LEU A 23 5.251 6.739 2.540 1.00 0.00 C ATOM 0 H LEU A 23 4.953 6.667 5.013 1.00 0.00 H new ATOM 0 HA LEU A 23 2.184 7.464 5.190 1.00 0.00 H new ATOM 0 HB2 LEU A 23 2.618 8.790 3.394 1.00 0.00 H new ATOM 0 HB3 LEU A 23 4.161 8.756 4.225 1.00 0.00 H new ATOM 0 HG LEU A 23 3.416 7.318 1.679 1.00 0.00 H new ATOM 0 HD11 LEU A 23 5.242 8.745 0.766 1.00 0.00 H new ATOM 0 HD12 LEU A 23 3.944 9.723 1.492 1.00 0.00 H new ATOM 0 HD13 LEU A 23 5.466 9.465 2.378 1.00 0.00 H new ATOM 0 HD21 LEU A 23 5.714 6.502 1.582 1.00 0.00 H new ATOM 0 HD22 LEU A 23 6.005 7.138 3.218 1.00 0.00 H new ATOM 0 HD23 LEU A 23 4.820 5.834 2.969 1.00 0.00 H new ATOM 375 N GLN A 24 2.931 4.751 3.660 1.00 0.00 N ATOM 376 CA GLN A 24 2.273 3.543 3.158 1.00 0.00 C ATOM 377 C GLN A 24 1.015 3.272 3.972 1.00 0.00 C ATOM 378 O GLN A 24 -0.067 3.045 3.430 1.00 0.00 O ATOM 379 CB GLN A 24 3.190 2.320 3.238 1.00 0.00 C ATOM 380 CG GLN A 24 4.228 2.251 2.138 1.00 0.00 C ATOM 381 CD GLN A 24 4.705 0.837 1.861 1.00 0.00 C ATOM 382 OE1 GLN A 24 4.105 0.114 1.066 1.00 0.00 O ATOM 383 NE2 GLN A 24 5.807 0.446 2.478 1.00 0.00 N ATOM 0 H GLN A 24 3.915 4.631 3.900 1.00 0.00 H new ATOM 0 HA GLN A 24 2.023 3.714 2.111 1.00 0.00 H new ATOM 0 HB2 GLN A 24 3.698 2.323 4.202 1.00 0.00 H new ATOM 0 HB3 GLN A 24 2.579 1.418 3.203 1.00 0.00 H new ATOM 0 HG2 GLN A 24 3.810 2.673 1.224 1.00 0.00 H new ATOM 0 HG3 GLN A 24 5.082 2.870 2.413 1.00 0.00 H new ATOM 0 HE21 GLN A 24 6.276 1.074 3.130 1.00 0.00 H new ATOM 0 HE22 GLN A 24 6.188 -0.484 2.301 1.00 0.00 H new ATOM 392 N ARG A 25 1.176 3.335 5.284 1.00 0.00 N ATOM 393 CA ARG A 25 0.086 3.134 6.213 1.00 0.00 C ATOM 394 C ARG A 25 -0.950 4.244 6.056 1.00 0.00 C ATOM 395 O ARG A 25 -2.152 3.991 6.031 1.00 0.00 O ATOM 396 CB ARG A 25 0.659 3.115 7.631 1.00 0.00 C ATOM 397 CG ARG A 25 -0.185 3.851 8.649 1.00 0.00 C ATOM 398 CD ARG A 25 0.647 4.268 9.849 1.00 0.00 C ATOM 399 NE ARG A 25 -0.153 4.940 10.870 1.00 0.00 N ATOM 400 CZ ARG A 25 0.348 5.799 11.755 1.00 0.00 C ATOM 401 NH1 ARG A 25 1.647 6.077 11.760 1.00 0.00 N ATOM 402 NH2 ARG A 25 -0.451 6.375 12.638 1.00 0.00 N ATOM 0 H ARG A 25 2.072 3.528 5.732 1.00 0.00 H new ATOM 0 HA ARG A 25 -0.413 2.186 6.011 1.00 0.00 H new ATOM 0 HB2 ARG A 25 0.774 2.079 7.951 1.00 0.00 H new ATOM 0 HB3 ARG A 25 1.656 3.556 7.614 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -0.631 4.732 8.188 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.006 3.212 8.976 1.00 0.00 H new ATOM 0 HD2 ARG A 25 1.122 3.388 10.283 1.00 0.00 H new ATOM 0 HD3 ARG A 25 1.447 4.932 9.521 1.00 0.00 H new ATOM 0 HE ARG A 25 -1.152 4.740 10.907 1.00 0.00 H new ATOM 0 HH11 ARG A 25 2.267 5.631 11.083 1.00 0.00 H new ATOM 0 HH12 ARG A 25 2.025 6.736 12.441 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -1.448 6.161 12.640 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -0.070 7.034 13.317 1.00 0.00 H new ATOM 416 N LEU A 26 -0.464 5.470 5.925 1.00 0.00 N ATOM 417 CA LEU A 26 -1.326 6.638 5.811 1.00 0.00 C ATOM 418 C LEU A 26 -2.151 6.572 4.529 1.00 0.00 C ATOM 419 O LEU A 26 -3.296 7.025 4.488 1.00 0.00 O ATOM 420 CB LEU A 26 -0.467 7.902 5.854 1.00 0.00 C ATOM 421 CG LEU A 26 0.435 7.997 7.092 1.00 0.00 C ATOM 422 CD1 LEU A 26 1.386 9.177 6.998 1.00 0.00 C ATOM 423 CD2 LEU A 26 -0.406 8.097 8.358 1.00 0.00 C ATOM 0 H LEU A 26 0.533 5.683 5.895 1.00 0.00 H new ATOM 0 HA LEU A 26 -2.025 6.659 6.647 1.00 0.00 H new ATOM 0 HB2 LEU A 26 0.155 7.938 4.959 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -1.120 8.775 5.824 1.00 0.00 H new ATOM 0 HG LEU A 26 1.033 7.087 7.136 1.00 0.00 H new ATOM 0 HD11 LEU A 26 2.010 9.214 7.891 1.00 0.00 H new ATOM 0 HD12 LEU A 26 2.019 9.065 6.118 1.00 0.00 H new ATOM 0 HD13 LEU A 26 0.813 10.101 6.917 1.00 0.00 H new ATOM 0 HD21 LEU A 26 0.250 8.164 9.226 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -1.034 8.987 8.308 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -1.037 7.212 8.447 1.00 0.00 H new ATOM 435 N ILE A 27 -1.563 5.991 3.492 1.00 0.00 N ATOM 436 CA ILE A 27 -2.278 5.719 2.258 1.00 0.00 C ATOM 437 C ILE A 27 -3.359 4.683 2.497 1.00 0.00 C ATOM 438 O ILE A 27 -4.528 4.925 2.217 1.00 0.00 O ATOM 439 CB ILE A 27 -1.336 5.194 1.158 1.00 0.00 C ATOM 440 CG1 ILE A 27 -0.319 6.257 0.767 1.00 0.00 C ATOM 441 CG2 ILE A 27 -2.122 4.746 -0.066 1.00 0.00 C ATOM 442 CD1 ILE A 27 0.743 5.727 -0.160 1.00 0.00 C ATOM 0 H ILE A 27 -0.586 5.698 3.484 1.00 0.00 H new ATOM 0 HA ILE A 27 -2.718 6.660 1.928 1.00 0.00 H new ATOM 0 HB ILE A 27 -0.804 4.332 1.560 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -0.834 7.088 0.286 1.00 0.00 H new ATOM 0 HG13 ILE A 27 0.153 6.652 1.667 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -1.433 4.380 -0.827 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -2.809 3.948 0.215 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -2.688 5.589 -0.464 1.00 0.00 H new ATOM 0 HD11 ILE A 27 1.442 6.526 -0.407 1.00 0.00 H new ATOM 0 HD12 ILE A 27 1.280 4.914 0.329 1.00 0.00 H new ATOM 0 HD13 ILE A 27 0.277 5.357 -1.073 1.00 0.00 H new ATOM 454 N THR A 28 -2.953 3.537 3.037 1.00 0.00 N ATOM 455 CA THR A 28 -3.858 2.408 3.227 1.00 0.00 C ATOM 456 C THR A 28 -5.103 2.802 4.030 1.00 0.00 C ATOM 457 O THR A 28 -6.189 2.299 3.763 1.00 0.00 O ATOM 458 CB THR A 28 -3.145 1.200 3.894 1.00 0.00 C ATOM 459 OG1 THR A 28 -3.712 -0.026 3.415 1.00 0.00 O ATOM 460 CG2 THR A 28 -3.266 1.231 5.411 1.00 0.00 C ATOM 0 H THR A 28 -1.998 3.366 3.352 1.00 0.00 H new ATOM 0 HA THR A 28 -4.181 2.102 2.232 1.00 0.00 H new ATOM 0 HB THR A 28 -2.089 1.265 3.631 1.00 0.00 H new ATOM 0 HG1 THR A 28 -3.257 -0.784 3.838 1.00 0.00 H new ATOM 0 HG21 THR A 28 -2.753 0.368 5.835 1.00 0.00 H new ATOM 0 HG22 THR A 28 -2.813 2.146 5.793 1.00 0.00 H new ATOM 0 HG23 THR A 28 -4.319 1.202 5.693 1.00 0.00 H new ATOM 468 N GLN A 29 -4.944 3.715 4.992 1.00 0.00 N ATOM 469 CA GLN A 29 -6.067 4.181 5.804 1.00 0.00 C ATOM 470 C GLN A 29 -7.130 4.805 4.919 1.00 0.00 C ATOM 471 O GLN A 29 -8.302 4.431 4.950 1.00 0.00 O ATOM 472 CB GLN A 29 -5.599 5.230 6.811 1.00 0.00 C ATOM 473 CG GLN A 29 -4.490 4.762 7.730 1.00 0.00 C ATOM 474 CD GLN A 29 -4.937 3.687 8.698 1.00 0.00 C ATOM 475 OE1 GLN A 29 -5.396 3.979 9.800 1.00 0.00 O ATOM 476 NE2 GLN A 29 -4.798 2.434 8.297 1.00 0.00 N ATOM 0 H GLN A 29 -4.049 4.145 5.226 1.00 0.00 H new ATOM 0 HA GLN A 29 -6.479 3.322 6.333 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -5.257 6.111 6.268 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -6.450 5.540 7.417 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -3.664 4.381 7.129 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -4.108 5.614 8.293 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -4.413 2.234 7.374 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -5.076 1.668 8.911 1.00 0.00 H new ATOM 485 N LYS A 30 -6.695 5.772 4.136 1.00 0.00 N ATOM 486 CA LYS A 30 -7.576 6.482 3.228 1.00 0.00 C ATOM 487 C LYS A 30 -8.045 5.565 2.097 1.00 0.00 C ATOM 488 O LYS A 30 -9.238 5.491 1.811 1.00 0.00 O ATOM 489 CB LYS A 30 -6.857 7.715 2.671 1.00 0.00 C ATOM 490 CG LYS A 30 -6.253 8.595 3.756 1.00 0.00 C ATOM 491 CD LYS A 30 -5.524 9.793 3.169 1.00 0.00 C ATOM 492 CE LYS A 30 -4.819 10.608 4.244 1.00 0.00 C ATOM 493 NZ LYS A 30 -5.761 11.155 5.256 1.00 0.00 N ATOM 0 H LYS A 30 -5.725 6.087 4.110 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.460 6.808 3.776 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -6.068 7.392 1.992 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -7.561 8.304 2.084 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -7.041 8.941 4.425 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -5.560 8.007 4.358 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -4.794 9.451 2.435 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -6.235 10.427 2.640 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -4.079 9.982 4.743 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -4.278 11.430 3.775 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -5.246 11.784 5.905 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -6.512 11.692 4.777 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -6.185 10.373 5.795 1.00 0.00 H new ATOM 507 N GLU A 31 -7.101 4.862 1.469 1.00 0.00 N ATOM 508 CA GLU A 31 -7.398 3.930 0.386 1.00 0.00 C ATOM 509 C GLU A 31 -8.519 2.951 0.718 1.00 0.00 C ATOM 510 O GLU A 31 -9.435 2.797 -0.074 1.00 0.00 O ATOM 511 CB GLU A 31 -6.148 3.153 0.001 1.00 0.00 C ATOM 512 CG GLU A 31 -5.373 3.788 -1.134 1.00 0.00 C ATOM 513 CD GLU A 31 -6.134 3.748 -2.445 1.00 0.00 C ATOM 514 OE1 GLU A 31 -6.355 2.639 -2.981 1.00 0.00 O ATOM 515 OE2 GLU A 31 -6.513 4.821 -2.951 1.00 0.00 O ATOM 0 H GLU A 31 -6.109 4.925 1.699 1.00 0.00 H new ATOM 0 HA GLU A 31 -7.741 4.539 -0.451 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -5.499 3.068 0.872 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -6.432 2.140 -0.284 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -5.145 4.823 -0.880 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -4.420 3.272 -1.254 1.00 0.00 H new ATOM 522 N GLU A 32 -8.456 2.285 1.870 1.00 0.00 N ATOM 523 CA GLU A 32 -9.465 1.275 2.205 1.00 0.00 C ATOM 524 C GLU A 32 -10.859 1.899 2.315 1.00 0.00 C ATOM 525 O GLU A 32 -11.860 1.283 1.933 1.00 0.00 O ATOM 526 CB GLU A 32 -9.105 0.519 3.493 1.00 0.00 C ATOM 527 CG GLU A 32 -8.846 1.410 4.696 1.00 0.00 C ATOM 528 CD GLU A 32 -8.711 0.628 5.983 1.00 0.00 C ATOM 529 OE1 GLU A 32 -7.657 -0.008 6.195 1.00 0.00 O ATOM 530 OE2 GLU A 32 -9.656 0.653 6.799 1.00 0.00 O ATOM 0 H GLU A 32 -7.733 2.420 2.576 1.00 0.00 H new ATOM 0 HA GLU A 32 -9.479 0.552 1.389 1.00 0.00 H new ATOM 0 HB2 GLU A 32 -9.916 -0.169 3.734 1.00 0.00 H new ATOM 0 HB3 GLU A 32 -8.218 -0.087 3.308 1.00 0.00 H new ATOM 0 HG2 GLU A 32 -7.935 1.985 4.528 1.00 0.00 H new ATOM 0 HG3 GLU A 32 -9.662 2.126 4.795 1.00 0.00 H new ATOM 537 N LYS A 33 -10.918 3.130 2.805 1.00 0.00 N ATOM 538 CA LYS A 33 -12.183 3.840 2.918 1.00 0.00 C ATOM 539 C LYS A 33 -12.649 4.321 1.549 1.00 0.00 C ATOM 540 O LYS A 33 -13.803 4.122 1.165 1.00 0.00 O ATOM 541 CB LYS A 33 -12.043 5.020 3.875 1.00 0.00 C ATOM 542 CG LYS A 33 -11.689 4.608 5.293 1.00 0.00 C ATOM 543 CD LYS A 33 -11.557 5.811 6.211 1.00 0.00 C ATOM 544 CE LYS A 33 -11.305 5.382 7.647 1.00 0.00 C ATOM 545 NZ LYS A 33 -12.418 4.550 8.176 1.00 0.00 N ATOM 0 H LYS A 33 -10.106 3.656 3.130 1.00 0.00 H new ATOM 0 HA LYS A 33 -12.931 3.154 3.316 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -11.274 5.695 3.498 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -12.979 5.579 3.890 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -12.457 3.938 5.680 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -10.752 4.050 5.287 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -10.739 6.444 5.869 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -12.466 6.411 6.162 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -10.373 4.819 7.700 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -11.181 6.265 8.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -12.373 4.530 9.215 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -13.327 4.956 7.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -12.333 3.581 7.807 1.00 0.00 H new ATOM 559 N ILE A 34 -11.733 4.938 0.812 1.00 0.00 N ATOM 560 CA ILE A 34 -12.022 5.428 -0.529 1.00 0.00 C ATOM 561 C ILE A 34 -12.339 4.267 -1.467 1.00 0.00 C ATOM 562 O ILE A 34 -13.092 4.418 -2.426 1.00 0.00 O ATOM 563 CB ILE A 34 -10.837 6.239 -1.089 1.00 0.00 C ATOM 564 CG1 ILE A 34 -10.642 7.506 -0.266 1.00 0.00 C ATOM 565 CG2 ILE A 34 -11.065 6.589 -2.550 1.00 0.00 C ATOM 566 CD1 ILE A 34 -9.236 8.062 -0.346 1.00 0.00 C ATOM 0 H ILE A 34 -10.777 5.111 1.124 1.00 0.00 H new ATOM 0 HA ILE A 34 -12.892 6.082 -0.463 1.00 0.00 H new ATOM 0 HB ILE A 34 -9.936 5.629 -1.023 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -11.345 8.265 -0.608 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -10.883 7.295 0.776 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -10.216 7.161 -2.924 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -11.170 5.673 -3.132 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -11.973 7.184 -2.644 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -9.166 8.964 0.263 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -8.529 7.319 0.024 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -8.999 8.304 -1.382 1.00 0.00 H new ATOM 578 N ARG A 35 -11.756 3.113 -1.177 1.00 0.00 N ATOM 579 CA ARG A 35 -12.003 1.902 -1.907 1.00 0.00 C ATOM 580 C ARG A 35 -13.495 1.636 -2.015 1.00 0.00 C ATOM 581 O ARG A 35 -14.010 1.381 -3.098 1.00 0.00 O ATOM 582 CB ARG A 35 -11.321 0.756 -1.180 1.00 0.00 C ATOM 583 CG ARG A 35 -10.853 -0.333 -2.097 1.00 0.00 C ATOM 584 CD ARG A 35 -10.260 -1.495 -1.322 1.00 0.00 C ATOM 585 NE ARG A 35 -9.930 -2.623 -2.188 1.00 0.00 N ATOM 586 CZ ARG A 35 -9.778 -3.873 -1.753 1.00 0.00 C ATOM 587 NH1 ARG A 35 -9.866 -4.140 -0.455 1.00 0.00 N ATOM 588 NH2 ARG A 35 -9.514 -4.850 -2.612 1.00 0.00 N ATOM 0 H ARG A 35 -11.089 3.002 -0.413 1.00 0.00 H new ATOM 0 HA ARG A 35 -11.605 1.997 -2.917 1.00 0.00 H new ATOM 0 HB2 ARG A 35 -10.468 1.144 -0.623 1.00 0.00 H new ATOM 0 HB3 ARG A 35 -12.013 0.335 -0.450 1.00 0.00 H new ATOM 0 HG2 ARG A 35 -11.689 -0.686 -2.701 1.00 0.00 H new ATOM 0 HG3 ARG A 35 -10.108 0.065 -2.786 1.00 0.00 H new ATOM 0 HD2 ARG A 35 -9.361 -1.162 -0.803 1.00 0.00 H new ATOM 0 HD3 ARG A 35 -10.967 -1.820 -0.559 1.00 0.00 H new ATOM 0 HE ARG A 35 -9.809 -2.444 -3.185 1.00 0.00 H new ATOM 0 HH11 ARG A 35 -10.050 -3.388 0.209 1.00 0.00 H new ATOM 0 HH12 ARG A 35 -9.750 -5.097 -0.122 1.00 0.00 H new ATOM 0 HH21 ARG A 35 -9.427 -4.644 -3.607 1.00 0.00 H new ATOM 0 HH22 ARG A 35 -9.398 -5.806 -2.277 1.00 0.00 H new ATOM 602 N VAL A 36 -14.189 1.720 -0.892 1.00 0.00 N ATOM 603 CA VAL A 36 -15.626 1.499 -0.882 1.00 0.00 C ATOM 604 C VAL A 36 -16.342 2.598 -1.667 1.00 0.00 C ATOM 605 O VAL A 36 -17.311 2.340 -2.384 1.00 0.00 O ATOM 606 CB VAL A 36 -16.187 1.448 0.549 1.00 0.00 C ATOM 607 CG1 VAL A 36 -17.582 0.849 0.539 1.00 0.00 C ATOM 608 CG2 VAL A 36 -15.261 0.662 1.465 1.00 0.00 C ATOM 0 H VAL A 36 -13.784 1.938 0.019 1.00 0.00 H new ATOM 0 HA VAL A 36 -15.805 0.533 -1.355 1.00 0.00 H new ATOM 0 HB VAL A 36 -16.250 2.465 0.937 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -17.971 0.817 1.557 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -18.237 1.462 -0.081 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -17.541 -0.162 0.134 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -15.678 0.639 2.472 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -15.159 -0.357 1.092 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -14.282 1.140 1.489 1.00 0.00 H new ATOM 618 N LEU A 37 -15.843 3.822 -1.539 1.00 0.00 N ATOM 619 CA LEU A 37 -16.401 4.967 -2.257 1.00 0.00 C ATOM 620 C LEU A 37 -16.241 4.796 -3.760 1.00 0.00 C ATOM 621 O LEU A 37 -17.158 5.082 -4.523 1.00 0.00 O ATOM 622 CB LEU A 37 -15.726 6.272 -1.817 1.00 0.00 C ATOM 623 CG LEU A 37 -16.306 6.945 -0.566 1.00 0.00 C ATOM 624 CD1 LEU A 37 -17.569 7.719 -0.911 1.00 0.00 C ATOM 625 CD2 LEU A 37 -16.592 5.921 0.521 1.00 0.00 C ATOM 0 H LEU A 37 -15.048 4.050 -0.942 1.00 0.00 H new ATOM 0 HA LEU A 37 -17.463 5.018 -2.016 1.00 0.00 H new ATOM 0 HB2 LEU A 37 -14.670 6.069 -1.639 1.00 0.00 H new ATOM 0 HB3 LEU A 37 -15.779 6.981 -2.643 1.00 0.00 H new ATOM 0 HG LEU A 37 -15.562 7.645 -0.186 1.00 0.00 H new ATOM 0 HD11 LEU A 37 -17.965 8.189 -0.011 1.00 0.00 H new ATOM 0 HD12 LEU A 37 -17.335 8.487 -1.648 1.00 0.00 H new ATOM 0 HD13 LEU A 37 -18.313 7.037 -1.322 1.00 0.00 H new ATOM 0 HD21 LEU A 37 -17.002 6.425 1.396 1.00 0.00 H new ATOM 0 HD22 LEU A 37 -17.312 5.190 0.152 1.00 0.00 H new ATOM 0 HD23 LEU A 37 -15.667 5.413 0.795 1.00 0.00 H new ATOM 637 N ARG A 38 -15.077 4.324 -4.181 1.00 0.00 N ATOM 638 CA ARG A 38 -14.795 4.165 -5.599 1.00 0.00 C ATOM 639 C ARG A 38 -15.636 3.050 -6.182 1.00 0.00 C ATOM 640 O ARG A 38 -16.057 3.128 -7.323 1.00 0.00 O ATOM 641 CB ARG A 38 -13.303 3.931 -5.844 1.00 0.00 C ATOM 642 CG ARG A 38 -12.780 2.548 -5.496 1.00 0.00 C ATOM 643 CD ARG A 38 -11.271 2.472 -5.697 1.00 0.00 C ATOM 644 NE ARG A 38 -10.587 3.647 -5.148 1.00 0.00 N ATOM 645 CZ ARG A 38 -9.402 3.620 -4.533 1.00 0.00 C ATOM 646 NH1 ARG A 38 -8.745 2.479 -4.370 1.00 0.00 N ATOM 647 NH2 ARG A 38 -8.864 4.749 -4.095 1.00 0.00 N ATOM 0 H ARG A 38 -14.315 4.045 -3.563 1.00 0.00 H new ATOM 0 HA ARG A 38 -15.063 5.091 -6.109 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -13.093 4.123 -6.896 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -12.741 4.666 -5.268 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -13.026 2.312 -4.461 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -13.272 1.801 -6.119 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -10.886 1.571 -5.219 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -11.050 2.387 -6.761 1.00 0.00 H new ATOM 0 HE ARG A 38 -11.050 4.551 -5.243 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -9.144 1.607 -4.717 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -7.841 2.474 -3.898 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -9.355 5.633 -4.228 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -7.959 4.734 -3.625 1.00 0.00 H new ATOM 661 N GLN A 39 -15.880 2.021 -5.383 1.00 0.00 N ATOM 662 CA GLN A 39 -16.839 0.976 -5.741 1.00 0.00 C ATOM 663 C GLN A 39 -18.214 1.570 -6.007 1.00 0.00 C ATOM 664 O GLN A 39 -18.903 1.182 -6.951 1.00 0.00 O ATOM 665 CB GLN A 39 -16.944 -0.050 -4.623 1.00 0.00 C ATOM 666 CG GLN A 39 -15.639 -0.748 -4.332 1.00 0.00 C ATOM 667 CD GLN A 39 -15.157 -1.571 -5.508 1.00 0.00 C ATOM 668 OE1 GLN A 39 -14.419 -1.080 -6.364 1.00 0.00 O ATOM 669 NE2 GLN A 39 -15.579 -2.821 -5.571 1.00 0.00 N ATOM 0 H GLN A 39 -15.428 1.884 -4.479 1.00 0.00 H new ATOM 0 HA GLN A 39 -16.481 0.491 -6.649 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -17.294 0.444 -3.717 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -17.695 -0.794 -4.891 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -14.882 -0.007 -4.074 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -15.761 -1.395 -3.463 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -16.189 -3.191 -4.842 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -15.294 -3.417 -6.348 1.00 0.00 H new ATOM 678 N ARG A 40 -18.610 2.504 -5.161 1.00 0.00 N ATOM 679 CA ARG A 40 -19.850 3.227 -5.348 1.00 0.00 C ATOM 680 C ARG A 40 -19.801 4.036 -6.637 1.00 0.00 C ATOM 681 O ARG A 40 -20.763 4.075 -7.404 1.00 0.00 O ATOM 682 CB ARG A 40 -20.089 4.142 -4.153 1.00 0.00 C ATOM 683 CG ARG A 40 -20.444 3.385 -2.884 1.00 0.00 C ATOM 684 CD ARG A 40 -20.523 4.301 -1.672 1.00 0.00 C ATOM 685 NE ARG A 40 -21.661 5.216 -1.730 1.00 0.00 N ATOM 686 CZ ARG A 40 -22.418 5.531 -0.675 1.00 0.00 C ATOM 687 NH1 ARG A 40 -22.192 4.962 0.504 1.00 0.00 N ATOM 688 NH2 ARG A 40 -23.406 6.409 -0.804 1.00 0.00 N ATOM 0 H ARG A 40 -18.084 2.780 -4.332 1.00 0.00 H new ATOM 0 HA ARG A 40 -20.673 2.516 -5.423 1.00 0.00 H new ATOM 0 HB2 ARG A 40 -19.194 4.738 -3.975 1.00 0.00 H new ATOM 0 HB3 ARG A 40 -20.894 4.838 -4.391 1.00 0.00 H new ATOM 0 HG2 ARG A 40 -21.401 2.881 -3.019 1.00 0.00 H new ATOM 0 HG3 ARG A 40 -19.698 2.611 -2.704 1.00 0.00 H new ATOM 0 HD2 ARG A 40 -20.594 3.696 -0.768 1.00 0.00 H new ATOM 0 HD3 ARG A 40 -19.601 4.878 -1.597 1.00 0.00 H new ATOM 0 HE ARG A 40 -21.891 5.639 -2.629 1.00 0.00 H new ATOM 0 HH11 ARG A 40 -21.438 4.282 0.606 1.00 0.00 H new ATOM 0 HH12 ARG A 40 -22.772 5.205 1.307 1.00 0.00 H new ATOM 0 HH21 ARG A 40 -23.587 6.843 -1.709 1.00 0.00 H new ATOM 0 HH22 ARG A 40 -23.983 6.649 0.002 1.00 0.00 H new ATOM 702 N LEU A 41 -18.670 4.679 -6.878 1.00 0.00 N ATOM 703 CA LEU A 41 -18.486 5.435 -8.109 1.00 0.00 C ATOM 704 C LEU A 41 -18.335 4.497 -9.307 1.00 0.00 C ATOM 705 O LEU A 41 -18.467 4.920 -10.448 1.00 0.00 O ATOM 706 CB LEU A 41 -17.270 6.355 -8.049 1.00 0.00 C ATOM 707 CG LEU A 41 -16.985 7.038 -6.712 1.00 0.00 C ATOM 708 CD1 LEU A 41 -15.734 7.893 -6.825 1.00 0.00 C ATOM 709 CD2 LEU A 41 -18.162 7.882 -6.249 1.00 0.00 C ATOM 0 H LEU A 41 -17.871 4.694 -6.244 1.00 0.00 H new ATOM 0 HA LEU A 41 -19.379 6.050 -8.226 1.00 0.00 H new ATOM 0 HB2 LEU A 41 -16.391 5.774 -8.327 1.00 0.00 H new ATOM 0 HB3 LEU A 41 -17.393 7.129 -8.806 1.00 0.00 H new ATOM 0 HG LEU A 41 -16.826 6.261 -5.965 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -15.537 8.377 -5.869 1.00 0.00 H new ATOM 0 HD12 LEU A 41 -14.886 7.263 -7.095 1.00 0.00 H new ATOM 0 HD13 LEU A 41 -15.881 8.653 -7.593 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -17.920 8.351 -5.295 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -18.370 8.653 -6.990 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -19.040 7.247 -6.129 1.00 0.00 H new ATOM 721 N VAL A 42 -18.028 3.233 -9.053 1.00 0.00 N ATOM 722 CA VAL A 42 -18.034 2.221 -10.102 1.00 0.00 C ATOM 723 C VAL A 42 -19.438 2.105 -10.679 1.00 0.00 C ATOM 724 O VAL A 42 -19.628 1.932 -11.883 1.00 0.00 O ATOM 725 CB VAL A 42 -17.574 0.847 -9.557 1.00 0.00 C ATOM 726 CG1 VAL A 42 -17.905 -0.272 -10.522 1.00 0.00 C ATOM 727 CG2 VAL A 42 -16.085 0.851 -9.251 1.00 0.00 C ATOM 0 H VAL A 42 -17.772 2.883 -8.130 1.00 0.00 H new ATOM 0 HA VAL A 42 -17.335 2.524 -10.882 1.00 0.00 H new ATOM 0 HB VAL A 42 -18.119 0.669 -8.630 1.00 0.00 H new ATOM 0 HG11 VAL A 42 -17.568 -1.222 -10.107 1.00 0.00 H new ATOM 0 HG12 VAL A 42 -18.983 -0.308 -10.682 1.00 0.00 H new ATOM 0 HG13 VAL A 42 -17.403 -0.093 -11.473 1.00 0.00 H new ATOM 0 HG21 VAL A 42 -15.789 -0.126 -8.870 1.00 0.00 H new ATOM 0 HG22 VAL A 42 -15.527 1.069 -10.162 1.00 0.00 H new ATOM 0 HG23 VAL A 42 -15.870 1.613 -8.502 1.00 0.00 H new ATOM 737 N GLU A 43 -20.416 2.241 -9.800 1.00 0.00 N ATOM 738 CA GLU A 43 -21.813 2.209 -10.189 1.00 0.00 C ATOM 739 C GLU A 43 -22.229 3.527 -10.837 1.00 0.00 C ATOM 740 O GLU A 43 -23.285 3.612 -11.464 1.00 0.00 O ATOM 741 CB GLU A 43 -22.688 1.932 -8.972 1.00 0.00 C ATOM 742 CG GLU A 43 -22.306 0.667 -8.228 1.00 0.00 C ATOM 743 CD GLU A 43 -23.236 0.383 -7.072 1.00 0.00 C ATOM 744 OE1 GLU A 43 -24.318 -0.193 -7.310 1.00 0.00 O ATOM 745 OE2 GLU A 43 -22.899 0.736 -5.923 1.00 0.00 O ATOM 0 H GLU A 43 -20.264 2.376 -8.801 1.00 0.00 H new ATOM 0 HA GLU A 43 -21.945 1.410 -10.918 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -22.625 2.779 -8.289 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -23.727 1.857 -9.291 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -22.319 -0.177 -8.918 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -21.285 0.760 -7.857 1.00 0.00 H new ATOM 752 N ARG A 44 -21.407 4.561 -10.671 1.00 0.00 N ATOM 753 CA ARG A 44 -21.674 5.847 -11.287 1.00 0.00 C ATOM 754 C ARG A 44 -20.962 5.921 -12.634 1.00 0.00 C ATOM 755 O ARG A 44 -21.430 6.554 -13.578 1.00 0.00 O ATOM 756 CB ARG A 44 -21.220 6.986 -10.368 1.00 0.00 C ATOM 757 CG ARG A 44 -19.872 7.549 -10.722 1.00 0.00 C ATOM 758 CD ARG A 44 -19.660 8.928 -10.120 1.00 0.00 C ATOM 759 NE ARG A 44 -18.382 9.511 -10.516 1.00 0.00 N ATOM 760 CZ ARG A 44 -18.006 10.752 -10.220 1.00 0.00 C ATOM 761 NH1 ARG A 44 -18.828 11.558 -9.559 1.00 0.00 N ATOM 762 NH2 ARG A 44 -16.810 11.186 -10.592 1.00 0.00 N ATOM 0 H ARG A 44 -20.553 4.528 -10.115 1.00 0.00 H new ATOM 0 HA ARG A 44 -22.747 5.954 -11.447 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -21.959 7.786 -10.404 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -21.194 6.623 -9.341 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -19.092 6.874 -10.368 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -19.776 7.607 -11.806 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -20.470 9.587 -10.431 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -19.705 8.859 -9.033 1.00 0.00 H new ATOM 0 HE ARG A 44 -17.737 8.931 -11.053 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -19.750 11.226 -9.277 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -18.537 12.509 -9.333 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -16.180 10.569 -11.104 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -16.520 12.137 -10.366 1.00 0.00 H new ATOM 776 N GLY A 45 -19.819 5.261 -12.692 1.00 0.00 N ATOM 777 CA GLY A 45 -19.046 5.178 -13.909 1.00 0.00 C ATOM 778 C GLY A 45 -17.756 5.972 -13.832 1.00 0.00 C ATOM 779 O GLY A 45 -17.325 6.567 -14.816 1.00 0.00 O ATOM 0 H GLY A 45 -19.406 4.771 -11.899 1.00 0.00 H new ATOM 0 HA2 GLY A 45 -18.814 4.134 -14.118 1.00 0.00 H new ATOM 0 HA3 GLY A 45 -19.645 5.545 -14.742 1.00 0.00 H new ATOM 783 N ASP A 46 -17.134 5.989 -12.656 1.00 0.00 N ATOM 784 CA ASP A 46 -15.889 6.733 -12.469 1.00 0.00 C ATOM 785 C ASP A 46 -14.684 5.854 -12.772 1.00 0.00 C ATOM 786 O ASP A 46 -13.659 6.329 -13.264 1.00 0.00 O ATOM 787 CB ASP A 46 -15.789 7.260 -11.038 1.00 0.00 C ATOM 788 CG ASP A 46 -14.641 8.233 -10.858 1.00 0.00 C ATOM 789 OD1 ASP A 46 -14.813 9.423 -11.194 1.00 0.00 O ATOM 790 OD2 ASP A 46 -13.569 7.818 -10.375 1.00 0.00 O ATOM 0 H ASP A 46 -17.467 5.501 -11.824 1.00 0.00 H new ATOM 0 HA ASP A 46 -15.896 7.575 -13.161 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -16.724 7.752 -10.769 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -15.661 6.422 -10.353 1.00 0.00 H new ATOM 795 N ALA A 47 -14.827 4.560 -12.510 1.00 0.00 N ATOM 796 CA ALA A 47 -13.754 3.609 -12.768 1.00 0.00 C ATOM 797 C ALA A 47 -13.672 3.314 -14.259 1.00 0.00 C ATOM 798 O ALA A 47 -12.704 2.728 -14.742 1.00 0.00 O ATOM 799 CB ALA A 47 -13.965 2.331 -11.969 1.00 0.00 C ATOM 0 H ALA A 47 -15.674 4.147 -12.120 1.00 0.00 H new ATOM 0 HA ALA A 47 -12.809 4.047 -12.449 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -13.153 1.634 -12.176 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -13.979 2.566 -10.905 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -14.914 1.877 -12.253 1.00 0.00 H new ATOM 805 N LYS A 48 -14.702 3.743 -14.977 1.00 0.00 N ATOM 806 CA LYS A 48 -14.734 3.653 -16.429 1.00 0.00 C ATOM 807 C LYS A 48 -13.643 4.538 -17.027 1.00 0.00 C ATOM 808 O LYS A 48 -13.138 4.277 -18.121 1.00 0.00 O ATOM 809 CB LYS A 48 -16.111 4.083 -16.937 1.00 0.00 C ATOM 810 CG LYS A 48 -16.334 3.797 -18.410 1.00 0.00 C ATOM 811 CD LYS A 48 -16.350 2.303 -18.684 1.00 0.00 C ATOM 812 CE LYS A 48 -16.532 2.012 -20.162 1.00 0.00 C ATOM 813 NZ LYS A 48 -17.820 2.543 -20.683 1.00 0.00 N ATOM 0 H LYS A 48 -15.537 4.162 -14.569 1.00 0.00 H new ATOM 0 HA LYS A 48 -14.551 2.623 -16.735 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -16.879 3.572 -16.356 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -16.236 5.151 -16.760 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -17.278 4.238 -18.730 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -15.547 4.269 -18.998 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -15.418 1.858 -18.336 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -17.156 1.837 -18.118 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -15.706 2.451 -20.722 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -16.491 0.935 -20.327 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -17.999 2.153 -21.630 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -18.593 2.268 -20.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -17.770 3.580 -20.740 1.00 0.00 H new ATOM 827 N GLY A 49 -13.274 5.581 -16.288 1.00 0.00 N ATOM 828 CA GLY A 49 -12.209 6.465 -16.718 1.00 0.00 C ATOM 829 C GLY A 49 -10.843 5.828 -16.559 1.00 0.00 C ATOM 830 O GLY A 49 -9.856 6.307 -17.110 1.00 0.00 O ATOM 0 H GLY A 49 -13.698 5.829 -15.394 1.00 0.00 H new ATOM 0 HA2 GLY A 49 -12.363 6.737 -17.762 1.00 0.00 H new ATOM 0 HA3 GLY A 49 -12.248 7.388 -16.139 1.00 0.00 H new ATOM 834 N THR A 50 -10.793 4.746 -15.801 1.00 0.00 N ATOM 835 CA THR A 50 -9.565 4.000 -15.610 1.00 0.00 C ATOM 836 C THR A 50 -9.656 2.665 -16.345 1.00 0.00 C ATOM 837 O THR A 50 -10.176 1.682 -15.813 1.00 0.00 O ATOM 838 CB THR A 50 -9.298 3.752 -14.110 1.00 0.00 C ATOM 839 OG1 THR A 50 -9.349 4.996 -13.395 1.00 0.00 O ATOM 840 CG2 THR A 50 -7.938 3.102 -13.893 1.00 0.00 C ATOM 0 H THR A 50 -11.598 4.363 -15.304 1.00 0.00 H new ATOM 0 HA THR A 50 -8.739 4.586 -16.014 1.00 0.00 H new ATOM 0 HB THR A 50 -10.068 3.077 -13.737 1.00 0.00 H new ATOM 0 HG1 THR A 50 -9.181 4.833 -12.443 1.00 0.00 H new ATOM 0 HG21 THR A 50 -7.778 2.940 -12.827 1.00 0.00 H new ATOM 0 HG22 THR A 50 -7.904 2.146 -14.415 1.00 0.00 H new ATOM 0 HG23 THR A 50 -7.157 3.755 -14.282 1.00 0.00 H new ATOM 848 N GLU A 51 -9.183 2.644 -17.583 1.00 0.00 N ATOM 849 CA GLU A 51 -9.216 1.435 -18.384 1.00 0.00 C ATOM 850 C GLU A 51 -8.087 0.492 -17.989 1.00 0.00 C ATOM 851 O GLU A 51 -6.927 0.891 -17.887 1.00 0.00 O ATOM 852 CB GLU A 51 -9.169 1.760 -19.884 1.00 0.00 C ATOM 853 CG GLU A 51 -8.516 3.088 -20.245 1.00 0.00 C ATOM 854 CD GLU A 51 -7.069 3.192 -19.812 1.00 0.00 C ATOM 855 OE1 GLU A 51 -6.802 3.862 -18.798 1.00 0.00 O ATOM 856 OE2 GLU A 51 -6.189 2.618 -20.489 1.00 0.00 O ATOM 0 H GLU A 51 -8.773 3.452 -18.052 1.00 0.00 H new ATOM 0 HA GLU A 51 -10.161 0.928 -18.187 1.00 0.00 H new ATOM 0 HB2 GLU A 51 -8.633 0.960 -20.395 1.00 0.00 H new ATOM 0 HB3 GLU A 51 -10.188 1.759 -20.271 1.00 0.00 H new ATOM 0 HG2 GLU A 51 -8.574 3.230 -21.324 1.00 0.00 H new ATOM 0 HG3 GLU A 51 -9.083 3.898 -19.786 1.00 0.00 H new ATOM 863 N LEU A 52 -8.440 -0.759 -17.748 1.00 0.00 N ATOM 864 CA LEU A 52 -7.477 -1.748 -17.292 1.00 0.00 C ATOM 865 C LEU A 52 -7.378 -2.903 -18.279 1.00 0.00 C ATOM 866 O LEU A 52 -6.630 -3.857 -18.060 1.00 0.00 O ATOM 867 CB LEU A 52 -7.879 -2.277 -15.911 1.00 0.00 C ATOM 868 CG LEU A 52 -7.997 -1.215 -14.814 1.00 0.00 C ATOM 869 CD1 LEU A 52 -8.497 -1.838 -13.521 1.00 0.00 C ATOM 870 CD2 LEU A 52 -6.660 -0.524 -14.588 1.00 0.00 C ATOM 0 H LEU A 52 -9.389 -1.115 -17.861 1.00 0.00 H new ATOM 0 HA LEU A 52 -6.501 -1.267 -17.223 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.836 -2.791 -16.001 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -7.146 -3.020 -15.597 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.719 -0.467 -15.140 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -8.575 -1.069 -12.753 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -9.477 -2.285 -13.688 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -7.798 -2.608 -13.194 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -6.766 0.227 -13.805 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.916 -1.261 -14.286 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -6.339 -0.042 -15.511 1.00 0.00 H new ATOM 882 N ASN A 53 -8.134 -2.818 -19.365 1.00 0.00 N ATOM 883 CA ASN A 53 -8.162 -3.888 -20.353 1.00 0.00 C ATOM 884 C ASN A 53 -7.662 -3.402 -21.706 1.00 0.00 C ATOM 885 O ASN A 53 -8.403 -2.785 -22.475 1.00 0.00 O ATOM 886 CB ASN A 53 -9.574 -4.467 -20.492 1.00 0.00 C ATOM 887 CG ASN A 53 -10.041 -5.168 -19.229 1.00 0.00 C ATOM 888 OD1 ASN A 53 -9.801 -6.362 -19.041 1.00 0.00 O ATOM 889 ND2 ASN A 53 -10.713 -4.432 -18.358 1.00 0.00 N ATOM 0 H ASN A 53 -8.734 -2.023 -19.584 1.00 0.00 H new ATOM 0 HA ASN A 53 -7.494 -4.675 -20.002 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -10.270 -3.665 -20.737 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -9.594 -5.171 -21.324 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -11.054 -4.850 -17.492 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -10.890 -3.447 -18.552 1.00 0.00 H new TER 896 ASN A 53 ATOM 897 N GLY B 84 19.515 -16.513 -16.926 1.00 0.00 N ATOM 898 CA GLY B 84 19.771 -15.497 -15.928 1.00 0.00 C ATOM 899 C GLY B 84 18.548 -14.635 -15.715 1.00 0.00 C ATOM 900 O GLY B 84 17.725 -14.510 -16.621 1.00 0.00 O ATOM 0 HA2 GLY B 84 20.058 -15.968 -14.988 1.00 0.00 H new ATOM 0 HA3 GLY B 84 20.610 -14.875 -16.242 1.00 0.00 H new ATOM 904 N PRO B 85 18.390 -14.029 -14.532 1.00 0.00 N ATOM 905 CA PRO B 85 17.212 -13.231 -14.209 1.00 0.00 C ATOM 906 C PRO B 85 17.305 -11.805 -14.743 1.00 0.00 C ATOM 907 O PRO B 85 18.217 -11.477 -15.505 1.00 0.00 O ATOM 908 CB PRO B 85 17.215 -13.235 -12.686 1.00 0.00 C ATOM 909 CG PRO B 85 18.661 -13.250 -12.331 1.00 0.00 C ATOM 910 CD PRO B 85 19.345 -14.064 -13.405 1.00 0.00 C ATOM 0 HA PRO B 85 16.303 -13.633 -14.657 1.00 0.00 H new ATOM 0 HB2 PRO B 85 16.714 -12.355 -12.283 1.00 0.00 H new ATOM 0 HB3 PRO B 85 16.697 -14.107 -12.288 1.00 0.00 H new ATOM 0 HG2 PRO B 85 19.064 -12.238 -12.292 1.00 0.00 H new ATOM 0 HG3 PRO B 85 18.817 -13.693 -11.347 1.00 0.00 H new ATOM 0 HD2 PRO B 85 20.307 -13.633 -13.682 1.00 0.00 H new ATOM 0 HD3 PRO B 85 19.536 -15.085 -13.073 1.00 0.00 H new ATOM 918 N LEU B 86 16.343 -10.977 -14.355 1.00 0.00 N ATOM 919 CA LEU B 86 16.342 -9.557 -14.701 1.00 0.00 C ATOM 920 C LEU B 86 17.703 -8.904 -14.439 1.00 0.00 C ATOM 921 O LEU B 86 18.410 -9.263 -13.495 1.00 0.00 O ATOM 922 CB LEU B 86 15.238 -8.821 -13.921 1.00 0.00 C ATOM 923 CG LEU B 86 14.892 -9.385 -12.527 1.00 0.00 C ATOM 924 CD1 LEU B 86 16.090 -9.352 -11.589 1.00 0.00 C ATOM 925 CD2 LEU B 86 13.731 -8.611 -11.921 1.00 0.00 C ATOM 0 H LEU B 86 15.543 -11.268 -13.793 1.00 0.00 H new ATOM 0 HA LEU B 86 16.141 -9.479 -15.769 1.00 0.00 H new ATOM 0 HB2 LEU B 86 15.538 -7.780 -13.804 1.00 0.00 H new ATOM 0 HB3 LEU B 86 14.331 -8.825 -14.526 1.00 0.00 H new ATOM 0 HG LEU B 86 14.603 -10.428 -12.657 1.00 0.00 H new ATOM 0 HD11 LEU B 86 15.804 -9.758 -10.619 1.00 0.00 H new ATOM 0 HD12 LEU B 86 16.898 -9.952 -12.009 1.00 0.00 H new ATOM 0 HD13 LEU B 86 16.428 -8.323 -11.467 1.00 0.00 H new ATOM 0 HD21 LEU B 86 13.496 -9.018 -10.938 1.00 0.00 H new ATOM 0 HD22 LEU B 86 14.006 -7.561 -11.823 1.00 0.00 H new ATOM 0 HD23 LEU B 86 12.858 -8.699 -12.568 1.00 0.00 H new ATOM 937 N GLY B 87 18.063 -7.944 -15.276 1.00 0.00 N ATOM 938 CA GLY B 87 19.350 -7.288 -15.144 1.00 0.00 C ATOM 939 C GLY B 87 19.268 -6.019 -14.324 1.00 0.00 C ATOM 940 O GLY B 87 20.196 -5.209 -14.325 1.00 0.00 O ATOM 0 H GLY B 87 17.487 -7.605 -16.047 1.00 0.00 H new ATOM 0 HA2 GLY B 87 20.058 -7.973 -14.678 1.00 0.00 H new ATOM 0 HA3 GLY B 87 19.738 -7.053 -16.135 1.00 0.00 H new ATOM 944 N SER B 88 18.158 -5.850 -13.622 1.00 0.00 N ATOM 945 CA SER B 88 17.930 -4.665 -12.811 1.00 0.00 C ATOM 946 C SER B 88 18.675 -4.746 -11.481 1.00 0.00 C ATOM 947 O SER B 88 19.101 -3.726 -10.941 1.00 0.00 O ATOM 948 CB SER B 88 16.432 -4.494 -12.568 1.00 0.00 C ATOM 949 OG SER B 88 15.841 -5.725 -12.183 1.00 0.00 O ATOM 0 H SER B 88 17.395 -6.526 -13.598 1.00 0.00 H new ATOM 0 HA SER B 88 18.314 -3.800 -13.352 1.00 0.00 H new ATOM 0 HB2 SER B 88 16.268 -3.748 -11.791 1.00 0.00 H new ATOM 0 HB3 SER B 88 15.952 -4.122 -13.473 1.00 0.00 H new ATOM 0 HG SER B 88 14.882 -5.594 -12.030 1.00 0.00 H new ATOM 955 N ARG B 89 18.827 -5.959 -10.965 1.00 0.00 N ATOM 956 CA ARG B 89 19.498 -6.170 -9.687 1.00 0.00 C ATOM 957 C ARG B 89 21.009 -6.105 -9.853 1.00 0.00 C ATOM 958 O ARG B 89 21.683 -5.393 -9.116 1.00 0.00 O ATOM 959 CB ARG B 89 19.099 -7.514 -9.084 1.00 0.00 C ATOM 960 CG ARG B 89 17.626 -7.606 -8.723 1.00 0.00 C ATOM 961 CD ARG B 89 17.312 -8.904 -8.003 1.00 0.00 C ATOM 962 NE ARG B 89 18.049 -9.020 -6.748 1.00 0.00 N ATOM 963 CZ ARG B 89 17.951 -10.051 -5.912 1.00 0.00 C ATOM 964 NH1 ARG B 89 17.136 -11.066 -6.189 1.00 0.00 N ATOM 965 NH2 ARG B 89 18.669 -10.063 -4.798 1.00 0.00 N ATOM 0 H ARG B 89 18.494 -6.813 -11.412 1.00 0.00 H new ATOM 0 HA ARG B 89 19.186 -5.375 -9.010 1.00 0.00 H new ATOM 0 HB2 ARG B 89 19.341 -8.307 -9.792 1.00 0.00 H new ATOM 0 HB3 ARG B 89 19.696 -7.693 -8.189 1.00 0.00 H new ATOM 0 HG2 ARG B 89 17.352 -6.762 -8.090 1.00 0.00 H new ATOM 0 HG3 ARG B 89 17.023 -7.535 -9.628 1.00 0.00 H new ATOM 0 HD2 ARG B 89 16.242 -8.959 -7.803 1.00 0.00 H new ATOM 0 HD3 ARG B 89 17.559 -9.747 -8.649 1.00 0.00 H new ATOM 0 HE ARG B 89 18.681 -8.260 -6.495 1.00 0.00 H new ATOM 0 HH11 ARG B 89 16.582 -11.056 -7.046 1.00 0.00 H new ATOM 0 HH12 ARG B 89 17.065 -11.854 -5.545 1.00 0.00 H new ATOM 0 HH21 ARG B 89 19.293 -9.285 -4.585 1.00 0.00 H new ATOM 0 HH22 ARG B 89 18.598 -10.851 -4.154 1.00 0.00 H new ATOM 979 N ARG B 90 21.523 -6.861 -10.823 1.00 0.00 N ATOM 980 CA ARG B 90 22.946 -6.851 -11.164 1.00 0.00 C ATOM 981 C ARG B 90 23.810 -7.018 -9.913 1.00 0.00 C ATOM 982 O ARG B 90 24.586 -6.126 -9.550 1.00 0.00 O ATOM 983 CB ARG B 90 23.308 -5.549 -11.887 1.00 0.00 C ATOM 984 CG ARG B 90 24.608 -5.619 -12.670 1.00 0.00 C ATOM 985 CD ARG B 90 24.455 -6.471 -13.919 1.00 0.00 C ATOM 986 NE ARG B 90 23.459 -5.920 -14.840 1.00 0.00 N ATOM 987 CZ ARG B 90 23.091 -6.504 -15.981 1.00 0.00 C ATOM 988 NH1 ARG B 90 23.628 -7.666 -16.344 1.00 0.00 N ATOM 989 NH2 ARG B 90 22.188 -5.924 -16.760 1.00 0.00 N ATOM 0 H ARG B 90 20.966 -7.497 -11.394 1.00 0.00 H new ATOM 0 HA ARG B 90 23.143 -7.692 -11.828 1.00 0.00 H new ATOM 0 HB2 ARG B 90 22.499 -5.287 -12.569 1.00 0.00 H new ATOM 0 HB3 ARG B 90 23.380 -4.746 -11.154 1.00 0.00 H new ATOM 0 HG2 ARG B 90 24.921 -4.613 -12.949 1.00 0.00 H new ATOM 0 HG3 ARG B 90 25.394 -6.034 -12.038 1.00 0.00 H new ATOM 0 HD2 ARG B 90 25.416 -6.546 -14.427 1.00 0.00 H new ATOM 0 HD3 ARG B 90 24.165 -7.483 -13.635 1.00 0.00 H new ATOM 0 HE ARG B 90 23.019 -5.034 -14.593 1.00 0.00 H new ATOM 0 HH11 ARG B 90 24.324 -8.114 -15.749 1.00 0.00 H new ATOM 0 HH12 ARG B 90 23.343 -8.109 -17.218 1.00 0.00 H new ATOM 0 HH21 ARG B 90 21.776 -5.032 -16.486 1.00 0.00 H new ATOM 0 HH22 ARG B 90 21.906 -6.370 -17.633 1.00 0.00 H new ATOM 1003 N PHE B 91 23.658 -8.166 -9.257 1.00 0.00 N ATOM 1004 CA PHE B 91 24.369 -8.458 -8.015 1.00 0.00 C ATOM 1005 C PHE B 91 23.982 -7.447 -6.933 1.00 0.00 C ATOM 1006 O PHE B 91 22.898 -6.867 -6.974 1.00 0.00 O ATOM 1007 CB PHE B 91 25.890 -8.449 -8.233 1.00 0.00 C ATOM 1008 CG PHE B 91 26.363 -9.393 -9.302 1.00 0.00 C ATOM 1009 CD1 PHE B 91 26.755 -8.914 -10.543 1.00 0.00 C ATOM 1010 CD2 PHE B 91 26.417 -10.756 -9.068 1.00 0.00 C ATOM 1011 CE1 PHE B 91 27.193 -9.777 -11.528 1.00 0.00 C ATOM 1012 CE2 PHE B 91 26.853 -11.626 -10.050 1.00 0.00 C ATOM 1013 CZ PHE B 91 27.242 -11.136 -11.281 1.00 0.00 C ATOM 0 H PHE B 91 23.042 -8.916 -9.569 1.00 0.00 H new ATOM 0 HA PHE B 91 24.081 -9.456 -7.686 1.00 0.00 H new ATOM 0 HB2 PHE B 91 26.203 -7.438 -8.492 1.00 0.00 H new ATOM 0 HB3 PHE B 91 26.382 -8.704 -7.294 1.00 0.00 H new ATOM 0 HD1 PHE B 91 26.717 -7.853 -10.742 1.00 0.00 H new ATOM 0 HD2 PHE B 91 26.115 -11.145 -8.107 1.00 0.00 H new ATOM 0 HE1 PHE B 91 27.497 -9.391 -12.490 1.00 0.00 H new ATOM 0 HE2 PHE B 91 26.889 -12.688 -9.855 1.00 0.00 H new ATOM 0 HZ PHE B 91 27.584 -11.813 -12.049 1.00 0.00 H new ATOM 1023 N VAL B 92 24.867 -7.226 -5.972 1.00 0.00 N ATOM 1024 CA VAL B 92 24.596 -6.263 -4.915 1.00 0.00 C ATOM 1025 C VAL B 92 24.941 -4.847 -5.364 1.00 0.00 C ATOM 1026 O VAL B 92 24.747 -3.890 -4.622 1.00 0.00 O ATOM 1027 CB VAL B 92 25.374 -6.594 -3.624 1.00 0.00 C ATOM 1028 CG1 VAL B 92 25.018 -7.986 -3.128 1.00 0.00 C ATOM 1029 CG2 VAL B 92 26.874 -6.464 -3.848 1.00 0.00 C ATOM 0 H VAL B 92 25.770 -7.695 -5.902 1.00 0.00 H new ATOM 0 HA VAL B 92 23.529 -6.324 -4.701 1.00 0.00 H new ATOM 0 HB VAL B 92 25.086 -5.875 -2.857 1.00 0.00 H new ATOM 0 HG11 VAL B 92 25.576 -8.202 -2.217 1.00 0.00 H new ATOM 0 HG12 VAL B 92 23.949 -8.036 -2.919 1.00 0.00 H new ATOM 0 HG13 VAL B 92 25.273 -8.721 -3.892 1.00 0.00 H new ATOM 0 HG21 VAL B 92 27.402 -6.702 -2.924 1.00 0.00 H new ATOM 0 HG22 VAL B 92 27.186 -7.154 -4.632 1.00 0.00 H new ATOM 0 HG23 VAL B 92 27.110 -5.443 -4.148 1.00 0.00 H new ATOM 1039 N VAL B 93 25.441 -4.720 -6.590 1.00 0.00 N ATOM 1040 CA VAL B 93 25.861 -3.428 -7.114 1.00 0.00 C ATOM 1041 C VAL B 93 24.655 -2.529 -7.351 1.00 0.00 C ATOM 1042 O VAL B 93 24.501 -1.495 -6.695 1.00 0.00 O ATOM 1043 CB VAL B 93 26.659 -3.574 -8.423 1.00 0.00 C ATOM 1044 CG1 VAL B 93 27.112 -2.213 -8.937 1.00 0.00 C ATOM 1045 CG2 VAL B 93 27.852 -4.496 -8.225 1.00 0.00 C ATOM 0 H VAL B 93 25.564 -5.498 -7.238 1.00 0.00 H new ATOM 0 HA VAL B 93 26.512 -2.975 -6.366 1.00 0.00 H new ATOM 0 HB VAL B 93 26.003 -4.018 -9.171 1.00 0.00 H new ATOM 0 HG11 VAL B 93 27.674 -2.342 -9.862 1.00 0.00 H new ATOM 0 HG12 VAL B 93 26.240 -1.587 -9.126 1.00 0.00 H new ATOM 0 HG13 VAL B 93 27.747 -1.735 -8.191 1.00 0.00 H new ATOM 0 HG21 VAL B 93 28.402 -4.585 -9.162 1.00 0.00 H new ATOM 0 HG22 VAL B 93 28.507 -4.084 -7.457 1.00 0.00 H new ATOM 0 HG23 VAL B 93 27.503 -5.481 -7.914 1.00 0.00 H new ATOM 1055 N ASP B 94 23.793 -2.928 -8.275 1.00 0.00 N ATOM 1056 CA ASP B 94 22.606 -2.165 -8.571 1.00 0.00 C ATOM 1057 C ASP B 94 21.599 -2.295 -7.442 1.00 0.00 C ATOM 1058 O ASP B 94 20.987 -1.308 -7.055 1.00 0.00 O ATOM 1059 CB ASP B 94 22.003 -2.611 -9.897 1.00 0.00 C ATOM 1060 CG ASP B 94 22.677 -1.976 -11.096 1.00 0.00 C ATOM 1061 OD1 ASP B 94 22.144 -0.973 -11.621 1.00 0.00 O ATOM 1062 OD2 ASP B 94 23.741 -2.466 -11.523 1.00 0.00 O ATOM 0 H ASP B 94 23.900 -3.778 -8.829 1.00 0.00 H new ATOM 0 HA ASP B 94 22.879 -1.114 -8.662 1.00 0.00 H new ATOM 0 HB2 ASP B 94 22.077 -3.696 -9.977 1.00 0.00 H new ATOM 0 HB3 ASP B 94 20.942 -2.362 -9.909 1.00 0.00 H new ATOM 1067 N ASP B 95 21.466 -3.498 -6.876 1.00 0.00 N ATOM 1068 CA ASP B 95 20.548 -3.721 -5.745 1.00 0.00 C ATOM 1069 C ASP B 95 20.828 -2.770 -4.591 1.00 0.00 C ATOM 1070 O ASP B 95 19.984 -2.571 -3.727 1.00 0.00 O ATOM 1071 CB ASP B 95 20.643 -5.145 -5.202 1.00 0.00 C ATOM 1072 CG ASP B 95 19.580 -6.071 -5.754 1.00 0.00 C ATOM 1073 OD1 ASP B 95 18.471 -5.594 -6.071 1.00 0.00 O ATOM 1074 OD2 ASP B 95 19.833 -7.293 -5.827 1.00 0.00 O ATOM 0 H ASP B 95 21.976 -4.329 -7.176 1.00 0.00 H new ATOM 0 HA ASP B 95 19.549 -3.542 -6.143 1.00 0.00 H new ATOM 0 HB2 ASP B 95 21.627 -5.551 -5.438 1.00 0.00 H new ATOM 0 HB3 ASP B 95 20.562 -5.118 -4.115 1.00 0.00 H new ATOM 1079 N ARG B 96 22.011 -2.195 -4.568 1.00 0.00 N ATOM 1080 CA ARG B 96 22.388 -1.297 -3.492 1.00 0.00 C ATOM 1081 C ARG B 96 21.834 0.090 -3.764 1.00 0.00 C ATOM 1082 O ARG B 96 20.947 0.568 -3.059 1.00 0.00 O ATOM 1083 CB ARG B 96 23.910 -1.247 -3.347 1.00 0.00 C ATOM 1084 CG ARG B 96 24.395 -0.346 -2.224 1.00 0.00 C ATOM 1085 CD ARG B 96 25.904 -0.433 -2.068 1.00 0.00 C ATOM 1086 NE ARG B 96 26.333 -1.790 -1.739 1.00 0.00 N ATOM 1087 CZ ARG B 96 27.490 -2.324 -2.118 1.00 0.00 C ATOM 1088 NH1 ARG B 96 28.369 -1.605 -2.808 1.00 0.00 N ATOM 1089 NH2 ARG B 96 27.772 -3.579 -1.797 1.00 0.00 N ATOM 0 H ARG B 96 22.729 -2.331 -5.280 1.00 0.00 H new ATOM 0 HA ARG B 96 21.969 -1.668 -2.557 1.00 0.00 H new ATOM 0 HB2 ARG B 96 24.282 -2.257 -3.175 1.00 0.00 H new ATOM 0 HB3 ARG B 96 24.343 -0.904 -4.287 1.00 0.00 H new ATOM 0 HG2 ARG B 96 24.106 0.685 -2.430 1.00 0.00 H new ATOM 0 HG3 ARG B 96 23.912 -0.632 -1.289 1.00 0.00 H new ATOM 0 HD2 ARG B 96 26.385 -0.113 -2.992 1.00 0.00 H new ATOM 0 HD3 ARG B 96 26.230 0.252 -1.285 1.00 0.00 H new ATOM 0 HE ARG B 96 25.703 -2.366 -1.181 1.00 0.00 H new ATOM 0 HH11 ARG B 96 28.158 -0.637 -3.050 1.00 0.00 H new ATOM 0 HH12 ARG B 96 29.255 -2.021 -3.095 1.00 0.00 H new ATOM 0 HH21 ARG B 96 27.102 -4.131 -1.261 1.00 0.00 H new ATOM 0 HH22 ARG B 96 28.659 -3.992 -2.086 1.00 0.00 H new ATOM 1103 N ARG B 97 22.336 0.703 -4.823 1.00 0.00 N ATOM 1104 CA ARG B 97 21.965 2.062 -5.181 1.00 0.00 C ATOM 1105 C ARG B 97 20.522 2.139 -5.675 1.00 0.00 C ATOM 1106 O ARG B 97 19.795 3.067 -5.334 1.00 0.00 O ATOM 1107 CB ARG B 97 22.939 2.588 -6.236 1.00 0.00 C ATOM 1108 CG ARG B 97 22.442 3.795 -7.015 1.00 0.00 C ATOM 1109 CD ARG B 97 22.172 3.419 -8.458 1.00 0.00 C ATOM 1110 NE ARG B 97 23.362 2.840 -9.081 1.00 0.00 N ATOM 1111 CZ ARG B 97 23.340 1.821 -9.933 1.00 0.00 C ATOM 1112 NH1 ARG B 97 22.188 1.344 -10.374 1.00 0.00 N ATOM 1113 NH2 ARG B 97 24.481 1.305 -10.371 1.00 0.00 N ATOM 0 H ARG B 97 23.010 0.274 -5.457 1.00 0.00 H new ATOM 0 HA ARG B 97 22.026 2.689 -4.291 1.00 0.00 H new ATOM 0 HB2 ARG B 97 23.877 2.850 -5.746 1.00 0.00 H new ATOM 0 HB3 ARG B 97 23.160 1.785 -6.939 1.00 0.00 H new ATOM 0 HG2 ARG B 97 21.532 4.181 -6.557 1.00 0.00 H new ATOM 0 HG3 ARG B 97 23.183 4.593 -6.973 1.00 0.00 H new ATOM 0 HD2 ARG B 97 21.350 2.705 -8.504 1.00 0.00 H new ATOM 0 HD3 ARG B 97 21.859 4.302 -9.015 1.00 0.00 H new ATOM 0 HE ARG B 97 24.268 3.245 -8.846 1.00 0.00 H new ATOM 0 HH11 ARG B 97 21.311 1.759 -10.060 1.00 0.00 H new ATOM 0 HH12 ARG B 97 22.177 0.561 -11.028 1.00 0.00 H new ATOM 0 HH21 ARG B 97 25.370 1.691 -10.053 1.00 0.00 H new ATOM 0 HH22 ARG B 97 24.469 0.523 -11.025 1.00 0.00 H new ATOM 1127 N GLU B 98 20.105 1.156 -6.456 1.00 0.00 N ATOM 1128 CA GLU B 98 18.765 1.150 -7.025 1.00 0.00 C ATOM 1129 C GLU B 98 17.701 0.999 -5.942 1.00 0.00 C ATOM 1130 O GLU B 98 16.708 1.722 -5.930 1.00 0.00 O ATOM 1131 CB GLU B 98 18.630 0.025 -8.035 1.00 0.00 C ATOM 1132 CG GLU B 98 19.360 0.296 -9.330 1.00 0.00 C ATOM 1133 CD GLU B 98 18.842 1.512 -10.067 1.00 0.00 C ATOM 1134 OE1 GLU B 98 19.653 2.420 -10.344 1.00 0.00 O ATOM 1135 OE2 GLU B 98 17.639 1.559 -10.389 1.00 0.00 O ATOM 0 H GLU B 98 20.675 0.350 -6.712 1.00 0.00 H new ATOM 0 HA GLU B 98 18.611 2.107 -7.523 1.00 0.00 H new ATOM 0 HB2 GLU B 98 19.012 -0.896 -7.596 1.00 0.00 H new ATOM 0 HB3 GLU B 98 17.574 -0.138 -8.248 1.00 0.00 H new ATOM 0 HG2 GLU B 98 20.421 0.432 -9.119 1.00 0.00 H new ATOM 0 HG3 GLU B 98 19.273 -0.577 -9.977 1.00 0.00 H new ATOM 1142 N LEU B 99 17.924 0.059 -5.029 1.00 0.00 N ATOM 1143 CA LEU B 99 16.978 -0.206 -3.953 1.00 0.00 C ATOM 1144 C LEU B 99 16.815 1.026 -3.067 1.00 0.00 C ATOM 1145 O LEU B 99 15.698 1.445 -2.792 1.00 0.00 O ATOM 1146 CB LEU B 99 17.448 -1.439 -3.164 1.00 0.00 C ATOM 1147 CG LEU B 99 16.690 -1.839 -1.889 1.00 0.00 C ATOM 1148 CD1 LEU B 99 17.295 -1.149 -0.683 1.00 0.00 C ATOM 1149 CD2 LEU B 99 15.200 -1.548 -1.997 1.00 0.00 C ATOM 0 H LEU B 99 18.754 -0.533 -5.014 1.00 0.00 H new ATOM 0 HA LEU B 99 15.993 -0.423 -4.366 1.00 0.00 H new ATOM 0 HB2 LEU B 99 17.425 -2.292 -3.842 1.00 0.00 H new ATOM 0 HB3 LEU B 99 18.491 -1.277 -2.890 1.00 0.00 H new ATOM 0 HG LEU B 99 16.793 -2.917 -1.764 1.00 0.00 H new ATOM 0 HD11 LEU B 99 16.749 -1.440 0.215 1.00 0.00 H new ATOM 0 HD12 LEU B 99 18.340 -1.441 -0.583 1.00 0.00 H new ATOM 0 HD13 LEU B 99 17.231 -0.069 -0.812 1.00 0.00 H new ATOM 0 HD21 LEU B 99 14.703 -1.846 -1.074 1.00 0.00 H new ATOM 0 HD22 LEU B 99 15.049 -0.481 -2.162 1.00 0.00 H new ATOM 0 HD23 LEU B 99 14.780 -2.108 -2.832 1.00 0.00 H new ATOM 1161 N GLN B 100 17.917 1.629 -2.646 1.00 0.00 N ATOM 1162 CA GLN B 100 17.836 2.815 -1.801 1.00 0.00 C ATOM 1163 C GLN B 100 17.246 3.990 -2.577 1.00 0.00 C ATOM 1164 O GLN B 100 16.570 4.847 -2.007 1.00 0.00 O ATOM 1165 CB GLN B 100 19.207 3.179 -1.234 1.00 0.00 C ATOM 1166 CG GLN B 100 20.264 3.449 -2.288 1.00 0.00 C ATOM 1167 CD GLN B 100 21.647 3.586 -1.691 1.00 0.00 C ATOM 1168 OE1 GLN B 100 22.648 3.252 -2.324 1.00 0.00 O ATOM 1169 NE2 GLN B 100 21.711 4.079 -0.470 1.00 0.00 N ATOM 0 H GLN B 100 18.864 1.324 -2.870 1.00 0.00 H new ATOM 0 HA GLN B 100 17.175 2.588 -0.965 1.00 0.00 H new ATOM 0 HB2 GLN B 100 19.104 4.062 -0.604 1.00 0.00 H new ATOM 0 HB3 GLN B 100 19.549 2.368 -0.592 1.00 0.00 H new ATOM 0 HG2 GLN B 100 20.264 2.638 -3.016 1.00 0.00 H new ATOM 0 HG3 GLN B 100 20.011 4.362 -2.828 1.00 0.00 H new ATOM 0 HE21 GLN B 100 20.856 4.343 0.019 1.00 0.00 H new ATOM 0 HE22 GLN B 100 22.616 4.196 -0.014 1.00 0.00 H new ATOM 1178 N TYR B 101 17.498 4.016 -3.880 1.00 0.00 N ATOM 1179 CA TYR B 101 16.945 5.044 -4.751 1.00 0.00 C ATOM 1180 C TYR B 101 15.431 4.904 -4.868 1.00 0.00 C ATOM 1181 O TYR B 101 14.703 5.890 -4.793 1.00 0.00 O ATOM 1182 CB TYR B 101 17.583 4.977 -6.144 1.00 0.00 C ATOM 1183 CG TYR B 101 16.980 5.950 -7.133 1.00 0.00 C ATOM 1184 CD1 TYR B 101 17.296 7.302 -7.088 1.00 0.00 C ATOM 1185 CD2 TYR B 101 16.092 5.516 -8.108 1.00 0.00 C ATOM 1186 CE1 TYR B 101 16.740 8.193 -7.986 1.00 0.00 C ATOM 1187 CE2 TYR B 101 15.535 6.400 -9.009 1.00 0.00 C ATOM 1188 CZ TYR B 101 15.861 7.737 -8.944 1.00 0.00 C ATOM 1189 OH TYR B 101 15.302 8.622 -9.840 1.00 0.00 O ATOM 0 H TYR B 101 18.085 3.333 -4.358 1.00 0.00 H new ATOM 0 HA TYR B 101 17.172 6.013 -4.305 1.00 0.00 H new ATOM 0 HB2 TYR B 101 18.651 5.177 -6.055 1.00 0.00 H new ATOM 0 HB3 TYR B 101 17.479 3.964 -6.534 1.00 0.00 H new ATOM 0 HD1 TYR B 101 17.987 7.662 -6.340 1.00 0.00 H new ATOM 0 HD2 TYR B 101 15.833 4.469 -8.162 1.00 0.00 H new ATOM 0 HE1 TYR B 101 16.993 9.242 -7.937 1.00 0.00 H new ATOM 0 HE2 TYR B 101 14.847 6.046 -9.762 1.00 0.00 H new ATOM 0 HH TYR B 101 14.706 8.138 -10.449 1.00 0.00 H new ATOM 1199 N ARG B 102 14.954 3.678 -5.045 1.00 0.00 N ATOM 1200 CA ARG B 102 13.529 3.447 -5.243 1.00 0.00 C ATOM 1201 C ARG B 102 12.738 3.845 -3.999 1.00 0.00 C ATOM 1202 O ARG B 102 11.584 4.237 -4.095 1.00 0.00 O ATOM 1203 CB ARG B 102 13.252 1.982 -5.635 1.00 0.00 C ATOM 1204 CG ARG B 102 13.338 0.977 -4.492 1.00 0.00 C ATOM 1205 CD ARG B 102 11.980 0.741 -3.842 1.00 0.00 C ATOM 1206 NE ARG B 102 12.085 -0.046 -2.611 1.00 0.00 N ATOM 1207 CZ ARG B 102 11.096 -0.794 -2.117 1.00 0.00 C ATOM 1208 NH1 ARG B 102 9.942 -0.897 -2.768 1.00 0.00 N ATOM 1209 NH2 ARG B 102 11.264 -1.450 -0.974 1.00 0.00 N ATOM 0 H ARG B 102 15.528 2.835 -5.056 1.00 0.00 H new ATOM 0 HA ARG B 102 13.197 4.077 -6.068 1.00 0.00 H new ATOM 0 HB2 ARG B 102 12.257 1.923 -6.076 1.00 0.00 H new ATOM 0 HB3 ARG B 102 13.961 1.689 -6.409 1.00 0.00 H new ATOM 0 HG2 ARG B 102 13.730 0.032 -4.868 1.00 0.00 H new ATOM 0 HG3 ARG B 102 14.042 1.339 -3.742 1.00 0.00 H new ATOM 0 HD2 ARG B 102 11.514 1.701 -3.619 1.00 0.00 H new ATOM 0 HD3 ARG B 102 11.327 0.226 -4.546 1.00 0.00 H new ATOM 0 HE ARG B 102 12.968 -0.021 -2.100 1.00 0.00 H new ATOM 0 HH11 ARG B 102 9.808 -0.403 -3.650 1.00 0.00 H new ATOM 0 HH12 ARG B 102 9.190 -1.470 -2.385 1.00 0.00 H new ATOM 0 HH21 ARG B 102 12.150 -1.382 -0.473 1.00 0.00 H new ATOM 0 HH22 ARG B 102 10.507 -2.021 -0.598 1.00 0.00 H new ATOM 1223 N VAL B 103 13.375 3.775 -2.838 1.00 0.00 N ATOM 1224 CA VAL B 103 12.697 4.082 -1.584 1.00 0.00 C ATOM 1225 C VAL B 103 12.378 5.578 -1.478 1.00 0.00 C ATOM 1226 O VAL B 103 11.277 5.951 -1.080 1.00 0.00 O ATOM 1227 CB VAL B 103 13.537 3.632 -0.368 1.00 0.00 C ATOM 1228 CG1 VAL B 103 12.754 3.750 0.921 1.00 0.00 C ATOM 1229 CG2 VAL B 103 14.032 2.206 -0.540 1.00 0.00 C ATOM 0 H VAL B 103 14.355 3.510 -2.737 1.00 0.00 H new ATOM 0 HA VAL B 103 11.759 3.527 -1.580 1.00 0.00 H new ATOM 0 HB VAL B 103 14.398 4.298 -0.312 1.00 0.00 H new ATOM 0 HG11 VAL B 103 13.376 3.425 1.755 1.00 0.00 H new ATOM 0 HG12 VAL B 103 12.457 4.788 1.072 1.00 0.00 H new ATOM 0 HG13 VAL B 103 11.865 3.122 0.865 1.00 0.00 H new ATOM 0 HG21 VAL B 103 14.620 1.917 0.331 1.00 0.00 H new ATOM 0 HG22 VAL B 103 13.179 1.535 -0.641 1.00 0.00 H new ATOM 0 HG23 VAL B 103 14.652 2.142 -1.434 1.00 0.00 H new ATOM 1239 N GLU B 104 13.330 6.435 -1.848 1.00 0.00 N ATOM 1240 CA GLU B 104 13.106 7.882 -1.802 1.00 0.00 C ATOM 1241 C GLU B 104 12.067 8.347 -2.820 1.00 0.00 C ATOM 1242 O GLU B 104 11.312 9.281 -2.541 1.00 0.00 O ATOM 1243 CB GLU B 104 14.408 8.671 -1.975 1.00 0.00 C ATOM 1244 CG GLU B 104 15.351 8.087 -3.000 1.00 0.00 C ATOM 1245 CD GLU B 104 16.548 8.972 -3.264 1.00 0.00 C ATOM 1246 OE1 GLU B 104 16.424 9.923 -4.061 1.00 0.00 O ATOM 1247 OE2 GLU B 104 17.618 8.724 -2.677 1.00 0.00 O ATOM 0 H GLU B 104 14.254 6.158 -2.179 1.00 0.00 H new ATOM 0 HA GLU B 104 12.711 8.088 -0.807 1.00 0.00 H new ATOM 0 HB2 GLU B 104 14.165 9.694 -2.262 1.00 0.00 H new ATOM 0 HB3 GLU B 104 14.920 8.722 -1.014 1.00 0.00 H new ATOM 0 HG2 GLU B 104 15.695 7.111 -2.657 1.00 0.00 H new ATOM 0 HG3 GLU B 104 14.811 7.925 -3.933 1.00 0.00 H new ATOM 1254 N VAL B 105 12.020 7.720 -3.994 1.00 0.00 N ATOM 1255 CA VAL B 105 10.957 8.031 -4.947 1.00 0.00 C ATOM 1256 C VAL B 105 9.620 7.548 -4.404 1.00 0.00 C ATOM 1257 O VAL B 105 8.630 8.266 -4.473 1.00 0.00 O ATOM 1258 CB VAL B 105 11.214 7.471 -6.377 1.00 0.00 C ATOM 1259 CG1 VAL B 105 12.121 6.261 -6.356 1.00 0.00 C ATOM 1260 CG2 VAL B 105 9.916 7.119 -7.087 1.00 0.00 C ATOM 0 H VAL B 105 12.686 7.012 -4.303 1.00 0.00 H new ATOM 0 HA VAL B 105 10.940 9.115 -5.057 1.00 0.00 H new ATOM 0 HB VAL B 105 11.711 8.268 -6.929 1.00 0.00 H new ATOM 0 HG11 VAL B 105 12.274 5.903 -7.374 1.00 0.00 H new ATOM 0 HG12 VAL B 105 13.082 6.534 -5.920 1.00 0.00 H new ATOM 0 HG13 VAL B 105 11.662 5.473 -5.759 1.00 0.00 H new ATOM 0 HG21 VAL B 105 10.139 6.732 -8.081 1.00 0.00 H new ATOM 0 HG22 VAL B 105 9.382 6.361 -6.514 1.00 0.00 H new ATOM 0 HG23 VAL B 105 9.296 8.011 -7.175 1.00 0.00 H new ATOM 1270 N GLN B 106 9.604 6.352 -3.822 1.00 0.00 N ATOM 1271 CA GLN B 106 8.391 5.828 -3.201 1.00 0.00 C ATOM 1272 C GLN B 106 7.925 6.758 -2.082 1.00 0.00 C ATOM 1273 O GLN B 106 6.740 7.056 -1.972 1.00 0.00 O ATOM 1274 CB GLN B 106 8.630 4.409 -2.676 1.00 0.00 C ATOM 1275 CG GLN B 106 8.854 3.385 -3.779 1.00 0.00 C ATOM 1276 CD GLN B 106 7.637 3.174 -4.659 1.00 0.00 C ATOM 1277 OE1 GLN B 106 6.832 2.279 -4.419 1.00 0.00 O ATOM 1278 NE2 GLN B 106 7.491 4.001 -5.684 1.00 0.00 N ATOM 0 H GLN B 106 10.411 5.731 -3.767 1.00 0.00 H new ATOM 0 HA GLN B 106 7.603 5.780 -3.952 1.00 0.00 H new ATOM 0 HB2 GLN B 106 9.497 4.415 -2.015 1.00 0.00 H new ATOM 0 HB3 GLN B 106 7.774 4.103 -2.075 1.00 0.00 H new ATOM 0 HG2 GLN B 106 9.691 3.707 -4.399 1.00 0.00 H new ATOM 0 HG3 GLN B 106 9.138 2.433 -3.329 1.00 0.00 H new ATOM 0 HE21 GLN B 106 8.182 4.733 -5.851 1.00 0.00 H new ATOM 0 HE22 GLN B 106 6.688 3.906 -6.306 1.00 0.00 H new ATOM 1287 N ASN B 107 8.875 7.241 -1.283 1.00 0.00 N ATOM 1288 CA ASN B 107 8.603 8.235 -0.238 1.00 0.00 C ATOM 1289 C ASN B 107 7.841 9.441 -0.808 1.00 0.00 C ATOM 1290 O ASN B 107 6.951 9.989 -0.166 1.00 0.00 O ATOM 1291 CB ASN B 107 9.921 8.705 0.387 1.00 0.00 C ATOM 1292 CG ASN B 107 9.729 9.770 1.454 1.00 0.00 C ATOM 1293 OD1 ASN B 107 10.564 10.659 1.605 1.00 0.00 O ATOM 1294 ND2 ASN B 107 8.643 9.683 2.211 1.00 0.00 N ATOM 0 H ASN B 107 9.853 6.957 -1.339 1.00 0.00 H new ATOM 0 HA ASN B 107 7.982 7.766 0.525 1.00 0.00 H new ATOM 0 HB2 ASN B 107 10.434 7.849 0.825 1.00 0.00 H new ATOM 0 HB3 ASN B 107 10.568 9.098 -0.397 1.00 0.00 H new ATOM 0 HD21 ASN B 107 8.479 10.369 2.948 1.00 0.00 H new ATOM 0 HD22 ASN B 107 7.972 8.931 2.056 1.00 0.00 H new ATOM 1301 N ARG B 108 8.192 9.839 -2.025 1.00 0.00 N ATOM 1302 CA ARG B 108 7.583 11.002 -2.657 1.00 0.00 C ATOM 1303 C ARG B 108 6.276 10.647 -3.362 1.00 0.00 C ATOM 1304 O ARG B 108 5.255 11.301 -3.160 1.00 0.00 O ATOM 1305 CB ARG B 108 8.561 11.620 -3.650 1.00 0.00 C ATOM 1306 CG ARG B 108 9.738 12.302 -2.979 1.00 0.00 C ATOM 1307 CD ARG B 108 10.787 12.734 -3.988 1.00 0.00 C ATOM 1308 NE ARG B 108 10.272 13.697 -4.957 1.00 0.00 N ATOM 1309 CZ ARG B 108 11.028 14.301 -5.871 1.00 0.00 C ATOM 1310 NH1 ARG B 108 12.331 14.042 -5.933 1.00 0.00 N ATOM 1311 NH2 ARG B 108 10.487 15.170 -6.714 1.00 0.00 N ATOM 0 H ARG B 108 8.897 9.372 -2.595 1.00 0.00 H new ATOM 0 HA ARG B 108 7.348 11.723 -1.874 1.00 0.00 H new ATOM 0 HB2 ARG B 108 8.932 10.842 -4.318 1.00 0.00 H new ATOM 0 HB3 ARG B 108 8.032 12.346 -4.268 1.00 0.00 H new ATOM 0 HG2 ARG B 108 9.387 13.172 -2.424 1.00 0.00 H new ATOM 0 HG3 ARG B 108 10.188 11.623 -2.255 1.00 0.00 H new ATOM 0 HD2 ARG B 108 11.634 13.173 -3.461 1.00 0.00 H new ATOM 0 HD3 ARG B 108 11.160 11.857 -4.516 1.00 0.00 H new ATOM 0 HE ARG B 108 9.277 13.919 -4.932 1.00 0.00 H new ATOM 0 HH11 ARG B 108 12.751 13.380 -5.280 1.00 0.00 H new ATOM 0 HH12 ARG B 108 12.910 14.505 -6.633 1.00 0.00 H new ATOM 0 HH21 ARG B 108 9.490 15.377 -6.663 1.00 0.00 H new ATOM 0 HH22 ARG B 108 11.068 15.632 -7.414 1.00 0.00 H new ATOM 1325 N VAL B 109 6.314 9.607 -4.186 1.00 0.00 N ATOM 1326 CA VAL B 109 5.144 9.191 -4.955 1.00 0.00 C ATOM 1327 C VAL B 109 3.990 8.814 -4.035 1.00 0.00 C ATOM 1328 O VAL B 109 2.832 9.119 -4.319 1.00 0.00 O ATOM 1329 CB VAL B 109 5.465 8.003 -5.886 1.00 0.00 C ATOM 1330 CG1 VAL B 109 4.260 7.653 -6.748 1.00 0.00 C ATOM 1331 CG2 VAL B 109 6.672 8.318 -6.752 1.00 0.00 C ATOM 0 H VAL B 109 7.144 9.034 -4.340 1.00 0.00 H new ATOM 0 HA VAL B 109 4.851 10.043 -5.568 1.00 0.00 H new ATOM 0 HB VAL B 109 5.702 7.137 -5.268 1.00 0.00 H new ATOM 0 HG11 VAL B 109 4.508 6.813 -7.397 1.00 0.00 H new ATOM 0 HG12 VAL B 109 3.421 7.381 -6.107 1.00 0.00 H new ATOM 0 HG13 VAL B 109 3.987 8.514 -7.358 1.00 0.00 H new ATOM 0 HG21 VAL B 109 6.885 7.470 -7.402 1.00 0.00 H new ATOM 0 HG22 VAL B 109 6.464 9.198 -7.360 1.00 0.00 H new ATOM 0 HG23 VAL B 109 7.535 8.513 -6.116 1.00 0.00 H new ATOM 1341 N TYR B 110 4.316 8.171 -2.923 1.00 0.00 N ATOM 1342 CA TYR B 110 3.312 7.769 -1.952 1.00 0.00 C ATOM 1343 C TYR B 110 2.739 8.987 -1.239 1.00 0.00 C ATOM 1344 O TYR B 110 1.572 9.004 -0.854 1.00 0.00 O ATOM 1345 CB TYR B 110 3.910 6.780 -0.951 1.00 0.00 C ATOM 1346 CG TYR B 110 4.118 5.389 -1.509 1.00 0.00 C ATOM 1347 CD1 TYR B 110 4.270 4.304 -0.660 1.00 0.00 C ATOM 1348 CD2 TYR B 110 4.150 5.157 -2.880 1.00 0.00 C ATOM 1349 CE1 TYR B 110 4.450 3.029 -1.159 1.00 0.00 C ATOM 1350 CE2 TYR B 110 4.329 3.887 -3.383 1.00 0.00 C ATOM 1351 CZ TYR B 110 4.478 2.826 -2.518 1.00 0.00 C ATOM 1352 OH TYR B 110 4.660 1.557 -3.018 1.00 0.00 O ATOM 0 H TYR B 110 5.271 7.916 -2.671 1.00 0.00 H new ATOM 0 HA TYR B 110 2.496 7.273 -2.478 1.00 0.00 H new ATOM 0 HB2 TYR B 110 4.867 7.167 -0.601 1.00 0.00 H new ATOM 0 HB3 TYR B 110 3.255 6.718 -0.082 1.00 0.00 H new ATOM 0 HD1 TYR B 110 4.247 4.458 0.409 1.00 0.00 H new ATOM 0 HD2 TYR B 110 4.033 5.986 -3.562 1.00 0.00 H new ATOM 0 HE1 TYR B 110 4.568 2.194 -0.484 1.00 0.00 H new ATOM 0 HE2 TYR B 110 4.352 3.724 -4.450 1.00 0.00 H new ATOM 0 HH TYR B 110 5.364 1.572 -3.700 1.00 0.00 H new ATOM 1362 N LYS B 111 3.565 10.017 -1.082 1.00 0.00 N ATOM 1363 CA LYS B 111 3.110 11.282 -0.523 1.00 0.00 C ATOM 1364 C LYS B 111 2.111 11.926 -1.473 1.00 0.00 C ATOM 1365 O LYS B 111 1.093 12.476 -1.050 1.00 0.00 O ATOM 1366 CB LYS B 111 4.301 12.218 -0.281 1.00 0.00 C ATOM 1367 CG LYS B 111 3.920 13.589 0.260 1.00 0.00 C ATOM 1368 CD LYS B 111 3.231 13.493 1.613 1.00 0.00 C ATOM 1369 CE LYS B 111 2.989 14.870 2.212 1.00 0.00 C ATOM 1370 NZ LYS B 111 2.077 15.701 1.377 1.00 0.00 N ATOM 0 H LYS B 111 4.553 9.999 -1.335 1.00 0.00 H new ATOM 0 HA LYS B 111 2.623 11.097 0.435 1.00 0.00 H new ATOM 0 HB2 LYS B 111 4.986 11.741 0.420 1.00 0.00 H new ATOM 0 HB3 LYS B 111 4.843 12.348 -1.218 1.00 0.00 H new ATOM 0 HG2 LYS B 111 4.815 14.205 0.351 1.00 0.00 H new ATOM 0 HG3 LYS B 111 3.260 14.089 -0.449 1.00 0.00 H new ATOM 0 HD2 LYS B 111 2.281 12.971 1.503 1.00 0.00 H new ATOM 0 HD3 LYS B 111 3.843 12.901 2.293 1.00 0.00 H new ATOM 0 HE2 LYS B 111 2.564 14.760 3.210 1.00 0.00 H new ATOM 0 HE3 LYS B 111 3.942 15.386 2.327 1.00 0.00 H new ATOM 0 HZ1 LYS B 111 1.890 16.603 1.860 1.00 0.00 H new ATOM 0 HZ2 LYS B 111 2.523 15.887 0.456 1.00 0.00 H new ATOM 0 HZ3 LYS B 111 1.181 15.194 1.231 1.00 0.00 H new ATOM 1384 N LYS B 112 2.406 11.826 -2.763 1.00 0.00 N ATOM 1385 CA LYS B 112 1.528 12.341 -3.802 1.00 0.00 C ATOM 1386 C LYS B 112 0.201 11.583 -3.813 1.00 0.00 C ATOM 1387 O LYS B 112 -0.845 12.153 -4.136 1.00 0.00 O ATOM 1388 CB LYS B 112 2.218 12.239 -5.163 1.00 0.00 C ATOM 1389 CG LYS B 112 3.499 13.057 -5.250 1.00 0.00 C ATOM 1390 CD LYS B 112 4.327 12.686 -6.472 1.00 0.00 C ATOM 1391 CE LYS B 112 3.597 12.977 -7.772 1.00 0.00 C ATOM 1392 NZ LYS B 112 3.400 14.433 -7.996 1.00 0.00 N ATOM 0 H LYS B 112 3.257 11.388 -3.116 1.00 0.00 H new ATOM 0 HA LYS B 112 1.315 13.389 -3.593 1.00 0.00 H new ATOM 0 HB2 LYS B 112 2.448 11.194 -5.369 1.00 0.00 H new ATOM 0 HB3 LYS B 112 1.528 12.573 -5.938 1.00 0.00 H new ATOM 0 HG2 LYS B 112 3.251 14.118 -5.288 1.00 0.00 H new ATOM 0 HG3 LYS B 112 4.092 12.901 -4.349 1.00 0.00 H new ATOM 0 HD2 LYS B 112 5.266 13.239 -6.453 1.00 0.00 H new ATOM 0 HD3 LYS B 112 4.580 11.627 -6.429 1.00 0.00 H new ATOM 0 HE2 LYS B 112 4.161 12.557 -8.605 1.00 0.00 H new ATOM 0 HE3 LYS B 112 2.627 12.479 -7.761 1.00 0.00 H new ATOM 0 HZ1 LYS B 112 2.990 14.587 -8.939 1.00 0.00 H new ATOM 0 HZ2 LYS B 112 2.756 14.811 -7.273 1.00 0.00 H new ATOM 0 HZ3 LYS B 112 4.316 14.921 -7.933 1.00 0.00 H new ATOM 1406 N GLU B 113 0.244 10.301 -3.443 1.00 0.00 N ATOM 1407 CA GLU B 113 -0.971 9.498 -3.340 1.00 0.00 C ATOM 1408 C GLU B 113 -1.882 10.061 -2.266 1.00 0.00 C ATOM 1409 O GLU B 113 -3.081 10.211 -2.475 1.00 0.00 O ATOM 1410 CB GLU B 113 -0.661 8.034 -3.014 1.00 0.00 C ATOM 1411 CG GLU B 113 0.223 7.353 -4.038 1.00 0.00 C ATOM 1412 CD GLU B 113 0.119 5.843 -3.987 1.00 0.00 C ATOM 1413 OE1 GLU B 113 -0.959 5.308 -4.316 1.00 0.00 O ATOM 1414 OE2 GLU B 113 1.120 5.182 -3.646 1.00 0.00 O ATOM 0 H GLU B 113 1.103 9.801 -3.212 1.00 0.00 H new ATOM 0 HA GLU B 113 -1.466 9.538 -4.310 1.00 0.00 H new ATOM 0 HB2 GLU B 113 -0.177 7.983 -2.039 1.00 0.00 H new ATOM 0 HB3 GLU B 113 -1.598 7.483 -2.933 1.00 0.00 H new ATOM 0 HG2 GLU B 113 -0.050 7.699 -5.035 1.00 0.00 H new ATOM 0 HG3 GLU B 113 1.259 7.648 -3.871 1.00 0.00 H new ATOM 1421 N ILE B 114 -1.299 10.378 -1.118 1.00 0.00 N ATOM 1422 CA ILE B 114 -2.049 10.926 0.001 1.00 0.00 C ATOM 1423 C ILE B 114 -2.721 12.240 -0.372 1.00 0.00 C ATOM 1424 O ILE B 114 -3.845 12.509 0.039 1.00 0.00 O ATOM 1425 CB ILE B 114 -1.132 11.144 1.211 1.00 0.00 C ATOM 1426 CG1 ILE B 114 -0.504 9.812 1.612 1.00 0.00 C ATOM 1427 CG2 ILE B 114 -1.911 11.753 2.370 1.00 0.00 C ATOM 1428 CD1 ILE B 114 0.486 9.928 2.740 1.00 0.00 C ATOM 0 H ILE B 114 -0.302 10.263 -0.938 1.00 0.00 H new ATOM 0 HA ILE B 114 -2.822 10.203 0.261 1.00 0.00 H new ATOM 0 HB ILE B 114 -0.339 11.843 0.944 1.00 0.00 H new ATOM 0 HG12 ILE B 114 -1.294 9.120 1.903 1.00 0.00 H new ATOM 0 HG13 ILE B 114 -0.005 9.379 0.745 1.00 0.00 H new ATOM 0 HG21 ILE B 114 -1.244 11.900 3.219 1.00 0.00 H new ATOM 0 HG22 ILE B 114 -2.327 12.713 2.064 1.00 0.00 H new ATOM 0 HG23 ILE B 114 -2.721 11.082 2.657 1.00 0.00 H new ATOM 0 HD11 ILE B 114 0.891 8.943 2.971 1.00 0.00 H new ATOM 0 HD12 ILE B 114 1.297 10.594 2.445 1.00 0.00 H new ATOM 0 HD13 ILE B 114 -0.012 10.331 3.622 1.00 0.00 H new ATOM 1440 N GLN B 115 -2.033 13.050 -1.161 1.00 0.00 N ATOM 1441 CA GLN B 115 -2.575 14.324 -1.602 1.00 0.00 C ATOM 1442 C GLN B 115 -3.789 14.102 -2.496 1.00 0.00 C ATOM 1443 O GLN B 115 -4.791 14.807 -2.392 1.00 0.00 O ATOM 1444 CB GLN B 115 -1.506 15.112 -2.337 1.00 0.00 C ATOM 1445 CG GLN B 115 -0.190 15.138 -1.586 1.00 0.00 C ATOM 1446 CD GLN B 115 0.793 16.128 -2.160 1.00 0.00 C ATOM 1447 OE1 GLN B 115 1.658 16.648 -1.451 1.00 0.00 O ATOM 1448 NE2 GLN B 115 0.664 16.406 -3.443 1.00 0.00 N ATOM 0 H GLN B 115 -1.096 12.847 -1.509 1.00 0.00 H new ATOM 0 HA GLN B 115 -2.894 14.896 -0.730 1.00 0.00 H new ATOM 0 HB2 GLN B 115 -1.350 14.675 -3.323 1.00 0.00 H new ATOM 0 HB3 GLN B 115 -1.853 16.134 -2.492 1.00 0.00 H new ATOM 0 HG2 GLN B 115 -0.378 15.385 -0.541 1.00 0.00 H new ATOM 0 HG3 GLN B 115 0.253 14.142 -1.604 1.00 0.00 H new ATOM 0 HE21 GLN B 115 -0.066 15.952 -3.992 1.00 0.00 H new ATOM 0 HE22 GLN B 115 1.294 17.075 -3.886 1.00 0.00 H new ATOM 1457 N ALA B 116 -3.691 13.108 -3.367 1.00 0.00 N ATOM 1458 CA ALA B 116 -4.820 12.704 -4.195 1.00 0.00 C ATOM 1459 C ALA B 116 -5.935 12.147 -3.317 1.00 0.00 C ATOM 1460 O ALA B 116 -7.104 12.493 -3.475 1.00 0.00 O ATOM 1461 CB ALA B 116 -4.383 11.664 -5.214 1.00 0.00 C ATOM 0 H ALA B 116 -2.841 12.565 -3.519 1.00 0.00 H new ATOM 0 HA ALA B 116 -5.194 13.577 -4.730 1.00 0.00 H new ATOM 0 HB1 ALA B 116 -5.237 11.372 -5.825 1.00 0.00 H new ATOM 0 HB2 ALA B 116 -3.606 12.085 -5.853 1.00 0.00 H new ATOM 0 HB3 ALA B 116 -3.992 10.789 -4.696 1.00 0.00 H new ATOM 1467 N LEU B 117 -5.536 11.302 -2.375 1.00 0.00 N ATOM 1468 CA LEU B 117 -6.443 10.702 -1.404 1.00 0.00 C ATOM 1469 C LEU B 117 -7.153 11.767 -0.575 1.00 0.00 C ATOM 1470 O LEU B 117 -8.253 11.547 -0.089 1.00 0.00 O ATOM 1471 CB LEU B 117 -5.653 9.775 -0.475 1.00 0.00 C ATOM 1472 CG LEU B 117 -5.618 8.284 -0.845 1.00 0.00 C ATOM 1473 CD1 LEU B 117 -5.657 8.066 -2.348 1.00 0.00 C ATOM 1474 CD2 LEU B 117 -4.366 7.644 -0.272 1.00 0.00 C ATOM 0 H LEU B 117 -4.565 11.011 -2.262 1.00 0.00 H new ATOM 0 HA LEU B 117 -7.198 10.135 -1.948 1.00 0.00 H new ATOM 0 HB2 LEU B 117 -4.626 10.137 -0.428 1.00 0.00 H new ATOM 0 HB3 LEU B 117 -6.069 9.866 0.528 1.00 0.00 H new ATOM 0 HG LEU B 117 -6.508 7.819 -0.420 1.00 0.00 H new ATOM 0 HD11 LEU B 117 -5.630 6.997 -2.561 1.00 0.00 H new ATOM 0 HD12 LEU B 117 -6.573 8.494 -2.754 1.00 0.00 H new ATOM 0 HD13 LEU B 117 -4.795 8.550 -2.808 1.00 0.00 H new ATOM 0 HD21 LEU B 117 -4.344 6.587 -0.536 1.00 0.00 H new ATOM 0 HD22 LEU B 117 -3.485 8.138 -0.681 1.00 0.00 H new ATOM 0 HD23 LEU B 117 -4.369 7.747 0.813 1.00 0.00 H new ATOM 1486 N ASP B 118 -6.512 12.915 -0.417 1.00 0.00 N ATOM 1487 CA ASP B 118 -7.069 14.014 0.365 1.00 0.00 C ATOM 1488 C ASP B 118 -8.289 14.620 -0.330 1.00 0.00 C ATOM 1489 O ASP B 118 -9.246 15.040 0.320 1.00 0.00 O ATOM 1490 CB ASP B 118 -5.992 15.072 0.606 1.00 0.00 C ATOM 1491 CG ASP B 118 -6.494 16.257 1.398 1.00 0.00 C ATOM 1492 OD1 ASP B 118 -6.583 16.154 2.640 1.00 0.00 O ATOM 1493 OD2 ASP B 118 -6.763 17.311 0.788 1.00 0.00 O ATOM 0 H ASP B 118 -5.597 13.113 -0.823 1.00 0.00 H new ATOM 0 HA ASP B 118 -7.402 13.626 1.328 1.00 0.00 H new ATOM 0 HB2 ASP B 118 -5.155 14.616 1.136 1.00 0.00 H new ATOM 0 HB3 ASP B 118 -5.610 15.419 -0.354 1.00 0.00 H new ATOM 1498 N ALA B 119 -8.261 14.644 -1.656 1.00 0.00 N ATOM 1499 CA ALA B 119 -9.427 15.060 -2.428 1.00 0.00 C ATOM 1500 C ALA B 119 -10.537 14.034 -2.243 1.00 0.00 C ATOM 1501 O ALA B 119 -11.720 14.368 -2.111 1.00 0.00 O ATOM 1502 CB ALA B 119 -9.069 15.204 -3.898 1.00 0.00 C ATOM 0 H ALA B 119 -7.450 14.383 -2.217 1.00 0.00 H new ATOM 0 HA ALA B 119 -9.771 16.031 -2.072 1.00 0.00 H new ATOM 0 HB1 ALA B 119 -9.951 15.515 -4.458 1.00 0.00 H new ATOM 0 HB2 ALA B 119 -8.285 15.953 -4.010 1.00 0.00 H new ATOM 0 HB3 ALA B 119 -8.714 14.247 -4.281 1.00 0.00 H new ATOM 1508 N GLU B 120 -10.126 12.779 -2.212 1.00 0.00 N ATOM 1509 CA GLU B 120 -11.015 11.680 -1.920 1.00 0.00 C ATOM 1510 C GLU B 120 -11.536 11.777 -0.481 1.00 0.00 C ATOM 1511 O GLU B 120 -12.614 11.294 -0.172 1.00 0.00 O ATOM 1512 CB GLU B 120 -10.277 10.363 -2.123 1.00 0.00 C ATOM 1513 CG GLU B 120 -10.345 9.779 -3.527 1.00 0.00 C ATOM 1514 CD GLU B 120 -10.093 10.784 -4.627 1.00 0.00 C ATOM 1515 OE1 GLU B 120 -8.933 10.928 -5.064 1.00 0.00 O ATOM 1516 OE2 GLU B 120 -11.071 11.408 -5.084 1.00 0.00 O ATOM 0 H GLU B 120 -9.162 12.497 -2.390 1.00 0.00 H new ATOM 0 HA GLU B 120 -11.869 11.725 -2.596 1.00 0.00 H new ATOM 0 HB2 GLU B 120 -9.229 10.510 -1.861 1.00 0.00 H new ATOM 0 HB3 GLU B 120 -10.680 9.630 -1.424 1.00 0.00 H new ATOM 0 HG2 GLU B 120 -9.614 8.975 -3.610 1.00 0.00 H new ATOM 0 HG3 GLU B 120 -11.328 9.333 -3.676 1.00 0.00 H new ATOM 1523 N ILE B 121 -10.758 12.378 0.408 1.00 0.00 N ATOM 1524 CA ILE B 121 -11.210 12.610 1.777 1.00 0.00 C ATOM 1525 C ILE B 121 -12.541 13.356 1.781 1.00 0.00 C ATOM 1526 O ILE B 121 -13.410 13.069 2.593 1.00 0.00 O ATOM 1527 CB ILE B 121 -10.144 13.366 2.621 1.00 0.00 C ATOM 1528 CG1 ILE B 121 -9.457 12.405 3.594 1.00 0.00 C ATOM 1529 CG2 ILE B 121 -10.740 14.546 3.384 1.00 0.00 C ATOM 1530 CD1 ILE B 121 -8.753 11.252 2.919 1.00 0.00 C ATOM 0 H ILE B 121 -9.815 12.713 0.210 1.00 0.00 H new ATOM 0 HA ILE B 121 -11.356 11.637 2.245 1.00 0.00 H new ATOM 0 HB ILE B 121 -9.408 13.766 1.924 1.00 0.00 H new ATOM 0 HG12 ILE B 121 -8.733 12.962 4.189 1.00 0.00 H new ATOM 0 HG13 ILE B 121 -10.201 12.009 4.285 1.00 0.00 H new ATOM 0 HG21 ILE B 121 -9.957 15.041 3.958 1.00 0.00 H new ATOM 0 HG22 ILE B 121 -11.175 15.253 2.678 1.00 0.00 H new ATOM 0 HG23 ILE B 121 -11.514 14.187 4.062 1.00 0.00 H new ATOM 0 HD11 ILE B 121 -8.291 10.616 3.674 1.00 0.00 H new ATOM 0 HD12 ILE B 121 -9.475 10.670 2.346 1.00 0.00 H new ATOM 0 HD13 ILE B 121 -7.984 11.637 2.249 1.00 0.00 H new ATOM 1542 N ARG B 122 -12.708 14.281 0.842 1.00 0.00 N ATOM 1543 CA ARG B 122 -13.947 15.016 0.702 1.00 0.00 C ATOM 1544 C ARG B 122 -15.110 14.073 0.391 1.00 0.00 C ATOM 1545 O ARG B 122 -16.200 14.210 0.951 1.00 0.00 O ATOM 1546 CB ARG B 122 -13.791 16.045 -0.404 1.00 0.00 C ATOM 1547 CG ARG B 122 -12.652 17.019 -0.164 1.00 0.00 C ATOM 1548 CD ARG B 122 -12.538 18.034 -1.285 1.00 0.00 C ATOM 1549 NE ARG B 122 -12.325 17.400 -2.586 1.00 0.00 N ATOM 1550 CZ ARG B 122 -11.806 18.026 -3.639 1.00 0.00 C ATOM 1551 NH1 ARG B 122 -11.413 19.290 -3.536 1.00 0.00 N ATOM 1552 NH2 ARG B 122 -11.682 17.389 -4.796 1.00 0.00 N ATOM 0 H ARG B 122 -11.990 14.537 0.164 1.00 0.00 H new ATOM 0 HA ARG B 122 -14.170 15.519 1.643 1.00 0.00 H new ATOM 0 HB2 ARG B 122 -13.625 15.529 -1.350 1.00 0.00 H new ATOM 0 HB3 ARG B 122 -14.722 16.603 -0.505 1.00 0.00 H new ATOM 0 HG2 ARG B 122 -12.809 17.537 0.782 1.00 0.00 H new ATOM 0 HG3 ARG B 122 -11.715 16.469 -0.074 1.00 0.00 H new ATOM 0 HD2 ARG B 122 -13.446 18.636 -1.321 1.00 0.00 H new ATOM 0 HD3 ARG B 122 -11.712 18.714 -1.075 1.00 0.00 H new ATOM 0 HE ARG B 122 -12.590 16.421 -2.692 1.00 0.00 H new ATOM 0 HH11 ARG B 122 -11.509 19.783 -2.648 1.00 0.00 H new ATOM 0 HH12 ARG B 122 -11.015 19.768 -4.345 1.00 0.00 H new ATOM 0 HH21 ARG B 122 -11.985 16.418 -4.879 1.00 0.00 H new ATOM 0 HH22 ARG B 122 -11.284 17.870 -5.603 1.00 0.00 H new ATOM 1566 N LYS B 123 -14.868 13.110 -0.497 1.00 0.00 N ATOM 1567 CA LYS B 123 -15.886 12.110 -0.840 1.00 0.00 C ATOM 1568 C LYS B 123 -16.215 11.252 0.378 1.00 0.00 C ATOM 1569 O LYS B 123 -17.327 10.749 0.526 1.00 0.00 O ATOM 1570 CB LYS B 123 -15.411 11.227 -1.994 1.00 0.00 C ATOM 1571 CG LYS B 123 -14.612 10.001 -1.567 1.00 0.00 C ATOM 1572 CD LYS B 123 -13.634 9.563 -2.642 1.00 0.00 C ATOM 1573 CE LYS B 123 -14.204 9.752 -4.030 1.00 0.00 C ATOM 1574 NZ LYS B 123 -13.178 9.626 -5.098 1.00 0.00 N ATOM 0 H LYS B 123 -13.983 12.998 -0.991 1.00 0.00 H new ATOM 0 HA LYS B 123 -16.788 12.634 -1.157 1.00 0.00 H new ATOM 0 HB2 LYS B 123 -16.280 10.898 -2.564 1.00 0.00 H new ATOM 0 HB3 LYS B 123 -14.798 11.828 -2.666 1.00 0.00 H new ATOM 0 HG2 LYS B 123 -14.068 10.223 -0.649 1.00 0.00 H new ATOM 0 HG3 LYS B 123 -15.295 9.182 -1.342 1.00 0.00 H new ATOM 0 HD2 LYS B 123 -12.710 10.134 -2.548 1.00 0.00 H new ATOM 0 HD3 LYS B 123 -13.377 8.514 -2.494 1.00 0.00 H new ATOM 0 HE2 LYS B 123 -14.989 9.015 -4.198 1.00 0.00 H new ATOM 0 HE3 LYS B 123 -14.670 10.735 -4.095 1.00 0.00 H new ATOM 0 HZ1 LYS B 123 -13.643 9.629 -6.028 1.00 0.00 H new ATOM 0 HZ2 LYS B 123 -12.516 10.426 -5.039 1.00 0.00 H new ATOM 0 HZ3 LYS B 123 -12.656 8.735 -4.975 1.00 0.00 H new ATOM 1588 N LEU B 124 -15.226 11.074 1.235 1.00 0.00 N ATOM 1589 CA LEU B 124 -15.417 10.379 2.487 1.00 0.00 C ATOM 1590 C LEU B 124 -16.216 11.236 3.460 1.00 0.00 C ATOM 1591 O LEU B 124 -17.172 10.760 4.061 1.00 0.00 O ATOM 1592 CB LEU B 124 -14.062 10.014 3.084 1.00 0.00 C ATOM 1593 CG LEU B 124 -13.292 8.924 2.339 1.00 0.00 C ATOM 1594 CD1 LEU B 124 -11.938 8.695 2.991 1.00 0.00 C ATOM 1595 CD2 LEU B 124 -14.097 7.641 2.314 1.00 0.00 C ATOM 0 H LEU B 124 -14.274 11.407 1.081 1.00 0.00 H new ATOM 0 HA LEU B 124 -15.981 9.465 2.301 1.00 0.00 H new ATOM 0 HB2 LEU B 124 -13.445 10.912 3.119 1.00 0.00 H new ATOM 0 HB3 LEU B 124 -14.213 9.690 4.114 1.00 0.00 H new ATOM 0 HG LEU B 124 -13.127 9.249 1.312 1.00 0.00 H new ATOM 0 HD11 LEU B 124 -11.401 7.916 2.450 1.00 0.00 H new ATOM 0 HD12 LEU B 124 -11.361 9.619 2.965 1.00 0.00 H new ATOM 0 HD13 LEU B 124 -12.080 8.385 4.026 1.00 0.00 H new ATOM 0 HD21 LEU B 124 -13.539 6.872 1.781 1.00 0.00 H new ATOM 0 HD22 LEU B 124 -14.286 7.310 3.335 1.00 0.00 H new ATOM 0 HD23 LEU B 124 -15.046 7.817 1.808 1.00 0.00 H new ATOM 1607 N GLU B 125 -15.837 12.509 3.587 1.00 0.00 N ATOM 1608 CA GLU B 125 -16.485 13.422 4.530 1.00 0.00 C ATOM 1609 C GLU B 125 -17.985 13.510 4.284 1.00 0.00 C ATOM 1610 O GLU B 125 -18.773 13.501 5.230 1.00 0.00 O ATOM 1611 CB GLU B 125 -15.879 14.824 4.454 1.00 0.00 C ATOM 1612 CG GLU B 125 -14.385 14.880 4.728 1.00 0.00 C ATOM 1613 CD GLU B 125 -13.854 16.297 4.722 1.00 0.00 C ATOM 1614 OE1 GLU B 125 -13.146 16.676 5.678 1.00 0.00 O ATOM 1615 OE2 GLU B 125 -14.158 17.050 3.773 1.00 0.00 O ATOM 0 H GLU B 125 -15.082 12.932 3.047 1.00 0.00 H new ATOM 0 HA GLU B 125 -16.315 13.013 5.526 1.00 0.00 H new ATOM 0 HB2 GLU B 125 -16.070 15.235 3.463 1.00 0.00 H new ATOM 0 HB3 GLU B 125 -16.391 15.467 5.170 1.00 0.00 H new ATOM 0 HG2 GLU B 125 -14.177 14.420 5.694 1.00 0.00 H new ATOM 0 HG3 GLU B 125 -13.857 14.293 3.976 1.00 0.00 H new ATOM 1622 N ARG B 126 -18.381 13.593 3.019 1.00 0.00 N ATOM 1623 CA ARG B 126 -19.798 13.656 2.680 1.00 0.00 C ATOM 1624 C ARG B 126 -20.521 12.386 3.125 1.00 0.00 C ATOM 1625 O ARG B 126 -21.668 12.444 3.558 1.00 0.00 O ATOM 1626 CB ARG B 126 -20.007 13.899 1.181 1.00 0.00 C ATOM 1627 CG ARG B 126 -19.252 12.932 0.291 1.00 0.00 C ATOM 1628 CD ARG B 126 -19.595 13.123 -1.176 1.00 0.00 C ATOM 1629 NE ARG B 126 -20.960 12.702 -1.477 1.00 0.00 N ATOM 1630 CZ ARG B 126 -21.476 12.658 -2.704 1.00 0.00 C ATOM 1631 NH1 ARG B 126 -20.756 13.049 -3.753 1.00 0.00 N ATOM 1632 NH2 ARG B 126 -22.718 12.228 -2.880 1.00 0.00 N ATOM 0 H ARG B 126 -17.749 13.618 2.219 1.00 0.00 H new ATOM 0 HA ARG B 126 -20.226 14.503 3.217 1.00 0.00 H new ATOM 0 HB2 ARG B 126 -21.071 13.829 0.956 1.00 0.00 H new ATOM 0 HB3 ARG B 126 -19.697 14.916 0.941 1.00 0.00 H new ATOM 0 HG2 ARG B 126 -18.180 13.069 0.434 1.00 0.00 H new ATOM 0 HG3 ARG B 126 -19.485 11.909 0.588 1.00 0.00 H new ATOM 0 HD2 ARG B 126 -19.472 14.172 -1.444 1.00 0.00 H new ATOM 0 HD3 ARG B 126 -18.896 12.554 -1.789 1.00 0.00 H new ATOM 0 HE ARG B 126 -21.557 12.424 -0.698 1.00 0.00 H new ATOM 0 HH11 ARG B 126 -19.802 13.385 -3.620 1.00 0.00 H new ATOM 0 HH12 ARG B 126 -21.158 13.012 -4.690 1.00 0.00 H new ATOM 0 HH21 ARG B 126 -23.274 11.933 -2.077 1.00 0.00 H new ATOM 0 HH22 ARG B 126 -23.117 12.193 -3.818 1.00 0.00 H new ATOM 1646 N LEU B 127 -19.842 11.243 3.039 1.00 0.00 N ATOM 1647 CA LEU B 127 -20.417 9.988 3.508 1.00 0.00 C ATOM 1648 C LEU B 127 -20.384 9.926 5.034 1.00 0.00 C ATOM 1649 O LEU B 127 -21.298 9.390 5.662 1.00 0.00 O ATOM 1650 CB LEU B 127 -19.674 8.789 2.911 1.00 0.00 C ATOM 1651 CG LEU B 127 -20.261 7.421 3.270 1.00 0.00 C ATOM 1652 CD1 LEU B 127 -21.707 7.317 2.812 1.00 0.00 C ATOM 1653 CD2 LEU B 127 -19.430 6.308 2.654 1.00 0.00 C ATOM 0 H LEU B 127 -18.902 11.162 2.652 1.00 0.00 H new ATOM 0 HA LEU B 127 -21.455 9.945 3.177 1.00 0.00 H new ATOM 0 HB2 LEU B 127 -19.664 8.890 1.826 1.00 0.00 H new ATOM 0 HB3 LEU B 127 -18.636 8.821 3.243 1.00 0.00 H new ATOM 0 HG LEU B 127 -20.237 7.314 4.355 1.00 0.00 H new ATOM 0 HD11 LEU B 127 -22.103 6.337 3.078 1.00 0.00 H new ATOM 0 HD12 LEU B 127 -22.299 8.092 3.299 1.00 0.00 H new ATOM 0 HD13 LEU B 127 -21.757 7.448 1.731 1.00 0.00 H new ATOM 0 HD21 LEU B 127 -19.861 5.343 2.919 1.00 0.00 H new ATOM 0 HD22 LEU B 127 -19.423 6.417 1.569 1.00 0.00 H new ATOM 0 HD23 LEU B 127 -18.409 6.365 3.031 1.00 0.00 H new ATOM 1665 N LEU B 128 -19.324 10.473 5.623 1.00 0.00 N ATOM 1666 CA LEU B 128 -19.208 10.564 7.074 1.00 0.00 C ATOM 1667 C LEU B 128 -20.421 11.270 7.658 1.00 0.00 C ATOM 1668 O LEU B 128 -21.150 10.707 8.476 1.00 0.00 O ATOM 1669 CB LEU B 128 -17.935 11.319 7.472 1.00 0.00 C ATOM 1670 CG LEU B 128 -16.633 10.702 6.972 1.00 0.00 C ATOM 1671 CD1 LEU B 128 -15.437 11.508 7.451 1.00 0.00 C ATOM 1672 CD2 LEU B 128 -16.520 9.256 7.420 1.00 0.00 C ATOM 0 H LEU B 128 -18.530 10.861 5.114 1.00 0.00 H new ATOM 0 HA LEU B 128 -19.155 9.551 7.472 1.00 0.00 H new ATOM 0 HB2 LEU B 128 -18.004 12.339 7.095 1.00 0.00 H new ATOM 0 HB3 LEU B 128 -17.894 11.383 8.559 1.00 0.00 H new ATOM 0 HG LEU B 128 -16.642 10.722 5.882 1.00 0.00 H new ATOM 0 HD11 LEU B 128 -14.519 11.050 7.083 1.00 0.00 H new ATOM 0 HD12 LEU B 128 -15.511 12.528 7.073 1.00 0.00 H new ATOM 0 HD13 LEU B 128 -15.422 11.525 8.541 1.00 0.00 H new ATOM 0 HD21 LEU B 128 -15.584 8.834 7.053 1.00 0.00 H new ATOM 0 HD22 LEU B 128 -16.537 9.210 8.509 1.00 0.00 H new ATOM 0 HD23 LEU B 128 -17.358 8.685 7.020 1.00 0.00 H new ATOM 1684 N GLU B 129 -20.642 12.494 7.197 1.00 0.00 N ATOM 1685 CA GLU B 129 -21.768 13.308 7.643 1.00 0.00 C ATOM 1686 C GLU B 129 -23.095 12.692 7.209 1.00 0.00 C ATOM 1687 O GLU B 129 -24.133 12.928 7.825 1.00 0.00 O ATOM 1688 CB GLU B 129 -21.635 14.714 7.070 1.00 0.00 C ATOM 1689 CG GLU B 129 -20.291 15.356 7.359 1.00 0.00 C ATOM 1690 CD GLU B 129 -20.112 15.733 8.816 1.00 0.00 C ATOM 1691 OE1 GLU B 129 -20.017 16.942 9.110 1.00 0.00 O ATOM 1692 OE2 GLU B 129 -20.061 14.830 9.675 1.00 0.00 O ATOM 0 H GLU B 129 -20.048 12.951 6.505 1.00 0.00 H new ATOM 0 HA GLU B 129 -21.756 13.352 8.732 1.00 0.00 H new ATOM 0 HB2 GLU B 129 -21.787 14.675 5.991 1.00 0.00 H new ATOM 0 HB3 GLU B 129 -22.426 15.342 7.480 1.00 0.00 H new ATOM 0 HG2 GLU B 129 -19.497 14.669 7.068 1.00 0.00 H new ATOM 0 HG3 GLU B 129 -20.182 16.249 6.743 1.00 0.00 H new ATOM 1699 N SER B 130 -23.050 11.906 6.141 1.00 0.00 N ATOM 1700 CA SER B 130 -24.228 11.202 5.636 1.00 0.00 C ATOM 1701 C SER B 130 -24.717 10.153 6.641 1.00 0.00 C ATOM 1702 O SER B 130 -25.823 9.623 6.511 1.00 0.00 O ATOM 1703 CB SER B 130 -23.905 10.541 4.292 1.00 0.00 C ATOM 1704 OG SER B 130 -25.033 9.882 3.746 1.00 0.00 O ATOM 0 H SER B 130 -22.202 11.737 5.601 1.00 0.00 H new ATOM 0 HA SER B 130 -25.027 11.929 5.494 1.00 0.00 H new ATOM 0 HB2 SER B 130 -23.551 11.297 3.591 1.00 0.00 H new ATOM 0 HB3 SER B 130 -23.094 9.825 4.425 1.00 0.00 H new ATOM 0 HG SER B 130 -25.651 9.640 4.467 1.00 0.00 H new ATOM 1710 N GLY B 131 -23.896 9.853 7.639 1.00 0.00 N ATOM 1711 CA GLY B 131 -24.301 8.915 8.665 1.00 0.00 C ATOM 1712 C GLY B 131 -23.448 7.666 8.693 1.00 0.00 C ATOM 1713 O GLY B 131 -23.908 6.605 9.117 1.00 0.00 O ATOM 0 H GLY B 131 -22.960 10.241 7.755 1.00 0.00 H new ATOM 0 HA2 GLY B 131 -24.251 9.405 9.638 1.00 0.00 H new ATOM 0 HA3 GLY B 131 -25.342 8.634 8.503 1.00 0.00 H new ATOM 1717 N LEU B 132 -22.214 7.772 8.224 1.00 0.00 N ATOM 1718 CA LEU B 132 -21.276 6.672 8.320 1.00 0.00 C ATOM 1719 C LEU B 132 -20.728 6.603 9.735 1.00 0.00 C ATOM 1720 O LEU B 132 -20.916 5.618 10.452 1.00 0.00 O ATOM 1721 CB LEU B 132 -20.128 6.883 7.340 1.00 0.00 C ATOM 1722 CG LEU B 132 -19.282 5.650 7.035 1.00 0.00 C ATOM 1723 CD1 LEU B 132 -20.101 4.601 6.300 1.00 0.00 C ATOM 1724 CD2 LEU B 132 -18.070 6.053 6.221 1.00 0.00 C ATOM 0 H LEU B 132 -21.842 8.609 7.774 1.00 0.00 H new ATOM 0 HA LEU B 132 -21.786 5.740 8.077 1.00 0.00 H new ATOM 0 HB2 LEU B 132 -20.539 7.259 6.403 1.00 0.00 H new ATOM 0 HB3 LEU B 132 -19.475 7.660 7.737 1.00 0.00 H new ATOM 0 HG LEU B 132 -18.947 5.211 7.975 1.00 0.00 H new ATOM 0 HD11 LEU B 132 -19.477 3.731 6.093 1.00 0.00 H new ATOM 0 HD12 LEU B 132 -20.948 4.302 6.918 1.00 0.00 H new ATOM 0 HD13 LEU B 132 -20.466 5.017 5.361 1.00 0.00 H new ATOM 0 HD21 LEU B 132 -17.467 5.171 6.004 1.00 0.00 H new ATOM 0 HD22 LEU B 132 -18.395 6.509 5.286 1.00 0.00 H new ATOM 0 HD23 LEU B 132 -17.474 6.770 6.786 1.00 0.00 H new ATOM 1736 N THR B 133 -20.059 7.670 10.129 1.00 0.00 N ATOM 1737 CA THR B 133 -19.508 7.789 11.465 1.00 0.00 C ATOM 1738 C THR B 133 -20.522 8.429 12.407 1.00 0.00 C ATOM 1739 O THR B 133 -21.207 7.689 13.139 1.00 0.00 O ATOM 1740 CB THR B 133 -18.213 8.618 11.449 1.00 0.00 C ATOM 1741 OG1 THR B 133 -18.410 9.807 10.670 1.00 0.00 O ATOM 1742 CG2 THR B 133 -17.059 7.811 10.875 1.00 0.00 C ATOM 1743 OXT THR B 133 -20.651 9.671 12.389 1.00 0.00 O ATOM 0 H THR B 133 -19.882 8.478 9.532 1.00 0.00 H new ATOM 0 HA THR B 133 -19.276 6.786 11.824 1.00 0.00 H new ATOM 0 HB THR B 133 -17.964 8.890 12.475 1.00 0.00 H new ATOM 0 HG1 THR B 133 -19.248 10.238 10.937 1.00 0.00 H new ATOM 0 HG21 THR B 133 -16.154 8.419 10.874 1.00 0.00 H new ATOM 0 HG22 THR B 133 -16.898 6.922 11.485 1.00 0.00 H new ATOM 0 HG23 THR B 133 -17.296 7.513 9.854 1.00 0.00 H new TER 1751 THR B 133