USER MOD reduce.3.24.130724 H: found=0, std=0, add=787, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 784 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 Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 3 HIS : no HD1:sc= -0.15 X(o=-0.15,f=-0.01) USER MOD Single : A 4 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 5 GLN : amide:sc=-0.00674 X(o=-0.0067,f=0) USER MOD Single : A 7 THR OG1 : rot 180:sc= 0 USER MOD Single : A 9 LYS NZ :NH3+ -158:sc= 1.08 (180deg=0.21) USER MOD Single : A 11 LYS NZ :NH3+ -129:sc= 0.2 (180deg=-0.189) USER MOD Single : A 22 THR OG1 : rot 180:sc= -0.0205 USER MOD Single : A 26 THR OG1 : rot 180:sc= -0.227 USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 38 LYS NZ :NH3+ -177:sc= 0 (180deg=-0.00336) USER MOD Single : A 40 SER OG : rot 180:sc= 0 USER MOD Single : A 46 MET CE :methyl 165:sc= -0.679 (180deg=-1.99!) USER MOD Single : A 48 GLN : amide:sc= 0 X(o=0,f=-0.018) USER MOD Single : A 51 MET CE :methyl 153:sc= -8.03! (180deg=-10.1!) USER MOD Single : A 60 LYS NZ :NH3+ 153:sc= -0.253 (180deg=-1.12) USER MOD Single : A 62 HIS : no HD1:sc= -6.19! C(o=-6.2!,f=-6.5!) USER MOD Single : A 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 THR OG1 : rot 180:sc= 0 USER MOD Single : A 73 THR OG1 : rot 8:sc= -0.321 USER MOD Single : A 78 TYR OH : rot 180:sc= 0 USER MOD Single : A 79 HIS : no HD1:sc= -3.46 X(o=-3.5,f=-3.5!) USER MOD Single : A 82 ASN : amide:sc= -5.78! K(o=-5.8!,f=-1.9) USER MOD Single : A 84 LYS NZ :NH3+ 167:sc= -0.0378 (180deg=-0.259) USER MOD Single : A 86 LYS NZ :NH3+ -174:sc= -0.267! (180deg=-0.393) USER MOD Single : A 89 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= -3.25 K(o=-3.3,f=-5.6!) USER MOD Single : A 95 LYS NZ :NH3+ -161:sc= -0.013 (180deg=-0.127) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -21.627 3.306 6.063 1.00 0.00 N ATOM 2 CA GLY A 1 -20.868 4.574 5.880 1.00 0.00 C ATOM 3 C GLY A 1 -19.793 4.460 4.816 1.00 0.00 C ATOM 4 O GLY A 1 -20.085 4.510 3.622 1.00 0.00 O ATOM 0 H1 GLY A 1 -22.349 3.437 6.800 1.00 0.00 H new ATOM 0 H2 GLY A 1 -22.089 3.046 5.168 1.00 0.00 H new ATOM 0 H3 GLY A 1 -20.974 2.549 6.348 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -21.560 5.372 5.609 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -20.409 4.858 6.827 1.00 0.00 H new ATOM 10 N SER A 2 -18.546 4.308 5.251 1.00 0.00 N ATOM 11 CA SER A 2 -17.425 4.187 4.326 1.00 0.00 C ATOM 12 C SER A 2 -17.302 5.434 3.455 1.00 0.00 C ATOM 13 O SER A 2 -18.098 6.365 3.574 1.00 0.00 O ATOM 14 CB SER A 2 -17.594 2.947 3.444 1.00 0.00 C ATOM 15 OG SER A 2 -16.784 1.879 3.903 1.00 0.00 O ATOM 0 H SER A 2 -18.287 4.266 6.237 1.00 0.00 H new ATOM 0 HA SER A 2 -16.512 4.084 4.912 1.00 0.00 H new ATOM 0 HB2 SER A 2 -18.640 2.639 3.441 1.00 0.00 H new ATOM 0 HB3 SER A 2 -17.331 3.191 2.415 1.00 0.00 H new ATOM 0 HG SER A 2 -16.912 1.099 3.324 1.00 0.00 H new ATOM 21 N HIS A 3 -16.299 5.446 2.583 1.00 0.00 N ATOM 22 CA HIS A 3 -16.074 6.580 1.694 1.00 0.00 C ATOM 23 C HIS A 3 -15.007 6.254 0.655 1.00 0.00 C ATOM 24 O HIS A 3 -14.206 5.337 0.838 1.00 0.00 O ATOM 25 CB HIS A 3 -15.658 7.812 2.502 1.00 0.00 C ATOM 26 CG HIS A 3 -16.668 8.916 2.474 1.00 0.00 C ATOM 27 ND1 HIS A 3 -17.016 9.648 3.588 1.00 0.00 N ATOM 28 CD2 HIS A 3 -17.408 9.416 1.454 1.00 0.00 C ATOM 29 CE1 HIS A 3 -17.925 10.548 3.260 1.00 0.00 C ATOM 30 NE2 HIS A 3 -18.181 10.429 1.970 1.00 0.00 N ATOM 0 H HIS A 3 -15.630 4.684 2.473 1.00 0.00 H new ATOM 0 HA HIS A 3 -17.008 6.793 1.173 1.00 0.00 H new ATOM 0 HB2 HIS A 3 -15.484 7.516 3.537 1.00 0.00 H new ATOM 0 HB3 HIS A 3 -14.711 8.187 2.115 1.00 0.00 H new ATOM 0 HD2 HIS A 3 -17.393 9.081 0.427 1.00 0.00 H new ATOM 0 HE1 HIS A 3 -18.381 11.260 3.932 1.00 0.00 H new ATOM 0 HE2 HIS A 3 -18.844 10.996 1.442 1.00 0.00 H new ATOM 38 N MET A 4 -15.000 7.014 -0.436 1.00 0.00 N ATOM 39 CA MET A 4 -14.031 6.809 -1.506 1.00 0.00 C ATOM 40 C MET A 4 -13.858 8.082 -2.328 1.00 0.00 C ATOM 41 O MET A 4 -14.812 8.578 -2.929 1.00 0.00 O ATOM 42 CB MET A 4 -14.473 5.658 -2.410 1.00 0.00 C ATOM 43 CG MET A 4 -13.317 4.822 -2.939 1.00 0.00 C ATOM 44 SD MET A 4 -13.869 3.314 -3.758 1.00 0.00 S ATOM 45 CE MET A 4 -14.444 3.969 -5.322 1.00 0.00 C ATOM 0 H MET A 4 -15.655 7.778 -0.602 1.00 0.00 H new ATOM 0 HA MET A 4 -13.072 6.555 -1.054 1.00 0.00 H new ATOM 0 HB2 MET A 4 -15.154 5.012 -1.856 1.00 0.00 H new ATOM 0 HB3 MET A 4 -15.033 6.063 -3.253 1.00 0.00 H new ATOM 0 HG2 MET A 4 -12.733 5.419 -3.640 1.00 0.00 H new ATOM 0 HG3 MET A 4 -12.655 4.561 -2.114 1.00 0.00 H new ATOM 0 HE1 MET A 4 -14.818 3.154 -5.942 1.00 0.00 H new ATOM 0 HE2 MET A 4 -15.245 4.686 -5.144 1.00 0.00 H new ATOM 0 HE3 MET A 4 -13.620 4.466 -5.834 1.00 0.00 H new ATOM 55 N GLN A 5 -12.637 8.606 -2.351 1.00 0.00 N ATOM 56 CA GLN A 5 -12.342 9.821 -3.101 1.00 0.00 C ATOM 57 C GLN A 5 -11.783 9.488 -4.480 1.00 0.00 C ATOM 58 O GLN A 5 -12.342 9.891 -5.501 1.00 0.00 O ATOM 59 CB GLN A 5 -11.346 10.692 -2.331 1.00 0.00 C ATOM 60 CG GLN A 5 -12.008 11.664 -1.368 1.00 0.00 C ATOM 61 CD GLN A 5 -11.332 13.022 -1.353 1.00 0.00 C ATOM 62 OE1 GLN A 5 -11.988 14.056 -1.475 1.00 0.00 O ATOM 63 NE2 GLN A 5 -10.012 13.024 -1.201 1.00 0.00 N ATOM 0 H GLN A 5 -11.837 8.209 -1.859 1.00 0.00 H new ATOM 0 HA GLN A 5 -13.273 10.373 -3.230 1.00 0.00 H new ATOM 0 HB2 GLN A 5 -10.667 10.047 -1.774 1.00 0.00 H new ATOM 0 HB3 GLN A 5 -10.741 11.254 -3.043 1.00 0.00 H new ATOM 0 HG2 GLN A 5 -13.055 11.787 -1.644 1.00 0.00 H new ATOM 0 HG3 GLN A 5 -11.991 11.242 -0.363 1.00 0.00 H new ATOM 0 HE21 GLN A 5 -9.509 12.142 -1.103 1.00 0.00 H new ATOM 0 HE22 GLN A 5 -9.502 13.907 -1.182 1.00 0.00 H new ATOM 72 N ALA A 6 -10.678 8.751 -4.502 1.00 0.00 N ATOM 73 CA ALA A 6 -10.044 8.366 -5.757 1.00 0.00 C ATOM 74 C ALA A 6 -10.755 7.174 -6.387 1.00 0.00 C ATOM 75 O ALA A 6 -11.337 6.344 -5.688 1.00 0.00 O ATOM 76 CB ALA A 6 -8.574 8.049 -5.531 1.00 0.00 C ATOM 0 H ALA A 6 -10.204 8.409 -3.666 1.00 0.00 H new ATOM 0 HA ALA A 6 -10.120 9.207 -6.447 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -8.114 7.763 -6.477 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -8.069 8.929 -5.133 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -8.484 7.227 -4.821 1.00 0.00 H new ATOM 82 N THR A 7 -10.703 7.095 -7.712 1.00 0.00 N ATOM 83 CA THR A 7 -11.343 6.005 -8.440 1.00 0.00 C ATOM 84 C THR A 7 -10.315 5.188 -9.214 1.00 0.00 C ATOM 85 O THR A 7 -9.217 5.664 -9.502 1.00 0.00 O ATOM 86 CB THR A 7 -12.396 6.558 -9.401 1.00 0.00 C ATOM 87 OG1 THR A 7 -12.029 7.847 -9.859 1.00 0.00 O ATOM 88 CG2 THR A 7 -13.773 6.663 -8.786 1.00 0.00 C ATOM 0 H THR A 7 -10.224 7.773 -8.304 1.00 0.00 H new ATOM 0 HA THR A 7 -11.827 5.352 -7.714 1.00 0.00 H new ATOM 0 HB THR A 7 -12.439 5.844 -10.224 1.00 0.00 H new ATOM 0 HG1 THR A 7 -12.714 8.183 -10.474 1.00 0.00 H new ATOM 0 HG21 THR A 7 -14.471 7.062 -9.522 1.00 0.00 H new ATOM 0 HG22 THR A 7 -14.106 5.675 -8.469 1.00 0.00 H new ATOM 0 HG23 THR A 7 -13.736 7.328 -7.923 1.00 0.00 H new ATOM 96 N TRP A 8 -10.685 3.959 -9.559 1.00 0.00 N ATOM 97 CA TRP A 8 -9.803 3.074 -10.311 1.00 0.00 C ATOM 98 C TRP A 8 -10.593 2.314 -11.376 1.00 0.00 C ATOM 99 O TRP A 8 -11.800 2.509 -11.526 1.00 0.00 O ATOM 100 CB TRP A 8 -9.113 2.080 -9.375 1.00 0.00 C ATOM 101 CG TRP A 8 -8.143 2.715 -8.424 1.00 0.00 C ATOM 102 CD1 TRP A 8 -8.426 3.632 -7.453 1.00 0.00 C ATOM 103 CD2 TRP A 8 -6.733 2.471 -8.349 1.00 0.00 C ATOM 104 NE1 TRP A 8 -7.280 3.972 -6.779 1.00 0.00 N ATOM 105 CE2 TRP A 8 -6.228 3.272 -7.309 1.00 0.00 C ATOM 106 CE3 TRP A 8 -5.850 1.651 -9.057 1.00 0.00 C ATOM 107 CZ2 TRP A 8 -4.876 3.276 -6.962 1.00 0.00 C ATOM 108 CZ3 TRP A 8 -4.514 1.656 -8.712 1.00 0.00 C ATOM 109 CH2 TRP A 8 -4.038 2.462 -7.672 1.00 0.00 C ATOM 0 H TRP A 8 -11.592 3.553 -9.329 1.00 0.00 H new ATOM 0 HA TRP A 8 -9.044 3.685 -10.799 1.00 0.00 H new ATOM 0 HB2 TRP A 8 -9.872 1.548 -8.803 1.00 0.00 H new ATOM 0 HB3 TRP A 8 -8.586 1.337 -9.974 1.00 0.00 H new ATOM 0 HD1 TRP A 8 -9.408 4.031 -7.246 1.00 0.00 H new ATOM 0 HE1 TRP A 8 -7.221 4.638 -6.009 1.00 0.00 H new ATOM 0 HE3 TRP A 8 -6.207 1.024 -9.861 1.00 0.00 H new ATOM 0 HZ2 TRP A 8 -4.505 3.899 -6.162 1.00 0.00 H new ATOM 0 HZ3 TRP A 8 -3.824 1.027 -9.254 1.00 0.00 H new ATOM 0 HH2 TRP A 8 -2.987 2.441 -7.425 1.00 0.00 H new ATOM 120 N LYS A 9 -9.905 1.441 -12.104 1.00 0.00 N ATOM 121 CA LYS A 9 -10.537 0.638 -13.149 1.00 0.00 C ATOM 122 C LYS A 9 -9.876 -0.736 -13.243 1.00 0.00 C ATOM 123 O LYS A 9 -9.951 -1.404 -14.275 1.00 0.00 O ATOM 124 CB LYS A 9 -10.442 1.353 -14.499 1.00 0.00 C ATOM 125 CG LYS A 9 -9.044 1.864 -14.816 1.00 0.00 C ATOM 126 CD LYS A 9 -8.961 3.377 -14.690 1.00 0.00 C ATOM 127 CE LYS A 9 -9.763 4.070 -15.779 1.00 0.00 C ATOM 128 NZ LYS A 9 -9.390 3.585 -17.136 1.00 0.00 N ATOM 0 H LYS A 9 -8.906 1.270 -11.990 1.00 0.00 H new ATOM 0 HA LYS A 9 -11.587 0.505 -12.890 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -10.758 0.669 -15.287 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -11.138 2.192 -14.507 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.325 1.402 -14.140 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -8.768 1.567 -15.828 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -9.333 3.683 -13.712 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -7.919 3.692 -14.748 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -10.826 3.899 -15.612 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -9.600 5.146 -15.721 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -9.654 4.299 -17.845 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -8.364 3.421 -17.176 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -9.891 2.696 -17.337 1.00 0.00 H new ATOM 142 N GLU A 10 -9.207 -1.134 -12.167 1.00 0.00 N ATOM 143 CA GLU A 10 -8.501 -2.410 -12.130 1.00 0.00 C ATOM 144 C GLU A 10 -9.451 -3.601 -12.200 1.00 0.00 C ATOM 145 O GLU A 10 -10.488 -3.627 -11.539 1.00 0.00 O ATOM 146 CB GLU A 10 -7.642 -2.523 -10.869 1.00 0.00 C ATOM 147 CG GLU A 10 -7.144 -1.198 -10.319 1.00 0.00 C ATOM 148 CD GLU A 10 -5.865 -1.351 -9.518 1.00 0.00 C ATOM 149 OE1 GLU A 10 -4.881 -1.886 -10.071 1.00 0.00 O ATOM 150 OE2 GLU A 10 -5.849 -0.940 -8.340 1.00 0.00 O ATOM 0 H GLU A 10 -9.138 -0.590 -11.307 1.00 0.00 H new ATOM 0 HA GLU A 10 -7.862 -2.433 -13.013 1.00 0.00 H new ATOM 0 HB2 GLU A 10 -8.221 -3.027 -10.095 1.00 0.00 H new ATOM 0 HB3 GLU A 10 -6.782 -3.156 -11.087 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -6.973 -0.506 -11.144 1.00 0.00 H new ATOM 0 HG3 GLU A 10 -7.915 -0.757 -9.687 1.00 0.00 H new ATOM 157 N LYS A 11 -9.066 -4.599 -12.995 1.00 0.00 N ATOM 158 CA LYS A 11 -9.857 -5.816 -13.142 1.00 0.00 C ATOM 159 C LYS A 11 -9.815 -6.616 -11.841 1.00 0.00 C ATOM 160 O LYS A 11 -9.547 -6.058 -10.778 1.00 0.00 O ATOM 161 CB LYS A 11 -9.324 -6.654 -14.310 1.00 0.00 C ATOM 162 CG LYS A 11 -7.849 -7.004 -14.188 1.00 0.00 C ATOM 163 CD LYS A 11 -7.512 -8.296 -14.910 1.00 0.00 C ATOM 164 CE LYS A 11 -6.019 -8.589 -14.883 1.00 0.00 C ATOM 165 NZ LYS A 11 -5.627 -9.589 -15.915 1.00 0.00 N ATOM 0 H LYS A 11 -8.209 -4.586 -13.548 1.00 0.00 H new ATOM 0 HA LYS A 11 -10.892 -5.550 -13.357 1.00 0.00 H new ATOM 0 HB2 LYS A 11 -9.903 -7.575 -14.378 1.00 0.00 H new ATOM 0 HB3 LYS A 11 -9.483 -6.108 -15.240 1.00 0.00 H new ATOM 0 HG2 LYS A 11 -7.248 -6.192 -14.598 1.00 0.00 H new ATOM 0 HG3 LYS A 11 -7.584 -7.097 -13.135 1.00 0.00 H new ATOM 0 HD2 LYS A 11 -8.052 -9.122 -14.447 1.00 0.00 H new ATOM 0 HD3 LYS A 11 -7.851 -8.233 -15.944 1.00 0.00 H new ATOM 0 HE2 LYS A 11 -5.465 -7.664 -15.046 1.00 0.00 H new ATOM 0 HE3 LYS A 11 -5.740 -8.958 -13.896 1.00 0.00 H new ATOM 0 HZ1 LYS A 11 -5.068 -10.345 -15.471 1.00 0.00 H new ATOM 0 HZ2 LYS A 11 -6.481 -9.997 -16.345 1.00 0.00 H new ATOM 0 HZ3 LYS A 11 -5.058 -9.124 -16.651 1.00 0.00 H new ATOM 179 N ASP A 12 -10.077 -7.918 -11.918 1.00 0.00 N ATOM 180 CA ASP A 12 -10.059 -8.757 -10.726 1.00 0.00 C ATOM 181 C ASP A 12 -9.125 -9.951 -10.897 1.00 0.00 C ATOM 182 O ASP A 12 -9.254 -10.955 -10.193 1.00 0.00 O ATOM 183 CB ASP A 12 -11.474 -9.236 -10.396 1.00 0.00 C ATOM 184 CG ASP A 12 -12.415 -8.088 -10.089 1.00 0.00 C ATOM 185 OD1 ASP A 12 -12.364 -7.563 -8.957 1.00 0.00 O ATOM 186 OD2 ASP A 12 -13.205 -7.713 -10.983 1.00 0.00 O ATOM 0 H ASP A 12 -10.302 -8.409 -12.783 1.00 0.00 H new ATOM 0 HA ASP A 12 -9.683 -8.155 -9.899 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -11.866 -9.809 -11.236 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -11.436 -9.910 -9.540 1.00 0.00 H new ATOM 191 N GLY A 13 -8.189 -9.846 -11.835 1.00 0.00 N ATOM 192 CA GLY A 13 -7.257 -10.933 -12.078 1.00 0.00 C ATOM 193 C GLY A 13 -5.909 -10.720 -11.412 1.00 0.00 C ATOM 194 O GLY A 13 -5.778 -9.902 -10.501 1.00 0.00 O ATOM 0 H GLY A 13 -8.059 -9.028 -12.431 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -7.692 -11.865 -11.716 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.111 -11.046 -13.152 1.00 0.00 H new ATOM 198 N ALA A 14 -4.907 -11.470 -11.866 1.00 0.00 N ATOM 199 CA ALA A 14 -3.560 -11.381 -11.310 1.00 0.00 C ATOM 200 C ALA A 14 -2.887 -10.054 -11.655 1.00 0.00 C ATOM 201 O ALA A 14 -3.501 -9.167 -12.247 1.00 0.00 O ATOM 202 CB ALA A 14 -2.717 -12.544 -11.805 1.00 0.00 C ATOM 0 H ALA A 14 -5.004 -12.149 -12.621 1.00 0.00 H new ATOM 0 HA ALA A 14 -3.645 -11.430 -10.224 1.00 0.00 H new ATOM 0 HB1 ALA A 14 -1.714 -12.470 -11.386 1.00 0.00 H new ATOM 0 HB2 ALA A 14 -3.173 -13.483 -11.492 1.00 0.00 H new ATOM 0 HB3 ALA A 14 -2.659 -12.514 -12.893 1.00 0.00 H new ATOM 208 N VAL A 15 -1.598 -9.957 -11.331 1.00 0.00 N ATOM 209 CA VAL A 15 -0.807 -8.775 -11.660 1.00 0.00 C ATOM 210 C VAL A 15 -0.617 -8.667 -13.168 1.00 0.00 C ATOM 211 O VAL A 15 -0.525 -9.684 -13.858 1.00 0.00 O ATOM 212 CB VAL A 15 0.569 -8.788 -10.965 1.00 0.00 C ATOM 213 CG1 VAL A 15 1.413 -9.954 -11.456 1.00 0.00 C ATOM 214 CG2 VAL A 15 1.297 -7.464 -11.171 1.00 0.00 C ATOM 0 H VAL A 15 -1.080 -10.685 -10.840 1.00 0.00 H new ATOM 0 HA VAL A 15 -1.359 -7.908 -11.296 1.00 0.00 H new ATOM 0 HB VAL A 15 0.404 -8.917 -9.895 1.00 0.00 H new ATOM 0 HG11 VAL A 15 2.379 -9.942 -10.951 1.00 0.00 H new ATOM 0 HG12 VAL A 15 0.901 -10.891 -11.237 1.00 0.00 H new ATOM 0 HG13 VAL A 15 1.565 -9.866 -12.532 1.00 0.00 H new ATOM 0 HG21 VAL A 15 2.265 -7.499 -10.671 1.00 0.00 H new ATOM 0 HG22 VAL A 15 1.446 -7.292 -12.237 1.00 0.00 H new ATOM 0 HG23 VAL A 15 0.702 -6.652 -10.752 1.00 0.00 H new ATOM 224 N GLU A 16 -0.519 -7.450 -13.682 1.00 0.00 N ATOM 225 CA GLU A 16 -0.295 -7.245 -15.106 1.00 0.00 C ATOM 226 C GLU A 16 0.762 -6.168 -15.325 1.00 0.00 C ATOM 227 O GLU A 16 1.132 -5.451 -14.395 1.00 0.00 O ATOM 228 CB GLU A 16 -1.599 -6.880 -15.824 1.00 0.00 C ATOM 229 CG GLU A 16 -2.298 -8.076 -16.449 1.00 0.00 C ATOM 230 CD GLU A 16 -2.767 -7.808 -17.865 1.00 0.00 C ATOM 231 OE1 GLU A 16 -2.045 -7.106 -18.606 1.00 0.00 O ATOM 232 OE2 GLU A 16 -3.854 -8.298 -18.235 1.00 0.00 O ATOM 0 H GLU A 16 -0.591 -6.591 -13.136 1.00 0.00 H new ATOM 0 HA GLU A 16 0.068 -8.181 -15.532 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -2.275 -6.403 -15.114 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -1.384 -6.147 -16.601 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -1.618 -8.928 -16.451 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -3.154 -8.353 -15.834 1.00 0.00 H new ATOM 239 N ALA A 17 1.273 -6.102 -16.553 1.00 0.00 N ATOM 240 CA ALA A 17 2.338 -5.158 -16.924 1.00 0.00 C ATOM 241 C ALA A 17 2.428 -3.969 -15.958 1.00 0.00 C ATOM 242 O ALA A 17 3.373 -3.881 -15.174 1.00 0.00 O ATOM 243 CB ALA A 17 2.130 -4.667 -18.349 1.00 0.00 C ATOM 0 H ALA A 17 0.965 -6.698 -17.321 1.00 0.00 H new ATOM 0 HA ALA A 17 3.284 -5.695 -16.859 1.00 0.00 H new ATOM 0 HB1 ALA A 17 2.924 -3.969 -18.613 1.00 0.00 H new ATOM 0 HB2 ALA A 17 2.151 -5.516 -19.033 1.00 0.00 H new ATOM 0 HB3 ALA A 17 1.166 -4.165 -18.424 1.00 0.00 H new ATOM 249 N GLU A 18 1.471 -3.047 -16.022 1.00 0.00 N ATOM 250 CA GLU A 18 1.503 -1.871 -15.147 1.00 0.00 C ATOM 251 C GLU A 18 0.286 -1.819 -14.223 1.00 0.00 C ATOM 252 O GLU A 18 -0.608 -0.989 -14.400 1.00 0.00 O ATOM 253 CB GLU A 18 1.569 -0.595 -15.988 1.00 0.00 C ATOM 254 CG GLU A 18 2.928 -0.360 -16.623 1.00 0.00 C ATOM 255 CD GLU A 18 2.825 0.206 -18.026 1.00 0.00 C ATOM 256 OE1 GLU A 18 2.216 1.285 -18.186 1.00 0.00 O ATOM 257 OE2 GLU A 18 3.352 -0.431 -18.962 1.00 0.00 O ATOM 0 H GLU A 18 0.675 -3.086 -16.658 1.00 0.00 H new ATOM 0 HA GLU A 18 2.394 -1.947 -14.523 1.00 0.00 H new ATOM 0 HB2 GLU A 18 0.814 -0.646 -16.772 1.00 0.00 H new ATOM 0 HB3 GLU A 18 1.318 0.259 -15.359 1.00 0.00 H new ATOM 0 HG2 GLU A 18 3.503 0.325 -16.000 1.00 0.00 H new ATOM 0 HG3 GLU A 18 3.478 -1.300 -16.654 1.00 0.00 H new ATOM 264 N ASP A 19 0.248 -2.732 -13.252 1.00 0.00 N ATOM 265 CA ASP A 19 -0.872 -2.816 -12.315 1.00 0.00 C ATOM 266 C ASP A 19 -0.577 -2.157 -10.968 1.00 0.00 C ATOM 267 O ASP A 19 0.444 -1.494 -10.791 1.00 0.00 O ATOM 268 CB ASP A 19 -1.212 -4.281 -12.082 1.00 0.00 C ATOM 269 CG ASP A 19 -1.795 -4.929 -13.313 1.00 0.00 C ATOM 270 OD1 ASP A 19 -1.457 -4.486 -14.430 1.00 0.00 O ATOM 271 OD2 ASP A 19 -2.583 -5.885 -13.160 1.00 0.00 O ATOM 0 H ASP A 19 0.980 -3.424 -13.094 1.00 0.00 H new ATOM 0 HA ASP A 19 -1.707 -2.277 -12.762 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -0.313 -4.818 -11.781 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -1.922 -4.362 -11.259 1.00 0.00 H new ATOM 276 N ARG A 20 -1.498 -2.359 -10.020 1.00 0.00 N ATOM 277 CA ARG A 20 -1.372 -1.815 -8.674 1.00 0.00 C ATOM 278 C ARG A 20 -1.985 -2.782 -7.654 1.00 0.00 C ATOM 279 O ARG A 20 -3.200 -2.978 -7.627 1.00 0.00 O ATOM 280 CB ARG A 20 -2.056 -0.453 -8.591 1.00 0.00 C ATOM 281 CG ARG A 20 -1.259 0.583 -7.817 1.00 0.00 C ATOM 282 CD ARG A 20 -1.087 1.871 -8.607 1.00 0.00 C ATOM 283 NE ARG A 20 -0.723 2.992 -7.743 1.00 0.00 N ATOM 284 CZ ARG A 20 -0.641 4.253 -8.159 1.00 0.00 C ATOM 285 NH1 ARG A 20 -0.889 4.560 -9.426 1.00 0.00 N ATOM 286 NH2 ARG A 20 -0.310 5.212 -7.304 1.00 0.00 N ATOM 0 H ARG A 20 -2.348 -2.903 -10.169 1.00 0.00 H new ATOM 0 HA ARG A 20 -0.314 -1.689 -8.443 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -2.233 -0.083 -9.601 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -3.032 -0.574 -8.120 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -1.763 0.799 -6.875 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -0.279 0.176 -7.568 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -0.317 1.732 -9.366 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -2.014 2.102 -9.132 1.00 0.00 H new ATOM 0 HE ARG A 20 -0.520 2.796 -6.763 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -1.144 3.827 -10.088 1.00 0.00 H new ATOM 0 HH12 ARG A 20 -0.824 5.529 -9.738 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -0.119 4.982 -6.329 1.00 0.00 H new ATOM 0 HH22 ARG A 20 -0.247 6.179 -7.622 1.00 0.00 H new ATOM 300 N VAL A 21 -1.138 -3.381 -6.816 1.00 0.00 N ATOM 301 CA VAL A 21 -1.587 -4.327 -5.791 1.00 0.00 C ATOM 302 C VAL A 21 -1.838 -3.639 -4.446 1.00 0.00 C ATOM 303 O VAL A 21 -1.466 -2.482 -4.249 1.00 0.00 O ATOM 304 CB VAL A 21 -0.541 -5.444 -5.579 1.00 0.00 C ATOM 305 CG1 VAL A 21 -0.356 -6.272 -6.844 1.00 0.00 C ATOM 306 CG2 VAL A 21 0.784 -4.846 -5.130 1.00 0.00 C ATOM 0 H VAL A 21 -0.130 -3.227 -6.827 1.00 0.00 H new ATOM 0 HA VAL A 21 -2.524 -4.752 -6.152 1.00 0.00 H new ATOM 0 HB VAL A 21 -0.907 -6.109 -4.797 1.00 0.00 H new ATOM 0 HG11 VAL A 21 0.386 -7.050 -6.664 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.305 -6.732 -7.120 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -0.016 -5.627 -7.655 1.00 0.00 H new ATOM 0 HG21 VAL A 21 1.512 -5.644 -4.984 1.00 0.00 H new ATOM 0 HG22 VAL A 21 1.149 -4.156 -5.891 1.00 0.00 H new ATOM 0 HG23 VAL A 21 0.642 -4.309 -4.192 1.00 0.00 H new ATOM 316 N THR A 22 -2.434 -4.380 -3.506 1.00 0.00 N ATOM 317 CA THR A 22 -2.690 -3.866 -2.164 1.00 0.00 C ATOM 318 C THR A 22 -2.016 -4.776 -1.146 1.00 0.00 C ATOM 319 O THR A 22 -2.381 -5.943 -1.014 1.00 0.00 O ATOM 320 CB THR A 22 -4.191 -3.788 -1.881 1.00 0.00 C ATOM 321 OG1 THR A 22 -4.829 -2.909 -2.788 1.00 0.00 O ATOM 322 CG2 THR A 22 -4.506 -3.315 -0.478 1.00 0.00 C ATOM 0 H THR A 22 -2.747 -5.339 -3.654 1.00 0.00 H new ATOM 0 HA THR A 22 -2.282 -2.858 -2.090 1.00 0.00 H new ATOM 0 HB THR A 22 -4.563 -4.806 -1.997 1.00 0.00 H new ATOM 0 HG1 THR A 22 -5.788 -2.875 -2.591 1.00 0.00 H new ATOM 0 HG21 THR A 22 -5.587 -3.281 -0.340 1.00 0.00 H new ATOM 0 HG22 THR A 22 -4.069 -4.004 0.245 1.00 0.00 H new ATOM 0 HG23 THR A 22 -4.089 -2.319 -0.328 1.00 0.00 H new ATOM 330 N ILE A 23 -1.008 -4.257 -0.454 1.00 0.00 N ATOM 331 CA ILE A 23 -0.275 -5.065 0.513 1.00 0.00 C ATOM 332 C ILE A 23 -0.236 -4.443 1.909 1.00 0.00 C ATOM 333 O ILE A 23 -0.484 -3.252 2.092 1.00 0.00 O ATOM 334 CB ILE A 23 1.179 -5.281 0.056 1.00 0.00 C ATOM 335 CG1 ILE A 23 1.849 -3.935 -0.218 1.00 0.00 C ATOM 336 CG2 ILE A 23 1.238 -6.176 -1.172 1.00 0.00 C ATOM 337 CD1 ILE A 23 3.192 -4.046 -0.902 1.00 0.00 C ATOM 0 H ILE A 23 -0.683 -3.294 -0.542 1.00 0.00 H new ATOM 0 HA ILE A 23 -0.814 -6.011 0.567 1.00 0.00 H new ATOM 0 HB ILE A 23 1.722 -5.783 0.857 1.00 0.00 H new ATOM 0 HG12 ILE A 23 1.186 -3.330 -0.837 1.00 0.00 H new ATOM 0 HG13 ILE A 23 1.976 -3.405 0.726 1.00 0.00 H new ATOM 0 HG21 ILE A 23 2.277 -6.312 -1.474 1.00 0.00 H new ATOM 0 HG22 ILE A 23 0.798 -7.145 -0.937 1.00 0.00 H new ATOM 0 HG23 ILE A 23 0.681 -5.713 -1.987 1.00 0.00 H new ATOM 0 HD11 ILE A 23 3.603 -3.049 -1.062 1.00 0.00 H new ATOM 0 HD12 ILE A 23 3.873 -4.623 -0.276 1.00 0.00 H new ATOM 0 HD13 ILE A 23 3.071 -4.547 -1.863 1.00 0.00 H new ATOM 349 N ASP A 24 0.122 -5.280 2.876 1.00 0.00 N ATOM 350 CA ASP A 24 0.262 -4.884 4.275 1.00 0.00 C ATOM 351 C ASP A 24 1.624 -5.386 4.758 1.00 0.00 C ATOM 352 O ASP A 24 1.878 -6.590 4.724 1.00 0.00 O ATOM 353 CB ASP A 24 -0.863 -5.507 5.116 1.00 0.00 C ATOM 354 CG ASP A 24 -0.678 -5.307 6.613 1.00 0.00 C ATOM 355 OD1 ASP A 24 0.482 -5.293 7.078 1.00 0.00 O ATOM 356 OD2 ASP A 24 -1.697 -5.169 7.320 1.00 0.00 O ATOM 0 H ASP A 24 0.326 -6.265 2.710 1.00 0.00 H new ATOM 0 HA ASP A 24 0.195 -3.801 4.377 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -1.816 -5.073 4.814 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -0.917 -6.575 4.903 1.00 0.00 H new ATOM 361 N PHE A 25 2.515 -4.488 5.172 1.00 0.00 N ATOM 362 CA PHE A 25 3.843 -4.922 5.603 1.00 0.00 C ATOM 363 C PHE A 25 4.365 -4.152 6.806 1.00 0.00 C ATOM 364 O PHE A 25 3.806 -3.136 7.210 1.00 0.00 O ATOM 365 CB PHE A 25 4.840 -4.789 4.446 1.00 0.00 C ATOM 366 CG PHE A 25 5.215 -3.369 4.106 1.00 0.00 C ATOM 367 CD1 PHE A 25 6.041 -2.634 4.943 1.00 0.00 C ATOM 368 CD2 PHE A 25 4.723 -2.765 2.960 1.00 0.00 C ATOM 369 CE1 PHE A 25 6.368 -1.322 4.642 1.00 0.00 C ATOM 370 CE2 PHE A 25 5.042 -1.456 2.663 1.00 0.00 C ATOM 371 CZ PHE A 25 5.862 -0.736 3.501 1.00 0.00 C ATOM 0 H PHE A 25 2.350 -3.482 5.218 1.00 0.00 H new ATOM 0 HA PHE A 25 3.743 -5.964 5.906 1.00 0.00 H new ATOM 0 HB2 PHE A 25 5.746 -5.341 4.698 1.00 0.00 H new ATOM 0 HB3 PHE A 25 4.415 -5.262 3.560 1.00 0.00 H new ATOM 0 HD1 PHE A 25 6.434 -3.090 5.840 1.00 0.00 H new ATOM 0 HD2 PHE A 25 4.084 -3.324 2.293 1.00 0.00 H new ATOM 0 HE1 PHE A 25 7.016 -0.760 5.298 1.00 0.00 H new ATOM 0 HE2 PHE A 25 4.647 -0.995 1.770 1.00 0.00 H new ATOM 0 HZ PHE A 25 6.109 0.288 3.265 1.00 0.00 H new ATOM 381 N THR A 26 5.451 -4.668 7.372 1.00 0.00 N ATOM 382 CA THR A 26 6.085 -4.058 8.538 1.00 0.00 C ATOM 383 C THR A 26 7.586 -4.353 8.556 1.00 0.00 C ATOM 384 O THR A 26 7.996 -5.510 8.661 1.00 0.00 O ATOM 385 CB THR A 26 5.438 -4.575 9.822 1.00 0.00 C ATOM 386 OG1 THR A 26 4.032 -4.680 9.668 1.00 0.00 O ATOM 387 CG2 THR A 26 5.710 -3.696 11.023 1.00 0.00 C ATOM 0 H THR A 26 5.914 -5.514 7.040 1.00 0.00 H new ATOM 0 HA THR A 26 5.944 -2.979 8.477 1.00 0.00 H new ATOM 0 HB THR A 26 5.887 -5.552 10.001 1.00 0.00 H new ATOM 0 HG1 THR A 26 3.636 -5.014 10.500 1.00 0.00 H new ATOM 0 HG21 THR A 26 5.223 -4.119 11.901 1.00 0.00 H new ATOM 0 HG22 THR A 26 6.785 -3.639 11.196 1.00 0.00 H new ATOM 0 HG23 THR A 26 5.319 -2.696 10.838 1.00 0.00 H new ATOM 395 N GLY A 27 8.400 -3.305 8.448 1.00 0.00 N ATOM 396 CA GLY A 27 9.843 -3.487 8.450 1.00 0.00 C ATOM 397 C GLY A 27 10.605 -2.222 8.795 1.00 0.00 C ATOM 398 O GLY A 27 10.038 -1.135 8.829 1.00 0.00 O ATOM 0 H GLY A 27 8.089 -2.338 8.360 1.00 0.00 H new ATOM 0 HA2 GLY A 27 10.103 -4.267 9.166 1.00 0.00 H new ATOM 0 HA3 GLY A 27 10.160 -3.838 7.468 1.00 0.00 H new ATOM 402 N SER A 28 11.898 -2.375 9.057 1.00 0.00 N ATOM 403 CA SER A 28 12.761 -1.246 9.405 1.00 0.00 C ATOM 404 C SER A 28 13.758 -0.951 8.288 1.00 0.00 C ATOM 405 O SER A 28 13.854 -1.701 7.318 1.00 0.00 O ATOM 406 CB SER A 28 13.516 -1.546 10.703 1.00 0.00 C ATOM 407 OG SER A 28 13.167 -2.819 11.218 1.00 0.00 O ATOM 0 H SER A 28 12.377 -3.275 9.035 1.00 0.00 H new ATOM 0 HA SER A 28 12.130 -0.368 9.544 1.00 0.00 H new ATOM 0 HB2 SER A 28 14.590 -1.507 10.519 1.00 0.00 H new ATOM 0 HB3 SER A 28 13.291 -0.778 11.443 1.00 0.00 H new ATOM 0 HG SER A 28 13.665 -2.985 12.046 1.00 0.00 H new ATOM 413 N VAL A 29 14.509 0.140 8.445 1.00 0.00 N ATOM 414 CA VAL A 29 15.512 0.534 7.462 1.00 0.00 C ATOM 415 C VAL A 29 16.932 0.310 7.997 1.00 0.00 C ATOM 416 O VAL A 29 17.575 -0.680 7.646 1.00 0.00 O ATOM 417 CB VAL A 29 15.315 2.001 6.985 1.00 0.00 C ATOM 418 CG1 VAL A 29 15.033 2.946 8.149 1.00 0.00 C ATOM 419 CG2 VAL A 29 16.508 2.486 6.168 1.00 0.00 C ATOM 0 H VAL A 29 14.439 0.766 9.247 1.00 0.00 H new ATOM 0 HA VAL A 29 15.376 -0.107 6.591 1.00 0.00 H new ATOM 0 HB VAL A 29 14.438 2.008 6.338 1.00 0.00 H new ATOM 0 HG11 VAL A 29 14.902 3.960 7.771 1.00 0.00 H new ATOM 0 HG12 VAL A 29 14.125 2.630 8.662 1.00 0.00 H new ATOM 0 HG13 VAL A 29 15.870 2.924 8.846 1.00 0.00 H new ATOM 0 HG21 VAL A 29 16.337 3.515 5.850 1.00 0.00 H new ATOM 0 HG22 VAL A 29 17.410 2.439 6.778 1.00 0.00 H new ATOM 0 HG23 VAL A 29 16.630 1.851 5.291 1.00 0.00 H new ATOM 429 N ASP A 30 17.419 1.211 8.845 1.00 0.00 N ATOM 430 CA ASP A 30 18.757 1.071 9.410 1.00 0.00 C ATOM 431 C ASP A 30 18.693 0.396 10.774 1.00 0.00 C ATOM 432 O ASP A 30 19.443 0.744 11.687 1.00 0.00 O ATOM 433 CB ASP A 30 19.426 2.440 9.537 1.00 0.00 C ATOM 434 CG ASP A 30 20.936 2.340 9.645 1.00 0.00 C ATOM 435 OD1 ASP A 30 21.529 1.511 8.924 1.00 0.00 O ATOM 436 OD2 ASP A 30 21.525 3.089 10.452 1.00 0.00 O ATOM 0 H ASP A 30 16.912 2.040 9.154 1.00 0.00 H new ATOM 0 HA ASP A 30 19.349 0.449 8.739 1.00 0.00 H new ATOM 0 HB2 ASP A 30 19.166 3.050 8.672 1.00 0.00 H new ATOM 0 HB3 ASP A 30 19.035 2.952 10.416 1.00 0.00 H new ATOM 441 N GLY A 31 17.784 -0.563 10.912 1.00 0.00 N ATOM 442 CA GLY A 31 17.629 -1.260 12.173 1.00 0.00 C ATOM 443 C GLY A 31 16.514 -0.676 13.019 1.00 0.00 C ATOM 444 O GLY A 31 16.158 -1.231 14.059 1.00 0.00 O ATOM 0 H GLY A 31 17.152 -0.869 10.172 1.00 0.00 H new ATOM 0 HA2 GLY A 31 17.423 -2.313 11.981 1.00 0.00 H new ATOM 0 HA3 GLY A 31 18.566 -1.215 12.728 1.00 0.00 H new ATOM 448 N GLU A 32 15.955 0.447 12.568 1.00 0.00 N ATOM 449 CA GLU A 32 14.873 1.105 13.285 1.00 0.00 C ATOM 450 C GLU A 32 13.742 1.465 12.328 1.00 0.00 C ATOM 451 O GLU A 32 13.923 2.261 11.407 1.00 0.00 O ATOM 452 CB GLU A 32 15.389 2.360 13.987 1.00 0.00 C ATOM 453 CG GLU A 32 16.447 2.072 15.040 1.00 0.00 C ATOM 454 CD GLU A 32 15.846 1.713 16.386 1.00 0.00 C ATOM 455 OE1 GLU A 32 15.360 2.627 17.082 1.00 0.00 O ATOM 456 OE2 GLU A 32 15.863 0.515 16.741 1.00 0.00 O ATOM 0 H GLU A 32 16.237 0.917 11.708 1.00 0.00 H new ATOM 0 HA GLU A 32 14.487 0.416 14.037 1.00 0.00 H new ATOM 0 HB2 GLU A 32 15.804 3.039 13.242 1.00 0.00 H new ATOM 0 HB3 GLU A 32 14.551 2.875 14.456 1.00 0.00 H new ATOM 0 HG2 GLU A 32 17.081 1.253 14.699 1.00 0.00 H new ATOM 0 HG3 GLU A 32 17.089 2.946 15.154 1.00 0.00 H new ATOM 463 N GLU A 33 12.582 0.861 12.546 1.00 0.00 N ATOM 464 CA GLU A 33 11.424 1.098 11.709 1.00 0.00 C ATOM 465 C GLU A 33 11.019 2.556 11.758 1.00 0.00 C ATOM 466 O GLU A 33 10.701 3.094 12.817 1.00 0.00 O ATOM 467 CB GLU A 33 10.263 0.198 12.143 1.00 0.00 C ATOM 468 CG GLU A 33 9.892 0.335 13.610 1.00 0.00 C ATOM 469 CD GLU A 33 8.475 -0.123 13.896 1.00 0.00 C ATOM 470 OE1 GLU A 33 8.062 -1.159 13.334 1.00 0.00 O ATOM 471 OE2 GLU A 33 7.779 0.554 14.681 1.00 0.00 O ATOM 0 H GLU A 33 12.422 0.198 13.304 1.00 0.00 H new ATOM 0 HA GLU A 33 11.684 0.854 10.679 1.00 0.00 H new ATOM 0 HB2 GLU A 33 9.389 0.430 11.534 1.00 0.00 H new ATOM 0 HB3 GLU A 33 10.526 -0.840 11.940 1.00 0.00 H new ATOM 0 HG2 GLU A 33 10.588 -0.248 14.213 1.00 0.00 H new ATOM 0 HG3 GLU A 33 10.002 1.376 13.914 1.00 0.00 H new ATOM 478 N PHE A 34 11.075 3.204 10.607 1.00 0.00 N ATOM 479 CA PHE A 34 10.758 4.628 10.488 1.00 0.00 C ATOM 480 C PHE A 34 9.254 4.889 10.374 1.00 0.00 C ATOM 481 O PHE A 34 8.452 4.263 11.066 1.00 0.00 O ATOM 482 CB PHE A 34 11.521 5.204 9.276 1.00 0.00 C ATOM 483 CG PHE A 34 10.976 4.803 7.921 1.00 0.00 C ATOM 484 CD1 PHE A 34 10.649 3.485 7.631 1.00 0.00 C ATOM 485 CD2 PHE A 34 10.797 5.761 6.933 1.00 0.00 C ATOM 486 CE1 PHE A 34 10.153 3.137 6.389 1.00 0.00 C ATOM 487 CE2 PHE A 34 10.302 5.415 5.691 1.00 0.00 C ATOM 488 CZ PHE A 34 9.979 4.103 5.419 1.00 0.00 C ATOM 0 H PHE A 34 11.341 2.764 9.726 1.00 0.00 H new ATOM 0 HA PHE A 34 11.077 5.131 11.401 1.00 0.00 H new ATOM 0 HB2 PHE A 34 11.513 6.292 9.346 1.00 0.00 H new ATOM 0 HB3 PHE A 34 12.562 4.888 9.339 1.00 0.00 H new ATOM 0 HD1 PHE A 34 10.784 2.723 8.385 1.00 0.00 H new ATOM 0 HD2 PHE A 34 11.048 6.791 7.138 1.00 0.00 H new ATOM 0 HE1 PHE A 34 9.901 2.108 6.177 1.00 0.00 H new ATOM 0 HE2 PHE A 34 10.168 6.172 4.933 1.00 0.00 H new ATOM 0 HZ PHE A 34 9.590 3.831 4.449 1.00 0.00 H new ATOM 498 N GLU A 35 8.883 5.793 9.481 1.00 0.00 N ATOM 499 CA GLU A 35 7.480 6.127 9.240 1.00 0.00 C ATOM 500 C GLU A 35 6.776 4.967 8.546 1.00 0.00 C ATOM 501 O GLU A 35 5.739 4.486 9.003 1.00 0.00 O ATOM 502 CB GLU A 35 7.372 7.387 8.377 1.00 0.00 C ATOM 503 CG GLU A 35 7.627 8.677 9.141 1.00 0.00 C ATOM 504 CD GLU A 35 7.686 9.890 8.232 1.00 0.00 C ATOM 505 OE1 GLU A 35 6.948 9.914 7.224 1.00 0.00 O ATOM 506 OE2 GLU A 35 8.470 10.817 8.528 1.00 0.00 O ATOM 0 H GLU A 35 9.540 6.317 8.903 1.00 0.00 H new ATOM 0 HA GLU A 35 7.000 6.314 10.200 1.00 0.00 H new ATOM 0 HB2 GLU A 35 8.084 7.315 7.555 1.00 0.00 H new ATOM 0 HB3 GLU A 35 6.377 7.429 7.934 1.00 0.00 H new ATOM 0 HG2 GLU A 35 6.839 8.819 9.880 1.00 0.00 H new ATOM 0 HG3 GLU A 35 8.566 8.592 9.688 1.00 0.00 H new ATOM 513 N GLY A 36 7.362 4.517 7.435 1.00 0.00 N ATOM 514 CA GLY A 36 6.797 3.407 6.688 1.00 0.00 C ATOM 515 C GLY A 36 7.132 2.066 7.304 1.00 0.00 C ATOM 516 O GLY A 36 6.941 1.022 6.677 1.00 0.00 O ATOM 0 H GLY A 36 8.219 4.904 7.041 1.00 0.00 H new ATOM 0 HA2 GLY A 36 5.714 3.520 6.638 1.00 0.00 H new ATOM 0 HA3 GLY A 36 7.168 3.436 5.664 1.00 0.00 H new ATOM 520 N GLY A 37 7.628 2.086 8.539 1.00 0.00 N ATOM 521 CA GLY A 37 7.976 0.858 9.220 1.00 0.00 C ATOM 522 C GLY A 37 6.806 -0.101 9.333 1.00 0.00 C ATOM 523 O GLY A 37 6.989 -1.274 9.659 1.00 0.00 O ATOM 0 H GLY A 37 7.794 2.936 9.078 1.00 0.00 H new ATOM 0 HA2 GLY A 37 8.791 0.369 8.686 1.00 0.00 H new ATOM 0 HA3 GLY A 37 8.345 1.093 10.218 1.00 0.00 H new ATOM 527 N LYS A 38 5.604 0.391 9.054 1.00 0.00 N ATOM 528 CA LYS A 38 4.409 -0.434 9.115 1.00 0.00 C ATOM 529 C LYS A 38 3.351 0.088 8.153 1.00 0.00 C ATOM 530 O LYS A 38 2.953 1.251 8.215 1.00 0.00 O ATOM 531 CB LYS A 38 3.855 -0.476 10.542 1.00 0.00 C ATOM 532 CG LYS A 38 3.504 0.892 11.104 1.00 0.00 C ATOM 533 CD LYS A 38 2.122 0.899 11.738 1.00 0.00 C ATOM 534 CE LYS A 38 1.059 1.353 10.751 1.00 0.00 C ATOM 535 NZ LYS A 38 1.068 2.830 10.566 1.00 0.00 N ATOM 0 H LYS A 38 5.434 1.360 8.783 1.00 0.00 H new ATOM 0 HA LYS A 38 4.678 -1.448 8.819 1.00 0.00 H new ATOM 0 HB2 LYS A 38 2.965 -1.104 10.558 1.00 0.00 H new ATOM 0 HB3 LYS A 38 4.590 -0.948 11.193 1.00 0.00 H new ATOM 0 HG2 LYS A 38 4.247 1.182 11.847 1.00 0.00 H new ATOM 0 HG3 LYS A 38 3.543 1.634 10.307 1.00 0.00 H new ATOM 0 HD2 LYS A 38 1.881 -0.101 12.099 1.00 0.00 H new ATOM 0 HD3 LYS A 38 2.121 1.560 12.605 1.00 0.00 H new ATOM 0 HE2 LYS A 38 1.224 0.866 9.790 1.00 0.00 H new ATOM 0 HE3 LYS A 38 0.077 1.037 11.104 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 0.296 3.104 9.925 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 0.936 3.296 11.486 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 1.978 3.123 10.157 1.00 0.00 H new ATOM 549 N ALA A 39 2.897 -0.784 7.264 1.00 0.00 N ATOM 550 CA ALA A 39 1.886 -0.425 6.285 1.00 0.00 C ATOM 551 C ALA A 39 0.807 -1.496 6.235 1.00 0.00 C ATOM 552 O ALA A 39 1.090 -2.686 6.382 1.00 0.00 O ATOM 553 CB ALA A 39 2.511 -0.231 4.909 1.00 0.00 C ATOM 0 H ALA A 39 3.217 -1.751 7.202 1.00 0.00 H new ATOM 0 HA ALA A 39 1.431 0.519 6.585 1.00 0.00 H new ATOM 0 HB1 ALA A 39 1.735 0.037 4.192 1.00 0.00 H new ATOM 0 HB2 ALA A 39 3.253 0.566 4.956 1.00 0.00 H new ATOM 0 HB3 ALA A 39 2.992 -1.157 4.594 1.00 0.00 H new ATOM 559 N SER A 40 -0.431 -1.071 6.038 1.00 0.00 N ATOM 560 CA SER A 40 -1.550 -1.999 5.982 1.00 0.00 C ATOM 561 C SER A 40 -2.138 -2.063 4.585 1.00 0.00 C ATOM 562 O SER A 40 -2.112 -3.106 3.933 1.00 0.00 O ATOM 563 CB SER A 40 -2.632 -1.593 6.984 1.00 0.00 C ATOM 564 OG SER A 40 -2.087 -1.417 8.280 1.00 0.00 O ATOM 0 H SER A 40 -0.686 -0.091 5.914 1.00 0.00 H new ATOM 0 HA SER A 40 -1.176 -2.989 6.243 1.00 0.00 H new ATOM 0 HB2 SER A 40 -3.106 -0.668 6.657 1.00 0.00 H new ATOM 0 HB3 SER A 40 -3.409 -2.356 7.014 1.00 0.00 H new ATOM 0 HG SER A 40 -2.798 -1.156 8.901 1.00 0.00 H new ATOM 570 N ASP A 41 -2.618 -0.930 4.105 1.00 0.00 N ATOM 571 CA ASP A 41 -3.155 -0.814 2.767 1.00 0.00 C ATOM 572 C ASP A 41 -2.129 -0.120 1.890 1.00 0.00 C ATOM 573 O ASP A 41 -2.324 1.029 1.491 1.00 0.00 O ATOM 574 CB ASP A 41 -4.470 -0.032 2.778 1.00 0.00 C ATOM 575 CG ASP A 41 -4.309 1.358 3.362 1.00 0.00 C ATOM 576 OD1 ASP A 41 -3.554 1.505 4.344 1.00 0.00 O ATOM 577 OD2 ASP A 41 -4.938 2.299 2.834 1.00 0.00 O ATOM 0 H ASP A 41 -2.645 -0.061 4.638 1.00 0.00 H new ATOM 0 HA ASP A 41 -3.365 -1.807 2.371 1.00 0.00 H new ATOM 0 HB2 ASP A 41 -4.852 0.046 1.760 1.00 0.00 H new ATOM 0 HB3 ASP A 41 -5.213 -0.582 3.356 1.00 0.00 H new ATOM 582 N PHE A 42 -1.045 -0.802 1.581 1.00 0.00 N ATOM 583 CA PHE A 42 -0.011 -0.216 0.739 1.00 0.00 C ATOM 584 C PHE A 42 -0.309 -0.516 -0.720 1.00 0.00 C ATOM 585 O PHE A 42 -0.195 -1.656 -1.167 1.00 0.00 O ATOM 586 CB PHE A 42 1.380 -0.742 1.117 1.00 0.00 C ATOM 587 CG PHE A 42 2.507 -0.030 0.412 1.00 0.00 C ATOM 588 CD1 PHE A 42 2.475 1.345 0.246 1.00 0.00 C ATOM 589 CD2 PHE A 42 3.595 -0.734 -0.090 1.00 0.00 C ATOM 590 CE1 PHE A 42 3.505 2.005 -0.402 1.00 0.00 C ATOM 591 CE2 PHE A 42 4.623 -0.078 -0.738 1.00 0.00 C ATOM 592 CZ PHE A 42 4.579 1.291 -0.895 1.00 0.00 C ATOM 0 H PHE A 42 -0.854 -1.754 1.894 1.00 0.00 H new ATOM 0 HA PHE A 42 -0.012 0.863 0.895 1.00 0.00 H new ATOM 0 HB2 PHE A 42 1.516 -0.643 2.194 1.00 0.00 H new ATOM 0 HB3 PHE A 42 1.432 -1.806 0.885 1.00 0.00 H new ATOM 0 HD1 PHE A 42 1.636 1.909 0.627 1.00 0.00 H new ATOM 0 HD2 PHE A 42 3.637 -1.807 0.028 1.00 0.00 H new ATOM 0 HE1 PHE A 42 3.468 3.078 -0.522 1.00 0.00 H new ATOM 0 HE2 PHE A 42 5.463 -0.638 -1.122 1.00 0.00 H new ATOM 0 HZ PHE A 42 5.383 1.804 -1.402 1.00 0.00 H new ATOM 602 N VAL A 43 -0.703 0.513 -1.458 1.00 0.00 N ATOM 603 CA VAL A 43 -1.029 0.360 -2.860 1.00 0.00 C ATOM 604 C VAL A 43 0.225 0.425 -3.720 1.00 0.00 C ATOM 605 O VAL A 43 0.709 1.507 -4.052 1.00 0.00 O ATOM 606 CB VAL A 43 -2.012 1.452 -3.310 1.00 0.00 C ATOM 607 CG1 VAL A 43 -2.485 1.197 -4.730 1.00 0.00 C ATOM 608 CG2 VAL A 43 -3.190 1.533 -2.350 1.00 0.00 C ATOM 0 H VAL A 43 -0.803 1.464 -1.103 1.00 0.00 H new ATOM 0 HA VAL A 43 -1.495 -0.617 -2.986 1.00 0.00 H new ATOM 0 HB VAL A 43 -1.494 2.411 -3.297 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -3.180 1.982 -5.028 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -1.628 1.195 -5.404 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -2.987 0.231 -4.778 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -3.877 2.311 -2.682 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -3.709 0.575 -2.329 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -2.828 1.771 -1.350 1.00 0.00 H new ATOM 618 N LEU A 44 0.751 -0.741 -4.070 1.00 0.00 N ATOM 619 CA LEU A 44 1.955 -0.820 -4.883 1.00 0.00 C ATOM 620 C LEU A 44 1.608 -0.844 -6.364 1.00 0.00 C ATOM 621 O LEU A 44 0.740 -1.598 -6.793 1.00 0.00 O ATOM 622 CB LEU A 44 2.764 -2.063 -4.513 1.00 0.00 C ATOM 623 CG LEU A 44 4.240 -1.806 -4.215 1.00 0.00 C ATOM 624 CD1 LEU A 44 4.973 -3.119 -4.026 1.00 0.00 C ATOM 625 CD2 LEU A 44 4.886 -0.993 -5.330 1.00 0.00 C ATOM 0 H LEU A 44 0.362 -1.645 -3.803 1.00 0.00 H new ATOM 0 HA LEU A 44 2.557 0.067 -4.685 1.00 0.00 H new ATOM 0 HB2 LEU A 44 2.308 -2.528 -3.639 1.00 0.00 H new ATOM 0 HB3 LEU A 44 2.693 -2.781 -5.330 1.00 0.00 H new ATOM 0 HG LEU A 44 4.307 -1.230 -3.292 1.00 0.00 H new ATOM 0 HD11 LEU A 44 6.024 -2.922 -3.814 1.00 0.00 H new ATOM 0 HD12 LEU A 44 4.531 -3.666 -3.193 1.00 0.00 H new ATOM 0 HD13 LEU A 44 4.892 -3.715 -4.935 1.00 0.00 H new ATOM 0 HD21 LEU A 44 5.937 -0.823 -5.095 1.00 0.00 H new ATOM 0 HD22 LEU A 44 4.808 -1.539 -6.270 1.00 0.00 H new ATOM 0 HD23 LEU A 44 4.376 -0.034 -5.424 1.00 0.00 H new ATOM 637 N ALA A 45 2.299 -0.011 -7.133 1.00 0.00 N ATOM 638 CA ALA A 45 2.078 0.079 -8.571 1.00 0.00 C ATOM 639 C ALA A 45 3.105 -0.751 -9.343 1.00 0.00 C ATOM 640 O ALA A 45 4.260 -0.349 -9.479 1.00 0.00 O ATOM 641 CB ALA A 45 2.145 1.532 -9.010 1.00 0.00 C ATOM 0 H ALA A 45 3.022 0.616 -6.781 1.00 0.00 H new ATOM 0 HA ALA A 45 1.089 -0.322 -8.791 1.00 0.00 H new ATOM 0 HB1 ALA A 45 1.979 1.595 -10.085 1.00 0.00 H new ATOM 0 HB2 ALA A 45 1.377 2.105 -8.490 1.00 0.00 H new ATOM 0 HB3 ALA A 45 3.127 1.940 -8.770 1.00 0.00 H new ATOM 647 N MET A 46 2.679 -1.903 -9.853 1.00 0.00 N ATOM 648 CA MET A 46 3.567 -2.776 -10.616 1.00 0.00 C ATOM 649 C MET A 46 3.965 -2.130 -11.936 1.00 0.00 C ATOM 650 O MET A 46 3.426 -2.466 -12.988 1.00 0.00 O ATOM 651 CB MET A 46 2.907 -4.133 -10.869 1.00 0.00 C ATOM 652 CG MET A 46 3.537 -5.263 -10.069 1.00 0.00 C ATOM 653 SD MET A 46 4.610 -6.319 -11.065 1.00 0.00 S ATOM 654 CE MET A 46 5.437 -5.110 -12.097 1.00 0.00 C ATOM 0 H MET A 46 1.726 -2.254 -9.752 1.00 0.00 H new ATOM 0 HA MET A 46 4.469 -2.933 -10.025 1.00 0.00 H new ATOM 0 HB2 MET A 46 1.848 -4.067 -10.620 1.00 0.00 H new ATOM 0 HB3 MET A 46 2.971 -4.369 -11.931 1.00 0.00 H new ATOM 0 HG2 MET A 46 4.114 -4.841 -9.246 1.00 0.00 H new ATOM 0 HG3 MET A 46 2.748 -5.871 -9.626 1.00 0.00 H new ATOM 0 HE1 MET A 46 6.307 -5.568 -12.568 1.00 0.00 H new ATOM 0 HE2 MET A 46 4.750 -4.758 -12.867 1.00 0.00 H new ATOM 0 HE3 MET A 46 5.758 -4.267 -11.485 1.00 0.00 H new ATOM 664 N GLY A 47 4.916 -1.206 -11.866 1.00 0.00 N ATOM 665 CA GLY A 47 5.382 -0.523 -13.057 1.00 0.00 C ATOM 666 C GLY A 47 4.862 0.898 -13.156 1.00 0.00 C ATOM 667 O GLY A 47 4.080 1.222 -14.050 1.00 0.00 O ATOM 0 H GLY A 47 5.374 -0.917 -11.002 1.00 0.00 H new ATOM 0 HA2 GLY A 47 6.472 -0.508 -13.060 1.00 0.00 H new ATOM 0 HA3 GLY A 47 5.069 -1.083 -13.938 1.00 0.00 H new ATOM 671 N GLN A 48 5.304 1.746 -12.234 1.00 0.00 N ATOM 672 CA GLN A 48 4.891 3.144 -12.212 1.00 0.00 C ATOM 673 C GLN A 48 6.106 4.056 -12.344 1.00 0.00 C ATOM 674 O GLN A 48 6.318 4.681 -13.383 1.00 0.00 O ATOM 675 CB GLN A 48 4.141 3.452 -10.917 1.00 0.00 C ATOM 676 CG GLN A 48 2.791 4.113 -11.137 1.00 0.00 C ATOM 677 CD GLN A 48 2.498 5.188 -10.112 1.00 0.00 C ATOM 678 OE1 GLN A 48 2.654 4.975 -8.909 1.00 0.00 O ATOM 679 NE2 GLN A 48 2.074 6.354 -10.584 1.00 0.00 N ATOM 0 H GLN A 48 5.951 1.488 -11.489 1.00 0.00 H new ATOM 0 HA GLN A 48 4.225 3.324 -13.056 1.00 0.00 H new ATOM 0 HB2 GLN A 48 3.996 2.525 -10.362 1.00 0.00 H new ATOM 0 HB3 GLN A 48 4.757 4.102 -10.296 1.00 0.00 H new ATOM 0 HG2 GLN A 48 2.762 4.550 -12.135 1.00 0.00 H new ATOM 0 HG3 GLN A 48 2.008 3.355 -11.098 1.00 0.00 H new ATOM 0 HE21 GLN A 48 1.959 6.486 -11.589 1.00 0.00 H new ATOM 0 HE22 GLN A 48 1.863 7.118 -9.942 1.00 0.00 H new ATOM 688 N GLY A 49 6.908 4.111 -11.286 1.00 0.00 N ATOM 689 CA GLY A 49 8.104 4.930 -11.302 1.00 0.00 C ATOM 690 C GLY A 49 9.337 4.102 -11.590 1.00 0.00 C ATOM 691 O GLY A 49 10.100 4.404 -12.505 1.00 0.00 O ATOM 0 H GLY A 49 6.750 3.602 -10.417 1.00 0.00 H new ATOM 0 HA2 GLY A 49 8.003 5.709 -12.057 1.00 0.00 H new ATOM 0 HA3 GLY A 49 8.217 5.431 -10.340 1.00 0.00 H new ATOM 695 N ARG A 50 9.518 3.048 -10.801 1.00 0.00 N ATOM 696 CA ARG A 50 10.652 2.144 -10.954 1.00 0.00 C ATOM 697 C ARG A 50 10.647 1.103 -9.839 1.00 0.00 C ATOM 698 O ARG A 50 11.518 1.098 -8.969 1.00 0.00 O ATOM 699 CB ARG A 50 11.971 2.919 -10.949 1.00 0.00 C ATOM 700 CG ARG A 50 12.304 3.561 -9.612 1.00 0.00 C ATOM 701 CD ARG A 50 13.685 3.148 -9.131 1.00 0.00 C ATOM 702 NE ARG A 50 14.697 3.374 -10.157 1.00 0.00 N ATOM 703 CZ ARG A 50 15.257 2.409 -10.888 1.00 0.00 C ATOM 704 NH1 ARG A 50 14.905 1.141 -10.721 1.00 0.00 N ATOM 705 NH2 ARG A 50 16.172 2.720 -11.795 1.00 0.00 N ATOM 0 H ARG A 50 8.886 2.797 -10.041 1.00 0.00 H new ATOM 0 HA ARG A 50 10.559 1.636 -11.914 1.00 0.00 H new ATOM 0 HB2 ARG A 50 12.779 2.243 -11.227 1.00 0.00 H new ATOM 0 HB3 ARG A 50 11.928 3.695 -11.713 1.00 0.00 H new ATOM 0 HG2 ARG A 50 12.258 4.646 -9.706 1.00 0.00 H new ATOM 0 HG3 ARG A 50 11.557 3.273 -8.872 1.00 0.00 H new ATOM 0 HD2 ARG A 50 13.943 3.711 -8.234 1.00 0.00 H new ATOM 0 HD3 ARG A 50 13.675 2.094 -8.854 1.00 0.00 H new ATOM 0 HE ARG A 50 14.996 4.334 -10.327 1.00 0.00 H new ATOM 0 HH11 ARG A 50 14.199 0.895 -10.027 1.00 0.00 H new ATOM 0 HH12 ARG A 50 15.341 0.412 -11.286 1.00 0.00 H new ATOM 0 HH21 ARG A 50 16.445 3.693 -11.931 1.00 0.00 H new ATOM 0 HH22 ARG A 50 16.603 1.986 -12.357 1.00 0.00 H new ATOM 719 N MET A 51 9.658 0.218 -9.870 1.00 0.00 N ATOM 720 CA MET A 51 9.545 -0.821 -8.857 1.00 0.00 C ATOM 721 C MET A 51 10.836 -1.617 -8.747 1.00 0.00 C ATOM 722 O MET A 51 11.246 -2.302 -9.684 1.00 0.00 O ATOM 723 CB MET A 51 8.369 -1.744 -9.161 1.00 0.00 C ATOM 724 CG MET A 51 7.086 -1.304 -8.478 1.00 0.00 C ATOM 725 SD MET A 51 5.958 -2.668 -8.160 1.00 0.00 S ATOM 726 CE MET A 51 7.018 -3.755 -7.220 1.00 0.00 C ATOM 0 H MET A 51 8.927 0.199 -10.581 1.00 0.00 H new ATOM 0 HA MET A 51 9.363 -0.337 -7.897 1.00 0.00 H new ATOM 0 HB2 MET A 51 8.209 -1.778 -10.239 1.00 0.00 H new ATOM 0 HB3 MET A 51 8.616 -2.757 -8.843 1.00 0.00 H new ATOM 0 HG2 MET A 51 7.332 -0.815 -7.535 1.00 0.00 H new ATOM 0 HG3 MET A 51 6.585 -0.563 -9.100 1.00 0.00 H new ATOM 0 HE1 MET A 51 6.411 -4.373 -6.559 1.00 0.00 H new ATOM 0 HE2 MET A 51 7.579 -4.395 -7.901 1.00 0.00 H new ATOM 0 HE3 MET A 51 7.713 -3.161 -6.626 1.00 0.00 H new ATOM 736 N ILE A 52 11.473 -1.511 -7.588 1.00 0.00 N ATOM 737 CA ILE A 52 12.727 -2.210 -7.326 1.00 0.00 C ATOM 738 C ILE A 52 12.512 -3.718 -7.271 1.00 0.00 C ATOM 739 O ILE A 52 11.385 -4.184 -7.102 1.00 0.00 O ATOM 740 CB ILE A 52 13.374 -1.750 -5.999 1.00 0.00 C ATOM 741 CG1 ILE A 52 12.307 -1.353 -4.972 1.00 0.00 C ATOM 742 CG2 ILE A 52 14.327 -0.590 -6.251 1.00 0.00 C ATOM 743 CD1 ILE A 52 12.847 -1.181 -3.571 1.00 0.00 C ATOM 0 H ILE A 52 11.140 -0.944 -6.809 1.00 0.00 H new ATOM 0 HA ILE A 52 13.398 -1.965 -8.150 1.00 0.00 H new ATOM 0 HB ILE A 52 13.939 -2.587 -5.589 1.00 0.00 H new ATOM 0 HG12 ILE A 52 11.840 -0.421 -5.289 1.00 0.00 H new ATOM 0 HG13 ILE A 52 11.526 -2.113 -4.960 1.00 0.00 H new ATOM 0 HG21 ILE A 52 14.775 -0.276 -5.308 1.00 0.00 H new ATOM 0 HG22 ILE A 52 15.111 -0.906 -6.938 1.00 0.00 H new ATOM 0 HG23 ILE A 52 13.777 0.244 -6.687 1.00 0.00 H new ATOM 0 HD11 ILE A 52 12.035 -0.900 -2.900 1.00 0.00 H new ATOM 0 HD12 ILE A 52 13.289 -2.119 -3.234 1.00 0.00 H new ATOM 0 HD13 ILE A 52 13.607 -0.400 -3.567 1.00 0.00 H new ATOM 755 N PRO A 53 13.592 -4.507 -7.400 1.00 0.00 N ATOM 756 CA PRO A 53 13.505 -5.967 -7.348 1.00 0.00 C ATOM 757 C PRO A 53 12.882 -6.436 -6.042 1.00 0.00 C ATOM 758 O PRO A 53 12.271 -7.501 -5.978 1.00 0.00 O ATOM 759 CB PRO A 53 14.965 -6.432 -7.449 1.00 0.00 C ATOM 760 CG PRO A 53 15.783 -5.227 -7.127 1.00 0.00 C ATOM 761 CD PRO A 53 14.978 -4.047 -7.587 1.00 0.00 C ATOM 0 HA PRO A 53 12.876 -6.372 -8.141 1.00 0.00 H new ATOM 0 HB2 PRO A 53 15.169 -7.244 -6.751 1.00 0.00 H new ATOM 0 HB3 PRO A 53 15.191 -6.806 -8.448 1.00 0.00 H new ATOM 0 HG2 PRO A 53 15.987 -5.168 -6.058 1.00 0.00 H new ATOM 0 HG3 PRO A 53 16.747 -5.263 -7.634 1.00 0.00 H new ATOM 0 HD2 PRO A 53 15.192 -3.156 -6.997 1.00 0.00 H new ATOM 0 HD3 PRO A 53 15.185 -3.797 -8.628 1.00 0.00 H new ATOM 769 N GLY A 54 13.040 -5.622 -5.003 1.00 0.00 N ATOM 770 CA GLY A 54 12.490 -5.951 -3.706 1.00 0.00 C ATOM 771 C GLY A 54 10.989 -6.142 -3.746 1.00 0.00 C ATOM 772 O GLY A 54 10.481 -7.223 -3.432 1.00 0.00 O ATOM 0 H GLY A 54 13.543 -4.735 -5.040 1.00 0.00 H new ATOM 0 HA2 GLY A 54 12.960 -6.863 -3.336 1.00 0.00 H new ATOM 0 HA3 GLY A 54 12.734 -5.158 -2.999 1.00 0.00 H new ATOM 776 N PHE A 55 10.272 -5.093 -4.137 1.00 0.00 N ATOM 777 CA PHE A 55 8.828 -5.160 -4.217 1.00 0.00 C ATOM 778 C PHE A 55 8.402 -6.054 -5.374 1.00 0.00 C ATOM 779 O PHE A 55 7.519 -6.899 -5.228 1.00 0.00 O ATOM 780 CB PHE A 55 8.236 -3.762 -4.404 1.00 0.00 C ATOM 781 CG PHE A 55 8.159 -2.921 -3.155 1.00 0.00 C ATOM 782 CD1 PHE A 55 7.364 -3.295 -2.078 1.00 0.00 C ATOM 783 CD2 PHE A 55 8.874 -1.735 -3.068 1.00 0.00 C ATOM 784 CE1 PHE A 55 7.289 -2.508 -0.948 1.00 0.00 C ATOM 785 CE2 PHE A 55 8.802 -0.946 -1.939 1.00 0.00 C ATOM 786 CZ PHE A 55 8.008 -1.333 -0.877 1.00 0.00 C ATOM 0 H PHE A 55 10.671 -4.192 -4.401 1.00 0.00 H new ATOM 0 HA PHE A 55 8.455 -5.581 -3.284 1.00 0.00 H new ATOM 0 HB2 PHE A 55 8.833 -3.229 -5.144 1.00 0.00 H new ATOM 0 HB3 PHE A 55 7.232 -3.863 -4.816 1.00 0.00 H new ATOM 0 HD1 PHE A 55 6.798 -4.213 -2.127 1.00 0.00 H new ATOM 0 HD2 PHE A 55 9.495 -1.426 -3.895 1.00 0.00 H new ATOM 0 HE1 PHE A 55 6.667 -2.812 -0.119 1.00 0.00 H new ATOM 0 HE2 PHE A 55 9.366 -0.026 -1.885 1.00 0.00 H new ATOM 0 HZ PHE A 55 7.950 -0.716 0.008 1.00 0.00 H new ATOM 796 N GLU A 56 9.041 -5.864 -6.526 1.00 0.00 N ATOM 797 CA GLU A 56 8.734 -6.656 -7.711 1.00 0.00 C ATOM 798 C GLU A 56 8.849 -8.150 -7.411 1.00 0.00 C ATOM 799 O GLU A 56 8.287 -8.980 -8.124 1.00 0.00 O ATOM 800 CB GLU A 56 9.663 -6.273 -8.869 1.00 0.00 C ATOM 801 CG GLU A 56 8.919 -5.893 -10.141 1.00 0.00 C ATOM 802 CD GLU A 56 9.781 -6.019 -11.382 1.00 0.00 C ATOM 803 OE1 GLU A 56 10.657 -6.907 -11.411 1.00 0.00 O ATOM 804 OE2 GLU A 56 9.574 -5.230 -12.329 1.00 0.00 O ATOM 0 H GLU A 56 9.774 -5.168 -6.663 1.00 0.00 H new ATOM 0 HA GLU A 56 7.706 -6.443 -8.004 1.00 0.00 H new ATOM 0 HB2 GLU A 56 10.290 -5.437 -8.560 1.00 0.00 H new ATOM 0 HB3 GLU A 56 10.329 -7.109 -9.083 1.00 0.00 H new ATOM 0 HG2 GLU A 56 8.041 -6.530 -10.247 1.00 0.00 H new ATOM 0 HG3 GLU A 56 8.561 -4.867 -10.055 1.00 0.00 H new ATOM 811 N ASP A 57 9.579 -8.486 -6.348 1.00 0.00 N ATOM 812 CA ASP A 57 9.758 -9.876 -5.956 1.00 0.00 C ATOM 813 C ASP A 57 8.525 -10.401 -5.231 1.00 0.00 C ATOM 814 O ASP A 57 7.737 -11.152 -5.799 1.00 0.00 O ATOM 815 CB ASP A 57 10.989 -10.028 -5.058 1.00 0.00 C ATOM 816 CG ASP A 57 12.125 -10.747 -5.754 1.00 0.00 C ATOM 817 OD1 ASP A 57 12.170 -10.719 -7.003 1.00 0.00 O ATOM 818 OD2 ASP A 57 12.971 -11.343 -5.054 1.00 0.00 O ATOM 0 H ASP A 57 10.054 -7.813 -5.746 1.00 0.00 H new ATOM 0 HA ASP A 57 9.905 -10.461 -6.864 1.00 0.00 H new ATOM 0 HB2 ASP A 57 11.327 -9.042 -4.740 1.00 0.00 H new ATOM 0 HB3 ASP A 57 10.713 -10.576 -4.157 1.00 0.00 H new ATOM 823 N GLY A 58 8.374 -10.023 -3.964 1.00 0.00 N ATOM 824 CA GLY A 58 7.244 -10.496 -3.187 1.00 0.00 C ATOM 825 C GLY A 58 5.930 -9.955 -3.692 1.00 0.00 C ATOM 826 O GLY A 58 4.982 -10.706 -3.918 1.00 0.00 O ATOM 0 H GLY A 58 9.010 -9.401 -3.465 1.00 0.00 H new ATOM 0 HA2 GLY A 58 7.219 -11.585 -3.214 1.00 0.00 H new ATOM 0 HA3 GLY A 58 7.377 -10.206 -2.145 1.00 0.00 H new ATOM 830 N ILE A 59 5.871 -8.642 -3.861 1.00 0.00 N ATOM 831 CA ILE A 59 4.683 -7.968 -4.331 1.00 0.00 C ATOM 832 C ILE A 59 4.585 -8.010 -5.846 1.00 0.00 C ATOM 833 O ILE A 59 4.111 -7.073 -6.487 1.00 0.00 O ATOM 834 CB ILE A 59 4.681 -6.511 -3.844 1.00 0.00 C ATOM 835 CG1 ILE A 59 5.101 -6.435 -2.372 1.00 0.00 C ATOM 836 CG2 ILE A 59 3.307 -5.896 -4.036 1.00 0.00 C ATOM 837 CD1 ILE A 59 6.587 -6.544 -2.131 1.00 0.00 C ATOM 0 H ILE A 59 6.654 -8.016 -3.673 1.00 0.00 H new ATOM 0 HA ILE A 59 3.816 -8.488 -3.924 1.00 0.00 H new ATOM 0 HB ILE A 59 5.402 -5.946 -4.435 1.00 0.00 H new ATOM 0 HG12 ILE A 59 4.748 -5.491 -1.956 1.00 0.00 H new ATOM 0 HG13 ILE A 59 4.599 -7.232 -1.824 1.00 0.00 H new ATOM 0 HG21 ILE A 59 3.319 -4.863 -3.687 1.00 0.00 H new ATOM 0 HG22 ILE A 59 3.043 -5.919 -5.093 1.00 0.00 H new ATOM 0 HG23 ILE A 59 2.571 -6.463 -3.466 1.00 0.00 H new ATOM 0 HD11 ILE A 59 6.788 -6.480 -1.062 1.00 0.00 H new ATOM 0 HD12 ILE A 59 6.948 -7.500 -2.511 1.00 0.00 H new ATOM 0 HD13 ILE A 59 7.100 -5.731 -2.646 1.00 0.00 H new ATOM 849 N LYS A 60 4.977 -9.150 -6.389 1.00 0.00 N ATOM 850 CA LYS A 60 4.859 -9.360 -7.823 1.00 0.00 C ATOM 851 C LYS A 60 3.412 -9.019 -8.178 1.00 0.00 C ATOM 852 O LYS A 60 3.132 -8.256 -9.102 1.00 0.00 O ATOM 853 CB LYS A 60 5.212 -10.797 -8.233 1.00 0.00 C ATOM 854 CG LYS A 60 4.716 -11.871 -7.275 1.00 0.00 C ATOM 855 CD LYS A 60 5.737 -12.989 -7.125 1.00 0.00 C ATOM 856 CE LYS A 60 5.834 -13.833 -8.386 1.00 0.00 C ATOM 857 NZ LYS A 60 6.764 -13.236 -9.385 1.00 0.00 N ATOM 0 H LYS A 60 5.374 -9.933 -5.869 1.00 0.00 H new ATOM 0 HA LYS A 60 5.565 -8.729 -8.363 1.00 0.00 H new ATOM 0 HB2 LYS A 60 4.796 -10.991 -9.222 1.00 0.00 H new ATOM 0 HB3 LYS A 60 6.295 -10.880 -8.321 1.00 0.00 H new ATOM 0 HG2 LYS A 60 4.513 -11.427 -6.300 1.00 0.00 H new ATOM 0 HG3 LYS A 60 3.775 -12.281 -7.640 1.00 0.00 H new ATOM 0 HD2 LYS A 60 6.714 -12.562 -6.897 1.00 0.00 H new ATOM 0 HD3 LYS A 60 5.461 -13.623 -6.283 1.00 0.00 H new ATOM 0 HE2 LYS A 60 6.175 -14.835 -8.126 1.00 0.00 H new ATOM 0 HE3 LYS A 60 4.844 -13.938 -8.829 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 7.159 -13.988 -9.984 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 6.246 -12.557 -9.978 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 7.536 -12.746 -8.891 1.00 0.00 H new ATOM 871 N GLY A 61 2.508 -9.633 -7.419 1.00 0.00 N ATOM 872 CA GLY A 61 1.087 -9.457 -7.612 1.00 0.00 C ATOM 873 C GLY A 61 0.477 -10.718 -8.165 1.00 0.00 C ATOM 874 O GLY A 61 -0.277 -10.696 -9.137 1.00 0.00 O ATOM 0 H GLY A 61 2.749 -10.265 -6.655 1.00 0.00 H new ATOM 0 HA2 GLY A 61 0.613 -9.200 -6.665 1.00 0.00 H new ATOM 0 HA3 GLY A 61 0.905 -8.627 -8.295 1.00 0.00 H new ATOM 878 N HIS A 62 0.835 -11.832 -7.540 1.00 0.00 N ATOM 879 CA HIS A 62 0.349 -13.139 -7.981 1.00 0.00 C ATOM 880 C HIS A 62 -0.359 -13.911 -6.867 1.00 0.00 C ATOM 881 O HIS A 62 -1.019 -14.917 -7.130 1.00 0.00 O ATOM 882 CB HIS A 62 1.510 -13.969 -8.539 1.00 0.00 C ATOM 883 CG HIS A 62 2.459 -14.479 -7.494 1.00 0.00 C ATOM 884 ND1 HIS A 62 3.320 -15.534 -7.714 1.00 0.00 N ATOM 885 CD2 HIS A 62 2.682 -14.078 -6.219 1.00 0.00 C ATOM 886 CE1 HIS A 62 4.028 -15.761 -6.623 1.00 0.00 C ATOM 887 NE2 HIS A 62 3.660 -14.890 -5.701 1.00 0.00 N ATOM 0 H HIS A 62 1.456 -11.861 -6.731 1.00 0.00 H new ATOM 0 HA HIS A 62 -0.388 -12.959 -8.764 1.00 0.00 H new ATOM 0 HB2 HIS A 62 1.104 -14.817 -9.090 1.00 0.00 H new ATOM 0 HB3 HIS A 62 2.066 -13.362 -9.253 1.00 0.00 H new ATOM 0 HD2 HIS A 62 2.183 -13.270 -5.706 1.00 0.00 H new ATOM 0 HE1 HIS A 62 4.779 -16.528 -6.505 1.00 0.00 H new ATOM 0 HE2 HIS A 62 4.041 -14.830 -4.757 1.00 0.00 H new ATOM 895 N LYS A 63 -0.228 -13.451 -5.629 1.00 0.00 N ATOM 896 CA LYS A 63 -0.866 -14.126 -4.504 1.00 0.00 C ATOM 897 C LYS A 63 -1.802 -13.191 -3.747 1.00 0.00 C ATOM 898 O LYS A 63 -1.425 -12.608 -2.732 1.00 0.00 O ATOM 899 CB LYS A 63 0.187 -14.688 -3.550 1.00 0.00 C ATOM 900 CG LYS A 63 0.789 -16.004 -4.013 1.00 0.00 C ATOM 901 CD LYS A 63 0.212 -17.181 -3.242 1.00 0.00 C ATOM 902 CE LYS A 63 -0.022 -18.379 -4.147 1.00 0.00 C ATOM 903 NZ LYS A 63 1.060 -19.395 -4.021 1.00 0.00 N ATOM 0 H LYS A 63 0.309 -12.621 -5.379 1.00 0.00 H new ATOM 0 HA LYS A 63 -1.459 -14.946 -4.909 1.00 0.00 H new ATOM 0 HB2 LYS A 63 0.985 -13.955 -3.431 1.00 0.00 H new ATOM 0 HB3 LYS A 63 -0.264 -14.830 -2.568 1.00 0.00 H new ATOM 0 HG2 LYS A 63 0.600 -16.137 -5.078 1.00 0.00 H new ATOM 0 HG3 LYS A 63 1.871 -15.977 -3.882 1.00 0.00 H new ATOM 0 HD2 LYS A 63 0.893 -17.459 -2.437 1.00 0.00 H new ATOM 0 HD3 LYS A 63 -0.728 -16.886 -2.776 1.00 0.00 H new ATOM 0 HE2 LYS A 63 -0.980 -18.837 -3.901 1.00 0.00 H new ATOM 0 HE3 LYS A 63 -0.086 -18.044 -5.182 1.00 0.00 H new ATOM 0 HZ1 LYS A 63 0.861 -20.195 -4.655 1.00 0.00 H new ATOM 0 HZ2 LYS A 63 1.971 -18.966 -4.281 1.00 0.00 H new ATOM 0 HZ3 LYS A 63 1.105 -19.735 -3.039 1.00 0.00 H new ATOM 917 N ALA A 64 -3.035 -13.082 -4.227 1.00 0.00 N ATOM 918 CA ALA A 64 -4.036 -12.252 -3.575 1.00 0.00 C ATOM 919 C ALA A 64 -4.284 -12.724 -2.140 1.00 0.00 C ATOM 920 O ALA A 64 -5.096 -13.620 -1.909 1.00 0.00 O ATOM 921 CB ALA A 64 -5.330 -12.266 -4.375 1.00 0.00 C ATOM 0 H ALA A 64 -3.364 -13.559 -5.066 1.00 0.00 H new ATOM 0 HA ALA A 64 -3.662 -11.229 -3.533 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -6.072 -11.641 -3.878 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -5.143 -11.879 -5.377 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -5.704 -13.288 -4.445 1.00 0.00 H new ATOM 927 N GLY A 65 -3.587 -12.118 -1.182 1.00 0.00 N ATOM 928 CA GLY A 65 -3.757 -12.499 0.212 1.00 0.00 C ATOM 929 C GLY A 65 -2.593 -13.320 0.739 1.00 0.00 C ATOM 930 O GLY A 65 -2.788 -14.263 1.505 1.00 0.00 O ATOM 0 H GLY A 65 -2.910 -11.373 -1.344 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -3.868 -11.601 0.819 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -4.678 -13.072 0.319 1.00 0.00 H new ATOM 934 N GLU A 66 -1.382 -12.968 0.316 1.00 0.00 N ATOM 935 CA GLU A 66 -0.182 -13.688 0.735 1.00 0.00 C ATOM 936 C GLU A 66 0.534 -12.992 1.888 1.00 0.00 C ATOM 937 O GLU A 66 0.244 -11.843 2.214 1.00 0.00 O ATOM 938 CB GLU A 66 0.782 -13.824 -0.443 1.00 0.00 C ATOM 939 CG GLU A 66 1.363 -15.218 -0.595 1.00 0.00 C ATOM 940 CD GLU A 66 2.674 -15.223 -1.356 1.00 0.00 C ATOM 941 OE1 GLU A 66 2.863 -14.338 -2.217 1.00 0.00 O ATOM 942 OE2 GLU A 66 3.513 -16.111 -1.089 1.00 0.00 O ATOM 0 H GLU A 66 -1.205 -12.188 -0.317 1.00 0.00 H new ATOM 0 HA GLU A 66 -0.501 -14.672 1.080 1.00 0.00 H new ATOM 0 HB2 GLU A 66 0.260 -13.555 -1.361 1.00 0.00 H new ATOM 0 HB3 GLU A 66 1.597 -13.111 -0.319 1.00 0.00 H new ATOM 0 HG2 GLU A 66 1.519 -15.652 0.392 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.644 -15.853 -1.113 1.00 0.00 H new ATOM 949 N GLU A 67 1.490 -13.709 2.477 1.00 0.00 N ATOM 950 CA GLU A 67 2.298 -13.192 3.578 1.00 0.00 C ATOM 951 C GLU A 67 3.766 -13.559 3.348 1.00 0.00 C ATOM 952 O GLU A 67 4.173 -14.693 3.593 1.00 0.00 O ATOM 953 CB GLU A 67 1.815 -13.762 4.915 1.00 0.00 C ATOM 954 CG GLU A 67 0.453 -13.242 5.347 1.00 0.00 C ATOM 955 CD GLU A 67 -0.670 -14.205 5.012 1.00 0.00 C ATOM 956 OE1 GLU A 67 -1.108 -14.224 3.843 1.00 0.00 O ATOM 957 OE2 GLU A 67 -1.111 -14.940 5.921 1.00 0.00 O ATOM 0 H GLU A 67 1.725 -14.663 2.204 1.00 0.00 H new ATOM 0 HA GLU A 67 2.196 -12.107 3.613 1.00 0.00 H new ATOM 0 HB2 GLU A 67 1.772 -14.849 4.842 1.00 0.00 H new ATOM 0 HB3 GLU A 67 2.547 -13.523 5.687 1.00 0.00 H new ATOM 0 HG2 GLU A 67 0.462 -13.059 6.421 1.00 0.00 H new ATOM 0 HG3 GLU A 67 0.263 -12.284 4.862 1.00 0.00 H new ATOM 964 N PHE A 68 4.548 -12.607 2.844 1.00 0.00 N ATOM 965 CA PHE A 68 5.960 -12.857 2.545 1.00 0.00 C ATOM 966 C PHE A 68 6.853 -11.729 3.052 1.00 0.00 C ATOM 967 O PHE A 68 6.376 -10.655 3.408 1.00 0.00 O ATOM 968 CB PHE A 68 6.141 -13.005 1.043 1.00 0.00 C ATOM 969 CG PHE A 68 5.548 -11.852 0.310 1.00 0.00 C ATOM 970 CD1 PHE A 68 6.261 -10.679 0.154 1.00 0.00 C ATOM 971 CD2 PHE A 68 4.265 -11.930 -0.192 1.00 0.00 C ATOM 972 CE1 PHE A 68 5.701 -9.600 -0.499 1.00 0.00 C ATOM 973 CE2 PHE A 68 3.699 -10.857 -0.839 1.00 0.00 C ATOM 974 CZ PHE A 68 4.415 -9.689 -0.995 1.00 0.00 C ATOM 0 H PHE A 68 4.232 -11.660 2.634 1.00 0.00 H new ATOM 0 HA PHE A 68 6.253 -13.775 3.055 1.00 0.00 H new ATOM 0 HB2 PHE A 68 7.203 -13.081 0.808 1.00 0.00 H new ATOM 0 HB3 PHE A 68 5.674 -13.931 0.708 1.00 0.00 H new ATOM 0 HD1 PHE A 68 7.265 -10.606 0.546 1.00 0.00 H new ATOM 0 HD2 PHE A 68 3.700 -12.843 -0.076 1.00 0.00 H new ATOM 0 HE1 PHE A 68 6.267 -8.688 -0.622 1.00 0.00 H new ATOM 0 HE2 PHE A 68 2.693 -10.929 -1.225 1.00 0.00 H new ATOM 0 HZ PHE A 68 3.971 -8.846 -1.504 1.00 0.00 H new ATOM 984 N THR A 69 8.157 -11.979 3.069 1.00 0.00 N ATOM 985 CA THR A 69 9.121 -10.985 3.518 1.00 0.00 C ATOM 986 C THR A 69 10.178 -10.735 2.447 1.00 0.00 C ATOM 987 O THR A 69 10.851 -11.668 2.007 1.00 0.00 O ATOM 988 CB THR A 69 9.791 -11.449 4.812 1.00 0.00 C ATOM 989 OG1 THR A 69 8.823 -11.756 5.799 1.00 0.00 O ATOM 990 CG2 THR A 69 10.736 -10.424 5.402 1.00 0.00 C ATOM 0 H THR A 69 8.571 -12.864 2.776 1.00 0.00 H new ATOM 0 HA THR A 69 8.589 -10.052 3.705 1.00 0.00 H new ATOM 0 HB THR A 69 10.366 -12.332 4.534 1.00 0.00 H new ATOM 0 HG1 THR A 69 9.273 -12.052 6.618 1.00 0.00 H new ATOM 0 HG21 THR A 69 11.176 -10.819 6.318 1.00 0.00 H new ATOM 0 HG22 THR A 69 11.527 -10.204 4.685 1.00 0.00 H new ATOM 0 HG23 THR A 69 10.186 -9.510 5.628 1.00 0.00 H new ATOM 998 N ILE A 70 10.334 -9.477 2.029 1.00 0.00 N ATOM 999 CA ILE A 70 11.328 -9.150 1.013 1.00 0.00 C ATOM 1000 C ILE A 70 12.162 -7.955 1.432 1.00 0.00 C ATOM 1001 O ILE A 70 11.812 -7.235 2.367 1.00 0.00 O ATOM 1002 CB ILE A 70 10.687 -8.866 -0.364 1.00 0.00 C ATOM 1003 CG1 ILE A 70 9.876 -7.566 -0.339 1.00 0.00 C ATOM 1004 CG2 ILE A 70 9.815 -10.034 -0.797 1.00 0.00 C ATOM 1005 CD1 ILE A 70 8.645 -7.632 0.539 1.00 0.00 C ATOM 0 H ILE A 70 9.794 -8.683 2.373 1.00 0.00 H new ATOM 0 HA ILE A 70 11.969 -10.027 0.917 1.00 0.00 H new ATOM 0 HB ILE A 70 11.490 -8.745 -1.091 1.00 0.00 H new ATOM 0 HG12 ILE A 70 10.516 -6.756 0.009 1.00 0.00 H new ATOM 0 HG13 ILE A 70 9.573 -7.318 -1.356 1.00 0.00 H new ATOM 0 HG21 ILE A 70 9.372 -9.816 -1.769 1.00 0.00 H new ATOM 0 HG22 ILE A 70 10.424 -10.935 -0.869 1.00 0.00 H new ATOM 0 HG23 ILE A 70 9.024 -10.189 -0.064 1.00 0.00 H new ATOM 0 HD11 ILE A 70 8.123 -6.676 0.506 1.00 0.00 H new ATOM 0 HD12 ILE A 70 7.983 -8.420 0.179 1.00 0.00 H new ATOM 0 HD13 ILE A 70 8.941 -7.848 1.565 1.00 0.00 H new ATOM 1017 N ASP A 71 13.250 -7.732 0.713 1.00 0.00 N ATOM 1018 CA ASP A 71 14.115 -6.601 0.988 1.00 0.00 C ATOM 1019 C ASP A 71 13.713 -5.441 0.096 1.00 0.00 C ATOM 1020 O ASP A 71 13.219 -5.652 -1.009 1.00 0.00 O ATOM 1021 CB ASP A 71 15.581 -6.972 0.746 1.00 0.00 C ATOM 1022 CG ASP A 71 16.146 -7.845 1.850 1.00 0.00 C ATOM 1023 OD1 ASP A 71 15.361 -8.587 2.480 1.00 0.00 O ATOM 1024 OD2 ASP A 71 17.370 -7.788 2.086 1.00 0.00 O ATOM 0 H ASP A 71 13.553 -8.319 -0.064 1.00 0.00 H new ATOM 0 HA ASP A 71 14.008 -6.313 2.034 1.00 0.00 H new ATOM 0 HB2 ASP A 71 15.668 -7.494 -0.207 1.00 0.00 H new ATOM 0 HB3 ASP A 71 16.175 -6.062 0.666 1.00 0.00 H new ATOM 1029 N VAL A 72 13.936 -4.222 0.556 1.00 0.00 N ATOM 1030 CA VAL A 72 13.600 -3.048 -0.243 1.00 0.00 C ATOM 1031 C VAL A 72 14.624 -1.942 -0.041 1.00 0.00 C ATOM 1032 O VAL A 72 14.977 -1.610 1.088 1.00 0.00 O ATOM 1033 CB VAL A 72 12.198 -2.500 0.089 1.00 0.00 C ATOM 1034 CG1 VAL A 72 11.127 -3.267 -0.671 1.00 0.00 C ATOM 1035 CG2 VAL A 72 11.938 -2.546 1.587 1.00 0.00 C ATOM 0 H VAL A 72 14.344 -4.016 1.468 1.00 0.00 H new ATOM 0 HA VAL A 72 13.607 -3.371 -1.284 1.00 0.00 H new ATOM 0 HB VAL A 72 12.158 -1.458 -0.227 1.00 0.00 H new ATOM 0 HG11 VAL A 72 10.145 -2.864 -0.422 1.00 0.00 H new ATOM 0 HG12 VAL A 72 11.299 -3.167 -1.743 1.00 0.00 H new ATOM 0 HG13 VAL A 72 11.168 -4.320 -0.394 1.00 0.00 H new ATOM 0 HG21 VAL A 72 10.943 -2.154 1.796 1.00 0.00 H new ATOM 0 HG22 VAL A 72 12.003 -3.577 1.936 1.00 0.00 H new ATOM 0 HG23 VAL A 72 12.682 -1.940 2.104 1.00 0.00 H new ATOM 1045 N THR A 73 15.090 -1.362 -1.139 1.00 0.00 N ATOM 1046 CA THR A 73 16.065 -0.282 -1.087 1.00 0.00 C ATOM 1047 C THR A 73 15.873 0.608 -2.308 1.00 0.00 C ATOM 1048 O THR A 73 15.928 0.135 -3.444 1.00 0.00 O ATOM 1049 CB THR A 73 17.491 -0.844 -1.049 1.00 0.00 C ATOM 1050 OG1 THR A 73 17.762 -1.435 0.210 1.00 0.00 O ATOM 1051 CG2 THR A 73 18.564 0.195 -1.306 1.00 0.00 C ATOM 0 H THR A 73 14.806 -1.624 -2.083 1.00 0.00 H new ATOM 0 HA THR A 73 15.915 0.303 -0.180 1.00 0.00 H new ATOM 0 HB THR A 73 17.527 -1.579 -1.853 1.00 0.00 H new ATOM 0 HG1 THR A 73 16.939 -1.466 0.741 1.00 0.00 H new ATOM 0 HG21 THR A 73 19.545 -0.277 -1.263 1.00 0.00 H new ATOM 0 HG22 THR A 73 18.416 0.635 -2.292 1.00 0.00 H new ATOM 0 HG23 THR A 73 18.504 0.976 -0.548 1.00 0.00 H new ATOM 1059 N PHE A 74 15.625 1.889 -2.078 1.00 0.00 N ATOM 1060 CA PHE A 74 15.396 2.825 -3.166 1.00 0.00 C ATOM 1061 C PHE A 74 16.706 3.380 -3.725 1.00 0.00 C ATOM 1062 O PHE A 74 17.593 3.785 -2.971 1.00 0.00 O ATOM 1063 CB PHE A 74 14.482 3.945 -2.685 1.00 0.00 C ATOM 1064 CG PHE A 74 13.084 3.459 -2.422 1.00 0.00 C ATOM 1065 CD1 PHE A 74 12.845 2.445 -1.505 1.00 0.00 C ATOM 1066 CD2 PHE A 74 12.016 3.999 -3.111 1.00 0.00 C ATOM 1067 CE1 PHE A 74 11.559 1.984 -1.284 1.00 0.00 C ATOM 1068 CE2 PHE A 74 10.730 3.546 -2.893 1.00 0.00 C ATOM 1069 CZ PHE A 74 10.500 2.536 -1.980 1.00 0.00 C ATOM 0 H PHE A 74 15.577 2.303 -1.147 1.00 0.00 H new ATOM 0 HA PHE A 74 14.910 2.293 -3.984 1.00 0.00 H new ATOM 0 HB2 PHE A 74 14.892 4.381 -1.774 1.00 0.00 H new ATOM 0 HB3 PHE A 74 14.455 4.737 -3.433 1.00 0.00 H new ATOM 0 HD1 PHE A 74 13.670 2.012 -0.959 1.00 0.00 H new ATOM 0 HD2 PHE A 74 12.189 4.786 -3.830 1.00 0.00 H new ATOM 0 HE1 PHE A 74 11.383 1.194 -0.569 1.00 0.00 H new ATOM 0 HE2 PHE A 74 9.904 3.981 -3.436 1.00 0.00 H new ATOM 0 HZ PHE A 74 9.495 2.178 -1.810 1.00 0.00 H new ATOM 1079 N PRO A 75 16.846 3.400 -5.064 1.00 0.00 N ATOM 1080 CA PRO A 75 18.054 3.898 -5.729 1.00 0.00 C ATOM 1081 C PRO A 75 18.214 5.410 -5.611 1.00 0.00 C ATOM 1082 O PRO A 75 17.353 6.097 -5.062 1.00 0.00 O ATOM 1083 CB PRO A 75 17.842 3.505 -7.192 1.00 0.00 C ATOM 1084 CG PRO A 75 16.365 3.428 -7.351 1.00 0.00 C ATOM 1085 CD PRO A 75 15.838 2.930 -6.036 1.00 0.00 C ATOM 0 HA PRO A 75 18.957 3.482 -5.281 1.00 0.00 H new ATOM 0 HB2 PRO A 75 18.275 4.243 -7.867 1.00 0.00 H new ATOM 0 HB3 PRO A 75 18.315 2.549 -7.418 1.00 0.00 H new ATOM 0 HG2 PRO A 75 15.947 4.404 -7.596 1.00 0.00 H new ATOM 0 HG3 PRO A 75 16.094 2.752 -8.162 1.00 0.00 H new ATOM 0 HD2 PRO A 75 14.850 3.336 -5.819 1.00 0.00 H new ATOM 0 HD3 PRO A 75 15.745 1.844 -6.025 1.00 0.00 H new ATOM 1093 N GLU A 76 19.323 5.919 -6.136 1.00 0.00 N ATOM 1094 CA GLU A 76 19.604 7.348 -6.096 1.00 0.00 C ATOM 1095 C GLU A 76 18.724 8.113 -7.084 1.00 0.00 C ATOM 1096 O GLU A 76 18.631 9.339 -7.019 1.00 0.00 O ATOM 1097 CB GLU A 76 21.082 7.608 -6.402 1.00 0.00 C ATOM 1098 CG GLU A 76 21.798 8.396 -5.318 1.00 0.00 C ATOM 1099 CD GLU A 76 22.410 7.505 -4.256 1.00 0.00 C ATOM 1100 OE1 GLU A 76 23.561 7.060 -4.446 1.00 0.00 O ATOM 1101 OE2 GLU A 76 21.740 7.256 -3.231 1.00 0.00 O ATOM 0 H GLU A 76 20.043 5.361 -6.595 1.00 0.00 H new ATOM 0 HA GLU A 76 19.378 7.705 -5.091 1.00 0.00 H new ATOM 0 HB2 GLU A 76 21.589 6.653 -6.541 1.00 0.00 H new ATOM 0 HB3 GLU A 76 21.159 8.150 -7.345 1.00 0.00 H new ATOM 0 HG2 GLU A 76 22.581 9.003 -5.773 1.00 0.00 H new ATOM 0 HG3 GLU A 76 21.094 9.083 -4.849 1.00 0.00 H new ATOM 1108 N GLU A 77 18.078 7.390 -7.997 1.00 0.00 N ATOM 1109 CA GLU A 77 17.211 8.024 -8.986 1.00 0.00 C ATOM 1110 C GLU A 77 15.795 8.206 -8.441 1.00 0.00 C ATOM 1111 O GLU A 77 15.118 9.181 -8.769 1.00 0.00 O ATOM 1112 CB GLU A 77 17.188 7.219 -10.290 1.00 0.00 C ATOM 1113 CG GLU A 77 17.055 5.716 -10.097 1.00 0.00 C ATOM 1114 CD GLU A 77 18.300 4.958 -10.518 1.00 0.00 C ATOM 1115 OE1 GLU A 77 19.022 5.450 -11.408 1.00 0.00 O ATOM 1116 OE2 GLU A 77 18.550 3.868 -9.961 1.00 0.00 O ATOM 0 H GLU A 77 18.138 6.375 -8.072 1.00 0.00 H new ATOM 0 HA GLU A 77 17.620 9.011 -9.201 1.00 0.00 H new ATOM 0 HB2 GLU A 77 16.359 7.569 -10.905 1.00 0.00 H new ATOM 0 HB3 GLU A 77 18.104 7.422 -10.845 1.00 0.00 H new ATOM 0 HG2 GLU A 77 16.844 5.506 -9.048 1.00 0.00 H new ATOM 0 HG3 GLU A 77 16.203 5.354 -10.672 1.00 0.00 H new ATOM 1123 N TYR A 78 15.357 7.281 -7.590 1.00 0.00 N ATOM 1124 CA TYR A 78 14.027 7.370 -6.988 1.00 0.00 C ATOM 1125 C TYR A 78 13.953 8.589 -6.082 1.00 0.00 C ATOM 1126 O TYR A 78 13.255 9.560 -6.375 1.00 0.00 O ATOM 1127 CB TYR A 78 13.721 6.105 -6.176 1.00 0.00 C ATOM 1128 CG TYR A 78 12.244 5.870 -5.943 1.00 0.00 C ATOM 1129 CD1 TYR A 78 11.510 6.671 -5.071 1.00 0.00 C ATOM 1130 CD2 TYR A 78 11.584 4.840 -6.597 1.00 0.00 C ATOM 1131 CE1 TYR A 78 10.161 6.448 -4.864 1.00 0.00 C ATOM 1132 CE2 TYR A 78 10.237 4.613 -6.397 1.00 0.00 C ATOM 1133 CZ TYR A 78 9.529 5.420 -5.530 1.00 0.00 C ATOM 1134 OH TYR A 78 8.187 5.195 -5.331 1.00 0.00 O ATOM 0 H TYR A 78 15.899 6.466 -7.303 1.00 0.00 H new ATOM 0 HA TYR A 78 13.289 7.464 -7.785 1.00 0.00 H new ATOM 0 HB2 TYR A 78 14.139 5.242 -6.694 1.00 0.00 H new ATOM 0 HB3 TYR A 78 14.225 6.173 -5.212 1.00 0.00 H new ATOM 0 HD1 TYR A 78 12.002 7.478 -4.549 1.00 0.00 H new ATOM 0 HD2 TYR A 78 12.134 4.204 -7.275 1.00 0.00 H new ATOM 0 HE1 TYR A 78 9.605 7.076 -4.184 1.00 0.00 H new ATOM 0 HE2 TYR A 78 9.740 3.807 -6.917 1.00 0.00 H new ATOM 0 HH TYR A 78 7.898 4.434 -5.877 1.00 0.00 H new ATOM 1144 N HIS A 79 14.704 8.523 -4.990 1.00 0.00 N ATOM 1145 CA HIS A 79 14.784 9.597 -4.007 1.00 0.00 C ATOM 1146 C HIS A 79 13.481 10.386 -3.860 1.00 0.00 C ATOM 1147 O HIS A 79 13.390 11.534 -4.299 1.00 0.00 O ATOM 1148 CB HIS A 79 15.934 10.537 -4.365 1.00 0.00 C ATOM 1149 CG HIS A 79 17.260 10.031 -3.893 1.00 0.00 C ATOM 1150 ND1 HIS A 79 18.378 10.829 -3.781 1.00 0.00 N ATOM 1151 CD2 HIS A 79 17.640 8.793 -3.491 1.00 0.00 C ATOM 1152 CE1 HIS A 79 19.390 10.107 -3.333 1.00 0.00 C ATOM 1153 NE2 HIS A 79 18.968 8.870 -3.147 1.00 0.00 N ATOM 0 H HIS A 79 15.281 7.714 -4.759 1.00 0.00 H new ATOM 0 HA HIS A 79 14.967 9.128 -3.040 1.00 0.00 H new ATOM 0 HB2 HIS A 79 15.965 10.672 -5.446 1.00 0.00 H new ATOM 0 HB3 HIS A 79 15.747 11.517 -3.927 1.00 0.00 H new ATOM 0 HD2 HIS A 79 17.016 7.912 -3.449 1.00 0.00 H new ATOM 0 HE1 HIS A 79 20.392 10.467 -3.150 1.00 0.00 H new ATOM 0 HE2 HIS A 79 19.536 8.096 -2.803 1.00 0.00 H new ATOM 1161 N ALA A 80 12.485 9.776 -3.220 1.00 0.00 N ATOM 1162 CA ALA A 80 11.205 10.439 -2.994 1.00 0.00 C ATOM 1163 C ALA A 80 11.260 11.286 -1.725 1.00 0.00 C ATOM 1164 O ALA A 80 11.855 10.890 -0.726 1.00 0.00 O ATOM 1165 CB ALA A 80 10.081 9.422 -2.909 1.00 0.00 C ATOM 0 H ALA A 80 12.541 8.827 -2.850 1.00 0.00 H new ATOM 0 HA ALA A 80 11.005 11.097 -3.840 1.00 0.00 H new ATOM 0 HB1 ALA A 80 9.136 9.938 -2.740 1.00 0.00 H new ATOM 0 HB2 ALA A 80 10.027 8.861 -3.842 1.00 0.00 H new ATOM 0 HB3 ALA A 80 10.273 8.736 -2.084 1.00 0.00 H new ATOM 1171 N GLU A 81 10.652 12.461 -1.780 1.00 0.00 N ATOM 1172 CA GLU A 81 10.641 13.393 -0.654 1.00 0.00 C ATOM 1173 C GLU A 81 10.368 12.722 0.699 1.00 0.00 C ATOM 1174 O GLU A 81 10.751 13.259 1.738 1.00 0.00 O ATOM 1175 CB GLU A 81 9.593 14.481 -0.896 1.00 0.00 C ATOM 1176 CG GLU A 81 9.935 15.412 -2.046 1.00 0.00 C ATOM 1177 CD GLU A 81 8.756 15.658 -2.967 1.00 0.00 C ATOM 1178 OE1 GLU A 81 7.976 16.597 -2.696 1.00 0.00 O ATOM 1179 OE2 GLU A 81 8.609 14.913 -3.959 1.00 0.00 O ATOM 0 H GLU A 81 10.152 12.798 -2.603 1.00 0.00 H new ATOM 0 HA GLU A 81 11.643 13.819 -0.599 1.00 0.00 H new ATOM 0 HB2 GLU A 81 8.631 14.009 -1.096 1.00 0.00 H new ATOM 0 HB3 GLU A 81 9.476 15.069 0.014 1.00 0.00 H new ATOM 0 HG2 GLU A 81 10.284 16.364 -1.646 1.00 0.00 H new ATOM 0 HG3 GLU A 81 10.758 14.987 -2.621 1.00 0.00 H new ATOM 1186 N ASN A 82 9.679 11.584 0.702 1.00 0.00 N ATOM 1187 CA ASN A 82 9.342 10.918 1.963 1.00 0.00 C ATOM 1188 C ASN A 82 10.332 9.821 2.372 1.00 0.00 C ATOM 1189 O ASN A 82 10.640 9.683 3.556 1.00 0.00 O ATOM 1190 CB ASN A 82 7.932 10.334 1.894 1.00 0.00 C ATOM 1191 CG ASN A 82 7.737 9.415 0.705 1.00 0.00 C ATOM 1192 OD1 ASN A 82 7.116 9.789 -0.290 1.00 0.00 O ATOM 1193 ND2 ASN A 82 8.270 8.205 0.804 1.00 0.00 N ATOM 0 H ASN A 82 9.347 11.108 -0.137 1.00 0.00 H new ATOM 0 HA ASN A 82 9.399 11.690 2.730 1.00 0.00 H new ATOM 0 HB2 ASN A 82 7.726 9.783 2.812 1.00 0.00 H new ATOM 0 HB3 ASN A 82 7.208 11.147 1.842 1.00 0.00 H new ATOM 0 HD21 ASN A 82 8.174 7.541 0.036 1.00 0.00 H new ATOM 0 HD22 ASN A 82 8.777 7.938 1.648 1.00 0.00 H new ATOM 1200 N LEU A 83 10.808 9.023 1.419 1.00 0.00 N ATOM 1201 CA LEU A 83 11.729 7.930 1.753 1.00 0.00 C ATOM 1202 C LEU A 83 12.943 7.867 0.830 1.00 0.00 C ATOM 1203 O LEU A 83 13.639 6.860 0.784 1.00 0.00 O ATOM 1204 CB LEU A 83 10.983 6.588 1.752 1.00 0.00 C ATOM 1205 CG LEU A 83 10.757 5.900 0.389 1.00 0.00 C ATOM 1206 CD1 LEU A 83 10.662 6.882 -0.767 1.00 0.00 C ATOM 1207 CD2 LEU A 83 11.852 4.897 0.117 1.00 0.00 C ATOM 0 H LEU A 83 10.580 9.106 0.428 1.00 0.00 H new ATOM 0 HA LEU A 83 12.111 8.135 2.753 1.00 0.00 H new ATOM 0 HB2 LEU A 83 11.533 5.897 2.391 1.00 0.00 H new ATOM 0 HB3 LEU A 83 10.009 6.744 2.216 1.00 0.00 H new ATOM 0 HG LEU A 83 9.795 5.392 0.458 1.00 0.00 H new ATOM 0 HD11 LEU A 83 10.503 6.335 -1.697 1.00 0.00 H new ATOM 0 HD12 LEU A 83 9.827 7.562 -0.599 1.00 0.00 H new ATOM 0 HD13 LEU A 83 11.588 7.454 -0.836 1.00 0.00 H new ATOM 0 HD21 LEU A 83 11.678 4.421 -0.848 1.00 0.00 H new ATOM 0 HD22 LEU A 83 12.816 5.406 0.102 1.00 0.00 H new ATOM 0 HD23 LEU A 83 11.854 4.139 0.900 1.00 0.00 H new ATOM 1219 N LYS A 84 13.195 8.942 0.106 1.00 0.00 N ATOM 1220 CA LYS A 84 14.328 9.012 -0.817 1.00 0.00 C ATOM 1221 C LYS A 84 15.517 8.147 -0.371 1.00 0.00 C ATOM 1222 O LYS A 84 15.993 8.254 0.759 1.00 0.00 O ATOM 1223 CB LYS A 84 14.779 10.469 -0.992 1.00 0.00 C ATOM 1224 CG LYS A 84 15.378 11.088 0.264 1.00 0.00 C ATOM 1225 CD LYS A 84 14.302 11.564 1.227 1.00 0.00 C ATOM 1226 CE LYS A 84 14.910 12.163 2.485 1.00 0.00 C ATOM 1227 NZ LYS A 84 15.788 13.327 2.182 1.00 0.00 N ATOM 0 H LYS A 84 12.628 9.789 0.136 1.00 0.00 H new ATOM 0 HA LYS A 84 13.982 8.613 -1.770 1.00 0.00 H new ATOM 0 HB2 LYS A 84 15.515 10.517 -1.794 1.00 0.00 H new ATOM 0 HB3 LYS A 84 13.924 11.068 -1.307 1.00 0.00 H new ATOM 0 HG2 LYS A 84 16.014 10.356 0.762 1.00 0.00 H new ATOM 0 HG3 LYS A 84 16.015 11.928 -0.013 1.00 0.00 H new ATOM 0 HD2 LYS A 84 13.674 12.307 0.735 1.00 0.00 H new ATOM 0 HD3 LYS A 84 13.656 10.728 1.496 1.00 0.00 H new ATOM 0 HE2 LYS A 84 14.113 12.476 3.159 1.00 0.00 H new ATOM 0 HE3 LYS A 84 15.487 11.400 3.007 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 16.004 13.837 3.062 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 16.673 12.991 1.751 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 15.301 13.966 1.521 1.00 0.00 H new ATOM 1241 N GLY A 85 15.983 7.288 -1.281 1.00 0.00 N ATOM 1242 CA GLY A 85 17.112 6.409 -0.996 1.00 0.00 C ATOM 1243 C GLY A 85 17.023 5.719 0.354 1.00 0.00 C ATOM 1244 O GLY A 85 17.951 5.801 1.161 1.00 0.00 O ATOM 0 H GLY A 85 15.595 7.185 -2.219 1.00 0.00 H new ATOM 0 HA2 GLY A 85 17.178 5.652 -1.777 1.00 0.00 H new ATOM 0 HA3 GLY A 85 18.033 6.990 -1.037 1.00 0.00 H new ATOM 1248 N LYS A 86 15.910 5.041 0.603 1.00 0.00 N ATOM 1249 CA LYS A 86 15.715 4.336 1.866 1.00 0.00 C ATOM 1250 C LYS A 86 16.005 2.840 1.746 1.00 0.00 C ATOM 1251 O LYS A 86 15.122 2.058 1.394 1.00 0.00 O ATOM 1252 CB LYS A 86 14.290 4.540 2.375 1.00 0.00 C ATOM 1253 CG LYS A 86 14.203 4.758 3.878 1.00 0.00 C ATOM 1254 CD LYS A 86 12.907 4.208 4.448 1.00 0.00 C ATOM 1255 CE LYS A 86 12.757 2.724 4.156 1.00 0.00 C ATOM 1256 NZ LYS A 86 11.589 2.445 3.281 1.00 0.00 N ATOM 0 H LYS A 86 15.130 4.964 -0.050 1.00 0.00 H new ATOM 0 HA LYS A 86 16.425 4.758 2.577 1.00 0.00 H new ATOM 0 HB2 LYS A 86 13.851 5.398 1.866 1.00 0.00 H new ATOM 0 HB3 LYS A 86 13.690 3.670 2.108 1.00 0.00 H new ATOM 0 HG2 LYS A 86 15.050 4.275 4.366 1.00 0.00 H new ATOM 0 HG3 LYS A 86 14.274 5.823 4.097 1.00 0.00 H new ATOM 0 HD2 LYS A 86 12.883 4.372 5.525 1.00 0.00 H new ATOM 0 HD3 LYS A 86 12.062 4.751 4.024 1.00 0.00 H new ATOM 0 HE2 LYS A 86 13.664 2.355 3.678 1.00 0.00 H new ATOM 0 HE3 LYS A 86 12.646 2.179 5.094 1.00 0.00 H new ATOM 0 HZ1 LYS A 86 11.462 1.417 3.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 86 10.734 2.864 3.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 86 11.753 2.859 2.341 1.00 0.00 H new ATOM 1270 N ALA A 87 17.231 2.440 2.065 1.00 0.00 N ATOM 1271 CA ALA A 87 17.605 1.030 2.020 1.00 0.00 C ATOM 1272 C ALA A 87 17.070 0.324 3.261 1.00 0.00 C ATOM 1273 O ALA A 87 17.657 0.427 4.338 1.00 0.00 O ATOM 1274 CB ALA A 87 19.119 0.886 1.930 1.00 0.00 C ATOM 0 H ALA A 87 17.980 3.068 2.356 1.00 0.00 H new ATOM 0 HA ALA A 87 17.169 0.569 1.134 1.00 0.00 H new ATOM 0 HB1 ALA A 87 19.383 -0.171 1.897 1.00 0.00 H new ATOM 0 HB2 ALA A 87 19.478 1.378 1.026 1.00 0.00 H new ATOM 0 HB3 ALA A 87 19.581 1.348 2.802 1.00 0.00 H new ATOM 1280 N ALA A 88 15.930 -0.355 3.127 1.00 0.00 N ATOM 1281 CA ALA A 88 15.314 -1.017 4.273 1.00 0.00 C ATOM 1282 C ALA A 88 14.929 -2.471 4.008 1.00 0.00 C ATOM 1283 O ALA A 88 15.200 -3.035 2.950 1.00 0.00 O ATOM 1284 CB ALA A 88 14.082 -0.229 4.702 1.00 0.00 C ATOM 0 H ALA A 88 15.422 -0.459 2.249 1.00 0.00 H new ATOM 0 HA ALA A 88 16.062 -1.039 5.066 1.00 0.00 H new ATOM 0 HB1 ALA A 88 13.617 -0.718 5.558 1.00 0.00 H new ATOM 0 HB2 ALA A 88 14.376 0.784 4.978 1.00 0.00 H new ATOM 0 HB3 ALA A 88 13.371 -0.188 3.877 1.00 0.00 H new ATOM 1290 N LYS A 89 14.264 -3.042 5.005 1.00 0.00 N ATOM 1291 CA LYS A 89 13.773 -4.410 4.958 1.00 0.00 C ATOM 1292 C LYS A 89 12.298 -4.390 5.313 1.00 0.00 C ATOM 1293 O LYS A 89 11.906 -3.687 6.241 1.00 0.00 O ATOM 1294 CB LYS A 89 14.539 -5.293 5.945 1.00 0.00 C ATOM 1295 CG LYS A 89 15.812 -5.895 5.368 1.00 0.00 C ATOM 1296 CD LYS A 89 16.995 -5.704 6.306 1.00 0.00 C ATOM 1297 CE LYS A 89 17.936 -4.617 5.808 1.00 0.00 C ATOM 1298 NZ LYS A 89 19.359 -5.057 5.835 1.00 0.00 N ATOM 0 H LYS A 89 14.049 -2.561 5.878 1.00 0.00 H new ATOM 0 HA LYS A 89 13.920 -4.823 3.960 1.00 0.00 H new ATOM 0 HB2 LYS A 89 14.794 -4.702 6.825 1.00 0.00 H new ATOM 0 HB3 LYS A 89 13.886 -6.099 6.280 1.00 0.00 H new ATOM 0 HG2 LYS A 89 15.661 -6.959 5.183 1.00 0.00 H new ATOM 0 HG3 LYS A 89 16.031 -5.432 4.406 1.00 0.00 H new ATOM 0 HD2 LYS A 89 16.633 -5.445 7.301 1.00 0.00 H new ATOM 0 HD3 LYS A 89 17.541 -6.643 6.400 1.00 0.00 H new ATOM 0 HE2 LYS A 89 17.662 -4.338 4.791 1.00 0.00 H new ATOM 0 HE3 LYS A 89 17.820 -3.726 6.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 89 19.967 -4.288 5.488 1.00 0.00 H new ATOM 0 HZ2 LYS A 89 19.629 -5.299 6.810 1.00 0.00 H new ATOM 0 HZ3 LYS A 89 19.476 -5.892 5.226 1.00 0.00 H new ATOM 1312 N PHE A 90 11.487 -5.177 4.619 1.00 0.00 N ATOM 1313 CA PHE A 90 10.052 -5.241 4.919 1.00 0.00 C ATOM 1314 C PHE A 90 9.533 -6.668 4.902 1.00 0.00 C ATOM 1315 O PHE A 90 10.057 -7.519 4.186 1.00 0.00 O ATOM 1316 CB PHE A 90 9.209 -4.495 3.879 1.00 0.00 C ATOM 1317 CG PHE A 90 9.469 -3.031 3.706 1.00 0.00 C ATOM 1318 CD1 PHE A 90 10.240 -2.308 4.594 1.00 0.00 C ATOM 1319 CD2 PHE A 90 8.897 -2.380 2.634 1.00 0.00 C ATOM 1320 CE1 PHE A 90 10.440 -0.953 4.411 1.00 0.00 C ATOM 1321 CE2 PHE A 90 9.085 -1.026 2.444 1.00 0.00 C ATOM 1322 CZ PHE A 90 9.860 -0.311 3.334 1.00 0.00 C ATOM 0 H PHE A 90 11.788 -5.777 3.851 1.00 0.00 H new ATOM 0 HA PHE A 90 9.957 -4.789 5.906 1.00 0.00 H new ATOM 0 HB2 PHE A 90 9.357 -4.980 2.914 1.00 0.00 H new ATOM 0 HB3 PHE A 90 8.159 -4.622 4.142 1.00 0.00 H new ATOM 0 HD1 PHE A 90 10.691 -2.806 5.440 1.00 0.00 H new ATOM 0 HD2 PHE A 90 8.293 -2.937 1.933 1.00 0.00 H new ATOM 0 HE1 PHE A 90 11.049 -0.397 5.109 1.00 0.00 H new ATOM 0 HE2 PHE A 90 8.627 -0.528 1.602 1.00 0.00 H new ATOM 0 HZ PHE A 90 10.013 0.748 3.189 1.00 0.00 H new ATOM 1332 N ALA A 91 8.447 -6.904 5.627 1.00 0.00 N ATOM 1333 CA ALA A 91 7.787 -8.193 5.637 1.00 0.00 C ATOM 1334 C ALA A 91 6.348 -7.898 5.249 1.00 0.00 C ATOM 1335 O ALA A 91 5.592 -7.305 6.016 1.00 0.00 O ATOM 1336 CB ALA A 91 7.872 -8.849 7.008 1.00 0.00 C ATOM 0 H ALA A 91 8.003 -6.205 6.222 1.00 0.00 H new ATOM 0 HA ALA A 91 8.256 -8.897 4.949 1.00 0.00 H new ATOM 0 HB1 ALA A 91 7.367 -9.815 6.981 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.918 -8.994 7.278 1.00 0.00 H new ATOM 0 HB3 ALA A 91 7.392 -8.209 7.748 1.00 0.00 H new ATOM 1342 N ILE A 92 6.028 -8.209 4.002 1.00 0.00 N ATOM 1343 CA ILE A 92 4.732 -7.861 3.435 1.00 0.00 C ATOM 1344 C ILE A 92 3.729 -9.006 3.339 1.00 0.00 C ATOM 1345 O ILE A 92 4.073 -10.183 3.405 1.00 0.00 O ATOM 1346 CB ILE A 92 4.945 -7.293 2.017 1.00 0.00 C ATOM 1347 CG1 ILE A 92 6.103 -6.283 2.017 1.00 0.00 C ATOM 1348 CG2 ILE A 92 3.664 -6.680 1.485 1.00 0.00 C ATOM 1349 CD1 ILE A 92 6.144 -5.372 0.810 1.00 0.00 C ATOM 0 H ILE A 92 6.649 -8.703 3.361 1.00 0.00 H new ATOM 0 HA ILE A 92 4.301 -7.137 4.126 1.00 0.00 H new ATOM 0 HB ILE A 92 5.215 -8.110 1.347 1.00 0.00 H new ATOM 0 HG12 ILE A 92 6.033 -5.670 2.916 1.00 0.00 H new ATOM 0 HG13 ILE A 92 7.044 -6.829 2.076 1.00 0.00 H new ATOM 0 HG21 ILE A 92 3.838 -6.286 0.484 1.00 0.00 H new ATOM 0 HG22 ILE A 92 2.885 -7.442 1.445 1.00 0.00 H new ATOM 0 HG23 ILE A 92 3.347 -5.871 2.143 1.00 0.00 H new ATOM 0 HD11 ILE A 92 6.993 -4.693 0.895 1.00 0.00 H new ATOM 0 HD12 ILE A 92 6.248 -5.971 -0.095 1.00 0.00 H new ATOM 0 HD13 ILE A 92 5.221 -4.794 0.759 1.00 0.00 H new ATOM 1361 N ASN A 93 2.473 -8.608 3.136 1.00 0.00 N ATOM 1362 CA ASN A 93 1.363 -9.532 2.967 1.00 0.00 C ATOM 1363 C ASN A 93 0.485 -9.063 1.803 1.00 0.00 C ATOM 1364 O ASN A 93 -0.260 -8.092 1.935 1.00 0.00 O ATOM 1365 CB ASN A 93 0.531 -9.629 4.246 1.00 0.00 C ATOM 1366 CG ASN A 93 1.347 -10.080 5.442 1.00 0.00 C ATOM 1367 OD1 ASN A 93 2.430 -10.648 5.292 1.00 0.00 O ATOM 1368 ND2 ASN A 93 0.826 -9.832 6.637 1.00 0.00 N ATOM 0 H ASN A 93 2.200 -7.626 3.085 1.00 0.00 H new ATOM 0 HA ASN A 93 1.762 -10.523 2.750 1.00 0.00 H new ATOM 0 HB2 ASN A 93 0.087 -8.657 4.460 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -0.291 -10.327 4.088 1.00 0.00 H new ATOM 0 HD21 ASN A 93 1.326 -10.115 7.480 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -0.074 -9.359 6.713 1.00 0.00 H new ATOM 1375 N LEU A 94 0.592 -9.737 0.662 1.00 0.00 N ATOM 1376 CA LEU A 94 -0.180 -9.364 -0.525 1.00 0.00 C ATOM 1377 C LEU A 94 -1.674 -9.553 -0.321 1.00 0.00 C ATOM 1378 O LEU A 94 -2.102 -10.350 0.512 1.00 0.00 O ATOM 1379 CB LEU A 94 0.277 -10.175 -1.736 1.00 0.00 C ATOM 1380 CG LEU A 94 -0.014 -9.531 -3.092 1.00 0.00 C ATOM 1381 CD1 LEU A 94 0.743 -8.220 -3.228 1.00 0.00 C ATOM 1382 CD2 LEU A 94 0.350 -10.482 -4.221 1.00 0.00 C ATOM 0 H LEU A 94 1.203 -10.543 0.531 1.00 0.00 H new ATOM 0 HA LEU A 94 0.002 -8.304 -0.702 1.00 0.00 H new ATOM 0 HB2 LEU A 94 1.350 -10.347 -1.655 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -0.206 -11.152 -1.703 1.00 0.00 H new ATOM 0 HG LEU A 94 -1.081 -9.319 -3.155 1.00 0.00 H new ATOM 0 HD11 LEU A 94 0.526 -7.773 -4.198 1.00 0.00 H new ATOM 0 HD12 LEU A 94 0.433 -7.537 -2.437 1.00 0.00 H new ATOM 0 HD13 LEU A 94 1.814 -8.408 -3.147 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.137 -10.008 -5.179 1.00 0.00 H new ATOM 0 HD22 LEU A 94 1.411 -10.725 -4.165 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -0.236 -11.396 -4.130 1.00 0.00 H new ATOM 1394 N LYS A 95 -2.465 -8.819 -1.103 1.00 0.00 N ATOM 1395 CA LYS A 95 -3.912 -8.910 -1.022 1.00 0.00 C ATOM 1396 C LYS A 95 -4.563 -8.589 -2.374 1.00 0.00 C ATOM 1397 O LYS A 95 -4.583 -9.428 -3.271 1.00 0.00 O ATOM 1398 CB LYS A 95 -4.449 -7.988 0.081 1.00 0.00 C ATOM 1399 CG LYS A 95 -4.377 -8.595 1.473 1.00 0.00 C ATOM 1400 CD LYS A 95 -5.571 -8.186 2.323 1.00 0.00 C ATOM 1401 CE LYS A 95 -5.178 -7.185 3.397 1.00 0.00 C ATOM 1402 NZ LYS A 95 -4.312 -7.797 4.444 1.00 0.00 N ATOM 0 H LYS A 95 -2.122 -8.156 -1.798 1.00 0.00 H new ATOM 0 HA LYS A 95 -4.174 -9.937 -0.765 1.00 0.00 H new ATOM 0 HB2 LYS A 95 -3.884 -7.056 0.071 1.00 0.00 H new ATOM 0 HB3 LYS A 95 -5.485 -7.734 -0.142 1.00 0.00 H new ATOM 0 HG2 LYS A 95 -4.340 -9.682 1.396 1.00 0.00 H new ATOM 0 HG3 LYS A 95 -3.456 -8.278 1.962 1.00 0.00 H new ATOM 0 HD2 LYS A 95 -6.341 -7.752 1.685 1.00 0.00 H new ATOM 0 HD3 LYS A 95 -6.005 -9.070 2.790 1.00 0.00 H new ATOM 0 HE2 LYS A 95 -4.653 -6.348 2.937 1.00 0.00 H new ATOM 0 HE3 LYS A 95 -6.077 -6.781 3.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 95 -4.330 -7.205 5.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 95 -4.665 -8.748 4.674 1.00 0.00 H new ATOM 0 HZ3 LYS A 95 -3.336 -7.866 4.091 1.00 0.00 H new ATOM 1416 N LYS A 96 -5.143 -7.400 -2.498 1.00 0.00 N ATOM 1417 CA LYS A 96 -5.838 -7.029 -3.723 1.00 0.00 C ATOM 1418 C LYS A 96 -4.889 -6.654 -4.855 1.00 0.00 C ATOM 1419 O LYS A 96 -4.354 -5.546 -4.893 1.00 0.00 O ATOM 1420 CB LYS A 96 -6.791 -5.867 -3.451 1.00 0.00 C ATOM 1421 CG LYS A 96 -7.787 -6.148 -2.337 1.00 0.00 C ATOM 1422 CD LYS A 96 -8.974 -5.201 -2.397 1.00 0.00 C ATOM 1423 CE LYS A 96 -10.288 -5.962 -2.436 1.00 0.00 C ATOM 1424 NZ LYS A 96 -11.415 -5.156 -1.886 1.00 0.00 N ATOM 0 H LYS A 96 -5.146 -6.683 -1.772 1.00 0.00 H new ATOM 0 HA LYS A 96 -6.395 -7.909 -4.046 1.00 0.00 H new ATOM 0 HB2 LYS A 96 -6.209 -4.983 -3.192 1.00 0.00 H new ATOM 0 HB3 LYS A 96 -7.337 -5.633 -4.365 1.00 0.00 H new ATOM 0 HG2 LYS A 96 -8.138 -7.177 -2.413 1.00 0.00 H new ATOM 0 HG3 LYS A 96 -7.291 -6.050 -1.371 1.00 0.00 H new ATOM 0 HD2 LYS A 96 -8.959 -4.541 -1.529 1.00 0.00 H new ATOM 0 HD3 LYS A 96 -8.892 -4.568 -3.280 1.00 0.00 H new ATOM 0 HE2 LYS A 96 -10.513 -6.246 -3.464 1.00 0.00 H new ATOM 0 HE3 LYS A 96 -10.190 -6.885 -1.865 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 -12.293 -5.711 -1.931 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 -11.213 -4.907 -0.897 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 -11.526 -4.287 -2.446 1.00 0.00 H new ATOM 1438 N VAL A 97 -4.720 -7.579 -5.796 1.00 0.00 N ATOM 1439 CA VAL A 97 -3.881 -7.365 -6.964 1.00 0.00 C ATOM 1440 C VAL A 97 -4.762 -7.300 -8.216 1.00 0.00 C ATOM 1441 O VAL A 97 -5.345 -8.306 -8.620 1.00 0.00 O ATOM 1442 CB VAL A 97 -2.844 -8.502 -7.115 1.00 0.00 C ATOM 1443 CG1 VAL A 97 -3.493 -9.864 -6.881 1.00 0.00 C ATOM 1444 CG2 VAL A 97 -2.170 -8.454 -8.481 1.00 0.00 C ATOM 0 H VAL A 97 -5.163 -8.498 -5.767 1.00 0.00 H new ATOM 0 HA VAL A 97 -3.343 -6.425 -6.839 1.00 0.00 H new ATOM 0 HB VAL A 97 -2.076 -8.355 -6.356 1.00 0.00 H new ATOM 0 HG11 VAL A 97 -2.744 -10.648 -6.993 1.00 0.00 H new ATOM 0 HG12 VAL A 97 -3.909 -9.901 -5.874 1.00 0.00 H new ATOM 0 HG13 VAL A 97 -4.290 -10.017 -7.609 1.00 0.00 H new ATOM 0 HG21 VAL A 97 -1.446 -9.265 -8.558 1.00 0.00 H new ATOM 0 HG22 VAL A 97 -2.922 -8.564 -9.262 1.00 0.00 H new ATOM 0 HG23 VAL A 97 -1.659 -7.499 -8.601 1.00 0.00 H new ATOM 1454 N GLU A 98 -4.880 -6.115 -8.811 1.00 0.00 N ATOM 1455 CA GLU A 98 -5.719 -5.941 -9.997 1.00 0.00 C ATOM 1456 C GLU A 98 -4.946 -5.283 -11.143 1.00 0.00 C ATOM 1457 O GLU A 98 -3.728 -5.153 -11.076 1.00 0.00 O ATOM 1458 CB GLU A 98 -6.946 -5.104 -9.635 1.00 0.00 C ATOM 1459 CG GLU A 98 -7.750 -5.674 -8.479 1.00 0.00 C ATOM 1460 CD GLU A 98 -8.760 -4.684 -7.929 1.00 0.00 C ATOM 1461 OE1 GLU A 98 -9.866 -4.585 -8.500 1.00 0.00 O ATOM 1462 OE2 GLU A 98 -8.443 -4.007 -6.929 1.00 0.00 O ATOM 0 H GLU A 98 -4.410 -5.267 -8.495 1.00 0.00 H new ATOM 0 HA GLU A 98 -6.035 -6.926 -10.340 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -6.625 -4.094 -9.380 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -7.591 -5.022 -10.510 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -8.270 -6.572 -8.811 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -7.070 -5.975 -7.682 1.00 0.00 H new ATOM 1469 N GLU A 99 -5.661 -4.877 -12.201 1.00 0.00 N ATOM 1470 CA GLU A 99 -5.022 -4.243 -13.360 1.00 0.00 C ATOM 1471 C GLU A 99 -5.456 -2.793 -13.533 1.00 0.00 C ATOM 1472 O GLU A 99 -6.423 -2.509 -14.237 1.00 0.00 O ATOM 1473 CB GLU A 99 -5.334 -5.014 -14.639 1.00 0.00 C ATOM 1474 CG GLU A 99 -4.355 -4.749 -15.770 1.00 0.00 C ATOM 1475 CD GLU A 99 -4.600 -3.420 -16.456 1.00 0.00 C ATOM 1476 OE1 GLU A 99 -5.752 -3.168 -16.867 1.00 0.00 O ATOM 1477 OE2 GLU A 99 -3.641 -2.629 -16.581 1.00 0.00 O ATOM 0 H GLU A 99 -6.673 -4.975 -12.278 1.00 0.00 H new ATOM 0 HA GLU A 99 -3.948 -4.260 -13.172 1.00 0.00 H new ATOM 0 HB2 GLU A 99 -5.338 -6.081 -14.417 1.00 0.00 H new ATOM 0 HB3 GLU A 99 -6.339 -4.754 -14.973 1.00 0.00 H new ATOM 0 HG2 GLU A 99 -3.338 -4.769 -15.377 1.00 0.00 H new ATOM 0 HG3 GLU A 99 -4.429 -5.551 -16.504 1.00 0.00 H new ATOM 1484 N ARG A 100 -4.722 -1.877 -12.913 1.00 0.00 N ATOM 1485 CA ARG A 100 -5.033 -0.455 -13.021 1.00 0.00 C ATOM 1486 C ARG A 100 -4.755 0.064 -14.427 1.00 0.00 C ATOM 1487 O ARG A 100 -3.944 -0.502 -15.162 1.00 0.00 O ATOM 1488 CB ARG A 100 -4.211 0.348 -12.012 1.00 0.00 C ATOM 1489 CG ARG A 100 -2.713 0.169 -12.181 1.00 0.00 C ATOM 1490 CD ARG A 100 -1.967 1.481 -11.986 1.00 0.00 C ATOM 1491 NE ARG A 100 -0.579 1.388 -12.438 1.00 0.00 N ATOM 1492 CZ ARG A 100 -0.039 2.166 -13.375 1.00 0.00 C ATOM 1493 NH1 ARG A 100 -0.760 3.108 -13.973 1.00 0.00 N ATOM 1494 NH2 ARG A 100 1.230 2.000 -13.717 1.00 0.00 N ATOM 0 H ARG A 100 -3.911 -2.091 -12.333 1.00 0.00 H new ATOM 0 HA ARG A 100 -6.094 -0.331 -12.806 1.00 0.00 H new ATOM 0 HB2 ARG A 100 -4.457 1.405 -12.112 1.00 0.00 H new ATOM 0 HB3 ARG A 100 -4.494 0.049 -11.003 1.00 0.00 H new ATOM 0 HG2 ARG A 100 -2.351 -0.567 -11.463 1.00 0.00 H new ATOM 0 HG3 ARG A 100 -2.503 -0.226 -13.175 1.00 0.00 H new ATOM 0 HD2 ARG A 100 -2.476 2.274 -12.535 1.00 0.00 H new ATOM 0 HD3 ARG A 100 -1.988 1.758 -10.932 1.00 0.00 H new ATOM 0 HE ARG A 100 0.015 0.680 -12.007 1.00 0.00 H new ATOM 0 HH11 ARG A 100 -1.738 3.242 -13.716 1.00 0.00 H new ATOM 0 HH12 ARG A 100 -0.336 3.698 -14.689 1.00 0.00 H new ATOM 0 HH21 ARG A 100 1.790 1.278 -13.263 1.00 0.00 H new ATOM 0 HH22 ARG A 100 1.647 2.594 -14.434 1.00 0.00 H new ATOM 1508 N GLU A 101 -5.424 1.153 -14.789 1.00 0.00 N ATOM 1509 CA GLU A 101 -5.247 1.767 -16.097 1.00 0.00 C ATOM 1510 C GLU A 101 -5.694 3.224 -16.062 1.00 0.00 C ATOM 1511 O GLU A 101 -6.644 3.615 -16.741 1.00 0.00 O ATOM 1512 CB GLU A 101 -6.028 1.003 -17.169 1.00 0.00 C ATOM 1513 CG GLU A 101 -5.565 1.310 -18.585 1.00 0.00 C ATOM 1514 CD GLU A 101 -5.297 0.058 -19.400 1.00 0.00 C ATOM 1515 OE1 GLU A 101 -4.190 -0.507 -19.274 1.00 0.00 O ATOM 1516 OE2 GLU A 101 -6.193 -0.356 -20.166 1.00 0.00 O ATOM 0 H GLU A 101 -6.098 1.630 -14.190 1.00 0.00 H new ATOM 0 HA GLU A 101 -4.188 1.727 -16.350 1.00 0.00 H new ATOM 0 HB2 GLU A 101 -5.930 -0.067 -16.986 1.00 0.00 H new ATOM 0 HB3 GLU A 101 -7.087 1.246 -17.080 1.00 0.00 H new ATOM 0 HG2 GLU A 101 -6.323 1.910 -19.088 1.00 0.00 H new ATOM 0 HG3 GLU A 101 -4.657 1.912 -18.543 1.00 0.00 H new ATOM 1523 N LEU A 102 -5.004 4.022 -15.256 1.00 0.00 N ATOM 1524 CA LEU A 102 -5.323 5.435 -15.113 1.00 0.00 C ATOM 1525 C LEU A 102 -4.870 6.229 -16.338 1.00 0.00 C ATOM 1526 O LEU A 102 -3.673 6.385 -16.574 1.00 0.00 O ATOM 1527 CB LEU A 102 -4.659 5.996 -13.850 1.00 0.00 C ATOM 1528 CG LEU A 102 -5.331 5.603 -12.531 1.00 0.00 C ATOM 1529 CD1 LEU A 102 -5.619 4.110 -12.496 1.00 0.00 C ATOM 1530 CD2 LEU A 102 -4.457 6.002 -11.351 1.00 0.00 C ATOM 0 H LEU A 102 -4.215 3.711 -14.689 1.00 0.00 H new ATOM 0 HA LEU A 102 -6.405 5.532 -15.026 1.00 0.00 H new ATOM 0 HB2 LEU A 102 -3.622 5.661 -13.825 1.00 0.00 H new ATOM 0 HB3 LEU A 102 -4.641 7.084 -13.920 1.00 0.00 H new ATOM 0 HG LEU A 102 -6.279 6.136 -12.459 1.00 0.00 H new ATOM 0 HD11 LEU A 102 -6.096 3.854 -11.550 1.00 0.00 H new ATOM 0 HD12 LEU A 102 -6.283 3.848 -13.320 1.00 0.00 H new ATOM 0 HD13 LEU A 102 -4.685 3.557 -12.593 1.00 0.00 H new ATOM 0 HD21 LEU A 102 -4.948 5.716 -10.421 1.00 0.00 H new ATOM 0 HD22 LEU A 102 -3.495 5.496 -11.423 1.00 0.00 H new ATOM 0 HD23 LEU A 102 -4.301 7.081 -11.362 1.00 0.00 H new ATOM 1542 N PRO A 103 -5.823 6.747 -17.142 1.00 0.00 N ATOM 1543 CA PRO A 103 -5.499 7.524 -18.341 1.00 0.00 C ATOM 1544 C PRO A 103 -4.977 8.916 -18.005 1.00 0.00 C ATOM 1545 O PRO A 103 -5.747 9.815 -17.668 1.00 0.00 O ATOM 1546 CB PRO A 103 -6.838 7.619 -19.074 1.00 0.00 C ATOM 1547 CG PRO A 103 -7.864 7.521 -17.999 1.00 0.00 C ATOM 1548 CD PRO A 103 -7.281 6.618 -16.945 1.00 0.00 C ATOM 0 HA PRO A 103 -4.708 7.057 -18.928 1.00 0.00 H new ATOM 0 HB2 PRO A 103 -6.925 8.558 -19.620 1.00 0.00 H new ATOM 0 HB3 PRO A 103 -6.949 6.815 -19.802 1.00 0.00 H new ATOM 0 HG2 PRO A 103 -8.092 8.504 -17.587 1.00 0.00 H new ATOM 0 HG3 PRO A 103 -8.798 7.114 -18.388 1.00 0.00 H new ATOM 0 HD2 PRO A 103 -7.579 6.927 -15.943 1.00 0.00 H new ATOM 0 HD3 PRO A 103 -7.613 5.588 -17.072 1.00 0.00 H new ATOM 1556 N GLU A 104 -3.663 9.086 -18.101 1.00 0.00 N ATOM 1557 CA GLU A 104 -3.036 10.369 -17.808 1.00 0.00 C ATOM 1558 C GLU A 104 -3.115 11.298 -19.015 1.00 0.00 C ATOM 1559 O GLU A 104 -2.468 11.064 -20.036 1.00 0.00 O ATOM 1560 CB GLU A 104 -1.577 10.164 -17.396 1.00 0.00 C ATOM 1561 CG GLU A 104 -1.309 10.484 -15.934 1.00 0.00 C ATOM 1562 CD GLU A 104 -0.665 11.843 -15.744 1.00 0.00 C ATOM 1563 OE1 GLU A 104 -0.997 12.770 -16.513 1.00 0.00 O ATOM 1564 OE2 GLU A 104 0.172 11.981 -14.827 1.00 0.00 O ATOM 0 H GLU A 104 -3.012 8.352 -18.379 1.00 0.00 H new ATOM 0 HA GLU A 104 -3.575 10.832 -16.982 1.00 0.00 H new ATOM 0 HB2 GLU A 104 -1.295 9.129 -17.591 1.00 0.00 H new ATOM 0 HB3 GLU A 104 -0.940 10.791 -18.020 1.00 0.00 H new ATOM 0 HG2 GLU A 104 -2.247 10.450 -15.380 1.00 0.00 H new ATOM 0 HG3 GLU A 104 -0.661 9.716 -15.511 1.00 0.00 H new ATOM 1571 N LEU A 105 -3.914 12.354 -18.893 1.00 0.00 N ATOM 1572 CA LEU A 105 -4.079 13.317 -19.974 1.00 0.00 C ATOM 1573 C LEU A 105 -3.027 14.419 -19.887 1.00 0.00 C ATOM 1574 O LEU A 105 -3.090 15.283 -19.012 1.00 0.00 O ATOM 1575 CB LEU A 105 -5.485 13.926 -19.930 1.00 0.00 C ATOM 1576 CG LEU A 105 -6.354 13.635 -21.154 1.00 0.00 C ATOM 1577 CD1 LEU A 105 -7.810 13.965 -20.864 1.00 0.00 C ATOM 1578 CD2 LEU A 105 -5.857 14.421 -22.358 1.00 0.00 C ATOM 0 H LEU A 105 -4.457 12.564 -18.055 1.00 0.00 H new ATOM 0 HA LEU A 105 -3.948 12.793 -20.921 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -5.998 13.555 -19.043 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -5.393 15.006 -19.817 1.00 0.00 H new ATOM 0 HG LEU A 105 -6.282 12.572 -21.384 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -8.414 13.752 -21.746 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -8.161 13.359 -20.029 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -7.900 15.021 -20.609 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -6.487 14.202 -23.220 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -5.900 15.488 -22.139 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -4.828 14.137 -22.579 1.00 0.00 H new ATOM 1590 N THR A 106 -2.062 14.382 -20.801 1.00 0.00 N ATOM 1591 CA THR A 106 -0.995 15.378 -20.826 1.00 0.00 C ATOM 1592 C THR A 106 -1.281 16.455 -21.870 1.00 0.00 C ATOM 1593 O THR A 106 -0.450 17.376 -22.009 1.00 0.00 O ATOM 1594 CB THR A 106 0.348 14.710 -21.120 1.00 0.00 C ATOM 1595 OG1 THR A 106 0.385 14.226 -22.451 1.00 0.00 O ATOM 1596 CG2 THR A 106 0.653 13.548 -20.200 1.00 0.00 C ATOM 1597 OXT THR A 106 -2.331 16.365 -22.539 1.00 0.00 O ATOM 0 H THR A 106 -1.997 13.675 -21.533 1.00 0.00 H new ATOM 0 HA THR A 106 -0.950 15.851 -19.845 1.00 0.00 H new ATOM 0 HB THR A 106 1.098 15.485 -20.960 1.00 0.00 H new ATOM 0 HG1 THR A 106 1.253 13.803 -22.621 1.00 0.00 H new ATOM 0 HG21 THR A 106 1.620 13.120 -20.463 1.00 0.00 H new ATOM 0 HG22 THR A 106 0.680 13.898 -19.168 1.00 0.00 H new ATOM 0 HG23 THR A 106 -0.121 12.788 -20.305 1.00 0.00 H new TER 1605 THR A 106