USER MOD reduce.3.24.130724 H: found=0, std=0, add=525, rem=0, adj=24 USER MOD reduce.3.24.130724 removed 523 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 44 SER OG : rot 150:sc= 0.168 USER MOD Set 1.2: A 47 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 12 CYS SG : rot 180:sc= 0.326 USER MOD Set 2.2: A 15 CYS SG : rot 123:sc= -1.78! USER MOD Single : A 1 MET CE :methyl 134:sc=-0.00303 (180deg=-0.0546) USER MOD Single : A 1 MET N :NH3+ -142:sc= -0.612 (180deg=-2.43!) USER MOD Single : A 3 LYS NZ :NH3+ -148:sc= -0.952 (180deg=-3.49!) USER MOD Single : A 4 HIS : no HD1:sc= -3.72 K(o=-3.7,f=-6!) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 10 MET CE :methyl -152:sc= -0.183 (180deg=-1.41!) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 20 SER OG : rot -170:sc= 0 USER MOD Single : A 24 ASN :FLIP amide:sc= -1.1! C(o=-4.9!,f=-1.1!) USER MOD Single : A 25 LYS NZ :NH3+ 161:sc= -0.514 (180deg=-1.43!) USER MOD Single : A 30 LYS NZ :NH3+ 155:sc= -0.0115 (180deg=-0.532) USER MOD Single : A 31 TYR OH : rot 180:sc= 0 USER MOD Single : A 37 ASN :FLIP amide:sc= -0.183 F(o=-0.8,f=-0.18) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 CYS SG : rot 180:sc= 0 USER MOD Single : A 46 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 48 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -160:sc= -0.365 USER MOD Single : A 54 THR OG1 : rot 80:sc= -1.38 USER MOD Single : A 56 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 57 LYS NZ :NH3+ 156:sc= -0.0367 (180deg=-0.371) USER MOD Single : A 58 THR OG1 : rot 150:sc= -2.22! USER MOD Single : A 61 THR OG1 : rot 180:sc= 0.138 USER MOD Single : A 63 SER OG : rot 180:sc= 0 USER MOD Single : A 64 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -16.407 -19.752 -23.008 1.00 0.00 N ATOM 2 CA MET A 1 -15.817 -18.472 -22.526 1.00 0.00 C ATOM 3 C MET A 1 -16.579 -17.300 -23.136 1.00 0.00 C ATOM 4 O MET A 1 -16.219 -16.799 -24.202 1.00 0.00 O ATOM 5 CB MET A 1 -14.345 -18.410 -22.935 1.00 0.00 C ATOM 6 CG MET A 1 -13.629 -19.675 -22.460 1.00 0.00 C ATOM 7 SD MET A 1 -12.833 -19.356 -20.866 1.00 0.00 S ATOM 8 CE MET A 1 -11.362 -18.525 -21.511 1.00 0.00 C ATOM 0 H1 MET A 1 -16.406 -20.447 -22.235 1.00 0.00 H new ATOM 0 H2 MET A 1 -17.384 -19.587 -23.324 1.00 0.00 H new ATOM 0 H3 MET A 1 -15.843 -20.117 -23.802 1.00 0.00 H new ATOM 0 HA MET A 1 -15.890 -18.417 -21.440 1.00 0.00 H new ATOM 0 HB2 MET A 1 -14.261 -18.317 -24.018 1.00 0.00 H new ATOM 0 HB3 MET A 1 -13.873 -17.528 -22.502 1.00 0.00 H new ATOM 0 HG2 MET A 1 -14.341 -20.495 -22.365 1.00 0.00 H new ATOM 0 HG3 MET A 1 -12.885 -19.982 -23.195 1.00 0.00 H new ATOM 0 HE1 MET A 1 -11.171 -17.622 -20.932 1.00 0.00 H new ATOM 0 HE2 MET A 1 -10.504 -19.193 -21.435 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.523 -18.259 -22.556 1.00 0.00 H new ATOM 20 N PRO A 2 -17.619 -16.860 -22.481 1.00 0.00 N ATOM 21 CA PRO A 2 -18.454 -15.720 -22.960 1.00 0.00 C ATOM 22 C PRO A 2 -17.659 -14.418 -23.019 1.00 0.00 C ATOM 23 O PRO A 2 -16.853 -14.133 -22.134 1.00 0.00 O ATOM 24 CB PRO A 2 -19.587 -15.618 -21.928 1.00 0.00 C ATOM 25 CG PRO A 2 -19.546 -16.887 -21.137 1.00 0.00 C ATOM 26 CD PRO A 2 -18.112 -17.404 -21.212 1.00 0.00 C ATOM 0 HA PRO A 2 -18.818 -15.885 -23.974 1.00 0.00 H new ATOM 0 HB2 PRO A 2 -19.448 -14.752 -21.281 1.00 0.00 H new ATOM 0 HB3 PRO A 2 -20.552 -15.497 -22.420 1.00 0.00 H new ATOM 0 HG2 PRO A 2 -19.839 -16.708 -20.103 1.00 0.00 H new ATOM 0 HG3 PRO A 2 -20.243 -17.619 -21.544 1.00 0.00 H new ATOM 0 HD2 PRO A 2 -17.516 -17.058 -20.368 1.00 0.00 H new ATOM 0 HD3 PRO A 2 -18.077 -18.493 -21.201 1.00 0.00 H new ATOM 34 N LYS A 3 -17.893 -13.632 -24.065 1.00 0.00 N ATOM 35 CA LYS A 3 -17.189 -12.366 -24.223 1.00 0.00 C ATOM 36 C LYS A 3 -18.152 -11.192 -24.071 1.00 0.00 C ATOM 37 O LYS A 3 -19.195 -11.143 -24.725 1.00 0.00 O ATOM 38 CB LYS A 3 -16.515 -12.306 -25.595 1.00 0.00 C ATOM 39 CG LYS A 3 -15.098 -12.873 -25.490 1.00 0.00 C ATOM 40 CD LYS A 3 -14.508 -13.050 -26.893 1.00 0.00 C ATOM 41 CE LYS A 3 -14.079 -14.506 -27.090 1.00 0.00 C ATOM 42 NZ LYS A 3 -13.399 -14.993 -25.856 1.00 0.00 N ATOM 0 H LYS A 3 -18.558 -13.847 -24.808 1.00 0.00 H new ATOM 0 HA LYS A 3 -16.428 -12.298 -23.445 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -17.094 -12.876 -26.322 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -16.481 -11.276 -25.951 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -14.470 -12.203 -24.903 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -15.117 -13.830 -24.969 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -15.245 -12.773 -27.646 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -13.653 -12.387 -27.025 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -14.948 -15.126 -27.308 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -13.407 -14.586 -27.945 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -12.670 -15.689 -26.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -12.954 -14.191 -25.365 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -14.098 -15.439 -25.228 1.00 0.00 H new ATOM 56 N HIS A 4 -17.794 -10.252 -23.202 1.00 0.00 N ATOM 57 CA HIS A 4 -18.629 -9.081 -22.964 1.00 0.00 C ATOM 58 C HIS A 4 -17.888 -7.810 -23.372 1.00 0.00 C ATOM 59 O HIS A 4 -16.744 -7.595 -22.975 1.00 0.00 O ATOM 60 CB HIS A 4 -19.000 -9.005 -21.481 1.00 0.00 C ATOM 61 CG HIS A 4 -20.422 -8.537 -21.338 1.00 0.00 C ATOM 62 ND1 HIS A 4 -21.497 -9.405 -21.434 1.00 0.00 N ATOM 63 CD2 HIS A 4 -20.961 -7.296 -21.106 1.00 0.00 C ATOM 64 CE1 HIS A 4 -22.619 -8.681 -21.264 1.00 0.00 C ATOM 65 NE2 HIS A 4 -22.349 -7.389 -21.060 1.00 0.00 N ATOM 0 H HIS A 4 -16.935 -10.278 -22.653 1.00 0.00 H new ATOM 0 HA HIS A 4 -19.536 -9.169 -23.562 1.00 0.00 H new ATOM 0 HB2 HIS A 4 -18.880 -9.983 -21.016 1.00 0.00 H new ATOM 0 HB3 HIS A 4 -18.328 -8.321 -20.963 1.00 0.00 H new ATOM 0 HD2 HIS A 4 -20.394 -6.386 -20.979 1.00 0.00 H new ATOM 0 HE1 HIS A 4 -23.616 -9.095 -21.289 1.00 0.00 H new ATOM 0 HE2 HIS A 4 -23.016 -6.633 -20.904 1.00 0.00 H new ATOM 73 N GLU A 5 -18.545 -6.970 -24.168 1.00 0.00 N ATOM 74 CA GLU A 5 -17.927 -5.727 -24.619 1.00 0.00 C ATOM 75 C GLU A 5 -18.664 -4.523 -24.044 1.00 0.00 C ATOM 76 O GLU A 5 -19.886 -4.421 -24.153 1.00 0.00 O ATOM 77 CB GLU A 5 -17.948 -5.660 -26.149 1.00 0.00 C ATOM 78 CG GLU A 5 -16.515 -5.683 -26.686 1.00 0.00 C ATOM 79 CD GLU A 5 -15.815 -4.367 -26.362 1.00 0.00 C ATOM 80 OE1 GLU A 5 -16.200 -3.738 -25.389 1.00 0.00 O ATOM 81 OE2 GLU A 5 -14.904 -4.007 -27.089 1.00 0.00 O ATOM 0 H GLU A 5 -19.493 -7.125 -24.510 1.00 0.00 H new ATOM 0 HA GLU A 5 -16.895 -5.707 -24.268 1.00 0.00 H new ATOM 0 HB2 GLU A 5 -18.511 -6.502 -26.552 1.00 0.00 H new ATOM 0 HB3 GLU A 5 -18.455 -4.752 -26.476 1.00 0.00 H new ATOM 0 HG2 GLU A 5 -15.966 -6.515 -26.245 1.00 0.00 H new ATOM 0 HG3 GLU A 5 -16.524 -5.844 -27.764 1.00 0.00 H new ATOM 88 N PHE A 6 -17.911 -3.609 -23.437 1.00 0.00 N ATOM 89 CA PHE A 6 -18.504 -2.413 -22.849 1.00 0.00 C ATOM 90 C PHE A 6 -17.835 -1.158 -23.405 1.00 0.00 C ATOM 91 O PHE A 6 -16.617 -1.115 -23.575 1.00 0.00 O ATOM 92 CB PHE A 6 -18.344 -2.450 -21.326 1.00 0.00 C ATOM 93 CG PHE A 6 -19.668 -2.792 -20.684 1.00 0.00 C ATOM 94 CD1 PHE A 6 -20.410 -3.881 -21.152 1.00 0.00 C ATOM 95 CD2 PHE A 6 -20.152 -2.019 -19.621 1.00 0.00 C ATOM 96 CE1 PHE A 6 -21.637 -4.200 -20.557 1.00 0.00 C ATOM 97 CE2 PHE A 6 -21.379 -2.338 -19.026 1.00 0.00 C ATOM 98 CZ PHE A 6 -22.121 -3.429 -19.494 1.00 0.00 C ATOM 0 H PHE A 6 -16.898 -3.673 -23.340 1.00 0.00 H new ATOM 0 HA PHE A 6 -19.564 -2.388 -23.103 1.00 0.00 H new ATOM 0 HB2 PHE A 6 -17.592 -3.188 -21.047 1.00 0.00 H new ATOM 0 HB3 PHE A 6 -17.992 -1.484 -20.964 1.00 0.00 H new ATOM 0 HD1 PHE A 6 -20.037 -4.476 -21.972 1.00 0.00 H new ATOM 0 HD2 PHE A 6 -19.579 -1.177 -19.260 1.00 0.00 H new ATOM 0 HE1 PHE A 6 -22.210 -5.041 -20.919 1.00 0.00 H new ATOM 0 HE2 PHE A 6 -21.753 -1.742 -18.206 1.00 0.00 H new ATOM 0 HZ PHE A 6 -23.067 -3.676 -19.035 1.00 0.00 H new ATOM 108 N SER A 7 -18.641 -0.137 -23.682 1.00 0.00 N ATOM 109 CA SER A 7 -18.119 1.118 -24.215 1.00 0.00 C ATOM 110 C SER A 7 -18.299 2.242 -23.202 1.00 0.00 C ATOM 111 O SER A 7 -19.423 2.589 -22.838 1.00 0.00 O ATOM 112 CB SER A 7 -18.840 1.479 -25.514 1.00 0.00 C ATOM 113 OG SER A 7 -18.625 2.856 -25.802 1.00 0.00 O ATOM 0 H SER A 7 -19.652 -0.153 -23.547 1.00 0.00 H new ATOM 0 HA SER A 7 -17.056 0.990 -24.417 1.00 0.00 H new ATOM 0 HB2 SER A 7 -18.470 0.862 -26.333 1.00 0.00 H new ATOM 0 HB3 SER A 7 -19.907 1.277 -25.420 1.00 0.00 H new ATOM 0 HG SER A 7 -19.084 3.092 -26.635 1.00 0.00 H new ATOM 119 N VAL A 8 -17.186 2.806 -22.744 1.00 0.00 N ATOM 120 CA VAL A 8 -17.236 3.887 -21.767 1.00 0.00 C ATOM 121 C VAL A 8 -16.365 5.060 -22.207 1.00 0.00 C ATOM 122 O VAL A 8 -15.235 4.871 -22.658 1.00 0.00 O ATOM 123 CB VAL A 8 -16.751 3.380 -20.407 1.00 0.00 C ATOM 124 CG1 VAL A 8 -15.307 2.888 -20.532 1.00 0.00 C ATOM 125 CG2 VAL A 8 -16.818 4.519 -19.385 1.00 0.00 C ATOM 0 H VAL A 8 -16.246 2.535 -23.031 1.00 0.00 H new ATOM 0 HA VAL A 8 -18.269 4.227 -21.689 1.00 0.00 H new ATOM 0 HB VAL A 8 -17.386 2.558 -20.076 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -14.961 2.527 -19.564 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -15.260 2.078 -21.260 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -14.670 3.709 -20.862 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -16.473 4.159 -18.416 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -16.182 5.341 -19.714 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -17.847 4.869 -19.297 1.00 0.00 H new ATOM 135 N ASP A 9 -16.894 6.271 -22.059 1.00 0.00 N ATOM 136 CA ASP A 9 -16.148 7.468 -22.429 1.00 0.00 C ATOM 137 C ASP A 9 -15.133 7.801 -21.340 1.00 0.00 C ATOM 138 O ASP A 9 -15.506 8.120 -20.211 1.00 0.00 O ATOM 139 CB ASP A 9 -17.105 8.646 -22.621 1.00 0.00 C ATOM 140 CG ASP A 9 -16.811 9.348 -23.942 1.00 0.00 C ATOM 141 OD1 ASP A 9 -15.687 9.787 -24.121 1.00 0.00 O ATOM 142 OD2 ASP A 9 -17.715 9.436 -24.757 1.00 0.00 O ATOM 0 H ASP A 9 -17.828 6.448 -21.689 1.00 0.00 H new ATOM 0 HA ASP A 9 -15.623 7.282 -23.366 1.00 0.00 H new ATOM 0 HB2 ASP A 9 -18.136 8.293 -22.609 1.00 0.00 H new ATOM 0 HB3 ASP A 9 -16.999 9.349 -21.795 1.00 0.00 H new ATOM 147 N MET A 10 -13.853 7.708 -21.679 1.00 0.00 N ATOM 148 CA MET A 10 -12.800 7.984 -20.710 1.00 0.00 C ATOM 149 C MET A 10 -12.721 9.473 -20.389 1.00 0.00 C ATOM 150 O MET A 10 -12.419 10.294 -21.256 1.00 0.00 O ATOM 151 CB MET A 10 -11.453 7.508 -21.258 1.00 0.00 C ATOM 152 CG MET A 10 -11.450 5.981 -21.346 1.00 0.00 C ATOM 153 SD MET A 10 -9.807 5.355 -20.924 1.00 0.00 S ATOM 154 CE MET A 10 -9.595 4.283 -22.365 1.00 0.00 C ATOM 0 H MET A 10 -13.521 7.446 -22.607 1.00 0.00 H new ATOM 0 HA MET A 10 -13.037 7.446 -19.792 1.00 0.00 H new ATOM 0 HB2 MET A 10 -11.276 7.940 -22.243 1.00 0.00 H new ATOM 0 HB3 MET A 10 -10.644 7.847 -20.611 1.00 0.00 H new ATOM 0 HG2 MET A 10 -12.194 5.566 -20.667 1.00 0.00 H new ATOM 0 HG3 MET A 10 -11.724 5.664 -22.352 1.00 0.00 H new ATOM 0 HE1 MET A 10 -8.936 3.454 -22.108 1.00 0.00 H new ATOM 0 HE2 MET A 10 -10.565 3.894 -22.675 1.00 0.00 H new ATOM 0 HE3 MET A 10 -9.156 4.855 -23.182 1.00 0.00 H new ATOM 164 N THR A 11 -12.977 9.809 -19.129 1.00 0.00 N ATOM 165 CA THR A 11 -12.915 11.195 -18.684 1.00 0.00 C ATOM 166 C THR A 11 -11.718 11.388 -17.759 1.00 0.00 C ATOM 167 O THR A 11 -11.067 12.433 -17.771 1.00 0.00 O ATOM 168 CB THR A 11 -14.201 11.573 -17.944 1.00 0.00 C ATOM 169 OG1 THR A 11 -13.978 12.751 -17.183 1.00 0.00 O ATOM 170 CG2 THR A 11 -14.612 10.432 -17.012 1.00 0.00 C ATOM 0 H THR A 11 -13.229 9.142 -18.400 1.00 0.00 H new ATOM 0 HA THR A 11 -12.806 11.838 -19.557 1.00 0.00 H new ATOM 0 HB THR A 11 -14.997 11.751 -18.667 1.00 0.00 H new ATOM 0 HG1 THR A 11 -14.801 12.995 -16.710 1.00 0.00 H new ATOM 0 HG21 THR A 11 -15.528 10.703 -16.486 1.00 0.00 H new ATOM 0 HG22 THR A 11 -14.784 9.528 -17.597 1.00 0.00 H new ATOM 0 HG23 THR A 11 -13.818 10.250 -16.288 1.00 0.00 H new ATOM 178 N CYS A 12 -11.440 10.363 -16.960 1.00 0.00 N ATOM 179 CA CYS A 12 -10.324 10.406 -16.024 1.00 0.00 C ATOM 180 C CYS A 12 -9.188 9.512 -16.501 1.00 0.00 C ATOM 181 O CYS A 12 -8.479 8.917 -15.694 1.00 0.00 O ATOM 182 CB CYS A 12 -10.795 9.958 -14.639 1.00 0.00 C ATOM 183 SG CYS A 12 -11.197 11.412 -13.641 1.00 0.00 S ATOM 0 H CYS A 12 -11.972 9.493 -16.942 1.00 0.00 H new ATOM 0 HA CYS A 12 -9.955 11.430 -15.967 1.00 0.00 H new ATOM 0 HB2 CYS A 12 -11.669 9.314 -14.731 1.00 0.00 H new ATOM 0 HB3 CYS A 12 -10.017 9.372 -14.150 1.00 0.00 H new ATOM 0 HG CYS A 12 -11.599 11.033 -12.464 1.00 0.00 H new ATOM 189 N GLY A 13 -9.020 9.429 -17.821 1.00 0.00 N ATOM 190 CA GLY A 13 -7.963 8.607 -18.405 1.00 0.00 C ATOM 191 C GLY A 13 -6.882 8.293 -17.377 1.00 0.00 C ATOM 192 O GLY A 13 -6.510 7.135 -17.187 1.00 0.00 O ATOM 0 H GLY A 13 -9.600 9.919 -18.502 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -8.388 7.678 -18.785 1.00 0.00 H new ATOM 0 HA3 GLY A 13 -7.521 9.127 -19.255 1.00 0.00 H new ATOM 196 N GLY A 14 -6.391 9.331 -16.706 1.00 0.00 N ATOM 197 CA GLY A 14 -5.363 9.150 -15.690 1.00 0.00 C ATOM 198 C GLY A 14 -5.901 8.324 -14.527 1.00 0.00 C ATOM 199 O GLY A 14 -5.305 7.319 -14.137 1.00 0.00 O ATOM 0 H GLY A 14 -6.686 10.297 -16.847 1.00 0.00 H new ATOM 0 HA2 GLY A 14 -4.496 8.654 -16.126 1.00 0.00 H new ATOM 0 HA3 GLY A 14 -5.026 10.121 -15.328 1.00 0.00 H new ATOM 203 N CYS A 15 -7.035 8.753 -13.978 1.00 0.00 N ATOM 204 CA CYS A 15 -7.651 8.042 -12.864 1.00 0.00 C ATOM 205 C CYS A 15 -8.501 6.880 -13.375 1.00 0.00 C ATOM 206 O CYS A 15 -8.429 5.771 -12.846 1.00 0.00 O ATOM 207 CB CYS A 15 -8.523 9.001 -12.048 1.00 0.00 C ATOM 208 SG CYS A 15 -8.364 10.677 -12.712 1.00 0.00 S ATOM 0 H CYS A 15 -7.542 9.583 -14.285 1.00 0.00 H new ATOM 0 HA CYS A 15 -6.860 7.645 -12.228 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.565 8.682 -12.084 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -8.220 8.983 -11.001 1.00 0.00 H new ATOM 0 HG CYS A 15 -9.538 11.126 -13.042 1.00 0.00 H new ATOM 214 N ALA A 16 -9.300 7.137 -14.409 1.00 0.00 N ATOM 215 CA ALA A 16 -10.149 6.095 -14.981 1.00 0.00 C ATOM 216 C ALA A 16 -9.306 4.884 -15.375 1.00 0.00 C ATOM 217 O ALA A 16 -9.766 3.745 -15.303 1.00 0.00 O ATOM 218 CB ALA A 16 -10.880 6.630 -16.214 1.00 0.00 C ATOM 0 H ALA A 16 -9.377 8.047 -14.863 1.00 0.00 H new ATOM 0 HA ALA A 16 -10.880 5.794 -14.231 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -11.510 5.845 -16.633 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -11.500 7.480 -15.929 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -10.151 6.947 -16.960 1.00 0.00 H new ATOM 224 N GLU A 17 -8.068 5.135 -15.788 1.00 0.00 N ATOM 225 CA GLU A 17 -7.176 4.052 -16.182 1.00 0.00 C ATOM 226 C GLU A 17 -6.912 3.131 -14.995 1.00 0.00 C ATOM 227 O GLU A 17 -6.914 1.908 -15.134 1.00 0.00 O ATOM 228 CB GLU A 17 -5.853 4.622 -16.697 1.00 0.00 C ATOM 229 CG GLU A 17 -4.814 3.503 -16.782 1.00 0.00 C ATOM 230 CD GLU A 17 -5.414 2.284 -17.473 1.00 0.00 C ATOM 231 OE1 GLU A 17 -6.208 2.472 -18.380 1.00 0.00 O ATOM 232 OE2 GLU A 17 -5.070 1.179 -17.086 1.00 0.00 O ATOM 0 H GLU A 17 -7.663 6.069 -15.858 1.00 0.00 H new ATOM 0 HA GLU A 17 -7.652 3.480 -16.978 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -5.997 5.074 -17.678 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -5.501 5.410 -16.031 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -3.939 3.849 -17.333 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -4.475 3.234 -15.782 1.00 0.00 H new ATOM 239 N ALA A 18 -6.697 3.729 -13.826 1.00 0.00 N ATOM 240 CA ALA A 18 -6.446 2.953 -12.618 1.00 0.00 C ATOM 241 C ALA A 18 -7.727 2.254 -12.175 1.00 0.00 C ATOM 242 O ALA A 18 -7.690 1.171 -11.593 1.00 0.00 O ATOM 243 CB ALA A 18 -5.948 3.871 -11.498 1.00 0.00 C ATOM 0 H ALA A 18 -6.692 4.740 -13.691 1.00 0.00 H new ATOM 0 HA ALA A 18 -5.683 2.205 -12.832 1.00 0.00 H new ATOM 0 HB1 ALA A 18 -5.763 3.282 -10.600 1.00 0.00 H new ATOM 0 HB2 ALA A 18 -5.023 4.357 -11.810 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -6.702 4.629 -11.286 1.00 0.00 H new ATOM 249 N VAL A 19 -8.858 2.887 -12.467 1.00 0.00 N ATOM 250 CA VAL A 19 -10.157 2.329 -12.111 1.00 0.00 C ATOM 251 C VAL A 19 -10.345 0.965 -12.764 1.00 0.00 C ATOM 252 O VAL A 19 -10.938 0.060 -12.176 1.00 0.00 O ATOM 253 CB VAL A 19 -11.274 3.273 -12.557 1.00 0.00 C ATOM 254 CG1 VAL A 19 -12.606 2.528 -12.537 1.00 0.00 C ATOM 255 CG2 VAL A 19 -11.345 4.469 -11.604 1.00 0.00 C ATOM 0 H VAL A 19 -8.901 3.785 -12.948 1.00 0.00 H new ATOM 0 HA VAL A 19 -10.199 2.211 -11.028 1.00 0.00 H new ATOM 0 HB VAL A 19 -11.069 3.626 -13.567 1.00 0.00 H new ATOM 0 HG11 VAL A 19 -13.403 3.200 -12.855 1.00 0.00 H new ATOM 0 HG12 VAL A 19 -12.557 1.677 -13.216 1.00 0.00 H new ATOM 0 HG13 VAL A 19 -12.810 2.175 -11.526 1.00 0.00 H new ATOM 0 HG21 VAL A 19 -12.141 5.141 -11.923 1.00 0.00 H new ATOM 0 HG22 VAL A 19 -11.550 4.117 -10.593 1.00 0.00 H new ATOM 0 HG23 VAL A 19 -10.394 5.001 -11.617 1.00 0.00 H new ATOM 265 N SER A 20 -9.839 0.823 -13.987 1.00 0.00 N ATOM 266 CA SER A 20 -9.961 -0.437 -14.710 1.00 0.00 C ATOM 267 C SER A 20 -9.368 -1.571 -13.883 1.00 0.00 C ATOM 268 O SER A 20 -9.852 -2.703 -13.923 1.00 0.00 O ATOM 269 CB SER A 20 -9.233 -0.344 -16.051 1.00 0.00 C ATOM 270 OG SER A 20 -9.965 -1.065 -17.034 1.00 0.00 O ATOM 0 H SER A 20 -9.345 1.558 -14.493 1.00 0.00 H new ATOM 0 HA SER A 20 -11.017 -0.638 -14.890 1.00 0.00 H new ATOM 0 HB2 SER A 20 -9.130 0.699 -16.350 1.00 0.00 H new ATOM 0 HB3 SER A 20 -8.226 -0.751 -15.960 1.00 0.00 H new ATOM 0 HG SER A 20 -9.428 -1.142 -17.850 1.00 0.00 H new ATOM 276 N ARG A 21 -8.327 -1.255 -13.122 1.00 0.00 N ATOM 277 CA ARG A 21 -7.684 -2.250 -12.273 1.00 0.00 C ATOM 278 C ARG A 21 -8.717 -2.881 -11.345 1.00 0.00 C ATOM 279 O ARG A 21 -8.684 -4.083 -11.084 1.00 0.00 O ATOM 280 CB ARG A 21 -6.577 -1.598 -11.442 1.00 0.00 C ATOM 281 CG ARG A 21 -5.506 -1.021 -12.369 1.00 0.00 C ATOM 282 CD ARG A 21 -4.467 -0.265 -11.537 1.00 0.00 C ATOM 283 NE ARG A 21 -3.280 -1.090 -11.342 1.00 0.00 N ATOM 284 CZ ARG A 21 -2.511 -1.438 -12.367 1.00 0.00 C ATOM 285 NH1 ARG A 21 -2.810 -1.034 -13.571 1.00 0.00 N ATOM 286 NH2 ARG A 21 -1.457 -2.181 -12.171 1.00 0.00 N ATOM 0 H ARG A 21 -7.912 -0.324 -13.075 1.00 0.00 H new ATOM 0 HA ARG A 21 -7.245 -3.022 -12.905 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -6.995 -0.808 -10.818 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -6.133 -2.333 -10.771 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -5.025 -1.822 -12.930 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -5.962 -0.351 -13.097 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -4.195 0.664 -12.039 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -4.892 0.007 -10.571 1.00 0.00 H new ATOM 0 HE ARG A 21 -3.037 -1.405 -10.403 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -3.633 -0.452 -13.724 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -2.220 -1.300 -14.359 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -1.223 -2.495 -11.229 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -0.867 -2.448 -12.959 1.00 0.00 H new ATOM 300 N VAL A 22 -9.632 -2.054 -10.852 1.00 0.00 N ATOM 301 CA VAL A 22 -10.679 -2.523 -9.951 1.00 0.00 C ATOM 302 C VAL A 22 -11.484 -3.644 -10.602 1.00 0.00 C ATOM 303 O VAL A 22 -12.143 -4.425 -9.916 1.00 0.00 O ATOM 304 CB VAL A 22 -11.611 -1.365 -9.593 1.00 0.00 C ATOM 305 CG1 VAL A 22 -12.607 -1.821 -8.524 1.00 0.00 C ATOM 306 CG2 VAL A 22 -10.784 -0.195 -9.055 1.00 0.00 C ATOM 0 H VAL A 22 -9.670 -1.056 -11.061 1.00 0.00 H new ATOM 0 HA VAL A 22 -10.210 -2.908 -9.045 1.00 0.00 H new ATOM 0 HB VAL A 22 -12.155 -1.048 -10.483 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -13.271 -0.995 -8.269 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -13.195 -2.655 -8.907 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -12.065 -2.138 -7.633 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -11.447 0.632 -8.799 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -10.240 -0.513 -8.165 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -10.075 0.130 -9.817 1.00 0.00 H new ATOM 316 N LEU A 23 -11.425 -3.719 -11.929 1.00 0.00 N ATOM 317 CA LEU A 23 -12.155 -4.752 -12.659 1.00 0.00 C ATOM 318 C LEU A 23 -11.691 -6.135 -12.223 1.00 0.00 C ATOM 319 O LEU A 23 -12.477 -7.078 -12.177 1.00 0.00 O ATOM 320 CB LEU A 23 -11.936 -4.590 -14.164 1.00 0.00 C ATOM 321 CG LEU A 23 -12.853 -5.554 -14.920 1.00 0.00 C ATOM 322 CD1 LEU A 23 -14.033 -4.781 -15.511 1.00 0.00 C ATOM 323 CD2 LEU A 23 -12.068 -6.224 -16.049 1.00 0.00 C ATOM 0 H LEU A 23 -10.885 -3.084 -12.516 1.00 0.00 H new ATOM 0 HA LEU A 23 -13.217 -4.645 -12.437 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -12.144 -3.563 -14.464 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -10.894 -4.791 -14.414 1.00 0.00 H new ATOM 0 HG LEU A 23 -13.225 -6.314 -14.233 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -14.685 -5.469 -16.049 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -14.593 -4.303 -14.708 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -13.662 -4.020 -16.198 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.720 -6.911 -16.588 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.696 -5.463 -16.735 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -11.227 -6.776 -15.630 1.00 0.00 H new ATOM 335 N ASN A 24 -10.409 -6.248 -11.899 1.00 0.00 N ATOM 336 CA ASN A 24 -9.856 -7.522 -11.461 1.00 0.00 C ATOM 337 C ASN A 24 -10.518 -7.963 -10.157 1.00 0.00 C ATOM 338 O ASN A 24 -10.784 -9.148 -9.953 1.00 0.00 O ATOM 339 CB ASN A 24 -8.346 -7.394 -11.252 1.00 0.00 C ATOM 340 CG ASN A 24 -7.701 -6.756 -12.480 1.00 0.00 C ATOM 341 OD1 ASN A 24 -8.453 -6.369 -13.474 1.00 0.00 O flip ATOM 342 ND2 ASN A 24 -6.481 -6.606 -12.532 1.00 0.00 N flip ATOM 0 H ASN A 24 -9.738 -5.480 -11.931 1.00 0.00 H new ATOM 0 HA ASN A 24 -10.050 -8.269 -12.230 1.00 0.00 H new ATOM 0 HB2 ASN A 24 -8.143 -6.789 -10.369 1.00 0.00 H new ATOM 0 HB3 ASN A 24 -7.911 -8.377 -11.072 1.00 0.00 H new ATOM 0 HD21 ASN A 24 -5.896 -6.910 -11.753 1.00 0.00 H new ATOM 0 HD22 ASN A 24 -6.054 -6.178 -13.354 1.00 0.00 H new ATOM 349 N LYS A 25 -10.780 -6.999 -9.279 1.00 0.00 N ATOM 350 CA LYS A 25 -11.409 -7.294 -7.995 1.00 0.00 C ATOM 351 C LYS A 25 -12.850 -7.764 -8.193 1.00 0.00 C ATOM 352 O LYS A 25 -13.285 -8.736 -7.573 1.00 0.00 O ATOM 353 CB LYS A 25 -11.397 -6.045 -7.106 1.00 0.00 C ATOM 354 CG LYS A 25 -10.043 -5.340 -7.229 1.00 0.00 C ATOM 355 CD LYS A 25 -9.954 -4.212 -6.196 1.00 0.00 C ATOM 356 CE LYS A 25 -9.830 -4.803 -4.789 1.00 0.00 C ATOM 357 NZ LYS A 25 -8.945 -6.000 -4.826 1.00 0.00 N ATOM 0 H LYS A 25 -10.568 -6.013 -9.431 1.00 0.00 H new ATOM 0 HA LYS A 25 -10.843 -8.091 -7.513 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -12.199 -5.368 -7.401 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -11.581 -6.323 -6.068 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -9.234 -6.054 -7.073 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -9.922 -4.936 -8.234 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -9.094 -3.578 -6.411 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -10.840 -3.580 -6.258 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -9.423 -4.058 -4.105 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -10.815 -5.078 -4.411 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -8.602 -6.208 -3.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -9.480 -6.816 -5.187 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -8.135 -5.813 -5.451 1.00 0.00 H new ATOM 371 N LEU A 26 -13.587 -7.069 -9.054 1.00 0.00 N ATOM 372 CA LEU A 26 -14.976 -7.422 -9.317 1.00 0.00 C ATOM 373 C LEU A 26 -15.068 -8.580 -10.306 1.00 0.00 C ATOM 374 O LEU A 26 -15.897 -9.478 -10.152 1.00 0.00 O ATOM 375 CB LEU A 26 -15.704 -6.210 -9.896 1.00 0.00 C ATOM 376 CG LEU A 26 -17.137 -6.172 -9.371 1.00 0.00 C ATOM 377 CD1 LEU A 26 -17.824 -7.507 -9.659 1.00 0.00 C ATOM 378 CD2 LEU A 26 -17.123 -5.920 -7.862 1.00 0.00 C ATOM 0 H LEU A 26 -13.247 -6.263 -9.578 1.00 0.00 H new ATOM 0 HA LEU A 26 -15.438 -7.729 -8.378 1.00 0.00 H new ATOM 0 HB2 LEU A 26 -15.181 -5.294 -9.621 1.00 0.00 H new ATOM 0 HB3 LEU A 26 -15.706 -6.261 -10.985 1.00 0.00 H new ATOM 0 HG LEU A 26 -17.682 -5.370 -9.868 1.00 0.00 H new ATOM 0 HD11 LEU A 26 -18.847 -7.478 -9.284 1.00 0.00 H new ATOM 0 HD12 LEU A 26 -17.837 -7.685 -10.734 1.00 0.00 H new ATOM 0 HD13 LEU A 26 -17.279 -8.311 -9.165 1.00 0.00 H new ATOM 0 HD21 LEU A 26 -18.147 -5.893 -7.488 1.00 0.00 H new ATOM 0 HD22 LEU A 26 -16.576 -6.721 -7.364 1.00 0.00 H new ATOM 0 HD23 LEU A 26 -16.637 -4.966 -7.657 1.00 0.00 H new ATOM 390 N GLY A 27 -14.216 -8.549 -11.323 1.00 0.00 N ATOM 391 CA GLY A 27 -14.210 -9.596 -12.338 1.00 0.00 C ATOM 392 C GLY A 27 -13.089 -10.598 -12.094 1.00 0.00 C ATOM 393 O GLY A 27 -13.322 -11.806 -12.049 1.00 0.00 O ATOM 0 H GLY A 27 -13.523 -7.814 -11.467 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -15.170 -10.113 -12.336 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -14.092 -9.148 -13.325 1.00 0.00 H new ATOM 397 N GLY A 28 -11.869 -10.092 -11.948 1.00 0.00 N ATOM 398 CA GLY A 28 -10.721 -10.959 -11.722 1.00 0.00 C ATOM 399 C GLY A 28 -10.492 -11.857 -12.933 1.00 0.00 C ATOM 400 O GLY A 28 -9.930 -12.946 -12.816 1.00 0.00 O ATOM 0 H GLY A 28 -11.652 -9.096 -11.982 1.00 0.00 H new ATOM 0 HA2 GLY A 28 -9.832 -10.356 -11.534 1.00 0.00 H new ATOM 0 HA3 GLY A 28 -10.886 -11.569 -10.834 1.00 0.00 H new ATOM 404 N VAL A 29 -10.941 -11.388 -14.093 1.00 0.00 N ATOM 405 CA VAL A 29 -10.794 -12.152 -15.328 1.00 0.00 C ATOM 406 C VAL A 29 -9.969 -11.381 -16.350 1.00 0.00 C ATOM 407 O VAL A 29 -9.510 -10.269 -16.089 1.00 0.00 O ATOM 408 CB VAL A 29 -12.173 -12.454 -15.916 1.00 0.00 C ATOM 409 CG1 VAL A 29 -12.879 -13.500 -15.053 1.00 0.00 C ATOM 410 CG2 VAL A 29 -13.007 -11.170 -15.944 1.00 0.00 C ATOM 0 H VAL A 29 -11.407 -10.488 -14.204 1.00 0.00 H new ATOM 0 HA VAL A 29 -10.278 -13.083 -15.094 1.00 0.00 H new ATOM 0 HB VAL A 29 -12.059 -12.837 -16.930 1.00 0.00 H new ATOM 0 HG11 VAL A 29 -13.862 -13.715 -15.473 1.00 0.00 H new ATOM 0 HG12 VAL A 29 -12.286 -14.414 -15.031 1.00 0.00 H new ATOM 0 HG13 VAL A 29 -12.993 -13.118 -14.039 1.00 0.00 H new ATOM 0 HG21 VAL A 29 -13.990 -11.384 -16.363 1.00 0.00 H new ATOM 0 HG22 VAL A 29 -13.120 -10.787 -14.930 1.00 0.00 H new ATOM 0 HG23 VAL A 29 -12.505 -10.423 -16.559 1.00 0.00 H new ATOM 420 N LYS A 30 -9.788 -11.987 -17.517 1.00 0.00 N ATOM 421 CA LYS A 30 -9.019 -11.365 -18.587 1.00 0.00 C ATOM 422 C LYS A 30 -9.628 -10.021 -18.969 1.00 0.00 C ATOM 423 O LYS A 30 -10.835 -9.913 -19.187 1.00 0.00 O ATOM 424 CB LYS A 30 -8.994 -12.280 -19.812 1.00 0.00 C ATOM 425 CG LYS A 30 -7.783 -13.212 -19.730 1.00 0.00 C ATOM 426 CD LYS A 30 -8.130 -14.559 -20.365 1.00 0.00 C ATOM 427 CE LYS A 30 -6.909 -15.097 -21.112 1.00 0.00 C ATOM 428 NZ LYS A 30 -5.733 -15.103 -20.197 1.00 0.00 N ATOM 0 H LYS A 30 -10.163 -12.908 -17.746 1.00 0.00 H new ATOM 0 HA LYS A 30 -8.001 -11.205 -18.232 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -9.913 -12.864 -19.861 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -8.946 -11.684 -20.723 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -6.932 -12.765 -20.243 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -7.490 -13.353 -18.690 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -8.441 -15.267 -19.596 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -8.969 -14.445 -21.051 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -7.106 -16.106 -21.475 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -6.701 -14.479 -21.985 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -5.049 -15.819 -20.515 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -5.282 -14.166 -20.205 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -6.046 -15.328 -19.231 1.00 0.00 H new ATOM 442 N TYR A 31 -8.785 -9.000 -19.046 1.00 0.00 N ATOM 443 CA TYR A 31 -9.250 -7.663 -19.400 1.00 0.00 C ATOM 444 C TYR A 31 -8.369 -7.052 -20.488 1.00 0.00 C ATOM 445 O TYR A 31 -7.191 -7.386 -20.608 1.00 0.00 O ATOM 446 CB TYR A 31 -9.233 -6.761 -18.165 1.00 0.00 C ATOM 447 CG TYR A 31 -7.823 -6.657 -17.636 1.00 0.00 C ATOM 448 CD1 TYR A 31 -7.258 -7.728 -16.933 1.00 0.00 C ATOM 449 CD2 TYR A 31 -7.081 -5.488 -17.847 1.00 0.00 C ATOM 450 CE1 TYR A 31 -5.951 -7.630 -16.442 1.00 0.00 C ATOM 451 CE2 TYR A 31 -5.773 -5.392 -17.357 1.00 0.00 C ATOM 452 CZ TYR A 31 -5.208 -6.463 -16.654 1.00 0.00 C ATOM 453 OH TYR A 31 -3.919 -6.366 -16.171 1.00 0.00 O ATOM 0 H TYR A 31 -7.783 -9.069 -18.870 1.00 0.00 H new ATOM 0 HA TYR A 31 -10.268 -7.746 -19.780 1.00 0.00 H new ATOM 0 HB2 TYR A 31 -9.611 -5.771 -18.420 1.00 0.00 H new ATOM 0 HB3 TYR A 31 -9.892 -7.166 -17.397 1.00 0.00 H new ATOM 0 HD1 TYR A 31 -7.830 -8.629 -16.770 1.00 0.00 H new ATOM 0 HD2 TYR A 31 -7.518 -4.661 -18.387 1.00 0.00 H new ATOM 0 HE1 TYR A 31 -5.515 -8.456 -15.899 1.00 0.00 H new ATOM 0 HE2 TYR A 31 -5.200 -4.492 -17.521 1.00 0.00 H new ATOM 0 HH TYR A 31 -3.546 -5.491 -16.407 1.00 0.00 H new ATOM 463 N ASP A 32 -8.952 -6.152 -21.276 1.00 0.00 N ATOM 464 CA ASP A 32 -8.216 -5.492 -22.350 1.00 0.00 C ATOM 465 C ASP A 32 -8.770 -4.090 -22.586 1.00 0.00 C ATOM 466 O ASP A 32 -9.974 -3.912 -22.766 1.00 0.00 O ATOM 467 CB ASP A 32 -8.323 -6.309 -23.639 1.00 0.00 C ATOM 468 CG ASP A 32 -7.649 -7.665 -23.456 1.00 0.00 C ATOM 469 OD1 ASP A 32 -8.322 -8.586 -23.024 1.00 0.00 O ATOM 470 OD2 ASP A 32 -6.469 -7.762 -23.752 1.00 0.00 O ATOM 0 H ASP A 32 -9.927 -5.864 -21.192 1.00 0.00 H new ATOM 0 HA ASP A 32 -7.169 -5.417 -22.058 1.00 0.00 H new ATOM 0 HB2 ASP A 32 -9.371 -6.448 -23.905 1.00 0.00 H new ATOM 0 HB3 ASP A 32 -7.854 -5.769 -24.461 1.00 0.00 H new ATOM 475 N ILE A 33 -7.887 -3.096 -22.574 1.00 0.00 N ATOM 476 CA ILE A 33 -8.306 -1.716 -22.777 1.00 0.00 C ATOM 477 C ILE A 33 -7.676 -1.135 -24.040 1.00 0.00 C ATOM 478 O ILE A 33 -6.465 -1.226 -24.239 1.00 0.00 O ATOM 479 CB ILE A 33 -7.897 -0.866 -21.574 1.00 0.00 C ATOM 480 CG1 ILE A 33 -6.654 -1.472 -20.915 1.00 0.00 C ATOM 481 CG2 ILE A 33 -9.044 -0.816 -20.561 1.00 0.00 C ATOM 482 CD1 ILE A 33 -7.049 -2.681 -20.060 1.00 0.00 C ATOM 0 H ILE A 33 -6.885 -3.220 -22.427 1.00 0.00 H new ATOM 0 HA ILE A 33 -9.390 -1.704 -22.888 1.00 0.00 H new ATOM 0 HB ILE A 33 -7.671 0.146 -21.910 1.00 0.00 H new ATOM 0 HG12 ILE A 33 -5.939 -1.775 -21.679 1.00 0.00 H new ATOM 0 HG13 ILE A 33 -6.160 -0.724 -20.295 1.00 0.00 H new ATOM 0 HG21 ILE A 33 -8.748 -0.209 -19.705 1.00 0.00 H new ATOM 0 HG22 ILE A 33 -9.925 -0.377 -21.030 1.00 0.00 H new ATOM 0 HG23 ILE A 33 -9.277 -1.826 -20.226 1.00 0.00 H new ATOM 0 HD11 ILE A 33 -6.159 -3.105 -19.596 1.00 0.00 H new ATOM 0 HD12 ILE A 33 -7.747 -2.366 -19.285 1.00 0.00 H new ATOM 0 HD13 ILE A 33 -7.522 -3.433 -20.691 1.00 0.00 H new ATOM 494 N ASP A 34 -8.505 -0.530 -24.885 1.00 0.00 N ATOM 495 CA ASP A 34 -8.012 0.073 -26.118 1.00 0.00 C ATOM 496 C ASP A 34 -8.048 1.594 -26.010 1.00 0.00 C ATOM 497 O ASP A 34 -9.098 2.216 -26.172 1.00 0.00 O ATOM 498 CB ASP A 34 -8.867 -0.380 -27.303 1.00 0.00 C ATOM 499 CG ASP A 34 -9.104 -1.884 -27.231 1.00 0.00 C ATOM 500 OD1 ASP A 34 -8.641 -2.492 -26.278 1.00 0.00 O ATOM 501 OD2 ASP A 34 -9.743 -2.408 -28.127 1.00 0.00 O ATOM 0 H ASP A 34 -9.511 -0.445 -24.741 1.00 0.00 H new ATOM 0 HA ASP A 34 -6.983 -0.249 -26.276 1.00 0.00 H new ATOM 0 HB2 ASP A 34 -9.821 0.147 -27.296 1.00 0.00 H new ATOM 0 HB3 ASP A 34 -8.369 -0.126 -28.239 1.00 0.00 H new ATOM 506 N LEU A 35 -6.892 2.184 -25.726 1.00 0.00 N ATOM 507 CA LEU A 35 -6.788 3.632 -25.586 1.00 0.00 C ATOM 508 C LEU A 35 -7.182 4.357 -26.876 1.00 0.00 C ATOM 509 O LEU A 35 -8.036 5.243 -26.856 1.00 0.00 O ATOM 510 CB LEU A 35 -5.356 4.014 -25.205 1.00 0.00 C ATOM 511 CG LEU A 35 -5.353 4.714 -23.844 1.00 0.00 C ATOM 512 CD1 LEU A 35 -5.853 3.749 -22.768 1.00 0.00 C ATOM 513 CD2 LEU A 35 -3.929 5.163 -23.507 1.00 0.00 C ATOM 0 H LEU A 35 -6.015 1.682 -25.588 1.00 0.00 H new ATOM 0 HA LEU A 35 -7.479 3.939 -24.801 1.00 0.00 H new ATOM 0 HB2 LEU A 35 -4.729 3.123 -25.168 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -4.931 4.671 -25.964 1.00 0.00 H new ATOM 0 HG LEU A 35 -6.010 5.583 -23.882 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -5.850 4.250 -21.800 1.00 0.00 H new ATOM 0 HD12 LEU A 35 -6.867 3.430 -23.008 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -5.199 2.878 -22.728 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -3.925 5.662 -22.538 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -3.272 4.294 -23.471 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -3.575 5.854 -24.272 1.00 0.00 H new ATOM 525 N PRO A 36 -6.571 4.019 -27.987 1.00 0.00 N ATOM 526 CA PRO A 36 -6.867 4.679 -29.293 1.00 0.00 C ATOM 527 C PRO A 36 -8.335 4.557 -29.700 1.00 0.00 C ATOM 528 O PRO A 36 -8.851 5.395 -30.438 1.00 0.00 O ATOM 529 CB PRO A 36 -5.957 3.968 -30.302 1.00 0.00 C ATOM 530 CG PRO A 36 -5.470 2.727 -29.626 1.00 0.00 C ATOM 531 CD PRO A 36 -5.534 2.983 -28.122 1.00 0.00 C ATOM 0 HA PRO A 36 -6.683 5.752 -29.239 1.00 0.00 H new ATOM 0 HB2 PRO A 36 -6.503 3.725 -31.214 1.00 0.00 H new ATOM 0 HB3 PRO A 36 -5.122 4.607 -30.590 1.00 0.00 H new ATOM 0 HG2 PRO A 36 -6.088 1.872 -29.898 1.00 0.00 H new ATOM 0 HG3 PRO A 36 -4.451 2.494 -29.935 1.00 0.00 H new ATOM 0 HD2 PRO A 36 -5.798 2.079 -27.573 1.00 0.00 H new ATOM 0 HD3 PRO A 36 -4.575 3.324 -27.733 1.00 0.00 H new ATOM 539 N ASN A 37 -9.003 3.514 -29.219 1.00 0.00 N ATOM 540 CA ASN A 37 -10.410 3.314 -29.552 1.00 0.00 C ATOM 541 C ASN A 37 -11.299 3.679 -28.369 1.00 0.00 C ATOM 542 O ASN A 37 -12.523 3.709 -28.486 1.00 0.00 O ATOM 543 CB ASN A 37 -10.654 1.857 -29.956 1.00 0.00 C ATOM 544 CG ASN A 37 -11.027 1.781 -31.433 1.00 0.00 C ATOM 545 OD1 ASN A 37 -10.510 2.637 -32.272 1.00 0.00 O flip ATOM 546 ND2 ASN A 37 -11.811 0.920 -31.833 1.00 0.00 N flip ATOM 0 H ASN A 37 -8.602 2.804 -28.607 1.00 0.00 H new ATOM 0 HA ASN A 37 -10.660 3.964 -30.390 1.00 0.00 H new ATOM 0 HB2 ASN A 37 -9.759 1.264 -29.767 1.00 0.00 H new ATOM 0 HB3 ASN A 37 -11.453 1.431 -29.348 1.00 0.00 H new ATOM 0 HD21 ASN A 37 -12.214 0.252 -31.176 1.00 0.00 H new ATOM 0 HD22 ASN A 37 -12.058 0.875 -32.822 1.00 0.00 H new ATOM 553 N LYS A 38 -10.674 3.959 -27.231 1.00 0.00 N ATOM 554 CA LYS A 38 -11.418 4.324 -26.032 1.00 0.00 C ATOM 555 C LYS A 38 -12.486 3.281 -25.727 1.00 0.00 C ATOM 556 O LYS A 38 -13.595 3.616 -25.310 1.00 0.00 O ATOM 557 CB LYS A 38 -12.079 5.690 -26.223 1.00 0.00 C ATOM 558 CG LYS A 38 -11.083 6.648 -26.878 1.00 0.00 C ATOM 559 CD LYS A 38 -11.795 7.950 -27.253 1.00 0.00 C ATOM 560 CE LYS A 38 -12.048 8.779 -25.992 1.00 0.00 C ATOM 561 NZ LYS A 38 -11.334 10.082 -26.104 1.00 0.00 N ATOM 0 H LYS A 38 -9.661 3.941 -27.114 1.00 0.00 H new ATOM 0 HA LYS A 38 -10.721 4.371 -25.195 1.00 0.00 H new ATOM 0 HB2 LYS A 38 -12.969 5.592 -26.845 1.00 0.00 H new ATOM 0 HB3 LYS A 38 -12.404 6.087 -25.261 1.00 0.00 H new ATOM 0 HG2 LYS A 38 -10.259 6.856 -26.195 1.00 0.00 H new ATOM 0 HG3 LYS A 38 -10.651 6.188 -27.767 1.00 0.00 H new ATOM 0 HD2 LYS A 38 -11.188 8.518 -27.958 1.00 0.00 H new ATOM 0 HD3 LYS A 38 -12.739 7.729 -27.751 1.00 0.00 H new ATOM 0 HE2 LYS A 38 -13.117 8.948 -25.863 1.00 0.00 H new ATOM 0 HE3 LYS A 38 -11.702 8.237 -25.112 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 -11.505 10.646 -25.247 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 -10.313 9.911 -26.208 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 -11.684 10.600 -26.935 1.00 0.00 H new ATOM 575 N LYS A 39 -12.144 2.015 -25.935 1.00 0.00 N ATOM 576 CA LYS A 39 -13.081 0.929 -25.677 1.00 0.00 C ATOM 577 C LYS A 39 -12.470 -0.077 -24.710 1.00 0.00 C ATOM 578 O LYS A 39 -11.256 -0.094 -24.502 1.00 0.00 O ATOM 579 CB LYS A 39 -13.447 0.231 -26.988 1.00 0.00 C ATOM 580 CG LYS A 39 -14.961 0.013 -27.046 1.00 0.00 C ATOM 581 CD LYS A 39 -15.331 -0.661 -28.369 1.00 0.00 C ATOM 582 CE LYS A 39 -16.690 -0.146 -28.846 1.00 0.00 C ATOM 583 NZ LYS A 39 -17.050 -0.813 -30.130 1.00 0.00 N ATOM 0 H LYS A 39 -11.231 1.717 -26.279 1.00 0.00 H new ATOM 0 HA LYS A 39 -13.983 1.346 -25.229 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -13.123 0.834 -27.836 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -12.928 -0.725 -27.060 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -15.282 -0.606 -26.208 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -15.480 0.967 -26.954 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -14.569 -0.454 -29.120 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -15.366 -1.743 -28.240 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -17.452 -0.347 -28.093 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -16.654 0.935 -28.983 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -17.974 -0.464 -30.456 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -16.327 -0.600 -30.847 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -17.100 -1.842 -29.985 1.00 0.00 H new ATOM 597 N VAL A 40 -13.315 -0.911 -24.117 1.00 0.00 N ATOM 598 CA VAL A 40 -12.840 -1.909 -23.168 1.00 0.00 C ATOM 599 C VAL A 40 -13.490 -3.263 -23.431 1.00 0.00 C ATOM 600 O VAL A 40 -14.713 -3.391 -23.395 1.00 0.00 O ATOM 601 CB VAL A 40 -13.164 -1.460 -21.742 1.00 0.00 C ATOM 602 CG1 VAL A 40 -12.383 -2.311 -20.740 1.00 0.00 C ATOM 603 CG2 VAL A 40 -12.778 0.012 -21.572 1.00 0.00 C ATOM 0 H VAL A 40 -14.323 -0.917 -24.274 1.00 0.00 H new ATOM 0 HA VAL A 40 -11.762 -2.010 -23.289 1.00 0.00 H new ATOM 0 HB VAL A 40 -14.232 -1.582 -21.560 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -12.618 -1.987 -19.726 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -12.660 -3.359 -20.859 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -11.314 -2.195 -20.920 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -13.008 0.334 -20.556 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -11.711 0.132 -21.757 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -13.340 0.620 -22.281 1.00 0.00 H new ATOM 613 N CYS A 41 -12.665 -4.274 -23.683 1.00 0.00 N ATOM 614 CA CYS A 41 -13.180 -5.615 -23.934 1.00 0.00 C ATOM 615 C CYS A 41 -12.658 -6.584 -22.880 1.00 0.00 C ATOM 616 O CYS A 41 -11.461 -6.864 -22.817 1.00 0.00 O ATOM 617 CB CYS A 41 -12.754 -6.088 -25.325 1.00 0.00 C ATOM 618 SG CYS A 41 -13.170 -7.839 -25.520 1.00 0.00 S ATOM 0 H CYS A 41 -11.649 -4.193 -23.719 1.00 0.00 H new ATOM 0 HA CYS A 41 -14.268 -5.587 -23.883 1.00 0.00 H new ATOM 0 HB2 CYS A 41 -13.255 -5.497 -26.091 1.00 0.00 H new ATOM 0 HB3 CYS A 41 -11.682 -5.941 -25.459 1.00 0.00 H new ATOM 0 HG CYS A 41 -12.810 -8.241 -26.703 1.00 0.00 H new ATOM 624 N ILE A 42 -13.565 -7.083 -22.049 1.00 0.00 N ATOM 625 CA ILE A 42 -13.203 -8.004 -20.993 1.00 0.00 C ATOM 626 C ILE A 42 -14.057 -9.260 -21.055 1.00 0.00 C ATOM 627 O ILE A 42 -15.267 -9.188 -21.271 1.00 0.00 O ATOM 628 CB ILE A 42 -13.406 -7.331 -19.644 1.00 0.00 C ATOM 629 CG1 ILE A 42 -14.900 -7.128 -19.387 1.00 0.00 C ATOM 630 CG2 ILE A 42 -12.704 -5.978 -19.636 1.00 0.00 C ATOM 631 CD1 ILE A 42 -15.399 -8.191 -18.405 1.00 0.00 C ATOM 0 H ILE A 42 -14.560 -6.860 -22.091 1.00 0.00 H new ATOM 0 HA ILE A 42 -12.157 -8.283 -21.122 1.00 0.00 H new ATOM 0 HB ILE A 42 -12.987 -7.964 -18.862 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -15.078 -6.132 -18.982 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -15.453 -7.195 -20.324 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -12.851 -5.498 -18.669 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -11.638 -6.120 -19.812 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -13.121 -5.347 -20.421 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -16.464 -8.046 -18.222 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -15.235 -9.182 -18.828 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -14.854 -8.103 -17.465 1.00 0.00 H new ATOM 643 N GLU A 43 -13.434 -10.409 -20.846 1.00 0.00 N ATOM 644 CA GLU A 43 -14.177 -11.656 -20.864 1.00 0.00 C ATOM 645 C GLU A 43 -14.321 -12.176 -19.440 1.00 0.00 C ATOM 646 O GLU A 43 -13.337 -12.528 -18.792 1.00 0.00 O ATOM 647 CB GLU A 43 -13.448 -12.692 -21.722 1.00 0.00 C ATOM 648 CG GLU A 43 -13.978 -14.091 -21.397 1.00 0.00 C ATOM 649 CD GLU A 43 -14.029 -14.937 -22.664 1.00 0.00 C ATOM 650 OE1 GLU A 43 -12.972 -15.311 -23.146 1.00 0.00 O ATOM 651 OE2 GLU A 43 -15.123 -15.200 -23.133 1.00 0.00 O ATOM 0 H GLU A 43 -12.435 -10.503 -20.665 1.00 0.00 H new ATOM 0 HA GLU A 43 -15.164 -11.480 -21.291 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -13.596 -12.472 -22.779 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -12.375 -12.645 -21.534 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -13.337 -14.569 -20.656 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -14.973 -14.019 -20.958 1.00 0.00 H new ATOM 658 N SER A 44 -15.558 -12.206 -18.960 1.00 0.00 N ATOM 659 CA SER A 44 -15.831 -12.667 -17.605 1.00 0.00 C ATOM 660 C SER A 44 -16.798 -13.845 -17.616 1.00 0.00 C ATOM 661 O SER A 44 -17.484 -14.092 -18.607 1.00 0.00 O ATOM 662 CB SER A 44 -16.430 -11.527 -16.781 1.00 0.00 C ATOM 663 OG SER A 44 -17.321 -12.064 -15.812 1.00 0.00 O ATOM 0 H SER A 44 -16.384 -11.918 -19.485 1.00 0.00 H new ATOM 0 HA SER A 44 -14.891 -12.991 -17.159 1.00 0.00 H new ATOM 0 HB2 SER A 44 -15.637 -10.963 -16.290 1.00 0.00 H new ATOM 0 HB3 SER A 44 -16.959 -10.832 -17.432 1.00 0.00 H new ATOM 0 HG SER A 44 -17.332 -11.485 -15.022 1.00 0.00 H new ATOM 669 N GLU A 45 -16.846 -14.563 -16.500 1.00 0.00 N ATOM 670 CA GLU A 45 -17.728 -15.712 -16.373 1.00 0.00 C ATOM 671 C GLU A 45 -19.168 -15.256 -16.164 1.00 0.00 C ATOM 672 O GLU A 45 -20.107 -15.898 -16.632 1.00 0.00 O ATOM 673 CB GLU A 45 -17.282 -16.562 -15.185 1.00 0.00 C ATOM 674 CG GLU A 45 -15.828 -16.998 -15.385 1.00 0.00 C ATOM 675 CD GLU A 45 -15.776 -18.466 -15.796 1.00 0.00 C ATOM 676 OE1 GLU A 45 -16.106 -18.754 -16.935 1.00 0.00 O ATOM 677 OE2 GLU A 45 -15.408 -19.281 -14.966 1.00 0.00 O ATOM 0 H GLU A 45 -16.284 -14.368 -15.671 1.00 0.00 H new ATOM 0 HA GLU A 45 -17.677 -16.301 -17.289 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -17.378 -15.992 -14.261 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -17.925 -17.437 -15.089 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.356 -16.381 -16.150 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -15.265 -16.850 -14.464 1.00 0.00 H new ATOM 684 N HIS A 46 -19.330 -14.141 -15.457 1.00 0.00 N ATOM 685 CA HIS A 46 -20.658 -13.604 -15.187 1.00 0.00 C ATOM 686 C HIS A 46 -20.957 -12.431 -16.114 1.00 0.00 C ATOM 687 O HIS A 46 -21.944 -12.442 -16.850 1.00 0.00 O ATOM 688 CB HIS A 46 -20.748 -13.143 -13.731 1.00 0.00 C ATOM 689 CG HIS A 46 -20.070 -14.151 -12.843 1.00 0.00 C ATOM 690 ND1 HIS A 46 -20.648 -15.373 -12.538 1.00 0.00 N ATOM 691 CD2 HIS A 46 -18.863 -14.134 -12.190 1.00 0.00 C ATOM 692 CE1 HIS A 46 -19.796 -16.035 -11.732 1.00 0.00 C ATOM 693 NE2 HIS A 46 -18.692 -15.324 -11.488 1.00 0.00 N ATOM 0 H HIS A 46 -18.563 -13.596 -15.063 1.00 0.00 H new ATOM 0 HA HIS A 46 -21.392 -14.390 -15.364 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -20.276 -12.167 -13.618 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -21.792 -13.028 -13.438 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -18.153 -13.320 -12.217 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -19.983 -17.021 -11.332 1.00 0.00 H new ATOM 0 HE2 HIS A 46 -17.895 -15.595 -10.912 1.00 0.00 H new ATOM 701 N SER A 47 -20.096 -11.425 -16.073 1.00 0.00 N ATOM 702 CA SER A 47 -20.268 -10.245 -16.912 1.00 0.00 C ATOM 703 C SER A 47 -21.550 -9.504 -16.538 1.00 0.00 C ATOM 704 O SER A 47 -22.445 -10.071 -15.914 1.00 0.00 O ATOM 705 CB SER A 47 -20.321 -10.658 -18.384 1.00 0.00 C ATOM 706 OG SER A 47 -19.362 -11.680 -18.618 1.00 0.00 O ATOM 0 H SER A 47 -19.273 -11.400 -15.470 1.00 0.00 H new ATOM 0 HA SER A 47 -19.420 -9.579 -16.753 1.00 0.00 H new ATOM 0 HB2 SER A 47 -21.319 -11.014 -18.638 1.00 0.00 H new ATOM 0 HB3 SER A 47 -20.117 -9.799 -19.023 1.00 0.00 H new ATOM 0 HG SER A 47 -19.394 -11.949 -19.560 1.00 0.00 H new ATOM 712 N MET A 48 -21.624 -8.233 -16.924 1.00 0.00 N ATOM 713 CA MET A 48 -22.797 -7.413 -16.626 1.00 0.00 C ATOM 714 C MET A 48 -22.851 -7.069 -15.141 1.00 0.00 C ATOM 715 O MET A 48 -23.927 -6.975 -14.552 1.00 0.00 O ATOM 716 CB MET A 48 -24.079 -8.147 -17.031 1.00 0.00 C ATOM 717 CG MET A 48 -25.254 -7.164 -17.039 1.00 0.00 C ATOM 718 SD MET A 48 -26.340 -7.529 -18.440 1.00 0.00 S ATOM 719 CE MET A 48 -27.910 -7.279 -17.577 1.00 0.00 C ATOM 0 H MET A 48 -20.890 -7.749 -17.441 1.00 0.00 H new ATOM 0 HA MET A 48 -22.718 -6.489 -17.199 1.00 0.00 H new ATOM 0 HB2 MET A 48 -23.958 -8.593 -18.018 1.00 0.00 H new ATOM 0 HB3 MET A 48 -24.279 -8.962 -16.335 1.00 0.00 H new ATOM 0 HG2 MET A 48 -25.811 -7.239 -16.105 1.00 0.00 H new ATOM 0 HG3 MET A 48 -24.885 -6.141 -17.109 1.00 0.00 H new ATOM 0 HE1 MET A 48 -28.736 -7.455 -18.266 1.00 0.00 H new ATOM 0 HE2 MET A 48 -27.980 -7.975 -16.741 1.00 0.00 H new ATOM 0 HE3 MET A 48 -27.961 -6.256 -17.203 1.00 0.00 H new ATOM 729 N ASP A 49 -21.680 -6.880 -14.546 1.00 0.00 N ATOM 730 CA ASP A 49 -21.594 -6.539 -13.132 1.00 0.00 C ATOM 731 C ASP A 49 -20.212 -5.980 -12.815 1.00 0.00 C ATOM 732 O ASP A 49 -20.075 -5.017 -12.061 1.00 0.00 O ATOM 733 CB ASP A 49 -21.857 -7.782 -12.279 1.00 0.00 C ATOM 734 CG ASP A 49 -23.357 -8.039 -12.181 1.00 0.00 C ATOM 735 OD1 ASP A 49 -24.111 -7.089 -12.320 1.00 0.00 O ATOM 736 OD2 ASP A 49 -23.731 -9.181 -11.970 1.00 0.00 O ATOM 0 H ASP A 49 -20.779 -6.957 -15.019 1.00 0.00 H new ATOM 0 HA ASP A 49 -22.346 -5.783 -12.904 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -21.359 -8.647 -12.718 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -21.437 -7.645 -11.282 1.00 0.00 H new ATOM 741 N THR A 50 -19.193 -6.593 -13.406 1.00 0.00 N ATOM 742 CA THR A 50 -17.817 -6.162 -13.197 1.00 0.00 C ATOM 743 C THR A 50 -17.498 -4.931 -14.044 1.00 0.00 C ATOM 744 O THR A 50 -16.758 -4.044 -13.616 1.00 0.00 O ATOM 745 CB THR A 50 -16.859 -7.298 -13.573 1.00 0.00 C ATOM 746 OG1 THR A 50 -15.604 -6.752 -13.947 1.00 0.00 O ATOM 747 CG2 THR A 50 -17.435 -8.092 -14.749 1.00 0.00 C ATOM 0 H THR A 50 -19.294 -7.390 -14.034 1.00 0.00 H new ATOM 0 HA THR A 50 -17.694 -5.904 -12.145 1.00 0.00 H new ATOM 0 HB THR A 50 -16.732 -7.960 -12.716 1.00 0.00 H new ATOM 0 HG1 THR A 50 -15.106 -7.409 -14.477 1.00 0.00 H new ATOM 0 HG21 THR A 50 -16.751 -8.899 -15.013 1.00 0.00 H new ATOM 0 HG22 THR A 50 -18.400 -8.513 -14.466 1.00 0.00 H new ATOM 0 HG23 THR A 50 -17.564 -7.431 -15.606 1.00 0.00 H new ATOM 755 N LEU A 51 -18.047 -4.895 -15.253 1.00 0.00 N ATOM 756 CA LEU A 51 -17.808 -3.786 -16.171 1.00 0.00 C ATOM 757 C LEU A 51 -18.378 -2.467 -15.645 1.00 0.00 C ATOM 758 O LEU A 51 -17.678 -1.457 -15.590 1.00 0.00 O ATOM 759 CB LEU A 51 -18.447 -4.095 -17.526 1.00 0.00 C ATOM 760 CG LEU A 51 -18.204 -5.561 -17.891 1.00 0.00 C ATOM 761 CD1 LEU A 51 -19.505 -6.352 -17.735 1.00 0.00 C ATOM 762 CD2 LEU A 51 -17.731 -5.650 -19.344 1.00 0.00 C ATOM 0 H LEU A 51 -18.661 -5.621 -15.621 1.00 0.00 H new ATOM 0 HA LEU A 51 -16.728 -3.673 -16.269 1.00 0.00 H new ATOM 0 HB2 LEU A 51 -19.517 -3.893 -17.488 1.00 0.00 H new ATOM 0 HB3 LEU A 51 -18.027 -3.445 -18.293 1.00 0.00 H new ATOM 0 HG LEU A 51 -17.444 -5.977 -17.230 1.00 0.00 H new ATOM 0 HD11 LEU A 51 -19.330 -7.396 -17.995 1.00 0.00 H new ATOM 0 HD12 LEU A 51 -19.848 -6.288 -16.702 1.00 0.00 H new ATOM 0 HD13 LEU A 51 -20.265 -5.936 -18.396 1.00 0.00 H new ATOM 0 HD21 LEU A 51 -17.557 -6.693 -19.607 1.00 0.00 H new ATOM 0 HD22 LEU A 51 -18.494 -5.233 -20.001 1.00 0.00 H new ATOM 0 HD23 LEU A 51 -16.805 -5.087 -19.460 1.00 0.00 H new ATOM 774 N LEU A 52 -19.660 -2.475 -15.297 1.00 0.00 N ATOM 775 CA LEU A 52 -20.322 -1.263 -14.823 1.00 0.00 C ATOM 776 C LEU A 52 -19.738 -0.752 -13.506 1.00 0.00 C ATOM 777 O LEU A 52 -19.422 0.431 -13.384 1.00 0.00 O ATOM 778 CB LEU A 52 -21.825 -1.516 -14.652 1.00 0.00 C ATOM 779 CG LEU A 52 -22.069 -2.942 -14.147 1.00 0.00 C ATOM 780 CD1 LEU A 52 -23.371 -2.976 -13.345 1.00 0.00 C ATOM 781 CD2 LEU A 52 -22.178 -3.911 -15.331 1.00 0.00 C ATOM 0 H LEU A 52 -20.259 -3.300 -15.333 1.00 0.00 H new ATOM 0 HA LEU A 52 -20.154 -0.494 -15.577 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -22.244 -0.797 -13.948 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -22.337 -1.367 -15.603 1.00 0.00 H new ATOM 0 HG LEU A 52 -21.234 -3.245 -13.515 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -23.549 -3.989 -12.983 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -23.294 -2.296 -12.497 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -24.199 -2.667 -13.983 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -22.351 -4.921 -14.960 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -23.008 -3.612 -15.971 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -21.252 -3.889 -15.905 1.00 0.00 H new ATOM 793 N ALA A 53 -19.619 -1.629 -12.516 1.00 0.00 N ATOM 794 CA ALA A 53 -19.098 -1.223 -11.214 1.00 0.00 C ATOM 795 C ALA A 53 -17.708 -0.604 -11.332 1.00 0.00 C ATOM 796 O ALA A 53 -17.443 0.459 -10.770 1.00 0.00 O ATOM 797 CB ALA A 53 -19.039 -2.433 -10.282 1.00 0.00 C ATOM 0 H ALA A 53 -19.872 -2.614 -12.587 1.00 0.00 H new ATOM 0 HA ALA A 53 -19.771 -0.469 -10.806 1.00 0.00 H new ATOM 0 HB1 ALA A 53 -18.650 -2.126 -9.311 1.00 0.00 H new ATOM 0 HB2 ALA A 53 -20.040 -2.845 -10.157 1.00 0.00 H new ATOM 0 HB3 ALA A 53 -18.385 -3.192 -10.712 1.00 0.00 H new ATOM 803 N THR A 54 -16.821 -1.274 -12.055 1.00 0.00 N ATOM 804 CA THR A 54 -15.460 -0.778 -12.226 1.00 0.00 C ATOM 805 C THR A 54 -15.428 0.473 -13.099 1.00 0.00 C ATOM 806 O THR A 54 -14.782 1.460 -12.758 1.00 0.00 O ATOM 807 CB THR A 54 -14.581 -1.865 -12.846 1.00 0.00 C ATOM 808 OG1 THR A 54 -14.317 -2.862 -11.870 1.00 0.00 O ATOM 809 CG2 THR A 54 -13.262 -1.255 -13.324 1.00 0.00 C ATOM 0 H THR A 54 -17.016 -2.156 -12.530 1.00 0.00 H new ATOM 0 HA THR A 54 -15.074 -0.514 -11.241 1.00 0.00 H new ATOM 0 HB THR A 54 -15.097 -2.309 -13.697 1.00 0.00 H new ATOM 0 HG1 THR A 54 -15.088 -3.462 -11.798 1.00 0.00 H new ATOM 0 HG21 THR A 54 -12.640 -2.034 -13.765 1.00 0.00 H new ATOM 0 HG22 THR A 54 -13.466 -0.487 -14.070 1.00 0.00 H new ATOM 0 HG23 THR A 54 -12.740 -0.809 -12.478 1.00 0.00 H new ATOM 817 N LEU A 55 -16.112 0.423 -14.233 1.00 0.00 N ATOM 818 CA LEU A 55 -16.131 1.554 -15.149 1.00 0.00 C ATOM 819 C LEU A 55 -16.766 2.788 -14.505 1.00 0.00 C ATOM 820 O LEU A 55 -16.333 3.913 -14.751 1.00 0.00 O ATOM 821 CB LEU A 55 -16.904 1.177 -16.410 1.00 0.00 C ATOM 822 CG LEU A 55 -16.127 0.112 -17.187 1.00 0.00 C ATOM 823 CD1 LEU A 55 -17.011 -0.460 -18.295 1.00 0.00 C ATOM 824 CD2 LEU A 55 -14.879 0.742 -17.808 1.00 0.00 C ATOM 0 H LEU A 55 -16.658 -0.383 -14.539 1.00 0.00 H new ATOM 0 HA LEU A 55 -15.100 1.801 -15.403 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -17.892 0.800 -16.145 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -17.056 2.058 -17.033 1.00 0.00 H new ATOM 0 HG LEU A 55 -15.832 -0.688 -16.508 1.00 0.00 H new ATOM 0 HD11 LEU A 55 -16.457 -1.218 -18.848 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -17.901 -0.910 -17.855 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -17.307 0.340 -18.974 1.00 0.00 H new ATOM 0 HD21 LEU A 55 -14.325 -0.017 -18.361 1.00 0.00 H new ATOM 0 HD22 LEU A 55 -15.175 1.543 -18.486 1.00 0.00 H new ATOM 0 HD23 LEU A 55 -14.246 1.150 -17.019 1.00 0.00 H new ATOM 836 N LYS A 56 -17.796 2.574 -13.694 1.00 0.00 N ATOM 837 CA LYS A 56 -18.480 3.686 -13.038 1.00 0.00 C ATOM 838 C LYS A 56 -17.620 4.284 -11.925 1.00 0.00 C ATOM 839 O LYS A 56 -17.731 5.470 -11.613 1.00 0.00 O ATOM 840 CB LYS A 56 -19.814 3.206 -12.459 1.00 0.00 C ATOM 841 CG LYS A 56 -20.235 4.118 -11.307 1.00 0.00 C ATOM 842 CD LYS A 56 -19.601 3.619 -10.009 1.00 0.00 C ATOM 843 CE LYS A 56 -20.650 2.872 -9.184 1.00 0.00 C ATOM 844 NZ LYS A 56 -19.968 1.975 -8.210 1.00 0.00 N ATOM 0 H LYS A 56 -18.174 1.652 -13.476 1.00 0.00 H new ATOM 0 HA LYS A 56 -18.661 4.461 -13.783 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -20.580 3.208 -13.235 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -19.720 2.179 -12.106 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -19.923 5.143 -11.507 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -21.321 4.128 -11.214 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -18.761 2.961 -10.231 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -19.205 4.459 -9.439 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -21.287 3.582 -8.657 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -21.297 2.290 -9.840 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -20.681 1.467 -7.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -19.378 1.289 -8.724 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -19.368 2.542 -7.577 1.00 0.00 H new ATOM 858 N LYS A 57 -16.775 3.458 -11.319 1.00 0.00 N ATOM 859 CA LYS A 57 -15.917 3.921 -10.230 1.00 0.00 C ATOM 860 C LYS A 57 -15.505 5.379 -10.430 1.00 0.00 C ATOM 861 O LYS A 57 -15.592 6.184 -9.504 1.00 0.00 O ATOM 862 CB LYS A 57 -14.666 3.048 -10.130 1.00 0.00 C ATOM 863 CG LYS A 57 -14.395 2.708 -8.661 1.00 0.00 C ATOM 864 CD LYS A 57 -14.022 3.983 -7.900 1.00 0.00 C ATOM 865 CE LYS A 57 -13.306 3.610 -6.600 1.00 0.00 C ATOM 866 NZ LYS A 57 -11.929 3.136 -6.911 1.00 0.00 N ATOM 0 H LYS A 57 -16.664 2.473 -11.559 1.00 0.00 H new ATOM 0 HA LYS A 57 -16.489 3.845 -9.305 1.00 0.00 H new ATOM 0 HB2 LYS A 57 -14.801 2.133 -10.707 1.00 0.00 H new ATOM 0 HB3 LYS A 57 -13.810 3.571 -10.557 1.00 0.00 H new ATOM 0 HG2 LYS A 57 -15.278 2.251 -8.214 1.00 0.00 H new ATOM 0 HG3 LYS A 57 -13.587 1.980 -8.589 1.00 0.00 H new ATOM 0 HD2 LYS A 57 -13.378 4.611 -8.515 1.00 0.00 H new ATOM 0 HD3 LYS A 57 -14.918 4.564 -7.681 1.00 0.00 H new ATOM 0 HE2 LYS A 57 -13.264 4.473 -5.935 1.00 0.00 H new ATOM 0 HE3 LYS A 57 -13.861 2.831 -6.077 1.00 0.00 H new ATOM 0 HZ1 LYS A 57 -11.320 3.268 -6.078 1.00 0.00 H new ATOM 0 HZ2 LYS A 57 -11.958 2.127 -7.162 1.00 0.00 H new ATOM 0 HZ3 LYS A 57 -11.546 3.681 -7.710 1.00 0.00 H new ATOM 880 N THR A 58 -15.047 5.715 -11.635 1.00 0.00 N ATOM 881 CA THR A 58 -14.617 7.082 -11.912 1.00 0.00 C ATOM 882 C THR A 58 -15.807 7.967 -12.282 1.00 0.00 C ATOM 883 O THR A 58 -15.715 9.193 -12.222 1.00 0.00 O ATOM 884 CB THR A 58 -13.594 7.088 -13.051 1.00 0.00 C ATOM 885 OG1 THR A 58 -13.329 5.751 -13.452 1.00 0.00 O ATOM 886 CG2 THR A 58 -12.299 7.747 -12.572 1.00 0.00 C ATOM 0 H THR A 58 -14.965 5.071 -12.422 1.00 0.00 H new ATOM 0 HA THR A 58 -14.158 7.483 -11.009 1.00 0.00 H new ATOM 0 HB THR A 58 -13.992 7.649 -13.896 1.00 0.00 H new ATOM 0 HG1 THR A 58 -13.099 5.735 -14.404 1.00 0.00 H new ATOM 0 HG21 THR A 58 -11.571 7.751 -13.383 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.505 8.772 -12.264 1.00 0.00 H new ATOM 0 HG23 THR A 58 -11.897 7.188 -11.727 1.00 0.00 H new ATOM 894 N GLY A 59 -16.924 7.347 -12.652 1.00 0.00 N ATOM 895 CA GLY A 59 -18.117 8.110 -13.011 1.00 0.00 C ATOM 896 C GLY A 59 -18.236 8.298 -14.520 1.00 0.00 C ATOM 897 O GLY A 59 -18.988 9.153 -14.988 1.00 0.00 O ATOM 0 H GLY A 59 -17.029 6.334 -12.711 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -19.003 7.596 -12.638 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -18.085 9.085 -12.525 1.00 0.00 H new ATOM 901 N ALA A 60 -17.491 7.503 -15.279 1.00 0.00 N ATOM 902 CA ALA A 60 -17.529 7.605 -16.735 1.00 0.00 C ATOM 903 C ALA A 60 -18.808 6.980 -17.283 1.00 0.00 C ATOM 904 O ALA A 60 -19.322 6.009 -16.726 1.00 0.00 O ATOM 905 CB ALA A 60 -16.316 6.899 -17.340 1.00 0.00 C ATOM 0 H ALA A 60 -16.860 6.788 -14.917 1.00 0.00 H new ATOM 0 HA ALA A 60 -17.508 8.660 -17.006 1.00 0.00 H new ATOM 0 HB1 ALA A 60 -16.352 6.980 -18.426 1.00 0.00 H new ATOM 0 HB2 ALA A 60 -15.402 7.366 -16.972 1.00 0.00 H new ATOM 0 HB3 ALA A 60 -16.327 5.847 -17.054 1.00 0.00 H new ATOM 911 N THR A 61 -19.316 7.539 -18.377 1.00 0.00 N ATOM 912 CA THR A 61 -20.536 7.022 -18.990 1.00 0.00 C ATOM 913 C THR A 61 -20.346 5.561 -19.387 1.00 0.00 C ATOM 914 O THR A 61 -19.298 5.182 -19.908 1.00 0.00 O ATOM 915 CB THR A 61 -20.898 7.851 -20.226 1.00 0.00 C ATOM 916 OG1 THR A 61 -20.146 9.058 -20.222 1.00 0.00 O ATOM 917 CG2 THR A 61 -22.391 8.179 -20.202 1.00 0.00 C ATOM 0 H THR A 61 -18.907 8.342 -18.854 1.00 0.00 H new ATOM 0 HA THR A 61 -21.347 7.092 -18.265 1.00 0.00 H new ATOM 0 HB THR A 61 -20.667 7.282 -21.126 1.00 0.00 H new ATOM 0 HG1 THR A 61 -20.375 9.589 -21.013 1.00 0.00 H new ATOM 0 HG21 THR A 61 -22.648 8.769 -21.082 1.00 0.00 H new ATOM 0 HG22 THR A 61 -22.967 7.254 -20.205 1.00 0.00 H new ATOM 0 HG23 THR A 61 -22.624 8.749 -19.302 1.00 0.00 H new ATOM 925 N VAL A 62 -21.361 4.743 -19.126 1.00 0.00 N ATOM 926 CA VAL A 62 -21.279 3.324 -19.452 1.00 0.00 C ATOM 927 C VAL A 62 -22.449 2.889 -20.330 1.00 0.00 C ATOM 928 O VAL A 62 -23.599 3.247 -20.076 1.00 0.00 O ATOM 929 CB VAL A 62 -21.272 2.500 -18.165 1.00 0.00 C ATOM 930 CG1 VAL A 62 -21.352 1.012 -18.512 1.00 0.00 C ATOM 931 CG2 VAL A 62 -19.978 2.777 -17.396 1.00 0.00 C ATOM 0 H VAL A 62 -22.239 5.033 -18.695 1.00 0.00 H new ATOM 0 HA VAL A 62 -20.355 3.156 -20.006 1.00 0.00 H new ATOM 0 HB VAL A 62 -22.129 2.774 -17.549 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -21.347 0.424 -17.594 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -22.271 0.816 -19.064 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -20.495 0.735 -19.125 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -19.969 2.191 -16.477 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -19.122 2.500 -18.012 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -19.920 3.838 -17.151 1.00 0.00 H new ATOM 941 N SER A 63 -22.139 2.109 -21.360 1.00 0.00 N ATOM 942 CA SER A 63 -23.161 1.614 -22.275 1.00 0.00 C ATOM 943 C SER A 63 -22.905 0.147 -22.605 1.00 0.00 C ATOM 944 O SER A 63 -21.886 -0.194 -23.205 1.00 0.00 O ATOM 945 CB SER A 63 -23.154 2.437 -23.562 1.00 0.00 C ATOM 946 OG SER A 63 -23.869 3.648 -23.350 1.00 0.00 O ATOM 0 H SER A 63 -21.190 1.806 -21.582 1.00 0.00 H new ATOM 0 HA SER A 63 -24.135 1.707 -21.794 1.00 0.00 H new ATOM 0 HB2 SER A 63 -22.129 2.654 -23.863 1.00 0.00 H new ATOM 0 HB3 SER A 63 -23.610 1.869 -24.373 1.00 0.00 H new ATOM 0 HG SER A 63 -23.865 4.179 -24.174 1.00 0.00 H new ATOM 952 N TYR A 64 -23.832 -0.718 -22.206 1.00 0.00 N ATOM 953 CA TYR A 64 -23.685 -2.146 -22.464 1.00 0.00 C ATOM 954 C TYR A 64 -24.026 -2.466 -23.916 1.00 0.00 C ATOM 955 O TYR A 64 -25.080 -2.076 -24.419 1.00 0.00 O ATOM 956 CB TYR A 64 -24.593 -2.945 -21.520 1.00 0.00 C ATOM 957 CG TYR A 64 -25.884 -3.302 -22.221 1.00 0.00 C ATOM 958 CD1 TYR A 64 -25.890 -4.284 -23.220 1.00 0.00 C ATOM 959 CD2 TYR A 64 -27.073 -2.649 -21.875 1.00 0.00 C ATOM 960 CE1 TYR A 64 -27.085 -4.614 -23.871 1.00 0.00 C ATOM 961 CE2 TYR A 64 -28.268 -2.978 -22.526 1.00 0.00 C ATOM 962 CZ TYR A 64 -28.274 -3.959 -23.524 1.00 0.00 C ATOM 963 OH TYR A 64 -29.452 -4.283 -24.166 1.00 0.00 O ATOM 0 H TYR A 64 -24.684 -0.459 -21.708 1.00 0.00 H new ATOM 0 HA TYR A 64 -22.648 -2.427 -22.283 1.00 0.00 H new ATOM 0 HB2 TYR A 64 -24.084 -3.852 -21.194 1.00 0.00 H new ATOM 0 HB3 TYR A 64 -24.806 -2.360 -20.625 1.00 0.00 H new ATOM 0 HD1 TYR A 64 -24.973 -4.787 -23.488 1.00 0.00 H new ATOM 0 HD2 TYR A 64 -27.068 -1.891 -21.106 1.00 0.00 H new ATOM 0 HE1 TYR A 64 -27.090 -5.373 -24.640 1.00 0.00 H new ATOM 0 HE2 TYR A 64 -29.185 -2.475 -22.258 1.00 0.00 H new ATOM 0 HH TYR A 64 -30.182 -3.737 -23.806 1.00 0.00 H new ATOM 973 N LEU A 65 -23.126 -3.182 -24.579 1.00 0.00 N ATOM 974 CA LEU A 65 -23.334 -3.559 -25.971 1.00 0.00 C ATOM 975 C LEU A 65 -24.156 -4.841 -26.057 1.00 0.00 C ATOM 976 O LEU A 65 -25.062 -4.955 -26.884 1.00 0.00 O ATOM 977 CB LEU A 65 -21.984 -3.766 -26.660 1.00 0.00 C ATOM 978 CG LEU A 65 -21.364 -2.407 -26.998 1.00 0.00 C ATOM 979 CD1 LEU A 65 -22.066 -1.814 -28.221 1.00 0.00 C ATOM 980 CD2 LEU A 65 -21.527 -1.459 -25.807 1.00 0.00 C ATOM 0 H LEU A 65 -22.249 -3.512 -24.177 1.00 0.00 H new ATOM 0 HA LEU A 65 -23.877 -2.758 -26.472 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -21.315 -4.330 -26.010 1.00 0.00 H new ATOM 0 HB3 LEU A 65 -22.115 -4.353 -27.569 1.00 0.00 H new ATOM 0 HG LEU A 65 -20.304 -2.538 -27.216 1.00 0.00 H new ATOM 0 HD11 LEU A 65 -21.624 -0.847 -28.461 1.00 0.00 H new ATOM 0 HD12 LEU A 65 -21.948 -2.487 -29.070 1.00 0.00 H new ATOM 0 HD13 LEU A 65 -23.126 -1.685 -28.005 1.00 0.00 H new ATOM 0 HD21 LEU A 65 -21.085 -0.492 -26.048 1.00 0.00 H new ATOM 0 HD22 LEU A 65 -22.587 -1.329 -25.588 1.00 0.00 H new ATOM 0 HD23 LEU A 65 -21.025 -1.880 -24.936 1.00 0.00 H new ATOM 992 N GLY A 66 -23.834 -5.801 -25.196 1.00 0.00 N ATOM 993 CA GLY A 66 -24.549 -7.073 -25.182 1.00 0.00 C ATOM 994 C GLY A 66 -23.598 -8.228 -24.895 1.00 0.00 C ATOM 995 O GLY A 66 -22.451 -8.018 -24.499 1.00 0.00 O ATOM 0 H GLY A 66 -23.089 -5.724 -24.504 1.00 0.00 H new ATOM 0 HA2 GLY A 66 -25.333 -7.046 -24.425 1.00 0.00 H new ATOM 0 HA3 GLY A 66 -25.039 -7.230 -26.143 1.00 0.00 H new ATOM 999 N LEU A 67 -24.079 -9.451 -25.098 1.00 0.00 N ATOM 1000 CA LEU A 67 -23.260 -10.632 -24.857 1.00 0.00 C ATOM 1001 C LEU A 67 -22.775 -11.227 -26.175 1.00 0.00 C ATOM 1002 O LEU A 67 -23.454 -11.134 -27.198 1.00 0.00 O ATOM 1003 CB LEU A 67 -24.068 -11.681 -24.091 1.00 0.00 C ATOM 1004 CG LEU A 67 -23.134 -12.786 -23.595 1.00 0.00 C ATOM 1005 CD1 LEU A 67 -22.662 -12.458 -22.179 1.00 0.00 C ATOM 1006 CD2 LEU A 67 -23.884 -14.120 -23.586 1.00 0.00 C ATOM 0 H LEU A 67 -25.024 -9.648 -25.426 1.00 0.00 H new ATOM 0 HA LEU A 67 -22.395 -10.335 -24.265 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -24.579 -11.217 -23.247 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -24.838 -12.104 -24.736 1.00 0.00 H new ATOM 0 HG LEU A 67 -22.271 -12.857 -24.258 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -21.996 -13.246 -21.826 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -22.129 -11.507 -22.184 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -23.524 -12.387 -21.516 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -23.220 -14.909 -23.233 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -24.746 -14.048 -22.923 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -24.221 -14.355 -24.596 1.00 0.00 H new ATOM 1018 N GLU A 68 -21.598 -11.841 -26.142 1.00 0.00 N ATOM 1019 CA GLU A 68 -21.030 -12.451 -27.339 1.00 0.00 C ATOM 1020 C GLU A 68 -20.119 -13.616 -26.964 1.00 0.00 C ATOM 1021 O GLU A 68 -19.665 -14.301 -27.866 1.00 0.00 O ATOM 1022 CB GLU A 68 -20.234 -11.413 -28.130 1.00 0.00 C ATOM 1023 CG GLU A 68 -20.397 -11.677 -29.628 1.00 0.00 C ATOM 1024 CD GLU A 68 -21.677 -11.022 -30.136 1.00 0.00 C ATOM 1025 OE1 GLU A 68 -22.365 -10.411 -29.335 1.00 0.00 O ATOM 1026 OE2 GLU A 68 -21.951 -11.143 -31.319 1.00 0.00 O ATOM 1027 OXT GLU A 68 -19.888 -13.804 -25.781 1.00 0.00 O ATOM 0 H GLU A 68 -21.021 -11.930 -25.305 1.00 0.00 H new ATOM 0 HA GLU A 68 -21.847 -12.825 -27.955 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -20.583 -10.409 -27.887 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -19.180 -11.460 -27.854 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -19.537 -11.284 -30.171 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -20.429 -12.750 -29.815 1.00 0.00 H new TER 1034 GLU A 68