USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=16 USER MOD reduce.3.24.130724 removed 955 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 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -127:sc=-0.00313 (180deg=-0.587) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot -140:sc= 0.0668 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -161:sc= -0.0491 (180deg=-0.569) USER MOD Single : A 30 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HE2:sc= -2.48 K(o=-2.5,f=-5.7!) USER MOD Single : A 39 THR OG1 : rot 70:sc= -2.09! USER MOD Single : A 48 CYS SG : rot 12:sc= -2.25! USER MOD Single : A 49 ASN : amide:sc= -0.29 X(o=-0.29,f=-0.27) USER MOD Single : A 54 GLN : amide:sc= -0.0338 X(o=-0.034,f=0) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 HIS : no HD1:sc= -5.14! C(o=-5.1!,f=-1.6!) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.123 K(o=-0.12,f=1.2) USER MOD Single : A 92 HIS : no HD1:sc= -4.54 X(o=-4.5,f=-4.1!) USER MOD Single : A 99 GLN : amide:sc= 0 X(o=0,f=-0.00013) USER MOD Single : A 102 CYS SG : rot 180:sc= -0.941 USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc=-0.00223 X(o=-0.0022,f=-0.23) USER MOD Single : A 113 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 THR OG1 : rot -32:sc= 0.45 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0.0853 USER MOD Single : A 125 TYR OH : rot 60:sc= 0.6 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 76.784 23.190 -22.785 1.00 1.00 N ATOM 2 CA MET A 1 77.157 21.748 -22.922 1.00 1.00 C ATOM 3 C MET A 1 75.944 20.870 -22.610 1.00 1.00 C ATOM 4 O MET A 1 74.948 21.339 -22.054 1.00 1.00 O ATOM 5 CB MET A 1 78.290 21.414 -21.944 1.00 1.00 C ATOM 6 CG MET A 1 79.565 22.172 -22.325 1.00 1.00 C ATOM 7 SD MET A 1 80.285 21.453 -23.823 1.00 1.00 S ATOM 8 CE MET A 1 81.951 22.139 -23.627 1.00 1.00 C ATOM 0 H1 MET A 1 77.040 23.699 -23.655 1.00 1.00 H new ATOM 0 H2 MET A 1 75.759 23.270 -22.626 1.00 1.00 H new ATOM 0 H3 MET A 1 77.293 23.605 -21.979 1.00 1.00 H new ATOM 0 HA MET A 1 77.489 21.560 -23.943 1.00 1.00 H new ATOM 0 HB2 MET A 1 77.992 21.677 -20.929 1.00 1.00 H new ATOM 0 HB3 MET A 1 78.481 20.341 -21.952 1.00 1.00 H new ATOM 0 HG2 MET A 1 79.337 23.225 -22.490 1.00 1.00 H new ATOM 0 HG3 MET A 1 80.284 22.126 -21.507 1.00 1.00 H new ATOM 0 HE1 MET A 1 82.578 21.816 -24.458 1.00 1.00 H new ATOM 0 HE2 MET A 1 81.897 23.228 -23.615 1.00 1.00 H new ATOM 0 HE3 MET A 1 82.382 21.786 -22.690 1.00 1.00 H new ATOM 18 N SER A 2 76.039 19.591 -22.978 1.00 1.00 N ATOM 19 CA SER A 2 74.964 18.616 -22.753 1.00 1.00 C ATOM 20 C SER A 2 75.337 17.662 -21.619 1.00 1.00 C ATOM 21 O SER A 2 74.644 16.675 -21.382 1.00 1.00 O ATOM 22 CB SER A 2 74.709 17.811 -24.029 1.00 1.00 C ATOM 23 OG SER A 2 75.866 17.047 -24.343 1.00 1.00 O ATOM 0 H SER A 2 76.860 19.200 -23.440 1.00 1.00 H new ATOM 0 HA SER A 2 74.060 19.160 -22.479 1.00 1.00 H new ATOM 0 HB2 SER A 2 73.851 17.153 -23.892 1.00 1.00 H new ATOM 0 HB3 SER A 2 74.468 18.482 -24.854 1.00 1.00 H new ATOM 0 HG SER A 2 75.704 16.529 -25.159 1.00 1.00 H new ATOM 29 N ASP A 3 76.428 17.981 -20.921 1.00 1.00 N ATOM 30 CA ASP A 3 76.896 17.164 -19.797 1.00 1.00 C ATOM 31 C ASP A 3 78.325 17.559 -19.406 1.00 1.00 C ATOM 32 O ASP A 3 79.295 17.099 -20.009 1.00 1.00 O ATOM 33 CB ASP A 3 76.825 15.661 -20.156 1.00 1.00 C ATOM 34 CG ASP A 3 77.769 14.833 -19.285 1.00 1.00 C ATOM 35 OD1 ASP A 3 77.355 14.433 -18.210 1.00 1.00 O ATOM 36 OD2 ASP A 3 78.893 14.615 -19.709 1.00 1.00 O ATOM 0 H ASP A 3 77.005 18.800 -21.113 1.00 1.00 H new ATOM 0 HA ASP A 3 76.244 17.344 -18.942 1.00 1.00 H new ATOM 0 HB2 ASP A 3 75.803 15.303 -20.029 1.00 1.00 H new ATOM 0 HB3 ASP A 3 77.083 15.524 -21.206 1.00 1.00 H new ATOM 41 N PHE A 4 78.439 18.411 -18.386 1.00 1.00 N ATOM 42 CA PHE A 4 79.746 18.863 -17.900 1.00 1.00 C ATOM 43 C PHE A 4 79.678 19.151 -16.407 1.00 1.00 C ATOM 44 O PHE A 4 78.655 19.616 -15.904 1.00 1.00 O ATOM 45 CB PHE A 4 80.183 20.133 -18.633 1.00 1.00 C ATOM 46 CG PHE A 4 81.550 20.548 -18.134 1.00 1.00 C ATOM 47 CD1 PHE A 4 82.681 19.819 -18.519 1.00 1.00 C ATOM 48 CD2 PHE A 4 81.688 21.654 -17.284 1.00 1.00 C ATOM 49 CE1 PHE A 4 83.949 20.194 -18.058 1.00 1.00 C ATOM 50 CE2 PHE A 4 82.957 22.031 -16.823 1.00 1.00 C ATOM 51 CZ PHE A 4 84.087 21.299 -17.209 1.00 1.00 C ATOM 0 H PHE A 4 77.644 18.802 -17.880 1.00 1.00 H new ATOM 0 HA PHE A 4 80.471 18.071 -18.090 1.00 1.00 H new ATOM 0 HB2 PHE A 4 80.213 19.955 -19.708 1.00 1.00 H new ATOM 0 HB3 PHE A 4 79.462 20.932 -18.462 1.00 1.00 H new ATOM 0 HD1 PHE A 4 82.576 18.966 -19.173 1.00 1.00 H new ATOM 0 HD2 PHE A 4 80.816 22.216 -16.984 1.00 1.00 H new ATOM 0 HE1 PHE A 4 84.821 19.631 -18.357 1.00 1.00 H new ATOM 0 HE2 PHE A 4 83.063 22.885 -16.171 1.00 1.00 H new ATOM 0 HZ PHE A 4 85.065 21.587 -16.852 1.00 1.00 H new ATOM 61 N ASP A 5 80.767 18.869 -15.698 1.00 1.00 N ATOM 62 CA ASP A 5 80.817 19.098 -14.258 1.00 1.00 C ATOM 63 C ASP A 5 82.263 19.330 -13.815 1.00 1.00 C ATOM 64 O ASP A 5 83.192 18.784 -14.408 1.00 1.00 O ATOM 65 CB ASP A 5 80.244 17.874 -13.540 1.00 1.00 C ATOM 66 CG ASP A 5 80.757 16.600 -14.201 1.00 1.00 C ATOM 67 OD1 ASP A 5 81.703 16.694 -14.966 1.00 1.00 O ATOM 68 OD2 ASP A 5 80.198 15.549 -13.933 1.00 1.00 O ATOM 0 H ASP A 5 81.623 18.483 -16.095 1.00 1.00 H new ATOM 0 HA ASP A 5 80.229 19.981 -14.008 1.00 1.00 H new ATOM 0 HB2 ASP A 5 80.531 17.890 -12.489 1.00 1.00 H new ATOM 0 HB3 ASP A 5 79.155 17.898 -13.573 1.00 1.00 H new ATOM 73 N THR A 6 82.453 20.141 -12.777 1.00 1.00 N ATOM 74 CA THR A 6 83.804 20.415 -12.292 1.00 1.00 C ATOM 75 C THR A 6 84.380 19.167 -11.605 1.00 1.00 C ATOM 76 O THR A 6 83.730 18.149 -11.518 1.00 1.00 O ATOM 77 CB THR A 6 83.806 21.628 -11.325 1.00 1.00 C ATOM 78 OG1 THR A 6 82.679 22.449 -11.599 1.00 1.00 O ATOM 79 CG2 THR A 6 85.088 22.462 -11.490 1.00 1.00 C ATOM 0 H THR A 6 81.707 20.611 -12.265 1.00 1.00 H new ATOM 0 HA THR A 6 84.436 20.666 -13.144 1.00 1.00 H new ATOM 0 HB THR A 6 83.763 21.254 -10.302 1.00 1.00 H new ATOM 0 HG1 THR A 6 82.938 23.392 -11.536 1.00 1.00 H new ATOM 0 HG21 THR A 6 85.064 23.306 -10.801 1.00 1.00 H new ATOM 0 HG22 THR A 6 85.957 21.841 -11.273 1.00 1.00 H new ATOM 0 HG23 THR A 6 85.153 22.831 -12.514 1.00 1.00 H new ATOM 87 N GLU A 7 85.620 19.267 -11.174 1.00 1.00 N ATOM 88 CA GLU A 7 86.322 18.150 -10.527 1.00 1.00 C ATOM 89 C GLU A 7 85.565 17.720 -9.274 1.00 1.00 C ATOM 90 O GLU A 7 85.223 16.557 -9.099 1.00 1.00 O ATOM 91 CB GLU A 7 87.744 18.594 -10.138 1.00 1.00 C ATOM 92 CG GLU A 7 88.479 17.466 -9.390 1.00 1.00 C ATOM 93 CD GLU A 7 88.157 17.507 -7.895 1.00 1.00 C ATOM 94 OE1 GLU A 7 88.791 18.277 -7.193 1.00 1.00 O ATOM 95 OE2 GLU A 7 87.288 16.765 -7.474 1.00 1.00 O ATOM 0 H GLU A 7 86.178 20.117 -11.256 1.00 1.00 H new ATOM 0 HA GLU A 7 86.377 17.311 -11.220 1.00 1.00 H new ATOM 0 HB2 GLU A 7 88.303 18.868 -11.033 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.694 19.483 -9.509 1.00 1.00 H new ATOM 0 HG2 GLU A 7 88.188 16.500 -9.803 1.00 1.00 H new ATOM 0 HG3 GLU A 7 89.554 17.566 -9.538 1.00 1.00 H new ATOM 102 N ARG A 8 85.347 18.681 -8.398 1.00 1.00 N ATOM 103 CA ARG A 8 84.663 18.377 -7.136 1.00 1.00 C ATOM 104 C ARG A 8 83.361 17.628 -7.480 1.00 1.00 C ATOM 105 O ARG A 8 83.103 16.528 -7.013 1.00 1.00 O ATOM 106 CB ARG A 8 84.303 19.677 -6.366 1.00 1.00 C ATOM 107 CG ARG A 8 84.927 20.908 -7.030 1.00 1.00 C ATOM 108 CD ARG A 8 84.365 22.157 -6.346 1.00 1.00 C ATOM 109 NE ARG A 8 82.919 22.240 -6.567 1.00 1.00 N ATOM 110 CZ ARG A 8 82.421 22.718 -7.704 1.00 1.00 C ATOM 111 NH1 ARG A 8 83.226 23.079 -8.664 1.00 1.00 N ATOM 112 NH2 ARG A 8 81.127 22.819 -7.867 1.00 1.00 N ATOM 0 H ARG A 8 85.621 19.656 -8.521 1.00 1.00 H new ATOM 0 HA ARG A 8 85.319 17.777 -6.505 1.00 1.00 H new ATOM 0 HB2 ARG A 8 83.220 19.792 -6.328 1.00 1.00 H new ATOM 0 HB3 ARG A 8 84.652 19.601 -5.336 1.00 1.00 H new ATOM 0 HG2 ARG A 8 86.013 20.880 -6.938 1.00 1.00 H new ATOM 0 HG3 ARG A 8 84.698 20.922 -8.096 1.00 1.00 H new ATOM 0 HD2 ARG A 8 84.577 22.123 -5.277 1.00 1.00 H new ATOM 0 HD3 ARG A 8 84.853 23.048 -6.740 1.00 1.00 H new ATOM 0 HE ARG A 8 82.282 21.925 -5.835 1.00 1.00 H new ATOM 0 HH11 ARG A 8 84.235 22.995 -8.542 1.00 1.00 H new ATOM 0 HH12 ARG A 8 82.847 23.446 -9.537 1.00 1.00 H new ATOM 0 HH21 ARG A 8 80.495 22.531 -7.120 1.00 1.00 H new ATOM 0 HH22 ARG A 8 80.750 23.186 -8.741 1.00 1.00 H new ATOM 126 N VAL A 9 82.561 18.288 -8.289 1.00 1.00 N ATOM 127 CA VAL A 9 81.273 17.717 -8.688 1.00 1.00 C ATOM 128 C VAL A 9 81.497 16.449 -9.561 1.00 1.00 C ATOM 129 O VAL A 9 80.911 15.419 -9.310 1.00 1.00 O ATOM 130 CB VAL A 9 80.348 18.773 -9.351 1.00 1.00 C ATOM 131 CG1 VAL A 9 78.971 18.758 -8.671 1.00 1.00 C ATOM 132 CG2 VAL A 9 80.940 20.173 -9.181 1.00 1.00 C ATOM 0 H VAL A 9 82.766 19.206 -8.683 1.00 1.00 H new ATOM 0 HA VAL A 9 80.738 17.398 -7.793 1.00 1.00 H new ATOM 0 HB VAL A 9 80.255 18.530 -10.409 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.326 19.501 -9.140 1.00 1.00 H new ATOM 0 HG12 VAL A 9 78.524 17.770 -8.777 1.00 1.00 H new ATOM 0 HG13 VAL A 9 79.085 18.993 -7.613 1.00 1.00 H new ATOM 0 HG21 VAL A 9 80.283 20.905 -9.650 1.00 1.00 H new ATOM 0 HG22 VAL A 9 81.038 20.400 -8.119 1.00 1.00 H new ATOM 0 HG23 VAL A 9 81.922 20.212 -9.652 1.00 1.00 H new ATOM 142 N SER A 10 82.370 16.542 -10.556 1.00 1.00 N ATOM 143 CA SER A 10 82.659 15.369 -11.430 1.00 1.00 C ATOM 144 C SER A 10 83.271 14.222 -10.591 1.00 1.00 C ATOM 145 O SER A 10 82.783 13.106 -10.603 1.00 1.00 O ATOM 146 CB SER A 10 83.625 15.746 -12.560 1.00 1.00 C ATOM 147 OG SER A 10 83.798 14.628 -13.421 1.00 1.00 O ATOM 0 H SER A 10 82.889 17.388 -10.790 1.00 1.00 H new ATOM 0 HA SER A 10 81.719 15.040 -11.873 1.00 1.00 H new ATOM 0 HB2 SER A 10 83.234 16.595 -13.121 1.00 1.00 H new ATOM 0 HB3 SER A 10 84.585 16.053 -12.146 1.00 1.00 H new ATOM 0 HG SER A 10 84.414 14.865 -14.146 1.00 1.00 H new ATOM 153 N ARG A 11 84.402 14.476 -9.953 1.00 1.00 N ATOM 154 CA ARG A 11 85.081 13.421 -9.178 1.00 1.00 C ATOM 155 C ARG A 11 84.219 13.005 -7.963 1.00 1.00 C ATOM 156 O ARG A 11 83.916 11.838 -7.786 1.00 1.00 O ATOM 157 CB ARG A 11 86.474 13.906 -8.742 1.00 1.00 C ATOM 158 CG ARG A 11 87.279 12.765 -8.087 1.00 1.00 C ATOM 159 CD ARG A 11 87.985 11.907 -9.151 1.00 1.00 C ATOM 160 NE ARG A 11 88.976 12.692 -9.880 1.00 1.00 N ATOM 161 CZ ARG A 11 89.668 12.156 -10.885 1.00 1.00 C ATOM 162 NH1 ARG A 11 89.436 10.925 -11.250 1.00 1.00 N ATOM 163 NH2 ARG A 11 90.571 12.861 -11.511 1.00 1.00 N ATOM 0 H ARG A 11 84.871 15.382 -9.948 1.00 1.00 H new ATOM 0 HA ARG A 11 85.211 12.540 -9.807 1.00 1.00 H new ATOM 0 HB2 ARG A 11 87.017 14.288 -9.607 1.00 1.00 H new ATOM 0 HB3 ARG A 11 86.371 14.733 -8.039 1.00 1.00 H new ATOM 0 HG2 ARG A 11 88.018 13.183 -7.403 1.00 1.00 H new ATOM 0 HG3 ARG A 11 86.613 12.139 -7.494 1.00 1.00 H new ATOM 0 HD2 ARG A 11 88.469 11.055 -8.674 1.00 1.00 H new ATOM 0 HD3 ARG A 11 87.249 11.506 -9.848 1.00 1.00 H new ATOM 0 HE ARG A 11 89.141 13.664 -9.617 1.00 1.00 H new ATOM 0 HH11 ARG A 11 88.726 10.375 -10.766 1.00 1.00 H new ATOM 0 HH12 ARG A 11 89.964 10.513 -12.019 1.00 1.00 H new ATOM 0 HH21 ARG A 11 90.749 13.826 -11.231 1.00 1.00 H new ATOM 0 HH22 ARG A 11 91.099 12.447 -12.280 1.00 1.00 H new ATOM 177 N ALA A 12 83.844 13.963 -7.127 1.00 1.00 N ATOM 178 CA ALA A 12 83.039 13.584 -5.943 1.00 1.00 C ATOM 179 C ALA A 12 81.864 12.735 -6.443 1.00 1.00 C ATOM 180 O ALA A 12 81.663 11.613 -5.994 1.00 1.00 O ATOM 181 CB ALA A 12 82.504 14.775 -5.135 1.00 1.00 C ATOM 0 H ALA A 12 84.061 14.955 -7.222 1.00 1.00 H new ATOM 0 HA ALA A 12 83.690 13.039 -5.260 1.00 1.00 H new ATOM 0 HB1 ALA A 12 81.926 14.409 -4.286 1.00 1.00 H new ATOM 0 HB2 ALA A 12 83.340 15.374 -4.773 1.00 1.00 H new ATOM 0 HB3 ALA A 12 81.866 15.389 -5.771 1.00 1.00 H new ATOM 187 N VAL A 13 81.133 13.256 -7.424 1.00 1.00 N ATOM 188 CA VAL A 13 80.042 12.452 -7.959 1.00 1.00 C ATOM 189 C VAL A 13 80.628 11.185 -8.596 1.00 1.00 C ATOM 190 O VAL A 13 80.194 10.115 -8.274 1.00 1.00 O ATOM 191 CB VAL A 13 79.072 13.176 -8.935 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.669 14.573 -8.394 1.00 1.00 C ATOM 193 CG2 VAL A 13 79.678 13.266 -10.346 1.00 1.00 C ATOM 0 H VAL A 13 81.263 14.176 -7.844 1.00 1.00 H new ATOM 0 HA VAL A 13 79.404 12.211 -7.109 1.00 1.00 H new ATOM 0 HB VAL A 13 78.160 12.583 -9.006 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.991 15.054 -9.098 1.00 1.00 H new ATOM 0 HG12 VAL A 13 78.172 14.461 -7.431 1.00 1.00 H new ATOM 0 HG13 VAL A 13 79.561 15.187 -8.272 1.00 1.00 H new ATOM 0 HG21 VAL A 13 78.980 13.776 -11.010 1.00 1.00 H new ATOM 0 HG22 VAL A 13 80.614 13.823 -10.305 1.00 1.00 H new ATOM 0 HG23 VAL A 13 79.870 12.262 -10.724 1.00 1.00 H new ATOM 203 N ALA A 14 81.647 11.264 -9.447 1.00 1.00 N ATOM 204 CA ALA A 14 82.173 10.002 -10.004 1.00 1.00 C ATOM 205 C ALA A 14 82.604 9.075 -8.862 1.00 1.00 C ATOM 206 O ALA A 14 82.095 7.984 -8.734 1.00 1.00 O ATOM 207 CB ALA A 14 83.367 10.249 -10.942 1.00 1.00 C ATOM 0 H ALA A 14 82.106 12.121 -9.756 1.00 1.00 H new ATOM 0 HA ALA A 14 81.378 9.536 -10.586 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.726 9.297 -11.332 1.00 1.00 H new ATOM 0 HB2 ALA A 14 83.054 10.885 -11.770 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.168 10.740 -10.390 1.00 1.00 H new ATOM 213 N ALA A 15 83.573 9.513 -8.077 1.00 1.00 N ATOM 214 CA ALA A 15 84.098 8.679 -6.979 1.00 1.00 C ATOM 215 C ALA A 15 82.953 8.200 -6.083 1.00 1.00 C ATOM 216 O ALA A 15 82.777 7.009 -5.848 1.00 1.00 O ATOM 217 CB ALA A 15 85.081 9.489 -6.123 1.00 1.00 C ATOM 0 H ALA A 15 84.016 10.427 -8.167 1.00 1.00 H new ATOM 0 HA ALA A 15 84.607 7.821 -7.418 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.462 8.863 -5.316 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.911 9.826 -6.743 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.569 10.354 -5.701 1.00 1.00 H new ATOM 223 N ALA A 16 82.208 9.160 -5.589 1.00 1.00 N ATOM 224 CA ALA A 16 81.092 8.841 -4.708 1.00 1.00 C ATOM 225 C ALA A 16 80.061 8.001 -5.488 1.00 1.00 C ATOM 226 O ALA A 16 79.643 6.932 -5.053 1.00 1.00 O ATOM 227 CB ALA A 16 80.460 10.133 -4.169 1.00 1.00 C ATOM 0 H ALA A 16 82.344 10.154 -5.773 1.00 1.00 H new ATOM 0 HA ALA A 16 81.445 8.262 -3.855 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.627 9.884 -3.512 1.00 1.00 H new ATOM 0 HB2 ALA A 16 81.207 10.698 -3.611 1.00 1.00 H new ATOM 0 HB3 ALA A 16 80.097 10.736 -5.002 1.00 1.00 H new ATOM 233 N LEU A 17 79.641 8.552 -6.615 1.00 1.00 N ATOM 234 CA LEU A 17 78.607 7.872 -7.422 1.00 1.00 C ATOM 235 C LEU A 17 79.102 6.461 -7.771 1.00 1.00 C ATOM 236 O LEU A 17 78.416 5.478 -7.505 1.00 1.00 O ATOM 237 CB LEU A 17 78.250 8.609 -8.721 1.00 1.00 C ATOM 238 CG LEU A 17 77.036 7.947 -9.391 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.752 8.234 -8.590 1.00 1.00 C ATOM 240 CD2 LEU A 17 76.901 8.499 -10.813 1.00 1.00 C ATOM 0 H LEU A 17 79.978 9.437 -6.994 1.00 1.00 H new ATOM 0 HA LEU A 17 77.701 7.848 -6.817 1.00 1.00 H new ATOM 0 HB2 LEU A 17 78.030 9.655 -8.506 1.00 1.00 H new ATOM 0 HB3 LEU A 17 79.102 8.596 -9.401 1.00 1.00 H new ATOM 0 HG LEU A 17 77.181 6.867 -9.421 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.903 7.757 -9.080 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.857 7.838 -7.580 1.00 1.00 H new ATOM 0 HD13 LEU A 17 75.586 9.310 -8.542 1.00 1.00 H new ATOM 0 HD21 LEU A 17 76.043 8.038 -11.302 1.00 1.00 H new ATOM 0 HD22 LEU A 17 76.759 9.579 -10.772 1.00 1.00 H new ATOM 0 HD23 LEU A 17 77.805 8.273 -11.378 1.00 1.00 H new ATOM 252 N VAL A 18 80.294 6.362 -8.363 1.00 1.00 N ATOM 253 CA VAL A 18 80.819 5.040 -8.711 1.00 1.00 C ATOM 254 C VAL A 18 81.157 4.278 -7.423 1.00 1.00 C ATOM 255 O VAL A 18 80.683 3.160 -7.211 1.00 1.00 O ATOM 256 CB VAL A 18 82.039 5.125 -9.681 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.793 6.188 -10.794 1.00 1.00 C ATOM 258 CG2 VAL A 18 83.354 5.436 -8.929 1.00 1.00 C ATOM 0 H VAL A 18 80.895 7.150 -8.605 1.00 1.00 H new ATOM 0 HA VAL A 18 80.051 4.490 -9.255 1.00 1.00 H new ATOM 0 HB VAL A 18 82.144 4.145 -10.146 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.658 6.228 -11.457 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.908 5.915 -11.368 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.641 7.166 -10.336 1.00 1.00 H new ATOM 0 HG21 VAL A 18 84.177 5.486 -9.641 1.00 1.00 H new ATOM 0 HG22 VAL A 18 83.261 6.392 -8.414 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.552 4.649 -8.201 1.00 1.00 H new ATOM 268 N GLY A 19 82.003 4.879 -6.586 1.00 1.00 N ATOM 269 CA GLY A 19 82.443 4.267 -5.336 1.00 1.00 C ATOM 270 C GLY A 19 81.305 4.075 -4.339 1.00 1.00 C ATOM 271 O GLY A 19 80.129 4.132 -4.698 1.00 1.00 O ATOM 0 H GLY A 19 82.401 5.802 -6.757 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.899 3.300 -5.551 1.00 1.00 H new ATOM 0 HA3 GLY A 19 83.215 4.890 -4.884 1.00 1.00 H new ATOM 275 N PRO A 20 81.638 3.815 -3.097 1.00 1.00 N ATOM 276 CA PRO A 20 80.642 3.577 -2.023 1.00 1.00 C ATOM 277 C PRO A 20 80.075 4.877 -1.453 1.00 1.00 C ATOM 278 O PRO A 20 79.001 4.881 -0.886 1.00 1.00 O ATOM 279 CB PRO A 20 81.426 2.781 -0.947 1.00 1.00 C ATOM 280 CG PRO A 20 82.866 2.749 -1.404 1.00 1.00 C ATOM 281 CD PRO A 20 82.999 3.742 -2.556 1.00 1.00 C ATOM 0 HA PRO A 20 79.770 3.038 -2.394 1.00 1.00 H new ATOM 0 HB2 PRO A 20 81.339 3.258 0.029 1.00 1.00 H new ATOM 0 HB3 PRO A 20 81.029 1.771 -0.845 1.00 1.00 H new ATOM 0 HG2 PRO A 20 83.535 3.017 -0.586 1.00 1.00 H new ATOM 0 HG3 PRO A 20 83.144 1.746 -1.727 1.00 1.00 H new ATOM 0 HD2 PRO A 20 83.347 4.715 -2.210 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.712 3.396 -3.305 1.00 1.00 H new ATOM 289 N GLY A 21 80.841 5.954 -1.553 1.00 1.00 N ATOM 290 CA GLY A 21 80.391 7.218 -0.962 1.00 1.00 C ATOM 291 C GLY A 21 79.036 7.640 -1.539 1.00 1.00 C ATOM 292 O GLY A 21 78.060 7.825 -0.811 1.00 1.00 O ATOM 0 H GLY A 21 81.747 5.987 -2.020 1.00 1.00 H new ATOM 0 HA2 GLY A 21 80.312 7.111 0.120 1.00 1.00 H new ATOM 0 HA3 GLY A 21 81.130 7.996 -1.152 1.00 1.00 H new ATOM 296 N GLY A 22 79.013 7.803 -2.845 1.00 1.00 N ATOM 297 CA GLY A 22 77.774 8.230 -3.511 1.00 1.00 C ATOM 298 C GLY A 22 76.729 7.178 -3.274 1.00 1.00 C ATOM 299 O GLY A 22 75.642 7.468 -2.787 1.00 1.00 O ATOM 0 H GLY A 22 79.810 7.654 -3.464 1.00 1.00 H new ATOM 0 HA2 GLY A 22 77.442 9.191 -3.118 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.943 8.364 -4.579 1.00 1.00 H new ATOM 303 N VAL A 23 77.073 5.952 -3.627 1.00 1.00 N ATOM 304 CA VAL A 23 76.143 4.850 -3.450 1.00 1.00 C ATOM 305 C VAL A 23 75.715 4.783 -1.976 1.00 1.00 C ATOM 306 O VAL A 23 74.558 4.513 -1.675 1.00 1.00 O ATOM 307 CB VAL A 23 76.780 3.523 -3.924 1.00 1.00 C ATOM 308 CG1 VAL A 23 75.987 2.332 -3.374 1.00 1.00 C ATOM 309 CG2 VAL A 23 76.755 3.462 -5.463 1.00 1.00 C ATOM 0 H VAL A 23 77.974 5.696 -4.031 1.00 1.00 H new ATOM 0 HA VAL A 23 75.255 5.014 -4.060 1.00 1.00 H new ATOM 0 HB VAL A 23 77.807 3.478 -3.561 1.00 1.00 H new ATOM 0 HG11 VAL A 23 76.444 1.403 -3.714 1.00 1.00 H new ATOM 0 HG12 VAL A 23 75.994 2.363 -2.284 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.959 2.383 -3.732 1.00 1.00 H new ATOM 0 HG21 VAL A 23 77.204 2.527 -5.797 1.00 1.00 H new ATOM 0 HG22 VAL A 23 75.724 3.515 -5.813 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.319 4.301 -5.870 1.00 1.00 H new ATOM 319 N ALA A 24 76.664 5.034 -1.075 1.00 1.00 N ATOM 320 CA ALA A 24 76.331 4.977 0.352 1.00 1.00 C ATOM 321 C ALA A 24 75.236 5.995 0.703 1.00 1.00 C ATOM 322 O ALA A 24 74.184 5.606 1.208 1.00 1.00 O ATOM 323 CB ALA A 24 77.558 5.215 1.244 1.00 1.00 C ATOM 0 H ALA A 24 77.632 5.270 -1.292 1.00 1.00 H new ATOM 0 HA ALA A 24 75.963 3.969 0.544 1.00 1.00 H new ATOM 0 HB1 ALA A 24 77.262 5.163 2.292 1.00 1.00 H new ATOM 0 HB2 ALA A 24 78.309 4.451 1.041 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.976 6.200 1.033 1.00 1.00 H new ATOM 329 N LEU A 25 75.485 7.293 0.502 1.00 1.00 N ATOM 330 CA LEU A 25 74.497 8.310 0.882 1.00 1.00 C ATOM 331 C LEU A 25 73.195 8.214 0.096 1.00 1.00 C ATOM 332 O LEU A 25 72.115 8.303 0.682 1.00 1.00 O ATOM 333 CB LEU A 25 75.093 9.712 0.675 1.00 1.00 C ATOM 334 CG LEU A 25 76.260 9.944 1.660 1.00 1.00 C ATOM 335 CD1 LEU A 25 77.231 10.984 1.084 1.00 1.00 C ATOM 336 CD2 LEU A 25 75.726 10.460 3.003 1.00 1.00 C ATOM 0 H LEU A 25 76.342 7.660 0.088 1.00 1.00 H new ATOM 0 HA LEU A 25 74.259 8.130 1.930 1.00 1.00 H new ATOM 0 HB2 LEU A 25 75.446 9.818 -0.351 1.00 1.00 H new ATOM 0 HB3 LEU A 25 74.323 10.469 0.826 1.00 1.00 H new ATOM 0 HG LEU A 25 76.777 8.996 1.811 1.00 1.00 H new ATOM 0 HD11 LEU A 25 78.051 11.143 1.784 1.00 1.00 H new ATOM 0 HD12 LEU A 25 77.628 10.624 0.135 1.00 1.00 H new ATOM 0 HD13 LEU A 25 76.704 11.924 0.924 1.00 1.00 H new ATOM 0 HD21 LEU A 25 76.558 10.620 3.688 1.00 1.00 H new ATOM 0 HD22 LEU A 25 75.199 11.401 2.847 1.00 1.00 H new ATOM 0 HD23 LEU A 25 75.041 9.726 3.428 1.00 1.00 H new ATOM 348 N VAL A 26 73.280 8.078 -1.221 1.00 1.00 N ATOM 349 CA VAL A 26 72.055 8.035 -2.002 1.00 1.00 C ATOM 350 C VAL A 26 71.205 6.837 -1.588 1.00 1.00 C ATOM 351 O VAL A 26 70.043 7.008 -1.225 1.00 1.00 O ATOM 352 CB VAL A 26 72.375 7.996 -3.509 1.00 1.00 C ATOM 353 CG1 VAL A 26 73.257 9.204 -3.862 1.00 1.00 C ATOM 354 CG2 VAL A 26 73.103 6.685 -3.869 1.00 1.00 C ATOM 0 H VAL A 26 74.147 7.999 -1.752 1.00 1.00 H new ATOM 0 HA VAL A 26 71.482 8.941 -1.806 1.00 1.00 H new ATOM 0 HB VAL A 26 71.447 8.039 -4.079 1.00 1.00 H new ATOM 0 HG11 VAL A 26 73.489 9.186 -4.927 1.00 1.00 H new ATOM 0 HG12 VAL A 26 72.726 10.125 -3.622 1.00 1.00 H new ATOM 0 HG13 VAL A 26 74.182 9.159 -3.288 1.00 1.00 H new ATOM 0 HG21 VAL A 26 73.322 6.672 -4.937 1.00 1.00 H new ATOM 0 HG22 VAL A 26 74.034 6.620 -3.306 1.00 1.00 H new ATOM 0 HG23 VAL A 26 72.468 5.835 -3.619 1.00 1.00 H new ATOM 364 N VAL A 27 71.739 5.623 -1.688 1.00 1.00 N ATOM 365 CA VAL A 27 70.962 4.432 -1.363 1.00 1.00 C ATOM 366 C VAL A 27 70.536 4.394 0.101 1.00 1.00 C ATOM 367 O VAL A 27 69.441 3.939 0.423 1.00 1.00 O ATOM 368 CB VAL A 27 71.803 3.181 -1.717 1.00 1.00 C ATOM 369 CG1 VAL A 27 72.726 2.787 -0.549 1.00 1.00 C ATOM 370 CG2 VAL A 27 70.886 1.997 -2.054 1.00 1.00 C ATOM 0 H VAL A 27 72.696 5.439 -1.988 1.00 1.00 H new ATOM 0 HA VAL A 27 70.043 4.451 -1.949 1.00 1.00 H new ATOM 0 HB VAL A 27 72.415 3.429 -2.585 1.00 1.00 H new ATOM 0 HG11 VAL A 27 73.305 1.906 -0.824 1.00 1.00 H new ATOM 0 HG12 VAL A 27 73.403 3.611 -0.327 1.00 1.00 H new ATOM 0 HG13 VAL A 27 72.124 2.565 0.332 1.00 1.00 H new ATOM 0 HG21 VAL A 27 71.493 1.126 -2.301 1.00 1.00 H new ATOM 0 HG22 VAL A 27 70.256 1.769 -1.195 1.00 1.00 H new ATOM 0 HG23 VAL A 27 70.258 2.255 -2.907 1.00 1.00 H new ATOM 380 N LYS A 28 71.408 4.843 0.983 1.00 1.00 N ATOM 381 CA LYS A 28 71.084 4.813 2.393 1.00 1.00 C ATOM 382 C LYS A 28 69.960 5.794 2.650 1.00 1.00 C ATOM 383 O LYS A 28 68.929 5.457 3.230 1.00 1.00 O ATOM 384 CB LYS A 28 72.339 5.168 3.208 1.00 1.00 C ATOM 385 CG LYS A 28 72.057 5.103 4.727 1.00 1.00 C ATOM 386 CD LYS A 28 71.737 6.503 5.272 1.00 1.00 C ATOM 387 CE LYS A 28 71.526 6.423 6.783 1.00 1.00 C ATOM 388 NZ LYS A 28 70.380 5.516 7.067 1.00 1.00 N ATOM 0 H LYS A 28 72.326 5.225 0.755 1.00 1.00 H new ATOM 0 HA LYS A 28 70.755 3.819 2.697 1.00 1.00 H new ATOM 0 HB2 LYS A 28 73.146 4.480 2.956 1.00 1.00 H new ATOM 0 HB3 LYS A 28 72.678 6.169 2.941 1.00 1.00 H new ATOM 0 HG2 LYS A 28 71.221 4.431 4.920 1.00 1.00 H new ATOM 0 HG3 LYS A 28 72.923 4.692 5.247 1.00 1.00 H new ATOM 0 HD2 LYS A 28 72.552 7.189 5.043 1.00 1.00 H new ATOM 0 HD3 LYS A 28 70.843 6.898 4.789 1.00 1.00 H new ATOM 0 HE2 LYS A 28 72.428 6.053 7.270 1.00 1.00 H new ATOM 0 HE3 LYS A 28 71.330 7.416 7.188 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 70.024 5.697 8.027 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 69.621 5.690 6.378 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 70.694 4.527 6.995 1.00 1.00 H new ATOM 402 N VAL A 29 70.202 7.017 2.236 1.00 1.00 N ATOM 403 CA VAL A 29 69.222 8.077 2.451 1.00 1.00 C ATOM 404 C VAL A 29 67.941 7.774 1.691 1.00 1.00 C ATOM 405 O VAL A 29 66.849 7.873 2.248 1.00 1.00 O ATOM 406 CB VAL A 29 69.756 9.456 2.035 1.00 1.00 C ATOM 407 CG1 VAL A 29 68.634 10.491 2.189 1.00 1.00 C ATOM 408 CG2 VAL A 29 70.927 9.854 2.938 1.00 1.00 C ATOM 0 H VAL A 29 71.053 7.308 1.755 1.00 1.00 H new ATOM 0 HA VAL A 29 69.017 8.110 3.521 1.00 1.00 H new ATOM 0 HB VAL A 29 70.095 9.416 1.000 1.00 1.00 H new ATOM 0 HG11 VAL A 29 69.003 11.474 1.896 1.00 1.00 H new ATOM 0 HG12 VAL A 29 67.794 10.214 1.552 1.00 1.00 H new ATOM 0 HG13 VAL A 29 68.307 10.521 3.228 1.00 1.00 H new ATOM 0 HG21 VAL A 29 71.301 10.833 2.638 1.00 1.00 H new ATOM 0 HG22 VAL A 29 70.590 9.896 3.974 1.00 1.00 H new ATOM 0 HG23 VAL A 29 71.724 9.117 2.846 1.00 1.00 H new ATOM 418 N CYS A 30 68.059 7.423 0.418 1.00 1.00 N ATOM 419 CA CYS A 30 66.862 7.143 -0.354 1.00 1.00 C ATOM 420 C CYS A 30 66.157 5.919 0.208 1.00 1.00 C ATOM 421 O CYS A 30 64.984 5.990 0.576 1.00 1.00 O ATOM 422 CB CYS A 30 67.246 6.896 -1.824 1.00 1.00 C ATOM 423 SG CYS A 30 65.755 6.806 -2.852 1.00 1.00 S ATOM 0 H CYS A 30 68.940 7.328 -0.086 1.00 1.00 H new ATOM 0 HA CYS A 30 66.187 7.997 -0.295 1.00 1.00 H new ATOM 0 HB2 CYS A 30 67.893 7.698 -2.178 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.812 5.968 -1.909 1.00 1.00 H new ATOM 0 HG CYS A 30 66.093 6.599 -4.090 1.00 1.00 H new ATOM 428 N ALA A 31 66.835 4.781 0.203 1.00 1.00 N ATOM 429 CA ALA A 31 66.228 3.535 0.638 1.00 1.00 C ATOM 430 C ALA A 31 65.852 3.569 2.105 1.00 1.00 C ATOM 431 O ALA A 31 64.717 3.258 2.464 1.00 1.00 O ATOM 432 CB ALA A 31 67.215 2.385 0.358 1.00 1.00 C ATOM 0 H ALA A 31 67.806 4.696 -0.098 1.00 1.00 H new ATOM 0 HA ALA A 31 65.303 3.382 0.082 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.774 1.441 0.679 1.00 1.00 H new ATOM 0 HB2 ALA A 31 67.429 2.341 -0.710 1.00 1.00 H new ATOM 0 HB3 ALA A 31 68.141 2.558 0.907 1.00 1.00 H new ATOM 438 N GLY A 32 66.805 3.934 2.952 1.00 1.00 N ATOM 439 CA GLY A 32 66.554 3.983 4.383 1.00 1.00 C ATOM 440 C GLY A 32 66.845 2.622 5.011 1.00 1.00 C ATOM 441 O GLY A 32 65.922 1.888 5.351 1.00 1.00 O ATOM 0 H GLY A 32 67.750 4.198 2.675 1.00 1.00 H new ATOM 0 HA2 GLY A 32 67.180 4.747 4.844 1.00 1.00 H new ATOM 0 HA3 GLY A 32 65.518 4.265 4.569 1.00 1.00 H new ATOM 445 N LEU A 33 68.141 2.296 5.139 1.00 1.00 N ATOM 446 CA LEU A 33 68.590 1.013 5.714 1.00 1.00 C ATOM 447 C LEU A 33 68.386 -0.135 4.703 1.00 1.00 C ATOM 448 O LEU A 33 67.282 -0.301 4.202 1.00 1.00 O ATOM 449 CB LEU A 33 67.823 0.675 7.003 1.00 1.00 C ATOM 450 CG LEU A 33 67.818 1.872 7.961 1.00 1.00 C ATOM 451 CD1 LEU A 33 67.024 1.499 9.215 1.00 1.00 C ATOM 452 CD2 LEU A 33 69.263 2.234 8.339 1.00 1.00 C ATOM 0 H LEU A 33 68.904 2.908 4.850 1.00 1.00 H new ATOM 0 HA LEU A 33 69.649 1.120 5.948 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.798 0.394 6.759 1.00 1.00 H new ATOM 0 HB3 LEU A 33 68.282 -0.185 7.490 1.00 1.00 H new ATOM 0 HG LEU A 33 67.354 2.733 7.480 1.00 1.00 H new ATOM 0 HD11 LEU A 33 67.014 2.344 9.904 1.00 1.00 H new ATOM 0 HD12 LEU A 33 66.001 1.246 8.936 1.00 1.00 H new ATOM 0 HD13 LEU A 33 67.491 0.641 9.699 1.00 1.00 H new ATOM 0 HD21 LEU A 33 69.259 3.085 9.020 1.00 1.00 H new ATOM 0 HD22 LEU A 33 69.736 1.382 8.827 1.00 1.00 H new ATOM 0 HD23 LEU A 33 69.821 2.493 7.439 1.00 1.00 H new ATOM 464 N PRO A 34 69.405 -0.919 4.382 1.00 1.00 N ATOM 465 CA PRO A 34 69.271 -2.044 3.392 1.00 1.00 C ATOM 466 C PRO A 34 68.473 -3.262 3.902 1.00 1.00 C ATOM 467 O PRO A 34 68.120 -4.137 3.110 1.00 1.00 O ATOM 468 CB PRO A 34 70.731 -2.431 3.082 1.00 1.00 C ATOM 469 CG PRO A 34 71.514 -2.029 4.292 1.00 1.00 C ATOM 470 CD PRO A 34 70.786 -0.825 4.906 1.00 1.00 C ATOM 0 HA PRO A 34 68.698 -1.721 2.523 1.00 1.00 H new ATOM 0 HB2 PRO A 34 70.822 -3.501 2.892 1.00 1.00 H new ATOM 0 HB3 PRO A 34 71.093 -1.917 2.191 1.00 1.00 H new ATOM 0 HG2 PRO A 34 71.573 -2.851 5.006 1.00 1.00 H new ATOM 0 HG3 PRO A 34 72.537 -1.767 4.022 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.801 -0.866 5.995 1.00 1.00 H new ATOM 0 HD3 PRO A 34 71.257 0.114 4.616 1.00 1.00 H new ATOM 478 N GLY A 35 68.208 -3.344 5.207 1.00 1.00 N ATOM 479 CA GLY A 35 67.472 -4.518 5.692 1.00 1.00 C ATOM 480 C GLY A 35 66.108 -4.582 5.014 1.00 1.00 C ATOM 481 O GLY A 35 65.802 -5.546 4.312 1.00 1.00 O ATOM 0 H GLY A 35 68.472 -2.657 5.913 1.00 1.00 H new ATOM 0 HA2 GLY A 35 68.037 -5.426 5.482 1.00 1.00 H new ATOM 0 HA3 GLY A 35 67.350 -4.462 6.774 1.00 1.00 H new ATOM 485 N VAL A 36 65.303 -3.548 5.195 1.00 1.00 N ATOM 486 CA VAL A 36 63.997 -3.512 4.547 1.00 1.00 C ATOM 487 C VAL A 36 64.228 -3.107 3.096 1.00 1.00 C ATOM 488 O VAL A 36 65.265 -3.449 2.530 1.00 1.00 O ATOM 489 CB VAL A 36 63.065 -2.507 5.260 1.00 1.00 C ATOM 490 CG1 VAL A 36 61.602 -2.927 5.076 1.00 1.00 C ATOM 491 CG2 VAL A 36 63.389 -2.482 6.758 1.00 1.00 C ATOM 0 H VAL A 36 65.522 -2.736 5.773 1.00 1.00 H new ATOM 0 HA VAL A 36 63.512 -4.487 4.598 1.00 1.00 H new ATOM 0 HB VAL A 36 63.217 -1.518 4.829 1.00 1.00 H new ATOM 0 HG11 VAL A 36 60.952 -2.213 5.582 1.00 1.00 H new ATOM 0 HG12 VAL A 36 61.360 -2.948 4.013 1.00 1.00 H new ATOM 0 HG13 VAL A 36 61.452 -3.919 5.502 1.00 1.00 H new ATOM 0 HG21 VAL A 36 62.731 -1.773 7.261 1.00 1.00 H new ATOM 0 HG22 VAL A 36 63.240 -3.476 7.179 1.00 1.00 H new ATOM 0 HG23 VAL A 36 64.426 -2.179 6.901 1.00 1.00 H new ATOM 501 N ILE A 37 63.300 -2.357 2.512 1.00 1.00 N ATOM 502 CA ILE A 37 63.449 -1.874 1.137 1.00 1.00 C ATOM 503 C ILE A 37 63.175 -2.957 0.098 1.00 1.00 C ATOM 504 O ILE A 37 64.109 -3.499 -0.492 1.00 1.00 O ATOM 505 CB ILE A 37 64.870 -1.305 0.894 1.00 1.00 C ATOM 506 CG1 ILE A 37 65.350 -0.480 2.110 1.00 1.00 C ATOM 507 CG2 ILE A 37 64.869 -0.423 -0.371 1.00 1.00 C ATOM 508 CD1 ILE A 37 64.267 0.502 2.576 1.00 1.00 C ATOM 0 H ILE A 37 62.434 -2.068 2.967 1.00 1.00 H new ATOM 0 HA ILE A 37 62.705 -1.086 1.019 1.00 1.00 H new ATOM 0 HB ILE A 37 65.556 -2.140 0.755 1.00 1.00 H new ATOM 0 HG12 ILE A 37 65.612 -1.151 2.928 1.00 1.00 H new ATOM 0 HG13 ILE A 37 66.254 0.069 1.846 1.00 1.00 H new ATOM 0 HG21 ILE A 37 65.870 -0.025 -0.538 1.00 1.00 H new ATOM 0 HG22 ILE A 37 64.568 -1.021 -1.231 1.00 1.00 H new ATOM 0 HG23 ILE A 37 64.168 0.401 -0.239 1.00 1.00 H new ATOM 0 HD11 ILE A 37 64.633 1.068 3.432 1.00 1.00 H new ATOM 0 HD12 ILE A 37 64.024 1.188 1.764 1.00 1.00 H new ATOM 0 HD13 ILE A 37 63.373 -0.052 2.863 1.00 1.00 H new ATOM 520 N HIS A 38 61.899 -3.254 -0.165 1.00 1.00 N ATOM 521 CA HIS A 38 61.537 -4.245 -1.177 1.00 1.00 C ATOM 522 C HIS A 38 60.377 -3.647 -1.990 1.00 1.00 C ATOM 523 O HIS A 38 59.377 -3.209 -1.422 1.00 1.00 O ATOM 524 CB HIS A 38 61.120 -5.586 -0.504 1.00 1.00 C ATOM 525 CG HIS A 38 61.096 -5.427 0.997 1.00 1.00 C ATOM 526 ND1 HIS A 38 59.918 -5.233 1.703 1.00 1.00 N ATOM 527 CD2 HIS A 38 62.100 -5.420 1.937 1.00 1.00 C ATOM 528 CE1 HIS A 38 60.240 -5.121 3.005 1.00 1.00 C ATOM 529 NE2 HIS A 38 61.555 -5.228 3.202 1.00 1.00 N ATOM 0 H HIS A 38 61.104 -2.823 0.308 1.00 1.00 H new ATOM 0 HA HIS A 38 62.383 -4.470 -1.827 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.136 -5.891 -0.861 1.00 1.00 H new ATOM 0 HB3 HIS A 38 61.819 -6.375 -0.783 1.00 1.00 H new ATOM 0 HD1 HIS A 38 58.979 -5.184 1.308 1.00 1.00 H new ATOM 0 HD2 HIS A 38 63.152 -5.545 1.725 1.00 1.00 H new ATOM 0 HE1 HIS A 38 59.521 -4.964 3.795 1.00 1.00 H new ATOM 537 N THR A 39 60.521 -3.614 -3.315 1.00 1.00 N ATOM 538 CA THR A 39 59.485 -3.044 -4.189 1.00 1.00 C ATOM 539 C THR A 39 58.713 -4.162 -4.886 1.00 1.00 C ATOM 540 O THR A 39 59.260 -5.236 -5.123 1.00 1.00 O ATOM 541 CB THR A 39 60.139 -2.137 -5.236 1.00 1.00 C ATOM 542 OG1 THR A 39 61.206 -2.840 -5.846 1.00 1.00 O ATOM 543 CG2 THR A 39 60.684 -0.869 -4.567 1.00 1.00 C ATOM 0 H THR A 39 61.339 -3.972 -3.808 1.00 1.00 H new ATOM 0 HA THR A 39 58.792 -2.459 -3.585 1.00 1.00 H new ATOM 0 HB THR A 39 59.399 -1.853 -5.984 1.00 1.00 H new ATOM 0 HG1 THR A 39 60.846 -3.558 -6.407 1.00 1.00 H new ATOM 0 HG21 THR A 39 61.147 -0.231 -5.320 1.00 1.00 H new ATOM 0 HG22 THR A 39 59.867 -0.330 -4.088 1.00 1.00 H new ATOM 0 HG23 THR A 39 61.426 -1.143 -3.818 1.00 1.00 H new ATOM 551 N PRO A 40 57.455 -3.958 -5.195 1.00 1.00 N ATOM 552 CA PRO A 40 56.629 -5.012 -5.850 1.00 1.00 C ATOM 553 C PRO A 40 56.925 -5.206 -7.345 1.00 1.00 C ATOM 554 O PRO A 40 56.864 -6.331 -7.840 1.00 1.00 O ATOM 555 CB PRO A 40 55.200 -4.496 -5.641 1.00 1.00 C ATOM 556 CG PRO A 40 55.347 -3.016 -5.687 1.00 1.00 C ATOM 557 CD PRO A 40 56.667 -2.722 -4.971 1.00 1.00 C ATOM 0 HA PRO A 40 56.827 -5.995 -5.424 1.00 1.00 H new ATOM 0 HB2 PRO A 40 54.527 -4.856 -6.419 1.00 1.00 H new ATOM 0 HB3 PRO A 40 54.790 -4.828 -4.687 1.00 1.00 H new ATOM 0 HG2 PRO A 40 55.367 -2.654 -6.715 1.00 1.00 H new ATOM 0 HG3 PRO A 40 54.511 -2.522 -5.191 1.00 1.00 H new ATOM 0 HD2 PRO A 40 57.165 -1.846 -5.387 1.00 1.00 H new ATOM 0 HD3 PRO A 40 56.515 -2.528 -3.909 1.00 1.00 H new ATOM 565 N ALA A 41 57.263 -4.126 -8.068 1.00 1.00 N ATOM 566 CA ALA A 41 57.585 -4.220 -9.506 1.00 1.00 C ATOM 567 C ALA A 41 58.915 -3.544 -9.828 1.00 1.00 C ATOM 568 O ALA A 41 59.145 -2.413 -9.404 1.00 1.00 O ATOM 569 CB ALA A 41 56.483 -3.570 -10.351 1.00 1.00 C ATOM 0 H ALA A 41 57.321 -3.182 -7.686 1.00 1.00 H new ATOM 0 HA ALA A 41 57.660 -5.280 -9.747 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.740 -3.650 -11.407 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.536 -4.079 -10.168 1.00 1.00 H new ATOM 0 HB3 ALA A 41 56.388 -2.519 -10.079 1.00 1.00 H new ATOM 575 N ARG A 42 59.767 -4.184 -10.615 1.00 1.00 N ATOM 576 CA ARG A 42 61.021 -3.544 -10.998 1.00 1.00 C ATOM 577 C ARG A 42 61.726 -4.325 -12.098 1.00 1.00 C ATOM 578 O ARG A 42 61.369 -5.468 -12.392 1.00 1.00 O ATOM 579 CB ARG A 42 61.940 -3.373 -9.789 1.00 1.00 C ATOM 580 CG ARG A 42 62.205 -4.728 -9.141 1.00 1.00 C ATOM 581 CD ARG A 42 63.144 -4.542 -7.948 1.00 1.00 C ATOM 582 NE ARG A 42 64.455 -4.082 -8.392 1.00 1.00 N ATOM 583 CZ ARG A 42 65.470 -3.983 -7.538 1.00 1.00 C ATOM 584 NH1 ARG A 42 65.329 -4.392 -6.308 1.00 1.00 N ATOM 585 NH2 ARG A 42 66.611 -3.493 -7.935 1.00 1.00 N ATOM 0 H ARG A 42 59.622 -5.120 -10.993 1.00 1.00 H new ATOM 0 HA ARG A 42 60.780 -2.555 -11.388 1.00 1.00 H new ATOM 0 HB2 ARG A 42 62.881 -2.918 -10.098 1.00 1.00 H new ATOM 0 HB3 ARG A 42 61.482 -2.698 -9.066 1.00 1.00 H new ATOM 0 HG2 ARG A 42 61.267 -5.177 -8.814 1.00 1.00 H new ATOM 0 HG3 ARG A 42 62.650 -5.410 -9.866 1.00 1.00 H new ATOM 0 HD2 ARG A 42 62.717 -3.821 -7.251 1.00 1.00 H new ATOM 0 HD3 ARG A 42 63.247 -5.484 -7.409 1.00 1.00 H new ATOM 0 HE ARG A 42 64.595 -3.833 -9.371 1.00 1.00 H new ATOM 0 HH11 ARG A 42 64.441 -4.788 -6.001 1.00 1.00 H new ATOM 0 HH12 ARG A 42 66.107 -4.316 -5.653 1.00 1.00 H new ATOM 0 HH21 ARG A 42 66.726 -3.185 -8.901 1.00 1.00 H new ATOM 0 HH22 ARG A 42 67.389 -3.417 -7.280 1.00 1.00 H new ATOM 599 N ARG A 43 62.742 -3.707 -12.694 1.00 1.00 N ATOM 600 CA ARG A 43 63.503 -4.361 -13.754 1.00 1.00 C ATOM 601 C ARG A 43 64.291 -5.539 -13.181 1.00 1.00 C ATOM 602 O ARG A 43 65.248 -6.017 -13.786 1.00 1.00 O ATOM 603 CB ARG A 43 64.447 -3.342 -14.447 1.00 1.00 C ATOM 604 CG ARG A 43 64.212 -3.324 -15.969 1.00 1.00 C ATOM 605 CD ARG A 43 64.789 -4.602 -16.585 1.00 1.00 C ATOM 606 NE ARG A 43 64.506 -4.643 -18.019 1.00 1.00 N ATOM 607 CZ ARG A 43 65.319 -5.262 -18.876 1.00 1.00 C ATOM 608 NH1 ARG A 43 66.422 -5.821 -18.453 1.00 1.00 N ATOM 609 NH2 ARG A 43 65.017 -5.302 -20.143 1.00 1.00 N ATOM 0 H ARG A 43 63.055 -2.764 -12.464 1.00 1.00 H new ATOM 0 HA ARG A 43 62.812 -4.744 -14.505 1.00 1.00 H new ATOM 0 HB2 ARG A 43 64.278 -2.346 -14.037 1.00 1.00 H new ATOM 0 HB3 ARG A 43 65.485 -3.601 -14.238 1.00 1.00 H new ATOM 0 HG2 ARG A 43 63.146 -3.253 -16.183 1.00 1.00 H new ATOM 0 HG3 ARG A 43 64.685 -2.447 -16.411 1.00 1.00 H new ATOM 0 HD2 ARG A 43 65.865 -4.641 -16.418 1.00 1.00 H new ATOM 0 HD3 ARG A 43 64.359 -5.476 -16.097 1.00 1.00 H new ATOM 0 HE ARG A 43 63.665 -4.187 -18.373 1.00 1.00 H new ATOM 0 HH11 ARG A 43 66.665 -5.785 -17.463 1.00 1.00 H new ATOM 0 HH12 ARG A 43 67.040 -6.293 -19.113 1.00 1.00 H new ATOM 0 HH21 ARG A 43 64.160 -4.860 -20.477 1.00 1.00 H new ATOM 0 HH22 ARG A 43 65.637 -5.775 -20.800 1.00 1.00 H new ATOM 623 N GLY A 44 63.872 -5.995 -12.007 1.00 1.00 N ATOM 624 CA GLY A 44 64.523 -7.110 -11.349 1.00 1.00 C ATOM 625 C GLY A 44 65.798 -6.668 -10.645 1.00 1.00 C ATOM 626 O GLY A 44 66.244 -7.327 -9.709 1.00 1.00 O ATOM 0 H GLY A 44 63.082 -5.605 -11.494 1.00 1.00 H new ATOM 0 HA2 GLY A 44 63.841 -7.556 -10.625 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.759 -7.881 -12.083 1.00 1.00 H new ATOM 630 N PHE A 45 66.404 -5.568 -11.103 1.00 1.00 N ATOM 631 CA PHE A 45 67.651 -5.073 -10.509 1.00 1.00 C ATOM 632 C PHE A 45 67.713 -3.541 -10.672 1.00 1.00 C ATOM 633 O PHE A 45 67.210 -3.019 -11.663 1.00 1.00 O ATOM 634 CB PHE A 45 68.836 -5.735 -11.251 1.00 1.00 C ATOM 635 CG PHE A 45 69.690 -6.593 -10.335 1.00 1.00 C ATOM 636 CD1 PHE A 45 70.762 -6.023 -9.637 1.00 1.00 C ATOM 637 CD2 PHE A 45 69.434 -7.966 -10.223 1.00 1.00 C ATOM 638 CE1 PHE A 45 71.577 -6.825 -8.827 1.00 1.00 C ATOM 639 CE2 PHE A 45 70.244 -8.767 -9.410 1.00 1.00 C ATOM 640 CZ PHE A 45 71.316 -8.199 -8.714 1.00 1.00 C ATOM 0 H PHE A 45 66.054 -5.006 -11.879 1.00 1.00 H new ATOM 0 HA PHE A 45 67.698 -5.318 -9.448 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.453 -6.349 -12.066 1.00 1.00 H new ATOM 0 HB3 PHE A 45 69.457 -4.960 -11.701 1.00 1.00 H new ATOM 0 HD1 PHE A 45 70.961 -4.965 -9.723 1.00 1.00 H new ATOM 0 HD2 PHE A 45 68.610 -8.407 -10.765 1.00 1.00 H new ATOM 0 HE1 PHE A 45 72.405 -6.386 -8.290 1.00 1.00 H new ATOM 0 HE2 PHE A 45 70.041 -9.824 -9.320 1.00 1.00 H new ATOM 0 HZ PHE A 45 71.943 -8.818 -8.089 1.00 1.00 H new ATOM 650 N PHE A 46 68.369 -2.867 -9.706 1.00 1.00 N ATOM 651 CA PHE A 46 68.546 -1.382 -9.713 1.00 1.00 C ATOM 652 C PHE A 46 68.491 -0.791 -8.277 1.00 1.00 C ATOM 653 O PHE A 46 67.503 -0.176 -7.921 1.00 1.00 O ATOM 654 CB PHE A 46 67.445 -0.680 -10.582 1.00 1.00 C ATOM 655 CG PHE A 46 67.906 -0.391 -12.013 1.00 1.00 C ATOM 656 CD1 PHE A 46 68.816 -1.224 -12.686 1.00 1.00 C ATOM 657 CD2 PHE A 46 67.389 0.739 -12.674 1.00 1.00 C ATOM 658 CE1 PHE A 46 69.202 -0.924 -14.004 1.00 1.00 C ATOM 659 CE2 PHE A 46 67.778 1.034 -13.986 1.00 1.00 C ATOM 660 CZ PHE A 46 68.682 0.204 -14.651 1.00 1.00 C ATOM 0 H PHE A 46 68.793 -3.324 -8.899 1.00 1.00 H new ATOM 0 HA PHE A 46 69.529 -1.192 -10.144 1.00 1.00 H new ATOM 0 HB2 PHE A 46 66.557 -1.311 -10.613 1.00 1.00 H new ATOM 0 HB3 PHE A 46 67.154 0.255 -10.104 1.00 1.00 H new ATOM 0 HD1 PHE A 46 69.219 -2.095 -12.190 1.00 1.00 H new ATOM 0 HD2 PHE A 46 66.687 1.383 -12.165 1.00 1.00 H new ATOM 0 HE1 PHE A 46 69.902 -1.565 -14.519 1.00 1.00 H new ATOM 0 HE2 PHE A 46 67.378 1.905 -14.484 1.00 1.00 H new ATOM 0 HZ PHE A 46 68.980 0.432 -15.664 1.00 1.00 H new ATOM 670 N ARG A 47 69.555 -1.005 -7.485 1.00 1.00 N ATOM 671 CA ARG A 47 69.669 -0.513 -6.073 1.00 1.00 C ATOM 672 C ARG A 47 70.205 -1.628 -5.217 1.00 1.00 C ATOM 673 O ARG A 47 70.008 -2.740 -5.595 1.00 1.00 O ATOM 674 CB ARG A 47 68.305 -0.112 -5.438 1.00 1.00 C ATOM 675 CG ARG A 47 67.282 -1.291 -5.453 1.00 1.00 C ATOM 676 CD ARG A 47 66.206 -1.100 -4.372 1.00 1.00 C ATOM 677 NE ARG A 47 64.942 -1.623 -4.869 1.00 1.00 N ATOM 678 CZ ARG A 47 64.192 -0.901 -5.693 1.00 1.00 C ATOM 679 NH1 ARG A 47 64.567 0.307 -6.012 1.00 1.00 N ATOM 680 NH2 ARG A 47 63.092 -1.395 -6.186 1.00 1.00 N ATOM 0 H ARG A 47 70.375 -1.527 -7.795 1.00 1.00 H new ATOM 0 HA ARG A 47 70.314 0.365 -6.111 1.00 1.00 H new ATOM 0 HB2 ARG A 47 68.466 0.215 -4.411 1.00 1.00 H new ATOM 0 HB3 ARG A 47 67.888 0.736 -5.981 1.00 1.00 H new ATOM 0 HG2 ARG A 47 66.810 -1.355 -6.433 1.00 1.00 H new ATOM 0 HG3 ARG A 47 67.805 -2.233 -5.288 1.00 1.00 H new ATOM 0 HD2 ARG A 47 66.495 -1.617 -3.457 1.00 1.00 H new ATOM 0 HD3 ARG A 47 66.105 -0.044 -4.123 1.00 1.00 H new ATOM 0 HE ARG A 47 64.630 -2.551 -4.582 1.00 1.00 H new ATOM 0 HH11 ARG A 47 65.431 0.691 -5.629 1.00 1.00 H new ATOM 0 HH12 ARG A 47 63.996 0.868 -6.644 1.00 1.00 H new ATOM 0 HH21 ARG A 47 62.803 -2.341 -5.939 1.00 1.00 H new ATOM 0 HH22 ARG A 47 62.520 -0.835 -6.819 1.00 1.00 H new ATOM 694 N CYS A 48 70.929 -1.362 -4.120 1.00 1.00 N ATOM 695 CA CYS A 48 71.478 -2.449 -3.275 1.00 1.00 C ATOM 696 C CYS A 48 72.245 -3.474 -4.094 1.00 1.00 C ATOM 697 O CYS A 48 71.912 -4.640 -4.070 1.00 1.00 O ATOM 698 CB CYS A 48 70.380 -3.166 -2.429 1.00 1.00 C ATOM 699 SG CYS A 48 68.897 -3.653 -3.382 1.00 1.00 S ATOM 0 H CYS A 48 71.149 -0.421 -3.795 1.00 1.00 H new ATOM 0 HA CYS A 48 72.169 -1.963 -2.587 1.00 1.00 H new ATOM 0 HB2 CYS A 48 70.813 -4.056 -1.972 1.00 1.00 H new ATOM 0 HB3 CYS A 48 70.075 -2.507 -1.616 1.00 1.00 H new ATOM 0 HG CYS A 48 69.142 -3.540 -4.654 1.00 1.00 H new ATOM 704 N ASN A 49 73.326 -3.052 -4.745 1.00 1.00 N ATOM 705 CA ASN A 49 74.160 -3.980 -5.528 1.00 1.00 C ATOM 706 C ASN A 49 75.521 -4.171 -4.846 1.00 1.00 C ATOM 707 O ASN A 49 76.035 -3.240 -4.225 1.00 1.00 O ATOM 708 CB ASN A 49 74.348 -3.412 -6.942 1.00 1.00 C ATOM 709 CG ASN A 49 74.440 -1.892 -6.877 1.00 1.00 C ATOM 710 OD1 ASN A 49 75.513 -1.345 -6.631 1.00 1.00 O ATOM 711 ND2 ASN A 49 73.367 -1.174 -7.077 1.00 1.00 N ATOM 0 H ASN A 49 73.649 -2.084 -4.751 1.00 1.00 H new ATOM 0 HA ASN A 49 73.668 -4.951 -5.589 1.00 1.00 H new ATOM 0 HB2 ASN A 49 75.252 -3.822 -7.392 1.00 1.00 H new ATOM 0 HB3 ASN A 49 73.514 -3.709 -7.577 1.00 1.00 H new ATOM 0 HD21 ASN A 49 73.418 -0.156 -7.029 1.00 1.00 H new ATOM 0 HD22 ASN A 49 72.478 -1.631 -7.281 1.00 1.00 H new ATOM 718 N PRO A 50 76.121 -5.340 -4.948 1.00 1.00 N ATOM 719 CA PRO A 50 77.447 -5.616 -4.318 1.00 1.00 C ATOM 720 C PRO A 50 78.582 -4.894 -5.046 1.00 1.00 C ATOM 721 O PRO A 50 79.559 -5.512 -5.467 1.00 1.00 O ATOM 722 CB PRO A 50 77.576 -7.142 -4.417 1.00 1.00 C ATOM 723 CG PRO A 50 76.794 -7.499 -5.635 1.00 1.00 C ATOM 724 CD PRO A 50 75.613 -6.526 -5.667 1.00 1.00 C ATOM 0 HA PRO A 50 77.513 -5.256 -3.291 1.00 1.00 H new ATOM 0 HB2 PRO A 50 78.618 -7.448 -4.509 1.00 1.00 H new ATOM 0 HB3 PRO A 50 77.177 -7.633 -3.530 1.00 1.00 H new ATOM 0 HG2 PRO A 50 77.404 -7.405 -6.534 1.00 1.00 H new ATOM 0 HG3 PRO A 50 76.449 -8.532 -5.590 1.00 1.00 H new ATOM 0 HD2 PRO A 50 75.322 -6.282 -6.689 1.00 1.00 H new ATOM 0 HD3 PRO A 50 74.734 -6.946 -5.177 1.00 1.00 H new ATOM 732 N GLU A 51 78.427 -3.577 -5.167 1.00 1.00 N ATOM 733 CA GLU A 51 79.418 -2.713 -5.819 1.00 1.00 C ATOM 734 C GLU A 51 79.507 -2.997 -7.325 1.00 1.00 C ATOM 735 O GLU A 51 80.244 -2.330 -8.048 1.00 1.00 O ATOM 736 CB GLU A 51 80.792 -2.871 -5.098 1.00 1.00 C ATOM 737 CG GLU A 51 81.811 -3.745 -5.890 1.00 1.00 C ATOM 738 CD GLU A 51 82.753 -4.501 -4.943 1.00 1.00 C ATOM 739 OE1 GLU A 51 82.430 -4.625 -3.773 1.00 1.00 O ATOM 740 OE2 GLU A 51 83.779 -4.962 -5.412 1.00 1.00 O ATOM 0 H GLU A 51 77.611 -3.075 -4.816 1.00 1.00 H new ATOM 0 HA GLU A 51 79.105 -1.673 -5.730 1.00 1.00 H new ATOM 0 HB2 GLU A 51 81.223 -1.883 -4.933 1.00 1.00 H new ATOM 0 HB3 GLU A 51 80.630 -3.316 -4.116 1.00 1.00 H new ATOM 0 HG2 GLU A 51 81.273 -4.457 -6.516 1.00 1.00 H new ATOM 0 HG3 GLU A 51 82.395 -3.111 -6.558 1.00 1.00 H new ATOM 747 N ARG A 52 78.755 -3.994 -7.780 1.00 1.00 N ATOM 748 CA ARG A 52 78.756 -4.372 -9.193 1.00 1.00 C ATOM 749 C ARG A 52 77.767 -3.538 -10.005 1.00 1.00 C ATOM 750 O ARG A 52 76.772 -3.034 -9.482 1.00 1.00 O ATOM 751 CB ARG A 52 78.420 -5.870 -9.323 1.00 1.00 C ATOM 752 CG ARG A 52 79.711 -6.697 -9.241 1.00 1.00 C ATOM 753 CD ARG A 52 79.389 -8.184 -9.041 1.00 1.00 C ATOM 754 NE ARG A 52 79.327 -8.484 -7.619 1.00 1.00 N ATOM 755 CZ ARG A 52 80.435 -8.532 -6.888 1.00 1.00 C ATOM 756 NH1 ARG A 52 81.594 -8.312 -7.448 1.00 1.00 N ATOM 757 NH2 ARG A 52 80.367 -8.794 -5.613 1.00 1.00 N ATOM 0 H ARG A 52 78.137 -4.555 -7.194 1.00 1.00 H new ATOM 0 HA ARG A 52 79.751 -4.179 -9.595 1.00 1.00 H new ATOM 0 HB2 ARG A 52 77.734 -6.169 -8.531 1.00 1.00 H new ATOM 0 HB3 ARG A 52 77.915 -6.059 -10.270 1.00 1.00 H new ATOM 0 HG2 ARG A 52 80.292 -6.565 -10.154 1.00 1.00 H new ATOM 0 HG3 ARG A 52 80.327 -6.339 -8.416 1.00 1.00 H new ATOM 0 HD2 ARG A 52 78.439 -8.427 -9.516 1.00 1.00 H new ATOM 0 HD3 ARG A 52 80.151 -8.799 -9.520 1.00 1.00 H new ATOM 0 HE ARG A 52 78.424 -8.659 -7.179 1.00 1.00 H new ATOM 0 HH11 ARG A 52 81.647 -8.104 -8.445 1.00 1.00 H new ATOM 0 HH12 ARG A 52 82.446 -8.348 -6.888 1.00 1.00 H new ATOM 0 HH21 ARG A 52 79.462 -8.963 -5.175 1.00 1.00 H new ATOM 0 HH22 ARG A 52 81.219 -8.830 -5.054 1.00 1.00 H new ATOM 771 N ILE A 53 78.060 -3.411 -11.300 1.00 1.00 N ATOM 772 CA ILE A 53 77.212 -2.653 -12.204 1.00 1.00 C ATOM 773 C ILE A 53 75.879 -3.365 -12.395 1.00 1.00 C ATOM 774 O ILE A 53 75.810 -4.589 -12.517 1.00 1.00 O ATOM 775 CB ILE A 53 77.926 -2.466 -13.556 1.00 1.00 C ATOM 776 CG1 ILE A 53 77.065 -1.598 -14.496 1.00 1.00 C ATOM 777 CG2 ILE A 53 78.193 -3.838 -14.213 1.00 1.00 C ATOM 778 CD1 ILE A 53 76.863 -0.196 -13.905 1.00 1.00 C ATOM 0 H ILE A 53 78.881 -3.826 -11.741 1.00 1.00 H new ATOM 0 HA ILE A 53 77.017 -1.671 -11.773 1.00 1.00 H new ATOM 0 HB ILE A 53 78.878 -1.965 -13.380 1.00 1.00 H new ATOM 0 HG12 ILE A 53 77.546 -1.521 -15.471 1.00 1.00 H new ATOM 0 HG13 ILE A 53 76.097 -2.074 -14.655 1.00 1.00 H new ATOM 0 HG21 ILE A 53 78.698 -3.692 -15.168 1.00 1.00 H new ATOM 0 HG22 ILE A 53 78.823 -4.439 -13.557 1.00 1.00 H new ATOM 0 HG23 ILE A 53 77.246 -4.353 -14.378 1.00 1.00 H new ATOM 0 HD11 ILE A 53 76.253 0.400 -14.583 1.00 1.00 H new ATOM 0 HD12 ILE A 53 76.361 -0.276 -12.941 1.00 1.00 H new ATOM 0 HD13 ILE A 53 77.832 0.285 -13.770 1.00 1.00 H new ATOM 790 N GLN A 54 74.828 -2.573 -12.369 1.00 1.00 N ATOM 791 CA GLN A 54 73.484 -3.119 -12.485 1.00 1.00 C ATOM 792 C GLN A 54 73.353 -3.860 -13.816 1.00 1.00 C ATOM 793 O GLN A 54 72.778 -3.336 -14.771 1.00 1.00 O ATOM 794 CB GLN A 54 72.472 -1.965 -12.460 1.00 1.00 C ATOM 795 CG GLN A 54 72.722 -1.020 -11.244 1.00 1.00 C ATOM 796 CD GLN A 54 72.854 0.441 -11.696 1.00 1.00 C ATOM 797 OE1 GLN A 54 73.786 1.134 -11.290 1.00 1.00 O ATOM 798 NE2 GLN A 54 71.972 0.950 -12.516 1.00 1.00 N ATOM 0 H GLN A 54 74.872 -1.559 -12.270 1.00 1.00 H new ATOM 0 HA GLN A 54 73.294 -3.804 -11.659 1.00 1.00 H new ATOM 0 HB2 GLN A 54 72.543 -1.396 -13.387 1.00 1.00 H new ATOM 0 HB3 GLN A 54 71.460 -2.367 -12.409 1.00 1.00 H new ATOM 0 HG2 GLN A 54 71.900 -1.111 -10.534 1.00 1.00 H new ATOM 0 HG3 GLN A 54 73.629 -1.326 -10.723 1.00 1.00 H new ATOM 0 HE21 GLN A 54 71.199 0.377 -12.853 1.00 1.00 H new ATOM 0 HE22 GLN A 54 72.057 1.920 -12.818 1.00 1.00 H new ATOM 807 N ILE A 55 73.854 -5.111 -13.862 1.00 1.00 N ATOM 808 CA ILE A 55 73.760 -5.954 -15.059 1.00 1.00 C ATOM 809 C ILE A 55 73.676 -7.435 -14.657 1.00 1.00 C ATOM 810 O ILE A 55 74.083 -7.802 -13.555 1.00 1.00 O ATOM 811 CB ILE A 55 74.981 -5.746 -15.976 1.00 1.00 C ATOM 812 CG1 ILE A 55 74.702 -6.363 -17.352 1.00 1.00 C ATOM 813 CG2 ILE A 55 76.229 -6.413 -15.376 1.00 1.00 C ATOM 814 CD1 ILE A 55 75.810 -5.952 -18.323 1.00 1.00 C ATOM 0 H ILE A 55 74.329 -5.557 -13.077 1.00 1.00 H new ATOM 0 HA ILE A 55 72.859 -5.668 -15.601 1.00 1.00 H new ATOM 0 HB ILE A 55 75.160 -4.675 -16.073 1.00 1.00 H new ATOM 0 HG12 ILE A 55 74.655 -7.449 -17.274 1.00 1.00 H new ATOM 0 HG13 ILE A 55 73.734 -6.028 -17.724 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.080 -6.255 -16.038 1.00 1.00 H new ATOM 0 HG22 ILE A 55 76.442 -5.976 -14.401 1.00 1.00 H new ATOM 0 HG23 ILE A 55 76.051 -7.482 -15.263 1.00 1.00 H new ATOM 0 HD11 ILE A 55 75.616 -6.389 -19.303 1.00 1.00 H new ATOM 0 HD12 ILE A 55 75.835 -4.866 -18.408 1.00 1.00 H new ATOM 0 HD13 ILE A 55 76.771 -6.309 -17.951 1.00 1.00 H new ATOM 826 N GLY A 56 73.145 -8.283 -15.541 1.00 1.00 N ATOM 827 CA GLY A 56 73.013 -9.720 -15.252 1.00 1.00 C ATOM 828 C GLY A 56 71.550 -10.101 -15.075 1.00 1.00 C ATOM 829 O GLY A 56 71.205 -11.282 -14.995 1.00 1.00 O ATOM 0 H GLY A 56 72.800 -8.005 -16.460 1.00 1.00 H new ATOM 0 HA2 GLY A 56 73.450 -10.301 -16.064 1.00 1.00 H new ATOM 0 HA3 GLY A 56 73.570 -9.967 -14.348 1.00 1.00 H new ATOM 833 N ASP A 57 70.696 -9.091 -15.076 1.00 1.00 N ATOM 834 CA ASP A 57 69.267 -9.348 -14.962 1.00 1.00 C ATOM 835 C ASP A 57 68.751 -9.847 -16.297 1.00 1.00 C ATOM 836 O ASP A 57 68.516 -9.072 -17.223 1.00 1.00 O ATOM 837 CB ASP A 57 68.530 -8.075 -14.570 1.00 1.00 C ATOM 838 CG ASP A 57 68.754 -6.981 -15.607 1.00 1.00 C ATOM 839 OD1 ASP A 57 69.904 -6.724 -15.931 1.00 1.00 O ATOM 840 OD2 ASP A 57 67.776 -6.407 -16.058 1.00 1.00 O ATOM 0 H ASP A 57 70.956 -8.108 -15.152 1.00 1.00 H new ATOM 0 HA ASP A 57 69.095 -10.099 -14.191 1.00 1.00 H new ATOM 0 HB2 ASP A 57 67.464 -8.281 -14.476 1.00 1.00 H new ATOM 0 HB3 ASP A 57 68.876 -7.734 -13.594 1.00 1.00 H new ATOM 845 N TRP A 58 68.625 -11.168 -16.401 1.00 1.00 N ATOM 846 CA TRP A 58 68.191 -11.812 -17.632 1.00 1.00 C ATOM 847 C TRP A 58 66.665 -11.929 -17.727 1.00 1.00 C ATOM 848 O TRP A 58 65.917 -11.585 -16.813 1.00 1.00 O ATOM 849 CB TRP A 58 68.857 -13.190 -17.768 1.00 1.00 C ATOM 850 CG TRP A 58 70.296 -13.044 -18.197 1.00 1.00 C ATOM 851 CD1 TRP A 58 71.055 -11.935 -18.016 1.00 1.00 C ATOM 852 CD2 TRP A 58 71.161 -14.019 -18.869 1.00 1.00 C ATOM 853 NE1 TRP A 58 72.320 -12.164 -18.531 1.00 1.00 N ATOM 854 CE2 TRP A 58 72.435 -13.431 -19.067 1.00 1.00 C ATOM 855 CE3 TRP A 58 70.969 -15.339 -19.325 1.00 1.00 C ATOM 856 CZ2 TRP A 58 73.476 -14.125 -19.688 1.00 1.00 C ATOM 857 CZ3 TRP A 58 72.015 -16.038 -19.950 1.00 1.00 C ATOM 858 CH2 TRP A 58 73.265 -15.433 -20.131 1.00 1.00 C ATOM 0 H TRP A 58 68.820 -11.816 -15.638 1.00 1.00 H new ATOM 0 HA TRP A 58 68.505 -11.179 -18.462 1.00 1.00 H new ATOM 0 HB2 TRP A 58 68.807 -13.719 -16.816 1.00 1.00 H new ATOM 0 HB3 TRP A 58 68.314 -13.792 -18.496 1.00 1.00 H new ATOM 0 HD1 TRP A 58 70.726 -11.020 -17.546 1.00 1.00 H new ATOM 0 HE1 TRP A 58 73.076 -11.479 -18.516 1.00 1.00 H new ATOM 0 HE3 TRP A 58 70.010 -15.817 -19.193 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 74.438 -13.653 -19.825 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 71.854 -17.049 -20.293 1.00 1.00 H new ATOM 0 HH2 TRP A 58 74.064 -15.977 -20.612 1.00 1.00 H new ATOM 869 N ARG A 59 66.267 -12.406 -18.888 1.00 1.00 N ATOM 870 CA ARG A 59 64.851 -12.581 -19.207 1.00 1.00 C ATOM 871 C ARG A 59 64.289 -13.914 -18.690 1.00 1.00 C ATOM 872 O ARG A 59 63.369 -13.945 -17.873 1.00 1.00 O ATOM 873 CB ARG A 59 64.657 -12.535 -20.724 1.00 1.00 C ATOM 874 CG ARG A 59 65.248 -11.231 -21.315 1.00 1.00 C ATOM 875 CD ARG A 59 65.927 -11.538 -22.652 1.00 1.00 C ATOM 876 NE ARG A 59 67.210 -12.199 -22.400 1.00 1.00 N ATOM 877 CZ ARG A 59 67.714 -13.101 -23.238 1.00 1.00 C ATOM 878 NH1 ARG A 59 67.050 -13.463 -24.303 1.00 1.00 N ATOM 879 NH2 ARG A 59 68.878 -13.637 -22.985 1.00 1.00 N ATOM 0 H ARG A 59 66.903 -12.683 -19.636 1.00 1.00 H new ATOM 0 HA ARG A 59 64.314 -11.771 -18.714 1.00 1.00 H new ATOM 0 HB2 ARG A 59 65.138 -13.398 -21.183 1.00 1.00 H new ATOM 0 HB3 ARG A 59 63.595 -12.599 -20.961 1.00 1.00 H new ATOM 0 HG2 ARG A 59 64.458 -10.493 -21.457 1.00 1.00 H new ATOM 0 HG3 ARG A 59 65.968 -10.798 -20.620 1.00 1.00 H new ATOM 0 HD2 ARG A 59 65.288 -12.178 -23.260 1.00 1.00 H new ATOM 0 HD3 ARG A 59 66.083 -10.617 -23.214 1.00 1.00 H new ATOM 0 HE ARG A 59 67.732 -11.961 -21.557 1.00 1.00 H new ATOM 0 HH11 ARG A 59 66.137 -13.053 -24.498 1.00 1.00 H new ATOM 0 HH12 ARG A 59 67.445 -14.155 -24.939 1.00 1.00 H new ATOM 0 HH21 ARG A 59 69.395 -13.363 -22.149 1.00 1.00 H new ATOM 0 HH22 ARG A 59 69.270 -14.329 -23.623 1.00 1.00 H new ATOM 893 N TYR A 60 64.848 -15.000 -19.200 1.00 1.00 N ATOM 894 CA TYR A 60 64.430 -16.370 -18.848 1.00 1.00 C ATOM 895 C TYR A 60 65.196 -16.959 -17.659 1.00 1.00 C ATOM 896 O TYR A 60 64.784 -17.971 -17.059 1.00 1.00 O ATOM 897 CB TYR A 60 64.562 -17.291 -20.074 1.00 1.00 C ATOM 898 CG TYR A 60 65.983 -17.779 -20.220 1.00 1.00 C ATOM 899 CD1 TYR A 60 66.926 -17.004 -20.902 1.00 1.00 C ATOM 900 CD2 TYR A 60 66.352 -19.009 -19.666 1.00 1.00 C ATOM 901 CE1 TYR A 60 68.242 -17.462 -21.028 1.00 1.00 C ATOM 902 CE2 TYR A 60 67.665 -19.467 -19.791 1.00 1.00 C ATOM 903 CZ TYR A 60 68.611 -18.693 -20.473 1.00 1.00 C ATOM 904 OH TYR A 60 69.908 -19.143 -20.599 1.00 1.00 O ATOM 0 H TYR A 60 65.611 -14.967 -19.876 1.00 1.00 H new ATOM 0 HA TYR A 60 63.387 -16.305 -18.537 1.00 1.00 H new ATOM 0 HB2 TYR A 60 63.888 -18.142 -19.971 1.00 1.00 H new ATOM 0 HB3 TYR A 60 64.262 -16.754 -20.974 1.00 1.00 H new ATOM 0 HD1 TYR A 60 66.639 -16.055 -21.330 1.00 1.00 H new ATOM 0 HD2 TYR A 60 65.620 -19.605 -19.141 1.00 1.00 H new ATOM 0 HE1 TYR A 60 68.973 -16.866 -21.554 1.00 1.00 H new ATOM 0 HE2 TYR A 60 67.950 -20.416 -19.362 1.00 1.00 H new ATOM 0 HH TYR A 60 69.997 -20.013 -20.157 1.00 1.00 H new ATOM 914 N GLU A 61 66.310 -16.344 -17.296 1.00 1.00 N ATOM 915 CA GLU A 61 67.106 -16.841 -16.191 1.00 1.00 C ATOM 916 C GLU A 61 66.491 -16.435 -14.869 1.00 1.00 C ATOM 917 O GLU A 61 66.912 -16.903 -13.823 1.00 1.00 O ATOM 918 CB GLU A 61 68.543 -16.280 -16.273 1.00 1.00 C ATOM 919 CG GLU A 61 69.584 -17.335 -15.888 1.00 1.00 C ATOM 920 CD GLU A 61 70.972 -16.702 -15.919 1.00 1.00 C ATOM 921 OE1 GLU A 61 71.053 -15.520 -16.214 1.00 1.00 O ATOM 922 OE2 GLU A 61 71.932 -17.402 -15.646 1.00 1.00 O ATOM 0 H GLU A 61 66.679 -15.507 -17.747 1.00 1.00 H new ATOM 0 HA GLU A 61 67.134 -17.929 -16.256 1.00 1.00 H new ATOM 0 HB2 GLU A 61 68.739 -15.927 -17.286 1.00 1.00 H new ATOM 0 HB3 GLU A 61 68.636 -15.418 -15.612 1.00 1.00 H new ATOM 0 HG2 GLU A 61 69.372 -17.727 -14.893 1.00 1.00 H new ATOM 0 HG3 GLU A 61 69.539 -18.177 -16.579 1.00 1.00 H new ATOM 929 N VAL A 62 65.558 -15.492 -14.886 1.00 1.00 N ATOM 930 CA VAL A 62 65.006 -14.990 -13.630 1.00 1.00 C ATOM 931 C VAL A 62 64.665 -16.141 -12.717 1.00 1.00 C ATOM 932 O VAL A 62 65.102 -16.165 -11.590 1.00 1.00 O ATOM 933 CB VAL A 62 63.758 -14.130 -13.900 1.00 1.00 C ATOM 934 CG1 VAL A 62 64.170 -12.866 -14.660 1.00 1.00 C ATOM 935 CG2 VAL A 62 62.736 -14.918 -14.739 1.00 1.00 C ATOM 0 H VAL A 62 65.174 -15.067 -15.730 1.00 1.00 H new ATOM 0 HA VAL A 62 65.755 -14.367 -13.141 1.00 1.00 H new ATOM 0 HB VAL A 62 63.301 -13.860 -12.948 1.00 1.00 H new ATOM 0 HG11 VAL A 62 63.289 -12.254 -14.853 1.00 1.00 H new ATOM 0 HG12 VAL A 62 64.882 -12.298 -14.062 1.00 1.00 H new ATOM 0 HG13 VAL A 62 64.633 -13.145 -15.607 1.00 1.00 H new ATOM 0 HG21 VAL A 62 61.859 -14.297 -14.922 1.00 1.00 H new ATOM 0 HG22 VAL A 62 63.186 -15.199 -15.691 1.00 1.00 H new ATOM 0 HG23 VAL A 62 62.438 -15.817 -14.199 1.00 1.00 H new ATOM 945 N ALA A 63 63.866 -17.069 -13.173 1.00 1.00 N ATOM 946 CA ALA A 63 63.490 -18.200 -12.352 1.00 1.00 C ATOM 947 C ALA A 63 64.700 -19.090 -12.094 1.00 1.00 C ATOM 948 O ALA A 63 65.021 -19.404 -10.942 1.00 1.00 O ATOM 949 CB ALA A 63 62.422 -19.007 -13.088 1.00 1.00 C ATOM 0 H ALA A 63 63.460 -17.068 -14.109 1.00 1.00 H new ATOM 0 HA ALA A 63 63.105 -17.841 -11.397 1.00 1.00 H new ATOM 0 HB1 ALA A 63 62.129 -19.863 -12.480 1.00 1.00 H new ATOM 0 HB2 ALA A 63 61.551 -18.377 -13.271 1.00 1.00 H new ATOM 0 HB3 ALA A 63 62.822 -19.358 -14.039 1.00 1.00 H new ATOM 955 N HIS A 64 65.380 -19.474 -13.180 1.00 1.00 N ATOM 956 CA HIS A 64 66.557 -20.338 -13.031 1.00 1.00 C ATOM 957 C HIS A 64 67.488 -19.722 -11.965 1.00 1.00 C ATOM 958 O HIS A 64 67.812 -20.347 -10.963 1.00 1.00 O ATOM 959 CB HIS A 64 67.268 -20.480 -14.400 1.00 1.00 C ATOM 960 CG HIS A 64 67.127 -21.884 -14.958 1.00 1.00 C ATOM 961 ND1 HIS A 64 68.228 -22.654 -15.301 1.00 1.00 N ATOM 962 CD2 HIS A 64 66.025 -22.651 -15.273 1.00 1.00 C ATOM 963 CE1 HIS A 64 67.774 -23.821 -15.799 1.00 1.00 C ATOM 964 NE2 HIS A 64 66.440 -23.871 -15.805 1.00 1.00 N ATOM 0 H HIS A 64 65.148 -19.213 -14.138 1.00 1.00 H new ATOM 0 HA HIS A 64 66.267 -21.336 -12.703 1.00 1.00 H new ATOM 0 HB2 HIS A 64 66.847 -19.763 -15.105 1.00 1.00 H new ATOM 0 HB3 HIS A 64 68.325 -20.236 -14.289 1.00 1.00 H new ATOM 0 HD2 HIS A 64 64.997 -22.352 -15.129 1.00 1.00 H new ATOM 0 HE1 HIS A 64 68.412 -24.619 -16.150 1.00 1.00 H new ATOM 0 HE2 HIS A 64 65.851 -24.638 -16.129 1.00 1.00 H new ATOM 972 N ASP A 65 67.880 -18.482 -12.182 1.00 1.00 N ATOM 973 CA ASP A 65 68.733 -17.775 -11.232 1.00 1.00 C ATOM 974 C ASP A 65 67.946 -17.462 -9.951 1.00 1.00 C ATOM 975 O ASP A 65 68.373 -17.774 -8.828 1.00 1.00 O ATOM 976 CB ASP A 65 69.236 -16.483 -11.868 1.00 1.00 C ATOM 977 CG ASP A 65 70.143 -15.731 -10.899 1.00 1.00 C ATOM 978 OD1 ASP A 65 70.903 -16.382 -10.202 1.00 1.00 O ATOM 979 OD2 ASP A 65 70.063 -14.514 -10.870 1.00 1.00 O ATOM 0 H ASP A 65 67.624 -17.938 -13.006 1.00 1.00 H new ATOM 0 HA ASP A 65 69.585 -18.404 -10.973 1.00 1.00 H new ATOM 0 HB2 ASP A 65 69.781 -16.709 -12.785 1.00 1.00 H new ATOM 0 HB3 ASP A 65 68.390 -15.854 -12.147 1.00 1.00 H new ATOM 984 N GLY A 66 66.750 -16.913 -10.103 1.00 1.00 N ATOM 985 CA GLY A 66 65.890 -16.622 -8.964 1.00 1.00 C ATOM 986 C GLY A 66 65.406 -17.919 -8.345 1.00 1.00 C ATOM 987 O GLY A 66 64.384 -17.962 -7.658 1.00 1.00 O ATOM 0 H GLY A 66 66.351 -16.659 -11.007 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.436 -16.036 -8.224 1.00 1.00 H new ATOM 0 HA3 GLY A 66 65.039 -16.020 -9.283 1.00 1.00 H new ATOM 991 N ARG A 67 66.215 -18.946 -8.520 1.00 1.00 N ATOM 992 CA ARG A 67 65.986 -20.231 -7.917 1.00 1.00 C ATOM 993 C ARG A 67 66.247 -20.063 -6.436 1.00 1.00 C ATOM 994 O ARG A 67 66.212 -21.044 -5.694 1.00 1.00 O ATOM 995 CB ARG A 67 66.953 -21.298 -8.444 1.00 1.00 C ATOM 996 CG ARG A 67 66.383 -22.070 -9.646 1.00 1.00 C ATOM 997 CD ARG A 67 65.413 -23.164 -9.184 1.00 1.00 C ATOM 998 NE ARG A 67 64.967 -23.942 -10.342 1.00 1.00 N ATOM 999 CZ ARG A 67 63.827 -23.663 -10.981 1.00 1.00 C ATOM 1000 NH1 ARG A 67 63.043 -22.712 -10.551 1.00 1.00 N ATOM 1001 NH2 ARG A 67 63.490 -24.350 -12.039 1.00 1.00 N ATOM 0 H ARG A 67 67.058 -18.904 -9.093 1.00 1.00 H new ATOM 0 HA ARG A 67 64.971 -20.557 -8.144 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.890 -20.823 -8.733 1.00 1.00 H new ATOM 0 HB3 ARG A 67 67.186 -22.000 -7.643 1.00 1.00 H new ATOM 0 HG2 ARG A 67 65.868 -21.381 -10.315 1.00 1.00 H new ATOM 0 HG3 ARG A 67 67.198 -22.518 -10.215 1.00 1.00 H new ATOM 0 HD2 ARG A 67 65.902 -23.816 -8.461 1.00 1.00 H new ATOM 0 HD3 ARG A 67 64.556 -22.716 -8.681 1.00 1.00 H new ATOM 0 HE ARG A 67 65.542 -24.718 -10.670 1.00 1.00 H new ATOM 0 HH11 ARG A 67 63.299 -22.176 -9.722 1.00 1.00 H new ATOM 0 HH12 ARG A 67 62.174 -22.505 -11.044 1.00 1.00 H new ATOM 0 HH21 ARG A 67 64.096 -25.098 -12.376 1.00 1.00 H new ATOM 0 HH22 ARG A 67 62.620 -24.139 -12.528 1.00 1.00 H new ATOM 1015 N LEU A 68 66.629 -18.828 -6.033 1.00 1.00 N ATOM 1016 CA LEU A 68 67.012 -18.567 -4.634 1.00 1.00 C ATOM 1017 C LEU A 68 66.194 -19.458 -3.714 1.00 1.00 C ATOM 1018 O LEU A 68 66.640 -19.852 -2.639 1.00 1.00 O ATOM 1019 CB LEU A 68 66.787 -17.086 -4.219 1.00 1.00 C ATOM 1020 CG LEU A 68 67.325 -16.847 -2.763 1.00 1.00 C ATOM 1021 CD1 LEU A 68 68.132 -15.541 -2.678 1.00 1.00 C ATOM 1022 CD2 LEU A 68 66.161 -16.760 -1.760 1.00 1.00 C ATOM 0 H LEU A 68 66.678 -18.015 -6.646 1.00 1.00 H new ATOM 0 HA LEU A 68 68.077 -18.781 -4.547 1.00 1.00 H new ATOM 0 HB2 LEU A 68 67.297 -16.423 -4.917 1.00 1.00 H new ATOM 0 HB3 LEU A 68 65.725 -16.844 -4.267 1.00 1.00 H new ATOM 0 HG LEU A 68 67.968 -17.692 -2.516 1.00 1.00 H new ATOM 0 HD11 LEU A 68 68.492 -15.401 -1.659 1.00 1.00 H new ATOM 0 HD12 LEU A 68 68.982 -15.593 -3.359 1.00 1.00 H new ATOM 0 HD13 LEU A 68 67.495 -14.701 -2.956 1.00 1.00 H new ATOM 0 HD21 LEU A 68 66.556 -16.594 -0.758 1.00 1.00 H new ATOM 0 HD22 LEU A 68 65.506 -15.933 -2.033 1.00 1.00 H new ATOM 0 HD23 LEU A 68 65.595 -17.691 -1.778 1.00 1.00 H new ATOM 1034 N LEU A 69 64.990 -19.767 -4.174 1.00 1.00 N ATOM 1035 CA LEU A 69 64.098 -20.626 -3.387 1.00 1.00 C ATOM 1036 C LEU A 69 64.637 -22.075 -3.313 1.00 1.00 C ATOM 1037 O LEU A 69 65.022 -22.528 -2.235 1.00 1.00 O ATOM 1038 CB LEU A 69 62.716 -20.637 -4.057 1.00 1.00 C ATOM 1039 CG LEU A 69 61.618 -20.974 -3.028 1.00 1.00 C ATOM 1040 CD1 LEU A 69 61.168 -19.701 -2.302 1.00 1.00 C ATOM 1041 CD2 LEU A 69 60.414 -21.600 -3.743 1.00 1.00 C ATOM 0 H LEU A 69 64.609 -19.448 -5.065 1.00 1.00 H new ATOM 0 HA LEU A 69 64.036 -20.233 -2.372 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.515 -19.664 -4.506 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.703 -21.369 -4.864 1.00 1.00 H new ATOM 0 HG LEU A 69 62.021 -21.679 -2.302 1.00 1.00 H new ATOM 0 HD11 LEU A 69 60.393 -19.950 -1.578 1.00 1.00 H new ATOM 0 HD12 LEU A 69 62.019 -19.257 -1.785 1.00 1.00 H new ATOM 0 HD13 LEU A 69 60.772 -18.989 -3.027 1.00 1.00 H new ATOM 0 HD21 LEU A 69 59.640 -21.837 -3.013 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.019 -20.896 -4.475 1.00 1.00 H new ATOM 0 HD23 LEU A 69 60.726 -22.513 -4.250 1.00 1.00 H new ATOM 1053 N ALA A 70 64.672 -22.806 -4.443 1.00 1.00 N ATOM 1054 CA ALA A 70 65.192 -24.187 -4.364 1.00 1.00 C ATOM 1055 C ALA A 70 66.711 -24.141 -4.368 1.00 1.00 C ATOM 1056 O ALA A 70 67.348 -24.279 -3.328 1.00 1.00 O ATOM 1057 CB ALA A 70 64.694 -25.029 -5.547 1.00 1.00 C ATOM 0 H ALA A 70 64.369 -22.493 -5.365 1.00 1.00 H new ATOM 0 HA ALA A 70 64.833 -24.650 -3.445 1.00 1.00 H new ATOM 0 HB1 ALA A 70 65.091 -26.041 -5.466 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.605 -25.064 -5.536 1.00 1.00 H new ATOM 0 HB3 ALA A 70 65.033 -24.581 -6.481 1.00 1.00 H new ATOM 1063 N ALA A 71 67.284 -23.955 -5.547 1.00 1.00 N ATOM 1064 CA ALA A 71 68.722 -23.887 -5.750 1.00 1.00 C ATOM 1065 C ALA A 71 69.399 -22.871 -4.818 1.00 1.00 C ATOM 1066 O ALA A 71 70.582 -22.577 -4.986 1.00 1.00 O ATOM 1067 CB ALA A 71 69.037 -23.666 -7.249 1.00 1.00 C ATOM 0 H ALA A 71 66.749 -23.845 -6.409 1.00 1.00 H new ATOM 0 HA ALA A 71 69.158 -24.845 -5.469 1.00 1.00 H new ATOM 0 HB1 ALA A 71 70.117 -23.616 -7.390 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.632 -24.493 -7.832 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.584 -22.732 -7.582 1.00 1.00 H new ATOM 1073 N HIS A 72 68.635 -22.321 -3.855 1.00 1.00 N ATOM 1074 CA HIS A 72 69.141 -21.319 -2.908 1.00 1.00 C ATOM 1075 C HIS A 72 70.653 -21.400 -2.703 1.00 1.00 C ATOM 1076 O HIS A 72 71.345 -20.392 -2.845 1.00 1.00 O ATOM 1077 CB HIS A 72 68.418 -21.521 -1.548 1.00 1.00 C ATOM 1078 CG HIS A 72 69.117 -22.563 -0.686 1.00 1.00 C ATOM 1079 ND1 HIS A 72 69.644 -22.257 0.563 1.00 1.00 N ATOM 1080 CD2 HIS A 72 69.363 -23.905 -0.871 1.00 1.00 C ATOM 1081 CE1 HIS A 72 70.172 -23.387 1.074 1.00 1.00 C ATOM 1082 NE2 HIS A 72 70.029 -24.420 0.241 1.00 1.00 N ATOM 0 H HIS A 72 67.653 -22.560 -3.715 1.00 1.00 H new ATOM 0 HA HIS A 72 68.936 -20.332 -3.324 1.00 1.00 H new ATOM 0 HB2 HIS A 72 68.380 -20.573 -1.012 1.00 1.00 H new ATOM 0 HB3 HIS A 72 67.388 -21.828 -1.726 1.00 1.00 H new ATOM 0 HD2 HIS A 72 69.082 -24.473 -1.745 1.00 1.00 H new ATOM 0 HE1 HIS A 72 70.652 -23.449 2.039 1.00 1.00 H new ATOM 0 HE2 HIS A 72 70.340 -25.380 0.386 1.00 1.00 H new ATOM 1090 N MET A 73 71.177 -22.573 -2.391 1.00 1.00 N ATOM 1091 CA MET A 73 72.614 -22.685 -2.213 1.00 1.00 C ATOM 1092 C MET A 73 73.288 -22.618 -3.580 1.00 1.00 C ATOM 1093 O MET A 73 74.283 -21.916 -3.760 1.00 1.00 O ATOM 1094 CB MET A 73 72.980 -23.994 -1.501 1.00 1.00 C ATOM 1095 CG MET A 73 74.501 -24.029 -1.190 1.00 1.00 C ATOM 1096 SD MET A 73 74.769 -24.058 0.604 1.00 1.00 S ATOM 1097 CE MET A 73 74.574 -25.842 0.823 1.00 1.00 C ATOM 0 H MET A 73 70.649 -23.436 -2.259 1.00 1.00 H new ATOM 0 HA MET A 73 72.962 -21.862 -1.589 1.00 1.00 H new ATOM 0 HB2 MET A 73 72.410 -24.085 -0.576 1.00 1.00 H new ATOM 0 HB3 MET A 73 72.710 -24.845 -2.127 1.00 1.00 H new ATOM 0 HG2 MET A 73 74.954 -24.909 -1.648 1.00 1.00 H new ATOM 0 HG3 MET A 73 74.989 -23.157 -1.625 1.00 1.00 H new ATOM 0 HE1 MET A 73 74.701 -26.095 1.876 1.00 1.00 H new ATOM 0 HE2 MET A 73 73.579 -26.142 0.495 1.00 1.00 H new ATOM 0 HE3 MET A 73 75.325 -26.365 0.231 1.00 1.00 H new ATOM 1107 N VAL A 74 72.791 -23.418 -4.523 1.00 1.00 N ATOM 1108 CA VAL A 74 73.416 -23.504 -5.838 1.00 1.00 C ATOM 1109 C VAL A 74 73.800 -22.136 -6.370 1.00 1.00 C ATOM 1110 O VAL A 74 74.895 -22.006 -6.916 1.00 1.00 O ATOM 1111 CB VAL A 74 72.474 -24.165 -6.825 1.00 1.00 C ATOM 1112 CG1 VAL A 74 73.161 -24.280 -8.186 1.00 1.00 C ATOM 1113 CG2 VAL A 74 72.085 -25.561 -6.325 1.00 1.00 C ATOM 0 H VAL A 74 71.968 -24.008 -4.402 1.00 1.00 H new ATOM 0 HA VAL A 74 74.321 -24.100 -5.724 1.00 1.00 H new ATOM 0 HB VAL A 74 71.573 -23.559 -6.921 1.00 1.00 H new ATOM 0 HG11 VAL A 74 72.484 -24.755 -8.896 1.00 1.00 H new ATOM 0 HG12 VAL A 74 73.425 -23.285 -8.546 1.00 1.00 H new ATOM 0 HG13 VAL A 74 74.065 -24.882 -8.088 1.00 1.00 H new ATOM 0 HG21 VAL A 74 71.408 -26.028 -7.040 1.00 1.00 H new ATOM 0 HG22 VAL A 74 72.981 -26.173 -6.220 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.589 -25.476 -5.358 1.00 1.00 H new ATOM 1123 N ASN A 75 72.954 -21.099 -6.233 1.00 1.00 N ATOM 1124 CA ASN A 75 73.296 -19.742 -6.707 1.00 1.00 C ATOM 1125 C ASN A 75 74.767 -19.401 -6.436 1.00 1.00 C ATOM 1126 O ASN A 75 75.305 -18.461 -6.988 1.00 1.00 O ATOM 1127 CB ASN A 75 72.379 -18.722 -5.975 1.00 1.00 C ATOM 1128 CG ASN A 75 71.416 -18.029 -6.939 1.00 1.00 C ATOM 1129 OD1 ASN A 75 70.595 -18.681 -7.583 1.00 1.00 O ATOM 1130 ND2 ASN A 75 71.466 -16.730 -7.064 1.00 1.00 N ATOM 0 H ASN A 75 72.033 -21.172 -5.801 1.00 1.00 H new ATOM 0 HA ASN A 75 73.143 -19.697 -7.785 1.00 1.00 H new ATOM 0 HB2 ASN A 75 71.810 -19.236 -5.200 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.994 -17.974 -5.476 1.00 1.00 H new ATOM 0 HD21 ASN A 75 70.823 -16.253 -7.697 1.00 1.00 H new ATOM 0 HD22 ASN A 75 72.148 -16.192 -6.529 1.00 1.00 H new ATOM 1137 N GLY A 76 75.391 -20.205 -5.604 1.00 1.00 N ATOM 1138 CA GLY A 76 76.806 -20.014 -5.285 1.00 1.00 C ATOM 1139 C GLY A 76 77.556 -19.702 -6.600 1.00 1.00 C ATOM 1140 O GLY A 76 78.591 -19.050 -6.600 1.00 1.00 O ATOM 0 H GLY A 76 74.952 -20.996 -5.133 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.929 -19.197 -4.574 1.00 1.00 H new ATOM 0 HA3 GLY A 76 77.215 -20.909 -4.817 1.00 1.00 H new ATOM 1144 N ILE A 77 76.964 -20.146 -7.717 1.00 1.00 N ATOM 1145 CA ILE A 77 77.527 -19.874 -9.042 1.00 1.00 C ATOM 1146 C ILE A 77 77.353 -18.374 -9.315 1.00 1.00 C ATOM 1147 O ILE A 77 78.258 -17.710 -9.777 1.00 1.00 O ATOM 1148 CB ILE A 77 76.848 -20.737 -10.122 1.00 1.00 C ATOM 1149 CG1 ILE A 77 75.346 -20.428 -10.205 1.00 1.00 C ATOM 1150 CG2 ILE A 77 77.043 -22.224 -9.792 1.00 1.00 C ATOM 1151 CD1 ILE A 77 74.658 -21.461 -11.111 1.00 1.00 C ATOM 0 H ILE A 77 76.102 -20.691 -7.728 1.00 1.00 H new ATOM 0 HA ILE A 77 78.585 -20.135 -9.070 1.00 1.00 H new ATOM 0 HB ILE A 77 77.306 -20.506 -11.084 1.00 1.00 H new ATOM 0 HG12 ILE A 77 74.904 -20.451 -9.209 1.00 1.00 H new ATOM 0 HG13 ILE A 77 75.192 -19.423 -10.599 1.00 1.00 H new ATOM 0 HG21 ILE A 77 76.562 -22.833 -10.557 1.00 1.00 H new ATOM 0 HG22 ILE A 77 78.108 -22.453 -9.762 1.00 1.00 H new ATOM 0 HG23 ILE A 77 76.598 -22.443 -8.821 1.00 1.00 H new ATOM 0 HD11 ILE A 77 73.592 -21.241 -11.169 1.00 1.00 H new ATOM 0 HD12 ILE A 77 75.093 -21.416 -12.109 1.00 1.00 H new ATOM 0 HD13 ILE A 77 74.800 -22.460 -10.698 1.00 1.00 H new ATOM 1163 N VAL A 78 76.126 -17.913 -9.079 1.00 1.00 N ATOM 1164 CA VAL A 78 75.771 -16.517 -9.348 1.00 1.00 C ATOM 1165 C VAL A 78 77.017 -15.659 -9.051 1.00 1.00 C ATOM 1166 O VAL A 78 77.299 -14.699 -9.762 1.00 1.00 O ATOM 1167 CB VAL A 78 74.557 -16.048 -8.508 1.00 1.00 C ATOM 1168 CG1 VAL A 78 74.969 -15.703 -7.058 1.00 1.00 C ATOM 1169 CG2 VAL A 78 73.934 -14.802 -9.162 1.00 1.00 C ATOM 0 H VAL A 78 75.365 -18.479 -8.705 1.00 1.00 H new ATOM 0 HA VAL A 78 75.468 -16.411 -10.390 1.00 1.00 H new ATOM 0 HB VAL A 78 73.835 -16.864 -8.475 1.00 1.00 H new ATOM 0 HG11 VAL A 78 74.092 -15.378 -6.498 1.00 1.00 H new ATOM 0 HG12 VAL A 78 75.397 -16.585 -6.582 1.00 1.00 H new ATOM 0 HG13 VAL A 78 75.709 -14.903 -7.071 1.00 1.00 H new ATOM 0 HG21 VAL A 78 73.079 -14.470 -8.572 1.00 1.00 H new ATOM 0 HG22 VAL A 78 74.676 -14.005 -9.206 1.00 1.00 H new ATOM 0 HG23 VAL A 78 73.605 -15.047 -10.172 1.00 1.00 H new ATOM 1179 N ILE A 79 77.779 -16.043 -8.008 1.00 1.00 N ATOM 1180 CA ILE A 79 79.012 -15.332 -7.652 1.00 1.00 C ATOM 1181 C ILE A 79 80.268 -16.031 -8.225 1.00 1.00 C ATOM 1182 O ILE A 79 81.283 -15.382 -8.489 1.00 1.00 O ATOM 1183 CB ILE A 79 79.116 -15.202 -6.120 1.00 1.00 C ATOM 1184 CG1 ILE A 79 79.087 -16.594 -5.476 1.00 1.00 C ATOM 1185 CG2 ILE A 79 77.939 -14.359 -5.578 1.00 1.00 C ATOM 1186 CD1 ILE A 79 79.351 -16.481 -3.969 1.00 1.00 C ATOM 0 H ILE A 79 77.561 -16.836 -7.405 1.00 1.00 H new ATOM 0 HA ILE A 79 78.967 -14.338 -8.097 1.00 1.00 H new ATOM 0 HB ILE A 79 80.055 -14.707 -5.872 1.00 1.00 H new ATOM 0 HG12 ILE A 79 78.119 -17.064 -5.650 1.00 1.00 H new ATOM 0 HG13 ILE A 79 79.839 -17.233 -5.938 1.00 1.00 H new ATOM 0 HG21 ILE A 79 78.022 -14.273 -4.495 1.00 1.00 H new ATOM 0 HG22 ILE A 79 77.968 -13.365 -6.024 1.00 1.00 H new ATOM 0 HG23 ILE A 79 76.997 -14.844 -5.833 1.00 1.00 H new ATOM 0 HD11 ILE A 79 79.328 -17.474 -3.520 1.00 1.00 H new ATOM 0 HD12 ILE A 79 80.330 -16.030 -3.804 1.00 1.00 H new ATOM 0 HD13 ILE A 79 78.583 -15.858 -3.511 1.00 1.00 H new ATOM 1198 N ALA A 80 80.167 -17.352 -8.440 1.00 1.00 N ATOM 1199 CA ALA A 80 81.258 -18.174 -9.009 1.00 1.00 C ATOM 1200 C ALA A 80 81.269 -18.198 -10.552 1.00 1.00 C ATOM 1201 O ALA A 80 82.253 -18.635 -11.151 1.00 1.00 O ATOM 1202 CB ALA A 80 81.218 -19.617 -8.458 1.00 1.00 C ATOM 0 H ALA A 80 79.325 -17.886 -8.225 1.00 1.00 H new ATOM 0 HA ALA A 80 82.183 -17.692 -8.692 1.00 1.00 H new ATOM 0 HB1 ALA A 80 82.032 -20.196 -8.895 1.00 1.00 H new ATOM 0 HB2 ALA A 80 81.329 -19.596 -7.374 1.00 1.00 H new ATOM 0 HB3 ALA A 80 80.265 -20.079 -8.716 1.00 1.00 H new ATOM 1208 N GLU A 81 80.213 -17.689 -11.198 1.00 1.00 N ATOM 1209 CA GLU A 81 80.171 -17.639 -12.633 1.00 1.00 C ATOM 1210 C GLU A 81 81.016 -16.466 -13.069 1.00 1.00 C ATOM 1211 O GLU A 81 82.094 -16.656 -13.635 1.00 1.00 O ATOM 1212 CB GLU A 81 78.709 -17.453 -13.091 1.00 1.00 C ATOM 1213 CG GLU A 81 78.136 -18.759 -13.646 1.00 1.00 C ATOM 1214 CD GLU A 81 76.638 -18.591 -13.849 1.00 1.00 C ATOM 1215 OE1 GLU A 81 75.948 -18.384 -12.865 1.00 1.00 O ATOM 1216 OE2 GLU A 81 76.204 -18.658 -14.987 1.00 1.00 O ATOM 0 H GLU A 81 79.386 -17.311 -10.735 1.00 1.00 H new ATOM 0 HA GLU A 81 80.554 -18.559 -13.074 1.00 1.00 H new ATOM 0 HB2 GLU A 81 78.102 -17.113 -12.252 1.00 1.00 H new ATOM 0 HB3 GLU A 81 78.660 -16.677 -13.855 1.00 1.00 H new ATOM 0 HG2 GLU A 81 78.619 -19.012 -14.590 1.00 1.00 H new ATOM 0 HG3 GLU A 81 78.334 -19.580 -12.957 1.00 1.00 H new ATOM 1223 N ASP A 82 80.557 -15.239 -12.789 1.00 1.00 N ATOM 1224 CA ASP A 82 81.343 -14.095 -13.161 1.00 1.00 C ATOM 1225 C ASP A 82 82.677 -14.201 -12.463 1.00 1.00 C ATOM 1226 O ASP A 82 83.687 -14.281 -13.141 1.00 1.00 O ATOM 1227 CB ASP A 82 80.622 -12.801 -12.759 1.00 1.00 C ATOM 1228 CG ASP A 82 79.962 -12.952 -11.389 1.00 1.00 C ATOM 1229 OD1 ASP A 82 80.654 -12.796 -10.395 1.00 1.00 O ATOM 1230 OD2 ASP A 82 78.769 -13.211 -11.351 1.00 1.00 O ATOM 0 H ASP A 82 79.674 -15.034 -12.322 1.00 1.00 H new ATOM 0 HA ASP A 82 81.489 -14.069 -14.241 1.00 1.00 H new ATOM 0 HB2 ASP A 82 81.333 -11.975 -12.736 1.00 1.00 H new ATOM 0 HB3 ASP A 82 79.868 -12.552 -13.506 1.00 1.00 H new ATOM 1235 N ALA A 83 82.659 -14.215 -11.111 1.00 1.00 N ATOM 1236 CA ALA A 83 83.897 -14.330 -10.312 1.00 1.00 C ATOM 1237 C ALA A 83 85.089 -13.672 -11.012 1.00 1.00 C ATOM 1238 O ALA A 83 85.672 -12.722 -10.496 1.00 1.00 O ATOM 1239 CB ALA A 83 84.205 -15.813 -10.023 1.00 1.00 C ATOM 0 H ALA A 83 81.807 -14.149 -10.555 1.00 1.00 H new ATOM 0 HA ALA A 83 83.734 -13.803 -9.372 1.00 1.00 H new ATOM 0 HB1 ALA A 83 85.119 -15.887 -9.434 1.00 1.00 H new ATOM 0 HB2 ALA A 83 83.378 -16.255 -9.467 1.00 1.00 H new ATOM 0 HB3 ALA A 83 84.336 -16.348 -10.964 1.00 1.00 H new ATOM 1245 N LEU A 84 85.474 -14.214 -12.156 1.00 1.00 N ATOM 1246 CA LEU A 84 86.635 -13.727 -12.924 1.00 1.00 C ATOM 1247 C LEU A 84 86.827 -12.217 -12.812 1.00 1.00 C ATOM 1248 O LEU A 84 87.963 -11.746 -12.710 1.00 1.00 O ATOM 1249 CB LEU A 84 86.407 -14.024 -14.425 1.00 1.00 C ATOM 1250 CG LEU A 84 86.236 -15.536 -14.690 1.00 1.00 C ATOM 1251 CD1 LEU A 84 85.515 -15.742 -16.032 1.00 1.00 C ATOM 1252 CD2 LEU A 84 87.603 -16.228 -14.760 1.00 1.00 C ATOM 0 H LEU A 84 84.997 -15.005 -12.588 1.00 1.00 H new ATOM 0 HA LEU A 84 87.511 -14.233 -12.517 1.00 1.00 H new ATOM 0 HB2 LEU A 84 85.521 -13.492 -14.770 1.00 1.00 H new ATOM 0 HB3 LEU A 84 87.251 -13.647 -15.003 1.00 1.00 H new ATOM 0 HG LEU A 84 85.654 -15.966 -13.875 1.00 1.00 H new ATOM 0 HD11 LEU A 84 85.394 -16.809 -16.220 1.00 1.00 H new ATOM 0 HD12 LEU A 84 84.535 -15.266 -15.995 1.00 1.00 H new ATOM 0 HD13 LEU A 84 86.104 -15.297 -16.834 1.00 1.00 H new ATOM 0 HD21 LEU A 84 87.463 -17.293 -14.947 1.00 1.00 H new ATOM 0 HD22 LEU A 84 88.191 -15.792 -15.568 1.00 1.00 H new ATOM 0 HD23 LEU A 84 88.128 -16.092 -13.815 1.00 1.00 H new ATOM 1264 N ILE A 85 85.730 -11.466 -12.784 1.00 1.00 N ATOM 1265 CA ILE A 85 85.815 -10.008 -12.631 1.00 1.00 C ATOM 1266 C ILE A 85 85.517 -9.651 -11.166 1.00 1.00 C ATOM 1267 O ILE A 85 86.077 -8.702 -10.614 1.00 1.00 O ATOM 1268 CB ILE A 85 84.887 -9.278 -13.664 1.00 1.00 C ATOM 1269 CG1 ILE A 85 83.673 -8.600 -13.001 1.00 1.00 C ATOM 1270 CG2 ILE A 85 84.379 -10.272 -14.715 1.00 1.00 C ATOM 1271 CD1 ILE A 85 82.746 -9.631 -12.342 1.00 1.00 C ATOM 0 H ILE A 85 84.781 -11.832 -12.864 1.00 1.00 H new ATOM 0 HA ILE A 85 86.821 -9.656 -12.858 1.00 1.00 H new ATOM 0 HB ILE A 85 85.495 -8.502 -14.129 1.00 1.00 H new ATOM 0 HG12 ILE A 85 84.017 -7.887 -12.252 1.00 1.00 H new ATOM 0 HG13 ILE A 85 83.117 -8.034 -13.749 1.00 1.00 H new ATOM 0 HG21 ILE A 85 83.736 -9.753 -15.426 1.00 1.00 H new ATOM 0 HG22 ILE A 85 85.227 -10.708 -15.243 1.00 1.00 H new ATOM 0 HG23 ILE A 85 83.812 -11.063 -14.224 1.00 1.00 H new ATOM 0 HD11 ILE A 85 81.900 -9.119 -11.884 1.00 1.00 H new ATOM 0 HD12 ILE A 85 82.383 -10.328 -13.097 1.00 1.00 H new ATOM 0 HD13 ILE A 85 83.296 -10.179 -11.577 1.00 1.00 H new ATOM 1283 N ALA A 86 84.618 -10.430 -10.566 1.00 1.00 N ATOM 1284 CA ALA A 86 84.226 -10.201 -9.177 1.00 1.00 C ATOM 1285 C ALA A 86 85.443 -10.387 -8.253 1.00 1.00 C ATOM 1286 O ALA A 86 85.839 -9.463 -7.548 1.00 1.00 O ATOM 1287 CB ALA A 86 83.086 -11.169 -8.794 1.00 1.00 C ATOM 0 H ALA A 86 84.151 -11.218 -11.015 1.00 1.00 H new ATOM 0 HA ALA A 86 83.864 -9.179 -9.062 1.00 1.00 H new ATOM 0 HB1 ALA A 86 82.795 -10.997 -7.758 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.229 -10.997 -9.445 1.00 1.00 H new ATOM 0 HB3 ALA A 86 83.428 -12.198 -8.909 1.00 1.00 H new ATOM 1293 N GLU A 87 86.026 -11.588 -8.233 1.00 1.00 N ATOM 1294 CA GLU A 87 87.178 -11.846 -7.366 1.00 1.00 C ATOM 1295 C GLU A 87 88.383 -10.991 -7.789 1.00 1.00 C ATOM 1296 O GLU A 87 89.513 -11.253 -7.369 1.00 1.00 O ATOM 1297 CB GLU A 87 87.539 -13.357 -7.390 1.00 1.00 C ATOM 1298 CG GLU A 87 87.548 -13.948 -5.966 1.00 1.00 C ATOM 1299 CD GLU A 87 86.120 -14.119 -5.458 1.00 1.00 C ATOM 1300 OE1 GLU A 87 85.356 -13.175 -5.566 1.00 1.00 O ATOM 1301 OE2 GLU A 87 85.813 -15.192 -4.963 1.00 1.00 O ATOM 0 H GLU A 87 85.726 -12.384 -8.796 1.00 1.00 H new ATOM 0 HA GLU A 87 86.912 -11.569 -6.346 1.00 1.00 H new ATOM 0 HB2 GLU A 87 86.820 -13.896 -8.006 1.00 1.00 H new ATOM 0 HB3 GLU A 87 88.518 -13.493 -7.850 1.00 1.00 H new ATOM 0 HG2 GLU A 87 88.059 -14.911 -5.967 1.00 1.00 H new ATOM 0 HG3 GLU A 87 88.104 -13.293 -5.296 1.00 1.00 H new ATOM 1308 N ALA A 88 88.134 -9.954 -8.592 1.00 1.00 N ATOM 1309 CA ALA A 88 89.195 -9.042 -9.030 1.00 1.00 C ATOM 1310 C ALA A 88 88.905 -7.647 -8.466 1.00 1.00 C ATOM 1311 O ALA A 88 89.783 -6.788 -8.413 1.00 1.00 O ATOM 1312 CB ALA A 88 89.283 -9.011 -10.563 1.00 1.00 C ATOM 0 H ALA A 88 87.208 -9.724 -8.952 1.00 1.00 H new ATOM 0 HA ALA A 88 90.158 -9.389 -8.657 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.076 -8.328 -10.868 1.00 1.00 H new ATOM 0 HB2 ALA A 88 89.502 -10.012 -10.935 1.00 1.00 H new ATOM 0 HB3 ALA A 88 88.333 -8.671 -10.975 1.00 1.00 H new ATOM 1318 N VAL A 89 87.662 -7.470 -7.998 1.00 1.00 N ATOM 1319 CA VAL A 89 87.240 -6.211 -7.382 1.00 1.00 C ATOM 1320 C VAL A 89 87.037 -6.412 -5.885 1.00 1.00 C ATOM 1321 O VAL A 89 86.217 -5.744 -5.267 1.00 1.00 O ATOM 1322 CB VAL A 89 86.001 -5.613 -8.050 1.00 1.00 C ATOM 1323 CG1 VAL A 89 86.300 -5.419 -9.534 1.00 1.00 C ATOM 1324 CG2 VAL A 89 84.803 -6.535 -7.891 1.00 1.00 C ATOM 0 H VAL A 89 86.934 -8.184 -8.036 1.00 1.00 H new ATOM 0 HA VAL A 89 88.035 -5.481 -7.533 1.00 1.00 H new ATOM 0 HB VAL A 89 85.762 -4.660 -7.578 1.00 1.00 H new ATOM 0 HG11 VAL A 89 85.427 -4.993 -10.028 1.00 1.00 H new ATOM 0 HG12 VAL A 89 87.148 -4.744 -9.649 1.00 1.00 H new ATOM 0 HG13 VAL A 89 86.539 -6.382 -9.986 1.00 1.00 H new ATOM 0 HG21 VAL A 89 83.934 -6.089 -8.374 1.00 1.00 H new ATOM 0 HG22 VAL A 89 85.021 -7.498 -8.354 1.00 1.00 H new ATOM 0 HG23 VAL A 89 84.594 -6.681 -6.831 1.00 1.00 H new ATOM 1334 N GLY A 90 87.825 -7.323 -5.301 1.00 1.00 N ATOM 1335 CA GLY A 90 87.762 -7.587 -3.868 1.00 1.00 C ATOM 1336 C GLY A 90 88.301 -6.402 -3.067 1.00 1.00 C ATOM 1337 O GLY A 90 87.737 -6.049 -2.031 1.00 1.00 O ATOM 0 H GLY A 90 88.511 -7.887 -5.803 1.00 1.00 H new ATOM 0 HA2 GLY A 90 86.731 -7.788 -3.577 1.00 1.00 H new ATOM 0 HA3 GLY A 90 88.340 -8.481 -3.634 1.00 1.00 H new ATOM 1341 N PRO A 91 89.369 -5.764 -3.518 1.00 1.00 N ATOM 1342 CA PRO A 91 89.945 -4.588 -2.801 1.00 1.00 C ATOM 1343 C PRO A 91 88.861 -3.585 -2.438 1.00 1.00 C ATOM 1344 O PRO A 91 89.103 -2.631 -1.698 1.00 1.00 O ATOM 1345 CB PRO A 91 90.941 -4.006 -3.806 1.00 1.00 C ATOM 1346 CG PRO A 91 91.386 -5.185 -4.600 1.00 1.00 C ATOM 1347 CD PRO A 91 90.150 -6.082 -4.733 1.00 1.00 C ATOM 0 HA PRO A 91 90.416 -4.854 -1.855 1.00 1.00 H new ATOM 0 HB2 PRO A 91 90.474 -3.252 -4.439 1.00 1.00 H new ATOM 0 HB3 PRO A 91 91.780 -3.524 -3.303 1.00 1.00 H new ATOM 0 HG2 PRO A 91 91.757 -4.881 -5.579 1.00 1.00 H new ATOM 0 HG3 PRO A 91 92.200 -5.710 -4.100 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.589 -5.862 -5.641 1.00 1.00 H new ATOM 0 HD3 PRO A 91 90.421 -7.137 -4.773 1.00 1.00 H new ATOM 1355 N HIS A 92 87.659 -3.823 -2.958 1.00 1.00 N ATOM 1356 CA HIS A 92 86.544 -2.941 -2.684 1.00 1.00 C ATOM 1357 C HIS A 92 86.338 -2.887 -1.175 1.00 1.00 C ATOM 1358 O HIS A 92 85.662 -2.014 -0.671 1.00 1.00 O ATOM 1359 CB HIS A 92 85.269 -3.412 -3.408 1.00 1.00 C ATOM 1360 CG HIS A 92 84.285 -2.269 -3.525 1.00 1.00 C ATOM 1361 ND1 HIS A 92 84.453 -1.244 -4.445 1.00 1.00 N ATOM 1362 CD2 HIS A 92 83.122 -1.977 -2.852 1.00 1.00 C ATOM 1363 CE1 HIS A 92 83.418 -0.394 -4.302 1.00 1.00 C ATOM 1364 NE2 HIS A 92 82.581 -0.789 -3.343 1.00 1.00 N ATOM 0 H HIS A 92 87.440 -4.613 -3.565 1.00 1.00 H new ATOM 0 HA HIS A 92 86.763 -1.942 -3.060 1.00 1.00 H new ATOM 0 HB2 HIS A 92 85.522 -3.787 -4.400 1.00 1.00 H new ATOM 0 HB3 HIS A 92 84.815 -4.238 -2.861 1.00 1.00 H new ATOM 0 HD2 HIS A 92 82.693 -2.577 -2.063 1.00 1.00 H new ATOM 0 HE1 HIS A 92 83.283 0.500 -4.893 1.00 1.00 H new ATOM 0 HE2 HIS A 92 81.728 -0.323 -3.034 1.00 1.00 H new ATOM 1372 N LEU A 93 86.957 -3.823 -0.456 1.00 1.00 N ATOM 1373 CA LEU A 93 86.860 -3.814 1.004 1.00 1.00 C ATOM 1374 C LEU A 93 87.514 -2.528 1.517 1.00 1.00 C ATOM 1375 O LEU A 93 86.885 -1.735 2.216 1.00 1.00 O ATOM 1376 CB LEU A 93 87.539 -5.050 1.619 1.00 1.00 C ATOM 1377 CG LEU A 93 88.986 -5.233 1.068 1.00 1.00 C ATOM 1378 CD1 LEU A 93 90.033 -4.772 2.108 1.00 1.00 C ATOM 1379 CD2 LEU A 93 89.224 -6.713 0.729 1.00 1.00 C ATOM 0 H LEU A 93 87.518 -4.580 -0.848 1.00 1.00 H new ATOM 0 HA LEU A 93 85.811 -3.848 1.299 1.00 1.00 H new ATOM 0 HB2 LEU A 93 87.571 -4.948 2.704 1.00 1.00 H new ATOM 0 HB3 LEU A 93 86.948 -5.939 1.399 1.00 1.00 H new ATOM 0 HG LEU A 93 89.093 -4.623 0.171 1.00 1.00 H new ATOM 0 HD11 LEU A 93 91.035 -4.909 1.701 1.00 1.00 H new ATOM 0 HD12 LEU A 93 89.876 -3.718 2.339 1.00 1.00 H new ATOM 0 HD13 LEU A 93 89.927 -5.363 3.018 1.00 1.00 H new ATOM 0 HD21 LEU A 93 90.236 -6.840 0.344 1.00 1.00 H new ATOM 0 HD22 LEU A 93 89.100 -7.317 1.628 1.00 1.00 H new ATOM 0 HD23 LEU A 93 88.506 -7.033 -0.026 1.00 1.00 H new ATOM 1391 N ALA A 94 88.778 -2.331 1.140 1.00 1.00 N ATOM 1392 CA ALA A 94 89.515 -1.139 1.534 1.00 1.00 C ATOM 1393 C ALA A 94 88.746 0.084 1.077 1.00 1.00 C ATOM 1394 O ALA A 94 88.464 0.989 1.860 1.00 1.00 O ATOM 1395 CB ALA A 94 90.891 -1.138 0.868 1.00 1.00 C ATOM 0 H ALA A 94 89.309 -2.983 0.563 1.00 1.00 H new ATOM 0 HA ALA A 94 89.637 -1.127 2.617 1.00 1.00 H new ATOM 0 HB1 ALA A 94 91.439 -0.244 1.166 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.446 -2.024 1.178 1.00 1.00 H new ATOM 0 HB3 ALA A 94 90.771 -1.146 -0.215 1.00 1.00 H new ATOM 1401 N ARG A 95 88.371 0.085 -0.195 1.00 1.00 N ATOM 1402 CA ARG A 95 87.603 1.185 -0.734 1.00 1.00 C ATOM 1403 C ARG A 95 86.326 1.263 0.063 1.00 1.00 C ATOM 1404 O ARG A 95 86.021 2.247 0.741 1.00 1.00 O ATOM 1405 CB ARG A 95 87.293 0.923 -2.212 1.00 1.00 C ATOM 1406 CG ARG A 95 86.829 2.209 -2.928 1.00 1.00 C ATOM 1407 CD ARG A 95 85.987 1.824 -4.155 1.00 1.00 C ATOM 1408 NE ARG A 95 85.883 2.932 -5.118 1.00 1.00 N ATOM 1409 CZ ARG A 95 86.077 2.750 -6.435 1.00 1.00 C ATOM 1410 NH1 ARG A 95 86.390 1.573 -6.912 1.00 1.00 N ATOM 1411 NH2 ARG A 95 85.939 3.755 -7.258 1.00 1.00 N ATOM 0 H ARG A 95 88.586 -0.657 -0.861 1.00 1.00 H new ATOM 0 HA ARG A 95 88.155 2.122 -0.667 1.00 1.00 H new ATOM 0 HB2 ARG A 95 88.181 0.530 -2.707 1.00 1.00 H new ATOM 0 HB3 ARG A 95 86.519 0.160 -2.293 1.00 1.00 H new ATOM 0 HG2 ARG A 95 86.243 2.827 -2.248 1.00 1.00 H new ATOM 0 HG3 ARG A 95 87.691 2.801 -3.234 1.00 1.00 H new ATOM 0 HD2 ARG A 95 86.433 0.958 -4.644 1.00 1.00 H new ATOM 0 HD3 ARG A 95 84.989 1.528 -3.832 1.00 1.00 H new ATOM 0 HE ARG A 95 85.657 3.866 -4.775 1.00 1.00 H new ATOM 0 HH11 ARG A 95 86.490 0.777 -6.282 1.00 1.00 H new ATOM 0 HH12 ARG A 95 86.534 1.451 -7.914 1.00 1.00 H new ATOM 0 HH21 ARG A 95 85.684 4.676 -6.900 1.00 1.00 H new ATOM 0 HH22 ARG A 95 86.086 3.619 -8.258 1.00 1.00 H new ATOM 1425 N ALA A 96 85.540 0.222 0.069 1.00 1.00 N ATOM 1426 CA ALA A 96 84.333 0.274 0.812 1.00 1.00 C ATOM 1427 C ALA A 96 84.570 0.821 2.208 1.00 1.00 C ATOM 1428 O ALA A 96 83.617 0.954 2.943 1.00 1.00 O ATOM 1429 CB ALA A 96 83.654 -1.071 0.780 1.00 1.00 C ATOM 0 H ALA A 96 85.717 -0.653 -0.425 1.00 1.00 H new ATOM 0 HA ALA A 96 83.643 0.979 0.348 1.00 1.00 H new ATOM 0 HB1 ALA A 96 82.728 -1.025 1.352 1.00 1.00 H new ATOM 0 HB2 ALA A 96 83.430 -1.341 -0.252 1.00 1.00 H new ATOM 0 HB3 ALA A 96 84.313 -1.822 1.216 1.00 1.00 H new ATOM 1435 N LEU A 97 85.862 0.885 2.633 1.00 1.00 N ATOM 1436 CA LEU A 97 86.261 1.148 4.041 1.00 1.00 C ATOM 1437 C LEU A 97 85.049 1.157 4.938 1.00 1.00 C ATOM 1438 O LEU A 97 85.040 0.409 5.898 1.00 1.00 O ATOM 1439 CB LEU A 97 86.856 2.576 4.024 1.00 1.00 C ATOM 1440 CG LEU A 97 87.340 3.037 5.409 1.00 1.00 C ATOM 1441 CD1 LEU A 97 88.694 2.400 5.729 1.00 1.00 C ATOM 1442 CD2 LEU A 97 87.483 4.570 5.411 1.00 1.00 C ATOM 0 H LEU A 97 86.656 0.755 2.006 1.00 1.00 H new ATOM 0 HA LEU A 97 86.954 0.390 4.407 1.00 1.00 H new ATOM 0 HB2 LEU A 97 87.690 2.609 3.323 1.00 1.00 H new ATOM 0 HB3 LEU A 97 86.104 3.274 3.656 1.00 1.00 H new ATOM 0 HG LEU A 97 86.615 2.731 6.164 1.00 1.00 H new ATOM 0 HD11 LEU A 97 89.029 2.732 6.712 1.00 1.00 H new ATOM 0 HD12 LEU A 97 88.595 1.315 5.727 1.00 1.00 H new ATOM 0 HD13 LEU A 97 89.424 2.699 4.977 1.00 1.00 H new ATOM 0 HD21 LEU A 97 87.826 4.902 6.391 1.00 1.00 H new ATOM 0 HD22 LEU A 97 88.207 4.869 4.653 1.00 1.00 H new ATOM 0 HD23 LEU A 97 86.518 5.026 5.191 1.00 1.00 H new ATOM 1454 N GLY A 98 84.005 1.884 4.683 1.00 1.00 N ATOM 1455 CA GLY A 98 82.843 1.726 5.519 1.00 1.00 C ATOM 1456 C GLY A 98 82.519 0.214 5.590 1.00 1.00 C ATOM 1457 O GLY A 98 81.923 -0.239 6.566 1.00 1.00 O ATOM 0 H GLY A 98 83.926 2.570 3.933 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.032 2.124 6.516 1.00 1.00 H new ATOM 0 HA3 GLY A 98 81.998 2.280 5.109 1.00 1.00 H new ATOM 1461 N GLN A 99 82.963 -0.599 4.571 1.00 1.00 N ATOM 1462 CA GLN A 99 82.712 -2.052 4.682 1.00 1.00 C ATOM 1463 C GLN A 99 83.543 -2.547 5.837 1.00 1.00 C ATOM 1464 O GLN A 99 83.262 -3.572 6.450 1.00 1.00 O ATOM 1465 CB GLN A 99 83.090 -2.847 3.419 1.00 1.00 C ATOM 1466 CG GLN A 99 82.701 -4.339 3.544 1.00 1.00 C ATOM 1467 CD GLN A 99 81.312 -4.574 2.950 1.00 1.00 C ATOM 1468 OE1 GLN A 99 80.304 -4.411 3.638 1.00 1.00 O ATOM 1469 NE2 GLN A 99 81.202 -4.936 1.702 1.00 1.00 N ATOM 0 H GLN A 99 83.456 -0.291 3.733 1.00 1.00 H new ATOM 0 HA GLN A 99 81.642 -2.204 4.825 1.00 1.00 H new ATOM 0 HB2 GLN A 99 82.591 -2.412 2.553 1.00 1.00 H new ATOM 0 HB3 GLN A 99 84.163 -2.764 3.244 1.00 1.00 H new ATOM 0 HG2 GLN A 99 83.435 -4.958 3.028 1.00 1.00 H new ATOM 0 HG3 GLN A 99 82.712 -4.639 4.592 1.00 1.00 H new ATOM 0 HE21 GLN A 99 82.039 -5.070 1.134 1.00 1.00 H new ATOM 0 HE22 GLN A 99 80.279 -5.085 1.294 1.00 1.00 H new ATOM 1478 N ILE A 100 84.548 -1.764 6.167 1.00 1.00 N ATOM 1479 CA ILE A 100 85.387 -2.122 7.305 1.00 1.00 C ATOM 1480 C ILE A 100 84.501 -2.089 8.549 1.00 1.00 C ATOM 1481 O ILE A 100 84.616 -2.952 9.412 1.00 1.00 O ATOM 1482 CB ILE A 100 86.622 -1.180 7.462 1.00 1.00 C ATOM 1483 CG1 ILE A 100 87.840 -1.989 7.951 1.00 1.00 C ATOM 1484 CG2 ILE A 100 86.347 -0.068 8.493 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.392 -2.902 6.836 1.00 1.00 C ATOM 0 H ILE A 100 84.804 -0.902 5.686 1.00 1.00 H new ATOM 0 HA ILE A 100 85.803 -3.117 7.151 1.00 1.00 H new ATOM 0 HB ILE A 100 86.819 -0.733 6.488 1.00 1.00 H new ATOM 0 HG12 ILE A 100 88.622 -1.307 8.285 1.00 1.00 H new ATOM 0 HG13 ILE A 100 87.555 -2.594 8.812 1.00 1.00 H new ATOM 0 HG21 ILE A 100 87.225 0.572 8.581 1.00 1.00 H new ATOM 0 HG22 ILE A 100 85.495 0.528 8.167 1.00 1.00 H new ATOM 0 HG23 ILE A 100 86.127 -0.516 9.462 1.00 1.00 H new ATOM 0 HD11 ILE A 100 89.250 -3.459 7.213 1.00 1.00 H new ATOM 0 HD12 ILE A 100 87.617 -3.600 6.520 1.00 1.00 H new ATOM 0 HD13 ILE A 100 88.700 -2.293 5.986 1.00 1.00 H new ATOM 1497 N VAL A 101 83.596 -1.096 8.632 1.00 1.00 N ATOM 1498 CA VAL A 101 82.700 -1.018 9.785 1.00 1.00 C ATOM 1499 C VAL A 101 81.888 -2.291 9.861 1.00 1.00 C ATOM 1500 O VAL A 101 81.956 -3.017 10.833 1.00 1.00 O ATOM 1501 CB VAL A 101 81.751 0.173 9.656 1.00 1.00 C ATOM 1502 CG1 VAL A 101 80.804 0.193 10.863 1.00 1.00 C ATOM 1503 CG2 VAL A 101 82.559 1.471 9.623 1.00 1.00 C ATOM 0 H VAL A 101 83.472 -0.361 7.935 1.00 1.00 H new ATOM 0 HA VAL A 101 83.298 -0.891 10.687 1.00 1.00 H new ATOM 0 HB VAL A 101 81.174 0.084 8.735 1.00 1.00 H new ATOM 0 HG11 VAL A 101 80.124 1.040 10.778 1.00 1.00 H new ATOM 0 HG12 VAL A 101 80.229 -0.733 10.890 1.00 1.00 H new ATOM 0 HG13 VAL A 101 81.386 0.285 11.780 1.00 1.00 H new ATOM 0 HG21 VAL A 101 81.881 2.319 9.531 1.00 1.00 H new ATOM 0 HG22 VAL A 101 83.135 1.565 10.544 1.00 1.00 H new ATOM 0 HG23 VAL A 101 83.238 1.455 8.771 1.00 1.00 H new ATOM 1513 N CYS A 102 81.103 -2.543 8.837 1.00 1.00 N ATOM 1514 CA CYS A 102 80.257 -3.716 8.788 1.00 1.00 C ATOM 1515 C CYS A 102 81.000 -4.992 9.219 1.00 1.00 C ATOM 1516 O CYS A 102 80.382 -5.897 9.760 1.00 1.00 O ATOM 1517 CB CYS A 102 79.811 -3.844 7.318 1.00 1.00 C ATOM 1518 SG CYS A 102 78.239 -4.721 7.167 1.00 1.00 S ATOM 0 H CYS A 102 81.033 -1.942 8.016 1.00 1.00 H new ATOM 0 HA CYS A 102 79.419 -3.606 9.476 1.00 1.00 H new ATOM 0 HB2 CYS A 102 79.717 -2.851 6.879 1.00 1.00 H new ATOM 0 HB3 CYS A 102 80.577 -4.372 6.750 1.00 1.00 H new ATOM 0 HG CYS A 102 77.906 -4.801 5.913 1.00 1.00 H new ATOM 1523 N ARG A 103 82.323 -4.985 9.026 1.00 1.00 N ATOM 1524 CA ARG A 103 83.222 -6.123 9.385 1.00 1.00 C ATOM 1525 C ARG A 103 83.704 -6.067 10.843 1.00 1.00 C ATOM 1526 O ARG A 103 83.636 -7.032 11.601 1.00 1.00 O ATOM 1527 CB ARG A 103 84.438 -6.083 8.428 1.00 1.00 C ATOM 1528 CG ARG A 103 85.597 -6.960 8.934 1.00 1.00 C ATOM 1529 CD ARG A 103 86.710 -6.974 7.882 1.00 1.00 C ATOM 1530 NE ARG A 103 87.887 -7.655 8.406 1.00 1.00 N ATOM 1531 CZ ARG A 103 88.651 -7.073 9.327 1.00 1.00 C ATOM 1532 NH1 ARG A 103 88.367 -5.865 9.731 1.00 1.00 N ATOM 1533 NH2 ARG A 103 89.687 -7.697 9.814 1.00 1.00 N ATOM 0 H ARG A 103 82.817 -4.193 8.615 1.00 1.00 H new ATOM 0 HA ARG A 103 82.661 -7.052 9.283 1.00 1.00 H new ATOM 0 HB2 ARG A 103 84.132 -6.422 7.438 1.00 1.00 H new ATOM 0 HB3 ARG A 103 84.782 -5.054 8.321 1.00 1.00 H new ATOM 0 HG2 ARG A 103 85.977 -6.572 9.879 1.00 1.00 H new ATOM 0 HG3 ARG A 103 85.246 -7.974 9.124 1.00 1.00 H new ATOM 0 HD2 ARG A 103 86.362 -7.476 6.980 1.00 1.00 H new ATOM 0 HD3 ARG A 103 86.967 -5.953 7.600 1.00 1.00 H new ATOM 0 HE ARG A 103 88.127 -8.585 8.064 1.00 1.00 H new ATOM 0 HH11 ARG A 103 87.563 -5.373 9.341 1.00 1.00 H new ATOM 0 HH12 ARG A 103 88.949 -5.413 10.437 1.00 1.00 H new ATOM 0 HH21 ARG A 103 89.916 -8.636 9.489 1.00 1.00 H new ATOM 0 HH22 ARG A 103 90.269 -7.246 10.520 1.00 1.00 H new ATOM 1547 N TYR A 104 84.137 -4.887 11.172 1.00 1.00 N ATOM 1548 CA TYR A 104 84.627 -4.477 12.480 1.00 1.00 C ATOM 1549 C TYR A 104 83.479 -3.755 13.210 1.00 1.00 C ATOM 1550 O TYR A 104 83.708 -2.989 14.143 1.00 1.00 O ATOM 1551 CB TYR A 104 85.952 -3.653 12.354 1.00 1.00 C ATOM 1552 CG TYR A 104 85.859 -2.347 13.098 1.00 1.00 C ATOM 1553 CD1 TYR A 104 86.136 -2.286 14.472 1.00 1.00 C ATOM 1554 CD2 TYR A 104 85.430 -1.218 12.423 1.00 1.00 C ATOM 1555 CE1 TYR A 104 85.969 -1.078 15.159 1.00 1.00 C ATOM 1556 CE2 TYR A 104 85.273 -0.009 13.097 1.00 1.00 C ATOM 1557 CZ TYR A 104 85.536 0.063 14.469 1.00 1.00 C ATOM 1558 OH TYR A 104 85.357 1.254 15.137 1.00 1.00 O ATOM 0 H TYR A 104 84.164 -4.124 10.496 1.00 1.00 H new ATOM 0 HA TYR A 104 84.911 -5.336 13.088 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.785 -4.238 12.745 1.00 1.00 H new ATOM 0 HB3 TYR A 104 86.164 -3.460 11.302 1.00 1.00 H new ATOM 0 HD1 TYR A 104 86.476 -3.166 14.997 1.00 1.00 H new ATOM 0 HD2 TYR A 104 85.215 -1.274 11.366 1.00 1.00 H new ATOM 0 HE1 TYR A 104 86.173 -1.025 16.218 1.00 1.00 H new ATOM 0 HE2 TYR A 104 84.949 0.871 12.561 1.00 1.00 H new ATOM 0 HH TYR A 104 85.055 1.941 14.506 1.00 1.00 H new ATOM 1568 N GLY A 105 82.210 -4.025 12.856 1.00 1.00 N ATOM 1569 CA GLY A 105 81.103 -3.401 13.546 1.00 1.00 C ATOM 1570 C GLY A 105 79.857 -4.231 13.215 1.00 1.00 C ATOM 1571 O GLY A 105 79.562 -5.224 13.880 1.00 1.00 O ATOM 0 H GLY A 105 81.943 -4.663 12.106 1.00 1.00 H new ATOM 0 HA2 GLY A 105 81.280 -3.379 14.621 1.00 1.00 H new ATOM 0 HA3 GLY A 105 80.978 -2.368 13.222 1.00 1.00 H new ATOM 1575 N ALA A 106 79.120 -3.798 12.193 1.00 1.00 N ATOM 1576 CA ALA A 106 77.901 -4.456 11.753 1.00 1.00 C ATOM 1577 C ALA A 106 76.717 -4.303 12.730 1.00 1.00 C ATOM 1578 O ALA A 106 76.230 -5.297 13.262 1.00 1.00 O ATOM 1579 CB ALA A 106 78.173 -5.958 11.456 1.00 1.00 C ATOM 0 H ALA A 106 79.359 -2.972 11.645 1.00 1.00 H new ATOM 0 HA ALA A 106 77.599 -3.947 10.838 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.251 -6.437 11.128 1.00 1.00 H new ATOM 0 HB2 ALA A 106 78.925 -6.043 10.672 1.00 1.00 H new ATOM 0 HB3 ALA A 106 78.534 -6.448 12.360 1.00 1.00 H new ATOM 1585 N THR A 107 76.217 -3.085 12.984 1.00 1.00 N ATOM 1586 CA THR A 107 75.065 -2.971 13.876 1.00 1.00 C ATOM 1587 C THR A 107 73.780 -3.310 13.099 1.00 1.00 C ATOM 1588 O THR A 107 73.008 -4.127 13.553 1.00 1.00 O ATOM 1589 CB THR A 107 74.966 -1.572 14.498 1.00 1.00 C ATOM 1590 OG1 THR A 107 76.132 -1.305 15.268 1.00 1.00 O ATOM 1591 CG2 THR A 107 73.735 -1.523 15.409 1.00 1.00 C ATOM 0 H THR A 107 76.573 -2.208 12.604 1.00 1.00 H new ATOM 0 HA THR A 107 75.193 -3.679 14.695 1.00 1.00 H new ATOM 0 HB THR A 107 74.879 -0.825 13.709 1.00 1.00 H new ATOM 0 HG1 THR A 107 76.066 -0.410 15.662 1.00 1.00 H new ATOM 0 HG21 THR A 107 73.653 -0.533 15.858 1.00 1.00 H new ATOM 0 HG22 THR A 107 72.840 -1.731 14.823 1.00 1.00 H new ATOM 0 HG23 THR A 107 73.835 -2.271 16.196 1.00 1.00 H new ATOM 1599 N VAL A 108 73.475 -2.597 12.000 1.00 1.00 N ATOM 1600 CA VAL A 108 72.218 -2.827 11.279 1.00 1.00 C ATOM 1601 C VAL A 108 72.273 -4.048 10.346 1.00 1.00 C ATOM 1602 O VAL A 108 71.485 -4.126 9.403 1.00 1.00 O ATOM 1603 CB VAL A 108 71.814 -1.566 10.483 1.00 1.00 C ATOM 1604 CG1 VAL A 108 70.391 -1.729 9.888 1.00 1.00 C ATOM 1605 CG2 VAL A 108 71.834 -0.355 11.429 1.00 1.00 C ATOM 0 H VAL A 108 74.071 -1.872 11.601 1.00 1.00 H new ATOM 0 HA VAL A 108 71.462 -3.041 12.034 1.00 1.00 H new ATOM 0 HB VAL A 108 72.519 -1.420 9.664 1.00 1.00 H new ATOM 0 HG11 VAL A 108 70.124 -0.831 9.331 1.00 1.00 H new ATOM 0 HG12 VAL A 108 70.373 -2.589 9.219 1.00 1.00 H new ATOM 0 HG13 VAL A 108 69.674 -1.881 10.695 1.00 1.00 H new ATOM 0 HG21 VAL A 108 71.550 0.542 10.878 1.00 1.00 H new ATOM 0 HG22 VAL A 108 71.129 -0.518 12.244 1.00 1.00 H new ATOM 0 HG23 VAL A 108 72.837 -0.228 11.837 1.00 1.00 H new ATOM 1615 N ILE A 109 73.149 -5.038 10.618 1.00 1.00 N ATOM 1616 CA ILE A 109 73.202 -6.274 9.801 1.00 1.00 C ATOM 1617 C ILE A 109 72.655 -7.493 10.608 1.00 1.00 C ATOM 1618 O ILE A 109 71.966 -8.341 10.036 1.00 1.00 O ATOM 1619 CB ILE A 109 74.635 -6.492 9.198 1.00 1.00 C ATOM 1620 CG1 ILE A 109 75.379 -7.739 9.764 1.00 1.00 C ATOM 1621 CG2 ILE A 109 75.476 -5.241 9.458 1.00 1.00 C ATOM 1622 CD1 ILE A 109 74.988 -9.006 8.992 1.00 1.00 C ATOM 0 H ILE A 109 73.821 -5.010 11.385 1.00 1.00 H new ATOM 0 HA ILE A 109 72.540 -6.166 8.942 1.00 1.00 H new ATOM 0 HB ILE A 109 74.502 -6.674 8.132 1.00 1.00 H new ATOM 0 HG12 ILE A 109 76.456 -7.586 9.698 1.00 1.00 H new ATOM 0 HG13 ILE A 109 75.139 -7.863 10.820 1.00 1.00 H new ATOM 0 HG21 ILE A 109 76.474 -5.381 9.043 1.00 1.00 H new ATOM 0 HG22 ILE A 109 75.004 -4.380 8.985 1.00 1.00 H new ATOM 0 HG23 ILE A 109 75.550 -5.069 10.532 1.00 1.00 H new ATOM 0 HD11 ILE A 109 75.520 -9.863 9.405 1.00 1.00 H new ATOM 0 HD12 ILE A 109 73.914 -9.169 9.080 1.00 1.00 H new ATOM 0 HD13 ILE A 109 75.252 -8.888 7.941 1.00 1.00 H new ATOM 1634 N PRO A 110 72.926 -7.607 11.914 1.00 1.00 N ATOM 1635 CA PRO A 110 72.410 -8.728 12.779 1.00 1.00 C ATOM 1636 C PRO A 110 70.879 -8.626 12.953 1.00 1.00 C ATOM 1637 O PRO A 110 70.209 -9.600 13.279 1.00 1.00 O ATOM 1638 CB PRO A 110 73.159 -8.553 14.124 1.00 1.00 C ATOM 1639 CG PRO A 110 74.295 -7.649 13.791 1.00 1.00 C ATOM 1640 CD PRO A 110 73.730 -6.718 12.734 1.00 1.00 C ATOM 0 HA PRO A 110 72.587 -9.712 12.345 1.00 1.00 H new ATOM 0 HB2 PRO A 110 72.513 -8.118 14.886 1.00 1.00 H new ATOM 0 HB3 PRO A 110 73.511 -9.509 14.512 1.00 1.00 H new ATOM 0 HG2 PRO A 110 74.635 -7.097 14.667 1.00 1.00 H new ATOM 0 HG3 PRO A 110 75.151 -8.208 13.413 1.00 1.00 H new ATOM 0 HD2 PRO A 110 73.130 -5.923 13.176 1.00 1.00 H new ATOM 0 HD3 PRO A 110 74.519 -6.238 12.155 1.00 1.00 H new ATOM 1648 N ASN A 111 70.339 -7.416 12.774 1.00 1.00 N ATOM 1649 CA ASN A 111 68.902 -7.209 12.923 1.00 1.00 C ATOM 1650 C ASN A 111 68.173 -7.907 11.776 1.00 1.00 C ATOM 1651 O ASN A 111 67.494 -8.918 11.993 1.00 1.00 O ATOM 1652 CB ASN A 111 68.613 -5.708 12.904 1.00 1.00 C ATOM 1653 CG ASN A 111 67.159 -5.429 13.264 1.00 1.00 C ATOM 1654 OD1 ASN A 111 66.270 -5.578 12.425 1.00 1.00 O ATOM 1655 ND2 ASN A 111 66.863 -5.017 14.466 1.00 1.00 N ATOM 0 H ASN A 111 70.869 -6.579 12.530 1.00 1.00 H new ATOM 0 HA ASN A 111 68.554 -7.627 13.868 1.00 1.00 H new ATOM 0 HB2 ASN A 111 69.270 -5.198 13.608 1.00 1.00 H new ATOM 0 HB3 ASN A 111 68.831 -5.304 11.915 1.00 1.00 H new ATOM 0 HD21 ASN A 111 65.894 -4.818 14.712 1.00 1.00 H new ATOM 0 HD22 ASN A 111 67.601 -4.894 15.159 1.00 1.00 H new ATOM 1662 N ILE A 112 68.340 -7.411 10.545 1.00 1.00 N ATOM 1663 CA ILE A 112 67.724 -8.033 9.376 1.00 1.00 C ATOM 1664 C ILE A 112 68.013 -9.520 9.408 1.00 1.00 C ATOM 1665 O ILE A 112 67.254 -10.334 8.914 1.00 1.00 O ATOM 1666 CB ILE A 112 68.385 -7.395 8.123 1.00 1.00 C ATOM 1667 CG1 ILE A 112 67.912 -8.080 6.803 1.00 1.00 C ATOM 1668 CG2 ILE A 112 69.916 -7.501 8.276 1.00 1.00 C ATOM 1669 CD1 ILE A 112 68.916 -7.842 5.647 1.00 1.00 C ATOM 0 H ILE A 112 68.896 -6.582 10.336 1.00 1.00 H new ATOM 0 HA ILE A 112 66.645 -7.882 9.360 1.00 1.00 H new ATOM 0 HB ILE A 112 68.084 -6.350 8.055 1.00 1.00 H new ATOM 0 HG12 ILE A 112 67.795 -9.151 6.970 1.00 1.00 H new ATOM 0 HG13 ILE A 112 66.933 -7.692 6.521 1.00 1.00 H new ATOM 0 HG21 ILE A 112 70.400 -7.058 7.406 1.00 1.00 H new ATOM 0 HG22 ILE A 112 70.229 -6.970 9.175 1.00 1.00 H new ATOM 0 HG23 ILE A 112 70.202 -8.550 8.356 1.00 1.00 H new ATOM 0 HD11 ILE A 112 68.554 -8.333 4.744 1.00 1.00 H new ATOM 0 HD12 ILE A 112 69.013 -6.772 5.464 1.00 1.00 H new ATOM 0 HD13 ILE A 112 69.888 -8.253 5.919 1.00 1.00 H new ATOM 1681 N ASN A 113 69.149 -9.826 9.983 1.00 1.00 N ATOM 1682 CA ASN A 113 69.588 -11.216 10.055 1.00 1.00 C ATOM 1683 C ASN A 113 68.490 -12.030 10.723 1.00 1.00 C ATOM 1684 O ASN A 113 68.019 -13.015 10.162 1.00 1.00 O ATOM 1685 CB ASN A 113 70.923 -11.379 10.785 1.00 1.00 C ATOM 1686 CG ASN A 113 71.202 -12.853 11.042 1.00 1.00 C ATOM 1687 OD1 ASN A 113 71.315 -13.636 10.106 1.00 1.00 O ATOM 1688 ND2 ASN A 113 71.307 -13.273 12.272 1.00 1.00 N ATOM 0 H ASN A 113 69.785 -9.150 10.405 1.00 1.00 H new ATOM 0 HA ASN A 113 69.763 -11.579 9.042 1.00 1.00 H new ATOM 0 HB2 ASN A 113 71.727 -10.947 10.189 1.00 1.00 H new ATOM 0 HB3 ASN A 113 70.899 -10.835 11.729 1.00 1.00 H new ATOM 0 HD21 ASN A 113 71.484 -14.260 12.461 1.00 1.00 H new ATOM 0 HD22 ASN A 113 71.212 -12.615 13.045 1.00 1.00 H new ATOM 1695 N ALA A 114 68.084 -11.631 11.920 1.00 1.00 N ATOM 1696 CA ALA A 114 67.046 -12.350 12.647 1.00 1.00 C ATOM 1697 C ALA A 114 65.733 -12.475 11.858 1.00 1.00 C ATOM 1698 O ALA A 114 65.040 -13.489 11.981 1.00 1.00 O ATOM 1699 CB ALA A 114 66.767 -11.620 13.969 1.00 1.00 C ATOM 0 H ALA A 114 68.456 -10.816 12.408 1.00 1.00 H new ATOM 0 HA ALA A 114 67.415 -13.361 12.820 1.00 1.00 H new ATOM 0 HB1 ALA A 114 65.991 -12.151 14.521 1.00 1.00 H new ATOM 0 HB2 ALA A 114 67.679 -11.587 14.566 1.00 1.00 H new ATOM 0 HB3 ALA A 114 66.433 -10.604 13.760 1.00 1.00 H new ATOM 1705 N ALA A 115 65.397 -11.490 11.011 1.00 1.00 N ATOM 1706 CA ALA A 115 64.170 -11.577 10.202 1.00 1.00 C ATOM 1707 C ALA A 115 64.392 -12.444 8.965 1.00 1.00 C ATOM 1708 O ALA A 115 63.633 -13.347 8.666 1.00 1.00 O ATOM 1709 CB ALA A 115 63.758 -10.177 9.746 1.00 1.00 C ATOM 0 H ALA A 115 65.944 -10.641 10.869 1.00 1.00 H new ATOM 0 HA ALA A 115 63.389 -12.025 10.817 1.00 1.00 H new ATOM 0 HB1 ALA A 115 62.850 -10.242 9.147 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.573 -9.550 10.618 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.557 -9.740 9.147 1.00 1.00 H new ATOM 1715 N ILE A 116 65.457 -12.117 8.268 1.00 1.00 N ATOM 1716 CA ILE A 116 65.810 -12.851 7.052 1.00 1.00 C ATOM 1717 C ILE A 116 65.763 -14.362 7.388 1.00 1.00 C ATOM 1718 O ILE A 116 65.052 -15.142 6.756 1.00 1.00 O ATOM 1719 CB ILE A 116 67.204 -12.405 6.531 1.00 1.00 C ATOM 1720 CG1 ILE A 116 67.052 -11.461 5.318 1.00 1.00 C ATOM 1721 CG2 ILE A 116 68.064 -13.612 6.147 1.00 1.00 C ATOM 1722 CD1 ILE A 116 68.438 -11.032 4.834 1.00 1.00 C ATOM 0 H ILE A 116 66.094 -11.358 8.510 1.00 1.00 H new ATOM 0 HA ILE A 116 65.104 -12.640 6.249 1.00 1.00 H new ATOM 0 HB ILE A 116 67.704 -11.870 7.338 1.00 1.00 H new ATOM 0 HG12 ILE A 116 66.514 -11.965 4.515 1.00 1.00 H new ATOM 0 HG13 ILE A 116 66.464 -10.586 5.595 1.00 1.00 H new ATOM 0 HG21 ILE A 116 69.033 -13.268 5.786 1.00 1.00 H new ATOM 0 HG22 ILE A 116 68.207 -14.249 7.020 1.00 1.00 H new ATOM 0 HG23 ILE A 116 67.565 -14.179 5.361 1.00 1.00 H new ATOM 0 HD11 ILE A 116 68.334 -10.366 3.978 1.00 1.00 H new ATOM 0 HD12 ILE A 116 68.959 -10.512 5.638 1.00 1.00 H new ATOM 0 HD13 ILE A 116 69.010 -11.913 4.541 1.00 1.00 H new ATOM 1734 N GLU A 117 66.574 -14.702 8.385 1.00 1.00 N ATOM 1735 CA GLU A 117 66.685 -16.105 8.827 1.00 1.00 C ATOM 1736 C GLU A 117 65.289 -16.696 8.743 1.00 1.00 C ATOM 1737 O GLU A 117 65.052 -17.690 8.041 1.00 1.00 O ATOM 1738 CB GLU A 117 67.235 -16.316 10.247 1.00 1.00 C ATOM 1739 CG GLU A 117 67.178 -17.841 10.573 1.00 1.00 C ATOM 1740 CD GLU A 117 68.447 -18.305 11.282 1.00 1.00 C ATOM 1741 OE1 GLU A 117 69.418 -18.575 10.593 1.00 1.00 O ATOM 1742 OE2 GLU A 117 68.426 -18.392 12.496 1.00 1.00 O ATOM 0 H GLU A 117 67.159 -14.044 8.901 1.00 1.00 H new ATOM 0 HA GLU A 117 67.413 -16.590 8.177 1.00 1.00 H new ATOM 0 HB2 GLU A 117 68.260 -15.951 10.315 1.00 1.00 H new ATOM 0 HB3 GLU A 117 66.647 -15.751 10.970 1.00 1.00 H new ATOM 0 HG2 GLU A 117 66.312 -18.049 11.201 1.00 1.00 H new ATOM 0 HG3 GLU A 117 67.046 -18.407 9.651 1.00 1.00 H new ATOM 1749 N VAL A 118 64.387 -16.016 9.443 1.00 1.00 N ATOM 1750 CA VAL A 118 62.971 -16.423 9.462 1.00 1.00 C ATOM 1751 C VAL A 118 62.446 -16.415 8.021 1.00 1.00 C ATOM 1752 O VAL A 118 61.826 -17.380 7.574 1.00 1.00 O ATOM 1753 CB VAL A 118 62.136 -15.469 10.348 1.00 1.00 C ATOM 1754 CG1 VAL A 118 60.656 -15.861 10.312 1.00 1.00 C ATOM 1755 CG2 VAL A 118 62.637 -15.538 11.792 1.00 1.00 C ATOM 0 H VAL A 118 64.599 -15.189 10.001 1.00 1.00 H new ATOM 0 HA VAL A 118 62.883 -17.424 9.885 1.00 1.00 H new ATOM 0 HB VAL A 118 62.246 -14.455 9.964 1.00 1.00 H new ATOM 0 HG11 VAL A 118 60.084 -15.179 10.941 1.00 1.00 H new ATOM 0 HG12 VAL A 118 60.289 -15.804 9.287 1.00 1.00 H new ATOM 0 HG13 VAL A 118 60.540 -16.880 10.682 1.00 1.00 H new ATOM 0 HG21 VAL A 118 62.047 -14.865 12.414 1.00 1.00 H new ATOM 0 HG22 VAL A 118 62.536 -16.558 12.164 1.00 1.00 H new ATOM 0 HG23 VAL A 118 63.685 -15.241 11.828 1.00 1.00 H new ATOM 1765 N LEU A 119 62.675 -15.304 7.316 1.00 1.00 N ATOM 1766 CA LEU A 119 62.175 -15.196 5.946 1.00 1.00 C ATOM 1767 C LEU A 119 62.735 -16.360 5.094 1.00 1.00 C ATOM 1768 O LEU A 119 61.992 -17.280 4.757 1.00 1.00 O ATOM 1769 CB LEU A 119 62.626 -13.841 5.368 1.00 1.00 C ATOM 1770 CG LEU A 119 61.712 -13.400 4.194 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.640 -12.420 4.690 1.00 1.00 C ATOM 1772 CD2 LEU A 119 62.548 -12.700 3.109 1.00 1.00 C ATOM 0 H LEU A 119 63.187 -14.491 7.658 1.00 1.00 H new ATOM 0 HA LEU A 119 61.087 -15.254 5.934 1.00 1.00 H new ATOM 0 HB2 LEU A 119 62.607 -13.084 6.152 1.00 1.00 H new ATOM 0 HB3 LEU A 119 63.657 -13.915 5.022 1.00 1.00 H new ATOM 0 HG LEU A 119 61.235 -14.290 3.783 1.00 1.00 H new ATOM 0 HD11 LEU A 119 60.007 -12.120 3.855 1.00 1.00 H new ATOM 0 HD12 LEU A 119 60.030 -12.904 5.453 1.00 1.00 H new ATOM 0 HD13 LEU A 119 61.121 -11.539 5.115 1.00 1.00 H new ATOM 0 HD21 LEU A 119 61.898 -12.394 2.289 1.00 1.00 H new ATOM 0 HD22 LEU A 119 63.034 -11.822 3.534 1.00 1.00 H new ATOM 0 HD23 LEU A 119 63.306 -13.388 2.734 1.00 1.00 H new ATOM 1784 N GLY A 120 64.027 -16.318 4.724 1.00 1.00 N ATOM 1785 CA GLY A 120 64.556 -17.410 3.894 1.00 1.00 C ATOM 1786 C GLY A 120 64.852 -18.695 4.696 1.00 1.00 C ATOM 1787 O GLY A 120 64.096 -19.667 4.696 1.00 1.00 O ATOM 0 H GLY A 120 64.691 -15.584 4.970 1.00 1.00 H new ATOM 0 HA2 GLY A 120 63.839 -17.639 3.106 1.00 1.00 H new ATOM 0 HA3 GLY A 120 65.471 -17.076 3.405 1.00 1.00 H new ATOM 1791 N THR A 121 66.009 -18.649 5.294 1.00 1.00 N ATOM 1792 CA THR A 121 66.614 -19.730 6.073 1.00 1.00 C ATOM 1793 C THR A 121 67.786 -19.098 6.783 1.00 1.00 C ATOM 1794 O THR A 121 68.244 -19.540 7.834 1.00 1.00 O ATOM 1795 CB THR A 121 67.079 -20.854 5.137 1.00 1.00 C ATOM 1796 OG1 THR A 121 66.002 -21.227 4.294 1.00 1.00 O ATOM 1797 CG2 THR A 121 67.541 -22.084 5.933 1.00 1.00 C ATOM 0 H THR A 121 66.599 -17.818 5.258 1.00 1.00 H new ATOM 0 HA THR A 121 65.914 -20.177 6.779 1.00 1.00 H new ATOM 0 HB THR A 121 67.920 -20.488 4.548 1.00 1.00 H new ATOM 0 HG1 THR A 121 65.156 -21.115 4.776 1.00 1.00 H new ATOM 0 HG21 THR A 121 67.864 -22.863 5.243 1.00 1.00 H new ATOM 0 HG22 THR A 121 68.371 -21.806 6.582 1.00 1.00 H new ATOM 0 HG23 THR A 121 66.715 -22.456 6.539 1.00 1.00 H new ATOM 1805 N GLY A 122 68.217 -18.000 6.173 1.00 1.00 N ATOM 1806 CA GLY A 122 69.291 -17.157 6.658 1.00 1.00 C ATOM 1807 C GLY A 122 70.566 -17.227 5.845 1.00 1.00 C ATOM 1808 O GLY A 122 71.264 -16.217 5.774 1.00 1.00 O ATOM 0 H GLY A 122 67.812 -17.665 5.299 1.00 1.00 H new ATOM 0 HA2 GLY A 122 68.944 -16.124 6.676 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.517 -17.435 7.687 1.00 1.00 H new ATOM 1812 N THR A 123 70.929 -18.363 5.264 1.00 1.00 N ATOM 1813 CA THR A 123 72.194 -18.410 4.532 1.00 1.00 C ATOM 1814 C THR A 123 72.443 -17.155 3.679 1.00 1.00 C ATOM 1815 O THR A 123 71.838 -16.959 2.626 1.00 1.00 O ATOM 1816 CB THR A 123 72.271 -19.673 3.650 1.00 1.00 C ATOM 1817 OG1 THR A 123 71.472 -20.701 4.220 1.00 1.00 O ATOM 1818 CG2 THR A 123 73.728 -20.150 3.567 1.00 1.00 C ATOM 0 H THR A 123 70.394 -19.231 5.280 1.00 1.00 H new ATOM 0 HA THR A 123 72.981 -18.445 5.286 1.00 1.00 H new ATOM 0 HB THR A 123 71.905 -19.439 2.650 1.00 1.00 H new ATOM 0 HG1 THR A 123 71.520 -21.502 3.658 1.00 1.00 H new ATOM 0 HG21 THR A 123 73.784 -21.043 2.944 1.00 1.00 H new ATOM 0 HG22 THR A 123 74.344 -19.364 3.131 1.00 1.00 H new ATOM 0 HG23 THR A 123 74.092 -20.383 4.568 1.00 1.00 H new ATOM 1826 N ASP A 124 73.380 -16.337 4.166 1.00 1.00 N ATOM 1827 CA ASP A 124 73.803 -15.107 3.492 1.00 1.00 C ATOM 1828 C ASP A 124 75.300 -14.937 3.680 1.00 1.00 C ATOM 1829 O ASP A 124 75.837 -15.276 4.736 1.00 1.00 O ATOM 1830 CB ASP A 124 73.104 -13.872 4.067 1.00 1.00 C ATOM 1831 CG ASP A 124 71.681 -13.773 3.550 1.00 1.00 C ATOM 1832 OD1 ASP A 124 71.504 -13.831 2.345 1.00 1.00 O ATOM 1833 OD2 ASP A 124 70.794 -13.621 4.363 1.00 1.00 O ATOM 0 H ASP A 124 73.869 -16.511 5.044 1.00 1.00 H new ATOM 0 HA ASP A 124 73.539 -15.194 2.438 1.00 1.00 H new ATOM 0 HB2 ASP A 124 73.098 -13.925 5.156 1.00 1.00 H new ATOM 0 HB3 ASP A 124 73.659 -12.974 3.795 1.00 1.00 H new ATOM 1838 N TYR A 125 75.976 -14.398 2.675 1.00 1.00 N ATOM 1839 CA TYR A 125 77.404 -14.170 2.744 1.00 1.00 C ATOM 1840 C TYR A 125 77.767 -12.966 1.845 1.00 1.00 C ATOM 1841 O TYR A 125 77.181 -12.771 0.781 1.00 1.00 O ATOM 1842 CB TYR A 125 78.132 -15.455 2.291 1.00 1.00 C ATOM 1843 CG TYR A 125 79.340 -15.126 1.441 1.00 1.00 C ATOM 1844 CD1 TYR A 125 79.165 -14.821 0.085 1.00 1.00 C ATOM 1845 CD2 TYR A 125 80.618 -15.115 2.004 1.00 1.00 C ATOM 1846 CE1 TYR A 125 80.271 -14.508 -0.709 1.00 1.00 C ATOM 1847 CE2 TYR A 125 81.726 -14.801 1.210 1.00 1.00 C ATOM 1848 CZ TYR A 125 81.552 -14.498 -0.148 1.00 1.00 C ATOM 1849 OH TYR A 125 82.643 -14.191 -0.932 1.00 1.00 O ATOM 0 H TYR A 125 75.548 -14.109 1.795 1.00 1.00 H new ATOM 0 HA TYR A 125 77.714 -13.938 3.763 1.00 1.00 H new ATOM 0 HB2 TYR A 125 78.443 -16.028 3.165 1.00 1.00 H new ATOM 0 HB3 TYR A 125 77.446 -16.085 1.725 1.00 1.00 H new ATOM 0 HD1 TYR A 125 78.175 -14.828 -0.347 1.00 1.00 H new ATOM 0 HD2 TYR A 125 80.751 -15.348 3.050 1.00 1.00 H new ATOM 0 HE1 TYR A 125 80.137 -14.274 -1.755 1.00 1.00 H new ATOM 0 HE2 TYR A 125 82.715 -14.792 1.643 1.00 1.00 H new ATOM 0 HH TYR A 125 82.536 -13.290 -1.303 1.00 1.00 H new ATOM 1859 N ARG A 126 78.773 -12.223 2.280 1.00 1.00 N ATOM 1860 CA ARG A 126 79.289 -11.069 1.526 1.00 1.00 C ATOM 1861 C ARG A 126 80.787 -10.944 1.759 1.00 1.00 C ATOM 1862 O ARG A 126 81.278 -11.325 2.821 1.00 1.00 O ATOM 1863 CB ARG A 126 78.609 -9.753 1.962 1.00 1.00 C ATOM 1864 CG ARG A 126 77.185 -9.631 1.382 1.00 1.00 C ATOM 1865 CD ARG A 126 77.219 -9.069 -0.052 1.00 1.00 C ATOM 1866 NE ARG A 126 77.649 -10.092 -1.004 1.00 1.00 N ATOM 1867 CZ ARG A 126 76.777 -10.924 -1.571 1.00 1.00 C ATOM 1868 NH1 ARG A 126 75.512 -10.859 -1.258 1.00 1.00 N ATOM 1869 NH2 ARG A 126 77.190 -11.806 -2.439 1.00 1.00 N ATOM 0 H ARG A 126 79.259 -12.394 3.160 1.00 1.00 H new ATOM 0 HA ARG A 126 79.073 -11.236 0.471 1.00 1.00 H new ATOM 0 HB2 ARG A 126 78.564 -9.709 3.050 1.00 1.00 H new ATOM 0 HB3 ARG A 126 79.210 -8.906 1.633 1.00 1.00 H new ATOM 0 HG2 ARG A 126 76.704 -10.609 1.382 1.00 1.00 H new ATOM 0 HG3 ARG A 126 76.584 -8.980 2.017 1.00 1.00 H new ATOM 0 HD2 ARG A 126 76.230 -8.704 -0.327 1.00 1.00 H new ATOM 0 HD3 ARG A 126 77.897 -8.217 -0.097 1.00 1.00 H new ATOM 0 HE ARG A 126 78.638 -10.170 -1.239 1.00 1.00 H new ATOM 0 HH11 ARG A 126 75.190 -10.170 -0.578 1.00 1.00 H new ATOM 0 HH12 ARG A 126 74.846 -11.497 -1.693 1.00 1.00 H new ATOM 0 HH21 ARG A 126 78.179 -11.858 -2.682 1.00 1.00 H new ATOM 0 HH22 ARG A 126 76.524 -12.444 -2.874 1.00 1.00 H new ATOM 1883 N PHE A 127 81.518 -10.390 0.790 1.00 1.00 N ATOM 1884 CA PHE A 127 82.965 -10.209 0.951 1.00 1.00 C ATOM 1885 C PHE A 127 83.394 -8.832 0.439 1.00 1.00 C ATOM 1886 O PHE A 127 82.712 -8.299 -0.419 1.00 1.00 O ATOM 1887 CB PHE A 127 83.720 -11.320 0.211 1.00 1.00 C ATOM 1888 CG PHE A 127 83.753 -11.045 -1.278 1.00 1.00 C ATOM 1889 CD1 PHE A 127 82.579 -11.134 -2.035 1.00 1.00 C ATOM 1890 CD2 PHE A 127 84.962 -10.710 -1.902 1.00 1.00 C ATOM 1891 CE1 PHE A 127 82.614 -10.891 -3.413 1.00 1.00 C ATOM 1892 CE2 PHE A 127 84.997 -10.465 -3.278 1.00 1.00 C ATOM 1893 CZ PHE A 127 83.825 -10.556 -4.034 1.00 1.00 C ATOM 1894 OXT PHE A 127 84.402 -8.334 0.917 1.00 1.00 O ATOM 0 H PHE A 127 81.142 -10.063 -0.100 1.00 1.00 H new ATOM 0 HA PHE A 127 83.210 -10.268 2.012 1.00 1.00 H new ATOM 0 HB2 PHE A 127 84.738 -11.393 0.595 1.00 1.00 H new ATOM 0 HB3 PHE A 127 83.239 -12.280 0.398 1.00 1.00 H new ATOM 0 HD1 PHE A 127 81.646 -11.390 -1.556 1.00 1.00 H new ATOM 0 HD2 PHE A 127 85.868 -10.641 -1.319 1.00 1.00 H new ATOM 0 HE1 PHE A 127 81.708 -10.962 -3.997 1.00 1.00 H new ATOM 0 HE2 PHE A 127 85.930 -10.205 -3.757 1.00 1.00 H new ATOM 0 HZ PHE A 127 83.853 -10.368 -5.097 1.00 1.00 H new