USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=18 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+ -130:sc= 0.0851 (180deg=-0.528) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot -135:sc= -8.1! USER MOD Single : A 28 LYS NZ :NH3+ 153:sc= -0.0925 (180deg=-0.756) USER MOD Single : A 30 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= -0.707 K(o=-0.71,f=-1.8) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0 USER MOD Single : A 48 CYS SG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -4.2! C(o=-4.2!,f=-10!) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,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 :FLIP no HE2:sc= -9.47! C(o=-11!,f=-9.5!) USER MOD Single : A 73 MET CE :methyl -158:sc= -0.132 (180deg=-1.43) USER MOD Single : A 75 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 92 HIS :FLIP no HD1:sc= -5.34 F(o=-5.9!,f=-5.3) USER MOD Single : A 99 GLN : amide:sc= -0.0509 X(o=-0.051,f=-0.06) USER MOD Single : A 102 CYS SG : rot -4:sc= 0.843 USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 54:sc= 0.63! USER MOD Single : A 111 ASN : amide:sc= -0.117 K(o=-0.12,f=-3.1) USER MOD Single : A 113 ASN : amide:sc= -10.2! C(o=-10!,f=-10!) USER MOD Single : A 121 THR OG1 : rot -21:sc= 0.514 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 TYR OH : rot 101:sc= 1.31 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 76.801 24.387 -21.771 1.00 1.00 N ATOM 2 CA MET A 1 77.345 23.136 -22.372 1.00 1.00 C ATOM 3 C MET A 1 76.305 22.029 -22.241 1.00 1.00 C ATOM 4 O MET A 1 75.281 22.205 -21.580 1.00 1.00 O ATOM 5 CB MET A 1 78.630 22.737 -21.644 1.00 1.00 C ATOM 6 CG MET A 1 79.707 23.793 -21.899 1.00 1.00 C ATOM 7 SD MET A 1 81.223 23.331 -21.026 1.00 1.00 S ATOM 8 CE MET A 1 82.027 24.949 -21.099 1.00 1.00 C ATOM 0 H1 MET A 1 76.918 25.174 -22.441 1.00 1.00 H new ATOM 0 H2 MET A 1 75.791 24.260 -21.560 1.00 1.00 H new ATOM 0 H3 MET A 1 77.314 24.602 -20.892 1.00 1.00 H new ATOM 0 HA MET A 1 77.571 23.297 -23.426 1.00 1.00 H new ATOM 0 HB2 MET A 1 78.441 22.645 -20.574 1.00 1.00 H new ATOM 0 HB3 MET A 1 78.971 21.762 -21.993 1.00 1.00 H new ATOM 0 HG2 MET A 1 79.902 23.878 -22.968 1.00 1.00 H new ATOM 0 HG3 MET A 1 79.362 24.769 -21.559 1.00 1.00 H new ATOM 0 HE1 MET A 1 82.999 24.895 -20.609 1.00 1.00 H new ATOM 0 HE2 MET A 1 82.162 25.242 -22.140 1.00 1.00 H new ATOM 0 HE3 MET A 1 81.406 25.687 -20.592 1.00 1.00 H new ATOM 18 N SER A 2 76.576 20.885 -22.866 1.00 1.00 N ATOM 19 CA SER A 2 75.661 19.741 -22.809 1.00 1.00 C ATOM 20 C SER A 2 76.235 18.635 -21.929 1.00 1.00 C ATOM 21 O SER A 2 75.606 17.595 -21.741 1.00 1.00 O ATOM 22 CB SER A 2 75.427 19.195 -24.217 1.00 1.00 C ATOM 23 OG SER A 2 74.869 20.219 -25.030 1.00 1.00 O ATOM 0 H SER A 2 77.419 20.723 -23.417 1.00 1.00 H new ATOM 0 HA SER A 2 74.716 20.078 -22.382 1.00 1.00 H new ATOM 0 HB2 SER A 2 76.367 18.846 -24.645 1.00 1.00 H new ATOM 0 HB3 SER A 2 74.755 18.337 -24.180 1.00 1.00 H new ATOM 0 HG SER A 2 74.719 19.873 -25.935 1.00 1.00 H new ATOM 29 N ASP A 3 77.431 18.864 -21.393 1.00 1.00 N ATOM 30 CA ASP A 3 78.076 17.871 -20.539 1.00 1.00 C ATOM 31 C ASP A 3 79.416 18.382 -20.031 1.00 1.00 C ATOM 32 O ASP A 3 80.445 18.209 -20.685 1.00 1.00 O ATOM 33 CB ASP A 3 78.301 16.570 -21.316 1.00 1.00 C ATOM 34 CG ASP A 3 78.921 16.874 -22.676 1.00 1.00 C ATOM 35 OD1 ASP A 3 78.511 17.845 -23.291 1.00 1.00 O ATOM 36 OD2 ASP A 3 79.800 16.132 -23.083 1.00 1.00 O ATOM 0 H ASP A 3 77.969 19.719 -21.533 1.00 1.00 H new ATOM 0 HA ASP A 3 77.419 17.684 -19.689 1.00 1.00 H new ATOM 0 HB2 ASP A 3 78.955 15.907 -20.749 1.00 1.00 H new ATOM 0 HB3 ASP A 3 77.354 16.047 -21.448 1.00 1.00 H new ATOM 41 N PHE A 4 79.408 19.000 -18.858 1.00 1.00 N ATOM 42 CA PHE A 4 80.640 19.515 -18.275 1.00 1.00 C ATOM 43 C PHE A 4 80.538 19.522 -16.765 1.00 1.00 C ATOM 44 O PHE A 4 79.460 19.723 -16.205 1.00 1.00 O ATOM 45 CB PHE A 4 80.910 20.935 -18.765 1.00 1.00 C ATOM 46 CG PHE A 4 82.323 21.334 -18.404 1.00 1.00 C ATOM 47 CD1 PHE A 4 82.596 21.904 -17.153 1.00 1.00 C ATOM 48 CD2 PHE A 4 83.360 21.132 -19.320 1.00 1.00 C ATOM 49 CE1 PHE A 4 83.907 22.272 -16.821 1.00 1.00 C ATOM 50 CE2 PHE A 4 84.670 21.499 -18.990 1.00 1.00 C ATOM 51 CZ PHE A 4 84.943 22.069 -17.740 1.00 1.00 C ATOM 0 H PHE A 4 78.571 19.156 -18.296 1.00 1.00 H new ATOM 0 HA PHE A 4 81.460 18.867 -18.583 1.00 1.00 H new ATOM 0 HB2 PHE A 4 80.770 20.991 -19.844 1.00 1.00 H new ATOM 0 HB3 PHE A 4 80.199 21.628 -18.315 1.00 1.00 H new ATOM 0 HD1 PHE A 4 81.796 22.060 -16.445 1.00 1.00 H new ATOM 0 HD2 PHE A 4 83.150 20.692 -20.284 1.00 1.00 H new ATOM 0 HE1 PHE A 4 84.118 22.712 -15.857 1.00 1.00 H new ATOM 0 HE2 PHE A 4 85.470 21.343 -19.699 1.00 1.00 H new ATOM 0 HZ PHE A 4 85.954 22.352 -17.485 1.00 1.00 H new ATOM 61 N ASP A 5 81.668 19.313 -16.104 1.00 1.00 N ATOM 62 CA ASP A 5 81.694 19.309 -14.656 1.00 1.00 C ATOM 63 C ASP A 5 83.096 19.627 -14.139 1.00 1.00 C ATOM 64 O ASP A 5 84.094 19.336 -14.801 1.00 1.00 O ATOM 65 CB ASP A 5 81.241 17.937 -14.136 1.00 1.00 C ATOM 66 CG ASP A 5 82.077 16.830 -14.770 1.00 1.00 C ATOM 67 OD1 ASP A 5 83.088 17.150 -15.371 1.00 1.00 O ATOM 68 OD2 ASP A 5 81.699 15.677 -14.636 1.00 1.00 O ATOM 0 H ASP A 5 82.571 19.145 -16.548 1.00 1.00 H new ATOM 0 HA ASP A 5 81.013 20.078 -14.292 1.00 1.00 H new ATOM 0 HB2 ASP A 5 81.339 17.901 -13.051 1.00 1.00 H new ATOM 0 HB3 ASP A 5 80.187 17.783 -14.366 1.00 1.00 H new ATOM 73 N THR A 6 83.163 20.190 -12.934 1.00 1.00 N ATOM 74 CA THR A 6 84.425 20.523 -12.273 1.00 1.00 C ATOM 75 C THR A 6 84.755 19.481 -11.184 1.00 1.00 C ATOM 76 O THR A 6 84.110 18.479 -11.056 1.00 1.00 O ATOM 77 CB THR A 6 84.348 21.942 -11.655 1.00 1.00 C ATOM 78 OG1 THR A 6 83.268 22.653 -12.243 1.00 1.00 O ATOM 79 CG2 THR A 6 85.655 22.701 -11.915 1.00 1.00 C ATOM 0 H THR A 6 82.338 20.430 -12.384 1.00 1.00 H new ATOM 0 HA THR A 6 85.221 20.508 -13.017 1.00 1.00 H new ATOM 0 HB THR A 6 84.193 21.855 -10.580 1.00 1.00 H new ATOM 0 HG1 THR A 6 83.216 23.550 -11.853 1.00 1.00 H new ATOM 0 HG21 THR A 6 85.591 23.697 -11.477 1.00 1.00 H new ATOM 0 HG22 THR A 6 86.486 22.159 -11.464 1.00 1.00 H new ATOM 0 HG23 THR A 6 85.818 22.787 -12.989 1.00 1.00 H new ATOM 87 N GLU A 7 85.748 19.768 -10.389 1.00 1.00 N ATOM 88 CA GLU A 7 86.177 18.869 -9.319 1.00 1.00 C ATOM 89 C GLU A 7 85.015 18.556 -8.384 1.00 1.00 C ATOM 90 O GLU A 7 84.823 17.428 -7.955 1.00 1.00 O ATOM 91 CB GLU A 7 87.343 19.508 -8.539 1.00 1.00 C ATOM 92 CG GLU A 7 88.012 18.464 -7.634 1.00 1.00 C ATOM 93 CD GLU A 7 89.264 19.050 -6.976 1.00 1.00 C ATOM 94 OE1 GLU A 7 89.189 20.166 -6.485 1.00 1.00 O ATOM 95 OE2 GLU A 7 90.276 18.371 -6.968 1.00 1.00 O ATOM 0 H GLU A 7 86.292 20.628 -10.453 1.00 1.00 H new ATOM 0 HA GLU A 7 86.518 17.932 -9.760 1.00 1.00 H new ATOM 0 HB2 GLU A 7 88.074 19.918 -9.236 1.00 1.00 H new ATOM 0 HB3 GLU A 7 86.975 20.339 -7.937 1.00 1.00 H new ATOM 0 HG2 GLU A 7 87.311 18.136 -6.867 1.00 1.00 H new ATOM 0 HG3 GLU A 7 88.279 17.584 -8.219 1.00 1.00 H new ATOM 102 N ARG A 8 84.218 19.548 -8.072 1.00 1.00 N ATOM 103 CA ARG A 8 83.093 19.287 -7.191 1.00 1.00 C ATOM 104 C ARG A 8 82.022 18.432 -7.892 1.00 1.00 C ATOM 105 O ARG A 8 81.755 17.303 -7.523 1.00 1.00 O ATOM 106 CB ARG A 8 82.500 20.622 -6.744 1.00 1.00 C ATOM 107 CG ARG A 8 82.152 21.504 -7.974 1.00 1.00 C ATOM 108 CD ARG A 8 82.365 22.995 -7.671 1.00 1.00 C ATOM 109 NE ARG A 8 81.349 23.776 -8.356 1.00 1.00 N ATOM 110 CZ ARG A 8 80.087 23.728 -7.957 1.00 1.00 C ATOM 111 NH1 ARG A 8 79.757 22.938 -6.973 1.00 1.00 N ATOM 112 NH2 ARG A 8 79.181 24.449 -8.554 1.00 1.00 N ATOM 0 H ARG A 8 84.315 20.510 -8.397 1.00 1.00 H new ATOM 0 HA ARG A 8 83.442 18.726 -6.324 1.00 1.00 H new ATOM 0 HB2 ARG A 8 81.603 20.447 -6.150 1.00 1.00 H new ATOM 0 HB3 ARG A 8 83.210 21.145 -6.103 1.00 1.00 H new ATOM 0 HG2 ARG A 8 82.772 21.211 -8.821 1.00 1.00 H new ATOM 0 HG3 ARG A 8 81.115 21.334 -8.264 1.00 1.00 H new ATOM 0 HD2 ARG A 8 82.311 23.170 -6.597 1.00 1.00 H new ATOM 0 HD3 ARG A 8 83.358 23.305 -7.996 1.00 1.00 H new ATOM 0 HE ARG A 8 81.609 24.364 -9.148 1.00 1.00 H new ATOM 0 HH11 ARG A 8 80.468 22.365 -6.519 1.00 1.00 H new ATOM 0 HH12 ARG A 8 78.788 22.893 -6.658 1.00 1.00 H new ATOM 0 HH21 ARG A 8 79.442 25.054 -9.333 1.00 1.00 H new ATOM 0 HH22 ARG A 8 78.210 24.408 -8.243 1.00 1.00 H new ATOM 126 N VAL A 9 81.484 19.000 -8.926 1.00 1.00 N ATOM 127 CA VAL A 9 80.462 18.295 -9.703 1.00 1.00 C ATOM 128 C VAL A 9 81.100 17.035 -10.304 1.00 1.00 C ATOM 129 O VAL A 9 80.572 15.954 -10.199 1.00 1.00 O ATOM 130 CB VAL A 9 79.853 19.194 -10.798 1.00 1.00 C ATOM 131 CG1 VAL A 9 78.566 19.884 -10.308 1.00 1.00 C ATOM 132 CG2 VAL A 9 80.869 20.265 -11.171 1.00 1.00 C ATOM 0 H VAL A 9 81.717 19.934 -9.263 1.00 1.00 H new ATOM 0 HA VAL A 9 79.637 18.016 -9.047 1.00 1.00 H new ATOM 0 HB VAL A 9 79.604 18.571 -11.657 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.163 20.510 -11.104 1.00 1.00 H new ATOM 0 HG12 VAL A 9 77.830 19.128 -10.033 1.00 1.00 H new ATOM 0 HG13 VAL A 9 78.793 20.503 -9.440 1.00 1.00 H new ATOM 0 HG21 VAL A 9 80.451 20.909 -11.945 1.00 1.00 H new ATOM 0 HG22 VAL A 9 81.107 20.863 -10.291 1.00 1.00 H new ATOM 0 HG23 VAL A 9 81.777 19.791 -11.544 1.00 1.00 H new ATOM 142 N SER A 10 82.254 17.168 -10.921 1.00 1.00 N ATOM 143 CA SER A 10 82.874 15.976 -11.495 1.00 1.00 C ATOM 144 C SER A 10 83.341 14.985 -10.440 1.00 1.00 C ATOM 145 O SER A 10 82.809 13.925 -10.362 1.00 1.00 O ATOM 146 CB SER A 10 84.110 16.323 -12.343 1.00 1.00 C ATOM 147 OG SER A 10 83.873 17.502 -13.072 1.00 1.00 O ATOM 0 H SER A 10 82.768 18.041 -11.040 1.00 1.00 H new ATOM 0 HA SER A 10 82.090 15.530 -12.107 1.00 1.00 H new ATOM 0 HB2 SER A 10 84.980 16.452 -11.699 1.00 1.00 H new ATOM 0 HB3 SER A 10 84.337 15.503 -13.024 1.00 1.00 H new ATOM 0 HG SER A 10 84.172 17.380 -13.997 1.00 1.00 H new ATOM 153 N ARG A 11 84.363 15.340 -9.668 1.00 1.00 N ATOM 154 CA ARG A 11 84.939 14.417 -8.664 1.00 1.00 C ATOM 155 C ARG A 11 84.009 14.112 -7.500 1.00 1.00 C ATOM 156 O ARG A 11 83.826 12.958 -7.140 1.00 1.00 O ATOM 157 CB ARG A 11 86.315 14.938 -8.141 1.00 1.00 C ATOM 158 CG ARG A 11 87.482 14.290 -8.911 1.00 1.00 C ATOM 159 CD ARG A 11 87.762 12.875 -8.378 1.00 1.00 C ATOM 160 NE ARG A 11 88.322 12.048 -9.439 1.00 1.00 N ATOM 161 CZ ARG A 11 89.559 12.239 -9.883 1.00 1.00 C ATOM 162 NH1 ARG A 11 90.301 13.182 -9.368 1.00 1.00 N ATOM 163 NH2 ARG A 11 90.028 11.486 -10.840 1.00 1.00 N ATOM 0 H ARG A 11 84.816 16.253 -9.709 1.00 1.00 H new ATOM 0 HA ARG A 11 85.088 13.474 -9.190 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.362 16.022 -8.248 1.00 1.00 H new ATOM 0 HB3 ARG A 11 86.410 14.718 -7.078 1.00 1.00 H new ATOM 0 HG2 ARG A 11 87.243 14.244 -9.973 1.00 1.00 H new ATOM 0 HG3 ARG A 11 88.376 14.905 -8.812 1.00 1.00 H new ATOM 0 HD2 ARG A 11 88.455 12.924 -7.538 1.00 1.00 H new ATOM 0 HD3 ARG A 11 86.840 12.428 -8.005 1.00 1.00 H new ATOM 0 HE ARG A 11 87.753 11.308 -9.849 1.00 1.00 H new ATOM 0 HH11 ARG A 11 89.931 13.773 -8.624 1.00 1.00 H new ATOM 0 HH12 ARG A 11 91.251 13.328 -9.710 1.00 1.00 H new ATOM 0 HH21 ARG A 11 89.445 10.753 -11.245 1.00 1.00 H new ATOM 0 HH22 ARG A 11 90.978 11.630 -11.183 1.00 1.00 H new ATOM 177 N ALA A 12 83.450 15.134 -6.892 1.00 1.00 N ATOM 178 CA ALA A 12 82.577 14.858 -5.760 1.00 1.00 C ATOM 179 C ALA A 12 81.431 14.001 -6.265 1.00 1.00 C ATOM 180 O ALA A 12 81.228 12.887 -5.818 1.00 1.00 O ATOM 181 CB ALA A 12 82.022 16.153 -5.156 1.00 1.00 C ATOM 0 H ALA A 12 83.570 16.116 -7.140 1.00 1.00 H new ATOM 0 HA ALA A 12 83.141 14.347 -4.980 1.00 1.00 H new ATOM 0 HB1 ALA A 12 81.374 15.913 -4.313 1.00 1.00 H new ATOM 0 HB2 ALA A 12 82.847 16.777 -4.813 1.00 1.00 H new ATOM 0 HB3 ALA A 12 81.450 16.691 -5.912 1.00 1.00 H new ATOM 187 N VAL A 13 80.724 14.557 -7.231 1.00 1.00 N ATOM 188 CA VAL A 13 79.620 13.804 -7.787 1.00 1.00 C ATOM 189 C VAL A 13 80.213 12.521 -8.358 1.00 1.00 C ATOM 190 O VAL A 13 79.775 11.467 -8.045 1.00 1.00 O ATOM 191 CB VAL A 13 78.772 14.590 -8.837 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.836 13.938 -10.235 1.00 1.00 C ATOM 193 CG2 VAL A 13 77.292 14.615 -8.430 1.00 1.00 C ATOM 0 H VAL A 13 80.883 15.482 -7.630 1.00 1.00 H new ATOM 0 HA VAL A 13 78.897 13.588 -7.000 1.00 1.00 H new ATOM 0 HB VAL A 13 79.192 15.595 -8.872 1.00 1.00 H new ATOM 0 HG11 VAL A 13 78.232 14.517 -10.934 1.00 1.00 H new ATOM 0 HG12 VAL A 13 79.870 13.917 -10.579 1.00 1.00 H new ATOM 0 HG13 VAL A 13 78.451 12.920 -10.180 1.00 1.00 H new ATOM 0 HG21 VAL A 13 76.719 15.167 -9.175 1.00 1.00 H new ATOM 0 HG22 VAL A 13 76.915 13.594 -8.366 1.00 1.00 H new ATOM 0 HG23 VAL A 13 77.190 15.101 -7.460 1.00 1.00 H new ATOM 203 N ALA A 14 81.249 12.601 -9.165 1.00 1.00 N ATOM 204 CA ALA A 14 81.763 11.333 -9.699 1.00 1.00 C ATOM 205 C ALA A 14 82.185 10.392 -8.587 1.00 1.00 C ATOM 206 O ALA A 14 81.594 9.363 -8.418 1.00 1.00 O ATOM 207 CB ALA A 14 82.966 11.479 -10.630 1.00 1.00 C ATOM 0 H ALA A 14 81.729 13.452 -9.456 1.00 1.00 H new ATOM 0 HA ALA A 14 80.924 10.936 -10.271 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.279 10.494 -10.977 1.00 1.00 H new ATOM 0 HB2 ALA A 14 82.691 12.095 -11.486 1.00 1.00 H new ATOM 0 HB3 ALA A 14 83.787 11.952 -10.092 1.00 1.00 H new ATOM 213 N ALA A 15 83.186 10.776 -7.827 1.00 1.00 N ATOM 214 CA ALA A 15 83.656 9.894 -6.757 1.00 1.00 C ATOM 215 C ALA A 15 82.463 9.493 -5.905 1.00 1.00 C ATOM 216 O ALA A 15 82.197 8.326 -5.705 1.00 1.00 O ATOM 217 CB ALA A 15 84.726 10.575 -5.911 1.00 1.00 C ATOM 0 H ALA A 15 83.684 11.662 -7.916 1.00 1.00 H new ATOM 0 HA ALA A 15 84.113 9.005 -7.192 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.055 9.896 -5.125 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.575 10.839 -6.542 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.314 11.478 -5.461 1.00 1.00 H new ATOM 223 N ALA A 16 81.750 10.464 -5.406 1.00 1.00 N ATOM 224 CA ALA A 16 80.596 10.137 -4.581 1.00 1.00 C ATOM 225 C ALA A 16 79.515 9.392 -5.406 1.00 1.00 C ATOM 226 O ALA A 16 79.093 8.292 -5.053 1.00 1.00 O ATOM 227 CB ALA A 16 80.004 11.422 -4.009 1.00 1.00 C ATOM 0 H ALA A 16 81.929 11.459 -5.543 1.00 1.00 H new ATOM 0 HA ALA A 16 80.922 9.483 -3.773 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.139 11.181 -3.391 1.00 1.00 H new ATOM 0 HB2 ALA A 16 80.754 11.929 -3.402 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.695 12.075 -4.825 1.00 1.00 H new ATOM 233 N LEU A 17 79.067 10.044 -6.466 1.00 1.00 N ATOM 234 CA LEU A 17 77.991 9.463 -7.318 1.00 1.00 C ATOM 235 C LEU A 17 78.454 8.084 -7.784 1.00 1.00 C ATOM 236 O LEU A 17 77.764 7.089 -7.581 1.00 1.00 O ATOM 237 CB LEU A 17 77.682 10.322 -8.563 1.00 1.00 C ATOM 238 CG LEU A 17 76.394 9.873 -9.272 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.152 10.252 -8.441 1.00 1.00 C ATOM 240 CD2 LEU A 17 76.341 10.571 -10.640 1.00 1.00 C ATOM 0 H LEU A 17 79.409 10.956 -6.769 1.00 1.00 H new ATOM 0 HA LEU A 17 77.080 9.415 -6.722 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.587 11.367 -8.267 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.518 10.263 -9.260 1.00 1.00 H new ATOM 0 HG LEU A 17 76.396 8.790 -9.392 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.252 9.925 -8.962 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.204 9.766 -7.467 1.00 1.00 H new ATOM 0 HD13 LEU A 17 75.120 11.333 -8.306 1.00 1.00 H new ATOM 0 HD21 LEU A 17 75.435 10.270 -11.167 1.00 1.00 H new ATOM 0 HD22 LEU A 17 76.336 11.652 -10.497 1.00 1.00 H new ATOM 0 HD23 LEU A 17 77.214 10.287 -11.228 1.00 1.00 H new ATOM 252 N VAL A 18 79.630 8.043 -8.418 1.00 1.00 N ATOM 253 CA VAL A 18 80.178 6.774 -8.910 1.00 1.00 C ATOM 254 C VAL A 18 80.640 5.907 -7.747 1.00 1.00 C ATOM 255 O VAL A 18 80.195 4.774 -7.595 1.00 1.00 O ATOM 256 CB VAL A 18 81.328 7.000 -9.948 1.00 1.00 C ATOM 257 CG1 VAL A 18 80.997 8.209 -10.870 1.00 1.00 C ATOM 258 CG2 VAL A 18 82.728 7.200 -9.286 1.00 1.00 C ATOM 0 H VAL A 18 80.213 8.859 -8.601 1.00 1.00 H new ATOM 0 HA VAL A 18 79.381 6.246 -9.433 1.00 1.00 H new ATOM 0 HB VAL A 18 81.389 6.088 -10.541 1.00 1.00 H new ATOM 0 HG11 VAL A 18 81.806 8.353 -11.586 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.068 8.014 -11.406 1.00 1.00 H new ATOM 0 HG13 VAL A 18 80.884 9.108 -10.264 1.00 1.00 H new ATOM 0 HG21 VAL A 18 83.479 7.351 -10.061 1.00 1.00 H new ATOM 0 HG22 VAL A 18 82.700 8.072 -8.633 1.00 1.00 H new ATOM 0 HG23 VAL A 18 82.983 6.316 -8.701 1.00 1.00 H new ATOM 268 N GLY A 19 81.569 6.421 -6.959 1.00 1.00 N ATOM 269 CA GLY A 19 82.115 5.671 -5.860 1.00 1.00 C ATOM 270 C GLY A 19 81.032 5.218 -4.918 1.00 1.00 C ATOM 271 O GLY A 19 79.844 5.270 -5.227 1.00 1.00 O ATOM 0 H GLY A 19 81.957 7.358 -7.067 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.655 4.804 -6.241 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.837 6.285 -5.321 1.00 1.00 H new ATOM 275 N PRO A 20 81.425 4.725 -3.792 1.00 1.00 N ATOM 276 CA PRO A 20 80.492 4.196 -2.799 1.00 1.00 C ATOM 277 C PRO A 20 79.925 5.262 -1.872 1.00 1.00 C ATOM 278 O PRO A 20 78.823 5.101 -1.389 1.00 1.00 O ATOM 279 CB PRO A 20 81.333 3.149 -2.054 1.00 1.00 C ATOM 280 CG PRO A 20 82.768 3.596 -2.186 1.00 1.00 C ATOM 281 CD PRO A 20 82.815 4.653 -3.305 1.00 1.00 C ATOM 0 HA PRO A 20 79.596 3.777 -3.256 1.00 1.00 H new ATOM 0 HB2 PRO A 20 81.039 3.086 -1.006 1.00 1.00 H new ATOM 0 HB3 PRO A 20 81.192 2.158 -2.484 1.00 1.00 H new ATOM 0 HG2 PRO A 20 83.129 4.014 -1.246 1.00 1.00 H new ATOM 0 HG3 PRO A 20 83.413 2.751 -2.427 1.00 1.00 H new ATOM 0 HD2 PRO A 20 83.156 5.617 -2.928 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.501 4.361 -4.100 1.00 1.00 H new ATOM 289 N GLY A 21 80.687 6.337 -1.618 1.00 1.00 N ATOM 290 CA GLY A 21 80.213 7.376 -0.691 1.00 1.00 C ATOM 291 C GLY A 21 78.918 8.016 -1.158 1.00 1.00 C ATOM 292 O GLY A 21 77.936 8.029 -0.436 1.00 1.00 O ATOM 0 H GLY A 21 81.606 6.508 -2.027 1.00 1.00 H new ATOM 0 HA2 GLY A 21 80.064 6.939 0.296 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.979 8.144 -0.587 1.00 1.00 H new ATOM 296 N GLY A 22 78.924 8.616 -2.323 1.00 1.00 N ATOM 297 CA GLY A 22 77.696 9.303 -2.735 1.00 1.00 C ATOM 298 C GLY A 22 76.603 8.281 -2.697 1.00 1.00 C ATOM 299 O GLY A 22 75.585 8.454 -2.034 1.00 1.00 O ATOM 0 H GLY A 22 79.706 8.652 -2.977 1.00 1.00 H new ATOM 0 HA2 GLY A 22 77.473 10.134 -2.066 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.802 9.720 -3.736 1.00 1.00 H new ATOM 303 N VAL A 23 76.855 7.195 -3.380 1.00 1.00 N ATOM 304 CA VAL A 23 75.890 6.121 -3.381 1.00 1.00 C ATOM 305 C VAL A 23 75.636 5.705 -1.931 1.00 1.00 C ATOM 306 O VAL A 23 74.543 5.262 -1.600 1.00 1.00 O ATOM 307 CB VAL A 23 76.342 4.918 -4.219 1.00 1.00 C ATOM 308 CG1 VAL A 23 75.189 3.913 -4.316 1.00 1.00 C ATOM 309 CG2 VAL A 23 76.715 5.379 -5.628 1.00 1.00 C ATOM 0 H VAL A 23 77.697 7.030 -3.931 1.00 1.00 H new ATOM 0 HA VAL A 23 74.972 6.481 -3.845 1.00 1.00 H new ATOM 0 HB VAL A 23 77.208 4.454 -3.746 1.00 1.00 H new ATOM 0 HG11 VAL A 23 75.503 3.055 -4.910 1.00 1.00 H new ATOM 0 HG12 VAL A 23 74.912 3.580 -3.316 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.331 4.389 -4.791 1.00 1.00 H new ATOM 0 HG21 VAL A 23 77.035 4.521 -6.219 1.00 1.00 H new ATOM 0 HG22 VAL A 23 75.849 5.842 -6.101 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.527 6.103 -5.571 1.00 1.00 H new ATOM 319 N ALA A 24 76.664 5.834 -1.059 1.00 1.00 N ATOM 320 CA ALA A 24 76.463 5.420 0.333 1.00 1.00 C ATOM 321 C ALA A 24 75.322 6.209 0.960 1.00 1.00 C ATOM 322 O ALA A 24 74.335 5.625 1.382 1.00 1.00 O ATOM 323 CB ALA A 24 77.708 5.638 1.203 1.00 1.00 C ATOM 0 H ALA A 24 77.589 6.201 -1.284 1.00 1.00 H new ATOM 0 HA ALA A 24 76.238 4.354 0.300 1.00 1.00 H new ATOM 0 HB1 ALA A 24 77.501 5.314 2.223 1.00 1.00 H new ATOM 0 HB2 ALA A 24 78.539 5.059 0.800 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.970 6.696 1.205 1.00 1.00 H new ATOM 329 N LEU A 25 75.472 7.521 1.074 1.00 1.00 N ATOM 330 CA LEU A 25 74.443 8.327 1.724 1.00 1.00 C ATOM 331 C LEU A 25 73.127 8.251 0.974 1.00 1.00 C ATOM 332 O LEU A 25 72.063 8.122 1.576 1.00 1.00 O ATOM 333 CB LEU A 25 74.881 9.807 1.817 1.00 1.00 C ATOM 334 CG LEU A 25 76.406 9.921 1.871 1.00 1.00 C ATOM 335 CD1 LEU A 25 76.796 11.397 1.860 1.00 1.00 C ATOM 336 CD2 LEU A 25 76.935 9.251 3.144 1.00 1.00 C ATOM 0 H LEU A 25 76.279 8.044 0.733 1.00 1.00 H new ATOM 0 HA LEU A 25 74.306 7.922 2.727 1.00 1.00 H new ATOM 0 HB2 LEU A 25 74.501 10.358 0.957 1.00 1.00 H new ATOM 0 HB3 LEU A 25 74.446 10.264 2.706 1.00 1.00 H new ATOM 0 HG LEU A 25 76.841 9.421 1.006 1.00 1.00 H new ATOM 0 HD11 LEU A 25 77.882 11.487 1.898 1.00 1.00 H new ATOM 0 HD12 LEU A 25 76.425 11.865 0.948 1.00 1.00 H new ATOM 0 HD13 LEU A 25 76.360 11.895 2.726 1.00 1.00 H new ATOM 0 HD21 LEU A 25 78.021 9.336 3.175 1.00 1.00 H new ATOM 0 HD22 LEU A 25 76.507 9.742 4.018 1.00 1.00 H new ATOM 0 HD23 LEU A 25 76.653 8.198 3.145 1.00 1.00 H new ATOM 348 N VAL A 26 73.200 8.392 -0.340 1.00 1.00 N ATOM 349 CA VAL A 26 71.992 8.382 -1.134 1.00 1.00 C ATOM 350 C VAL A 26 71.268 7.066 -0.941 1.00 1.00 C ATOM 351 O VAL A 26 70.104 7.048 -0.548 1.00 1.00 O ATOM 352 CB VAL A 26 72.381 8.533 -2.599 1.00 1.00 C ATOM 353 CG1 VAL A 26 71.143 8.407 -3.482 1.00 1.00 C ATOM 354 CG2 VAL A 26 73.037 9.898 -2.811 1.00 1.00 C ATOM 0 H VAL A 26 74.066 8.512 -0.866 1.00 1.00 H new ATOM 0 HA VAL A 26 71.337 9.198 -0.829 1.00 1.00 H new ATOM 0 HB VAL A 26 73.086 7.747 -2.869 1.00 1.00 H new ATOM 0 HG11 VAL A 26 71.430 8.516 -4.528 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.686 7.429 -3.331 1.00 1.00 H new ATOM 0 HG13 VAL A 26 70.427 9.186 -3.219 1.00 1.00 H new ATOM 0 HG21 VAL A 26 73.316 10.009 -3.859 1.00 1.00 H new ATOM 0 HG22 VAL A 26 72.335 10.686 -2.538 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.928 9.974 -2.188 1.00 1.00 H new ATOM 364 N VAL A 27 71.935 5.967 -1.259 1.00 1.00 N ATOM 365 CA VAL A 27 71.296 4.670 -1.144 1.00 1.00 C ATOM 366 C VAL A 27 70.882 4.414 0.294 1.00 1.00 C ATOM 367 O VAL A 27 69.844 3.822 0.553 1.00 1.00 O ATOM 368 CB VAL A 27 72.242 3.554 -1.656 1.00 1.00 C ATOM 369 CG1 VAL A 27 73.214 3.101 -0.555 1.00 1.00 C ATOM 370 CG2 VAL A 27 71.425 2.338 -2.117 1.00 1.00 C ATOM 0 H VAL A 27 72.899 5.948 -1.592 1.00 1.00 H new ATOM 0 HA VAL A 27 70.399 4.664 -1.764 1.00 1.00 H new ATOM 0 HB VAL A 27 72.812 3.964 -2.490 1.00 1.00 H new ATOM 0 HG11 VAL A 27 73.865 2.318 -0.944 1.00 1.00 H new ATOM 0 HG12 VAL A 27 73.819 3.948 -0.232 1.00 1.00 H new ATOM 0 HG13 VAL A 27 72.649 2.715 0.293 1.00 1.00 H new ATOM 0 HG21 VAL A 27 72.100 1.560 -2.475 1.00 1.00 H new ATOM 0 HG22 VAL A 27 70.840 1.954 -1.281 1.00 1.00 H new ATOM 0 HG23 VAL A 27 70.754 2.635 -2.923 1.00 1.00 H new ATOM 380 N LYS A 28 71.716 4.853 1.222 1.00 1.00 N ATOM 381 CA LYS A 28 71.424 4.640 2.630 1.00 1.00 C ATOM 382 C LYS A 28 70.178 5.408 3.036 1.00 1.00 C ATOM 383 O LYS A 28 69.227 4.844 3.575 1.00 1.00 O ATOM 384 CB LYS A 28 72.627 5.110 3.445 1.00 1.00 C ATOM 385 CG LYS A 28 72.347 4.960 4.941 1.00 1.00 C ATOM 386 CD LYS A 28 73.656 5.106 5.737 1.00 1.00 C ATOM 387 CE LYS A 28 74.016 6.587 5.914 1.00 1.00 C ATOM 388 NZ LYS A 28 72.993 7.242 6.776 1.00 1.00 N ATOM 0 H LYS A 28 72.586 5.351 1.032 1.00 1.00 H new ATOM 0 HA LYS A 28 71.239 3.582 2.815 1.00 1.00 H new ATOM 0 HB2 LYS A 28 73.508 4.529 3.173 1.00 1.00 H new ATOM 0 HB3 LYS A 28 72.848 6.152 3.212 1.00 1.00 H new ATOM 0 HG2 LYS A 28 71.630 5.715 5.263 1.00 1.00 H new ATOM 0 HG3 LYS A 28 71.897 3.987 5.140 1.00 1.00 H new ATOM 0 HD2 LYS A 28 73.550 4.633 6.713 1.00 1.00 H new ATOM 0 HD3 LYS A 28 74.463 4.589 5.218 1.00 1.00 H new ATOM 0 HE2 LYS A 28 75.004 6.682 6.366 1.00 1.00 H new ATOM 0 HE3 LYS A 28 74.061 7.081 4.943 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 73.421 8.052 7.268 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 72.203 7.573 6.186 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 72.640 6.559 7.476 1.00 1.00 H new ATOM 402 N VAL A 29 70.228 6.706 2.813 1.00 1.00 N ATOM 403 CA VAL A 29 69.119 7.571 3.201 1.00 1.00 C ATOM 404 C VAL A 29 67.880 7.190 2.424 1.00 1.00 C ATOM 405 O VAL A 29 66.795 7.057 2.995 1.00 1.00 O ATOM 406 CB VAL A 29 69.438 9.051 2.967 1.00 1.00 C ATOM 407 CG1 VAL A 29 68.190 9.891 3.272 1.00 1.00 C ATOM 408 CG2 VAL A 29 70.573 9.491 3.896 1.00 1.00 C ATOM 0 H VAL A 29 71.012 7.186 2.371 1.00 1.00 H new ATOM 0 HA VAL A 29 68.949 7.432 4.269 1.00 1.00 H new ATOM 0 HB VAL A 29 69.741 9.193 1.930 1.00 1.00 H new ATOM 0 HG11 VAL A 29 68.412 10.945 3.107 1.00 1.00 H new ATOM 0 HG12 VAL A 29 67.376 9.584 2.615 1.00 1.00 H new ATOM 0 HG13 VAL A 29 67.895 9.741 4.310 1.00 1.00 H new ATOM 0 HG21 VAL A 29 70.795 10.544 3.725 1.00 1.00 H new ATOM 0 HG22 VAL A 29 70.270 9.348 4.933 1.00 1.00 H new ATOM 0 HG23 VAL A 29 71.462 8.895 3.692 1.00 1.00 H new ATOM 418 N CYS A 30 68.029 7.038 1.117 1.00 1.00 N ATOM 419 CA CYS A 30 66.890 6.700 0.301 1.00 1.00 C ATOM 420 C CYS A 30 66.385 5.320 0.679 1.00 1.00 C ATOM 421 O CYS A 30 65.220 5.160 1.040 1.00 1.00 O ATOM 422 CB CYS A 30 67.326 6.709 -1.162 1.00 1.00 C ATOM 423 SG CYS A 30 65.894 6.530 -2.253 1.00 1.00 S ATOM 0 H CYS A 30 68.910 7.142 0.614 1.00 1.00 H new ATOM 0 HA CYS A 30 66.088 7.422 0.455 1.00 1.00 H new ATOM 0 HB2 CYS A 30 67.847 7.640 -1.386 1.00 1.00 H new ATOM 0 HB3 CYS A 30 68.031 5.898 -1.342 1.00 1.00 H new ATOM 0 HG CYS A 30 66.288 6.542 -3.492 1.00 1.00 H new ATOM 428 N ALA A 31 67.233 4.313 0.522 1.00 1.00 N ATOM 429 CA ALA A 31 66.811 2.945 0.785 1.00 1.00 C ATOM 430 C ALA A 31 66.323 2.828 2.195 1.00 1.00 C ATOM 431 O ALA A 31 65.276 2.240 2.462 1.00 1.00 O ATOM 432 CB ALA A 31 67.969 1.961 0.553 1.00 1.00 C ATOM 0 H ALA A 31 68.202 4.414 0.219 1.00 1.00 H new ATOM 0 HA ALA A 31 66.003 2.695 0.097 1.00 1.00 H new ATOM 0 HB1 ALA A 31 67.630 0.945 0.756 1.00 1.00 H new ATOM 0 HB2 ALA A 31 68.305 2.032 -0.482 1.00 1.00 H new ATOM 0 HB3 ALA A 31 68.795 2.207 1.220 1.00 1.00 H new ATOM 438 N GLY A 32 67.107 3.362 3.101 1.00 1.00 N ATOM 439 CA GLY A 32 66.762 3.286 4.496 1.00 1.00 C ATOM 440 C GLY A 32 67.008 1.872 4.989 1.00 1.00 C ATOM 441 O GLY A 32 66.069 1.145 5.295 1.00 1.00 O ATOM 0 H GLY A 32 67.980 3.849 2.898 1.00 1.00 H new ATOM 0 HA2 GLY A 32 67.359 3.994 5.071 1.00 1.00 H new ATOM 0 HA3 GLY A 32 65.717 3.559 4.641 1.00 1.00 H new ATOM 445 N LEU A 33 68.300 1.516 5.027 1.00 1.00 N ATOM 446 CA LEU A 33 68.789 0.198 5.456 1.00 1.00 C ATOM 447 C LEU A 33 69.051 -0.695 4.252 1.00 1.00 C ATOM 448 O LEU A 33 68.249 -1.570 3.938 1.00 1.00 O ATOM 449 CB LEU A 33 67.827 -0.514 6.419 1.00 1.00 C ATOM 450 CG LEU A 33 67.643 0.349 7.684 1.00 1.00 C ATOM 451 CD1 LEU A 33 66.336 -0.022 8.387 1.00 1.00 C ATOM 452 CD2 LEU A 33 68.835 0.144 8.639 1.00 1.00 C ATOM 0 H LEU A 33 69.051 2.150 4.754 1.00 1.00 H new ATOM 0 HA LEU A 33 69.719 0.380 5.995 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.865 -0.679 5.934 1.00 1.00 H new ATOM 0 HB3 LEU A 33 68.221 -1.494 6.687 1.00 1.00 H new ATOM 0 HG LEU A 33 67.600 1.399 7.393 1.00 1.00 H new ATOM 0 HD11 LEU A 33 66.215 0.593 9.279 1.00 1.00 H new ATOM 0 HD12 LEU A 33 65.498 0.150 7.712 1.00 1.00 H new ATOM 0 HD13 LEU A 33 66.362 -1.074 8.672 1.00 1.00 H new ATOM 0 HD21 LEU A 33 68.697 0.757 9.530 1.00 1.00 H new ATOM 0 HD22 LEU A 33 68.894 -0.906 8.927 1.00 1.00 H new ATOM 0 HD23 LEU A 33 69.758 0.436 8.137 1.00 1.00 H new ATOM 464 N PRO A 34 70.158 -0.507 3.574 1.00 1.00 N ATOM 465 CA PRO A 34 70.504 -1.333 2.385 1.00 1.00 C ATOM 466 C PRO A 34 70.286 -2.832 2.623 1.00 1.00 C ATOM 467 O PRO A 34 70.026 -3.576 1.677 1.00 1.00 O ATOM 468 CB PRO A 34 71.990 -1.024 2.151 1.00 1.00 C ATOM 469 CG PRO A 34 72.202 0.350 2.713 1.00 1.00 C ATOM 470 CD PRO A 34 71.189 0.515 3.854 1.00 1.00 C ATOM 0 HA PRO A 34 69.871 -1.097 1.530 1.00 1.00 H new ATOM 0 HB2 PRO A 34 72.627 -1.755 2.649 1.00 1.00 H new ATOM 0 HB3 PRO A 34 72.236 -1.057 1.090 1.00 1.00 H new ATOM 0 HG2 PRO A 34 73.222 0.466 3.080 1.00 1.00 H new ATOM 0 HG3 PRO A 34 72.050 1.110 1.947 1.00 1.00 H new ATOM 0 HD2 PRO A 34 71.655 0.355 4.826 1.00 1.00 H new ATOM 0 HD3 PRO A 34 70.763 1.518 3.866 1.00 1.00 H new ATOM 478 N GLY A 35 70.424 -3.286 3.871 1.00 1.00 N ATOM 479 CA GLY A 35 70.257 -4.720 4.122 1.00 1.00 C ATOM 480 C GLY A 35 68.842 -5.160 3.718 1.00 1.00 C ATOM 481 O GLY A 35 68.682 -5.981 2.818 1.00 1.00 O ATOM 0 H GLY A 35 70.640 -2.715 4.688 1.00 1.00 H new ATOM 0 HA2 GLY A 35 70.998 -5.286 3.557 1.00 1.00 H new ATOM 0 HA3 GLY A 35 70.427 -4.936 5.177 1.00 1.00 H new ATOM 485 N VAL A 36 67.819 -4.580 4.354 1.00 1.00 N ATOM 486 CA VAL A 36 66.422 -4.894 4.010 1.00 1.00 C ATOM 487 C VAL A 36 65.922 -3.791 3.095 1.00 1.00 C ATOM 488 O VAL A 36 66.666 -2.861 2.834 1.00 1.00 O ATOM 489 CB VAL A 36 65.539 -4.994 5.274 1.00 1.00 C ATOM 490 CG1 VAL A 36 65.558 -3.668 6.037 1.00 1.00 C ATOM 491 CG2 VAL A 36 64.085 -5.355 4.899 1.00 1.00 C ATOM 0 H VAL A 36 67.926 -3.896 5.103 1.00 1.00 H new ATOM 0 HA VAL A 36 66.369 -5.863 3.513 1.00 1.00 H new ATOM 0 HB VAL A 36 65.943 -5.782 5.909 1.00 1.00 H new ATOM 0 HG11 VAL A 36 64.932 -3.751 6.926 1.00 1.00 H new ATOM 0 HG12 VAL A 36 66.580 -3.433 6.334 1.00 1.00 H new ATOM 0 HG13 VAL A 36 65.175 -2.874 5.396 1.00 1.00 H new ATOM 0 HG21 VAL A 36 63.481 -5.420 5.804 1.00 1.00 H new ATOM 0 HG22 VAL A 36 63.676 -4.585 4.245 1.00 1.00 H new ATOM 0 HG23 VAL A 36 64.070 -6.315 4.383 1.00 1.00 H new ATOM 501 N ILE A 37 64.678 -3.922 2.636 1.00 1.00 N ATOM 502 CA ILE A 37 64.022 -2.943 1.742 1.00 1.00 C ATOM 503 C ILE A 37 64.036 -3.428 0.301 1.00 1.00 C ATOM 504 O ILE A 37 65.093 -3.630 -0.293 1.00 1.00 O ATOM 505 CB ILE A 37 64.678 -1.531 1.811 1.00 1.00 C ATOM 506 CG1 ILE A 37 64.383 -0.888 3.193 1.00 1.00 C ATOM 507 CG2 ILE A 37 64.156 -0.637 0.676 1.00 1.00 C ATOM 508 CD1 ILE A 37 63.080 -0.078 3.176 1.00 1.00 C ATOM 0 H ILE A 37 64.083 -4.716 2.872 1.00 1.00 H new ATOM 0 HA ILE A 37 62.994 -2.855 2.094 1.00 1.00 H new ATOM 0 HB ILE A 37 65.756 -1.633 1.690 1.00 1.00 H new ATOM 0 HG12 ILE A 37 64.316 -1.669 3.951 1.00 1.00 H new ATOM 0 HG13 ILE A 37 65.211 -0.239 3.476 1.00 1.00 H new ATOM 0 HG21 ILE A 37 64.625 0.345 0.741 1.00 1.00 H new ATOM 0 HG22 ILE A 37 64.397 -1.092 -0.285 1.00 1.00 H new ATOM 0 HG23 ILE A 37 63.075 -0.529 0.766 1.00 1.00 H new ATOM 0 HD11 ILE A 37 62.909 0.356 4.161 1.00 1.00 H new ATOM 0 HD12 ILE A 37 63.157 0.719 2.437 1.00 1.00 H new ATOM 0 HD13 ILE A 37 62.248 -0.733 2.918 1.00 1.00 H new ATOM 520 N HIS A 38 62.849 -3.579 -0.262 1.00 1.00 N ATOM 521 CA HIS A 38 62.715 -4.006 -1.650 1.00 1.00 C ATOM 522 C HIS A 38 61.554 -3.278 -2.293 1.00 1.00 C ATOM 523 O HIS A 38 60.487 -3.144 -1.694 1.00 1.00 O ATOM 524 CB HIS A 38 62.498 -5.517 -1.715 1.00 1.00 C ATOM 525 CG HIS A 38 63.762 -6.204 -1.282 1.00 1.00 C ATOM 526 ND1 HIS A 38 64.049 -6.454 0.050 1.00 1.00 N ATOM 527 CD2 HIS A 38 64.836 -6.676 -1.994 1.00 1.00 C ATOM 528 CE1 HIS A 38 65.254 -7.050 0.099 1.00 1.00 C ATOM 529 NE2 HIS A 38 65.777 -7.211 -1.120 1.00 1.00 N ATOM 0 H HIS A 38 61.964 -3.413 0.217 1.00 1.00 H new ATOM 0 HA HIS A 38 63.629 -3.765 -2.192 1.00 1.00 H new ATOM 0 HB2 HIS A 38 61.669 -5.808 -1.069 1.00 1.00 H new ATOM 0 HB3 HIS A 38 62.233 -5.817 -2.729 1.00 1.00 H new ATOM 0 HD2 HIS A 38 64.936 -6.638 -3.069 1.00 1.00 H new ATOM 0 HE1 HIS A 38 65.740 -7.361 1.012 1.00 1.00 H new ATOM 0 HE2 HIS A 38 66.674 -7.635 -1.359 1.00 1.00 H new ATOM 537 N THR A 39 61.750 -2.815 -3.524 1.00 1.00 N ATOM 538 CA THR A 39 60.686 -2.108 -4.223 1.00 1.00 C ATOM 539 C THR A 39 59.875 -3.118 -5.051 1.00 1.00 C ATOM 540 O THR A 39 60.458 -3.896 -5.805 1.00 1.00 O ATOM 541 CB THR A 39 61.271 -1.019 -5.130 1.00 1.00 C ATOM 542 OG1 THR A 39 62.238 -0.267 -4.405 1.00 1.00 O ATOM 543 CG2 THR A 39 60.145 -0.087 -5.583 1.00 1.00 C ATOM 0 H THR A 39 62.619 -2.914 -4.049 1.00 1.00 H new ATOM 0 HA THR A 39 60.033 -1.625 -3.496 1.00 1.00 H new ATOM 0 HB THR A 39 61.743 -1.479 -5.998 1.00 1.00 H new ATOM 0 HG1 THR A 39 62.614 0.428 -4.985 1.00 1.00 H new ATOM 0 HG21 THR A 39 60.554 0.690 -6.229 1.00 1.00 H new ATOM 0 HG22 THR A 39 59.398 -0.659 -6.133 1.00 1.00 H new ATOM 0 HG23 THR A 39 59.680 0.373 -4.711 1.00 1.00 H new ATOM 551 N PRO A 40 58.561 -3.163 -4.916 1.00 1.00 N ATOM 552 CA PRO A 40 57.725 -4.153 -5.667 1.00 1.00 C ATOM 553 C PRO A 40 57.788 -3.973 -7.183 1.00 1.00 C ATOM 554 O PRO A 40 57.588 -4.931 -7.930 1.00 1.00 O ATOM 555 CB PRO A 40 56.290 -3.901 -5.149 1.00 1.00 C ATOM 556 CG PRO A 40 56.312 -2.517 -4.588 1.00 1.00 C ATOM 557 CD PRO A 40 57.723 -2.300 -4.053 1.00 1.00 C ATOM 0 HA PRO A 40 58.080 -5.170 -5.499 1.00 1.00 H new ATOM 0 HB2 PRO A 40 55.560 -3.988 -5.954 1.00 1.00 H new ATOM 0 HB3 PRO A 40 56.013 -4.630 -4.387 1.00 1.00 H new ATOM 0 HG2 PRO A 40 56.069 -1.782 -5.355 1.00 1.00 H new ATOM 0 HG3 PRO A 40 55.573 -2.406 -3.794 1.00 1.00 H new ATOM 0 HD2 PRO A 40 58.021 -1.254 -4.122 1.00 1.00 H new ATOM 0 HD3 PRO A 40 57.802 -2.585 -3.004 1.00 1.00 H new ATOM 565 N ALA A 41 57.983 -2.735 -7.638 1.00 1.00 N ATOM 566 CA ALA A 41 57.980 -2.462 -9.079 1.00 1.00 C ATOM 567 C ALA A 41 59.346 -2.104 -9.605 1.00 1.00 C ATOM 568 O ALA A 41 59.735 -0.936 -9.649 1.00 1.00 O ATOM 569 CB ALA A 41 57.038 -1.292 -9.362 1.00 1.00 C ATOM 0 H ALA A 41 58.142 -1.920 -7.046 1.00 1.00 H new ATOM 0 HA ALA A 41 57.654 -3.374 -9.579 1.00 1.00 H new ATOM 0 HB1 ALA A 41 57.030 -1.082 -10.432 1.00 1.00 H new ATOM 0 HB2 ALA A 41 56.030 -1.549 -9.035 1.00 1.00 H new ATOM 0 HB3 ALA A 41 57.381 -0.410 -8.822 1.00 1.00 H new ATOM 575 N ARG A 42 60.054 -3.130 -10.034 1.00 1.00 N ATOM 576 CA ARG A 42 61.380 -2.971 -10.594 1.00 1.00 C ATOM 577 C ARG A 42 61.516 -3.907 -11.783 1.00 1.00 C ATOM 578 O ARG A 42 60.920 -4.983 -11.798 1.00 1.00 O ATOM 579 CB ARG A 42 62.442 -3.284 -9.532 1.00 1.00 C ATOM 580 CG ARG A 42 62.161 -4.625 -8.839 1.00 1.00 C ATOM 581 CD ARG A 42 63.227 -4.857 -7.757 1.00 1.00 C ATOM 582 NE ARG A 42 64.540 -5.046 -8.368 1.00 1.00 N ATOM 583 CZ ARG A 42 65.639 -5.157 -7.625 1.00 1.00 C ATOM 584 NH1 ARG A 42 65.558 -5.087 -6.323 1.00 1.00 N ATOM 585 NH2 ARG A 42 66.799 -5.331 -8.196 1.00 1.00 N ATOM 0 H ARG A 42 59.726 -4.095 -10.004 1.00 1.00 H new ATOM 0 HA ARG A 42 61.528 -1.942 -10.922 1.00 1.00 H new ATOM 0 HB2 ARG A 42 63.427 -3.312 -9.997 1.00 1.00 H new ATOM 0 HB3 ARG A 42 62.463 -2.486 -8.790 1.00 1.00 H new ATOM 0 HG2 ARG A 42 61.166 -4.618 -8.393 1.00 1.00 H new ATOM 0 HG3 ARG A 42 62.179 -5.437 -9.566 1.00 1.00 H new ATOM 0 HD2 ARG A 42 63.255 -4.006 -7.076 1.00 1.00 H new ATOM 0 HD3 ARG A 42 62.966 -5.732 -7.162 1.00 1.00 H new ATOM 0 HE ARG A 42 64.616 -5.094 -9.384 1.00 1.00 H new ATOM 0 HH11 ARG A 42 64.652 -4.947 -5.875 1.00 1.00 H new ATOM 0 HH12 ARG A 42 66.400 -5.172 -5.754 1.00 1.00 H new ATOM 0 HH21 ARG A 42 66.864 -5.382 -9.213 1.00 1.00 H new ATOM 0 HH22 ARG A 42 67.640 -5.416 -7.626 1.00 1.00 H new ATOM 599 N ARG A 43 62.211 -3.471 -12.833 1.00 1.00 N ATOM 600 CA ARG A 43 62.313 -4.271 -14.039 1.00 1.00 C ATOM 601 C ARG A 43 62.753 -5.699 -13.722 1.00 1.00 C ATOM 602 O ARG A 43 62.597 -6.597 -14.549 1.00 1.00 O ATOM 603 CB ARG A 43 63.324 -3.601 -14.976 1.00 1.00 C ATOM 604 CG ARG A 43 63.404 -4.354 -16.303 1.00 1.00 C ATOM 605 CD ARG A 43 64.377 -3.636 -17.236 1.00 1.00 C ATOM 606 NE ARG A 43 64.371 -4.279 -18.542 1.00 1.00 N ATOM 607 CZ ARG A 43 65.303 -4.007 -19.450 1.00 1.00 C ATOM 608 NH1 ARG A 43 66.235 -3.133 -19.186 1.00 1.00 N ATOM 609 NH2 ARG A 43 65.284 -4.613 -20.605 1.00 1.00 N ATOM 0 H ARG A 43 62.704 -2.579 -12.868 1.00 1.00 H new ATOM 0 HA ARG A 43 61.335 -4.331 -14.516 1.00 1.00 H new ATOM 0 HB2 ARG A 43 63.032 -2.566 -15.155 1.00 1.00 H new ATOM 0 HB3 ARG A 43 64.306 -3.578 -14.504 1.00 1.00 H new ATOM 0 HG2 ARG A 43 63.735 -5.379 -16.133 1.00 1.00 H new ATOM 0 HG3 ARG A 43 62.417 -4.410 -16.762 1.00 1.00 H new ATOM 0 HD2 ARG A 43 64.094 -2.588 -17.335 1.00 1.00 H new ATOM 0 HD3 ARG A 43 65.382 -3.657 -16.815 1.00 1.00 H new ATOM 0 HE ARG A 43 63.637 -4.952 -18.765 1.00 1.00 H new ATOM 0 HH11 ARG A 43 66.248 -2.659 -18.283 1.00 1.00 H new ATOM 0 HH12 ARG A 43 66.950 -2.924 -19.882 1.00 1.00 H new ATOM 0 HH21 ARG A 43 64.554 -5.295 -20.811 1.00 1.00 H new ATOM 0 HH22 ARG A 43 65.999 -4.405 -21.302 1.00 1.00 H new ATOM 623 N GLY A 44 63.274 -5.911 -12.515 1.00 1.00 N ATOM 624 CA GLY A 44 63.710 -7.246 -12.088 1.00 1.00 C ATOM 625 C GLY A 44 65.194 -7.261 -11.767 1.00 1.00 C ATOM 626 O GLY A 44 65.657 -8.070 -10.962 1.00 1.00 O ATOM 0 H GLY A 44 63.406 -5.181 -11.815 1.00 1.00 H new ATOM 0 HA2 GLY A 44 63.142 -7.554 -11.210 1.00 1.00 H new ATOM 0 HA3 GLY A 44 63.498 -7.970 -12.875 1.00 1.00 H new ATOM 630 N PHE A 45 65.934 -6.346 -12.372 1.00 1.00 N ATOM 631 CA PHE A 45 67.360 -6.239 -12.120 1.00 1.00 C ATOM 632 C PHE A 45 67.795 -4.833 -12.463 1.00 1.00 C ATOM 633 O PHE A 45 67.079 -4.148 -13.190 1.00 1.00 O ATOM 634 CB PHE A 45 68.156 -7.275 -12.944 1.00 1.00 C ATOM 635 CG PHE A 45 68.736 -6.614 -14.178 1.00 1.00 C ATOM 636 CD1 PHE A 45 67.921 -6.357 -15.284 1.00 1.00 C ATOM 637 CD2 PHE A 45 70.081 -6.222 -14.190 1.00 1.00 C ATOM 638 CE1 PHE A 45 68.450 -5.711 -16.405 1.00 1.00 C ATOM 639 CE2 PHE A 45 70.612 -5.580 -15.312 1.00 1.00 C ATOM 640 CZ PHE A 45 69.796 -5.323 -16.420 1.00 1.00 C ATOM 0 H PHE A 45 65.570 -5.667 -13.041 1.00 1.00 H new ATOM 0 HA PHE A 45 67.561 -6.448 -11.069 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.956 -7.698 -12.337 1.00 1.00 H new ATOM 0 HB3 PHE A 45 67.505 -8.100 -13.234 1.00 1.00 H new ATOM 0 HD1 PHE A 45 66.884 -6.657 -15.272 1.00 1.00 H new ATOM 0 HD2 PHE A 45 70.708 -6.416 -13.332 1.00 1.00 H new ATOM 0 HE1 PHE A 45 67.821 -5.511 -17.260 1.00 1.00 H new ATOM 0 HE2 PHE A 45 71.650 -5.283 -15.324 1.00 1.00 H new ATOM 0 HZ PHE A 45 70.204 -4.825 -17.287 1.00 1.00 H new ATOM 650 N PHE A 46 68.968 -4.443 -11.940 1.00 1.00 N ATOM 651 CA PHE A 46 69.575 -3.113 -12.167 1.00 1.00 C ATOM 652 C PHE A 46 69.684 -2.287 -10.870 1.00 1.00 C ATOM 653 O PHE A 46 68.710 -2.076 -10.183 1.00 1.00 O ATOM 654 CB PHE A 46 68.788 -2.261 -13.208 1.00 1.00 C ATOM 655 CG PHE A 46 67.506 -1.637 -12.612 1.00 1.00 C ATOM 656 CD1 PHE A 46 66.820 -2.209 -11.508 1.00 1.00 C ATOM 657 CD2 PHE A 46 67.031 -0.435 -13.146 1.00 1.00 C ATOM 658 CE1 PHE A 46 65.711 -1.582 -10.963 1.00 1.00 C ATOM 659 CE2 PHE A 46 65.895 0.185 -12.596 1.00 1.00 C ATOM 660 CZ PHE A 46 65.244 -0.388 -11.501 1.00 1.00 C ATOM 0 H PHE A 46 69.531 -5.046 -11.340 1.00 1.00 H new ATOM 0 HA PHE A 46 70.571 -3.330 -12.553 1.00 1.00 H new ATOM 0 HB2 PHE A 46 69.433 -1.468 -13.586 1.00 1.00 H new ATOM 0 HB3 PHE A 46 68.522 -2.888 -14.059 1.00 1.00 H new ATOM 0 HD1 PHE A 46 67.166 -3.142 -11.089 1.00 1.00 H new ATOM 0 HD2 PHE A 46 67.539 0.019 -13.984 1.00 1.00 H new ATOM 0 HE1 PHE A 46 65.207 -2.023 -10.116 1.00 1.00 H new ATOM 0 HE2 PHE A 46 65.525 1.106 -13.021 1.00 1.00 H new ATOM 0 HZ PHE A 46 64.379 0.096 -11.073 1.00 1.00 H new ATOM 670 N ARG A 47 70.872 -1.880 -10.451 1.00 1.00 N ATOM 671 CA ARG A 47 70.990 -1.112 -9.192 1.00 1.00 C ATOM 672 C ARG A 47 70.865 -2.036 -7.981 1.00 1.00 C ATOM 673 O ARG A 47 70.427 -3.180 -8.098 1.00 1.00 O ATOM 674 CB ARG A 47 69.922 0.037 -9.102 1.00 1.00 C ATOM 675 CG ARG A 47 70.526 1.367 -9.563 1.00 1.00 C ATOM 676 CD ARG A 47 69.412 2.365 -9.913 1.00 1.00 C ATOM 677 NE ARG A 47 68.804 2.015 -11.204 1.00 1.00 N ATOM 678 CZ ARG A 47 68.460 2.947 -12.103 1.00 1.00 C ATOM 679 NH1 ARG A 47 68.644 4.213 -11.848 1.00 1.00 N ATOM 680 NH2 ARG A 47 67.931 2.593 -13.242 1.00 1.00 N ATOM 0 H ARG A 47 71.752 -2.055 -10.937 1.00 1.00 H new ATOM 0 HA ARG A 47 71.978 -0.651 -9.190 1.00 1.00 H new ATOM 0 HB2 ARG A 47 69.059 -0.211 -9.720 1.00 1.00 H new ATOM 0 HB3 ARG A 47 69.564 0.129 -8.077 1.00 1.00 H new ATOM 0 HG2 ARG A 47 71.159 1.779 -8.777 1.00 1.00 H new ATOM 0 HG3 ARG A 47 71.163 1.203 -10.432 1.00 1.00 H new ATOM 0 HD2 ARG A 47 68.652 2.361 -9.132 1.00 1.00 H new ATOM 0 HD3 ARG A 47 69.819 3.375 -9.957 1.00 1.00 H new ATOM 0 HE ARG A 47 68.639 1.032 -11.423 1.00 1.00 H new ATOM 0 HH11 ARG A 47 69.053 4.500 -10.959 1.00 1.00 H new ATOM 0 HH12 ARG A 47 68.379 4.916 -12.538 1.00 1.00 H new ATOM 0 HH21 ARG A 47 67.779 1.606 -13.449 1.00 1.00 H new ATOM 0 HH22 ARG A 47 67.670 3.303 -13.926 1.00 1.00 H new ATOM 694 N CYS A 48 71.294 -1.528 -6.826 1.00 1.00 N ATOM 695 CA CYS A 48 71.271 -2.311 -5.597 1.00 1.00 C ATOM 696 C CYS A 48 72.163 -3.533 -5.777 1.00 1.00 C ATOM 697 O CYS A 48 71.680 -4.661 -5.885 1.00 1.00 O ATOM 698 CB CYS A 48 69.837 -2.740 -5.256 1.00 1.00 C ATOM 699 SG CYS A 48 69.708 -3.044 -3.477 1.00 1.00 S ATOM 0 H CYS A 48 71.660 -0.582 -6.718 1.00 1.00 H new ATOM 0 HA CYS A 48 71.643 -1.703 -4.772 1.00 1.00 H new ATOM 0 HB2 CYS A 48 69.133 -1.964 -5.556 1.00 1.00 H new ATOM 0 HB3 CYS A 48 69.574 -3.641 -5.810 1.00 1.00 H new ATOM 0 HG CYS A 48 68.494 -3.406 -3.185 1.00 1.00 H new ATOM 704 N ASN A 49 73.471 -3.300 -5.838 1.00 1.00 N ATOM 705 CA ASN A 49 74.426 -4.383 -6.036 1.00 1.00 C ATOM 706 C ASN A 49 75.723 -4.071 -5.270 1.00 1.00 C ATOM 707 O ASN A 49 75.941 -2.933 -4.872 1.00 1.00 O ATOM 708 CB ASN A 49 74.690 -4.565 -7.564 1.00 1.00 C ATOM 709 CG ASN A 49 73.980 -3.475 -8.373 1.00 1.00 C ATOM 710 OD1 ASN A 49 72.810 -3.626 -8.728 1.00 1.00 O ATOM 711 ND2 ASN A 49 74.621 -2.385 -8.685 1.00 1.00 N ATOM 0 H ASN A 49 73.891 -2.375 -5.753 1.00 1.00 H new ATOM 0 HA ASN A 49 74.023 -5.318 -5.647 1.00 1.00 H new ATOM 0 HB2 ASN A 49 75.762 -4.529 -7.759 1.00 1.00 H new ATOM 0 HB3 ASN A 49 74.341 -5.547 -7.883 1.00 1.00 H new ATOM 0 HD21 ASN A 49 74.154 -1.655 -9.224 1.00 1.00 H new ATOM 0 HD22 ASN A 49 75.590 -2.261 -8.391 1.00 1.00 H new ATOM 718 N PRO A 50 76.568 -5.055 -5.062 1.00 1.00 N ATOM 719 CA PRO A 50 77.882 -4.882 -4.331 1.00 1.00 C ATOM 720 C PRO A 50 78.755 -3.757 -4.957 1.00 1.00 C ATOM 721 O PRO A 50 79.919 -3.981 -5.268 1.00 1.00 O ATOM 722 CB PRO A 50 78.556 -6.285 -4.485 1.00 1.00 C ATOM 723 CG PRO A 50 77.781 -6.998 -5.557 1.00 1.00 C ATOM 724 CD PRO A 50 76.366 -6.449 -5.487 1.00 1.00 C ATOM 0 HA PRO A 50 77.751 -4.578 -3.292 1.00 1.00 H new ATOM 0 HB2 PRO A 50 79.606 -6.186 -4.762 1.00 1.00 H new ATOM 0 HB3 PRO A 50 78.525 -6.839 -3.547 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.220 -6.821 -6.539 1.00 1.00 H new ATOM 0 HG3 PRO A 50 77.790 -8.076 -5.393 1.00 1.00 H new ATOM 0 HD2 PRO A 50 75.863 -6.507 -6.452 1.00 1.00 H new ATOM 0 HD3 PRO A 50 75.754 -7.003 -4.775 1.00 1.00 H new ATOM 732 N GLU A 51 78.243 -2.515 -5.023 1.00 1.00 N ATOM 733 CA GLU A 51 79.026 -1.377 -5.540 1.00 1.00 C ATOM 734 C GLU A 51 79.584 -1.633 -6.955 1.00 1.00 C ATOM 735 O GLU A 51 80.698 -1.219 -7.275 1.00 1.00 O ATOM 736 CB GLU A 51 80.161 -1.088 -4.563 1.00 1.00 C ATOM 737 CG GLU A 51 79.556 -0.703 -3.204 1.00 1.00 C ATOM 738 CD GLU A 51 80.618 -0.769 -2.118 1.00 1.00 C ATOM 739 OE1 GLU A 51 81.284 -1.793 -2.037 1.00 1.00 O ATOM 740 OE2 GLU A 51 80.750 0.189 -1.382 1.00 1.00 O ATOM 0 H GLU A 51 77.297 -2.274 -4.727 1.00 1.00 H new ATOM 0 HA GLU A 51 78.364 -0.515 -5.625 1.00 1.00 H new ATOM 0 HB2 GLU A 51 80.801 -1.964 -4.457 1.00 1.00 H new ATOM 0 HB3 GLU A 51 80.788 -0.280 -4.940 1.00 1.00 H new ATOM 0 HG2 GLU A 51 79.140 0.303 -3.255 1.00 1.00 H new ATOM 0 HG3 GLU A 51 78.734 -1.376 -2.960 1.00 1.00 H new ATOM 747 N ARG A 52 78.790 -2.312 -7.798 1.00 1.00 N ATOM 748 CA ARG A 52 79.184 -2.612 -9.188 1.00 1.00 C ATOM 749 C ARG A 52 77.946 -2.730 -10.081 1.00 1.00 C ATOM 750 O ARG A 52 76.809 -2.620 -9.627 1.00 1.00 O ATOM 751 CB ARG A 52 80.044 -3.920 -9.328 1.00 1.00 C ATOM 752 CG ARG A 52 80.081 -4.754 -8.020 1.00 1.00 C ATOM 753 CD ARG A 52 81.533 -4.893 -7.513 1.00 1.00 C ATOM 754 NE ARG A 52 81.567 -5.497 -6.173 1.00 1.00 N ATOM 755 CZ ARG A 52 82.208 -6.643 -5.905 1.00 1.00 C ATOM 756 NH1 ARG A 52 82.842 -7.298 -6.844 1.00 1.00 N ATOM 757 NH2 ARG A 52 82.204 -7.106 -4.685 1.00 1.00 N ATOM 0 H ARG A 52 77.868 -2.666 -7.542 1.00 1.00 H new ATOM 0 HA ARG A 52 79.809 -1.777 -9.507 1.00 1.00 H new ATOM 0 HB2 ARG A 52 79.638 -4.532 -10.133 1.00 1.00 H new ATOM 0 HB3 ARG A 52 81.062 -3.652 -9.613 1.00 1.00 H new ATOM 0 HG2 ARG A 52 79.467 -4.275 -7.258 1.00 1.00 H new ATOM 0 HG3 ARG A 52 79.655 -5.741 -8.198 1.00 1.00 H new ATOM 0 HD2 ARG A 52 82.107 -5.507 -8.207 1.00 1.00 H new ATOM 0 HD3 ARG A 52 82.008 -3.912 -7.486 1.00 1.00 H new ATOM 0 HE ARG A 52 81.081 -5.022 -5.413 1.00 1.00 H new ATOM 0 HH11 ARG A 52 82.854 -6.938 -7.798 1.00 1.00 H new ATOM 0 HH12 ARG A 52 83.324 -8.169 -6.622 1.00 1.00 H new ATOM 0 HH21 ARG A 52 81.717 -6.597 -3.948 1.00 1.00 H new ATOM 0 HH22 ARG A 52 82.688 -7.977 -4.469 1.00 1.00 H new ATOM 771 N ILE A 53 78.201 -2.998 -11.357 1.00 1.00 N ATOM 772 CA ILE A 53 77.145 -3.193 -12.347 1.00 1.00 C ATOM 773 C ILE A 53 76.637 -4.629 -12.255 1.00 1.00 C ATOM 774 O ILE A 53 77.269 -5.469 -11.608 1.00 1.00 O ATOM 775 CB ILE A 53 77.657 -2.880 -13.767 1.00 1.00 C ATOM 776 CG1 ILE A 53 76.493 -2.348 -14.624 1.00 1.00 C ATOM 777 CG2 ILE A 53 78.239 -4.146 -14.424 1.00 1.00 C ATOM 778 CD1 ILE A 53 76.076 -0.935 -14.165 1.00 1.00 C ATOM 0 H ILE A 53 79.144 -3.086 -11.735 1.00 1.00 H new ATOM 0 HA ILE A 53 76.324 -2.506 -12.139 1.00 1.00 H new ATOM 0 HB ILE A 53 78.443 -2.128 -13.699 1.00 1.00 H new ATOM 0 HG12 ILE A 53 76.790 -2.322 -15.673 1.00 1.00 H new ATOM 0 HG13 ILE A 53 75.642 -3.025 -14.550 1.00 1.00 H new ATOM 0 HG21 ILE A 53 78.595 -3.905 -15.426 1.00 1.00 H new ATOM 0 HG22 ILE A 53 79.069 -4.519 -13.824 1.00 1.00 H new ATOM 0 HG23 ILE A 53 77.465 -4.911 -14.488 1.00 1.00 H new ATOM 0 HD11 ILE A 53 75.253 -0.579 -14.784 1.00 1.00 H new ATOM 0 HD12 ILE A 53 75.758 -0.970 -13.123 1.00 1.00 H new ATOM 0 HD13 ILE A 53 76.923 -0.256 -14.263 1.00 1.00 H new ATOM 790 N GLN A 54 75.516 -4.939 -12.918 1.00 1.00 N ATOM 791 CA GLN A 54 74.968 -6.289 -12.916 1.00 1.00 C ATOM 792 C GLN A 54 74.625 -6.685 -14.357 1.00 1.00 C ATOM 793 O GLN A 54 73.965 -5.930 -15.070 1.00 1.00 O ATOM 794 CB GLN A 54 73.695 -6.326 -12.067 1.00 1.00 C ATOM 795 CG GLN A 54 73.290 -7.792 -11.771 1.00 1.00 C ATOM 796 CD GLN A 54 73.592 -8.145 -10.314 1.00 1.00 C ATOM 797 OE1 GLN A 54 72.784 -7.866 -9.430 1.00 1.00 O ATOM 798 NE2 GLN A 54 74.718 -8.728 -10.012 1.00 1.00 N ATOM 0 H GLN A 54 74.974 -4.267 -13.462 1.00 1.00 H new ATOM 0 HA GLN A 54 75.699 -6.982 -12.500 1.00 1.00 H new ATOM 0 HB2 GLN A 54 73.858 -5.790 -11.132 1.00 1.00 H new ATOM 0 HB3 GLN A 54 72.886 -5.816 -12.590 1.00 1.00 H new ATOM 0 HG2 GLN A 54 72.228 -7.930 -11.973 1.00 1.00 H new ATOM 0 HG3 GLN A 54 73.831 -8.466 -12.435 1.00 1.00 H new ATOM 0 HE21 GLN A 54 75.386 -8.958 -10.747 1.00 1.00 H new ATOM 0 HE22 GLN A 54 74.931 -8.954 -9.040 1.00 1.00 H new ATOM 807 N ILE A 55 75.049 -7.879 -14.768 1.00 1.00 N ATOM 808 CA ILE A 55 74.751 -8.377 -16.121 1.00 1.00 C ATOM 809 C ILE A 55 74.532 -9.887 -16.094 1.00 1.00 C ATOM 810 O ILE A 55 75.032 -10.563 -15.198 1.00 1.00 O ATOM 811 CB ILE A 55 75.888 -8.033 -17.073 1.00 1.00 C ATOM 812 CG1 ILE A 55 75.484 -8.408 -18.498 1.00 1.00 C ATOM 813 CG2 ILE A 55 77.141 -8.812 -16.672 1.00 1.00 C ATOM 814 CD1 ILE A 55 76.512 -7.842 -19.475 1.00 1.00 C ATOM 0 H ILE A 55 75.596 -8.519 -14.193 1.00 1.00 H new ATOM 0 HA ILE A 55 73.839 -7.896 -16.473 1.00 1.00 H new ATOM 0 HB ILE A 55 76.097 -6.964 -17.024 1.00 1.00 H new ATOM 0 HG12 ILE A 55 75.426 -9.492 -18.599 1.00 1.00 H new ATOM 0 HG13 ILE A 55 74.493 -8.013 -18.724 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.956 -8.566 -17.353 1.00 1.00 H new ATOM 0 HG22 ILE A 55 77.426 -8.544 -15.654 1.00 1.00 H new ATOM 0 HG23 ILE A 55 76.936 -9.881 -16.722 1.00 1.00 H new ATOM 0 HD11 ILE A 55 76.229 -8.106 -20.494 1.00 1.00 H new ATOM 0 HD12 ILE A 55 76.547 -6.757 -19.378 1.00 1.00 H new ATOM 0 HD13 ILE A 55 77.494 -8.258 -19.251 1.00 1.00 H new ATOM 826 N GLY A 56 73.780 -10.433 -17.061 1.00 1.00 N ATOM 827 CA GLY A 56 73.524 -11.873 -17.097 1.00 1.00 C ATOM 828 C GLY A 56 72.133 -12.172 -16.557 1.00 1.00 C ATOM 829 O GLY A 56 71.739 -13.332 -16.438 1.00 1.00 O ATOM 0 H GLY A 56 73.345 -9.904 -17.817 1.00 1.00 H new ATOM 0 HA2 GLY A 56 73.612 -12.240 -18.120 1.00 1.00 H new ATOM 0 HA3 GLY A 56 74.273 -12.398 -16.504 1.00 1.00 H new ATOM 833 N ASP A 57 71.405 -11.111 -16.191 1.00 1.00 N ATOM 834 CA ASP A 57 70.069 -11.260 -15.621 1.00 1.00 C ATOM 835 C ASP A 57 68.952 -11.180 -16.676 1.00 1.00 C ATOM 836 O ASP A 57 68.702 -10.146 -17.287 1.00 1.00 O ATOM 837 CB ASP A 57 69.833 -10.191 -14.553 1.00 1.00 C ATOM 838 CG ASP A 57 68.620 -10.572 -13.709 1.00 1.00 C ATOM 839 OD1 ASP A 57 67.523 -10.540 -14.241 1.00 1.00 O ATOM 840 OD2 ASP A 57 68.807 -10.898 -12.549 1.00 1.00 O ATOM 0 H ASP A 57 71.720 -10.145 -16.280 1.00 1.00 H new ATOM 0 HA ASP A 57 70.029 -12.256 -15.180 1.00 1.00 H new ATOM 0 HB2 ASP A 57 70.714 -10.095 -13.919 1.00 1.00 H new ATOM 0 HB3 ASP A 57 69.671 -9.221 -15.024 1.00 1.00 H new ATOM 845 N TRP A 58 68.283 -12.309 -16.794 1.00 1.00 N ATOM 846 CA TRP A 58 67.137 -12.481 -17.695 1.00 1.00 C ATOM 847 C TRP A 58 65.870 -11.956 -17.013 1.00 1.00 C ATOM 848 O TRP A 58 65.925 -11.469 -15.884 1.00 1.00 O ATOM 849 CB TRP A 58 66.989 -13.905 -18.183 1.00 1.00 C ATOM 850 CG TRP A 58 68.077 -14.248 -19.151 1.00 1.00 C ATOM 851 CD1 TRP A 58 69.214 -13.537 -19.355 1.00 1.00 C ATOM 852 CD2 TRP A 58 68.146 -15.392 -20.042 1.00 1.00 C ATOM 853 NE1 TRP A 58 69.978 -14.183 -20.305 1.00 1.00 N ATOM 854 CE2 TRP A 58 69.360 -15.332 -20.761 1.00 1.00 C ATOM 855 CE3 TRP A 58 67.278 -16.468 -20.288 1.00 1.00 C ATOM 856 CZ2 TRP A 58 69.704 -16.309 -21.693 1.00 1.00 C ATOM 857 CZ3 TRP A 58 67.617 -17.453 -21.227 1.00 1.00 C ATOM 858 CH2 TRP A 58 68.829 -17.375 -21.927 1.00 1.00 C ATOM 0 H TRP A 58 68.515 -13.150 -16.265 1.00 1.00 H new ATOM 0 HA TRP A 58 67.313 -11.892 -18.595 1.00 1.00 H new ATOM 0 HB2 TRP A 58 67.020 -14.590 -17.336 1.00 1.00 H new ATOM 0 HB3 TRP A 58 66.017 -14.032 -18.660 1.00 1.00 H new ATOM 0 HD1 TRP A 58 69.478 -12.616 -18.856 1.00 1.00 H new ATOM 0 HE1 TRP A 58 70.887 -13.853 -20.631 1.00 1.00 H new ATOM 0 HE3 TRP A 58 66.344 -16.537 -19.751 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 70.639 -16.244 -22.230 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 66.941 -18.275 -21.412 1.00 1.00 H new ATOM 0 HH2 TRP A 58 69.087 -18.138 -22.647 1.00 1.00 H new ATOM 869 N ARG A 59 64.721 -12.066 -17.684 1.00 1.00 N ATOM 870 CA ARG A 59 63.443 -11.611 -17.129 1.00 1.00 C ATOM 871 C ARG A 59 62.688 -12.766 -16.438 1.00 1.00 C ATOM 872 O ARG A 59 62.336 -12.685 -15.259 1.00 1.00 O ATOM 873 CB ARG A 59 62.606 -11.010 -18.284 1.00 1.00 C ATOM 874 CG ARG A 59 62.831 -11.799 -19.591 1.00 1.00 C ATOM 875 CD ARG A 59 62.110 -11.112 -20.750 1.00 1.00 C ATOM 876 NE ARG A 59 62.281 -11.893 -21.970 1.00 1.00 N ATOM 877 CZ ARG A 59 63.457 -11.961 -22.590 1.00 1.00 C ATOM 878 NH1 ARG A 59 64.498 -11.341 -22.099 1.00 1.00 N ATOM 879 NH2 ARG A 59 63.577 -12.661 -23.686 1.00 1.00 N ATOM 0 H ARG A 59 64.649 -12.469 -18.618 1.00 1.00 H new ATOM 0 HA ARG A 59 63.621 -10.854 -16.365 1.00 1.00 H new ATOM 0 HB2 ARG A 59 61.548 -11.028 -18.020 1.00 1.00 H new ATOM 0 HB3 ARG A 59 62.880 -9.965 -18.433 1.00 1.00 H new ATOM 0 HG2 ARG A 59 63.898 -11.867 -19.805 1.00 1.00 H new ATOM 0 HG3 ARG A 59 62.463 -12.819 -19.477 1.00 1.00 H new ATOM 0 HD2 ARG A 59 61.050 -11.007 -20.520 1.00 1.00 H new ATOM 0 HD3 ARG A 59 62.506 -10.107 -20.892 1.00 1.00 H new ATOM 0 HE ARG A 59 61.483 -12.397 -22.356 1.00 1.00 H new ATOM 0 HH11 ARG A 59 64.411 -10.802 -21.237 1.00 1.00 H new ATOM 0 HH12 ARG A 59 65.397 -11.396 -22.578 1.00 1.00 H new ATOM 0 HH21 ARG A 59 62.770 -13.155 -24.066 1.00 1.00 H new ATOM 0 HH22 ARG A 59 64.478 -12.713 -24.162 1.00 1.00 H new ATOM 893 N TYR A 60 62.471 -13.834 -17.196 1.00 1.00 N ATOM 894 CA TYR A 60 61.784 -15.056 -16.735 1.00 1.00 C ATOM 895 C TYR A 60 62.708 -15.918 -15.858 1.00 1.00 C ATOM 896 O TYR A 60 62.298 -16.948 -15.294 1.00 1.00 O ATOM 897 CB TYR A 60 61.282 -15.889 -17.943 1.00 1.00 C ATOM 898 CG TYR A 60 61.045 -17.328 -17.513 1.00 1.00 C ATOM 899 CD1 TYR A 60 59.853 -17.694 -16.874 1.00 1.00 C ATOM 900 CD2 TYR A 60 62.054 -18.279 -17.710 1.00 1.00 C ATOM 901 CE1 TYR A 60 59.671 -19.015 -16.438 1.00 1.00 C ATOM 902 CE2 TYR A 60 61.876 -19.595 -17.266 1.00 1.00 C ATOM 903 CZ TYR A 60 60.685 -19.963 -16.631 1.00 1.00 C ATOM 904 OH TYR A 60 60.511 -21.258 -16.183 1.00 1.00 O ATOM 0 H TYR A 60 62.770 -13.886 -18.170 1.00 1.00 H new ATOM 0 HA TYR A 60 60.929 -14.746 -16.135 1.00 1.00 H new ATOM 0 HB2 TYR A 60 60.359 -15.460 -18.334 1.00 1.00 H new ATOM 0 HB3 TYR A 60 62.015 -15.857 -18.749 1.00 1.00 H new ATOM 0 HD1 TYR A 60 59.076 -16.961 -16.717 1.00 1.00 H new ATOM 0 HD2 TYR A 60 62.971 -17.997 -18.205 1.00 1.00 H new ATOM 0 HE1 TYR A 60 58.749 -19.301 -15.954 1.00 1.00 H new ATOM 0 HE2 TYR A 60 62.658 -20.325 -17.414 1.00 1.00 H new ATOM 0 HH TYR A 60 61.307 -21.788 -16.397 1.00 1.00 H new ATOM 914 N GLU A 61 63.944 -15.509 -15.719 1.00 1.00 N ATOM 915 CA GLU A 61 64.884 -16.259 -14.911 1.00 1.00 C ATOM 916 C GLU A 61 64.650 -16.015 -13.436 1.00 1.00 C ATOM 917 O GLU A 61 65.163 -16.729 -12.594 1.00 1.00 O ATOM 918 CB GLU A 61 66.278 -15.822 -15.297 1.00 1.00 C ATOM 919 CG GLU A 61 67.341 -16.737 -14.713 1.00 1.00 C ATOM 920 CD GLU A 61 68.720 -16.134 -14.947 1.00 1.00 C ATOM 921 OE1 GLU A 61 69.052 -15.184 -14.260 1.00 1.00 O ATOM 922 OE2 GLU A 61 69.423 -16.637 -15.807 1.00 1.00 O ATOM 0 H GLU A 61 64.325 -14.667 -16.150 1.00 1.00 H new ATOM 0 HA GLU A 61 64.753 -17.326 -15.089 1.00 1.00 H new ATOM 0 HB2 GLU A 61 66.367 -15.810 -16.383 1.00 1.00 H new ATOM 0 HB3 GLU A 61 66.447 -14.802 -14.952 1.00 1.00 H new ATOM 0 HG2 GLU A 61 67.170 -16.875 -13.645 1.00 1.00 H new ATOM 0 HG3 GLU A 61 67.281 -17.722 -15.175 1.00 1.00 H new ATOM 929 N VAL A 62 63.937 -14.962 -13.112 1.00 1.00 N ATOM 930 CA VAL A 62 63.743 -14.599 -11.701 1.00 1.00 C ATOM 931 C VAL A 62 63.381 -15.832 -10.923 1.00 1.00 C ATOM 932 O VAL A 62 64.000 -16.146 -9.912 1.00 1.00 O ATOM 933 CB VAL A 62 62.644 -13.534 -11.549 1.00 1.00 C ATOM 934 CG1 VAL A 62 62.382 -13.257 -10.062 1.00 1.00 C ATOM 935 CG2 VAL A 62 63.092 -12.234 -12.221 1.00 1.00 C ATOM 0 H VAL A 62 63.483 -14.342 -13.783 1.00 1.00 H new ATOM 0 HA VAL A 62 64.670 -14.176 -11.314 1.00 1.00 H new ATOM 0 HB VAL A 62 61.732 -13.902 -12.019 1.00 1.00 H new ATOM 0 HG11 VAL A 62 61.602 -12.502 -9.964 1.00 1.00 H new ATOM 0 HG12 VAL A 62 62.060 -14.176 -9.572 1.00 1.00 H new ATOM 0 HG13 VAL A 62 63.297 -12.897 -9.592 1.00 1.00 H new ATOM 0 HG21 VAL A 62 62.312 -11.481 -12.112 1.00 1.00 H new ATOM 0 HG22 VAL A 62 64.008 -11.878 -11.750 1.00 1.00 H new ATOM 0 HG23 VAL A 62 63.275 -12.416 -13.280 1.00 1.00 H new ATOM 945 N ALA A 63 62.428 -16.569 -11.415 1.00 1.00 N ATOM 946 CA ALA A 63 62.060 -17.781 -10.775 1.00 1.00 C ATOM 947 C ALA A 63 63.233 -18.746 -10.851 1.00 1.00 C ATOM 948 O ALA A 63 63.674 -19.283 -9.830 1.00 1.00 O ATOM 949 CB ALA A 63 60.842 -18.365 -11.500 1.00 1.00 C ATOM 0 H ALA A 63 61.897 -16.346 -12.257 1.00 1.00 H new ATOM 0 HA ALA A 63 61.806 -17.608 -9.729 1.00 1.00 H new ATOM 0 HB1 ALA A 63 60.546 -19.298 -11.020 1.00 1.00 H new ATOM 0 HB2 ALA A 63 60.016 -17.655 -11.454 1.00 1.00 H new ATOM 0 HB3 ALA A 63 61.097 -18.558 -12.542 1.00 1.00 H new ATOM 955 N HIS A 64 63.789 -18.902 -12.064 1.00 1.00 N ATOM 956 CA HIS A 64 64.934 -19.802 -12.247 1.00 1.00 C ATOM 957 C HIS A 64 66.111 -19.436 -11.312 1.00 1.00 C ATOM 958 O HIS A 64 66.496 -20.214 -10.434 1.00 1.00 O ATOM 959 CB HIS A 64 65.369 -19.739 -13.727 1.00 1.00 C ATOM 960 CG HIS A 64 65.844 -21.087 -14.210 1.00 1.00 C ATOM 961 ND1 HIS A 64 66.955 -21.718 -13.677 1.00 1.00 N ATOM 962 CD2 HIS A 64 65.355 -21.934 -15.173 1.00 1.00 C ATOM 963 CE1 HIS A 64 67.096 -22.894 -14.314 1.00 1.00 C ATOM 964 NE2 HIS A 64 66.145 -23.076 -15.236 1.00 1.00 N ATOM 0 H HIS A 64 63.473 -18.429 -12.911 1.00 1.00 H new ATOM 0 HA HIS A 64 64.635 -20.817 -11.985 1.00 1.00 H new ATOM 0 HB2 HIS A 64 64.534 -19.403 -14.341 1.00 1.00 H new ATOM 0 HB3 HIS A 64 66.166 -19.005 -13.844 1.00 1.00 H new ATOM 0 HD2 HIS A 64 64.488 -21.742 -15.788 1.00 1.00 H new ATOM 0 HE1 HIS A 64 67.882 -23.605 -14.106 1.00 1.00 H new ATOM 0 HE2 HIS A 64 66.025 -23.880 -15.853 1.00 1.00 H new ATOM 972 N ASP A 65 66.656 -18.244 -11.456 1.00 1.00 N ATOM 973 CA ASP A 65 67.750 -17.813 -10.589 1.00 1.00 C ATOM 974 C ASP A 65 67.252 -17.649 -9.142 1.00 1.00 C ATOM 975 O ASP A 65 67.783 -18.255 -8.191 1.00 1.00 O ATOM 976 CB ASP A 65 68.305 -16.492 -11.123 1.00 1.00 C ATOM 977 CG ASP A 65 69.277 -15.874 -10.132 1.00 1.00 C ATOM 978 OD1 ASP A 65 70.260 -16.521 -9.812 1.00 1.00 O ATOM 979 OD2 ASP A 65 69.027 -14.758 -9.708 1.00 1.00 O ATOM 0 H ASP A 65 66.368 -17.559 -12.155 1.00 1.00 H new ATOM 0 HA ASP A 65 68.539 -18.565 -10.586 1.00 1.00 H new ATOM 0 HB2 ASP A 65 68.808 -16.662 -12.075 1.00 1.00 H new ATOM 0 HB3 ASP A 65 67.486 -15.799 -11.315 1.00 1.00 H new ATOM 984 N GLY A 66 66.200 -16.849 -8.976 1.00 1.00 N ATOM 985 CA GLY A 66 65.589 -16.607 -7.667 1.00 1.00 C ATOM 986 C GLY A 66 65.015 -17.887 -7.073 1.00 1.00 C ATOM 987 O GLY A 66 64.066 -17.854 -6.289 1.00 1.00 O ATOM 0 H GLY A 66 65.747 -16.351 -9.742 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.334 -16.192 -6.988 1.00 1.00 H new ATOM 0 HA3 GLY A 66 64.798 -15.864 -7.766 1.00 1.00 H new ATOM 991 N ARG A 67 65.666 -18.988 -7.371 1.00 1.00 N ATOM 992 CA ARG A 67 65.335 -20.284 -6.834 1.00 1.00 C ATOM 993 C ARG A 67 65.838 -20.408 -5.399 1.00 1.00 C ATOM 994 O ARG A 67 65.748 -21.484 -4.822 1.00 1.00 O ATOM 995 CB ARG A 67 65.909 -21.402 -7.684 1.00 1.00 C ATOM 996 CG ARG A 67 64.929 -21.822 -8.741 1.00 1.00 C ATOM 997 CD ARG A 67 65.554 -22.918 -9.570 1.00 1.00 C ATOM 998 NE ARG A 67 64.629 -23.263 -10.625 1.00 1.00 N ATOM 999 CZ ARG A 67 64.654 -24.447 -11.200 1.00 1.00 C ATOM 1000 NH1 ARG A 67 65.508 -25.348 -10.801 1.00 1.00 N ATOM 1001 NH2 ARG A 67 63.813 -24.710 -12.154 1.00 1.00 N ATOM 0 H ARG A 67 66.461 -19.005 -8.010 1.00 1.00 H new ATOM 0 HA ARG A 67 64.249 -20.378 -6.843 1.00 1.00 H new ATOM 0 HB2 ARG A 67 66.836 -21.071 -8.152 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.158 -22.255 -7.052 1.00 1.00 H new ATOM 0 HG2 ARG A 67 64.006 -22.175 -8.282 1.00 1.00 H new ATOM 0 HG3 ARG A 67 64.667 -20.973 -9.372 1.00 1.00 H new ATOM 0 HD2 ARG A 67 66.503 -22.584 -9.989 1.00 1.00 H new ATOM 0 HD3 ARG A 67 65.768 -23.789 -8.951 1.00 1.00 H new ATOM 0 HE ARG A 67 63.942 -22.574 -10.931 1.00 1.00 H new ATOM 0 HH11 ARG A 67 66.157 -25.136 -10.043 1.00 1.00 H new ATOM 0 HH12 ARG A 67 65.527 -26.265 -11.247 1.00 1.00 H new ATOM 0 HH21 ARG A 67 63.141 -24.002 -12.451 1.00 1.00 H new ATOM 0 HH22 ARG A 67 63.824 -25.624 -12.606 1.00 1.00 H new ATOM 1015 N LEU A 68 66.400 -19.322 -4.855 1.00 1.00 N ATOM 1016 CA LEU A 68 66.933 -19.362 -3.462 1.00 1.00 C ATOM 1017 C LEU A 68 66.027 -20.307 -2.651 1.00 1.00 C ATOM 1018 O LEU A 68 66.451 -21.019 -1.754 1.00 1.00 O ATOM 1019 CB LEU A 68 66.925 -17.963 -2.806 1.00 1.00 C ATOM 1020 CG LEU A 68 65.543 -17.268 -3.003 1.00 1.00 C ATOM 1021 CD1 LEU A 68 64.763 -17.210 -1.677 1.00 1.00 C ATOM 1022 CD2 LEU A 68 65.742 -15.833 -3.521 1.00 1.00 C ATOM 0 H LEU A 68 66.502 -18.425 -5.329 1.00 1.00 H new ATOM 0 HA LEU A 68 67.966 -19.708 -3.481 1.00 1.00 H new ATOM 0 HB2 LEU A 68 67.143 -18.054 -1.742 1.00 1.00 H new ATOM 0 HB3 LEU A 68 67.712 -17.348 -3.241 1.00 1.00 H new ATOM 0 HG LEU A 68 64.976 -17.852 -3.728 1.00 1.00 H new ATOM 0 HD11 LEU A 68 63.803 -16.721 -1.841 1.00 1.00 H new ATOM 0 HD12 LEU A 68 64.596 -18.222 -1.308 1.00 1.00 H new ATOM 0 HD13 LEU A 68 65.337 -16.646 -0.942 1.00 1.00 H new ATOM 0 HD21 LEU A 68 64.771 -15.357 -3.655 1.00 1.00 H new ATOM 0 HD22 LEU A 68 66.329 -15.264 -2.800 1.00 1.00 H new ATOM 0 HD23 LEU A 68 66.268 -15.860 -4.475 1.00 1.00 H new ATOM 1034 N LEU A 69 64.772 -20.345 -3.030 1.00 1.00 N ATOM 1035 CA LEU A 69 63.875 -21.297 -2.357 1.00 1.00 C ATOM 1036 C LEU A 69 64.397 -22.719 -2.672 1.00 1.00 C ATOM 1037 O LEU A 69 64.857 -23.423 -1.768 1.00 1.00 O ATOM 1038 CB LEU A 69 62.437 -21.157 -2.873 1.00 1.00 C ATOM 1039 CG LEU A 69 62.440 -20.926 -4.417 1.00 1.00 C ATOM 1040 CD1 LEU A 69 61.596 -21.985 -5.136 1.00 1.00 C ATOM 1041 CD2 LEU A 69 61.899 -19.530 -4.755 1.00 1.00 C ATOM 0 H LEU A 69 64.351 -19.769 -3.758 1.00 1.00 H new ATOM 0 HA LEU A 69 63.864 -21.103 -1.285 1.00 1.00 H new ATOM 0 HB2 LEU A 69 61.867 -22.055 -2.633 1.00 1.00 H new ATOM 0 HB3 LEU A 69 61.943 -20.323 -2.374 1.00 1.00 H new ATOM 0 HG LEU A 69 63.472 -21.007 -4.759 1.00 1.00 H new ATOM 0 HD11 LEU A 69 61.616 -21.799 -6.210 1.00 1.00 H new ATOM 0 HD12 LEU A 69 62.003 -22.975 -4.931 1.00 1.00 H new ATOM 0 HD13 LEU A 69 60.567 -21.935 -4.779 1.00 1.00 H new ATOM 0 HD21 LEU A 69 61.909 -19.388 -5.836 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.878 -19.436 -4.386 1.00 1.00 H new ATOM 0 HD23 LEU A 69 62.526 -18.773 -4.284 1.00 1.00 H new ATOM 1053 N ALA A 70 64.353 -23.127 -3.955 1.00 1.00 N ATOM 1054 CA ALA A 70 64.860 -24.457 -4.338 1.00 1.00 C ATOM 1055 C ALA A 70 66.388 -24.380 -4.357 1.00 1.00 C ATOM 1056 O ALA A 70 67.036 -24.884 -3.461 1.00 1.00 O ATOM 1057 CB ALA A 70 64.344 -24.827 -5.737 1.00 1.00 C ATOM 0 H ALA A 70 63.982 -22.571 -4.725 1.00 1.00 H new ATOM 0 HA ALA A 70 64.521 -25.215 -3.632 1.00 1.00 H new ATOM 0 HB1 ALA A 70 64.721 -25.811 -6.016 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.254 -24.845 -5.730 1.00 1.00 H new ATOM 0 HB3 ALA A 70 64.690 -24.088 -6.460 1.00 1.00 H new ATOM 1063 N ALA A 71 66.929 -23.712 -5.392 1.00 1.00 N ATOM 1064 CA ALA A 71 68.369 -23.476 -5.612 1.00 1.00 C ATOM 1065 C ALA A 71 69.051 -22.923 -4.376 1.00 1.00 C ATOM 1066 O ALA A 71 70.210 -22.522 -4.443 1.00 1.00 O ATOM 1067 CB ALA A 71 68.582 -22.514 -6.788 1.00 1.00 C ATOM 0 H ALA A 71 66.352 -23.305 -6.128 1.00 1.00 H new ATOM 0 HA ALA A 71 68.819 -24.442 -5.842 1.00 1.00 H new ATOM 0 HB1 ALA A 71 69.650 -22.351 -6.936 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.152 -22.944 -7.692 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.096 -21.562 -6.572 1.00 1.00 H new ATOM 1073 N HIS A 72 68.297 -22.828 -3.282 1.00 1.00 N ATOM 1074 CA HIS A 72 68.769 -22.238 -2.033 1.00 1.00 C ATOM 1075 C HIS A 72 70.284 -22.146 -1.969 1.00 1.00 C ATOM 1076 O HIS A 72 70.827 -21.043 -1.934 1.00 1.00 O ATOM 1077 CB HIS A 72 68.230 -23.137 -0.895 1.00 1.00 C ATOM 1078 CG HIS A 72 68.950 -24.479 -0.904 1.00 1.00 C ATOM 1079 ND1 HIS A 72 69.283 -25.358 -1.921 1.00 1.00 N flip ATOM 1080 CD2 HIS A 72 69.497 -25.029 0.246 1.00 1.00 C flip ATOM 1081 CE1 HIS A 72 70.019 -26.416 -1.409 1.00 1.00 C flip ATOM 1082 NE2 HIS A 72 70.126 -26.170 -0.103 1.00 1.00 N flip ATOM 0 H HIS A 72 67.334 -23.161 -3.238 1.00 1.00 H new ATOM 0 HA HIS A 72 68.408 -21.213 -1.947 1.00 1.00 H new ATOM 0 HB2 HIS A 72 68.373 -22.645 0.067 1.00 1.00 H new ATOM 0 HB3 HIS A 72 67.158 -23.290 -1.018 1.00 1.00 H new ATOM 0 HD1 HIS A 72 69.025 -25.244 -2.901 1.00 1.00 H new ATOM 0 HD2 HIS A 72 69.431 -24.617 1.242 1.00 1.00 H new ATOM 0 HE1 HIS A 72 70.420 -27.259 -1.952 1.00 1.00 H new ATOM 1090 N MET A 73 70.963 -23.252 -2.001 1.00 1.00 N ATOM 1091 CA MET A 73 72.398 -23.239 -2.000 1.00 1.00 C ATOM 1092 C MET A 73 72.932 -22.967 -3.402 1.00 1.00 C ATOM 1093 O MET A 73 73.907 -22.236 -3.565 1.00 1.00 O ATOM 1094 CB MET A 73 72.894 -24.562 -1.466 1.00 1.00 C ATOM 1095 CG MET A 73 72.650 -25.655 -2.500 1.00 1.00 C ATOM 1096 SD MET A 73 72.753 -27.260 -1.687 1.00 1.00 S ATOM 1097 CE MET A 73 74.441 -27.063 -1.072 1.00 1.00 C ATOM 0 H MET A 73 70.545 -24.182 -2.028 1.00 1.00 H new ATOM 0 HA MET A 73 72.762 -22.438 -1.357 1.00 1.00 H new ATOM 0 HB2 MET A 73 73.957 -24.497 -1.235 1.00 1.00 H new ATOM 0 HB3 MET A 73 72.380 -24.806 -0.536 1.00 1.00 H new ATOM 0 HG2 MET A 73 71.670 -25.527 -2.960 1.00 1.00 H new ATOM 0 HG3 MET A 73 73.388 -25.589 -3.300 1.00 1.00 H new ATOM 0 HE1 MET A 73 74.874 -28.044 -0.876 1.00 1.00 H new ATOM 0 HE2 MET A 73 75.042 -26.544 -1.819 1.00 1.00 H new ATOM 0 HE3 MET A 73 74.427 -26.482 -0.150 1.00 1.00 H new ATOM 1107 N VAL A 74 72.364 -23.656 -4.414 1.00 1.00 N ATOM 1108 CA VAL A 74 72.888 -23.563 -5.780 1.00 1.00 C ATOM 1109 C VAL A 74 73.270 -22.128 -6.095 1.00 1.00 C ATOM 1110 O VAL A 74 74.326 -21.915 -6.682 1.00 1.00 O ATOM 1111 CB VAL A 74 71.835 -24.050 -6.767 1.00 1.00 C ATOM 1112 CG1 VAL A 74 72.324 -23.874 -8.207 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.484 -25.518 -6.508 1.00 1.00 C ATOM 0 H VAL A 74 71.557 -24.271 -4.308 1.00 1.00 H new ATOM 0 HA VAL A 74 73.776 -24.189 -5.865 1.00 1.00 H new ATOM 0 HB VAL A 74 70.937 -23.448 -6.625 1.00 1.00 H new ATOM 0 HG11 VAL A 74 71.558 -24.228 -8.897 1.00 1.00 H new ATOM 0 HG12 VAL A 74 72.525 -22.820 -8.397 1.00 1.00 H new ATOM 0 HG13 VAL A 74 73.238 -24.449 -8.354 1.00 1.00 H new ATOM 0 HG21 VAL A 74 70.730 -25.844 -7.225 1.00 1.00 H new ATOM 0 HG22 VAL A 74 72.379 -26.131 -6.618 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.093 -25.626 -5.496 1.00 1.00 H new ATOM 1123 N ASN A 75 72.439 -21.144 -5.723 1.00 1.00 N ATOM 1124 CA ASN A 75 72.747 -19.722 -5.975 1.00 1.00 C ATOM 1125 C ASN A 75 74.258 -19.457 -5.805 1.00 1.00 C ATOM 1126 O ASN A 75 74.842 -18.530 -6.388 1.00 1.00 O ATOM 1127 CB ASN A 75 71.955 -18.893 -4.955 1.00 1.00 C ATOM 1128 CG ASN A 75 72.157 -17.407 -5.195 1.00 1.00 C ATOM 1129 OD1 ASN A 75 72.728 -16.710 -4.357 1.00 1.00 O ATOM 1130 ND2 ASN A 75 71.705 -16.878 -6.294 1.00 1.00 N ATOM 0 H ASN A 75 71.550 -21.302 -5.248 1.00 1.00 H new ATOM 0 HA ASN A 75 72.473 -19.451 -6.995 1.00 1.00 H new ATOM 0 HB2 ASN A 75 70.895 -19.137 -5.026 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.274 -19.150 -3.945 1.00 1.00 H new ATOM 0 HD21 ASN A 75 71.823 -15.879 -6.465 1.00 1.00 H new ATOM 0 HD22 ASN A 75 71.233 -17.462 -6.984 1.00 1.00 H new ATOM 1137 N GLY A 76 74.881 -20.376 -5.102 1.00 1.00 N ATOM 1138 CA GLY A 76 76.317 -20.373 -4.932 1.00 1.00 C ATOM 1139 C GLY A 76 76.984 -20.234 -6.311 1.00 1.00 C ATOM 1140 O GLY A 76 78.138 -19.906 -6.420 1.00 1.00 O ATOM 0 H GLY A 76 74.407 -21.147 -4.632 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.618 -19.550 -4.284 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.641 -21.295 -4.448 1.00 1.00 H new ATOM 1144 N ILE A 77 76.253 -20.571 -7.367 1.00 1.00 N ATOM 1145 CA ILE A 77 76.808 -20.542 -8.728 1.00 1.00 C ATOM 1146 C ILE A 77 77.411 -19.182 -9.084 1.00 1.00 C ATOM 1147 O ILE A 77 78.507 -19.113 -9.625 1.00 1.00 O ATOM 1148 CB ILE A 77 75.718 -20.871 -9.764 1.00 1.00 C ATOM 1149 CG1 ILE A 77 74.457 -20.079 -9.408 1.00 1.00 C ATOM 1150 CG2 ILE A 77 75.415 -22.379 -9.785 1.00 1.00 C ATOM 1151 CD1 ILE A 77 73.340 -20.415 -10.383 1.00 1.00 C ATOM 0 H ILE A 77 75.278 -20.867 -7.315 1.00 1.00 H new ATOM 0 HA ILE A 77 77.599 -21.292 -8.751 1.00 1.00 H new ATOM 0 HB ILE A 77 76.067 -20.593 -10.759 1.00 1.00 H new ATOM 0 HG12 ILE A 77 74.145 -20.314 -8.390 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.668 -19.010 -9.438 1.00 1.00 H new ATOM 0 HG21 ILE A 77 74.642 -22.584 -10.525 1.00 1.00 H new ATOM 0 HG22 ILE A 77 76.320 -22.928 -10.044 1.00 1.00 H new ATOM 0 HG23 ILE A 77 75.068 -22.694 -8.801 1.00 1.00 H new ATOM 0 HD11 ILE A 77 72.447 -19.847 -10.123 1.00 1.00 H new ATOM 0 HD12 ILE A 77 73.651 -20.158 -11.395 1.00 1.00 H new ATOM 0 HD13 ILE A 77 73.120 -21.481 -10.331 1.00 1.00 H new ATOM 1163 N VAL A 78 76.697 -18.098 -8.803 1.00 1.00 N ATOM 1164 CA VAL A 78 77.173 -16.775 -9.135 1.00 1.00 C ATOM 1165 C VAL A 78 78.498 -16.465 -8.465 1.00 1.00 C ATOM 1166 O VAL A 78 79.215 -15.557 -8.885 1.00 1.00 O ATOM 1167 CB VAL A 78 76.124 -15.758 -8.697 1.00 1.00 C ATOM 1168 CG1 VAL A 78 76.396 -14.421 -9.382 1.00 1.00 C ATOM 1169 CG2 VAL A 78 74.727 -16.274 -9.076 1.00 1.00 C ATOM 0 H VAL A 78 75.786 -18.117 -8.345 1.00 1.00 H new ATOM 0 HA VAL A 78 77.334 -16.725 -10.212 1.00 1.00 H new ATOM 0 HB VAL A 78 76.171 -15.619 -7.617 1.00 1.00 H new ATOM 0 HG11 VAL A 78 75.647 -13.693 -9.070 1.00 1.00 H new ATOM 0 HG12 VAL A 78 77.387 -14.064 -9.103 1.00 1.00 H new ATOM 0 HG13 VAL A 78 76.348 -14.550 -10.463 1.00 1.00 H new ATOM 0 HG21 VAL A 78 73.975 -15.550 -8.764 1.00 1.00 H new ATOM 0 HG22 VAL A 78 74.671 -16.414 -10.156 1.00 1.00 H new ATOM 0 HG23 VAL A 78 74.543 -17.226 -8.577 1.00 1.00 H new ATOM 1179 N ILE A 79 78.810 -17.214 -7.424 1.00 1.00 N ATOM 1180 CA ILE A 79 80.066 -16.985 -6.710 1.00 1.00 C ATOM 1181 C ILE A 79 81.245 -17.651 -7.422 1.00 1.00 C ATOM 1182 O ILE A 79 82.268 -17.028 -7.636 1.00 1.00 O ATOM 1183 CB ILE A 79 79.965 -17.482 -5.246 1.00 1.00 C ATOM 1184 CG1 ILE A 79 80.437 -18.962 -5.114 1.00 1.00 C ATOM 1185 CG2 ILE A 79 78.513 -17.309 -4.776 1.00 1.00 C ATOM 1186 CD1 ILE A 79 80.025 -19.562 -3.767 1.00 1.00 C ATOM 0 H ILE A 79 78.232 -17.970 -7.056 1.00 1.00 H new ATOM 0 HA ILE A 79 80.246 -15.910 -6.700 1.00 1.00 H new ATOM 0 HB ILE A 79 80.626 -16.891 -4.612 1.00 1.00 H new ATOM 0 HG12 ILE A 79 80.011 -19.555 -5.924 1.00 1.00 H new ATOM 0 HG13 ILE A 79 81.521 -19.011 -5.219 1.00 1.00 H new ATOM 0 HG21 ILE A 79 78.420 -17.654 -3.746 1.00 1.00 H new ATOM 0 HG22 ILE A 79 78.235 -16.257 -4.833 1.00 1.00 H new ATOM 0 HG23 ILE A 79 77.852 -17.894 -5.415 1.00 1.00 H new ATOM 0 HD11 ILE A 79 80.370 -20.594 -3.708 1.00 1.00 H new ATOM 0 HD12 ILE A 79 80.472 -18.983 -2.959 1.00 1.00 H new ATOM 0 HD13 ILE A 79 78.939 -19.536 -3.674 1.00 1.00 H new ATOM 1198 N ALA A 80 81.050 -18.903 -7.822 1.00 1.00 N ATOM 1199 CA ALA A 80 82.084 -19.666 -8.529 1.00 1.00 C ATOM 1200 C ALA A 80 82.097 -19.392 -10.039 1.00 1.00 C ATOM 1201 O ALA A 80 83.079 -19.697 -10.717 1.00 1.00 O ATOM 1202 CB ALA A 80 81.888 -21.165 -8.277 1.00 1.00 C ATOM 0 H ALA A 80 80.182 -19.417 -7.670 1.00 1.00 H new ATOM 0 HA ALA A 80 83.047 -19.340 -8.135 1.00 1.00 H new ATOM 0 HB1 ALA A 80 82.659 -21.727 -8.805 1.00 1.00 H new ATOM 0 HB2 ALA A 80 81.960 -21.367 -7.208 1.00 1.00 H new ATOM 0 HB3 ALA A 80 80.906 -21.469 -8.639 1.00 1.00 H new ATOM 1208 N GLU A 81 80.998 -18.848 -10.567 1.00 1.00 N ATOM 1209 CA GLU A 81 80.894 -18.570 -11.994 1.00 1.00 C ATOM 1210 C GLU A 81 81.503 -17.225 -12.385 1.00 1.00 C ATOM 1211 O GLU A 81 82.534 -17.184 -13.057 1.00 1.00 O ATOM 1212 CB GLU A 81 79.418 -18.554 -12.380 1.00 1.00 C ATOM 1213 CG GLU A 81 78.861 -19.974 -12.416 1.00 1.00 C ATOM 1214 CD GLU A 81 77.415 -19.921 -12.887 1.00 1.00 C ATOM 1215 OE1 GLU A 81 76.700 -19.046 -12.422 1.00 1.00 O ATOM 1216 OE2 GLU A 81 77.051 -20.737 -13.708 1.00 1.00 O ATOM 0 H GLU A 81 80.172 -18.593 -10.026 1.00 1.00 H new ATOM 0 HA GLU A 81 81.448 -19.350 -12.517 1.00 1.00 H new ATOM 0 HB2 GLU A 81 78.855 -17.954 -11.665 1.00 1.00 H new ATOM 0 HB3 GLU A 81 79.296 -18.084 -13.356 1.00 1.00 H new ATOM 0 HG2 GLU A 81 79.454 -20.595 -13.087 1.00 1.00 H new ATOM 0 HG3 GLU A 81 78.919 -20.428 -11.427 1.00 1.00 H new ATOM 1223 N ASP A 82 80.841 -16.123 -12.018 1.00 1.00 N ATOM 1224 CA ASP A 82 81.319 -14.797 -12.390 1.00 1.00 C ATOM 1225 C ASP A 82 82.573 -14.422 -11.628 1.00 1.00 C ATOM 1226 O ASP A 82 83.306 -13.530 -12.053 1.00 1.00 O ATOM 1227 CB ASP A 82 80.238 -13.746 -12.121 1.00 1.00 C ATOM 1228 CG ASP A 82 79.050 -13.948 -13.060 1.00 1.00 C ATOM 1229 OD1 ASP A 82 79.236 -14.559 -14.098 1.00 1.00 O ATOM 1230 OD2 ASP A 82 77.974 -13.478 -12.728 1.00 1.00 O ATOM 0 H ASP A 82 79.981 -16.127 -11.469 1.00 1.00 H new ATOM 0 HA ASP A 82 81.553 -14.825 -13.454 1.00 1.00 H new ATOM 0 HB2 ASP A 82 79.906 -13.814 -11.085 1.00 1.00 H new ATOM 0 HB3 ASP A 82 80.652 -12.747 -12.258 1.00 1.00 H new ATOM 1235 N ALA A 83 82.839 -15.120 -10.519 1.00 1.00 N ATOM 1236 CA ALA A 83 84.059 -14.855 -9.742 1.00 1.00 C ATOM 1237 C ALA A 83 85.233 -14.503 -10.668 1.00 1.00 C ATOM 1238 O ALA A 83 85.982 -13.574 -10.393 1.00 1.00 O ATOM 1239 CB ALA A 83 84.432 -16.096 -8.904 1.00 1.00 C ATOM 0 H ALA A 83 82.242 -15.857 -10.144 1.00 1.00 H new ATOM 0 HA ALA A 83 83.862 -14.009 -9.083 1.00 1.00 H new ATOM 0 HB1 ALA A 83 85.337 -15.890 -8.332 1.00 1.00 H new ATOM 0 HB2 ALA A 83 83.616 -16.332 -8.221 1.00 1.00 H new ATOM 0 HB3 ALA A 83 84.607 -16.944 -9.567 1.00 1.00 H new ATOM 1245 N LEU A 84 85.461 -15.350 -11.682 1.00 1.00 N ATOM 1246 CA LEU A 84 86.635 -15.214 -12.573 1.00 1.00 C ATOM 1247 C LEU A 84 87.080 -13.762 -12.682 1.00 1.00 C ATOM 1248 O LEU A 84 88.262 -13.457 -12.529 1.00 1.00 O ATOM 1249 CB LEU A 84 86.266 -15.735 -13.986 1.00 1.00 C ATOM 1250 CG LEU A 84 87.483 -16.385 -14.679 1.00 1.00 C ATOM 1251 CD1 LEU A 84 88.661 -15.399 -14.706 1.00 1.00 C ATOM 1252 CD2 LEU A 84 87.887 -17.694 -13.952 1.00 1.00 C ATOM 0 H LEU A 84 84.853 -16.136 -11.910 1.00 1.00 H new ATOM 0 HA LEU A 84 87.454 -15.797 -12.151 1.00 1.00 H new ATOM 0 HB2 LEU A 84 85.458 -16.462 -13.908 1.00 1.00 H new ATOM 0 HB3 LEU A 84 85.896 -14.910 -14.595 1.00 1.00 H new ATOM 0 HG LEU A 84 87.211 -16.634 -15.705 1.00 1.00 H new ATOM 0 HD11 LEU A 84 89.515 -15.866 -15.197 1.00 1.00 H new ATOM 0 HD12 LEU A 84 88.373 -14.503 -15.255 1.00 1.00 H new ATOM 0 HD13 LEU A 84 88.932 -15.128 -13.686 1.00 1.00 H new ATOM 0 HD21 LEU A 84 88.746 -18.139 -14.454 1.00 1.00 H new ATOM 0 HD22 LEU A 84 88.147 -17.470 -12.917 1.00 1.00 H new ATOM 0 HD23 LEU A 84 87.052 -18.394 -13.973 1.00 1.00 H new ATOM 1264 N ILE A 85 86.132 -12.870 -12.900 1.00 1.00 N ATOM 1265 CA ILE A 85 86.444 -11.450 -12.979 1.00 1.00 C ATOM 1266 C ILE A 85 86.224 -10.795 -11.618 1.00 1.00 C ATOM 1267 O ILE A 85 87.111 -10.134 -11.083 1.00 1.00 O ATOM 1268 CB ILE A 85 85.544 -10.791 -14.011 1.00 1.00 C ATOM 1269 CG1 ILE A 85 85.725 -11.497 -15.358 1.00 1.00 C ATOM 1270 CG2 ILE A 85 85.932 -9.321 -14.150 1.00 1.00 C ATOM 1271 CD1 ILE A 85 84.676 -10.982 -16.343 1.00 1.00 C ATOM 0 H ILE A 85 85.146 -13.098 -13.025 1.00 1.00 H new ATOM 0 HA ILE A 85 87.487 -11.327 -13.272 1.00 1.00 H new ATOM 0 HB ILE A 85 84.503 -10.865 -13.696 1.00 1.00 H new ATOM 0 HG12 ILE A 85 86.727 -11.313 -15.746 1.00 1.00 H new ATOM 0 HG13 ILE A 85 85.625 -12.575 -15.233 1.00 1.00 H new ATOM 0 HG21 ILE A 85 85.289 -8.843 -14.889 1.00 1.00 H new ATOM 0 HG22 ILE A 85 85.813 -8.821 -13.189 1.00 1.00 H new ATOM 0 HG23 ILE A 85 86.971 -9.248 -14.471 1.00 1.00 H new ATOM 0 HD11 ILE A 85 84.802 -11.482 -17.303 1.00 1.00 H new ATOM 0 HD12 ILE A 85 83.679 -11.189 -15.954 1.00 1.00 H new ATOM 0 HD13 ILE A 85 84.798 -9.907 -16.475 1.00 1.00 H new ATOM 1283 N ALA A 86 85.016 -10.968 -11.080 1.00 1.00 N ATOM 1284 CA ALA A 86 84.667 -10.370 -9.789 1.00 1.00 C ATOM 1285 C ALA A 86 85.816 -10.546 -8.794 1.00 1.00 C ATOM 1286 O ALA A 86 86.124 -9.643 -8.018 1.00 1.00 O ATOM 1287 CB ALA A 86 83.379 -10.989 -9.224 1.00 1.00 C ATOM 0 H ALA A 86 84.269 -11.512 -11.512 1.00 1.00 H new ATOM 0 HA ALA A 86 84.493 -9.305 -9.946 1.00 1.00 H new ATOM 0 HB1 ALA A 86 83.143 -10.527 -8.265 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.558 -10.819 -9.920 1.00 1.00 H new ATOM 0 HB3 ALA A 86 83.521 -12.061 -9.085 1.00 1.00 H new ATOM 1293 N GLU A 87 86.436 -11.718 -8.830 1.00 1.00 N ATOM 1294 CA GLU A 87 87.548 -12.029 -7.938 1.00 1.00 C ATOM 1295 C GLU A 87 88.644 -10.975 -8.057 1.00 1.00 C ATOM 1296 O GLU A 87 89.369 -10.706 -7.101 1.00 1.00 O ATOM 1297 CB GLU A 87 88.133 -13.392 -8.317 1.00 1.00 C ATOM 1298 CG GLU A 87 89.179 -13.810 -7.281 1.00 1.00 C ATOM 1299 CD GLU A 87 89.694 -15.212 -7.593 1.00 1.00 C ATOM 1300 OE1 GLU A 87 89.059 -15.895 -8.379 1.00 1.00 O ATOM 1301 OE2 GLU A 87 90.714 -15.584 -7.036 1.00 1.00 O ATOM 0 H GLU A 87 86.187 -12.473 -9.470 1.00 1.00 H new ATOM 0 HA GLU A 87 87.178 -12.044 -6.913 1.00 1.00 H new ATOM 0 HB2 GLU A 87 87.340 -14.138 -8.368 1.00 1.00 H new ATOM 0 HB3 GLU A 87 88.587 -13.341 -9.307 1.00 1.00 H new ATOM 0 HG2 GLU A 87 90.007 -13.101 -7.282 1.00 1.00 H new ATOM 0 HG3 GLU A 87 88.742 -13.788 -6.283 1.00 1.00 H new ATOM 1308 N ALA A 88 88.749 -10.388 -9.241 1.00 1.00 N ATOM 1309 CA ALA A 88 89.763 -9.361 -9.483 1.00 1.00 C ATOM 1310 C ALA A 88 89.307 -8.049 -8.871 1.00 1.00 C ATOM 1311 O ALA A 88 90.089 -7.110 -8.716 1.00 1.00 O ATOM 1312 CB ALA A 88 90.010 -9.181 -10.985 1.00 1.00 C ATOM 0 H ALA A 88 88.154 -10.599 -10.043 1.00 1.00 H new ATOM 0 HA ALA A 88 90.699 -9.676 -9.021 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.767 -8.413 -11.140 1.00 1.00 H new ATOM 0 HB2 ALA A 88 90.356 -10.122 -11.412 1.00 1.00 H new ATOM 0 HB3 ALA A 88 89.083 -8.880 -11.473 1.00 1.00 H new ATOM 1318 N VAL A 89 88.035 -8.017 -8.495 1.00 1.00 N ATOM 1319 CA VAL A 89 87.440 -6.857 -7.865 1.00 1.00 C ATOM 1320 C VAL A 89 87.684 -6.954 -6.363 1.00 1.00 C ATOM 1321 O VAL A 89 86.838 -6.562 -5.555 1.00 1.00 O ATOM 1322 CB VAL A 89 85.944 -6.712 -8.203 1.00 1.00 C ATOM 1323 CG1 VAL A 89 85.471 -5.288 -7.870 1.00 1.00 C ATOM 1324 CG2 VAL A 89 85.740 -6.929 -9.708 1.00 1.00 C ATOM 0 H VAL A 89 87.391 -8.798 -8.621 1.00 1.00 H new ATOM 0 HA VAL A 89 87.909 -5.953 -8.253 1.00 1.00 H new ATOM 0 HB VAL A 89 85.381 -7.445 -7.625 1.00 1.00 H new ATOM 0 HG11 VAL A 89 84.412 -5.191 -8.111 1.00 1.00 H new ATOM 0 HG12 VAL A 89 85.621 -5.094 -6.808 1.00 1.00 H new ATOM 0 HG13 VAL A 89 86.044 -4.568 -8.455 1.00 1.00 H new ATOM 0 HG21 VAL A 89 84.682 -6.827 -9.950 1.00 1.00 H new ATOM 0 HG22 VAL A 89 86.313 -6.186 -10.264 1.00 1.00 H new ATOM 0 HG23 VAL A 89 86.080 -7.928 -9.981 1.00 1.00 H new ATOM 1334 N GLY A 90 88.899 -7.425 -5.967 1.00 1.00 N ATOM 1335 CA GLY A 90 89.266 -7.499 -4.573 1.00 1.00 C ATOM 1336 C GLY A 90 89.131 -6.130 -3.891 1.00 1.00 C ATOM 1337 O GLY A 90 88.876 -6.122 -2.692 1.00 1.00 O ATOM 0 H GLY A 90 89.620 -7.752 -6.610 1.00 1.00 H new ATOM 0 HA2 GLY A 90 88.632 -8.226 -4.065 1.00 1.00 H new ATOM 0 HA3 GLY A 90 90.293 -7.854 -4.483 1.00 1.00 H new ATOM 1341 N PRO A 91 89.204 -4.966 -4.607 1.00 1.00 N ATOM 1342 CA PRO A 91 88.937 -3.603 -4.022 1.00 1.00 C ATOM 1343 C PRO A 91 87.879 -3.612 -2.900 1.00 1.00 C ATOM 1344 O PRO A 91 87.649 -2.593 -2.255 1.00 1.00 O ATOM 1345 CB PRO A 91 88.411 -2.806 -5.249 1.00 1.00 C ATOM 1346 CG PRO A 91 88.828 -3.583 -6.483 1.00 1.00 C ATOM 1347 CD PRO A 91 89.692 -4.745 -5.996 1.00 1.00 C ATOM 0 HA PRO A 91 89.826 -3.186 -3.550 1.00 1.00 H new ATOM 0 HB2 PRO A 91 87.327 -2.700 -5.206 1.00 1.00 H new ATOM 0 HB3 PRO A 91 88.829 -1.800 -5.265 1.00 1.00 H new ATOM 0 HG2 PRO A 91 87.955 -3.949 -7.024 1.00 1.00 H new ATOM 0 HG3 PRO A 91 89.386 -2.947 -7.171 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.562 -5.632 -6.616 1.00 1.00 H new ATOM 0 HD3 PRO A 91 90.753 -4.495 -6.016 1.00 1.00 H new ATOM 1355 N HIS A 92 87.299 -4.774 -2.655 1.00 1.00 N ATOM 1356 CA HIS A 92 86.334 -4.928 -1.593 1.00 1.00 C ATOM 1357 C HIS A 92 86.963 -4.353 -0.329 1.00 1.00 C ATOM 1358 O HIS A 92 86.250 -3.778 0.495 1.00 1.00 O ATOM 1359 CB HIS A 92 86.031 -6.418 -1.368 1.00 1.00 C ATOM 1360 CG HIS A 92 85.409 -6.631 -0.005 1.00 1.00 C ATOM 1361 ND1 HIS A 92 85.851 -7.312 1.108 1.00 1.00 N flip ATOM 1362 CD2 HIS A 92 84.194 -6.076 0.354 1.00 1.00 C flip ATOM 1363 CE1 HIS A 92 84.928 -7.177 2.140 1.00 1.00 C flip ATOM 1364 NE2 HIS A 92 83.949 -6.422 1.633 1.00 1.00 N flip ATOM 0 H HIS A 92 87.485 -5.626 -3.184 1.00 1.00 H new ATOM 0 HA HIS A 92 85.404 -4.418 -1.845 1.00 1.00 H new ATOM 0 HB2 HIS A 92 85.355 -6.779 -2.143 1.00 1.00 H new ATOM 0 HB3 HIS A 92 86.950 -6.999 -1.450 1.00 1.00 H new ATOM 0 HD2 HIS A 92 83.557 -5.474 -0.277 1.00 1.00 H new ATOM 0 HE1 HIS A 92 84.989 -7.592 3.135 1.00 1.00 H new ATOM 0 HE2 HIS A 92 83.117 -6.141 2.152 1.00 1.00 H new ATOM 1372 N LEU A 93 88.304 -4.418 -0.175 1.00 1.00 N ATOM 1373 CA LEU A 93 88.953 -3.827 0.972 1.00 1.00 C ATOM 1374 C LEU A 93 88.653 -2.339 1.006 1.00 1.00 C ATOM 1375 O LEU A 93 88.144 -1.826 1.981 1.00 1.00 O ATOM 1376 CB LEU A 93 90.470 -4.052 0.836 1.00 1.00 C ATOM 1377 CG LEU A 93 90.944 -3.761 -0.627 1.00 1.00 C ATOM 1378 CD1 LEU A 93 91.924 -2.584 -0.644 1.00 1.00 C ATOM 1379 CD2 LEU A 93 91.638 -4.994 -1.226 1.00 1.00 C ATOM 0 H LEU A 93 88.936 -4.873 -0.834 1.00 1.00 H new ATOM 0 HA LEU A 93 88.590 -4.282 1.894 1.00 1.00 H new ATOM 0 HB2 LEU A 93 91.003 -3.404 1.532 1.00 1.00 H new ATOM 0 HB3 LEU A 93 90.716 -5.079 1.106 1.00 1.00 H new ATOM 0 HG LEU A 93 90.064 -3.516 -1.222 1.00 1.00 H new ATOM 0 HD11 LEU A 93 92.245 -2.393 -1.668 1.00 1.00 H new ATOM 0 HD12 LEU A 93 91.433 -1.696 -0.246 1.00 1.00 H new ATOM 0 HD13 LEU A 93 92.792 -2.824 -0.030 1.00 1.00 H new ATOM 0 HD21 LEU A 93 91.960 -4.772 -2.243 1.00 1.00 H new ATOM 0 HD22 LEU A 93 92.505 -5.254 -0.619 1.00 1.00 H new ATOM 0 HD23 LEU A 93 90.941 -5.832 -1.241 1.00 1.00 H new ATOM 1391 N ALA A 94 89.019 -1.632 -0.057 1.00 1.00 N ATOM 1392 CA ALA A 94 88.789 -0.193 -0.084 1.00 1.00 C ATOM 1393 C ALA A 94 87.350 0.023 0.345 1.00 1.00 C ATOM 1394 O ALA A 94 87.066 0.736 1.295 1.00 1.00 O ATOM 1395 CB ALA A 94 89.012 0.337 -1.497 1.00 1.00 C ATOM 0 H ALA A 94 89.464 -2.018 -0.890 1.00 1.00 H new ATOM 0 HA ALA A 94 89.474 0.335 0.580 1.00 1.00 H new ATOM 0 HB1 ALA A 94 88.839 1.413 -1.513 1.00 1.00 H new ATOM 0 HB2 ALA A 94 90.036 0.129 -1.806 1.00 1.00 H new ATOM 0 HB3 ALA A 94 88.320 -0.152 -2.183 1.00 1.00 H new ATOM 1401 N ARG A 95 86.445 -0.647 -0.315 1.00 1.00 N ATOM 1402 CA ARG A 95 85.062 -0.560 0.081 1.00 1.00 C ATOM 1403 C ARG A 95 84.936 -1.037 1.513 1.00 1.00 C ATOM 1404 O ARG A 95 84.025 -0.626 2.227 1.00 1.00 O ATOM 1405 CB ARG A 95 84.217 -1.412 -0.846 1.00 1.00 C ATOM 1406 CG ARG A 95 84.180 -0.866 -2.322 1.00 1.00 C ATOM 1407 CD ARG A 95 85.082 0.373 -2.635 1.00 1.00 C ATOM 1408 NE ARG A 95 86.307 -0.014 -3.314 1.00 1.00 N ATOM 1409 CZ ARG A 95 87.062 0.922 -3.878 1.00 1.00 C ATOM 1410 NH1 ARG A 95 86.732 2.173 -3.730 1.00 1.00 N ATOM 1411 NH2 ARG A 95 88.129 0.595 -4.556 1.00 1.00 N ATOM 0 H ARG A 95 86.633 -1.250 -1.116 1.00 1.00 H new ATOM 0 HA ARG A 95 84.711 0.470 0.016 1.00 1.00 H new ATOM 0 HB2 ARG A 95 84.607 -2.430 -0.851 1.00 1.00 H new ATOM 0 HB3 ARG A 95 83.200 -1.462 -0.458 1.00 1.00 H new ATOM 0 HG2 ARG A 95 84.470 -1.676 -2.992 1.00 1.00 H new ATOM 0 HG3 ARG A 95 83.149 -0.606 -2.563 1.00 1.00 H new ATOM 0 HD2 ARG A 95 84.529 1.079 -3.255 1.00 1.00 H new ATOM 0 HD3 ARG A 95 85.327 0.889 -1.707 1.00 1.00 H new ATOM 0 HE ARG A 95 86.584 -0.995 -3.357 1.00 1.00 H new ATOM 0 HH11 ARG A 95 85.905 2.421 -3.188 1.00 1.00 H new ATOM 0 HH12 ARG A 95 87.301 2.904 -4.156 1.00 1.00 H new ATOM 0 HH21 ARG A 95 88.389 -0.386 -4.656 1.00 1.00 H new ATOM 0 HH22 ARG A 95 88.703 1.321 -4.986 1.00 1.00 H new ATOM 1425 N ALA A 96 85.843 -1.900 1.954 1.00 1.00 N ATOM 1426 CA ALA A 96 85.736 -2.363 3.343 1.00 1.00 C ATOM 1427 C ALA A 96 85.823 -1.139 4.216 1.00 1.00 C ATOM 1428 O ALA A 96 84.988 -0.931 5.055 1.00 1.00 O ATOM 1429 CB ALA A 96 86.794 -3.388 3.717 1.00 1.00 C ATOM 0 H ALA A 96 86.620 -2.279 1.412 1.00 1.00 H new ATOM 0 HA ALA A 96 84.788 -2.883 3.481 1.00 1.00 H new ATOM 0 HB1 ALA A 96 86.658 -3.688 4.756 1.00 1.00 H new ATOM 0 HB2 ALA A 96 86.699 -4.261 3.072 1.00 1.00 H new ATOM 0 HB3 ALA A 96 87.785 -2.951 3.592 1.00 1.00 H new ATOM 1435 N LEU A 97 86.863 -0.352 4.001 1.00 1.00 N ATOM 1436 CA LEU A 97 87.039 0.856 4.810 1.00 1.00 C ATOM 1437 C LEU A 97 85.610 1.479 5.044 1.00 1.00 C ATOM 1438 O LEU A 97 85.261 1.941 6.140 1.00 1.00 O ATOM 1439 CB LEU A 97 87.990 1.847 4.080 1.00 1.00 C ATOM 1440 CG LEU A 97 89.417 1.773 4.666 1.00 1.00 C ATOM 1441 CD1 LEU A 97 90.453 2.230 3.626 1.00 1.00 C ATOM 1442 CD2 LEU A 97 89.509 2.683 5.896 1.00 1.00 C ATOM 0 H LEU A 97 87.583 -0.514 3.296 1.00 1.00 H new ATOM 0 HA LEU A 97 87.497 0.627 5.772 1.00 1.00 H new ATOM 0 HB2 LEU A 97 88.017 1.614 3.015 1.00 1.00 H new ATOM 0 HB3 LEU A 97 87.606 2.863 4.175 1.00 1.00 H new ATOM 0 HG LEU A 97 89.626 0.740 4.945 1.00 1.00 H new ATOM 0 HD11 LEU A 97 91.452 2.171 4.057 1.00 1.00 H new ATOM 0 HD12 LEU A 97 90.398 1.585 2.749 1.00 1.00 H new ATOM 0 HD13 LEU A 97 90.245 3.259 3.333 1.00 1.00 H new ATOM 0 HD21 LEU A 97 90.515 2.632 6.312 1.00 1.00 H new ATOM 0 HD22 LEU A 97 89.287 3.710 5.606 1.00 1.00 H new ATOM 0 HD23 LEU A 97 88.790 2.354 6.646 1.00 1.00 H new ATOM 1454 N GLY A 98 84.719 1.302 4.048 1.00 1.00 N ATOM 1455 CA GLY A 98 83.305 1.728 4.217 1.00 1.00 C ATOM 1456 C GLY A 98 82.482 0.662 4.987 1.00 1.00 C ATOM 1457 O GLY A 98 81.820 0.915 6.018 1.00 1.00 O ATOM 0 H GLY A 98 84.937 0.882 3.145 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.270 2.675 4.755 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.856 1.900 3.239 1.00 1.00 H new ATOM 1461 N GLN A 99 82.568 -0.553 4.492 1.00 1.00 N ATOM 1462 CA GLN A 99 81.901 -1.680 5.077 1.00 1.00 C ATOM 1463 C GLN A 99 82.699 -2.128 6.281 1.00 1.00 C ATOM 1464 O GLN A 99 82.434 -3.180 6.866 1.00 1.00 O ATOM 1465 CB GLN A 99 81.729 -2.821 4.066 1.00 1.00 C ATOM 1466 CG GLN A 99 81.206 -2.283 2.729 1.00 1.00 C ATOM 1467 CD GLN A 99 79.853 -1.610 2.919 1.00 1.00 C ATOM 1468 OE1 GLN A 99 78.923 -2.221 3.445 1.00 1.00 O ATOM 1469 NE2 GLN A 99 79.684 -0.380 2.512 1.00 1.00 N ATOM 0 H GLN A 99 83.112 -0.782 3.660 1.00 1.00 H new ATOM 0 HA GLN A 99 80.897 -1.390 5.386 1.00 1.00 H new ATOM 0 HB2 GLN A 99 82.683 -3.325 3.913 1.00 1.00 H new ATOM 0 HB3 GLN A 99 81.036 -3.563 4.462 1.00 1.00 H new ATOM 0 HG2 GLN A 99 81.918 -1.570 2.313 1.00 1.00 H new ATOM 0 HG3 GLN A 99 81.116 -3.099 2.012 1.00 1.00 H new ATOM 0 HE21 GLN A 99 80.457 0.124 2.076 1.00 1.00 H new ATOM 0 HE22 GLN A 99 78.779 0.076 2.630 1.00 1.00 H new ATOM 1478 N ILE A 100 83.691 -1.313 6.670 1.00 1.00 N ATOM 1479 CA ILE A 100 84.526 -1.626 7.807 1.00 1.00 C ATOM 1480 C ILE A 100 83.656 -1.740 8.995 1.00 1.00 C ATOM 1481 O ILE A 100 83.696 -2.735 9.704 1.00 1.00 O ATOM 1482 CB ILE A 100 85.566 -0.518 8.034 1.00 1.00 C ATOM 1483 CG1 ILE A 100 86.574 -0.931 9.147 1.00 1.00 C ATOM 1484 CG2 ILE A 100 84.870 0.793 8.441 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.016 -0.759 8.648 1.00 1.00 C ATOM 0 H ILE A 100 83.923 -0.436 6.205 1.00 1.00 H new ATOM 0 HA ILE A 100 85.058 -2.560 7.628 1.00 1.00 H new ATOM 0 HB ILE A 100 86.107 -0.367 7.100 1.00 1.00 H new ATOM 0 HG12 ILE A 100 86.414 -0.322 10.037 1.00 1.00 H new ATOM 0 HG13 ILE A 100 86.403 -1.968 9.436 1.00 1.00 H new ATOM 0 HG21 ILE A 100 85.619 1.569 8.599 1.00 1.00 H new ATOM 0 HG22 ILE A 100 84.187 1.103 7.650 1.00 1.00 H new ATOM 0 HG23 ILE A 100 84.310 0.637 9.363 1.00 1.00 H new ATOM 0 HD11 ILE A 100 88.711 -1.051 9.435 1.00 1.00 H new ATOM 0 HD12 ILE A 100 88.175 -1.388 7.772 1.00 1.00 H new ATOM 0 HD13 ILE A 100 88.187 0.284 8.382 1.00 1.00 H new ATOM 1497 N VAL A 101 82.826 -0.744 9.234 1.00 1.00 N ATOM 1498 CA VAL A 101 81.950 -0.887 10.384 1.00 1.00 C ATOM 1499 C VAL A 101 81.165 -2.162 10.174 1.00 1.00 C ATOM 1500 O VAL A 101 81.166 -3.047 11.014 1.00 1.00 O ATOM 1501 CB VAL A 101 80.999 0.302 10.520 1.00 1.00 C ATOM 1502 CG1 VAL A 101 79.954 0.029 11.616 1.00 1.00 C ATOM 1503 CG2 VAL A 101 81.804 1.540 10.895 1.00 1.00 C ATOM 0 H VAL A 101 82.738 0.116 8.693 1.00 1.00 H new ATOM 0 HA VAL A 101 82.537 -0.923 11.302 1.00 1.00 H new ATOM 0 HB VAL A 101 80.485 0.458 9.572 1.00 1.00 H new ATOM 0 HG11 VAL A 101 79.284 0.885 11.701 1.00 1.00 H new ATOM 0 HG12 VAL A 101 79.378 -0.859 11.356 1.00 1.00 H new ATOM 0 HG13 VAL A 101 80.459 -0.132 12.568 1.00 1.00 H new ATOM 0 HG21 VAL A 101 81.134 2.394 10.994 1.00 1.00 H new ATOM 0 HG22 VAL A 101 82.315 1.368 11.842 1.00 1.00 H new ATOM 0 HG23 VAL A 101 82.540 1.745 10.117 1.00 1.00 H new ATOM 1513 N CYS A 102 80.451 -2.243 9.056 1.00 1.00 N ATOM 1514 CA CYS A 102 79.626 -3.423 8.812 1.00 1.00 C ATOM 1515 C CYS A 102 80.402 -4.708 9.137 1.00 1.00 C ATOM 1516 O CYS A 102 79.819 -5.740 9.417 1.00 1.00 O ATOM 1517 CB CYS A 102 79.166 -3.438 7.348 1.00 1.00 C ATOM 1518 SG CYS A 102 78.638 -5.107 6.858 1.00 1.00 S ATOM 0 H CYS A 102 80.424 -1.532 8.325 1.00 1.00 H new ATOM 0 HA CYS A 102 78.753 -3.380 9.464 1.00 1.00 H new ATOM 0 HB2 CYS A 102 78.343 -2.736 7.213 1.00 1.00 H new ATOM 0 HB3 CYS A 102 79.979 -3.104 6.703 1.00 1.00 H new ATOM 0 HG CYS A 102 78.849 -5.934 7.838 1.00 1.00 H new ATOM 1523 N ARG A 103 81.721 -4.622 9.106 1.00 1.00 N ATOM 1524 CA ARG A 103 82.593 -5.767 9.410 1.00 1.00 C ATOM 1525 C ARG A 103 82.986 -5.851 10.898 1.00 1.00 C ATOM 1526 O ARG A 103 82.980 -6.915 11.517 1.00 1.00 O ATOM 1527 CB ARG A 103 83.865 -5.621 8.525 1.00 1.00 C ATOM 1528 CG ARG A 103 85.108 -6.360 9.112 1.00 1.00 C ATOM 1529 CD ARG A 103 85.646 -7.408 8.136 1.00 1.00 C ATOM 1530 NE ARG A 103 86.925 -7.900 8.624 1.00 1.00 N ATOM 1531 CZ ARG A 103 87.019 -8.584 9.768 1.00 1.00 C ATOM 1532 NH1 ARG A 103 85.954 -8.865 10.472 1.00 1.00 N ATOM 1533 NH2 ARG A 103 88.186 -8.980 10.188 1.00 1.00 N ATOM 0 H ARG A 103 82.225 -3.767 8.872 1.00 1.00 H new ATOM 0 HA ARG A 103 82.052 -6.689 9.196 1.00 1.00 H new ATOM 0 HB2 ARG A 103 83.654 -6.012 7.529 1.00 1.00 H new ATOM 0 HB3 ARG A 103 84.100 -4.563 8.409 1.00 1.00 H new ATOM 0 HG2 ARG A 103 85.890 -5.636 9.338 1.00 1.00 H new ATOM 0 HG3 ARG A 103 84.837 -6.841 10.052 1.00 1.00 H new ATOM 0 HD2 ARG A 103 84.938 -8.231 8.040 1.00 1.00 H new ATOM 0 HD3 ARG A 103 85.764 -6.972 7.144 1.00 1.00 H new ATOM 0 HE ARG A 103 87.769 -7.719 8.081 1.00 1.00 H new ATOM 0 HH11 ARG A 103 85.035 -8.561 10.150 1.00 1.00 H new ATOM 0 HH12 ARG A 103 86.042 -9.388 11.343 1.00 1.00 H new ATOM 0 HH21 ARG A 103 89.023 -8.768 9.644 1.00 1.00 H new ATOM 0 HH22 ARG A 103 88.264 -9.502 11.061 1.00 1.00 H new ATOM 1547 N TYR A 104 83.311 -4.692 11.414 1.00 1.00 N ATOM 1548 CA TYR A 104 83.723 -4.452 12.798 1.00 1.00 C ATOM 1549 C TYR A 104 82.563 -3.839 13.588 1.00 1.00 C ATOM 1550 O TYR A 104 82.759 -3.258 14.650 1.00 1.00 O ATOM 1551 CB TYR A 104 85.035 -3.610 12.855 1.00 1.00 C ATOM 1552 CG TYR A 104 84.982 -2.636 14.004 1.00 1.00 C ATOM 1553 CD1 TYR A 104 85.252 -3.066 15.315 1.00 1.00 C ATOM 1554 CD2 TYR A 104 84.569 -1.327 13.768 1.00 1.00 C ATOM 1555 CE1 TYR A 104 85.118 -2.168 16.382 1.00 1.00 C ATOM 1556 CE2 TYR A 104 84.419 -0.437 14.831 1.00 1.00 C ATOM 1557 CZ TYR A 104 84.694 -0.852 16.136 1.00 1.00 C ATOM 1558 OH TYR A 104 84.525 0.030 17.177 1.00 1.00 O ATOM 0 H TYR A 104 83.298 -3.836 10.859 1.00 1.00 H new ATOM 0 HA TYR A 104 83.965 -5.400 13.278 1.00 1.00 H new ATOM 0 HB2 TYR A 104 85.894 -4.271 12.969 1.00 1.00 H new ATOM 0 HB3 TYR A 104 85.170 -3.070 11.918 1.00 1.00 H new ATOM 0 HD1 TYR A 104 85.561 -4.084 15.499 1.00 1.00 H new ATOM 0 HD2 TYR A 104 84.364 -1.000 12.759 1.00 1.00 H new ATOM 0 HE1 TYR A 104 85.340 -2.487 17.390 1.00 1.00 H new ATOM 0 HE2 TYR A 104 84.090 0.575 14.645 1.00 1.00 H new ATOM 0 HH TYR A 104 84.229 0.896 16.827 1.00 1.00 H new ATOM 1568 N GLY A 105 81.334 -4.005 13.143 1.00 1.00 N ATOM 1569 CA GLY A 105 80.240 -3.455 13.919 1.00 1.00 C ATOM 1570 C GLY A 105 78.914 -4.011 13.470 1.00 1.00 C ATOM 1571 O GLY A 105 77.946 -3.861 14.188 1.00 1.00 O ATOM 0 H GLY A 105 81.073 -4.494 12.287 1.00 1.00 H new ATOM 0 HA2 GLY A 105 80.392 -3.680 14.975 1.00 1.00 H new ATOM 0 HA3 GLY A 105 80.233 -2.369 13.822 1.00 1.00 H new ATOM 1575 N ALA A 106 78.899 -4.651 12.286 1.00 1.00 N ATOM 1576 CA ALA A 106 77.680 -5.250 11.704 1.00 1.00 C ATOM 1577 C ALA A 106 76.547 -5.359 12.731 1.00 1.00 C ATOM 1578 O ALA A 106 76.137 -6.451 13.123 1.00 1.00 O ATOM 1579 CB ALA A 106 78.016 -6.643 11.101 1.00 1.00 C ATOM 0 H ALA A 106 79.729 -4.768 11.705 1.00 1.00 H new ATOM 0 HA ALA A 106 77.326 -4.591 10.911 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.114 -7.081 10.673 1.00 1.00 H new ATOM 0 HB2 ALA A 106 78.770 -6.530 10.322 1.00 1.00 H new ATOM 0 HB3 ALA A 106 78.400 -7.296 11.885 1.00 1.00 H new ATOM 1585 N THR A 107 76.054 -4.205 13.177 1.00 1.00 N ATOM 1586 CA THR A 107 74.987 -4.164 14.161 1.00 1.00 C ATOM 1587 C THR A 107 73.647 -3.876 13.472 1.00 1.00 C ATOM 1588 O THR A 107 72.613 -3.827 14.128 1.00 1.00 O ATOM 1589 CB THR A 107 75.274 -3.088 15.223 1.00 1.00 C ATOM 1590 OG1 THR A 107 76.482 -3.398 15.907 1.00 1.00 O ATOM 1591 CG2 THR A 107 74.131 -3.046 16.242 1.00 1.00 C ATOM 0 H THR A 107 76.380 -3.289 12.869 1.00 1.00 H new ATOM 0 HA THR A 107 74.933 -5.134 14.654 1.00 1.00 H new ATOM 0 HB THR A 107 75.365 -2.121 14.728 1.00 1.00 H new ATOM 0 HG1 THR A 107 77.204 -3.521 15.256 1.00 1.00 H new ATOM 0 HG21 THR A 107 74.340 -2.283 16.991 1.00 1.00 H new ATOM 0 HG22 THR A 107 73.197 -2.808 15.732 1.00 1.00 H new ATOM 0 HG23 THR A 107 74.042 -4.017 16.729 1.00 1.00 H new ATOM 1599 N VAL A 108 73.683 -3.626 12.151 1.00 1.00 N ATOM 1600 CA VAL A 108 72.462 -3.308 11.400 1.00 1.00 C ATOM 1601 C VAL A 108 71.738 -4.566 10.948 1.00 1.00 C ATOM 1602 O VAL A 108 70.574 -4.775 11.303 1.00 1.00 O ATOM 1603 CB VAL A 108 72.804 -2.443 10.193 1.00 1.00 C ATOM 1604 CG1 VAL A 108 73.449 -1.154 10.695 1.00 1.00 C ATOM 1605 CG2 VAL A 108 73.768 -3.205 9.264 1.00 1.00 C ATOM 0 H VAL A 108 74.535 -3.638 11.590 1.00 1.00 H new ATOM 0 HA VAL A 108 71.795 -2.760 12.065 1.00 1.00 H new ATOM 0 HB VAL A 108 71.903 -2.205 9.627 1.00 1.00 H new ATOM 0 HG11 VAL A 108 73.702 -0.519 9.846 1.00 1.00 H new ATOM 0 HG12 VAL A 108 72.751 -0.628 11.346 1.00 1.00 H new ATOM 0 HG13 VAL A 108 74.355 -1.393 11.252 1.00 1.00 H new ATOM 0 HG21 VAL A 108 74.010 -2.583 8.402 1.00 1.00 H new ATOM 0 HG22 VAL A 108 74.682 -3.445 9.807 1.00 1.00 H new ATOM 0 HG23 VAL A 108 73.294 -4.126 8.925 1.00 1.00 H new ATOM 1615 N ILE A 109 72.426 -5.431 10.167 1.00 1.00 N ATOM 1616 CA ILE A 109 71.855 -6.679 9.680 1.00 1.00 C ATOM 1617 C ILE A 109 71.167 -7.472 10.771 1.00 1.00 C ATOM 1618 O ILE A 109 70.125 -8.063 10.520 1.00 1.00 O ATOM 1619 CB ILE A 109 72.987 -7.569 8.995 1.00 1.00 C ATOM 1620 CG1 ILE A 109 73.547 -8.723 9.909 1.00 1.00 C ATOM 1621 CG2 ILE A 109 74.187 -6.691 8.610 1.00 1.00 C ATOM 1622 CD1 ILE A 109 74.008 -9.915 9.060 1.00 1.00 C ATOM 0 H ILE A 109 73.387 -5.272 9.866 1.00 1.00 H new ATOM 0 HA ILE A 109 71.094 -6.415 8.945 1.00 1.00 H new ATOM 0 HB ILE A 109 72.501 -8.021 8.131 1.00 1.00 H new ATOM 0 HG12 ILE A 109 74.381 -8.350 10.503 1.00 1.00 H new ATOM 0 HG13 ILE A 109 72.776 -9.046 10.609 1.00 1.00 H new ATOM 0 HG21 ILE A 109 74.954 -7.308 8.143 1.00 1.00 H new ATOM 0 HG22 ILE A 109 73.864 -5.921 7.909 1.00 1.00 H new ATOM 0 HG23 ILE A 109 74.595 -6.220 9.504 1.00 1.00 H new ATOM 0 HD11 ILE A 109 74.391 -10.700 9.712 1.00 1.00 H new ATOM 0 HD12 ILE A 109 73.166 -10.300 8.485 1.00 1.00 H new ATOM 0 HD13 ILE A 109 74.796 -9.593 8.378 1.00 1.00 H new ATOM 1634 N PRO A 110 71.739 -7.597 11.957 1.00 1.00 N ATOM 1635 CA PRO A 110 71.140 -8.449 13.011 1.00 1.00 C ATOM 1636 C PRO A 110 69.634 -8.334 13.083 1.00 1.00 C ATOM 1637 O PRO A 110 68.955 -9.326 13.330 1.00 1.00 O ATOM 1638 CB PRO A 110 71.802 -7.924 14.310 1.00 1.00 C ATOM 1639 CG PRO A 110 72.504 -6.682 13.893 1.00 1.00 C ATOM 1640 CD PRO A 110 72.990 -7.004 12.494 1.00 1.00 C ATOM 0 HA PRO A 110 71.316 -9.508 12.824 1.00 1.00 H new ATOM 0 HB2 PRO A 110 71.058 -7.720 15.080 1.00 1.00 H new ATOM 0 HB3 PRO A 110 72.498 -8.654 14.724 1.00 1.00 H new ATOM 0 HG2 PRO A 110 71.835 -5.822 13.897 1.00 1.00 H new ATOM 0 HG3 PRO A 110 73.332 -6.445 14.561 1.00 1.00 H new ATOM 0 HD2 PRO A 110 73.309 -6.119 11.943 1.00 1.00 H new ATOM 0 HD3 PRO A 110 73.826 -7.703 12.487 1.00 1.00 H new ATOM 1648 N ASN A 111 69.101 -7.146 12.898 1.00 1.00 N ATOM 1649 CA ASN A 111 67.663 -7.008 12.999 1.00 1.00 C ATOM 1650 C ASN A 111 66.963 -7.805 11.894 1.00 1.00 C ATOM 1651 O ASN A 111 66.265 -8.794 12.156 1.00 1.00 O ATOM 1652 CB ASN A 111 67.319 -5.525 12.879 1.00 1.00 C ATOM 1653 CG ASN A 111 65.815 -5.332 12.798 1.00 1.00 C ATOM 1654 OD1 ASN A 111 65.228 -5.457 11.723 1.00 1.00 O ATOM 1655 ND2 ASN A 111 65.153 -5.027 13.879 1.00 1.00 N ATOM 0 H ASN A 111 69.616 -6.292 12.685 1.00 1.00 H new ATOM 0 HA ASN A 111 67.321 -7.400 13.957 1.00 1.00 H new ATOM 0 HB2 ASN A 111 67.715 -4.983 13.738 1.00 1.00 H new ATOM 0 HB3 ASN A 111 67.793 -5.106 11.991 1.00 1.00 H new ATOM 0 HD21 ASN A 111 64.143 -4.891 13.837 1.00 1.00 H new ATOM 0 HD22 ASN A 111 65.645 -4.925 14.767 1.00 1.00 H new ATOM 1662 N ILE A 112 67.132 -7.349 10.663 1.00 1.00 N ATOM 1663 CA ILE A 112 66.492 -7.977 9.508 1.00 1.00 C ATOM 1664 C ILE A 112 67.052 -9.358 9.245 1.00 1.00 C ATOM 1665 O ILE A 112 66.424 -10.200 8.622 1.00 1.00 O ATOM 1666 CB ILE A 112 66.739 -7.099 8.242 1.00 1.00 C ATOM 1667 CG1 ILE A 112 68.104 -7.461 7.568 1.00 1.00 C ATOM 1668 CG2 ILE A 112 66.753 -5.613 8.649 1.00 1.00 C ATOM 1669 CD1 ILE A 112 68.382 -6.619 6.320 1.00 1.00 C ATOM 0 H ILE A 112 67.710 -6.541 10.433 1.00 1.00 H new ATOM 0 HA ILE A 112 65.427 -8.065 9.723 1.00 1.00 H new ATOM 0 HB ILE A 112 65.938 -7.288 7.528 1.00 1.00 H new ATOM 0 HG12 ILE A 112 68.910 -7.317 8.287 1.00 1.00 H new ATOM 0 HG13 ILE A 112 68.103 -8.517 7.297 1.00 1.00 H new ATOM 0 HG21 ILE A 112 66.925 -4.996 7.767 1.00 1.00 H new ATOM 0 HG22 ILE A 112 65.794 -5.349 9.095 1.00 1.00 H new ATOM 0 HG23 ILE A 112 67.549 -5.442 9.373 1.00 1.00 H new ATOM 0 HD11 ILE A 112 69.341 -6.910 5.891 1.00 1.00 H new ATOM 0 HD12 ILE A 112 67.592 -6.783 5.587 1.00 1.00 H new ATOM 0 HD13 ILE A 112 68.411 -5.564 6.592 1.00 1.00 H new ATOM 1681 N ASN A 113 68.286 -9.517 9.642 1.00 1.00 N ATOM 1682 CA ASN A 113 69.005 -10.754 9.371 1.00 1.00 C ATOM 1683 C ASN A 113 68.223 -11.926 9.901 1.00 1.00 C ATOM 1684 O ASN A 113 67.810 -12.793 9.139 1.00 1.00 O ATOM 1685 CB ASN A 113 70.405 -10.717 9.996 1.00 1.00 C ATOM 1686 CG ASN A 113 71.048 -12.106 9.956 1.00 1.00 C ATOM 1687 OD1 ASN A 113 72.064 -12.300 9.291 1.00 1.00 O ATOM 1688 ND2 ASN A 113 70.507 -13.085 10.632 1.00 1.00 N ATOM 0 H ASN A 113 68.821 -8.815 10.153 1.00 1.00 H new ATOM 0 HA ASN A 113 69.119 -10.862 8.292 1.00 1.00 H new ATOM 0 HB2 ASN A 113 71.031 -10.005 9.458 1.00 1.00 H new ATOM 0 HB3 ASN A 113 70.340 -10.370 11.027 1.00 1.00 H new ATOM 0 HD21 ASN A 113 70.928 -14.014 10.609 1.00 1.00 H new ATOM 0 HD22 ASN A 113 69.664 -12.920 11.182 1.00 1.00 H new ATOM 1695 N ALA A 114 68.013 -11.940 11.190 1.00 1.00 N ATOM 1696 CA ALA A 114 67.281 -13.006 11.808 1.00 1.00 C ATOM 1697 C ALA A 114 65.863 -13.062 11.275 1.00 1.00 C ATOM 1698 O ALA A 114 65.235 -14.123 11.283 1.00 1.00 O ATOM 1699 CB ALA A 114 67.258 -12.793 13.323 1.00 1.00 C ATOM 0 H ALA A 114 68.342 -11.220 11.833 1.00 1.00 H new ATOM 0 HA ALA A 114 67.772 -13.951 11.576 1.00 1.00 H new ATOM 0 HB1 ALA A 114 66.702 -13.602 13.796 1.00 1.00 H new ATOM 0 HB2 ALA A 114 68.279 -12.783 13.705 1.00 1.00 H new ATOM 0 HB3 ALA A 114 66.777 -11.842 13.549 1.00 1.00 H new ATOM 1705 N ALA A 115 65.379 -11.935 10.740 1.00 1.00 N ATOM 1706 CA ALA A 115 64.047 -11.905 10.172 1.00 1.00 C ATOM 1707 C ALA A 115 63.986 -12.528 8.773 1.00 1.00 C ATOM 1708 O ALA A 115 63.232 -13.479 8.547 1.00 1.00 O ATOM 1709 CB ALA A 115 63.580 -10.447 10.099 1.00 1.00 C ATOM 0 H ALA A 115 65.887 -11.052 10.693 1.00 1.00 H new ATOM 0 HA ALA A 115 63.396 -12.498 10.815 1.00 1.00 H new ATOM 0 HB1 ALA A 115 62.577 -10.407 9.673 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.566 -10.019 11.101 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.264 -9.877 9.471 1.00 1.00 H new ATOM 1715 N ILE A 116 64.715 -11.994 7.791 1.00 1.00 N ATOM 1716 CA ILE A 116 64.620 -12.534 6.443 1.00 1.00 C ATOM 1717 C ILE A 116 65.229 -13.923 6.332 1.00 1.00 C ATOM 1718 O ILE A 116 64.675 -14.812 5.701 1.00 1.00 O ATOM 1719 CB ILE A 116 65.366 -11.580 5.503 1.00 1.00 C ATOM 1720 CG1 ILE A 116 64.673 -10.214 5.506 1.00 1.00 C ATOM 1721 CG2 ILE A 116 65.363 -12.140 4.079 1.00 1.00 C ATOM 1722 CD1 ILE A 116 65.570 -9.189 4.811 1.00 1.00 C ATOM 0 H ILE A 116 65.359 -11.211 7.902 1.00 1.00 H new ATOM 0 HA ILE A 116 63.567 -12.622 6.177 1.00 1.00 H new ATOM 0 HB ILE A 116 66.395 -11.475 5.848 1.00 1.00 H new ATOM 0 HG12 ILE A 116 63.713 -10.280 4.994 1.00 1.00 H new ATOM 0 HG13 ILE A 116 64.468 -9.900 6.529 1.00 1.00 H new ATOM 0 HG21 ILE A 116 65.895 -11.456 3.418 1.00 1.00 H new ATOM 0 HG22 ILE A 116 65.857 -13.112 4.069 1.00 1.00 H new ATOM 0 HG23 ILE A 116 64.335 -12.252 3.734 1.00 1.00 H new ATOM 0 HD11 ILE A 116 65.079 -8.216 4.812 1.00 1.00 H new ATOM 0 HD12 ILE A 116 66.519 -9.117 5.342 1.00 1.00 H new ATOM 0 HD13 ILE A 116 65.752 -9.503 3.783 1.00 1.00 H new ATOM 1734 N GLU A 117 66.409 -14.072 6.896 1.00 1.00 N ATOM 1735 CA GLU A 117 67.137 -15.337 6.808 1.00 1.00 C ATOM 1736 C GLU A 117 66.223 -16.484 7.142 1.00 1.00 C ATOM 1737 O GLU A 117 65.954 -17.349 6.292 1.00 1.00 O ATOM 1738 CB GLU A 117 68.342 -15.356 7.756 1.00 1.00 C ATOM 1739 CG GLU A 117 69.458 -14.472 7.193 1.00 1.00 C ATOM 1740 CD GLU A 117 70.672 -14.538 8.110 1.00 1.00 C ATOM 1741 OE1 GLU A 117 70.542 -15.101 9.185 1.00 1.00 O ATOM 1742 OE2 GLU A 117 71.709 -14.024 7.729 1.00 1.00 O ATOM 0 H GLU A 117 66.890 -13.341 7.420 1.00 1.00 H new ATOM 0 HA GLU A 117 67.500 -15.439 5.785 1.00 1.00 H new ATOM 0 HB2 GLU A 117 68.046 -15.000 8.743 1.00 1.00 H new ATOM 0 HB3 GLU A 117 68.702 -16.377 7.881 1.00 1.00 H new ATOM 0 HG2 GLU A 117 69.728 -14.804 6.191 1.00 1.00 H new ATOM 0 HG3 GLU A 117 69.111 -13.442 7.105 1.00 1.00 H new ATOM 1749 N VAL A 118 65.760 -16.500 8.388 1.00 1.00 N ATOM 1750 CA VAL A 118 64.884 -17.553 8.822 1.00 1.00 C ATOM 1751 C VAL A 118 63.732 -17.680 7.844 1.00 1.00 C ATOM 1752 O VAL A 118 63.042 -18.698 7.829 1.00 1.00 O ATOM 1753 CB VAL A 118 64.360 -17.256 10.238 1.00 1.00 C ATOM 1754 CG1 VAL A 118 63.240 -16.215 10.176 1.00 1.00 C ATOM 1755 CG2 VAL A 118 63.821 -18.541 10.877 1.00 1.00 C ATOM 0 H VAL A 118 65.980 -15.801 9.097 1.00 1.00 H new ATOM 0 HA VAL A 118 65.432 -18.495 8.852 1.00 1.00 H new ATOM 0 HB VAL A 118 65.182 -16.868 10.840 1.00 1.00 H new ATOM 0 HG11 VAL A 118 62.876 -16.012 11.183 1.00 1.00 H new ATOM 0 HG12 VAL A 118 63.623 -15.294 9.736 1.00 1.00 H new ATOM 0 HG13 VAL A 118 62.422 -16.596 9.565 1.00 1.00 H new ATOM 0 HG21 VAL A 118 63.452 -18.322 11.879 1.00 1.00 H new ATOM 0 HG22 VAL A 118 63.007 -18.936 10.269 1.00 1.00 H new ATOM 0 HG23 VAL A 118 64.620 -19.280 10.938 1.00 1.00 H new ATOM 1765 N LEU A 119 63.534 -16.664 6.981 1.00 1.00 N ATOM 1766 CA LEU A 119 62.471 -16.768 6.001 1.00 1.00 C ATOM 1767 C LEU A 119 62.917 -17.690 4.867 1.00 1.00 C ATOM 1768 O LEU A 119 62.292 -18.731 4.657 1.00 1.00 O ATOM 1769 CB LEU A 119 62.126 -15.375 5.451 1.00 1.00 C ATOM 1770 CG LEU A 119 60.653 -15.299 5.043 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.381 -13.884 4.536 1.00 1.00 C ATOM 1772 CD2 LEU A 119 60.365 -16.315 3.929 1.00 1.00 C ATOM 0 H LEU A 119 64.078 -15.802 6.951 1.00 1.00 H new ATOM 0 HA LEU A 119 61.581 -17.185 6.472 1.00 1.00 H new ATOM 0 HB2 LEU A 119 62.338 -14.618 6.207 1.00 1.00 H new ATOM 0 HB3 LEU A 119 62.758 -15.152 4.591 1.00 1.00 H new ATOM 0 HG LEU A 119 60.011 -15.530 5.893 1.00 1.00 H new ATOM 0 HD11 LEU A 119 59.336 -13.799 4.237 1.00 1.00 H new ATOM 0 HD12 LEU A 119 60.591 -13.167 5.329 1.00 1.00 H new ATOM 0 HD13 LEU A 119 61.022 -13.675 3.679 1.00 1.00 H new ATOM 0 HD21 LEU A 119 59.315 -16.255 3.644 1.00 1.00 H new ATOM 0 HD22 LEU A 119 60.989 -16.093 3.063 1.00 1.00 H new ATOM 0 HD23 LEU A 119 60.587 -17.320 4.287 1.00 1.00 H new ATOM 1784 N GLY A 120 64.002 -17.356 4.127 1.00 1.00 N ATOM 1785 CA GLY A 120 64.395 -18.278 3.058 1.00 1.00 C ATOM 1786 C GLY A 120 64.971 -19.579 3.635 1.00 1.00 C ATOM 1787 O GLY A 120 64.277 -20.593 3.731 1.00 1.00 O ATOM 0 H GLY A 120 64.576 -16.521 4.242 1.00 1.00 H new ATOM 0 HA2 GLY A 120 63.531 -18.505 2.433 1.00 1.00 H new ATOM 0 HA3 GLY A 120 65.136 -17.801 2.417 1.00 1.00 H new ATOM 1791 N THR A 121 66.243 -19.534 4.011 1.00 1.00 N ATOM 1792 CA THR A 121 66.932 -20.705 4.573 1.00 1.00 C ATOM 1793 C THR A 121 68.184 -20.256 5.350 1.00 1.00 C ATOM 1794 O THR A 121 68.733 -20.997 6.166 1.00 1.00 O ATOM 1795 CB THR A 121 67.305 -21.684 3.454 1.00 1.00 C ATOM 1796 OG1 THR A 121 66.138 -22.019 2.707 1.00 1.00 O ATOM 1797 CG2 THR A 121 67.897 -22.953 4.062 1.00 1.00 C ATOM 0 H THR A 121 66.826 -18.700 3.939 1.00 1.00 H new ATOM 0 HA THR A 121 66.263 -21.217 5.265 1.00 1.00 H new ATOM 0 HB THR A 121 68.039 -21.218 2.796 1.00 1.00 H new ATOM 0 HG1 THR A 121 65.340 -21.834 3.246 1.00 1.00 H new ATOM 0 HG21 THR A 121 68.162 -23.649 3.266 1.00 1.00 H new ATOM 0 HG22 THR A 121 68.789 -22.700 4.635 1.00 1.00 H new ATOM 0 HG23 THR A 121 67.163 -23.418 4.720 1.00 1.00 H new ATOM 1805 N GLY A 122 68.601 -19.025 5.062 1.00 1.00 N ATOM 1806 CA GLY A 122 69.772 -18.360 5.666 1.00 1.00 C ATOM 1807 C GLY A 122 70.918 -18.200 4.663 1.00 1.00 C ATOM 1808 O GLY A 122 71.636 -17.204 4.728 1.00 1.00 O ATOM 0 H GLY A 122 68.123 -18.437 4.380 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.479 -17.380 6.042 1.00 1.00 H new ATOM 0 HA3 GLY A 122 70.117 -18.940 6.522 1.00 1.00 H new ATOM 1812 N THR A 123 71.129 -19.175 3.778 1.00 1.00 N ATOM 1813 CA THR A 123 72.230 -19.101 2.803 1.00 1.00 C ATOM 1814 C THR A 123 72.555 -17.666 2.389 1.00 1.00 C ATOM 1815 O THR A 123 71.957 -17.119 1.463 1.00 1.00 O ATOM 1816 CB THR A 123 71.828 -19.878 1.540 1.00 1.00 C ATOM 1817 OG1 THR A 123 72.828 -19.704 0.546 1.00 1.00 O ATOM 1818 CG2 THR A 123 70.475 -19.356 1.000 1.00 1.00 C ATOM 0 H THR A 123 70.561 -20.020 3.712 1.00 1.00 H new ATOM 0 HA THR A 123 73.113 -19.525 3.281 1.00 1.00 H new ATOM 0 HB THR A 123 71.728 -20.935 1.788 1.00 1.00 H new ATOM 0 HG1 THR A 123 72.576 -20.199 -0.261 1.00 1.00 H new ATOM 0 HG21 THR A 123 70.201 -19.914 0.105 1.00 1.00 H new ATOM 0 HG22 THR A 123 69.705 -19.488 1.760 1.00 1.00 H new ATOM 0 HG23 THR A 123 70.565 -18.298 0.754 1.00 1.00 H new ATOM 1826 N ASP A 124 73.538 -17.072 3.059 1.00 1.00 N ATOM 1827 CA ASP A 124 73.971 -15.719 2.748 1.00 1.00 C ATOM 1828 C ASP A 124 75.486 -15.639 2.931 1.00 1.00 C ATOM 1829 O ASP A 124 76.051 -16.306 3.795 1.00 1.00 O ATOM 1830 CB ASP A 124 73.249 -14.724 3.657 1.00 1.00 C ATOM 1831 CG ASP A 124 71.774 -14.671 3.272 1.00 1.00 C ATOM 1832 OD1 ASP A 124 71.489 -14.707 2.084 1.00 1.00 O ATOM 1833 OD2 ASP A 124 70.950 -14.605 4.167 1.00 1.00 O ATOM 0 H ASP A 124 74.050 -17.511 3.824 1.00 1.00 H new ATOM 0 HA ASP A 124 73.725 -15.466 1.717 1.00 1.00 H new ATOM 0 HB2 ASP A 124 73.354 -15.023 4.700 1.00 1.00 H new ATOM 0 HB3 ASP A 124 73.698 -13.735 3.562 1.00 1.00 H new ATOM 1838 N TYR A 125 76.153 -14.855 2.088 1.00 1.00 N ATOM 1839 CA TYR A 125 77.604 -14.728 2.150 1.00 1.00 C ATOM 1840 C TYR A 125 78.039 -13.357 1.633 1.00 1.00 C ATOM 1841 O TYR A 125 77.415 -12.797 0.733 1.00 1.00 O ATOM 1842 CB TYR A 125 78.248 -15.854 1.292 1.00 1.00 C ATOM 1843 CG TYR A 125 79.064 -15.260 0.152 1.00 1.00 C ATOM 1844 CD1 TYR A 125 78.438 -14.903 -1.051 1.00 1.00 C ATOM 1845 CD2 TYR A 125 80.432 -15.026 0.324 1.00 1.00 C ATOM 1846 CE1 TYR A 125 79.185 -14.318 -2.082 1.00 1.00 C ATOM 1847 CE2 TYR A 125 81.177 -14.435 -0.704 1.00 1.00 C ATOM 1848 CZ TYR A 125 80.554 -14.083 -1.906 1.00 1.00 C ATOM 1849 OH TYR A 125 81.287 -13.496 -2.919 1.00 1.00 O ATOM 0 H TYR A 125 75.711 -14.299 1.355 1.00 1.00 H new ATOM 0 HA TYR A 125 77.933 -14.823 3.185 1.00 1.00 H new ATOM 0 HB2 TYR A 125 78.888 -16.475 1.919 1.00 1.00 H new ATOM 0 HB3 TYR A 125 77.470 -16.502 0.890 1.00 1.00 H new ATOM 0 HD1 TYR A 125 77.381 -15.079 -1.183 1.00 1.00 H new ATOM 0 HD2 TYR A 125 80.914 -15.301 1.250 1.00 1.00 H new ATOM 0 HE1 TYR A 125 78.705 -14.049 -3.011 1.00 1.00 H new ATOM 0 HE2 TYR A 125 82.233 -14.251 -0.569 1.00 1.00 H new ATOM 0 HH TYR A 125 81.424 -12.547 -2.716 1.00 1.00 H new ATOM 1859 N ARG A 126 79.136 -12.848 2.177 1.00 1.00 N ATOM 1860 CA ARG A 126 79.671 -11.567 1.731 1.00 1.00 C ATOM 1861 C ARG A 126 81.192 -11.547 1.901 1.00 1.00 C ATOM 1862 O ARG A 126 81.741 -12.248 2.752 1.00 1.00 O ATOM 1863 CB ARG A 126 78.996 -10.416 2.508 1.00 1.00 C ATOM 1864 CG ARG A 126 78.530 -9.301 1.542 1.00 1.00 C ATOM 1865 CD ARG A 126 77.187 -9.667 0.882 1.00 1.00 C ATOM 1866 NE ARG A 126 77.393 -10.503 -0.297 1.00 1.00 N ATOM 1867 CZ ARG A 126 76.358 -10.925 -1.015 1.00 1.00 C ATOM 1868 NH1 ARG A 126 75.145 -10.618 -0.643 1.00 1.00 N ATOM 1869 NH2 ARG A 126 76.550 -11.647 -2.088 1.00 1.00 N ATOM 0 H ARG A 126 79.670 -13.297 2.921 1.00 1.00 H new ATOM 0 HA ARG A 126 79.453 -11.429 0.672 1.00 1.00 H new ATOM 0 HB2 ARG A 126 78.142 -10.800 3.067 1.00 1.00 H new ATOM 0 HB3 ARG A 126 79.694 -10.004 3.236 1.00 1.00 H new ATOM 0 HG2 ARG A 126 78.428 -8.363 2.087 1.00 1.00 H new ATOM 0 HG3 ARG A 126 79.286 -9.142 0.773 1.00 1.00 H new ATOM 0 HD2 ARG A 126 76.557 -10.193 1.599 1.00 1.00 H new ATOM 0 HD3 ARG A 126 76.657 -8.757 0.599 1.00 1.00 H new ATOM 0 HE ARG A 126 78.340 -10.765 -0.572 1.00 1.00 H new ATOM 0 HH11 ARG A 126 74.995 -10.057 0.195 1.00 1.00 H new ATOM 0 HH12 ARG A 126 74.347 -10.939 -1.191 1.00 1.00 H new ATOM 0 HH21 ARG A 126 77.498 -11.889 -2.377 1.00 1.00 H new ATOM 0 HH22 ARG A 126 75.752 -11.969 -2.636 1.00 1.00 H new ATOM 1883 N PHE A 127 81.867 -10.769 1.061 1.00 1.00 N ATOM 1884 CA PHE A 127 83.324 -10.677 1.089 1.00 1.00 C ATOM 1885 C PHE A 127 83.792 -9.427 0.351 1.00 1.00 C ATOM 1886 O PHE A 127 84.927 -9.420 -0.096 1.00 1.00 O ATOM 1887 CB PHE A 127 83.944 -11.924 0.435 1.00 1.00 C ATOM 1888 CG PHE A 127 83.846 -11.863 -1.091 1.00 1.00 C ATOM 1889 CD1 PHE A 127 82.765 -11.228 -1.735 1.00 1.00 C ATOM 1890 CD2 PHE A 127 84.856 -12.448 -1.868 1.00 1.00 C ATOM 1891 CE1 PHE A 127 82.700 -11.184 -3.130 1.00 1.00 C ATOM 1892 CE2 PHE A 127 84.787 -12.402 -3.266 1.00 1.00 C ATOM 1893 CZ PHE A 127 83.711 -11.771 -3.896 1.00 1.00 C ATOM 1894 OXT PHE A 127 83.003 -8.507 0.220 1.00 1.00 O ATOM 0 H PHE A 127 81.425 -10.189 0.348 1.00 1.00 H new ATOM 0 HA PHE A 127 83.647 -10.617 2.128 1.00 1.00 H new ATOM 0 HB2 PHE A 127 84.990 -12.010 0.731 1.00 1.00 H new ATOM 0 HB3 PHE A 127 83.436 -12.817 0.798 1.00 1.00 H new ATOM 0 HD1 PHE A 127 81.982 -10.773 -1.147 1.00 1.00 H new ATOM 0 HD2 PHE A 127 85.690 -12.936 -1.386 1.00 1.00 H new ATOM 0 HE1 PHE A 127 81.868 -10.696 -3.617 1.00 1.00 H new ATOM 0 HE2 PHE A 127 85.568 -12.855 -3.859 1.00 1.00 H new ATOM 0 HZ PHE A 127 83.661 -11.737 -4.974 1.00 1.00 H new