USER MOD reduce.3.24.130724 H: found=0, std=0, add=1006, rem=0, adj=14 USER MOD reduce.3.24.130724 removed 1000 hydrogens (45 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 72 HIS : no HD1:sc= -12.2! C(o=-17!,f=-18!) USER MOD Set 1.2: A 123 THR OG1 : rot 6:sc= -4.74! USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 160:sc= -0.632 (180deg=-1.62!) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot -150:sc= 0.0369 USER MOD Single : A 10 SER OG : rot 125:sc= 0.448 USER MOD Single : A 28 LYS NZ :NH3+ -163:sc=-0.00246 (180deg=-0.159) USER MOD Single : A 38 HIS :FLIP no HE2:sc= -0.142 F(o=-0.87,f=-0.14) USER MOD Single : A 39 THR OG1 : rot 180:sc= 0.268 USER MOD Single : A 49 ASN : amide:sc= -0.82 X(o=-0.82,f=-0.42) USER MOD Single : A 54 GLN : amide:sc= -2.51! C(o=-2.5!,f=-3.9!) 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 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.672 X(o=-0.67,f=-0.95) USER MOD Single : A 92 HIS : no HD1:sc= -6.23! C(o=-6.2!,f=-7.5!) USER MOD Single : A 99 GLN : amide:sc= -1.44 X(o=-1.4,f=-0.98) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot -36:sc= 0.656 USER MOD Single : A 111 ASN : amide:sc= -0.232 X(o=-0.23,f=0) USER MOD Single : A 113 ASN :FLIP amide:sc= -4.43! C(o=-8.2!,f=-4.4!) USER MOD Single : A 121 THR OG1 : rot 9:sc= 0.889! USER MOD Single : A 125 TYR OH : rot 34:sc= -0.429 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 76.956 24.325 -22.526 1.00 1.00 N ATOM 2 CA MET A 1 77.610 23.047 -22.937 1.00 1.00 C ATOM 3 C MET A 1 76.595 21.904 -22.834 1.00 1.00 C ATOM 4 O MET A 1 75.506 22.078 -22.287 1.00 1.00 O ATOM 5 CB MET A 1 78.852 22.762 -22.048 1.00 1.00 C ATOM 6 CG MET A 1 78.673 23.302 -20.607 1.00 1.00 C ATOM 7 SD MET A 1 80.275 23.860 -19.963 1.00 1.00 S ATOM 8 CE MET A 1 80.206 25.559 -20.588 1.00 1.00 C ATOM 0 H1 MET A 1 77.685 25.020 -22.267 1.00 1.00 H new ATOM 0 H2 MET A 1 76.390 24.695 -23.316 1.00 1.00 H new ATOM 0 H3 MET A 1 76.338 24.151 -21.708 1.00 1.00 H new ATOM 0 HA MET A 1 77.950 23.130 -23.969 1.00 1.00 H new ATOM 0 HB2 MET A 1 79.033 21.688 -22.012 1.00 1.00 H new ATOM 0 HB3 MET A 1 79.733 23.219 -22.499 1.00 1.00 H new ATOM 0 HG2 MET A 1 77.961 24.127 -20.603 1.00 1.00 H new ATOM 0 HG3 MET A 1 78.263 22.523 -19.964 1.00 1.00 H new ATOM 0 HE1 MET A 1 81.113 26.090 -20.298 1.00 1.00 H new ATOM 0 HE2 MET A 1 80.126 25.544 -21.675 1.00 1.00 H new ATOM 0 HE3 MET A 1 79.338 26.066 -20.167 1.00 1.00 H new ATOM 18 N SER A 2 76.953 20.740 -23.377 1.00 1.00 N ATOM 19 CA SER A 2 76.068 19.575 -23.365 1.00 1.00 C ATOM 20 C SER A 2 76.166 18.810 -22.042 1.00 1.00 C ATOM 21 O SER A 2 75.553 17.758 -21.897 1.00 1.00 O ATOM 22 CB SER A 2 76.432 18.637 -24.516 1.00 1.00 C ATOM 23 OG SER A 2 77.648 17.971 -24.206 1.00 1.00 O ATOM 0 H SER A 2 77.852 20.579 -23.832 1.00 1.00 H new ATOM 0 HA SER A 2 75.045 19.932 -23.481 1.00 1.00 H new ATOM 0 HB2 SER A 2 75.635 17.910 -24.675 1.00 1.00 H new ATOM 0 HB3 SER A 2 76.538 19.202 -25.442 1.00 1.00 H new ATOM 0 HG SER A 2 77.886 17.366 -24.940 1.00 1.00 H new ATOM 29 N ASP A 3 76.924 19.369 -21.092 1.00 1.00 N ATOM 30 CA ASP A 3 77.101 18.768 -19.755 1.00 1.00 C ATOM 31 C ASP A 3 78.432 19.191 -19.130 1.00 1.00 C ATOM 32 O ASP A 3 79.491 19.041 -19.738 1.00 1.00 O ATOM 33 CB ASP A 3 77.048 17.217 -19.819 1.00 1.00 C ATOM 34 CG ASP A 3 75.621 16.688 -19.623 1.00 1.00 C ATOM 35 OD1 ASP A 3 74.734 17.486 -19.374 1.00 1.00 O ATOM 36 OD2 ASP A 3 75.440 15.488 -19.745 1.00 1.00 O ATOM 0 H ASP A 3 77.431 20.245 -21.222 1.00 1.00 H new ATOM 0 HA ASP A 3 76.279 19.130 -19.137 1.00 1.00 H new ATOM 0 HB2 ASP A 3 77.432 16.879 -20.782 1.00 1.00 H new ATOM 0 HB3 ASP A 3 77.699 16.799 -19.052 1.00 1.00 H new ATOM 41 N PHE A 4 78.365 19.712 -17.902 1.00 1.00 N ATOM 42 CA PHE A 4 79.571 20.138 -17.194 1.00 1.00 C ATOM 43 C PHE A 4 79.349 20.129 -15.682 1.00 1.00 C ATOM 44 O PHE A 4 78.226 20.310 -15.210 1.00 1.00 O ATOM 45 CB PHE A 4 79.976 21.534 -17.653 1.00 1.00 C ATOM 46 CG PHE A 4 81.334 21.883 -17.096 1.00 1.00 C ATOM 47 CD1 PHE A 4 82.480 21.346 -17.687 1.00 1.00 C ATOM 48 CD2 PHE A 4 81.450 22.751 -16.001 1.00 1.00 C ATOM 49 CE1 PHE A 4 83.745 21.673 -17.190 1.00 1.00 C ATOM 50 CE2 PHE A 4 82.718 23.076 -15.501 1.00 1.00 C ATOM 51 CZ PHE A 4 83.865 22.538 -16.096 1.00 1.00 C ATOM 0 H PHE A 4 77.497 19.847 -17.383 1.00 1.00 H new ATOM 0 HA PHE A 4 80.371 19.435 -17.426 1.00 1.00 H new ATOM 0 HB2 PHE A 4 79.998 21.576 -18.742 1.00 1.00 H new ATOM 0 HB3 PHE A 4 79.238 22.264 -17.320 1.00 1.00 H new ATOM 0 HD1 PHE A 4 82.389 20.677 -18.530 1.00 1.00 H new ATOM 0 HD2 PHE A 4 80.565 23.168 -15.544 1.00 1.00 H new ATOM 0 HE1 PHE A 4 84.630 21.258 -17.650 1.00 1.00 H new ATOM 0 HE2 PHE A 4 82.810 23.742 -14.656 1.00 1.00 H new ATOM 0 HZ PHE A 4 84.842 22.790 -15.711 1.00 1.00 H new ATOM 61 N ASP A 5 80.426 19.908 -14.928 1.00 1.00 N ATOM 62 CA ASP A 5 80.346 19.868 -13.468 1.00 1.00 C ATOM 63 C ASP A 5 81.700 20.252 -12.853 1.00 1.00 C ATOM 64 O ASP A 5 82.747 19.993 -13.446 1.00 1.00 O ATOM 65 CB ASP A 5 79.928 18.460 -13.026 1.00 1.00 C ATOM 66 CG ASP A 5 80.672 17.408 -13.847 1.00 1.00 C ATOM 67 OD1 ASP A 5 81.780 17.687 -14.274 1.00 1.00 O ATOM 68 OD2 ASP A 5 80.120 16.334 -14.035 1.00 1.00 O ATOM 0 H ASP A 5 81.362 19.754 -15.303 1.00 1.00 H new ATOM 0 HA ASP A 5 79.602 20.586 -13.121 1.00 1.00 H new ATOM 0 HB2 ASP A 5 80.144 18.324 -11.966 1.00 1.00 H new ATOM 0 HB3 ASP A 5 78.852 18.336 -13.151 1.00 1.00 H new ATOM 73 N THR A 6 81.683 20.878 -11.669 1.00 1.00 N ATOM 74 CA THR A 6 82.936 21.293 -11.016 1.00 1.00 C ATOM 75 C THR A 6 83.580 20.101 -10.292 1.00 1.00 C ATOM 76 O THR A 6 83.000 19.069 -10.194 1.00 1.00 O ATOM 77 CB THR A 6 82.679 22.483 -10.049 1.00 1.00 C ATOM 78 OG1 THR A 6 81.325 22.896 -10.162 1.00 1.00 O ATOM 79 CG2 THR A 6 83.592 23.674 -10.390 1.00 1.00 C ATOM 0 H THR A 6 80.835 21.106 -11.150 1.00 1.00 H new ATOM 0 HA THR A 6 83.636 21.636 -11.778 1.00 1.00 H new ATOM 0 HB THR A 6 82.894 22.153 -9.032 1.00 1.00 H new ATOM 0 HG1 THR A 6 81.258 23.855 -9.970 1.00 1.00 H new ATOM 0 HG21 THR A 6 83.393 24.494 -9.700 1.00 1.00 H new ATOM 0 HG22 THR A 6 84.635 23.370 -10.302 1.00 1.00 H new ATOM 0 HG23 THR A 6 83.395 24.003 -11.410 1.00 1.00 H new ATOM 87 N GLU A 7 84.797 20.270 -9.828 1.00 1.00 N ATOM 88 CA GLU A 7 85.523 19.175 -9.156 1.00 1.00 C ATOM 89 C GLU A 7 84.725 18.655 -7.968 1.00 1.00 C ATOM 90 O GLU A 7 84.443 17.465 -7.849 1.00 1.00 O ATOM 91 CB GLU A 7 86.874 19.684 -8.654 1.00 1.00 C ATOM 92 CG GLU A 7 87.700 18.511 -8.131 1.00 1.00 C ATOM 93 CD GLU A 7 89.095 18.999 -7.765 1.00 1.00 C ATOM 94 OE1 GLU A 7 89.186 20.000 -7.073 1.00 1.00 O ATOM 95 OE2 GLU A 7 90.050 18.370 -8.187 1.00 1.00 O ATOM 0 H GLU A 7 85.318 21.145 -9.895 1.00 1.00 H new ATOM 0 HA GLU A 7 85.668 18.368 -9.874 1.00 1.00 H new ATOM 0 HB2 GLU A 7 87.407 20.187 -9.461 1.00 1.00 H new ATOM 0 HB3 GLU A 7 86.726 20.419 -7.863 1.00 1.00 H new ATOM 0 HG2 GLU A 7 87.216 18.071 -7.259 1.00 1.00 H new ATOM 0 HG3 GLU A 7 87.763 17.730 -8.888 1.00 1.00 H new ATOM 102 N ARG A 8 84.424 19.567 -7.073 1.00 1.00 N ATOM 103 CA ARG A 8 83.695 19.184 -5.863 1.00 1.00 C ATOM 104 C ARG A 8 82.428 18.455 -6.317 1.00 1.00 C ATOM 105 O ARG A 8 82.162 17.317 -5.928 1.00 1.00 O ATOM 106 CB ARG A 8 83.338 20.423 -5.007 1.00 1.00 C ATOM 107 CG ARG A 8 83.456 21.700 -5.854 1.00 1.00 C ATOM 108 CD ARG A 8 82.713 22.877 -5.182 1.00 1.00 C ATOM 109 NE ARG A 8 81.487 23.179 -5.918 1.00 1.00 N ATOM 110 CZ ARG A 8 81.490 24.009 -6.961 1.00 1.00 C ATOM 111 NH1 ARG A 8 82.603 24.571 -7.352 1.00 1.00 N ATOM 112 NH2 ARG A 8 80.380 24.256 -7.602 1.00 1.00 N ATOM 0 H ARG A 8 84.660 20.557 -7.145 1.00 1.00 H new ATOM 0 HA ARG A 8 84.311 18.540 -5.236 1.00 1.00 H new ATOM 0 HB2 ARG A 8 82.324 20.327 -4.619 1.00 1.00 H new ATOM 0 HB3 ARG A 8 84.004 20.485 -4.147 1.00 1.00 H new ATOM 0 HG2 ARG A 8 84.507 21.957 -5.988 1.00 1.00 H new ATOM 0 HG3 ARG A 8 83.042 21.523 -6.847 1.00 1.00 H new ATOM 0 HD2 ARG A 8 82.474 22.625 -4.149 1.00 1.00 H new ATOM 0 HD3 ARG A 8 83.357 23.756 -5.155 1.00 1.00 H new ATOM 0 HE ARG A 8 80.611 22.746 -5.627 1.00 1.00 H new ATOM 0 HH11 ARG A 8 83.474 24.375 -6.859 1.00 1.00 H new ATOM 0 HH12 ARG A 8 82.601 25.205 -8.151 1.00 1.00 H new ATOM 0 HH21 ARG A 8 79.510 23.814 -7.305 1.00 1.00 H new ATOM 0 HH22 ARG A 8 80.382 24.891 -8.400 1.00 1.00 H new ATOM 126 N VAL A 9 81.670 19.147 -7.152 1.00 1.00 N ATOM 127 CA VAL A 9 80.439 18.577 -7.672 1.00 1.00 C ATOM 128 C VAL A 9 80.767 17.380 -8.584 1.00 1.00 C ATOM 129 O VAL A 9 80.228 16.334 -8.416 1.00 1.00 O ATOM 130 CB VAL A 9 79.586 19.639 -8.416 1.00 1.00 C ATOM 131 CG1 VAL A 9 78.094 19.389 -8.148 1.00 1.00 C ATOM 132 CG2 VAL A 9 79.941 21.041 -7.914 1.00 1.00 C ATOM 0 H VAL A 9 81.881 20.090 -7.480 1.00 1.00 H new ATOM 0 HA VAL A 9 79.839 18.225 -6.833 1.00 1.00 H new ATOM 0 HB VAL A 9 79.792 19.564 -9.484 1.00 1.00 H new ATOM 0 HG11 VAL A 9 77.500 20.137 -8.673 1.00 1.00 H new ATOM 0 HG12 VAL A 9 77.822 18.395 -8.503 1.00 1.00 H new ATOM 0 HG13 VAL A 9 77.900 19.457 -7.078 1.00 1.00 H new ATOM 0 HG21 VAL A 9 79.338 21.780 -8.441 1.00 1.00 H new ATOM 0 HG22 VAL A 9 79.741 21.106 -6.844 1.00 1.00 H new ATOM 0 HG23 VAL A 9 80.997 21.237 -8.098 1.00 1.00 H new ATOM 142 N SER A 10 81.645 17.565 -9.550 1.00 1.00 N ATOM 143 CA SER A 10 81.983 16.457 -10.474 1.00 1.00 C ATOM 144 C SER A 10 82.696 15.309 -9.745 1.00 1.00 C ATOM 145 O SER A 10 82.196 14.192 -9.706 1.00 1.00 O ATOM 146 CB SER A 10 82.924 16.942 -11.592 1.00 1.00 C ATOM 147 OG SER A 10 83.087 15.916 -12.559 1.00 1.00 O ATOM 0 H SER A 10 82.136 18.441 -9.728 1.00 1.00 H new ATOM 0 HA SER A 10 81.038 16.106 -10.889 1.00 1.00 H new ATOM 0 HB2 SER A 10 82.515 17.836 -12.062 1.00 1.00 H new ATOM 0 HB3 SER A 10 83.892 17.217 -11.172 1.00 1.00 H new ATOM 0 HG SER A 10 82.846 16.260 -13.445 1.00 1.00 H new ATOM 153 N ARG A 11 83.895 15.583 -9.233 1.00 1.00 N ATOM 154 CA ARG A 11 84.695 14.540 -8.576 1.00 1.00 C ATOM 155 C ARG A 11 84.038 14.026 -7.291 1.00 1.00 C ATOM 156 O ARG A 11 83.850 12.835 -7.120 1.00 1.00 O ATOM 157 CB ARG A 11 86.086 15.096 -8.236 1.00 1.00 C ATOM 158 CG ARG A 11 87.080 13.934 -7.903 1.00 1.00 C ATOM 159 CD ARG A 11 87.793 14.140 -6.537 1.00 1.00 C ATOM 160 NE ARG A 11 89.196 14.457 -6.756 1.00 1.00 N ATOM 161 CZ ARG A 11 90.046 13.520 -7.156 1.00 1.00 C ATOM 162 NH1 ARG A 11 89.617 12.309 -7.381 1.00 1.00 N ATOM 163 NH2 ARG A 11 91.306 13.805 -7.331 1.00 1.00 N ATOM 0 H ARG A 11 84.333 16.504 -9.257 1.00 1.00 H new ATOM 0 HA ARG A 11 84.772 13.704 -9.272 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.466 15.677 -9.076 1.00 1.00 H new ATOM 0 HB3 ARG A 11 86.014 15.775 -7.386 1.00 1.00 H new ATOM 0 HG2 ARG A 11 86.538 12.988 -7.888 1.00 1.00 H new ATOM 0 HG3 ARG A 11 87.827 13.861 -8.693 1.00 1.00 H new ATOM 0 HD2 ARG A 11 87.311 14.945 -5.983 1.00 1.00 H new ATOM 0 HD3 ARG A 11 87.705 13.238 -5.931 1.00 1.00 H new ATOM 0 HE ARG A 11 89.529 15.408 -6.601 1.00 1.00 H new ATOM 0 HH11 ARG A 11 88.631 12.085 -7.249 1.00 1.00 H new ATOM 0 HH12 ARG A 11 90.268 11.586 -7.689 1.00 1.00 H new ATOM 0 HH21 ARG A 11 91.643 14.752 -7.160 1.00 1.00 H new ATOM 0 HH22 ARG A 11 91.955 13.081 -7.639 1.00 1.00 H new ATOM 177 N ALA A 12 83.780 14.918 -6.348 1.00 1.00 N ATOM 178 CA ALA A 12 83.220 14.431 -5.072 1.00 1.00 C ATOM 179 C ALA A 12 81.973 13.617 -5.402 1.00 1.00 C ATOM 180 O ALA A 12 81.804 12.492 -4.949 1.00 1.00 O ATOM 181 CB ALA A 12 82.892 15.547 -4.073 1.00 1.00 C ATOM 0 H ALA A 12 83.933 15.924 -6.418 1.00 1.00 H new ATOM 0 HA ALA A 12 83.976 13.823 -4.574 1.00 1.00 H new ATOM 0 HB1 ALA A 12 82.485 15.111 -3.161 1.00 1.00 H new ATOM 0 HB2 ALA A 12 83.800 16.102 -3.836 1.00 1.00 H new ATOM 0 HB3 ALA A 12 82.157 16.223 -4.511 1.00 1.00 H new ATOM 187 N VAL A 13 81.114 14.212 -6.214 1.00 1.00 N ATOM 188 CA VAL A 13 79.914 13.499 -6.610 1.00 1.00 C ATOM 189 C VAL A 13 80.346 12.266 -7.375 1.00 1.00 C ATOM 190 O VAL A 13 79.893 11.196 -7.087 1.00 1.00 O ATOM 191 CB VAL A 13 78.975 14.310 -7.493 1.00 1.00 C ATOM 192 CG1 VAL A 13 77.757 13.465 -7.882 1.00 1.00 C ATOM 193 CG2 VAL A 13 78.513 15.559 -6.735 1.00 1.00 C ATOM 0 H VAL A 13 81.218 15.151 -6.599 1.00 1.00 H new ATOM 0 HA VAL A 13 79.359 13.265 -5.701 1.00 1.00 H new ATOM 0 HB VAL A 13 79.504 14.607 -8.399 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.092 14.054 -8.513 1.00 1.00 H new ATOM 0 HG12 VAL A 13 78.087 12.581 -8.428 1.00 1.00 H new ATOM 0 HG13 VAL A 13 77.225 13.158 -6.982 1.00 1.00 H new ATOM 0 HG21 VAL A 13 77.841 16.140 -7.366 1.00 1.00 H new ATOM 0 HG22 VAL A 13 77.990 15.261 -5.826 1.00 1.00 H new ATOM 0 HG23 VAL A 13 79.379 16.166 -6.472 1.00 1.00 H new ATOM 203 N ALA A 14 81.220 12.408 -8.364 1.00 1.00 N ATOM 204 CA ALA A 14 81.603 11.207 -9.107 1.00 1.00 C ATOM 205 C ALA A 14 82.148 10.184 -8.123 1.00 1.00 C ATOM 206 O ALA A 14 81.621 9.103 -8.017 1.00 1.00 O ATOM 207 CB ALA A 14 82.651 11.488 -10.194 1.00 1.00 C ATOM 0 H ALA A 14 81.655 13.282 -8.660 1.00 1.00 H new ATOM 0 HA ALA A 14 80.716 10.830 -9.616 1.00 1.00 H new ATOM 0 HB1 ALA A 14 82.896 10.561 -10.712 1.00 1.00 H new ATOM 0 HB2 ALA A 14 82.250 12.207 -10.908 1.00 1.00 H new ATOM 0 HB3 ALA A 14 83.551 11.896 -9.735 1.00 1.00 H new ATOM 213 N ALA A 15 83.213 10.552 -7.432 1.00 1.00 N ATOM 214 CA ALA A 15 83.840 9.634 -6.470 1.00 1.00 C ATOM 215 C ALA A 15 82.784 9.125 -5.474 1.00 1.00 C ATOM 216 O ALA A 15 82.627 7.933 -5.282 1.00 1.00 O ATOM 217 CB ALA A 15 84.977 10.326 -5.710 1.00 1.00 C ATOM 0 H ALA A 15 83.663 11.464 -7.510 1.00 1.00 H new ATOM 0 HA ALA A 15 84.259 8.793 -7.022 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.423 9.624 -5.005 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.736 10.662 -6.417 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.582 11.184 -5.167 1.00 1.00 H new ATOM 223 N ALA A 16 82.085 10.054 -4.846 1.00 1.00 N ATOM 224 CA ALA A 16 81.053 9.681 -3.862 1.00 1.00 C ATOM 225 C ALA A 16 79.927 8.898 -4.562 1.00 1.00 C ATOM 226 O ALA A 16 79.600 7.772 -4.196 1.00 1.00 O ATOM 227 CB ALA A 16 80.460 10.940 -3.213 1.00 1.00 C ATOM 0 H ALA A 16 82.200 11.058 -4.987 1.00 1.00 H new ATOM 0 HA ALA A 16 81.512 9.060 -3.093 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.699 10.652 -2.488 1.00 1.00 H new ATOM 0 HB2 ALA A 16 81.250 11.496 -2.708 1.00 1.00 H new ATOM 0 HB3 ALA A 16 80.009 11.568 -3.982 1.00 1.00 H new ATOM 233 N LEU A 17 79.340 9.552 -5.556 1.00 1.00 N ATOM 234 CA LEU A 17 78.220 8.953 -6.310 1.00 1.00 C ATOM 235 C LEU A 17 78.669 7.609 -6.862 1.00 1.00 C ATOM 236 O LEU A 17 78.023 6.596 -6.637 1.00 1.00 O ATOM 237 CB LEU A 17 77.759 9.858 -7.466 1.00 1.00 C ATOM 238 CG LEU A 17 76.521 9.262 -8.199 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.548 10.387 -8.580 1.00 1.00 C ATOM 240 CD2 LEU A 17 76.977 8.574 -9.495 1.00 1.00 C ATOM 0 H LEU A 17 79.608 10.486 -5.865 1.00 1.00 H new ATOM 0 HA LEU A 17 77.375 8.830 -5.633 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.513 10.847 -7.079 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.576 9.988 -8.176 1.00 1.00 H new ATOM 0 HG LEU A 17 76.032 8.549 -7.536 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.684 9.963 -9.092 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.218 10.903 -7.679 1.00 1.00 H new ATOM 0 HD13 LEU A 17 76.050 11.094 -9.240 1.00 1.00 H new ATOM 0 HD21 LEU A 17 76.111 8.156 -10.009 1.00 1.00 H new ATOM 0 HD22 LEU A 17 77.466 9.303 -10.141 1.00 1.00 H new ATOM 0 HD23 LEU A 17 77.677 7.774 -9.255 1.00 1.00 H new ATOM 252 N VAL A 18 79.772 7.600 -7.595 1.00 1.00 N ATOM 253 CA VAL A 18 80.252 6.339 -8.148 1.00 1.00 C ATOM 254 C VAL A 18 80.762 5.446 -7.002 1.00 1.00 C ATOM 255 O VAL A 18 80.304 4.315 -6.833 1.00 1.00 O ATOM 256 CB VAL A 18 81.328 6.567 -9.260 1.00 1.00 C ATOM 257 CG1 VAL A 18 80.917 7.764 -10.179 1.00 1.00 C ATOM 258 CG2 VAL A 18 82.743 6.814 -8.670 1.00 1.00 C ATOM 0 H VAL A 18 80.336 8.420 -7.817 1.00 1.00 H new ATOM 0 HA VAL A 18 79.427 5.824 -8.641 1.00 1.00 H new ATOM 0 HB VAL A 18 81.374 5.652 -9.851 1.00 1.00 H new ATOM 0 HG11 VAL A 18 81.676 7.910 -10.948 1.00 1.00 H new ATOM 0 HG12 VAL A 18 79.959 7.548 -10.652 1.00 1.00 H new ATOM 0 HG13 VAL A 18 80.829 8.670 -9.579 1.00 1.00 H new ATOM 0 HG21 VAL A 18 83.454 6.967 -9.482 1.00 1.00 H new ATOM 0 HG22 VAL A 18 82.723 7.699 -8.034 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.047 5.950 -8.079 1.00 1.00 H new ATOM 268 N GLY A 19 81.729 5.959 -6.240 1.00 1.00 N ATOM 269 CA GLY A 19 82.336 5.218 -5.141 1.00 1.00 C ATOM 270 C GLY A 19 81.293 4.769 -4.141 1.00 1.00 C ATOM 271 O GLY A 19 80.114 4.723 -4.450 1.00 1.00 O ATOM 0 H GLY A 19 82.110 6.896 -6.369 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.865 4.349 -5.533 1.00 1.00 H new ATOM 0 HA3 GLY A 19 83.076 5.844 -4.642 1.00 1.00 H new ATOM 275 N PRO A 20 81.712 4.405 -2.962 1.00 1.00 N ATOM 276 CA PRO A 20 80.799 3.920 -1.912 1.00 1.00 C ATOM 277 C PRO A 20 80.111 5.041 -1.115 1.00 1.00 C ATOM 278 O PRO A 20 79.019 4.833 -0.609 1.00 1.00 O ATOM 279 CB PRO A 20 81.719 3.057 -1.039 1.00 1.00 C ATOM 280 CG PRO A 20 83.069 3.702 -1.137 1.00 1.00 C ATOM 281 CD PRO A 20 83.107 4.442 -2.490 1.00 1.00 C ATOM 0 HA PRO A 20 79.950 3.375 -2.324 1.00 1.00 H new ATOM 0 HB2 PRO A 20 81.370 3.028 -0.007 1.00 1.00 H new ATOM 0 HB3 PRO A 20 81.748 2.027 -1.395 1.00 1.00 H new ATOM 0 HG2 PRO A 20 83.228 4.396 -0.311 1.00 1.00 H new ATOM 0 HG3 PRO A 20 83.860 2.955 -1.082 1.00 1.00 H new ATOM 0 HD2 PRO A 20 83.461 5.466 -2.374 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.779 3.951 -3.194 1.00 1.00 H new ATOM 289 N GLY A 21 80.770 6.207 -0.954 1.00 1.00 N ATOM 290 CA GLY A 21 80.176 7.282 -0.129 1.00 1.00 C ATOM 291 C GLY A 21 78.853 7.814 -0.686 1.00 1.00 C ATOM 292 O GLY A 21 77.827 7.762 -0.017 1.00 1.00 O ATOM 0 H GLY A 21 81.677 6.425 -1.365 1.00 1.00 H new ATOM 0 HA2 GLY A 21 80.012 6.906 0.881 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.886 8.105 -0.051 1.00 1.00 H new ATOM 296 N GLY A 22 78.881 8.370 -1.881 1.00 1.00 N ATOM 297 CA GLY A 22 77.640 8.949 -2.418 1.00 1.00 C ATOM 298 C GLY A 22 76.595 7.862 -2.356 1.00 1.00 C ATOM 299 O GLY A 22 75.526 8.039 -1.780 1.00 1.00 O ATOM 0 H GLY A 22 79.701 8.439 -2.484 1.00 1.00 H new ATOM 0 HA2 GLY A 22 77.332 9.816 -1.833 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.784 9.290 -3.443 1.00 1.00 H new ATOM 303 N VAL A 23 76.931 6.721 -2.920 1.00 1.00 N ATOM 304 CA VAL A 23 76.012 5.598 -2.868 1.00 1.00 C ATOM 305 C VAL A 23 75.688 5.284 -1.407 1.00 1.00 C ATOM 306 O VAL A 23 74.600 4.804 -1.112 1.00 1.00 O ATOM 307 CB VAL A 23 76.543 4.336 -3.556 1.00 1.00 C ATOM 308 CG1 VAL A 23 75.396 3.331 -3.689 1.00 1.00 C ATOM 309 CG2 VAL A 23 77.051 4.675 -4.951 1.00 1.00 C ATOM 0 H VAL A 23 77.809 6.546 -3.408 1.00 1.00 H new ATOM 0 HA VAL A 23 75.118 5.896 -3.416 1.00 1.00 H new ATOM 0 HB VAL A 23 77.358 3.919 -2.964 1.00 1.00 H new ATOM 0 HG11 VAL A 23 75.759 2.427 -4.177 1.00 1.00 H new ATOM 0 HG12 VAL A 23 75.015 3.081 -2.699 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.596 3.769 -4.286 1.00 1.00 H new ATOM 0 HG21 VAL A 23 77.426 3.771 -5.431 1.00 1.00 H new ATOM 0 HG22 VAL A 23 76.236 5.090 -5.544 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.855 5.407 -4.877 1.00 1.00 H new ATOM 319 N ALA A 24 76.630 5.568 -0.484 1.00 1.00 N ATOM 320 CA ALA A 24 76.331 5.273 0.923 1.00 1.00 C ATOM 321 C ALA A 24 75.125 6.086 1.415 1.00 1.00 C ATOM 322 O ALA A 24 74.121 5.494 1.796 1.00 1.00 O ATOM 323 CB ALA A 24 77.510 5.569 1.865 1.00 1.00 C ATOM 0 H ALA A 24 77.546 5.975 -0.672 1.00 1.00 H new ATOM 0 HA ALA A 24 76.117 4.205 0.952 1.00 1.00 H new ATOM 0 HB1 ALA A 24 77.226 5.330 2.890 1.00 1.00 H new ATOM 0 HB2 ALA A 24 78.368 4.962 1.576 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.773 6.625 1.798 1.00 1.00 H new ATOM 329 N LEU A 25 75.214 7.426 1.452 1.00 1.00 N ATOM 330 CA LEU A 25 74.091 8.223 1.972 1.00 1.00 C ATOM 331 C LEU A 25 72.834 8.081 1.131 1.00 1.00 C ATOM 332 O LEU A 25 71.744 7.907 1.669 1.00 1.00 O ATOM 333 CB LEU A 25 74.474 9.714 2.029 1.00 1.00 C ATOM 334 CG LEU A 25 75.382 9.974 3.231 1.00 1.00 C ATOM 335 CD1 LEU A 25 76.702 9.208 3.053 1.00 1.00 C ATOM 336 CD2 LEU A 25 75.659 11.476 3.329 1.00 1.00 C ATOM 0 H LEU A 25 76.022 7.965 1.140 1.00 1.00 H new ATOM 0 HA LEU A 25 73.880 7.841 2.971 1.00 1.00 H new ATOM 0 HB2 LEU A 25 74.983 10.003 1.109 1.00 1.00 H new ATOM 0 HB3 LEU A 25 73.575 10.326 2.102 1.00 1.00 H new ATOM 0 HG LEU A 25 74.896 9.633 4.145 1.00 1.00 H new ATOM 0 HD11 LEU A 25 77.349 9.394 3.910 1.00 1.00 H new ATOM 0 HD12 LEU A 25 76.496 8.140 2.979 1.00 1.00 H new ATOM 0 HD13 LEU A 25 77.199 9.546 2.144 1.00 1.00 H new ATOM 0 HD21 LEU A 25 76.306 11.672 4.184 1.00 1.00 H new ATOM 0 HD22 LEU A 25 76.150 11.816 2.417 1.00 1.00 H new ATOM 0 HD23 LEU A 25 74.718 12.012 3.456 1.00 1.00 H new ATOM 348 N VAL A 26 72.970 8.204 -0.179 1.00 1.00 N ATOM 349 CA VAL A 26 71.790 8.133 -1.023 1.00 1.00 C ATOM 350 C VAL A 26 71.076 6.807 -0.811 1.00 1.00 C ATOM 351 O VAL A 26 69.897 6.781 -0.455 1.00 1.00 O ATOM 352 CB VAL A 26 72.230 8.256 -2.473 1.00 1.00 C ATOM 353 CG1 VAL A 26 71.023 8.106 -3.398 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.880 9.626 -2.671 1.00 1.00 C ATOM 0 H VAL A 26 73.853 8.349 -0.668 1.00 1.00 H new ATOM 0 HA VAL A 26 71.102 8.940 -0.769 1.00 1.00 H new ATOM 0 HB VAL A 26 72.947 7.471 -2.713 1.00 1.00 H new ATOM 0 HG11 VAL A 26 71.346 8.195 -4.435 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.565 7.129 -3.243 1.00 1.00 H new ATOM 0 HG13 VAL A 26 70.295 8.887 -3.176 1.00 1.00 H new ATOM 0 HG21 VAL A 26 73.201 9.730 -3.707 1.00 1.00 H new ATOM 0 HG22 VAL A 26 72.159 10.408 -2.435 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.744 9.718 -2.012 1.00 1.00 H new ATOM 364 N VAL A 27 71.775 5.712 -1.057 1.00 1.00 N ATOM 365 CA VAL A 27 71.168 4.402 -0.914 1.00 1.00 C ATOM 366 C VAL A 27 70.722 4.180 0.525 1.00 1.00 C ATOM 367 O VAL A 27 69.709 3.553 0.783 1.00 1.00 O ATOM 368 CB VAL A 27 72.160 3.299 -1.373 1.00 1.00 C ATOM 369 CG1 VAL A 27 73.033 2.803 -0.206 1.00 1.00 C ATOM 370 CG2 VAL A 27 71.376 2.114 -1.943 1.00 1.00 C ATOM 0 H VAL A 27 72.751 5.704 -1.353 1.00 1.00 H new ATOM 0 HA VAL A 27 70.285 4.348 -1.550 1.00 1.00 H new ATOM 0 HB VAL A 27 72.812 3.730 -2.133 1.00 1.00 H new ATOM 0 HG11 VAL A 27 73.715 2.032 -0.564 1.00 1.00 H new ATOM 0 HG12 VAL A 27 73.608 3.636 0.198 1.00 1.00 H new ATOM 0 HG13 VAL A 27 72.395 2.389 0.575 1.00 1.00 H new ATOM 0 HG21 VAL A 27 72.071 1.339 -2.266 1.00 1.00 H new ATOM 0 HG22 VAL A 27 70.715 1.712 -1.175 1.00 1.00 H new ATOM 0 HG23 VAL A 27 70.783 2.446 -2.795 1.00 1.00 H new ATOM 380 N LYS A 28 71.498 4.686 1.459 1.00 1.00 N ATOM 381 CA LYS A 28 71.151 4.495 2.858 1.00 1.00 C ATOM 382 C LYS A 28 69.884 5.257 3.198 1.00 1.00 C ATOM 383 O LYS A 28 68.905 4.693 3.671 1.00 1.00 O ATOM 384 CB LYS A 28 72.308 4.996 3.726 1.00 1.00 C ATOM 385 CG LYS A 28 71.914 5.041 5.204 1.00 1.00 C ATOM 386 CD LYS A 28 73.158 5.390 6.033 1.00 1.00 C ATOM 387 CE LYS A 28 72.742 5.979 7.380 1.00 1.00 C ATOM 388 NZ LYS A 28 72.305 7.389 7.175 1.00 1.00 N ATOM 0 H LYS A 28 72.351 5.219 1.288 1.00 1.00 H new ATOM 0 HA LYS A 28 70.975 3.436 3.046 1.00 1.00 H new ATOM 0 HB2 LYS A 28 73.171 4.343 3.597 1.00 1.00 H new ATOM 0 HB3 LYS A 28 72.608 5.991 3.397 1.00 1.00 H new ATOM 0 HG2 LYS A 28 71.132 5.783 5.364 1.00 1.00 H new ATOM 0 HG3 LYS A 28 71.509 4.079 5.517 1.00 1.00 H new ATOM 0 HD2 LYS A 28 73.763 4.497 6.189 1.00 1.00 H new ATOM 0 HD3 LYS A 28 73.778 6.104 5.491 1.00 1.00 H new ATOM 0 HE2 LYS A 28 71.932 5.393 7.814 1.00 1.00 H new ATOM 0 HE3 LYS A 28 73.575 5.941 8.082 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 72.296 7.886 8.089 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 72.964 7.866 6.528 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 71.349 7.400 6.766 1.00 1.00 H new ATOM 402 N VAL A 29 69.927 6.550 2.990 1.00 1.00 N ATOM 403 CA VAL A 29 68.781 7.379 3.341 1.00 1.00 C ATOM 404 C VAL A 29 67.578 7.040 2.488 1.00 1.00 C ATOM 405 O VAL A 29 66.484 6.827 3.012 1.00 1.00 O ATOM 406 CB VAL A 29 69.103 8.865 3.200 1.00 1.00 C ATOM 407 CG1 VAL A 29 67.842 9.684 3.502 1.00 1.00 C ATOM 408 CG2 VAL A 29 70.189 9.229 4.207 1.00 1.00 C ATOM 0 H VAL A 29 70.720 7.050 2.589 1.00 1.00 H new ATOM 0 HA VAL A 29 68.546 7.169 4.384 1.00 1.00 H new ATOM 0 HB VAL A 29 69.445 9.079 2.187 1.00 1.00 H new ATOM 0 HG11 VAL A 29 68.066 10.746 3.403 1.00 1.00 H new ATOM 0 HG12 VAL A 29 67.054 9.412 2.799 1.00 1.00 H new ATOM 0 HG13 VAL A 29 67.508 9.477 4.519 1.00 1.00 H new ATOM 0 HG21 VAL A 29 70.429 10.289 4.117 1.00 1.00 H new ATOM 0 HG22 VAL A 29 69.833 9.022 5.216 1.00 1.00 H new ATOM 0 HG23 VAL A 29 71.082 8.637 4.009 1.00 1.00 H new ATOM 418 N CYS A 30 67.769 6.990 1.179 1.00 1.00 N ATOM 419 CA CYS A 30 66.656 6.686 0.318 1.00 1.00 C ATOM 420 C CYS A 30 66.186 5.272 0.568 1.00 1.00 C ATOM 421 O CYS A 30 65.032 5.052 0.935 1.00 1.00 O ATOM 422 CB CYS A 30 67.097 6.844 -1.139 1.00 1.00 C ATOM 423 SG CYS A 30 65.650 7.123 -2.183 1.00 1.00 S ATOM 0 H CYS A 30 68.659 7.152 0.708 1.00 1.00 H new ATOM 0 HA CYS A 30 65.832 7.369 0.525 1.00 1.00 H new ATOM 0 HB2 CYS A 30 67.791 7.680 -1.231 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.628 5.951 -1.468 1.00 1.00 H new ATOM 428 N ALA A 31 67.048 4.298 0.333 1.00 1.00 N ATOM 429 CA ALA A 31 66.642 2.919 0.495 1.00 1.00 C ATOM 430 C ALA A 31 66.272 2.635 1.937 1.00 1.00 C ATOM 431 O ALA A 31 65.206 2.081 2.216 1.00 1.00 O ATOM 432 CB ALA A 31 67.770 1.969 0.023 1.00 1.00 C ATOM 0 H ALA A 31 68.014 4.434 0.035 1.00 1.00 H new ATOM 0 HA ALA A 31 65.760 2.743 -0.121 1.00 1.00 H new ATOM 0 HB1 ALA A 31 67.451 0.934 0.150 1.00 1.00 H new ATOM 0 HB2 ALA A 31 67.986 2.155 -1.029 1.00 1.00 H new ATOM 0 HB3 ALA A 31 68.668 2.148 0.615 1.00 1.00 H new ATOM 438 N GLY A 32 67.147 3.027 2.857 1.00 1.00 N ATOM 439 CA GLY A 32 66.884 2.809 4.267 1.00 1.00 C ATOM 440 C GLY A 32 66.687 1.337 4.561 1.00 1.00 C ATOM 441 O GLY A 32 65.617 0.981 5.032 1.00 1.00 O ATOM 0 H GLY A 32 68.032 3.491 2.652 1.00 1.00 H new ATOM 0 HA2 GLY A 32 67.714 3.194 4.859 1.00 1.00 H new ATOM 0 HA3 GLY A 32 65.995 3.365 4.565 1.00 1.00 H new ATOM 445 N LEU A 33 67.713 0.486 4.279 1.00 1.00 N ATOM 446 CA LEU A 33 67.702 -0.981 4.504 1.00 1.00 C ATOM 447 C LEU A 33 67.414 -1.759 3.193 1.00 1.00 C ATOM 448 O LEU A 33 66.601 -1.317 2.378 1.00 1.00 O ATOM 449 CB LEU A 33 66.794 -1.476 5.651 1.00 1.00 C ATOM 450 CG LEU A 33 67.477 -1.266 7.024 1.00 1.00 C ATOM 451 CD1 LEU A 33 68.054 0.150 7.161 1.00 1.00 C ATOM 452 CD2 LEU A 33 66.451 -1.504 8.149 1.00 1.00 C ATOM 0 H LEU A 33 68.592 0.814 3.878 1.00 1.00 H new ATOM 0 HA LEU A 33 68.715 -1.201 4.840 1.00 1.00 H new ATOM 0 HB2 LEU A 33 65.845 -0.940 5.626 1.00 1.00 H new ATOM 0 HB3 LEU A 33 66.567 -2.533 5.511 1.00 1.00 H new ATOM 0 HG LEU A 33 68.299 -1.977 7.100 1.00 1.00 H new ATOM 0 HD11 LEU A 33 68.525 0.258 8.138 1.00 1.00 H new ATOM 0 HD12 LEU A 33 68.796 0.318 6.380 1.00 1.00 H new ATOM 0 HD13 LEU A 33 67.252 0.881 7.062 1.00 1.00 H new ATOM 0 HD21 LEU A 33 66.931 -1.356 9.116 1.00 1.00 H new ATOM 0 HD22 LEU A 33 65.625 -0.801 8.043 1.00 1.00 H new ATOM 0 HD23 LEU A 33 66.070 -2.523 8.085 1.00 1.00 H new ATOM 464 N PRO A 34 68.084 -2.897 2.953 1.00 1.00 N ATOM 465 CA PRO A 34 67.887 -3.690 1.694 1.00 1.00 C ATOM 466 C PRO A 34 66.418 -4.011 1.389 1.00 1.00 C ATOM 467 O PRO A 34 65.931 -3.671 0.314 1.00 1.00 O ATOM 468 CB PRO A 34 68.660 -5.004 1.947 1.00 1.00 C ATOM 469 CG PRO A 34 69.639 -4.709 3.039 1.00 1.00 C ATOM 470 CD PRO A 34 69.081 -3.526 3.840 1.00 1.00 C ATOM 0 HA PRO A 34 68.236 -3.121 0.833 1.00 1.00 H new ATOM 0 HB2 PRO A 34 67.981 -5.805 2.239 1.00 1.00 H new ATOM 0 HB3 PRO A 34 69.173 -5.334 1.043 1.00 1.00 H new ATOM 0 HG2 PRO A 34 69.773 -5.579 3.681 1.00 1.00 H new ATOM 0 HG3 PRO A 34 70.617 -4.466 2.624 1.00 1.00 H new ATOM 0 HD2 PRO A 34 68.624 -3.861 4.771 1.00 1.00 H new ATOM 0 HD3 PRO A 34 69.870 -2.823 4.107 1.00 1.00 H new ATOM 478 N GLY A 35 65.714 -4.685 2.306 1.00 1.00 N ATOM 479 CA GLY A 35 64.324 -5.019 1.994 1.00 1.00 C ATOM 480 C GLY A 35 63.513 -3.741 1.897 1.00 1.00 C ATOM 481 O GLY A 35 62.951 -3.452 0.839 1.00 1.00 O ATOM 0 H GLY A 35 66.058 -4.993 3.216 1.00 1.00 H new ATOM 0 HA2 GLY A 35 64.272 -5.569 1.054 1.00 1.00 H new ATOM 0 HA3 GLY A 35 63.911 -5.668 2.766 1.00 1.00 H new ATOM 485 N VAL A 36 63.468 -2.959 2.989 1.00 1.00 N ATOM 486 CA VAL A 36 62.733 -1.689 2.981 1.00 1.00 C ATOM 487 C VAL A 36 62.961 -1.040 1.624 1.00 1.00 C ATOM 488 O VAL A 36 64.059 -1.139 1.113 1.00 1.00 O ATOM 489 CB VAL A 36 63.263 -0.780 4.091 1.00 1.00 C ATOM 490 CG1 VAL A 36 62.510 0.549 4.077 1.00 1.00 C ATOM 491 CG2 VAL A 36 63.081 -1.456 5.455 1.00 1.00 C ATOM 0 H VAL A 36 63.925 -3.181 3.873 1.00 1.00 H new ATOM 0 HA VAL A 36 61.669 -1.855 3.152 1.00 1.00 H new ATOM 0 HB VAL A 36 64.324 -0.597 3.920 1.00 1.00 H new ATOM 0 HG11 VAL A 36 62.892 1.192 4.870 1.00 1.00 H new ATOM 0 HG12 VAL A 36 62.652 1.038 3.113 1.00 1.00 H new ATOM 0 HG13 VAL A 36 61.447 0.367 4.238 1.00 1.00 H new ATOM 0 HG21 VAL A 36 63.461 -0.801 6.239 1.00 1.00 H new ATOM 0 HG22 VAL A 36 62.022 -1.650 5.626 1.00 1.00 H new ATOM 0 HG23 VAL A 36 63.630 -2.398 5.471 1.00 1.00 H new ATOM 501 N ILE A 37 61.921 -0.445 1.043 1.00 1.00 N ATOM 502 CA ILE A 37 62.005 0.165 -0.298 1.00 1.00 C ATOM 503 C ILE A 37 62.098 -0.931 -1.374 1.00 1.00 C ATOM 504 O ILE A 37 63.131 -1.157 -1.988 1.00 1.00 O ATOM 505 CB ILE A 37 63.188 1.190 -0.372 1.00 1.00 C ATOM 506 CG1 ILE A 37 62.868 2.260 -1.451 1.00 1.00 C ATOM 507 CG2 ILE A 37 64.585 0.542 -0.672 1.00 1.00 C ATOM 508 CD1 ILE A 37 62.031 3.394 -0.849 1.00 1.00 C ATOM 0 H ILE A 37 61.001 -0.368 1.477 1.00 1.00 H new ATOM 0 HA ILE A 37 61.094 0.731 -0.493 1.00 1.00 H new ATOM 0 HB ILE A 37 63.271 1.637 0.619 1.00 1.00 H new ATOM 0 HG12 ILE A 37 63.795 2.662 -1.860 1.00 1.00 H new ATOM 0 HG13 ILE A 37 62.327 1.801 -2.279 1.00 1.00 H new ATOM 0 HG21 ILE A 37 65.347 1.320 -0.706 1.00 1.00 H new ATOM 0 HG22 ILE A 37 64.831 -0.172 0.114 1.00 1.00 H new ATOM 0 HG23 ILE A 37 64.549 0.027 -1.632 1.00 1.00 H new ATOM 0 HD11 ILE A 37 61.816 4.135 -1.619 1.00 1.00 H new ATOM 0 HD12 ILE A 37 61.095 2.990 -0.462 1.00 1.00 H new ATOM 0 HD13 ILE A 37 62.586 3.864 -0.037 1.00 1.00 H new ATOM 520 N HIS A 38 60.998 -1.617 -1.635 1.00 1.00 N ATOM 521 CA HIS A 38 61.006 -2.674 -2.644 1.00 1.00 C ATOM 522 C HIS A 38 59.730 -2.611 -3.450 1.00 1.00 C ATOM 523 O HIS A 38 58.645 -2.454 -2.893 1.00 1.00 O ATOM 524 CB HIS A 38 61.119 -4.039 -1.956 1.00 1.00 C ATOM 525 CG HIS A 38 60.084 -4.141 -0.869 1.00 1.00 C ATOM 526 ND1 HIS A 38 59.983 -3.536 0.360 1.00 1.00 N flip ATOM 527 CD2 HIS A 38 58.967 -4.951 -0.984 1.00 1.00 C flip ATOM 528 CE1 HIS A 38 58.824 -3.965 0.999 1.00 1.00 C flip ATOM 529 NE2 HIS A 38 58.248 -4.815 0.146 1.00 1.00 N flip ATOM 0 H HIS A 38 60.100 -1.469 -1.174 1.00 1.00 H new ATOM 0 HA HIS A 38 61.859 -2.536 -3.309 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.977 -4.838 -2.684 1.00 1.00 H new ATOM 0 HB3 HIS A 38 62.117 -4.165 -1.536 1.00 1.00 H new ATOM 0 HD1 HIS A 38 60.655 -2.873 0.746 1.00 1.00 H new ATOM 0 HD2 HIS A 38 58.718 -5.578 -1.827 1.00 1.00 H new ATOM 0 HE1 HIS A 38 58.467 -3.673 1.976 1.00 1.00 H new ATOM 537 N THR A 39 59.868 -2.744 -4.767 1.00 1.00 N ATOM 538 CA THR A 39 58.723 -2.714 -5.671 1.00 1.00 C ATOM 539 C THR A 39 58.555 -4.093 -6.320 1.00 1.00 C ATOM 540 O THR A 39 59.546 -4.735 -6.672 1.00 1.00 O ATOM 541 CB THR A 39 58.949 -1.656 -6.759 1.00 1.00 C ATOM 542 OG1 THR A 39 58.126 -1.946 -7.881 1.00 1.00 O ATOM 543 CG2 THR A 39 60.420 -1.649 -7.192 1.00 1.00 C ATOM 0 H THR A 39 60.766 -2.874 -5.233 1.00 1.00 H new ATOM 0 HA THR A 39 57.823 -2.462 -5.110 1.00 1.00 H new ATOM 0 HB THR A 39 58.692 -0.675 -6.359 1.00 1.00 H new ATOM 0 HG1 THR A 39 58.269 -1.269 -8.575 1.00 1.00 H new ATOM 0 HG21 THR A 39 60.568 -0.894 -7.964 1.00 1.00 H new ATOM 0 HG22 THR A 39 61.051 -1.419 -6.334 1.00 1.00 H new ATOM 0 HG23 THR A 39 60.688 -2.629 -7.586 1.00 1.00 H new ATOM 551 N PRO A 40 57.346 -4.574 -6.482 1.00 1.00 N ATOM 552 CA PRO A 40 57.102 -5.912 -7.092 1.00 1.00 C ATOM 553 C PRO A 40 57.392 -5.924 -8.587 1.00 1.00 C ATOM 554 O PRO A 40 57.341 -6.978 -9.221 1.00 1.00 O ATOM 555 CB PRO A 40 55.608 -6.164 -6.823 1.00 1.00 C ATOM 556 CG PRO A 40 55.003 -4.802 -6.730 1.00 1.00 C ATOM 557 CD PRO A 40 56.080 -3.910 -6.111 1.00 1.00 C ATOM 0 HA PRO A 40 57.753 -6.679 -6.672 1.00 1.00 H new ATOM 0 HB2 PRO A 40 55.154 -6.745 -7.626 1.00 1.00 H new ATOM 0 HB3 PRO A 40 55.461 -6.726 -5.901 1.00 1.00 H new ATOM 0 HG2 PRO A 40 54.710 -4.436 -7.714 1.00 1.00 H new ATOM 0 HG3 PRO A 40 54.104 -4.815 -6.114 1.00 1.00 H new ATOM 0 HD2 PRO A 40 56.032 -2.894 -6.503 1.00 1.00 H new ATOM 0 HD3 PRO A 40 55.968 -3.840 -5.029 1.00 1.00 H new ATOM 565 N ALA A 41 57.662 -4.751 -9.157 1.00 1.00 N ATOM 566 CA ALA A 41 57.912 -4.662 -10.600 1.00 1.00 C ATOM 567 C ALA A 41 59.343 -4.282 -10.881 1.00 1.00 C ATOM 568 O ALA A 41 59.685 -3.098 -10.920 1.00 1.00 O ATOM 569 CB ALA A 41 56.994 -3.603 -11.213 1.00 1.00 C ATOM 0 H ALA A 41 57.713 -3.864 -8.656 1.00 1.00 H new ATOM 0 HA ALA A 41 57.714 -5.640 -11.039 1.00 1.00 H new ATOM 0 HB1 ALA A 41 57.180 -3.537 -12.285 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.954 -3.880 -11.041 1.00 1.00 H new ATOM 0 HB3 ALA A 41 57.193 -2.637 -10.750 1.00 1.00 H new ATOM 575 N ARG A 42 60.184 -5.294 -11.046 1.00 1.00 N ATOM 576 CA ARG A 42 61.601 -5.068 -11.288 1.00 1.00 C ATOM 577 C ARG A 42 62.066 -5.739 -12.590 1.00 1.00 C ATOM 578 O ARG A 42 61.637 -6.833 -12.941 1.00 1.00 O ATOM 579 CB ARG A 42 62.433 -5.605 -10.079 1.00 1.00 C ATOM 580 CG ARG A 42 61.543 -6.411 -9.118 1.00 1.00 C ATOM 581 CD ARG A 42 62.380 -6.881 -7.924 1.00 1.00 C ATOM 582 NE ARG A 42 63.474 -7.739 -8.373 1.00 1.00 N ATOM 583 CZ ARG A 42 64.419 -8.147 -7.526 1.00 1.00 C ATOM 584 NH1 ARG A 42 64.358 -7.807 -6.267 1.00 1.00 N ATOM 585 NH2 ARG A 42 65.406 -8.889 -7.951 1.00 1.00 N ATOM 0 H ARG A 42 59.910 -6.276 -11.017 1.00 1.00 H new ATOM 0 HA ARG A 42 61.760 -3.995 -11.394 1.00 1.00 H new ATOM 0 HB2 ARG A 42 63.246 -6.234 -10.442 1.00 1.00 H new ATOM 0 HB3 ARG A 42 62.889 -4.770 -9.546 1.00 1.00 H new ATOM 0 HG2 ARG A 42 60.711 -5.797 -8.774 1.00 1.00 H new ATOM 0 HG3 ARG A 42 61.113 -7.269 -9.635 1.00 1.00 H new ATOM 0 HD2 ARG A 42 62.781 -6.019 -7.391 1.00 1.00 H new ATOM 0 HD3 ARG A 42 61.749 -7.424 -7.221 1.00 1.00 H new ATOM 0 HE ARG A 42 63.515 -8.030 -9.350 1.00 1.00 H new ATOM 0 HH11 ARG A 42 63.587 -7.229 -5.932 1.00 1.00 H new ATOM 0 HH12 ARG A 42 65.081 -8.119 -5.619 1.00 1.00 H new ATOM 0 HH21 ARG A 42 65.455 -9.158 -8.934 1.00 1.00 H new ATOM 0 HH22 ARG A 42 66.128 -9.200 -7.300 1.00 1.00 H new ATOM 599 N ARG A 43 62.924 -4.995 -13.279 1.00 1.00 N ATOM 600 CA ARG A 43 63.505 -5.428 -14.568 1.00 1.00 C ATOM 601 C ARG A 43 64.279 -6.764 -14.333 1.00 1.00 C ATOM 602 O ARG A 43 65.343 -7.014 -14.882 1.00 1.00 O ATOM 603 CB ARG A 43 64.406 -4.286 -15.126 1.00 1.00 C ATOM 604 CG ARG A 43 65.247 -4.694 -16.373 1.00 1.00 C ATOM 605 CD ARG A 43 64.407 -4.656 -17.668 1.00 1.00 C ATOM 606 NE ARG A 43 64.679 -3.401 -18.370 1.00 1.00 N ATOM 607 CZ ARG A 43 64.715 -3.309 -19.704 1.00 1.00 C ATOM 608 NH1 ARG A 43 64.434 -4.338 -20.464 1.00 1.00 N ATOM 609 NH2 ARG A 43 65.031 -2.168 -20.253 1.00 1.00 N ATOM 0 H ARG A 43 63.243 -4.076 -12.971 1.00 1.00 H new ATOM 0 HA ARG A 43 62.737 -5.620 -15.317 1.00 1.00 H new ATOM 0 HB2 ARG A 43 63.777 -3.435 -15.388 1.00 1.00 H new ATOM 0 HB3 ARG A 43 65.081 -3.952 -14.338 1.00 1.00 H new ATOM 0 HG2 ARG A 43 66.099 -4.022 -16.473 1.00 1.00 H new ATOM 0 HG3 ARG A 43 65.648 -5.697 -16.229 1.00 1.00 H new ATOM 0 HD2 ARG A 43 64.655 -5.506 -18.304 1.00 1.00 H new ATOM 0 HD3 ARG A 43 63.346 -4.734 -17.432 1.00 1.00 H new ATOM 0 HE ARG A 43 64.848 -2.560 -17.818 1.00 1.00 H new ATOM 0 HH11 ARG A 43 64.182 -5.231 -20.041 1.00 1.00 H new ATOM 0 HH12 ARG A 43 64.467 -4.246 -21.479 1.00 1.00 H new ATOM 0 HH21 ARG A 43 65.246 -1.362 -19.666 1.00 1.00 H new ATOM 0 HH22 ARG A 43 65.063 -2.082 -21.269 1.00 1.00 H new ATOM 623 N GLY A 44 63.728 -7.629 -13.474 1.00 1.00 N ATOM 624 CA GLY A 44 64.339 -8.907 -13.137 1.00 1.00 C ATOM 625 C GLY A 44 65.615 -8.670 -12.355 1.00 1.00 C ATOM 626 O GLY A 44 65.999 -9.467 -11.504 1.00 1.00 O ATOM 0 H GLY A 44 62.844 -7.456 -12.995 1.00 1.00 H new ATOM 0 HA2 GLY A 44 63.646 -9.509 -12.549 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.556 -9.468 -14.046 1.00 1.00 H new ATOM 630 N PHE A 45 66.242 -7.546 -12.648 1.00 1.00 N ATOM 631 CA PHE A 45 67.465 -7.149 -11.994 1.00 1.00 C ATOM 632 C PHE A 45 67.797 -5.704 -12.384 1.00 1.00 C ATOM 633 O PHE A 45 67.094 -5.119 -13.203 1.00 1.00 O ATOM 634 CB PHE A 45 68.608 -8.126 -12.381 1.00 1.00 C ATOM 635 CG PHE A 45 69.153 -8.819 -11.138 1.00 1.00 C ATOM 636 CD1 PHE A 45 70.090 -8.164 -10.329 1.00 1.00 C ATOM 637 CD2 PHE A 45 68.703 -10.102 -10.783 1.00 1.00 C ATOM 638 CE1 PHE A 45 70.575 -8.789 -9.173 1.00 1.00 C ATOM 639 CE2 PHE A 45 69.195 -10.724 -9.627 1.00 1.00 C ATOM 640 CZ PHE A 45 70.129 -10.065 -8.822 1.00 1.00 C ATOM 0 H PHE A 45 65.912 -6.883 -13.350 1.00 1.00 H new ATOM 0 HA PHE A 45 67.346 -7.192 -10.911 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.237 -8.869 -13.087 1.00 1.00 H new ATOM 0 HB3 PHE A 45 69.408 -7.581 -12.882 1.00 1.00 H new ATOM 0 HD1 PHE A 45 70.439 -7.177 -10.596 1.00 1.00 H new ATOM 0 HD2 PHE A 45 67.977 -10.609 -11.401 1.00 1.00 H new ATOM 0 HE1 PHE A 45 71.297 -8.282 -8.550 1.00 1.00 H new ATOM 0 HE2 PHE A 45 68.852 -11.712 -9.358 1.00 1.00 H new ATOM 0 HZ PHE A 45 70.505 -10.542 -7.929 1.00 1.00 H new ATOM 650 N PHE A 46 68.867 -5.190 -11.754 1.00 1.00 N ATOM 651 CA PHE A 46 69.423 -3.814 -11.911 1.00 1.00 C ATOM 652 C PHE A 46 69.263 -3.078 -10.592 1.00 1.00 C ATOM 653 O PHE A 46 68.144 -2.762 -10.201 1.00 1.00 O ATOM 654 CB PHE A 46 68.798 -2.932 -13.042 1.00 1.00 C ATOM 655 CG PHE A 46 69.565 -3.086 -14.354 1.00 1.00 C ATOM 656 CD1 PHE A 46 69.412 -4.238 -15.135 1.00 1.00 C ATOM 657 CD2 PHE A 46 70.426 -2.057 -14.795 1.00 1.00 C ATOM 658 CE1 PHE A 46 70.110 -4.370 -16.344 1.00 1.00 C ATOM 659 CE2 PHE A 46 71.125 -2.196 -16.007 1.00 1.00 C ATOM 660 CZ PHE A 46 70.965 -3.353 -16.779 1.00 1.00 C ATOM 0 H PHE A 46 69.403 -5.743 -11.085 1.00 1.00 H new ATOM 0 HA PHE A 46 70.461 -3.963 -12.208 1.00 1.00 H new ATOM 0 HB2 PHE A 46 67.756 -3.214 -13.192 1.00 1.00 H new ATOM 0 HB3 PHE A 46 68.804 -1.886 -12.735 1.00 1.00 H new ATOM 0 HD1 PHE A 46 68.754 -5.028 -14.805 1.00 1.00 H new ATOM 0 HD2 PHE A 46 70.548 -1.163 -14.201 1.00 1.00 H new ATOM 0 HE1 PHE A 46 69.987 -5.261 -16.942 1.00 1.00 H new ATOM 0 HE2 PHE A 46 71.785 -1.410 -16.343 1.00 1.00 H new ATOM 0 HZ PHE A 46 71.502 -3.460 -17.710 1.00 1.00 H new ATOM 670 N ARG A 47 70.405 -2.830 -9.934 1.00 1.00 N ATOM 671 CA ARG A 47 70.488 -2.126 -8.647 1.00 1.00 C ATOM 672 C ARG A 47 70.642 -3.099 -7.498 1.00 1.00 C ATOM 673 O ARG A 47 70.214 -4.253 -7.567 1.00 1.00 O ATOM 674 CB ARG A 47 69.300 -1.194 -8.373 1.00 1.00 C ATOM 675 CG ARG A 47 69.283 -0.052 -9.411 1.00 1.00 C ATOM 676 CD ARG A 47 70.271 1.081 -9.017 1.00 1.00 C ATOM 677 NE ARG A 47 71.530 0.955 -9.742 1.00 1.00 N ATOM 678 CZ ARG A 47 72.425 1.941 -9.709 1.00 1.00 C ATOM 679 NH1 ARG A 47 72.173 3.016 -9.013 1.00 1.00 N ATOM 680 NH2 ARG A 47 73.549 1.837 -10.365 1.00 1.00 N ATOM 0 H ARG A 47 71.316 -3.120 -10.290 1.00 1.00 H new ATOM 0 HA ARG A 47 71.376 -1.499 -8.722 1.00 1.00 H new ATOM 0 HB2 ARG A 47 68.367 -1.755 -8.421 1.00 1.00 H new ATOM 0 HB3 ARG A 47 69.373 -0.782 -7.366 1.00 1.00 H new ATOM 0 HG2 ARG A 47 69.549 -0.445 -10.392 1.00 1.00 H new ATOM 0 HG3 ARG A 47 68.275 0.354 -9.493 1.00 1.00 H new ATOM 0 HD2 ARG A 47 69.821 2.051 -9.230 1.00 1.00 H new ATOM 0 HD3 ARG A 47 70.460 1.046 -7.944 1.00 1.00 H new ATOM 0 HE ARG A 47 71.726 0.109 -10.276 1.00 1.00 H new ATOM 0 HH11 ARG A 47 71.296 3.097 -8.499 1.00 1.00 H new ATOM 0 HH12 ARG A 47 72.853 3.775 -8.983 1.00 1.00 H new ATOM 0 HH21 ARG A 47 73.747 0.996 -10.908 1.00 1.00 H new ATOM 0 HH22 ARG A 47 74.229 2.596 -10.335 1.00 1.00 H new ATOM 694 N CYS A 48 71.258 -2.607 -6.432 1.00 1.00 N ATOM 695 CA CYS A 48 71.478 -3.415 -5.249 1.00 1.00 C ATOM 696 C CYS A 48 72.458 -4.542 -5.581 1.00 1.00 C ATOM 697 O CYS A 48 72.078 -5.710 -5.659 1.00 1.00 O ATOM 698 CB CYS A 48 70.121 -3.967 -4.757 1.00 1.00 C ATOM 699 SG CYS A 48 70.076 -3.983 -2.945 1.00 1.00 S ATOM 0 H CYS A 48 71.613 -1.653 -6.366 1.00 1.00 H new ATOM 0 HA CYS A 48 71.913 -2.815 -4.450 1.00 1.00 H new ATOM 0 HB2 CYS A 48 69.308 -3.353 -5.143 1.00 1.00 H new ATOM 0 HB3 CYS A 48 69.969 -4.976 -5.141 1.00 1.00 H new ATOM 704 N ASN A 49 73.730 -4.183 -5.793 1.00 1.00 N ATOM 705 CA ASN A 49 74.752 -5.177 -6.136 1.00 1.00 C ATOM 706 C ASN A 49 76.039 -4.917 -5.346 1.00 1.00 C ATOM 707 O ASN A 49 76.252 -3.815 -4.846 1.00 1.00 O ATOM 708 CB ASN A 49 75.042 -5.107 -7.659 1.00 1.00 C ATOM 709 CG ASN A 49 74.389 -6.275 -8.392 1.00 1.00 C ATOM 710 OD1 ASN A 49 75.030 -6.934 -9.211 1.00 1.00 O ATOM 711 ND2 ASN A 49 73.147 -6.574 -8.144 1.00 1.00 N ATOM 0 H ASN A 49 74.072 -3.224 -5.734 1.00 1.00 H new ATOM 0 HA ASN A 49 74.385 -6.170 -5.878 1.00 1.00 H new ATOM 0 HB2 ASN A 49 74.668 -4.165 -8.061 1.00 1.00 H new ATOM 0 HB3 ASN A 49 76.119 -5.122 -7.829 1.00 1.00 H new ATOM 0 HD21 ASN A 49 72.704 -7.355 -8.628 1.00 1.00 H new ATOM 0 HD22 ASN A 49 72.617 -6.028 -7.465 1.00 1.00 H new ATOM 718 N PRO A 50 76.892 -5.914 -5.241 1.00 1.00 N ATOM 719 CA PRO A 50 78.200 -5.804 -4.518 1.00 1.00 C ATOM 720 C PRO A 50 79.111 -4.730 -5.140 1.00 1.00 C ATOM 721 O PRO A 50 80.232 -5.014 -5.551 1.00 1.00 O ATOM 722 CB PRO A 50 78.807 -7.223 -4.651 1.00 1.00 C ATOM 723 CG PRO A 50 78.093 -7.849 -5.810 1.00 1.00 C ATOM 724 CD PRO A 50 76.691 -7.265 -5.797 1.00 1.00 C ATOM 0 HA PRO A 50 78.082 -5.493 -3.480 1.00 1.00 H new ATOM 0 HB2 PRO A 50 79.881 -7.177 -4.829 1.00 1.00 H new ATOM 0 HB3 PRO A 50 78.660 -7.801 -3.739 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.601 -7.626 -6.748 1.00 1.00 H new ATOM 0 HG3 PRO A 50 78.065 -8.934 -5.712 1.00 1.00 H new ATOM 0 HD2 PRO A 50 76.261 -7.228 -6.798 1.00 1.00 H new ATOM 0 HD3 PRO A 50 76.014 -7.857 -5.181 1.00 1.00 H new ATOM 732 N GLU A 51 78.625 -3.490 -5.181 1.00 1.00 N ATOM 733 CA GLU A 51 79.403 -2.379 -5.731 1.00 1.00 C ATOM 734 C GLU A 51 80.060 -2.789 -7.057 1.00 1.00 C ATOM 735 O GLU A 51 81.122 -2.286 -7.423 1.00 1.00 O ATOM 736 CB GLU A 51 80.463 -1.948 -4.680 1.00 1.00 C ATOM 737 CG GLU A 51 80.462 -0.420 -4.453 1.00 1.00 C ATOM 738 CD GLU A 51 81.135 -0.098 -3.121 1.00 1.00 C ATOM 739 OE1 GLU A 51 80.447 -0.110 -2.114 1.00 1.00 O ATOM 740 OE2 GLU A 51 82.330 0.151 -3.125 1.00 1.00 O ATOM 0 H GLU A 51 77.699 -3.229 -4.841 1.00 1.00 H new ATOM 0 HA GLU A 51 78.749 -1.533 -5.944 1.00 1.00 H new ATOM 0 HB2 GLU A 51 80.265 -2.455 -3.736 1.00 1.00 H new ATOM 0 HB3 GLU A 51 81.452 -2.265 -5.011 1.00 1.00 H new ATOM 0 HG2 GLU A 51 80.988 0.079 -5.267 1.00 1.00 H new ATOM 0 HG3 GLU A 51 79.439 -0.043 -4.456 1.00 1.00 H new ATOM 747 N ARG A 52 79.398 -3.704 -7.774 1.00 1.00 N ATOM 748 CA ARG A 52 79.886 -4.197 -9.072 1.00 1.00 C ATOM 749 C ARG A 52 78.832 -4.009 -10.159 1.00 1.00 C ATOM 750 O ARG A 52 77.633 -3.962 -9.891 1.00 1.00 O ATOM 751 CB ARG A 52 80.223 -5.690 -8.973 1.00 1.00 C ATOM 752 CG ARG A 52 81.545 -5.883 -8.221 1.00 1.00 C ATOM 753 CD ARG A 52 81.618 -7.323 -7.723 1.00 1.00 C ATOM 754 NE ARG A 52 82.900 -7.581 -7.067 1.00 1.00 N ATOM 755 CZ ARG A 52 82.981 -8.181 -5.875 1.00 1.00 C ATOM 756 NH1 ARG A 52 81.902 -8.561 -5.238 1.00 1.00 N ATOM 757 NH2 ARG A 52 84.147 -8.388 -5.340 1.00 1.00 N ATOM 0 H ARG A 52 78.516 -4.122 -7.477 1.00 1.00 H new ATOM 0 HA ARG A 52 80.777 -3.625 -9.332 1.00 1.00 H new ATOM 0 HB2 ARG A 52 79.421 -6.218 -8.457 1.00 1.00 H new ATOM 0 HB3 ARG A 52 80.297 -6.121 -9.971 1.00 1.00 H new ATOM 0 HG2 ARG A 52 82.388 -5.667 -8.877 1.00 1.00 H new ATOM 0 HG3 ARG A 52 81.608 -5.189 -7.382 1.00 1.00 H new ATOM 0 HD2 ARG A 52 80.802 -7.513 -7.025 1.00 1.00 H new ATOM 0 HD3 ARG A 52 81.488 -8.009 -8.560 1.00 1.00 H new ATOM 0 HE ARG A 52 83.760 -7.294 -7.534 1.00 1.00 H new ATOM 0 HH11 ARG A 52 80.983 -8.400 -5.651 1.00 1.00 H new ATOM 0 HH12 ARG A 52 81.980 -9.018 -4.329 1.00 1.00 H new ATOM 0 HH21 ARG A 52 84.992 -8.093 -5.829 1.00 1.00 H new ATOM 0 HH22 ARG A 52 84.217 -8.845 -4.431 1.00 1.00 H new ATOM 771 N ILE A 53 79.306 -3.856 -11.387 1.00 1.00 N ATOM 772 CA ILE A 53 78.433 -3.611 -12.525 1.00 1.00 C ATOM 773 C ILE A 53 77.317 -4.671 -12.744 1.00 1.00 C ATOM 774 O ILE A 53 77.486 -5.885 -12.614 1.00 1.00 O ATOM 775 CB ILE A 53 79.291 -3.415 -13.784 1.00 1.00 C ATOM 776 CG1 ILE A 53 78.479 -2.663 -14.861 1.00 1.00 C ATOM 777 CG2 ILE A 53 79.727 -4.765 -14.337 1.00 1.00 C ATOM 778 CD1 ILE A 53 78.318 -1.172 -14.505 1.00 1.00 C ATOM 0 H ILE A 53 80.298 -3.898 -11.621 1.00 1.00 H new ATOM 0 HA ILE A 53 77.878 -2.700 -12.300 1.00 1.00 H new ATOM 0 HB ILE A 53 80.173 -2.832 -13.518 1.00 1.00 H new ATOM 0 HG12 ILE A 53 78.977 -2.756 -15.826 1.00 1.00 H new ATOM 0 HG13 ILE A 53 77.496 -3.122 -14.964 1.00 1.00 H new ATOM 0 HG21 ILE A 53 80.335 -4.614 -15.229 1.00 1.00 H new ATOM 0 HG22 ILE A 53 80.312 -5.294 -13.585 1.00 1.00 H new ATOM 0 HG23 ILE A 53 78.847 -5.355 -14.593 1.00 1.00 H new ATOM 0 HD11 ILE A 53 77.742 -0.672 -15.284 1.00 1.00 H new ATOM 0 HD12 ILE A 53 77.797 -1.080 -13.552 1.00 1.00 H new ATOM 0 HD13 ILE A 53 79.301 -0.708 -14.427 1.00 1.00 H new ATOM 790 N GLN A 54 76.194 -4.083 -13.098 1.00 1.00 N ATOM 791 CA GLN A 54 74.953 -4.819 -13.381 1.00 1.00 C ATOM 792 C GLN A 54 74.876 -5.294 -14.850 1.00 1.00 C ATOM 793 O GLN A 54 74.271 -4.632 -15.696 1.00 1.00 O ATOM 794 CB GLN A 54 73.696 -4.014 -12.997 1.00 1.00 C ATOM 795 CG GLN A 54 73.882 -2.528 -13.322 1.00 1.00 C ATOM 796 CD GLN A 54 74.635 -1.828 -12.198 1.00 1.00 C ATOM 797 OE1 GLN A 54 75.650 -1.177 -12.437 1.00 1.00 O ATOM 798 NE2 GLN A 54 74.187 -1.923 -10.978 1.00 1.00 N ATOM 0 H GLN A 54 76.103 -3.072 -13.202 1.00 1.00 H new ATOM 0 HA GLN A 54 74.979 -5.707 -12.750 1.00 1.00 H new ATOM 0 HB2 GLN A 54 72.831 -4.403 -13.534 1.00 1.00 H new ATOM 0 HB3 GLN A 54 73.492 -4.136 -11.933 1.00 1.00 H new ATOM 0 HG2 GLN A 54 74.430 -2.420 -14.258 1.00 1.00 H new ATOM 0 HG3 GLN A 54 72.910 -2.056 -13.466 1.00 1.00 H new ATOM 0 HE21 GLN A 54 73.344 -2.464 -10.785 1.00 1.00 H new ATOM 0 HE22 GLN A 54 74.679 -1.456 -10.216 1.00 1.00 H new ATOM 807 N ILE A 55 75.463 -6.476 -15.123 1.00 1.00 N ATOM 808 CA ILE A 55 75.426 -7.085 -16.471 1.00 1.00 C ATOM 809 C ILE A 55 75.313 -8.608 -16.342 1.00 1.00 C ATOM 810 O ILE A 55 75.789 -9.175 -15.356 1.00 1.00 O ATOM 811 CB ILE A 55 76.681 -6.749 -17.291 1.00 1.00 C ATOM 812 CG1 ILE A 55 76.519 -7.327 -18.698 1.00 1.00 C ATOM 813 CG2 ILE A 55 77.917 -7.376 -16.628 1.00 1.00 C ATOM 814 CD1 ILE A 55 77.606 -6.775 -19.614 1.00 1.00 C ATOM 0 H ILE A 55 75.968 -7.029 -14.430 1.00 1.00 H new ATOM 0 HA ILE A 55 74.560 -6.675 -16.991 1.00 1.00 H new ATOM 0 HB ILE A 55 76.808 -5.668 -17.340 1.00 1.00 H new ATOM 0 HG12 ILE A 55 76.579 -8.415 -18.663 1.00 1.00 H new ATOM 0 HG13 ILE A 55 75.535 -7.074 -19.093 1.00 1.00 H new ATOM 0 HG21 ILE A 55 78.805 -7.135 -17.213 1.00 1.00 H new ATOM 0 HG22 ILE A 55 78.029 -6.980 -15.619 1.00 1.00 H new ATOM 0 HG23 ILE A 55 77.795 -8.458 -16.582 1.00 1.00 H new ATOM 0 HD11 ILE A 55 77.485 -7.191 -20.614 1.00 1.00 H new ATOM 0 HD12 ILE A 55 77.526 -5.689 -19.660 1.00 1.00 H new ATOM 0 HD13 ILE A 55 78.586 -7.050 -19.223 1.00 1.00 H new ATOM 826 N GLY A 56 74.694 -9.287 -17.322 1.00 1.00 N ATOM 827 CA GLY A 56 74.553 -10.749 -17.265 1.00 1.00 C ATOM 828 C GLY A 56 73.144 -11.139 -16.839 1.00 1.00 C ATOM 829 O GLY A 56 72.832 -12.315 -16.670 1.00 1.00 O ATOM 0 H GLY A 56 74.289 -8.853 -18.152 1.00 1.00 H new ATOM 0 HA2 GLY A 56 74.775 -11.179 -18.242 1.00 1.00 H new ATOM 0 HA3 GLY A 56 75.278 -11.162 -16.563 1.00 1.00 H new ATOM 833 N ASP A 57 72.304 -10.127 -16.626 1.00 1.00 N ATOM 834 CA ASP A 57 70.936 -10.344 -16.170 1.00 1.00 C ATOM 835 C ASP A 57 69.932 -10.520 -17.324 1.00 1.00 C ATOM 836 O ASP A 57 69.619 -9.594 -18.069 1.00 1.00 O ATOM 837 CB ASP A 57 70.532 -9.172 -15.277 1.00 1.00 C ATOM 838 CG ASP A 57 70.933 -7.855 -15.931 1.00 1.00 C ATOM 839 OD1 ASP A 57 70.433 -7.571 -17.006 1.00 1.00 O ATOM 840 OD2 ASP A 57 71.741 -7.149 -15.347 1.00 1.00 O ATOM 0 H ASP A 57 72.550 -9.147 -16.763 1.00 1.00 H new ATOM 0 HA ASP A 57 70.911 -11.280 -15.612 1.00 1.00 H new ATOM 0 HB2 ASP A 57 69.456 -9.189 -15.105 1.00 1.00 H new ATOM 0 HB3 ASP A 57 71.012 -9.264 -14.303 1.00 1.00 H new ATOM 845 N TRP A 58 69.405 -11.733 -17.398 1.00 1.00 N ATOM 846 CA TRP A 58 68.391 -12.113 -18.386 1.00 1.00 C ATOM 847 C TRP A 58 67.025 -11.649 -17.875 1.00 1.00 C ATOM 848 O TRP A 58 66.962 -11.020 -16.818 1.00 1.00 O ATOM 849 CB TRP A 58 68.449 -13.598 -18.703 1.00 1.00 C ATOM 850 CG TRP A 58 69.653 -13.902 -19.541 1.00 1.00 C ATOM 851 CD1 TRP A 58 70.716 -13.081 -19.727 1.00 1.00 C ATOM 852 CD2 TRP A 58 69.936 -15.112 -20.287 1.00 1.00 C ATOM 853 NE1 TRP A 58 71.631 -13.718 -20.546 1.00 1.00 N ATOM 854 CE2 TRP A 58 71.194 -14.973 -20.921 1.00 1.00 C ATOM 855 CE3 TRP A 58 69.225 -16.306 -20.473 1.00 1.00 C ATOM 856 CZ2 TRP A 58 71.725 -15.993 -21.713 1.00 1.00 C ATOM 857 CZ3 TRP A 58 69.754 -17.333 -21.267 1.00 1.00 C ATOM 858 CH2 TRP A 58 71.001 -17.177 -21.887 1.00 1.00 C ATOM 0 H TRP A 58 69.668 -12.493 -16.770 1.00 1.00 H new ATOM 0 HA TRP A 58 68.585 -11.619 -19.338 1.00 1.00 H new ATOM 0 HB2 TRP A 58 68.486 -14.173 -17.778 1.00 1.00 H new ATOM 0 HB3 TRP A 58 67.544 -13.900 -19.230 1.00 1.00 H new ATOM 0 HD1 TRP A 58 70.830 -12.093 -19.305 1.00 1.00 H new ATOM 0 HE1 TRP A 58 72.520 -13.311 -20.837 1.00 1.00 H new ATOM 0 HE3 TRP A 58 68.262 -16.435 -20.001 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 72.687 -15.869 -22.188 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 69.198 -18.249 -21.402 1.00 1.00 H new ATOM 0 HH2 TRP A 58 71.403 -17.971 -22.499 1.00 1.00 H new ATOM 869 N ARG A 59 65.932 -11.935 -18.587 1.00 1.00 N ATOM 870 CA ARG A 59 64.591 -11.524 -18.149 1.00 1.00 C ATOM 871 C ARG A 59 63.872 -12.692 -17.414 1.00 1.00 C ATOM 872 O ARG A 59 63.380 -12.551 -16.292 1.00 1.00 O ATOM 873 CB ARG A 59 63.768 -11.093 -19.406 1.00 1.00 C ATOM 874 CG ARG A 59 64.700 -10.805 -20.622 1.00 1.00 C ATOM 875 CD ARG A 59 64.990 -12.095 -21.427 1.00 1.00 C ATOM 876 NE ARG A 59 66.064 -11.856 -22.416 1.00 1.00 N ATOM 877 CZ ARG A 59 67.132 -12.667 -22.553 1.00 1.00 C ATOM 878 NH1 ARG A 59 67.305 -13.697 -21.768 1.00 1.00 N ATOM 879 NH2 ARG A 59 68.022 -12.419 -23.483 1.00 1.00 N ATOM 0 H ARG A 59 65.947 -12.449 -19.468 1.00 1.00 H new ATOM 0 HA ARG A 59 64.675 -10.690 -17.453 1.00 1.00 H new ATOM 0 HB2 ARG A 59 63.059 -11.879 -19.666 1.00 1.00 H new ATOM 0 HB3 ARG A 59 63.184 -10.202 -19.173 1.00 1.00 H new ATOM 0 HG2 ARG A 59 64.234 -10.065 -21.273 1.00 1.00 H new ATOM 0 HG3 ARG A 59 65.638 -10.375 -20.270 1.00 1.00 H new ATOM 0 HD2 ARG A 59 65.283 -12.896 -20.749 1.00 1.00 H new ATOM 0 HD3 ARG A 59 64.085 -12.424 -21.937 1.00 1.00 H new ATOM 0 HE ARG A 59 65.993 -11.039 -23.023 1.00 1.00 H new ATOM 0 HH11 ARG A 59 66.625 -13.900 -21.035 1.00 1.00 H new ATOM 0 HH12 ARG A 59 68.120 -14.299 -21.888 1.00 1.00 H new ATOM 0 HH21 ARG A 59 67.905 -11.615 -24.100 1.00 1.00 H new ATOM 0 HH22 ARG A 59 68.832 -13.030 -23.590 1.00 1.00 H new ATOM 893 N TYR A 60 63.828 -13.831 -18.115 1.00 1.00 N ATOM 894 CA TYR A 60 63.197 -15.098 -17.672 1.00 1.00 C ATOM 895 C TYR A 60 64.072 -15.848 -16.666 1.00 1.00 C ATOM 896 O TYR A 60 63.664 -16.867 -16.073 1.00 1.00 O ATOM 897 CB TYR A 60 62.927 -16.016 -18.882 1.00 1.00 C ATOM 898 CG TYR A 60 62.464 -17.378 -18.390 1.00 1.00 C ATOM 899 CD1 TYR A 60 61.162 -17.543 -17.900 1.00 1.00 C ATOM 900 CD2 TYR A 60 63.352 -18.465 -18.388 1.00 1.00 C ATOM 901 CE1 TYR A 60 60.746 -18.790 -17.415 1.00 1.00 C ATOM 902 CE2 TYR A 60 62.939 -19.711 -17.894 1.00 1.00 C ATOM 903 CZ TYR A 60 61.635 -19.873 -17.408 1.00 1.00 C ATOM 904 OH TYR A 60 61.225 -21.095 -16.904 1.00 1.00 O ATOM 0 H TYR A 60 64.244 -13.907 -19.043 1.00 1.00 H new ATOM 0 HA TYR A 60 62.258 -14.834 -17.186 1.00 1.00 H new ATOM 0 HB2 TYR A 60 62.168 -15.573 -19.526 1.00 1.00 H new ATOM 0 HB3 TYR A 60 63.831 -16.122 -19.481 1.00 1.00 H new ATOM 0 HD1 TYR A 60 60.478 -16.708 -17.896 1.00 1.00 H new ATOM 0 HD2 TYR A 60 64.356 -18.342 -18.768 1.00 1.00 H new ATOM 0 HE1 TYR A 60 59.739 -18.917 -17.046 1.00 1.00 H new ATOM 0 HE2 TYR A 60 63.625 -20.545 -17.888 1.00 1.00 H new ATOM 0 HH TYR A 60 61.959 -21.740 -16.973 1.00 1.00 H new ATOM 914 N GLU A 61 65.258 -15.342 -16.450 1.00 1.00 N ATOM 915 CA GLU A 61 66.168 -15.943 -15.515 1.00 1.00 C ATOM 916 C GLU A 61 65.653 -15.734 -14.103 1.00 1.00 C ATOM 917 O GLU A 61 66.124 -16.339 -13.156 1.00 1.00 O ATOM 918 CB GLU A 61 67.540 -15.285 -15.724 1.00 1.00 C ATOM 919 CG GLU A 61 68.442 -15.311 -14.472 1.00 1.00 C ATOM 920 CD GLU A 61 68.247 -14.034 -13.652 1.00 1.00 C ATOM 921 OE1 GLU A 61 67.118 -13.744 -13.297 1.00 1.00 O ATOM 922 OE2 GLU A 61 69.234 -13.356 -13.404 1.00 1.00 O ATOM 0 H GLU A 61 65.617 -14.508 -16.914 1.00 1.00 H new ATOM 0 HA GLU A 61 66.255 -17.018 -15.672 1.00 1.00 H new ATOM 0 HB2 GLU A 61 68.054 -15.791 -16.541 1.00 1.00 H new ATOM 0 HB3 GLU A 61 67.393 -14.250 -16.032 1.00 1.00 H new ATOM 0 HG2 GLU A 61 68.205 -16.183 -13.862 1.00 1.00 H new ATOM 0 HG3 GLU A 61 69.486 -15.405 -14.769 1.00 1.00 H new ATOM 929 N VAL A 62 64.730 -14.803 -13.950 1.00 1.00 N ATOM 930 CA VAL A 62 64.257 -14.452 -12.609 1.00 1.00 C ATOM 931 C VAL A 62 63.976 -15.690 -11.810 1.00 1.00 C ATOM 932 O VAL A 62 64.476 -15.839 -10.708 1.00 1.00 O ATOM 933 CB VAL A 62 62.997 -13.555 -12.661 1.00 1.00 C ATOM 934 CG1 VAL A 62 63.414 -12.148 -13.081 1.00 1.00 C ATOM 935 CG2 VAL A 62 61.956 -14.095 -13.661 1.00 1.00 C ATOM 0 H VAL A 62 64.297 -14.283 -14.713 1.00 1.00 H new ATOM 0 HA VAL A 62 65.050 -13.885 -12.122 1.00 1.00 H new ATOM 0 HB VAL A 62 62.539 -13.546 -11.672 1.00 1.00 H new ATOM 0 HG11 VAL A 62 62.535 -11.505 -13.122 1.00 1.00 H new ATOM 0 HG12 VAL A 62 64.123 -11.747 -12.357 1.00 1.00 H new ATOM 0 HG13 VAL A 62 63.882 -12.186 -14.065 1.00 1.00 H new ATOM 0 HG21 VAL A 62 61.086 -13.439 -13.670 1.00 1.00 H new ATOM 0 HG22 VAL A 62 62.394 -14.130 -14.659 1.00 1.00 H new ATOM 0 HG23 VAL A 62 61.651 -15.098 -13.363 1.00 1.00 H new ATOM 945 N ALA A 63 63.195 -16.580 -12.347 1.00 1.00 N ATOM 946 CA ALA A 63 62.891 -17.787 -11.656 1.00 1.00 C ATOM 947 C ALA A 63 64.161 -18.615 -11.498 1.00 1.00 C ATOM 948 O ALA A 63 64.481 -19.072 -10.396 1.00 1.00 O ATOM 949 CB ALA A 63 61.854 -18.554 -12.473 1.00 1.00 C ATOM 0 H ALA A 63 62.758 -16.488 -13.264 1.00 1.00 H new ATOM 0 HA ALA A 63 62.493 -17.573 -10.664 1.00 1.00 H new ATOM 0 HB1 ALA A 63 61.605 -19.484 -11.963 1.00 1.00 H new ATOM 0 HB2 ALA A 63 60.955 -17.947 -12.581 1.00 1.00 H new ATOM 0 HB3 ALA A 63 62.261 -18.779 -13.459 1.00 1.00 H new ATOM 955 N HIS A 64 64.899 -18.758 -12.610 1.00 1.00 N ATOM 956 CA HIS A 64 66.152 -19.531 -12.595 1.00 1.00 C ATOM 957 C HIS A 64 67.108 -18.995 -11.501 1.00 1.00 C ATOM 958 O HIS A 64 67.486 -19.716 -10.574 1.00 1.00 O ATOM 959 CB HIS A 64 66.792 -19.447 -14.007 1.00 1.00 C ATOM 960 CG HIS A 64 66.879 -20.798 -14.675 1.00 1.00 C ATOM 961 ND1 HIS A 64 68.086 -21.352 -15.065 1.00 1.00 N ATOM 962 CD2 HIS A 64 65.913 -21.695 -15.062 1.00 1.00 C ATOM 963 CE1 HIS A 64 67.821 -22.530 -15.658 1.00 1.00 C ATOM 964 NE2 HIS A 64 66.512 -22.788 -15.682 1.00 1.00 N ATOM 0 H HIS A 64 64.656 -18.357 -13.516 1.00 1.00 H new ATOM 0 HA HIS A 64 65.951 -20.575 -12.354 1.00 1.00 H new ATOM 0 HB2 HIS A 64 66.205 -18.772 -14.630 1.00 1.00 H new ATOM 0 HB3 HIS A 64 67.791 -19.018 -13.926 1.00 1.00 H new ATOM 0 HD2 HIS A 64 64.851 -21.571 -14.909 1.00 1.00 H new ATOM 0 HE1 HIS A 64 68.576 -23.187 -16.065 1.00 1.00 H new ATOM 0 HE2 HIS A 64 66.050 -23.610 -16.071 1.00 1.00 H new ATOM 972 N ASP A 65 67.483 -17.730 -11.589 1.00 1.00 N ATOM 973 CA ASP A 65 68.352 -17.156 -10.572 1.00 1.00 C ATOM 974 C ASP A 65 67.569 -17.080 -9.256 1.00 1.00 C ATOM 975 O ASP A 65 68.022 -17.548 -8.197 1.00 1.00 O ATOM 976 CB ASP A 65 68.812 -15.749 -10.971 1.00 1.00 C ATOM 977 CG ASP A 65 69.961 -15.833 -11.977 1.00 1.00 C ATOM 978 OD1 ASP A 65 70.107 -16.875 -12.593 1.00 1.00 O ATOM 979 OD2 ASP A 65 70.680 -14.854 -12.113 1.00 1.00 O ATOM 0 H ASP A 65 67.208 -17.092 -12.336 1.00 1.00 H new ATOM 0 HA ASP A 65 69.236 -17.783 -10.462 1.00 1.00 H new ATOM 0 HB2 ASP A 65 67.979 -15.196 -11.405 1.00 1.00 H new ATOM 0 HB3 ASP A 65 69.133 -15.199 -10.086 1.00 1.00 H new ATOM 984 N GLY A 66 66.359 -16.518 -9.318 1.00 1.00 N ATOM 985 CA GLY A 66 65.492 -16.396 -8.151 1.00 1.00 C ATOM 986 C GLY A 66 65.087 -17.749 -7.597 1.00 1.00 C ATOM 987 O GLY A 66 64.034 -17.893 -6.990 1.00 1.00 O ATOM 0 H GLY A 66 65.958 -16.138 -10.175 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.006 -15.827 -7.376 1.00 1.00 H new ATOM 0 HA3 GLY A 66 64.599 -15.833 -8.421 1.00 1.00 H new ATOM 991 N ARG A 67 65.956 -18.712 -7.765 1.00 1.00 N ATOM 992 CA ARG A 67 65.759 -20.032 -7.222 1.00 1.00 C ATOM 993 C ARG A 67 66.114 -19.999 -5.748 1.00 1.00 C ATOM 994 O ARG A 67 66.031 -21.027 -5.079 1.00 1.00 O ATOM 995 CB ARG A 67 66.662 -21.060 -7.879 1.00 1.00 C ATOM 996 CG ARG A 67 66.070 -21.540 -9.199 1.00 1.00 C ATOM 997 CD ARG A 67 64.912 -22.513 -8.971 1.00 1.00 C ATOM 998 NE ARG A 67 64.783 -23.359 -10.148 1.00 1.00 N ATOM 999 CZ ARG A 67 64.295 -24.588 -10.073 1.00 1.00 C ATOM 1000 NH1 ARG A 67 63.912 -25.076 -8.924 1.00 1.00 N ATOM 1001 NH2 ARG A 67 64.208 -25.309 -11.152 1.00 1.00 N ATOM 0 H ARG A 67 66.826 -18.602 -8.286 1.00 1.00 H new ATOM 0 HA ARG A 67 64.720 -20.312 -7.397 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.647 -20.626 -8.054 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.802 -21.908 -7.209 1.00 1.00 H new ATOM 0 HG2 ARG A 67 65.719 -20.684 -9.775 1.00 1.00 H new ATOM 0 HG3 ARG A 67 66.845 -22.027 -9.791 1.00 1.00 H new ATOM 0 HD2 ARG A 67 65.097 -23.121 -8.085 1.00 1.00 H new ATOM 0 HD3 ARG A 67 63.986 -21.966 -8.794 1.00 1.00 H new ATOM 0 HE ARG A 67 65.076 -22.996 -11.055 1.00 1.00 H new ATOM 0 HH11 ARG A 67 63.988 -24.510 -8.079 1.00 1.00 H new ATOM 0 HH12 ARG A 67 63.537 -26.023 -8.872 1.00 1.00 H new ATOM 0 HH21 ARG A 67 64.514 -24.927 -12.047 1.00 1.00 H new ATOM 0 HH22 ARG A 67 63.833 -26.256 -11.103 1.00 1.00 H new ATOM 1015 N LEU A 68 66.582 -18.830 -5.265 1.00 1.00 N ATOM 1016 CA LEU A 68 67.015 -18.730 -3.856 1.00 1.00 C ATOM 1017 C LEU A 68 66.097 -19.599 -3.003 1.00 1.00 C ATOM 1018 O LEU A 68 66.482 -20.091 -1.953 1.00 1.00 O ATOM 1019 CB LEU A 68 67.003 -17.289 -3.288 1.00 1.00 C ATOM 1020 CG LEU A 68 65.568 -16.752 -3.118 1.00 1.00 C ATOM 1021 CD1 LEU A 68 65.611 -15.366 -2.479 1.00 1.00 C ATOM 1022 CD2 LEU A 68 64.903 -16.648 -4.481 1.00 1.00 C ATOM 0 H LEU A 68 66.668 -17.970 -5.807 1.00 1.00 H new ATOM 0 HA LEU A 68 68.051 -19.066 -3.824 1.00 1.00 H new ATOM 0 HB2 LEU A 68 67.513 -17.274 -2.325 1.00 1.00 H new ATOM 0 HB3 LEU A 68 67.561 -16.631 -3.954 1.00 1.00 H new ATOM 0 HG LEU A 68 65.003 -17.432 -2.481 1.00 1.00 H new ATOM 0 HD11 LEU A 68 64.595 -14.989 -2.360 1.00 1.00 H new ATOM 0 HD12 LEU A 68 66.091 -15.430 -1.503 1.00 1.00 H new ATOM 0 HD13 LEU A 68 66.177 -14.688 -3.118 1.00 1.00 H new ATOM 0 HD21 LEU A 68 63.888 -16.268 -4.363 1.00 1.00 H new ATOM 0 HD22 LEU A 68 65.473 -15.968 -5.113 1.00 1.00 H new ATOM 0 HD23 LEU A 68 64.870 -17.633 -4.946 1.00 1.00 H new ATOM 1034 N LEU A 69 64.858 -19.727 -3.459 1.00 1.00 N ATOM 1035 CA LEU A 69 63.874 -20.514 -2.707 1.00 1.00 C ATOM 1036 C LEU A 69 64.177 -22.019 -2.800 1.00 1.00 C ATOM 1037 O LEU A 69 64.573 -22.626 -1.805 1.00 1.00 O ATOM 1038 CB LEU A 69 62.470 -20.240 -3.291 1.00 1.00 C ATOM 1039 CG LEU A 69 62.486 -20.305 -4.863 1.00 1.00 C ATOM 1040 CD1 LEU A 69 61.629 -21.480 -5.374 1.00 1.00 C ATOM 1041 CD2 LEU A 69 61.913 -19.000 -5.451 1.00 1.00 C ATOM 0 H LEU A 69 64.511 -19.310 -4.323 1.00 1.00 H new ATOM 0 HA LEU A 69 63.919 -20.222 -1.658 1.00 1.00 H new ATOM 0 HB2 LEU A 69 61.762 -20.971 -2.901 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.124 -19.258 -2.968 1.00 1.00 H new ATOM 0 HG LEU A 69 63.520 -20.443 -5.179 1.00 1.00 H new ATOM 0 HD11 LEU A 69 61.656 -21.503 -6.463 1.00 1.00 H new ATOM 0 HD12 LEU A 69 62.024 -22.417 -4.981 1.00 1.00 H new ATOM 0 HD13 LEU A 69 60.600 -21.352 -5.039 1.00 1.00 H new ATOM 0 HD21 LEU A 69 61.928 -19.054 -6.540 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.887 -18.866 -5.108 1.00 1.00 H new ATOM 0 HD23 LEU A 69 62.518 -18.156 -5.121 1.00 1.00 H new ATOM 1053 N ALA A 70 63.997 -22.628 -3.978 1.00 1.00 N ATOM 1054 CA ALA A 70 64.267 -24.062 -4.089 1.00 1.00 C ATOM 1055 C ALA A 70 65.772 -24.285 -4.149 1.00 1.00 C ATOM 1056 O ALA A 70 66.390 -24.676 -3.161 1.00 1.00 O ATOM 1057 CB ALA A 70 63.614 -24.570 -5.388 1.00 1.00 C ATOM 0 H ALA A 70 63.679 -22.172 -4.833 1.00 1.00 H new ATOM 0 HA ALA A 70 63.863 -24.598 -3.230 1.00 1.00 H new ATOM 0 HB1 ALA A 70 63.801 -25.639 -5.495 1.00 1.00 H new ATOM 0 HB2 ALA A 70 62.539 -24.391 -5.349 1.00 1.00 H new ATOM 0 HB3 ALA A 70 64.039 -24.040 -6.240 1.00 1.00 H new ATOM 1063 N ALA A 71 66.350 -24.047 -5.313 1.00 1.00 N ATOM 1064 CA ALA A 71 67.769 -24.220 -5.577 1.00 1.00 C ATOM 1065 C ALA A 71 68.656 -23.373 -4.669 1.00 1.00 C ATOM 1066 O ALA A 71 69.834 -23.175 -4.956 1.00 1.00 O ATOM 1067 CB ALA A 71 68.058 -24.071 -7.077 1.00 1.00 C ATOM 0 H ALA A 71 65.829 -23.718 -6.126 1.00 1.00 H new ATOM 0 HA ALA A 71 68.043 -25.241 -5.311 1.00 1.00 H new ATOM 0 HB1 ALA A 71 69.125 -24.203 -7.257 1.00 1.00 H new ATOM 0 HB2 ALA A 71 67.500 -24.825 -7.632 1.00 1.00 H new ATOM 0 HB3 ALA A 71 67.755 -23.078 -7.409 1.00 1.00 H new ATOM 1073 N HIS A 72 68.054 -22.823 -3.614 1.00 1.00 N ATOM 1074 CA HIS A 72 68.738 -21.938 -2.670 1.00 1.00 C ATOM 1075 C HIS A 72 70.267 -22.046 -2.735 1.00 1.00 C ATOM 1076 O HIS A 72 70.945 -21.049 -2.976 1.00 1.00 O ATOM 1077 CB HIS A 72 68.276 -22.361 -1.234 1.00 1.00 C ATOM 1078 CG HIS A 72 69.470 -22.501 -0.324 1.00 1.00 C ATOM 1079 ND1 HIS A 72 70.394 -21.479 -0.185 1.00 1.00 N ATOM 1080 CD2 HIS A 72 69.980 -23.566 0.368 1.00 1.00 C ATOM 1081 CE1 HIS A 72 71.415 -21.951 0.546 1.00 1.00 C ATOM 1082 NE2 HIS A 72 71.219 -23.221 0.905 1.00 1.00 N ATOM 0 H HIS A 72 67.072 -22.980 -3.389 1.00 1.00 H new ATOM 0 HA HIS A 72 68.483 -20.908 -2.920 1.00 1.00 H new ATOM 0 HB2 HIS A 72 67.588 -21.618 -0.832 1.00 1.00 H new ATOM 0 HB3 HIS A 72 67.733 -23.305 -1.282 1.00 1.00 H new ATOM 0 HD2 HIS A 72 69.497 -24.525 0.481 1.00 1.00 H new ATOM 0 HE1 HIS A 72 72.288 -21.374 0.811 1.00 1.00 H new ATOM 0 HE2 HIS A 72 71.842 -23.813 1.455 1.00 1.00 H new ATOM 1090 N MET A 73 70.808 -23.220 -2.481 1.00 1.00 N ATOM 1091 CA MET A 73 72.251 -23.365 -2.483 1.00 1.00 C ATOM 1092 C MET A 73 72.835 -23.118 -3.880 1.00 1.00 C ATOM 1093 O MET A 73 73.795 -22.361 -4.024 1.00 1.00 O ATOM 1094 CB MET A 73 72.624 -24.759 -1.962 1.00 1.00 C ATOM 1095 CG MET A 73 71.630 -25.813 -2.498 1.00 1.00 C ATOM 1096 SD MET A 73 70.274 -26.043 -1.323 1.00 1.00 S ATOM 1097 CE MET A 73 69.116 -26.852 -2.453 1.00 1.00 C ATOM 0 H MET A 73 70.285 -24.071 -2.275 1.00 1.00 H new ATOM 0 HA MET A 73 72.682 -22.613 -1.822 1.00 1.00 H new ATOM 0 HB2 MET A 73 73.637 -25.013 -2.274 1.00 1.00 H new ATOM 0 HB3 MET A 73 72.616 -24.762 -0.872 1.00 1.00 H new ATOM 0 HG2 MET A 73 71.235 -25.494 -3.463 1.00 1.00 H new ATOM 0 HG3 MET A 73 72.145 -26.760 -2.661 1.00 1.00 H new ATOM 0 HE1 MET A 73 68.193 -27.086 -1.922 1.00 1.00 H new ATOM 0 HE2 MET A 73 68.896 -26.186 -3.287 1.00 1.00 H new ATOM 0 HE3 MET A 73 69.560 -27.773 -2.831 1.00 1.00 H new ATOM 1107 N VAL A 74 72.336 -23.831 -4.895 1.00 1.00 N ATOM 1108 CA VAL A 74 72.938 -23.721 -6.225 1.00 1.00 C ATOM 1109 C VAL A 74 73.223 -22.261 -6.585 1.00 1.00 C ATOM 1110 O VAL A 74 74.320 -21.987 -7.029 1.00 1.00 O ATOM 1111 CB VAL A 74 72.071 -24.409 -7.304 1.00 1.00 C ATOM 1112 CG1 VAL A 74 71.241 -25.525 -6.665 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.143 -23.402 -7.991 1.00 1.00 C ATOM 0 H VAL A 74 71.544 -24.470 -4.826 1.00 1.00 H new ATOM 0 HA VAL A 74 73.892 -24.247 -6.195 1.00 1.00 H new ATOM 0 HB VAL A 74 72.735 -24.831 -8.058 1.00 1.00 H new ATOM 0 HG11 VAL A 74 70.631 -26.008 -7.429 1.00 1.00 H new ATOM 0 HG12 VAL A 74 71.907 -26.261 -6.214 1.00 1.00 H new ATOM 0 HG13 VAL A 74 70.593 -25.102 -5.897 1.00 1.00 H new ATOM 0 HG21 VAL A 74 70.545 -23.914 -8.745 1.00 1.00 H new ATOM 0 HG22 VAL A 74 70.483 -22.951 -7.250 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.739 -22.624 -8.468 1.00 1.00 H new ATOM 1123 N ASN A 75 72.287 -21.323 -6.375 1.00 1.00 N ATOM 1124 CA ASN A 75 72.536 -19.893 -6.675 1.00 1.00 C ATOM 1125 C ASN A 75 73.996 -19.521 -6.312 1.00 1.00 C ATOM 1126 O ASN A 75 74.622 -18.601 -6.875 1.00 1.00 O ATOM 1127 CB ASN A 75 71.546 -19.066 -5.816 1.00 1.00 C ATOM 1128 CG ASN A 75 70.777 -18.046 -6.652 1.00 1.00 C ATOM 1129 OD1 ASN A 75 70.441 -18.302 -7.808 1.00 1.00 O ATOM 1130 ND2 ASN A 75 70.469 -16.901 -6.113 1.00 1.00 N ATOM 0 H ASN A 75 71.358 -21.519 -6.003 1.00 1.00 H new ATOM 0 HA ASN A 75 72.391 -19.688 -7.736 1.00 1.00 H new ATOM 0 HB2 ASN A 75 70.842 -19.738 -5.327 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.094 -18.550 -5.028 1.00 1.00 H new ATOM 0 HD21 ASN A 75 69.946 -16.209 -6.649 1.00 1.00 H new ATOM 0 HD22 ASN A 75 70.751 -16.696 -5.154 1.00 1.00 H new ATOM 1137 N GLY A 76 74.564 -20.334 -5.441 1.00 1.00 N ATOM 1138 CA GLY A 76 75.954 -20.185 -5.076 1.00 1.00 C ATOM 1139 C GLY A 76 76.764 -20.078 -6.368 1.00 1.00 C ATOM 1140 O GLY A 76 77.896 -19.650 -6.372 1.00 1.00 O ATOM 0 H GLY A 76 74.082 -21.103 -4.975 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.095 -19.296 -4.461 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.288 -21.038 -4.485 1.00 1.00 H new ATOM 1144 N ILE A 77 76.161 -20.554 -7.461 1.00 1.00 N ATOM 1145 CA ILE A 77 76.830 -20.569 -8.759 1.00 1.00 C ATOM 1146 C ILE A 77 77.288 -19.177 -9.174 1.00 1.00 C ATOM 1147 O ILE A 77 78.434 -19.015 -9.561 1.00 1.00 O ATOM 1148 CB ILE A 77 75.926 -21.138 -9.878 1.00 1.00 C ATOM 1149 CG1 ILE A 77 74.557 -20.447 -9.835 1.00 1.00 C ATOM 1150 CG2 ILE A 77 75.765 -22.656 -9.748 1.00 1.00 C ATOM 1151 CD1 ILE A 77 73.611 -21.086 -10.856 1.00 1.00 C ATOM 0 H ILE A 77 75.214 -20.932 -7.470 1.00 1.00 H new ATOM 0 HA ILE A 77 77.696 -21.219 -8.634 1.00 1.00 H new ATOM 0 HB ILE A 77 76.401 -20.940 -10.839 1.00 1.00 H new ATOM 0 HG12 ILE A 77 74.132 -20.527 -8.834 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.671 -19.384 -10.049 1.00 1.00 H new ATOM 0 HG21 ILE A 77 75.124 -23.024 -10.549 1.00 1.00 H new ATOM 0 HG22 ILE A 77 76.743 -23.133 -9.817 1.00 1.00 H new ATOM 0 HG23 ILE A 77 75.313 -22.893 -8.785 1.00 1.00 H new ATOM 0 HD11 ILE A 77 72.642 -20.587 -10.816 1.00 1.00 H new ATOM 0 HD12 ILE A 77 74.032 -20.983 -11.856 1.00 1.00 H new ATOM 0 HD13 ILE A 77 73.485 -22.143 -10.623 1.00 1.00 H new ATOM 1163 N VAL A 78 76.430 -18.155 -9.059 1.00 1.00 N ATOM 1164 CA VAL A 78 76.805 -16.803 -9.433 1.00 1.00 C ATOM 1165 C VAL A 78 78.181 -16.429 -8.935 1.00 1.00 C ATOM 1166 O VAL A 78 78.786 -15.483 -9.434 1.00 1.00 O ATOM 1167 CB VAL A 78 75.771 -15.841 -8.858 1.00 1.00 C ATOM 1168 CG1 VAL A 78 76.125 -14.402 -9.240 1.00 1.00 C ATOM 1169 CG2 VAL A 78 74.397 -16.210 -9.419 1.00 1.00 C ATOM 0 H VAL A 78 75.476 -18.248 -8.710 1.00 1.00 H new ATOM 0 HA VAL A 78 76.834 -16.744 -10.521 1.00 1.00 H new ATOM 0 HB VAL A 78 75.759 -15.916 -7.771 1.00 1.00 H new ATOM 0 HG11 VAL A 78 75.381 -13.722 -8.825 1.00 1.00 H new ATOM 0 HG12 VAL A 78 77.108 -14.151 -8.842 1.00 1.00 H new ATOM 0 HG13 VAL A 78 76.138 -14.307 -10.326 1.00 1.00 H new ATOM 0 HG21 VAL A 78 73.645 -15.531 -9.017 1.00 1.00 H new ATOM 0 HG22 VAL A 78 74.414 -16.130 -10.506 1.00 1.00 H new ATOM 0 HG23 VAL A 78 74.151 -17.233 -9.135 1.00 1.00 H new ATOM 1179 N ILE A 79 78.685 -17.173 -7.963 1.00 1.00 N ATOM 1180 CA ILE A 79 80.028 -16.870 -7.436 1.00 1.00 C ATOM 1181 C ILE A 79 81.140 -17.647 -8.171 1.00 1.00 C ATOM 1182 O ILE A 79 82.207 -17.112 -8.459 1.00 1.00 O ATOM 1183 CB ILE A 79 80.104 -17.174 -5.916 1.00 1.00 C ATOM 1184 CG1 ILE A 79 80.545 -18.651 -5.674 1.00 1.00 C ATOM 1185 CG2 ILE A 79 78.725 -16.875 -5.307 1.00 1.00 C ATOM 1186 CD1 ILE A 79 80.367 -19.075 -4.216 1.00 1.00 C ATOM 0 H ILE A 79 78.213 -17.966 -7.528 1.00 1.00 H new ATOM 0 HA ILE A 79 80.194 -15.806 -7.607 1.00 1.00 H new ATOM 0 HB ILE A 79 80.853 -16.546 -5.433 1.00 1.00 H new ATOM 0 HG12 ILE A 79 79.963 -19.312 -6.316 1.00 1.00 H new ATOM 0 HG13 ILE A 79 81.590 -18.768 -5.960 1.00 1.00 H new ATOM 0 HG21 ILE A 79 78.748 -17.080 -4.237 1.00 1.00 H new ATOM 0 HG22 ILE A 79 78.475 -15.827 -5.471 1.00 1.00 H new ATOM 0 HG23 ILE A 79 77.973 -17.506 -5.781 1.00 1.00 H new ATOM 0 HD11 ILE A 79 80.687 -20.110 -4.096 1.00 1.00 H new ATOM 0 HD12 ILE A 79 80.970 -18.432 -3.574 1.00 1.00 H new ATOM 0 HD13 ILE A 79 79.317 -18.985 -3.937 1.00 1.00 H new ATOM 1198 N ALA A 80 80.865 -18.910 -8.476 1.00 1.00 N ATOM 1199 CA ALA A 80 81.842 -19.777 -9.140 1.00 1.00 C ATOM 1200 C ALA A 80 81.909 -19.602 -10.656 1.00 1.00 C ATOM 1201 O ALA A 80 82.923 -19.938 -11.267 1.00 1.00 O ATOM 1202 CB ALA A 80 81.546 -21.237 -8.787 1.00 1.00 C ATOM 0 H ALA A 80 79.972 -19.361 -8.275 1.00 1.00 H new ATOM 0 HA ALA A 80 82.823 -19.480 -8.769 1.00 1.00 H new ATOM 0 HB1 ALA A 80 82.271 -21.885 -9.280 1.00 1.00 H new ATOM 0 HB2 ALA A 80 81.614 -21.371 -7.707 1.00 1.00 H new ATOM 0 HB3 ALA A 80 80.542 -21.496 -9.122 1.00 1.00 H new ATOM 1208 N GLU A 81 80.830 -19.121 -11.277 1.00 1.00 N ATOM 1209 CA GLU A 81 80.828 -18.985 -12.740 1.00 1.00 C ATOM 1210 C GLU A 81 81.284 -17.615 -13.237 1.00 1.00 C ATOM 1211 O GLU A 81 82.386 -17.510 -13.762 1.00 1.00 O ATOM 1212 CB GLU A 81 79.399 -19.259 -13.288 1.00 1.00 C ATOM 1213 CG GLU A 81 78.374 -18.981 -12.186 1.00 1.00 C ATOM 1214 CD GLU A 81 76.989 -18.701 -12.768 1.00 1.00 C ATOM 1215 OE1 GLU A 81 76.270 -19.653 -13.022 1.00 1.00 O ATOM 1216 OE2 GLU A 81 76.655 -17.534 -12.915 1.00 1.00 O ATOM 0 H GLU A 81 79.972 -18.827 -10.811 1.00 1.00 H new ATOM 0 HA GLU A 81 81.548 -19.715 -13.109 1.00 1.00 H new ATOM 0 HB2 GLU A 81 79.201 -18.626 -14.153 1.00 1.00 H new ATOM 0 HB3 GLU A 81 79.318 -20.293 -13.624 1.00 1.00 H new ATOM 0 HG2 GLU A 81 78.321 -19.837 -11.513 1.00 1.00 H new ATOM 0 HG3 GLU A 81 78.700 -18.127 -11.592 1.00 1.00 H new ATOM 1223 N ASP A 82 80.453 -16.565 -13.117 1.00 1.00 N ATOM 1224 CA ASP A 82 80.843 -15.253 -13.622 1.00 1.00 C ATOM 1225 C ASP A 82 81.533 -14.342 -12.608 1.00 1.00 C ATOM 1226 O ASP A 82 82.181 -13.396 -13.016 1.00 1.00 O ATOM 1227 CB ASP A 82 79.609 -14.569 -14.204 1.00 1.00 C ATOM 1228 CG ASP A 82 79.182 -15.292 -15.479 1.00 1.00 C ATOM 1229 OD1 ASP A 82 79.673 -14.928 -16.533 1.00 1.00 O ATOM 1230 OD2 ASP A 82 78.399 -16.223 -15.376 1.00 1.00 O ATOM 0 H ASP A 82 79.530 -16.603 -12.684 1.00 1.00 H new ATOM 0 HA ASP A 82 81.601 -15.429 -14.385 1.00 1.00 H new ATOM 0 HB2 ASP A 82 78.797 -14.580 -13.477 1.00 1.00 H new ATOM 0 HB3 ASP A 82 79.828 -13.524 -14.422 1.00 1.00 H new ATOM 1235 N ALA A 83 81.349 -14.558 -11.301 1.00 1.00 N ATOM 1236 CA ALA A 83 81.946 -13.622 -10.351 1.00 1.00 C ATOM 1237 C ALA A 83 83.458 -13.536 -10.505 1.00 1.00 C ATOM 1238 O ALA A 83 84.019 -12.450 -10.393 1.00 1.00 O ATOM 1239 CB ALA A 83 81.572 -13.969 -8.924 1.00 1.00 C ATOM 0 H ALA A 83 80.820 -15.330 -10.895 1.00 1.00 H new ATOM 0 HA ALA A 83 81.537 -12.638 -10.581 1.00 1.00 H new ATOM 0 HB1 ALA A 83 82.032 -13.253 -8.243 1.00 1.00 H new ATOM 0 HB2 ALA A 83 80.488 -13.931 -8.812 1.00 1.00 H new ATOM 0 HB3 ALA A 83 81.926 -14.973 -8.689 1.00 1.00 H new ATOM 1245 N LEU A 84 84.126 -14.664 -10.721 1.00 1.00 N ATOM 1246 CA LEU A 84 85.582 -14.662 -10.846 1.00 1.00 C ATOM 1247 C LEU A 84 86.105 -13.480 -11.675 1.00 1.00 C ATOM 1248 O LEU A 84 87.299 -13.168 -11.643 1.00 1.00 O ATOM 1249 CB LEU A 84 86.059 -16.019 -11.412 1.00 1.00 C ATOM 1250 CG LEU A 84 85.881 -16.145 -12.951 1.00 1.00 C ATOM 1251 CD1 LEU A 84 84.466 -15.738 -13.388 1.00 1.00 C ATOM 1252 CD2 LEU A 84 86.928 -15.293 -13.707 1.00 1.00 C ATOM 0 H LEU A 84 83.691 -15.582 -10.813 1.00 1.00 H new ATOM 0 HA LEU A 84 86.004 -14.529 -9.850 1.00 1.00 H new ATOM 0 HB2 LEU A 84 87.111 -16.158 -11.163 1.00 1.00 H new ATOM 0 HB3 LEU A 84 85.507 -16.822 -10.923 1.00 1.00 H new ATOM 0 HG LEU A 84 86.033 -17.194 -13.205 1.00 1.00 H new ATOM 0 HD11 LEU A 84 84.376 -15.838 -14.470 1.00 1.00 H new ATOM 0 HD12 LEU A 84 83.735 -16.384 -12.902 1.00 1.00 H new ATOM 0 HD13 LEU A 84 84.281 -14.702 -13.103 1.00 1.00 H new ATOM 0 HD21 LEU A 84 86.778 -15.401 -14.781 1.00 1.00 H new ATOM 0 HD22 LEU A 84 86.814 -14.245 -13.429 1.00 1.00 H new ATOM 0 HD23 LEU A 84 87.930 -15.631 -13.444 1.00 1.00 H new ATOM 1264 N ILE A 85 85.214 -12.818 -12.403 1.00 1.00 N ATOM 1265 CA ILE A 85 85.594 -11.675 -13.229 1.00 1.00 C ATOM 1266 C ILE A 85 85.496 -10.350 -12.459 1.00 1.00 C ATOM 1267 O ILE A 85 86.383 -9.502 -12.559 1.00 1.00 O ATOM 1268 CB ILE A 85 84.677 -11.631 -14.463 1.00 1.00 C ATOM 1269 CG1 ILE A 85 85.312 -10.752 -15.552 1.00 1.00 C ATOM 1270 CG2 ILE A 85 83.287 -11.063 -14.089 1.00 1.00 C ATOM 1271 CD1 ILE A 85 84.284 -10.480 -16.659 1.00 1.00 C ATOM 0 H ILE A 85 84.222 -13.052 -12.439 1.00 1.00 H new ATOM 0 HA ILE A 85 86.635 -11.798 -13.528 1.00 1.00 H new ATOM 0 HB ILE A 85 84.553 -12.647 -14.837 1.00 1.00 H new ATOM 0 HG12 ILE A 85 85.654 -9.811 -15.121 1.00 1.00 H new ATOM 0 HG13 ILE A 85 86.188 -11.249 -15.969 1.00 1.00 H new ATOM 0 HG21 ILE A 85 82.653 -11.040 -14.975 1.00 1.00 H new ATOM 0 HG22 ILE A 85 82.827 -11.696 -13.330 1.00 1.00 H new ATOM 0 HG23 ILE A 85 83.400 -10.052 -13.698 1.00 1.00 H new ATOM 0 HD11 ILE A 85 84.736 -9.857 -17.430 1.00 1.00 H new ATOM 0 HD12 ILE A 85 83.963 -11.425 -17.098 1.00 1.00 H new ATOM 0 HD13 ILE A 85 83.421 -9.965 -16.236 1.00 1.00 H new ATOM 1283 N ALA A 86 84.408 -10.175 -11.706 1.00 1.00 N ATOM 1284 CA ALA A 86 84.180 -8.951 -10.944 1.00 1.00 C ATOM 1285 C ALA A 86 84.681 -9.089 -9.508 1.00 1.00 C ATOM 1286 O ALA A 86 84.974 -8.095 -8.848 1.00 1.00 O ATOM 1287 CB ALA A 86 82.683 -8.640 -10.961 1.00 1.00 C ATOM 0 H ALA A 86 83.669 -10.871 -11.609 1.00 1.00 H new ATOM 0 HA ALA A 86 84.737 -8.134 -11.403 1.00 1.00 H new ATOM 0 HB1 ALA A 86 82.495 -7.727 -10.396 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.351 -8.504 -11.990 1.00 1.00 H new ATOM 0 HB3 ALA A 86 82.135 -9.467 -10.509 1.00 1.00 H new ATOM 1293 N GLU A 87 84.772 -10.329 -9.031 1.00 1.00 N ATOM 1294 CA GLU A 87 85.241 -10.598 -7.674 1.00 1.00 C ATOM 1295 C GLU A 87 86.764 -10.623 -7.664 1.00 1.00 C ATOM 1296 O GLU A 87 87.402 -10.337 -6.650 1.00 1.00 O ATOM 1297 CB GLU A 87 84.643 -11.949 -7.184 1.00 1.00 C ATOM 1298 CG GLU A 87 85.595 -12.725 -6.243 1.00 1.00 C ATOM 1299 CD GLU A 87 86.770 -13.342 -7.009 1.00 1.00 C ATOM 1300 OE1 GLU A 87 86.809 -13.194 -8.218 1.00 1.00 O ATOM 1301 OE2 GLU A 87 87.624 -13.938 -6.369 1.00 1.00 O ATOM 0 H GLU A 87 84.527 -11.163 -9.565 1.00 1.00 H new ATOM 0 HA GLU A 87 84.911 -9.813 -6.993 1.00 1.00 H new ATOM 0 HB2 GLU A 87 83.704 -11.757 -6.665 1.00 1.00 H new ATOM 0 HB3 GLU A 87 84.408 -12.571 -8.048 1.00 1.00 H new ATOM 0 HG2 GLU A 87 85.975 -12.052 -5.474 1.00 1.00 H new ATOM 0 HG3 GLU A 87 85.040 -13.512 -5.732 1.00 1.00 H new ATOM 1308 N ALA A 88 87.339 -10.962 -8.806 1.00 1.00 N ATOM 1309 CA ALA A 88 88.778 -11.027 -8.916 1.00 1.00 C ATOM 1310 C ALA A 88 89.398 -9.657 -8.684 1.00 1.00 C ATOM 1311 O ALA A 88 90.577 -9.463 -8.982 1.00 1.00 O ATOM 1312 CB ALA A 88 89.180 -11.557 -10.306 1.00 1.00 C ATOM 0 H ALA A 88 86.833 -11.194 -9.661 1.00 1.00 H new ATOM 0 HA ALA A 88 89.150 -11.710 -8.152 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.267 -11.602 -10.378 1.00 1.00 H new ATOM 0 HB2 ALA A 88 88.765 -12.555 -10.449 1.00 1.00 H new ATOM 0 HB3 ALA A 88 88.793 -10.890 -11.076 1.00 1.00 H new ATOM 1318 N VAL A 89 88.631 -8.691 -8.159 1.00 1.00 N ATOM 1319 CA VAL A 89 89.147 -7.350 -7.906 1.00 1.00 C ATOM 1320 C VAL A 89 89.844 -7.280 -6.556 1.00 1.00 C ATOM 1321 O VAL A 89 89.549 -6.397 -5.770 1.00 1.00 O ATOM 1322 CB VAL A 89 88.028 -6.297 -8.002 1.00 1.00 C ATOM 1323 CG1 VAL A 89 88.617 -4.872 -7.878 1.00 1.00 C ATOM 1324 CG2 VAL A 89 87.340 -6.443 -9.366 1.00 1.00 C ATOM 0 H VAL A 89 87.652 -8.819 -7.903 1.00 1.00 H new ATOM 0 HA VAL A 89 89.884 -7.126 -8.678 1.00 1.00 H new ATOM 0 HB VAL A 89 87.314 -6.451 -7.193 1.00 1.00 H new ATOM 0 HG11 VAL A 89 87.813 -4.139 -7.948 1.00 1.00 H new ATOM 0 HG12 VAL A 89 89.120 -4.769 -6.917 1.00 1.00 H new ATOM 0 HG13 VAL A 89 89.333 -4.703 -8.682 1.00 1.00 H new ATOM 0 HG21 VAL A 89 86.543 -5.704 -9.453 1.00 1.00 H new ATOM 0 HG22 VAL A 89 88.069 -6.285 -10.160 1.00 1.00 H new ATOM 0 HG23 VAL A 89 86.918 -7.444 -9.455 1.00 1.00 H new ATOM 1334 N GLY A 90 90.686 -8.281 -6.255 1.00 1.00 N ATOM 1335 CA GLY A 90 91.330 -8.377 -4.929 1.00 1.00 C ATOM 1336 C GLY A 90 91.543 -6.983 -4.313 1.00 1.00 C ATOM 1337 O GLY A 90 91.168 -6.809 -3.153 1.00 1.00 O ATOM 0 H GLY A 90 90.937 -9.029 -6.901 1.00 1.00 H new ATOM 0 HA2 GLY A 90 90.712 -8.981 -4.264 1.00 1.00 H new ATOM 0 HA3 GLY A 90 92.289 -8.886 -5.023 1.00 1.00 H new ATOM 1341 N PRO A 91 91.978 -5.953 -5.039 1.00 1.00 N ATOM 1342 CA PRO A 91 91.977 -4.563 -4.477 1.00 1.00 C ATOM 1343 C PRO A 91 90.665 -4.259 -3.708 1.00 1.00 C ATOM 1344 O PRO A 91 90.497 -3.171 -3.155 1.00 1.00 O ATOM 1345 CB PRO A 91 92.063 -3.680 -5.725 1.00 1.00 C ATOM 1346 CG PRO A 91 92.839 -4.481 -6.724 1.00 1.00 C ATOM 1347 CD PRO A 91 92.605 -5.973 -6.389 1.00 1.00 C ATOM 0 HA PRO A 91 92.787 -4.405 -3.765 1.00 1.00 H new ATOM 0 HB2 PRO A 91 91.070 -3.436 -6.103 1.00 1.00 H new ATOM 0 HB3 PRO A 91 92.562 -2.736 -5.505 1.00 1.00 H new ATOM 0 HG2 PRO A 91 92.508 -4.257 -7.738 1.00 1.00 H new ATOM 0 HG3 PRO A 91 93.900 -4.236 -6.674 1.00 1.00 H new ATOM 0 HD2 PRO A 91 91.954 -6.448 -7.123 1.00 1.00 H new ATOM 0 HD3 PRO A 91 93.541 -6.531 -6.385 1.00 1.00 H new ATOM 1355 N HIS A 92 89.725 -5.218 -3.732 1.00 1.00 N ATOM 1356 CA HIS A 92 88.421 -5.043 -3.100 1.00 1.00 C ATOM 1357 C HIS A 92 88.651 -4.515 -1.696 1.00 1.00 C ATOM 1358 O HIS A 92 87.739 -3.962 -1.081 1.00 1.00 O ATOM 1359 CB HIS A 92 87.614 -6.383 -3.061 1.00 1.00 C ATOM 1360 CG HIS A 92 86.221 -6.197 -3.636 1.00 1.00 C ATOM 1361 ND1 HIS A 92 86.010 -5.841 -4.962 1.00 1.00 N ATOM 1362 CD2 HIS A 92 84.964 -6.338 -3.087 1.00 1.00 C ATOM 1363 CE1 HIS A 92 84.679 -5.786 -5.164 1.00 1.00 C ATOM 1364 NE2 HIS A 92 83.996 -6.081 -4.055 1.00 1.00 N ATOM 0 H HIS A 92 89.851 -6.123 -4.186 1.00 1.00 H new ATOM 0 HA HIS A 92 87.827 -4.337 -3.681 1.00 1.00 H new ATOM 0 HB2 HIS A 92 88.145 -7.148 -3.627 1.00 1.00 H new ATOM 0 HB3 HIS A 92 87.542 -6.739 -2.033 1.00 1.00 H new ATOM 0 HD2 HIS A 92 84.761 -6.607 -2.061 1.00 1.00 H new ATOM 0 HE1 HIS A 92 84.220 -5.534 -6.109 1.00 1.00 H new ATOM 0 HE2 HIS A 92 82.983 -6.112 -3.941 1.00 1.00 H new ATOM 1372 N LEU A 93 89.889 -4.628 -1.210 1.00 1.00 N ATOM 1373 CA LEU A 93 90.220 -4.078 0.087 1.00 1.00 C ATOM 1374 C LEU A 93 89.910 -2.584 0.020 1.00 1.00 C ATOM 1375 O LEU A 93 89.287 -2.032 0.911 1.00 1.00 O ATOM 1376 CB LEU A 93 91.711 -4.286 0.357 1.00 1.00 C ATOM 1377 CG LEU A 93 92.042 -3.960 1.825 1.00 1.00 C ATOM 1378 CD1 LEU A 93 91.824 -5.207 2.689 1.00 1.00 C ATOM 1379 CD2 LEU A 93 93.505 -3.525 1.931 1.00 1.00 C ATOM 0 H LEU A 93 90.661 -5.089 -1.692 1.00 1.00 H new ATOM 0 HA LEU A 93 89.653 -4.560 0.884 1.00 1.00 H new ATOM 0 HB2 LEU A 93 91.987 -5.317 0.136 1.00 1.00 H new ATOM 0 HB3 LEU A 93 92.299 -3.650 -0.305 1.00 1.00 H new ATOM 0 HG LEU A 93 91.392 -3.157 2.172 1.00 1.00 H new ATOM 0 HD11 LEU A 93 92.059 -4.975 3.728 1.00 1.00 H new ATOM 0 HD12 LEU A 93 90.784 -5.524 2.614 1.00 1.00 H new ATOM 0 HD13 LEU A 93 92.474 -6.009 2.340 1.00 1.00 H new ATOM 0 HD21 LEU A 93 93.741 -3.294 2.970 1.00 1.00 H new ATOM 0 HD22 LEU A 93 94.150 -4.331 1.583 1.00 1.00 H new ATOM 0 HD23 LEU A 93 93.667 -2.640 1.316 1.00 1.00 H new ATOM 1391 N ALA A 94 90.408 -1.891 -1.014 1.00 1.00 N ATOM 1392 CA ALA A 94 90.168 -0.451 -1.090 1.00 1.00 C ATOM 1393 C ALA A 94 88.694 -0.214 -0.815 1.00 1.00 C ATOM 1394 O ALA A 94 88.339 0.568 0.069 1.00 1.00 O ATOM 1395 CB ALA A 94 90.520 0.093 -2.478 1.00 1.00 C ATOM 0 H ALA A 94 90.956 -2.287 -1.778 1.00 1.00 H new ATOM 0 HA ALA A 94 90.794 0.063 -0.360 1.00 1.00 H new ATOM 0 HB1 ALA A 94 90.332 1.166 -2.507 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.573 -0.097 -2.687 1.00 1.00 H new ATOM 0 HB3 ALA A 94 89.906 -0.403 -3.230 1.00 1.00 H new ATOM 1401 N ARG A 95 87.832 -0.941 -1.515 1.00 1.00 N ATOM 1402 CA ARG A 95 86.415 -0.841 -1.259 1.00 1.00 C ATOM 1403 C ARG A 95 86.137 -1.268 0.181 1.00 1.00 C ATOM 1404 O ARG A 95 85.176 -0.805 0.790 1.00 1.00 O ATOM 1405 CB ARG A 95 85.647 -1.761 -2.215 1.00 1.00 C ATOM 1406 CG ARG A 95 85.456 -1.085 -3.595 1.00 1.00 C ATOM 1407 CD ARG A 95 85.577 -2.133 -4.714 1.00 1.00 C ATOM 1408 NE ARG A 95 86.981 -2.301 -5.075 1.00 1.00 N ATOM 1409 CZ ARG A 95 87.542 -1.605 -6.061 1.00 1.00 C ATOM 1410 NH1 ARG A 95 86.833 -0.760 -6.756 1.00 1.00 N ATOM 1411 NH2 ARG A 95 88.807 -1.771 -6.332 1.00 1.00 N ATOM 0 H ARG A 95 88.092 -1.596 -2.253 1.00 1.00 H new ATOM 0 HA ARG A 95 86.091 0.188 -1.413 1.00 1.00 H new ATOM 0 HB2 ARG A 95 86.188 -2.699 -2.337 1.00 1.00 H new ATOM 0 HB3 ARG A 95 84.675 -2.007 -1.788 1.00 1.00 H new ATOM 0 HG2 ARG A 95 84.480 -0.603 -3.641 1.00 1.00 H new ATOM 0 HG3 ARG A 95 86.204 -0.304 -3.734 1.00 1.00 H new ATOM 0 HD2 ARG A 95 85.160 -3.084 -4.383 1.00 1.00 H new ATOM 0 HD3 ARG A 95 85.002 -1.819 -5.585 1.00 1.00 H new ATOM 0 HE ARG A 95 87.549 -2.971 -4.557 1.00 1.00 H new ATOM 0 HH11 ARG A 95 85.844 -0.630 -6.545 1.00 1.00 H new ATOM 0 HH12 ARG A 95 87.268 -0.229 -7.511 1.00 1.00 H new ATOM 0 HH21 ARG A 95 89.362 -2.432 -5.789 1.00 1.00 H new ATOM 0 HH22 ARG A 95 89.241 -1.240 -7.087 1.00 1.00 H new ATOM 1425 N ALA A 96 86.978 -2.158 0.740 1.00 1.00 N ATOM 1426 CA ALA A 96 86.723 -2.582 2.130 1.00 1.00 C ATOM 1427 C ALA A 96 86.642 -1.333 2.966 1.00 1.00 C ATOM 1428 O ALA A 96 85.718 -1.143 3.731 1.00 1.00 O ATOM 1429 CB ALA A 96 87.776 -3.528 2.737 1.00 1.00 C ATOM 0 H ALA A 96 87.790 -2.576 0.286 1.00 1.00 H new ATOM 0 HA ALA A 96 85.799 -3.161 2.121 1.00 1.00 H new ATOM 0 HB1 ALA A 96 87.494 -3.778 3.760 1.00 1.00 H new ATOM 0 HB2 ALA A 96 87.832 -4.440 2.143 1.00 1.00 H new ATOM 0 HB3 ALA A 96 88.749 -3.036 2.739 1.00 1.00 H new ATOM 1435 N LEU A 97 87.672 -0.514 2.822 1.00 1.00 N ATOM 1436 CA LEU A 97 87.782 0.727 3.588 1.00 1.00 C ATOM 1437 C LEU A 97 86.340 1.344 3.750 1.00 1.00 C ATOM 1438 O LEU A 97 85.995 1.956 4.774 1.00 1.00 O ATOM 1439 CB LEU A 97 88.749 1.687 2.831 1.00 1.00 C ATOM 1440 CG LEU A 97 89.723 2.398 3.801 1.00 1.00 C ATOM 1441 CD1 LEU A 97 90.797 3.146 3.010 1.00 1.00 C ATOM 1442 CD2 LEU A 97 88.963 3.402 4.663 1.00 1.00 C ATOM 0 H LEU A 97 88.448 -0.683 2.181 1.00 1.00 H new ATOM 0 HA LEU A 97 88.188 0.553 4.584 1.00 1.00 H new ATOM 0 HB2 LEU A 97 89.318 1.123 2.092 1.00 1.00 H new ATOM 0 HB3 LEU A 97 88.170 2.432 2.286 1.00 1.00 H new ATOM 0 HG LEU A 97 90.189 1.644 4.436 1.00 1.00 H new ATOM 0 HD11 LEU A 97 91.478 3.643 3.701 1.00 1.00 H new ATOM 0 HD12 LEU A 97 91.355 2.439 2.396 1.00 1.00 H new ATOM 0 HD13 LEU A 97 90.325 3.890 2.368 1.00 1.00 H new ATOM 0 HD21 LEU A 97 89.657 3.897 5.342 1.00 1.00 H new ATOM 0 HD22 LEU A 97 88.489 4.146 4.023 1.00 1.00 H new ATOM 0 HD23 LEU A 97 88.199 2.881 5.241 1.00 1.00 H new ATOM 1454 N GLY A 98 85.446 1.023 2.799 1.00 1.00 N ATOM 1455 CA GLY A 98 84.030 1.434 2.918 1.00 1.00 C ATOM 1456 C GLY A 98 83.233 0.417 3.775 1.00 1.00 C ATOM 1457 O GLY A 98 82.561 0.732 4.789 1.00 1.00 O ATOM 0 H GLY A 98 85.668 0.493 1.956 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.971 2.424 3.371 1.00 1.00 H new ATOM 0 HA3 GLY A 98 83.584 1.510 1.926 1.00 1.00 H new ATOM 1461 N GLN A 99 83.384 -0.830 3.385 1.00 1.00 N ATOM 1462 CA GLN A 99 82.795 -1.941 4.062 1.00 1.00 C ATOM 1463 C GLN A 99 83.604 -2.193 5.325 1.00 1.00 C ATOM 1464 O GLN A 99 83.395 -3.204 5.997 1.00 1.00 O ATOM 1465 CB GLN A 99 82.757 -3.180 3.158 1.00 1.00 C ATOM 1466 CG GLN A 99 81.915 -2.890 1.904 1.00 1.00 C ATOM 1467 CD GLN A 99 80.462 -2.606 2.280 1.00 1.00 C ATOM 1468 OE1 GLN A 99 79.912 -1.574 1.896 1.00 1.00 O ATOM 1469 NE2 GLN A 99 79.798 -3.469 2.999 1.00 1.00 N ATOM 0 H GLN A 99 83.934 -1.095 2.568 1.00 1.00 H new ATOM 0 HA GLN A 99 81.760 -1.721 4.324 1.00 1.00 H new ATOM 0 HB2 GLN A 99 83.770 -3.461 2.869 1.00 1.00 H new ATOM 0 HB3 GLN A 99 82.335 -4.025 3.702 1.00 1.00 H new ATOM 0 HG2 GLN A 99 82.331 -2.035 1.371 1.00 1.00 H new ATOM 0 HG3 GLN A 99 81.960 -3.742 1.225 1.00 1.00 H new ATOM 0 HE21 GLN A 99 80.253 -4.325 3.318 1.00 1.00 H new ATOM 0 HE22 GLN A 99 78.824 -3.288 3.242 1.00 1.00 H new ATOM 1478 N ILE A 100 84.528 -1.262 5.666 1.00 1.00 N ATOM 1479 CA ILE A 100 85.336 -1.405 6.867 1.00 1.00 C ATOM 1480 C ILE A 100 84.450 -1.418 8.055 1.00 1.00 C ATOM 1481 O ILE A 100 84.482 -2.360 8.850 1.00 1.00 O ATOM 1482 CB ILE A 100 86.309 -0.230 7.017 1.00 1.00 C ATOM 1483 CG1 ILE A 100 87.213 -0.442 8.246 1.00 1.00 C ATOM 1484 CG2 ILE A 100 85.545 1.100 7.189 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.517 0.329 8.042 1.00 1.00 C ATOM 0 H ILE A 100 84.719 -0.420 5.124 1.00 1.00 H new ATOM 0 HA ILE A 100 85.899 -2.335 6.787 1.00 1.00 H new ATOM 0 HB ILE A 100 86.914 -0.183 6.112 1.00 1.00 H new ATOM 0 HG12 ILE A 100 86.709 -0.097 9.149 1.00 1.00 H new ATOM 0 HG13 ILE A 100 87.420 -1.503 8.383 1.00 1.00 H new ATOM 0 HG21 ILE A 100 86.258 1.918 7.293 1.00 1.00 H new ATOM 0 HG22 ILE A 100 84.917 1.275 6.315 1.00 1.00 H new ATOM 0 HG23 ILE A 100 84.920 1.048 8.080 1.00 1.00 H new ATOM 0 HD11 ILE A 100 89.164 0.185 8.907 1.00 1.00 H new ATOM 0 HD12 ILE A 100 89.020 -0.038 7.148 1.00 1.00 H new ATOM 0 HD13 ILE A 100 88.298 1.390 7.925 1.00 1.00 H new ATOM 1497 N VAL A 101 83.632 -0.382 8.210 1.00 1.00 N ATOM 1498 CA VAL A 101 82.761 -0.387 9.362 1.00 1.00 C ATOM 1499 C VAL A 101 81.937 -1.660 9.313 1.00 1.00 C ATOM 1500 O VAL A 101 81.951 -2.447 10.253 1.00 1.00 O ATOM 1501 CB VAL A 101 81.843 0.849 9.402 1.00 1.00 C ATOM 1502 CG1 VAL A 101 81.040 0.985 8.096 1.00 1.00 C ATOM 1503 CG2 VAL A 101 80.882 0.687 10.583 1.00 1.00 C ATOM 0 H VAL A 101 83.558 0.424 7.589 1.00 1.00 H new ATOM 0 HA VAL A 101 83.365 -0.350 10.268 1.00 1.00 H new ATOM 0 HB VAL A 101 82.449 1.748 9.515 1.00 1.00 H new ATOM 0 HG11 VAL A 101 80.401 1.866 8.152 1.00 1.00 H new ATOM 0 HG12 VAL A 101 81.727 1.088 7.256 1.00 1.00 H new ATOM 0 HG13 VAL A 101 80.423 0.097 7.954 1.00 1.00 H new ATOM 0 HG21 VAL A 101 80.219 1.551 10.634 1.00 1.00 H new ATOM 0 HG22 VAL A 101 80.289 -0.218 10.448 1.00 1.00 H new ATOM 0 HG23 VAL A 101 81.453 0.612 11.509 1.00 1.00 H new ATOM 1513 N CYS A 102 81.175 -1.828 8.241 1.00 1.00 N ATOM 1514 CA CYS A 102 80.296 -2.989 8.131 1.00 1.00 C ATOM 1515 C CYS A 102 81.010 -4.276 8.563 1.00 1.00 C ATOM 1516 O CYS A 102 80.374 -5.270 8.882 1.00 1.00 O ATOM 1517 CB CYS A 102 79.773 -3.106 6.675 1.00 1.00 C ATOM 1518 SG CYS A 102 80.679 -4.382 5.751 1.00 1.00 S ATOM 0 H CYS A 102 81.145 -1.189 7.447 1.00 1.00 H new ATOM 0 HA CYS A 102 79.450 -2.851 8.804 1.00 1.00 H new ATOM 0 HB2 CYS A 102 78.710 -3.347 6.686 1.00 1.00 H new ATOM 0 HB3 CYS A 102 79.877 -2.145 6.170 1.00 1.00 H new ATOM 1523 N ARG A 103 82.330 -4.227 8.596 1.00 1.00 N ATOM 1524 CA ARG A 103 83.144 -5.376 9.031 1.00 1.00 C ATOM 1525 C ARG A 103 83.589 -5.271 10.498 1.00 1.00 C ATOM 1526 O ARG A 103 83.627 -6.252 11.238 1.00 1.00 O ATOM 1527 CB ARG A 103 84.349 -5.501 8.100 1.00 1.00 C ATOM 1528 CG ARG A 103 85.410 -6.449 8.689 1.00 1.00 C ATOM 1529 CD ARG A 103 86.261 -7.039 7.551 1.00 1.00 C ATOM 1530 NE ARG A 103 86.301 -6.120 6.415 1.00 1.00 N ATOM 1531 CZ ARG A 103 86.608 -6.558 5.200 1.00 1.00 C ATOM 1532 NH1 ARG A 103 86.967 -7.798 5.037 1.00 1.00 N ATOM 1533 NH2 ARG A 103 86.561 -5.752 4.175 1.00 1.00 N ATOM 0 H ARG A 103 82.874 -3.406 8.328 1.00 1.00 H new ATOM 0 HA ARG A 103 82.528 -6.273 8.972 1.00 1.00 H new ATOM 0 HB2 ARG A 103 84.024 -5.873 7.128 1.00 1.00 H new ATOM 0 HB3 ARG A 103 84.788 -4.517 7.934 1.00 1.00 H new ATOM 0 HG2 ARG A 103 86.046 -5.909 9.390 1.00 1.00 H new ATOM 0 HG3 ARG A 103 84.927 -7.250 9.249 1.00 1.00 H new ATOM 0 HD2 ARG A 103 87.273 -7.231 7.907 1.00 1.00 H new ATOM 0 HD3 ARG A 103 85.846 -7.997 7.237 1.00 1.00 H new ATOM 0 HE ARG A 103 86.091 -5.132 6.557 1.00 1.00 H new ATOM 0 HH11 ARG A 103 87.011 -8.426 5.840 1.00 1.00 H new ATOM 0 HH12 ARG A 103 87.204 -8.142 4.107 1.00 1.00 H new ATOM 0 HH21 ARG A 103 86.287 -4.778 4.304 1.00 1.00 H new ATOM 0 HH22 ARG A 103 86.798 -6.096 3.245 1.00 1.00 H new ATOM 1547 N TYR A 104 83.894 -4.044 10.875 1.00 1.00 N ATOM 1548 CA TYR A 104 84.332 -3.649 12.220 1.00 1.00 C ATOM 1549 C TYR A 104 83.178 -3.007 12.994 1.00 1.00 C ATOM 1550 O TYR A 104 83.397 -2.282 13.964 1.00 1.00 O ATOM 1551 CB TYR A 104 85.553 -2.721 12.193 1.00 1.00 C ATOM 1552 CG TYR A 104 85.883 -2.310 13.621 1.00 1.00 C ATOM 1553 CD1 TYR A 104 86.235 -3.282 14.576 1.00 1.00 C ATOM 1554 CD2 TYR A 104 85.805 -0.964 14.003 1.00 1.00 C ATOM 1555 CE1 TYR A 104 86.507 -2.904 15.898 1.00 1.00 C ATOM 1556 CE2 TYR A 104 86.083 -0.588 15.326 1.00 1.00 C ATOM 1557 CZ TYR A 104 86.433 -1.558 16.273 1.00 1.00 C ATOM 1558 OH TYR A 104 86.699 -1.191 17.579 1.00 1.00 O ATOM 0 H TYR A 104 83.844 -3.254 10.232 1.00 1.00 H new ATOM 0 HA TYR A 104 84.640 -4.559 12.735 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.404 -3.229 11.739 1.00 1.00 H new ATOM 0 HB3 TYR A 104 85.346 -1.841 11.584 1.00 1.00 H new ATOM 0 HD1 TYR A 104 86.296 -4.322 14.290 1.00 1.00 H new ATOM 0 HD2 TYR A 104 85.530 -0.214 13.277 1.00 1.00 H new ATOM 0 HE1 TYR A 104 86.774 -3.653 16.629 1.00 1.00 H new ATOM 0 HE2 TYR A 104 86.027 0.451 15.614 1.00 1.00 H new ATOM 0 HH TYR A 104 86.604 -0.220 17.672 1.00 1.00 H new ATOM 1568 N GLY A 105 81.947 -3.276 12.603 1.00 1.00 N ATOM 1569 CA GLY A 105 80.836 -2.692 13.322 1.00 1.00 C ATOM 1570 C GLY A 105 79.504 -3.262 12.882 1.00 1.00 C ATOM 1571 O GLY A 105 78.517 -3.022 13.558 1.00 1.00 O ATOM 0 H GLY A 105 81.697 -3.876 11.817 1.00 1.00 H new ATOM 0 HA2 GLY A 105 80.967 -2.864 14.390 1.00 1.00 H new ATOM 0 HA3 GLY A 105 80.835 -1.613 13.170 1.00 1.00 H new ATOM 1575 N ALA A 106 79.495 -4.007 11.752 1.00 1.00 N ATOM 1576 CA ALA A 106 78.271 -4.622 11.201 1.00 1.00 C ATOM 1577 C ALA A 106 77.135 -4.669 12.235 1.00 1.00 C ATOM 1578 O ALA A 106 76.738 -5.742 12.691 1.00 1.00 O ATOM 1579 CB ALA A 106 78.607 -6.053 10.695 1.00 1.00 C ATOM 0 H ALA A 106 80.333 -4.196 11.201 1.00 1.00 H new ATOM 0 HA ALA A 106 77.919 -4.007 10.372 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.708 -6.515 10.286 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.370 -5.995 9.919 1.00 1.00 H new ATOM 0 HB3 ALA A 106 78.979 -6.654 11.525 1.00 1.00 H new ATOM 1585 N THR A 107 76.611 -3.496 12.619 1.00 1.00 N ATOM 1586 CA THR A 107 75.537 -3.429 13.599 1.00 1.00 C ATOM 1587 C THR A 107 74.306 -2.818 12.958 1.00 1.00 C ATOM 1588 O THR A 107 73.271 -2.727 13.603 1.00 1.00 O ATOM 1589 CB THR A 107 75.967 -2.632 14.834 1.00 1.00 C ATOM 1590 OG1 THR A 107 74.926 -2.670 15.799 1.00 1.00 O ATOM 1591 CG2 THR A 107 76.259 -1.187 14.449 1.00 1.00 C ATOM 0 H THR A 107 76.917 -2.590 12.264 1.00 1.00 H new ATOM 0 HA THR A 107 75.299 -4.439 13.932 1.00 1.00 H new ATOM 0 HB THR A 107 76.872 -3.074 15.252 1.00 1.00 H new ATOM 0 HG1 THR A 107 74.058 -2.651 15.345 1.00 1.00 H new ATOM 0 HG21 THR A 107 76.564 -0.629 15.334 1.00 1.00 H new ATOM 0 HG22 THR A 107 77.060 -1.162 13.711 1.00 1.00 H new ATOM 0 HG23 THR A 107 75.362 -0.735 14.026 1.00 1.00 H new ATOM 1599 N VAL A 108 74.449 -2.329 11.714 1.00 1.00 N ATOM 1600 CA VAL A 108 73.328 -1.721 10.995 1.00 1.00 C ATOM 1601 C VAL A 108 72.542 -2.812 10.251 1.00 1.00 C ATOM 1602 O VAL A 108 71.746 -2.515 9.360 1.00 1.00 O ATOM 1603 CB VAL A 108 73.826 -0.665 9.993 1.00 1.00 C ATOM 1604 CG1 VAL A 108 74.739 0.328 10.715 1.00 1.00 C ATOM 1605 CG2 VAL A 108 74.605 -1.343 8.862 1.00 1.00 C ATOM 0 H VAL A 108 75.326 -2.345 11.193 1.00 1.00 H new ATOM 0 HA VAL A 108 72.679 -1.228 11.719 1.00 1.00 H new ATOM 0 HB VAL A 108 72.969 -0.139 9.571 1.00 1.00 H new ATOM 0 HG11 VAL A 108 75.093 1.077 10.007 1.00 1.00 H new ATOM 0 HG12 VAL A 108 74.183 0.818 11.515 1.00 1.00 H new ATOM 0 HG13 VAL A 108 75.592 -0.203 11.138 1.00 1.00 H new ATOM 0 HG21 VAL A 108 74.954 -0.588 8.157 1.00 1.00 H new ATOM 0 HG22 VAL A 108 75.461 -1.875 9.278 1.00 1.00 H new ATOM 0 HG23 VAL A 108 73.955 -2.049 8.345 1.00 1.00 H new ATOM 1615 N ILE A 109 72.741 -4.080 10.650 1.00 1.00 N ATOM 1616 CA ILE A 109 72.029 -5.225 10.076 1.00 1.00 C ATOM 1617 C ILE A 109 71.058 -5.942 11.089 1.00 1.00 C ATOM 1618 O ILE A 109 70.226 -6.732 10.663 1.00 1.00 O ATOM 1619 CB ILE A 109 73.076 -6.251 9.593 1.00 1.00 C ATOM 1620 CG1 ILE A 109 73.912 -6.724 10.796 1.00 1.00 C ATOM 1621 CG2 ILE A 109 74.020 -5.610 8.563 1.00 1.00 C ATOM 1622 CD1 ILE A 109 74.807 -7.896 10.385 1.00 1.00 C ATOM 0 H ILE A 109 73.403 -4.336 11.382 1.00 1.00 H new ATOM 0 HA ILE A 109 71.411 -4.844 9.263 1.00 1.00 H new ATOM 0 HB ILE A 109 72.556 -7.091 9.133 1.00 1.00 H new ATOM 0 HG12 ILE A 109 74.524 -5.903 11.170 1.00 1.00 H new ATOM 0 HG13 ILE A 109 73.253 -7.027 11.610 1.00 1.00 H new ATOM 0 HG21 ILE A 109 74.752 -6.347 8.233 1.00 1.00 H new ATOM 0 HG22 ILE A 109 73.442 -5.263 7.706 1.00 1.00 H new ATOM 0 HG23 ILE A 109 74.536 -4.765 9.019 1.00 1.00 H new ATOM 0 HD11 ILE A 109 75.394 -8.223 11.243 1.00 1.00 H new ATOM 0 HD12 ILE A 109 74.188 -8.721 10.033 1.00 1.00 H new ATOM 0 HD13 ILE A 109 75.477 -7.579 9.586 1.00 1.00 H new ATOM 1634 N PRO A 110 71.211 -5.759 12.407 1.00 1.00 N ATOM 1635 CA PRO A 110 70.444 -6.516 13.446 1.00 1.00 C ATOM 1636 C PRO A 110 68.951 -6.456 13.269 1.00 1.00 C ATOM 1637 O PRO A 110 68.269 -7.453 13.508 1.00 1.00 O ATOM 1638 CB PRO A 110 70.880 -5.913 14.799 1.00 1.00 C ATOM 1639 CG PRO A 110 71.531 -4.626 14.456 1.00 1.00 C ATOM 1640 CD PRO A 110 72.063 -4.777 13.030 1.00 1.00 C ATOM 0 HA PRO A 110 70.669 -7.580 13.373 1.00 1.00 H new ATOM 0 HB2 PRO A 110 70.024 -5.759 15.456 1.00 1.00 H new ATOM 0 HB3 PRO A 110 71.569 -6.576 15.323 1.00 1.00 H new ATOM 0 HG2 PRO A 110 70.820 -3.802 14.520 1.00 1.00 H new ATOM 0 HG3 PRO A 110 72.341 -4.403 15.151 1.00 1.00 H new ATOM 0 HD2 PRO A 110 72.027 -3.828 12.494 1.00 1.00 H new ATOM 0 HD3 PRO A 110 73.103 -5.103 13.031 1.00 1.00 H new ATOM 1648 N ASN A 111 68.417 -5.316 12.873 1.00 1.00 N ATOM 1649 CA ASN A 111 66.986 -5.244 12.716 1.00 1.00 C ATOM 1650 C ASN A 111 66.551 -6.209 11.620 1.00 1.00 C ATOM 1651 O ASN A 111 65.861 -7.192 11.891 1.00 1.00 O ATOM 1652 CB ASN A 111 66.607 -3.807 12.349 1.00 1.00 C ATOM 1653 CG ASN A 111 65.120 -3.718 12.058 1.00 1.00 C ATOM 1654 OD1 ASN A 111 64.301 -3.800 12.974 1.00 1.00 O ATOM 1655 ND2 ASN A 111 64.723 -3.559 10.830 1.00 1.00 N ATOM 0 H ASN A 111 68.932 -4.461 12.663 1.00 1.00 H new ATOM 0 HA ASN A 111 66.485 -5.523 13.643 1.00 1.00 H new ATOM 0 HB2 ASN A 111 66.866 -3.134 13.166 1.00 1.00 H new ATOM 0 HB3 ASN A 111 67.176 -3.484 11.477 1.00 1.00 H new ATOM 0 HD21 ASN A 111 63.727 -3.501 10.620 1.00 1.00 H new ATOM 0 HD22 ASN A 111 65.408 -3.492 10.077 1.00 1.00 H new ATOM 1662 N ILE A 112 66.930 -5.908 10.383 1.00 1.00 N ATOM 1663 CA ILE A 112 66.532 -6.749 9.256 1.00 1.00 C ATOM 1664 C ILE A 112 67.127 -8.134 9.407 1.00 1.00 C ATOM 1665 O ILE A 112 66.613 -9.110 8.878 1.00 1.00 O ATOM 1666 CB ILE A 112 67.006 -6.115 7.915 1.00 1.00 C ATOM 1667 CG1 ILE A 112 68.298 -6.799 7.409 1.00 1.00 C ATOM 1668 CG2 ILE A 112 67.284 -4.620 8.121 1.00 1.00 C ATOM 1669 CD1 ILE A 112 68.802 -6.100 6.166 1.00 1.00 C ATOM 0 H ILE A 112 67.503 -5.102 10.135 1.00 1.00 H new ATOM 0 HA ILE A 112 65.445 -6.826 9.245 1.00 1.00 H new ATOM 0 HB ILE A 112 66.218 -6.253 7.175 1.00 1.00 H new ATOM 0 HG12 ILE A 112 69.062 -6.772 8.186 1.00 1.00 H new ATOM 0 HG13 ILE A 112 68.102 -7.849 7.191 1.00 1.00 H new ATOM 0 HG21 ILE A 112 67.616 -4.179 7.181 1.00 1.00 H new ATOM 0 HG22 ILE A 112 66.373 -4.123 8.454 1.00 1.00 H new ATOM 0 HG23 ILE A 112 68.061 -4.495 8.875 1.00 1.00 H new ATOM 0 HD11 ILE A 112 69.712 -6.589 5.817 1.00 1.00 H new ATOM 0 HD12 ILE A 112 68.042 -6.150 5.387 1.00 1.00 H new ATOM 0 HD13 ILE A 112 69.016 -5.057 6.397 1.00 1.00 H new ATOM 1681 N ASN A 113 68.266 -8.189 10.050 1.00 1.00 N ATOM 1682 CA ASN A 113 68.944 -9.458 10.159 1.00 1.00 C ATOM 1683 C ASN A 113 68.055 -10.461 10.847 1.00 1.00 C ATOM 1684 O ASN A 113 67.654 -11.439 10.235 1.00 1.00 O ATOM 1685 CB ASN A 113 70.256 -9.315 10.921 1.00 1.00 C ATOM 1686 CG ASN A 113 70.823 -10.675 11.305 1.00 1.00 C ATOM 1687 OD1 ASN A 113 70.265 -11.355 12.272 1.00 1.00 O flip ATOM 1688 ND2 ASN A 113 71.808 -11.115 10.724 1.00 1.00 N flip ATOM 0 H ASN A 113 68.733 -7.398 10.494 1.00 1.00 H new ATOM 0 HA ASN A 113 69.171 -9.809 9.153 1.00 1.00 H new ATOM 0 HB2 ASN A 113 70.979 -8.777 10.307 1.00 1.00 H new ATOM 0 HB3 ASN A 113 70.094 -8.719 11.819 1.00 1.00 H new ATOM 0 HD21 ASN A 113 72.238 -10.578 9.970 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.198 -12.018 10.994 1.00 1.00 H new ATOM 1695 N ALA A 114 67.716 -10.231 12.101 1.00 1.00 N ATOM 1696 CA ALA A 114 66.870 -11.169 12.803 1.00 1.00 C ATOM 1697 C ALA A 114 65.497 -11.287 12.162 1.00 1.00 C ATOM 1698 O ALA A 114 64.852 -12.326 12.293 1.00 1.00 O ATOM 1699 CB ALA A 114 66.723 -10.742 14.258 1.00 1.00 C ATOM 0 H ALA A 114 68.008 -9.418 12.644 1.00 1.00 H new ATOM 0 HA ALA A 114 67.346 -12.148 12.748 1.00 1.00 H new ATOM 0 HB1 ALA A 114 66.084 -11.452 14.783 1.00 1.00 H new ATOM 0 HB2 ALA A 114 67.705 -10.718 14.731 1.00 1.00 H new ATOM 0 HB3 ALA A 114 66.275 -9.749 14.302 1.00 1.00 H new ATOM 1705 N ALA A 115 65.036 -10.249 11.457 1.00 1.00 N ATOM 1706 CA ALA A 115 63.730 -10.341 10.816 1.00 1.00 C ATOM 1707 C ALA A 115 63.818 -11.176 9.547 1.00 1.00 C ATOM 1708 O ALA A 115 63.129 -12.190 9.422 1.00 1.00 O ATOM 1709 CB ALA A 115 63.228 -8.940 10.477 1.00 1.00 C ATOM 0 H ALA A 115 65.530 -9.367 11.321 1.00 1.00 H new ATOM 0 HA ALA A 115 63.034 -10.823 11.503 1.00 1.00 H new ATOM 0 HB1 ALA A 115 62.251 -9.009 9.998 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.142 -8.353 11.391 1.00 1.00 H new ATOM 0 HB3 ALA A 115 63.931 -8.456 9.799 1.00 1.00 H new ATOM 1715 N ILE A 116 64.654 -10.751 8.590 1.00 1.00 N ATOM 1716 CA ILE A 116 64.774 -11.495 7.350 1.00 1.00 C ATOM 1717 C ILE A 116 65.331 -12.880 7.638 1.00 1.00 C ATOM 1718 O ILE A 116 64.816 -13.877 7.143 1.00 1.00 O ATOM 1719 CB ILE A 116 65.671 -10.737 6.356 1.00 1.00 C ATOM 1720 CG1 ILE A 116 65.081 -9.337 6.134 1.00 1.00 C ATOM 1721 CG2 ILE A 116 65.725 -11.488 5.015 1.00 1.00 C ATOM 1722 CD1 ILE A 116 65.924 -8.574 5.112 1.00 1.00 C ATOM 0 H ILE A 116 65.239 -9.918 8.655 1.00 1.00 H new ATOM 0 HA ILE A 116 63.788 -11.602 6.897 1.00 1.00 H new ATOM 0 HB ILE A 116 66.682 -10.662 6.758 1.00 1.00 H new ATOM 0 HG12 ILE A 116 64.052 -9.418 5.782 1.00 1.00 H new ATOM 0 HG13 ILE A 116 65.054 -8.791 7.077 1.00 1.00 H new ATOM 0 HG21 ILE A 116 66.362 -10.943 4.318 1.00 1.00 H new ATOM 0 HG22 ILE A 116 66.131 -12.487 5.174 1.00 1.00 H new ATOM 0 HG23 ILE A 116 64.720 -11.567 4.601 1.00 1.00 H new ATOM 0 HD11 ILE A 116 65.500 -7.582 4.959 1.00 1.00 H new ATOM 0 HD12 ILE A 116 66.945 -8.479 5.481 1.00 1.00 H new ATOM 0 HD13 ILE A 116 65.928 -9.116 4.167 1.00 1.00 H new ATOM 1734 N GLU A 117 66.409 -12.930 8.416 1.00 1.00 N ATOM 1735 CA GLU A 117 67.036 -14.225 8.714 1.00 1.00 C ATOM 1736 C GLU A 117 65.972 -15.210 9.108 1.00 1.00 C ATOM 1737 O GLU A 117 65.715 -16.173 8.384 1.00 1.00 O ATOM 1738 CB GLU A 117 68.095 -14.185 9.825 1.00 1.00 C ATOM 1739 CG GLU A 117 69.388 -13.566 9.302 1.00 1.00 C ATOM 1740 CD GLU A 117 70.447 -13.605 10.395 1.00 1.00 C ATOM 1741 OE1 GLU A 117 70.106 -13.964 11.510 1.00 1.00 O ATOM 1742 OE2 GLU A 117 71.587 -13.307 10.093 1.00 1.00 O ATOM 0 H GLU A 117 66.859 -12.120 8.842 1.00 1.00 H new ATOM 0 HA GLU A 117 67.555 -14.519 7.801 1.00 1.00 H new ATOM 0 HB2 GLU A 117 67.723 -13.607 10.671 1.00 1.00 H new ATOM 0 HB3 GLU A 117 68.288 -15.194 10.189 1.00 1.00 H new ATOM 0 HG2 GLU A 117 69.736 -14.111 8.424 1.00 1.00 H new ATOM 0 HG3 GLU A 117 69.211 -12.537 8.989 1.00 1.00 H new ATOM 1749 N VAL A 118 65.340 -14.980 10.250 1.00 1.00 N ATOM 1750 CA VAL A 118 64.303 -15.875 10.695 1.00 1.00 C ATOM 1751 C VAL A 118 63.331 -16.143 9.565 1.00 1.00 C ATOM 1752 O VAL A 118 62.659 -17.174 9.571 1.00 1.00 O ATOM 1753 CB VAL A 118 63.570 -15.273 11.904 1.00 1.00 C ATOM 1754 CG1 VAL A 118 62.265 -16.038 12.170 1.00 1.00 C ATOM 1755 CG2 VAL A 118 64.478 -15.373 13.131 1.00 1.00 C ATOM 0 H VAL A 118 65.529 -14.193 10.870 1.00 1.00 H new ATOM 0 HA VAL A 118 64.754 -16.820 10.998 1.00 1.00 H new ATOM 0 HB VAL A 118 63.329 -14.230 11.698 1.00 1.00 H new ATOM 0 HG11 VAL A 118 61.756 -15.601 13.029 1.00 1.00 H new ATOM 0 HG12 VAL A 118 61.620 -15.973 11.294 1.00 1.00 H new ATOM 0 HG13 VAL A 118 62.492 -17.084 12.376 1.00 1.00 H new ATOM 0 HG21 VAL A 118 63.969 -14.949 13.996 1.00 1.00 H new ATOM 0 HG22 VAL A 118 64.713 -16.419 13.325 1.00 1.00 H new ATOM 0 HG23 VAL A 118 65.400 -14.822 12.947 1.00 1.00 H new ATOM 1765 N LEU A 119 63.252 -15.249 8.562 1.00 1.00 N ATOM 1766 CA LEU A 119 62.348 -15.497 7.453 1.00 1.00 C ATOM 1767 C LEU A 119 63.015 -16.514 6.527 1.00 1.00 C ATOM 1768 O LEU A 119 62.486 -17.613 6.354 1.00 1.00 O ATOM 1769 CB LEU A 119 62.066 -14.160 6.735 1.00 1.00 C ATOM 1770 CG LEU A 119 60.559 -13.880 6.621 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.360 -12.416 6.229 1.00 1.00 C ATOM 1772 CD2 LEU A 119 59.939 -14.774 5.549 1.00 1.00 C ATOM 0 H LEU A 119 63.787 -14.382 8.506 1.00 1.00 H new ATOM 0 HA LEU A 119 61.393 -15.902 7.788 1.00 1.00 H new ATOM 0 HB2 LEU A 119 62.547 -13.347 7.279 1.00 1.00 H new ATOM 0 HB3 LEU A 119 62.508 -14.182 5.739 1.00 1.00 H new ATOM 0 HG LEU A 119 60.078 -14.086 7.577 1.00 1.00 H new ATOM 0 HD11 LEU A 119 59.294 -12.204 6.145 1.00 1.00 H new ATOM 0 HD12 LEU A 119 60.799 -11.772 6.991 1.00 1.00 H new ATOM 0 HD13 LEU A 119 60.845 -12.227 5.271 1.00 1.00 H new ATOM 0 HD21 LEU A 119 58.871 -14.568 5.476 1.00 1.00 H new ATOM 0 HD22 LEU A 119 60.414 -14.573 4.589 1.00 1.00 H new ATOM 0 HD23 LEU A 119 60.089 -15.820 5.816 1.00 1.00 H new ATOM 1784 N GLY A 120 64.206 -16.192 5.970 1.00 1.00 N ATOM 1785 CA GLY A 120 64.869 -17.196 5.153 1.00 1.00 C ATOM 1786 C GLY A 120 65.186 -18.402 6.038 1.00 1.00 C ATOM 1787 O GLY A 120 64.433 -19.365 6.079 1.00 1.00 O ATOM 0 H GLY A 120 64.691 -15.300 6.069 1.00 1.00 H new ATOM 0 HA2 GLY A 120 64.229 -17.493 4.322 1.00 1.00 H new ATOM 0 HA3 GLY A 120 65.784 -16.791 4.721 1.00 1.00 H new ATOM 1791 N THR A 121 66.291 -18.258 6.765 1.00 1.00 N ATOM 1792 CA THR A 121 66.793 -19.271 7.730 1.00 1.00 C ATOM 1793 C THR A 121 68.321 -19.249 7.903 1.00 1.00 C ATOM 1794 O THR A 121 68.841 -19.864 8.833 1.00 1.00 O ATOM 1795 CB THR A 121 66.396 -20.694 7.288 1.00 1.00 C ATOM 1796 OG1 THR A 121 67.131 -21.640 8.057 1.00 1.00 O ATOM 1797 CG2 THR A 121 66.713 -20.905 5.797 1.00 1.00 C ATOM 0 H THR A 121 66.881 -17.428 6.710 1.00 1.00 H new ATOM 0 HA THR A 121 66.332 -19.008 8.682 1.00 1.00 H new ATOM 0 HB THR A 121 65.325 -20.826 7.443 1.00 1.00 H new ATOM 0 HG1 THR A 121 67.612 -21.176 8.774 1.00 1.00 H new ATOM 0 HG21 THR A 121 66.426 -21.915 5.503 1.00 1.00 H new ATOM 0 HG22 THR A 121 66.157 -20.182 5.201 1.00 1.00 H new ATOM 0 HG23 THR A 121 67.781 -20.768 5.629 1.00 1.00 H new ATOM 1805 N GLY A 122 69.046 -18.610 6.987 1.00 1.00 N ATOM 1806 CA GLY A 122 70.515 -18.613 7.035 1.00 1.00 C ATOM 1807 C GLY A 122 71.033 -19.459 5.887 1.00 1.00 C ATOM 1808 O GLY A 122 72.213 -19.420 5.556 1.00 1.00 O ATOM 0 H GLY A 122 68.649 -18.086 6.207 1.00 1.00 H new ATOM 0 HA2 GLY A 122 70.898 -17.596 6.959 1.00 1.00 H new ATOM 0 HA3 GLY A 122 70.862 -19.014 7.987 1.00 1.00 H new ATOM 1812 N THR A 123 70.107 -20.208 5.292 1.00 1.00 N ATOM 1813 CA THR A 123 70.470 -21.045 4.158 1.00 1.00 C ATOM 1814 C THR A 123 71.039 -20.116 3.090 1.00 1.00 C ATOM 1815 O THR A 123 70.371 -19.734 2.130 1.00 1.00 O ATOM 1816 CB THR A 123 69.253 -21.810 3.631 1.00 1.00 C ATOM 1817 OG1 THR A 123 69.685 -22.721 2.657 1.00 1.00 O ATOM 1818 CG2 THR A 123 68.207 -20.851 3.022 1.00 1.00 C ATOM 0 H THR A 123 69.126 -20.251 5.569 1.00 1.00 H new ATOM 0 HA THR A 123 71.206 -21.795 4.449 1.00 1.00 H new ATOM 0 HB THR A 123 68.779 -22.334 4.461 1.00 1.00 H new ATOM 0 HG1 THR A 123 70.664 -22.717 2.616 1.00 1.00 H new ATOM 0 HG21 THR A 123 67.356 -21.425 2.657 1.00 1.00 H new ATOM 0 HG22 THR A 123 67.871 -20.148 3.784 1.00 1.00 H new ATOM 0 HG23 THR A 123 68.655 -20.302 2.194 1.00 1.00 H new ATOM 1826 N ASP A 124 72.301 -19.771 3.301 1.00 1.00 N ATOM 1827 CA ASP A 124 73.022 -18.892 2.411 1.00 1.00 C ATOM 1828 C ASP A 124 74.531 -18.945 2.648 1.00 1.00 C ATOM 1829 O ASP A 124 75.000 -19.473 3.659 1.00 1.00 O ATOM 1830 CB ASP A 124 72.510 -17.471 2.613 1.00 1.00 C ATOM 1831 CG ASP A 124 73.046 -16.572 1.514 1.00 1.00 C ATOM 1832 OD1 ASP A 124 74.137 -16.052 1.682 1.00 1.00 O ATOM 1833 OD2 ASP A 124 72.361 -16.415 0.518 1.00 1.00 O ATOM 0 H ASP A 124 72.849 -20.097 4.097 1.00 1.00 H new ATOM 0 HA ASP A 124 72.850 -19.220 1.386 1.00 1.00 H new ATOM 0 HB2 ASP A 124 71.420 -17.462 2.604 1.00 1.00 H new ATOM 0 HB3 ASP A 124 72.823 -17.096 3.587 1.00 1.00 H new ATOM 1838 N TYR A 125 75.276 -18.344 1.730 1.00 1.00 N ATOM 1839 CA TYR A 125 76.730 -18.257 1.839 1.00 1.00 C ATOM 1840 C TYR A 125 77.198 -16.928 1.217 1.00 1.00 C ATOM 1841 O TYR A 125 76.638 -16.472 0.220 1.00 1.00 O ATOM 1842 CB TYR A 125 77.396 -19.480 1.150 1.00 1.00 C ATOM 1843 CG TYR A 125 78.682 -19.062 0.477 1.00 1.00 C ATOM 1844 CD1 TYR A 125 78.616 -18.351 -0.720 1.00 1.00 C ATOM 1845 CD2 TYR A 125 79.927 -19.355 1.048 1.00 1.00 C ATOM 1846 CE1 TYR A 125 79.778 -17.930 -1.347 1.00 1.00 C ATOM 1847 CE2 TYR A 125 81.101 -18.934 0.410 1.00 1.00 C ATOM 1848 CZ TYR A 125 81.023 -18.217 -0.788 1.00 1.00 C ATOM 1849 OH TYR A 125 82.173 -17.812 -1.433 1.00 1.00 O ATOM 0 H TYR A 125 74.894 -17.905 0.892 1.00 1.00 H new ATOM 0 HA TYR A 125 77.029 -18.275 2.887 1.00 1.00 H new ATOM 0 HB2 TYR A 125 77.599 -20.257 1.888 1.00 1.00 H new ATOM 0 HB3 TYR A 125 76.715 -19.908 0.415 1.00 1.00 H new ATOM 0 HD1 TYR A 125 77.656 -18.127 -1.161 1.00 1.00 H new ATOM 0 HD2 TYR A 125 79.982 -19.903 1.977 1.00 1.00 H new ATOM 0 HE1 TYR A 125 79.719 -17.377 -2.273 1.00 1.00 H new ATOM 0 HE2 TYR A 125 82.064 -19.163 0.842 1.00 1.00 H new ATOM 0 HH TYR A 125 82.010 -16.959 -1.887 1.00 1.00 H new ATOM 1859 N ARG A 126 78.249 -16.336 1.790 1.00 1.00 N ATOM 1860 CA ARG A 126 78.816 -15.087 1.272 1.00 1.00 C ATOM 1861 C ARG A 126 80.327 -15.039 1.543 1.00 1.00 C ATOM 1862 O ARG A 126 80.800 -15.581 2.542 1.00 1.00 O ATOM 1863 CB ARG A 126 78.138 -13.885 1.937 1.00 1.00 C ATOM 1864 CG ARG A 126 78.516 -12.561 1.200 1.00 1.00 C ATOM 1865 CD ARG A 126 77.313 -11.988 0.422 1.00 1.00 C ATOM 1866 NE ARG A 126 77.174 -12.676 -0.864 1.00 1.00 N ATOM 1867 CZ ARG A 126 75.987 -13.034 -1.365 1.00 1.00 C ATOM 1868 NH1 ARG A 126 74.882 -12.852 -0.689 1.00 1.00 N ATOM 1869 NH2 ARG A 126 75.933 -13.586 -2.546 1.00 1.00 N ATOM 0 H ARG A 126 78.726 -16.702 2.614 1.00 1.00 H new ATOM 0 HA ARG A 126 78.644 -15.047 0.196 1.00 1.00 H new ATOM 0 HB2 ARG A 126 77.056 -14.018 1.924 1.00 1.00 H new ATOM 0 HB3 ARG A 126 78.439 -13.824 2.983 1.00 1.00 H new ATOM 0 HG2 ARG A 126 78.866 -11.826 1.925 1.00 1.00 H new ATOM 0 HG3 ARG A 126 79.341 -12.748 0.512 1.00 1.00 H new ATOM 0 HD2 ARG A 126 76.401 -12.106 1.007 1.00 1.00 H new ATOM 0 HD3 ARG A 126 77.451 -10.919 0.259 1.00 1.00 H new ATOM 0 HE ARG A 126 78.016 -12.890 -1.398 1.00 1.00 H new ATOM 0 HH11 ARG A 126 74.915 -12.430 0.239 1.00 1.00 H new ATOM 0 HH12 ARG A 126 73.987 -13.132 -1.090 1.00 1.00 H new ATOM 0 HH21 ARG A 126 76.790 -13.740 -3.077 1.00 1.00 H new ATOM 0 HH22 ARG A 126 75.033 -13.863 -2.939 1.00 1.00 H new ATOM 1883 N PHE A 127 81.077 -14.375 0.658 1.00 1.00 N ATOM 1884 CA PHE A 127 82.533 -14.242 0.819 1.00 1.00 C ATOM 1885 C PHE A 127 82.927 -12.770 0.860 1.00 1.00 C ATOM 1886 O PHE A 127 82.036 -11.939 0.792 1.00 1.00 O ATOM 1887 CB PHE A 127 83.270 -14.924 -0.335 1.00 1.00 C ATOM 1888 CG PHE A 127 82.885 -14.266 -1.638 1.00 1.00 C ATOM 1889 CD1 PHE A 127 81.647 -14.556 -2.222 1.00 1.00 C ATOM 1890 CD2 PHE A 127 83.757 -13.362 -2.257 1.00 1.00 C ATOM 1891 CE1 PHE A 127 81.281 -13.944 -3.427 1.00 1.00 C ATOM 1892 CE2 PHE A 127 83.390 -12.749 -3.461 1.00 1.00 C ATOM 1893 CZ PHE A 127 82.153 -13.041 -4.046 1.00 1.00 C ATOM 1894 OXT PHE A 127 84.112 -12.495 0.960 1.00 1.00 O ATOM 0 H PHE A 127 80.704 -13.921 -0.176 1.00 1.00 H new ATOM 0 HA PHE A 127 82.813 -14.723 1.756 1.00 1.00 H new ATOM 0 HB2 PHE A 127 84.347 -14.854 -0.184 1.00 1.00 H new ATOM 0 HB3 PHE A 127 83.021 -15.985 -0.363 1.00 1.00 H new ATOM 0 HD1 PHE A 127 80.974 -15.252 -1.743 1.00 1.00 H new ATOM 0 HD2 PHE A 127 84.712 -13.138 -1.806 1.00 1.00 H new ATOM 0 HE1 PHE A 127 80.326 -14.169 -3.879 1.00 1.00 H new ATOM 0 HE2 PHE A 127 84.062 -12.051 -3.938 1.00 1.00 H new ATOM 0 HZ PHE A 127 81.871 -12.569 -4.976 1.00 1.00 H new TER 1904 PHE A 127 HETATM 1905 O1 MTN A 128 66.341 4.507 -9.634 1.00 1.00 O HETATM 1906 N1 MTN A 128 66.209 4.610 -8.378 1.00 1.00 N HETATM 1907 C1 MTN A 128 66.194 3.443 -7.461 1.00 1.00 C HETATM 1908 C2 MTN A 128 66.023 4.132 -6.161 1.00 1.00 C HETATM 1909 C3 MTN A 128 65.945 5.447 -6.262 1.00 1.00 C HETATM 1910 C4 MTN A 128 65.768 6.387 -5.113 1.00 1.00 C HETATM 1911 S1 MTN A 128 65.690 5.587 -3.492 1.00 1.00 S HETATM 1912 C5 MTN A 128 66.055 5.926 -7.693 1.00 1.00 C HETATM 1913 C6 MTN A 128 64.851 6.744 -8.140 1.00 1.00 C HETATM 1914 C7 MTN A 128 67.346 6.721 -7.870 1.00 1.00 C HETATM 1915 C8 MTN A 128 65.045 2.476 -7.733 1.00 1.00 C HETATM 1916 C9 MTN A 128 67.526 2.723 -7.508 1.00 1.00 C HETATM 0 H93 MTN A 128 67.716 2.376 -8.524 1.00 1.00 H new HETATM 0 H92 MTN A 128 68.319 3.405 -7.203 1.00 1.00 H new HETATM 0 H91 MTN A 128 67.502 1.869 -6.831 1.00 1.00 H new HETATM 0 H83 MTN A 128 64.095 2.997 -7.616 1.00 1.00 H new HETATM 0 H82 MTN A 128 65.125 2.093 -8.750 1.00 1.00 H new HETATM 0 H81 MTN A 128 65.093 1.646 -7.028 1.00 1.00 H new HETATM 0 H73 MTN A 128 68.177 6.169 -7.430 1.00 1.00 H new HETATM 0 H72 MTN A 128 67.535 6.876 -8.932 1.00 1.00 H new HETATM 0 H71 MTN A 128 67.249 7.687 -7.374 1.00 1.00 H new HETATM 0 H63 MTN A 128 64.929 6.954 -9.207 1.00 1.00 H new HETATM 0 H62 MTN A 128 63.937 6.182 -7.947 1.00 1.00 H new HETATM 0 H61 MTN A 128 64.823 7.683 -7.587 1.00 1.00 H new HETATM 0 H42 MTN A 128 66.593 7.099 -5.113 1.00 1.00 H new HETATM 0 H41 MTN A 128 64.853 6.959 -5.266 1.00 1.00 H new HETATM 0 H2 MTN A 128 65.967 3.603 -5.209 1.00 1.00 H new HETATM 1932 O1 MTN A 129 71.187 -9.915 -5.297 1.00 1.00 O HETATM 1933 N1 MTN A 129 70.912 -8.937 -4.541 1.00 1.00 N HETATM 1934 C1 MTN A 129 69.627 -8.219 -4.605 1.00 1.00 C HETATM 1935 C2 MTN A 129 69.849 -7.211 -3.543 1.00 1.00 C HETATM 1936 C3 MTN A 129 71.028 -7.305 -2.959 1.00 1.00 C HETATM 1937 C4 MTN A 129 71.507 -6.415 -1.865 1.00 1.00 C HETATM 1938 S1 MTN A 129 71.872 -4.727 -2.401 1.00 1.00 S HETATM 1939 C5 MTN A 129 71.870 -8.432 -3.524 1.00 1.00 C HETATM 1940 C6 MTN A 129 73.222 -7.981 -4.104 1.00 1.00 C HETATM 1941 C7 MTN A 129 72.040 -9.520 -2.456 1.00 1.00 C HETATM 1942 C8 MTN A 129 69.376 -7.567 -5.964 1.00 1.00 C HETATM 1943 C9 MTN A 129 68.497 -9.162 -4.222 1.00 1.00 C HETATM 0 H93 MTN A 129 68.476 -10.004 -4.913 1.00 1.00 H new HETATM 0 H92 MTN A 129 68.657 -9.529 -3.208 1.00 1.00 H new HETATM 0 H91 MTN A 129 67.547 -8.630 -4.270 1.00 1.00 H new HETATM 0 H83 MTN A 129 70.168 -6.848 -6.175 1.00 1.00 H new HETATM 0 H82 MTN A 129 69.366 -8.333 -6.739 1.00 1.00 H new HETATM 0 H81 MTN A 129 68.415 -7.054 -5.949 1.00 1.00 H new HETATM 0 H73 MTN A 129 71.075 -9.730 -1.994 1.00 1.00 H new HETATM 0 H72 MTN A 129 72.426 -10.428 -2.920 1.00 1.00 H new HETATM 0 H71 MTN A 129 72.740 -9.176 -1.694 1.00 1.00 H new HETATM 0 H63 MTN A 129 73.701 -8.822 -4.606 1.00 1.00 H new HETATM 0 H62 MTN A 129 73.060 -7.175 -4.820 1.00 1.00 H new HETATM 0 H61 MTN A 129 73.864 -7.626 -3.297 1.00 1.00 H new HETATM 0 H42 MTN A 129 70.751 -6.381 -1.080 1.00 1.00 H new HETATM 0 H41 MTN A 129 72.405 -6.848 -1.424 1.00 1.00 H new HETATM 0 H2 MTN A 129 69.107 -6.461 -3.269 1.00 1.00 H new HETATM 1959 O1 MTN A 130 82.096 -10.442 5.712 1.00 1.00 O HETATM 1960 N1 MTN A 130 81.371 -9.556 6.258 1.00 1.00 N HETATM 1961 C1 MTN A 130 81.315 -9.359 7.722 1.00 1.00 C HETATM 1962 C2 MTN A 130 80.344 -8.241 7.795 1.00 1.00 C HETATM 1963 C3 MTN A 130 79.894 -7.839 6.617 1.00 1.00 C HETATM 1964 C4 MTN A 130 78.883 -6.745 6.409 1.00 1.00 C HETATM 1965 S1 MTN A 130 79.240 -5.614 5.041 1.00 1.00 S HETATM 1966 C5 MTN A 130 80.506 -8.633 5.469 1.00 1.00 C HETATM 1967 C6 MTN A 130 79.469 -9.336 4.599 1.00 1.00 C HETATM 1968 C7 MTN A 130 81.431 -7.741 4.617 1.00 1.00 C HETATM 1969 C8 MTN A 130 80.814 -10.586 8.473 1.00 1.00 C HETATM 1970 C9 MTN A 130 82.672 -8.926 8.241 1.00 1.00 C HETATM 0 H93 MTN A 130 83.411 -9.693 8.011 1.00 1.00 H new HETATM 0 H92 MTN A 130 82.962 -7.989 7.765 1.00 1.00 H new HETATM 0 H91 MTN A 130 82.620 -8.784 9.320 1.00 1.00 H new HETATM 0 H83 MTN A 130 79.808 -10.833 8.135 1.00 1.00 H new HETATM 0 H82 MTN A 130 81.479 -11.428 8.279 1.00 1.00 H new HETATM 0 H81 MTN A 130 80.797 -10.376 9.542 1.00 1.00 H new HETATM 0 H73 MTN A 130 82.093 -7.174 5.271 1.00 1.00 H new HETATM 0 H72 MTN A 130 82.026 -8.366 3.951 1.00 1.00 H new HETATM 0 H71 MTN A 130 80.828 -7.052 4.026 1.00 1.00 H new HETATM 0 H63 MTN A 130 79.974 -9.988 3.886 1.00 1.00 H new HETATM 0 H62 MTN A 130 78.808 -9.931 5.229 1.00 1.00 H new HETATM 0 H61 MTN A 130 78.883 -8.592 4.059 1.00 1.00 H new HETATM 0 H42 MTN A 130 77.908 -7.201 6.237 1.00 1.00 H new HETATM 0 H41 MTN A 130 78.805 -6.164 7.328 1.00 1.00 H new HETATM 0 H2 MTN A 130 80.029 -7.790 8.736 1.00 1.00 H new