USER MOD reduce.3.24.130724 H: found=0, std=0, add=964, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 955 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 99 GLN : amide:sc= 0 X(o=-0.2,f=-0.36) USER MOD Set 1.2: A 102 CYS SG : rot 32:sc= -0.203 USER MOD Set 2.1: A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.2: A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -138:sc= -0.0478 (180deg=-0.489) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0258) USER MOD Single : A 30 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= 0 X(o=0,f=-0.00048) USER MOD Single : A 39 THR OG1 : rot 27:sc= -1.16! USER MOD Single : A 48 CYS SG : rot 180:sc= 0 USER MOD Single : A 49 ASN : amide:sc= -3.27! C(o=-3.3!,f=-2.4!) USER MOD Single : A 54 GLN : amide:sc= -1.18 K(o=-1.2,f=-2.5) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 72 HIS : no HE2:sc= -5.23! C(o=-5.2!,f=-15!) USER MOD Single : A 75 ASN : amide:sc= -0.865 K(o=-0.87,f=-2.7!) USER MOD Single : A 92 HIS : no HE2:sc= -6.15! C(o=-6.2!,f=-9.1!) USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= -0.154 K(o=-0.15,f=-2!) USER MOD Single : A 113 ASN : amide:sc= -0.164 K(o=-0.16,f=-0.95) USER MOD Single : A 121 THR OG1 : rot 48:sc= 1.04 USER MOD Single : A 125 TYR OH : rot 114:sc= -0.937 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 77.172 22.673 -22.532 1.00 1.00 N ATOM 2 CA MET A 1 77.475 21.209 -22.528 1.00 1.00 C ATOM 3 C MET A 1 76.197 20.434 -22.192 1.00 1.00 C ATOM 4 O MET A 1 75.241 21.001 -21.665 1.00 1.00 O ATOM 5 CB MET A 1 78.545 20.906 -21.473 1.00 1.00 C ATOM 6 CG MET A 1 79.839 21.670 -21.779 1.00 1.00 C ATOM 7 SD MET A 1 80.520 21.127 -23.365 1.00 1.00 S ATOM 8 CE MET A 1 82.044 22.105 -23.290 1.00 1.00 C ATOM 0 H1 MET A 1 77.648 23.124 -23.340 1.00 1.00 H new ATOM 0 H2 MET A 1 76.145 22.815 -22.612 1.00 1.00 H new ATOM 0 H3 MET A 1 77.513 23.100 -21.647 1.00 1.00 H new ATOM 0 HA MET A 1 77.843 20.910 -23.510 1.00 1.00 H new ATOM 0 HB2 MET A 1 78.178 21.184 -20.485 1.00 1.00 H new ATOM 0 HB3 MET A 1 78.746 19.835 -21.449 1.00 1.00 H new ATOM 0 HG2 MET A 1 79.640 22.741 -21.807 1.00 1.00 H new ATOM 0 HG3 MET A 1 80.567 21.502 -20.985 1.00 1.00 H new ATOM 0 HE1 MET A 1 82.636 21.925 -24.187 1.00 1.00 H new ATOM 0 HE2 MET A 1 81.794 23.164 -23.227 1.00 1.00 H new ATOM 0 HE3 MET A 1 82.619 21.815 -22.411 1.00 1.00 H new ATOM 18 N SER A 2 76.192 19.131 -22.492 1.00 1.00 N ATOM 19 CA SER A 2 75.046 18.253 -22.221 1.00 1.00 C ATOM 20 C SER A 2 75.374 17.292 -21.074 1.00 1.00 C ATOM 21 O SER A 2 74.634 16.343 -20.818 1.00 1.00 O ATOM 22 CB SER A 2 74.684 17.452 -23.474 1.00 1.00 C ATOM 23 OG SER A 2 75.827 16.734 -23.922 1.00 1.00 O ATOM 0 H SER A 2 76.981 18.655 -22.929 1.00 1.00 H new ATOM 0 HA SER A 2 74.196 18.873 -21.936 1.00 1.00 H new ATOM 0 HB2 SER A 2 73.870 16.761 -23.255 1.00 1.00 H new ATOM 0 HB3 SER A 2 74.331 18.122 -24.258 1.00 1.00 H new ATOM 0 HG SER A 2 75.597 16.219 -24.723 1.00 1.00 H new ATOM 29 N ASP A 3 76.484 17.551 -20.386 1.00 1.00 N ATOM 30 CA ASP A 3 76.902 16.709 -19.259 1.00 1.00 C ATOM 31 C ASP A 3 78.350 17.028 -18.874 1.00 1.00 C ATOM 32 O ASP A 3 79.287 16.432 -19.407 1.00 1.00 O ATOM 33 CB ASP A 3 76.764 15.207 -19.626 1.00 1.00 C ATOM 34 CG ASP A 3 75.497 14.595 -19.015 1.00 1.00 C ATOM 35 OD1 ASP A 3 74.595 15.343 -18.680 1.00 1.00 O ATOM 36 OD2 ASP A 3 75.455 13.380 -18.890 1.00 1.00 O ATOM 0 H ASP A 3 77.109 18.332 -20.585 1.00 1.00 H new ATOM 0 HA ASP A 3 76.255 16.919 -18.407 1.00 1.00 H new ATOM 0 HB2 ASP A 3 76.737 15.097 -20.710 1.00 1.00 H new ATOM 0 HB3 ASP A 3 77.640 14.663 -19.272 1.00 1.00 H new ATOM 41 N PHE A 4 78.525 17.960 -17.938 1.00 1.00 N ATOM 42 CA PHE A 4 79.860 18.339 -17.479 1.00 1.00 C ATOM 43 C PHE A 4 79.811 18.742 -16.013 1.00 1.00 C ATOM 44 O PHE A 4 78.831 19.332 -15.558 1.00 1.00 O ATOM 45 CB PHE A 4 80.393 19.511 -18.301 1.00 1.00 C ATOM 46 CG PHE A 4 81.818 19.798 -17.893 1.00 1.00 C ATOM 47 CD1 PHE A 4 82.856 18.991 -18.375 1.00 1.00 C ATOM 48 CD2 PHE A 4 82.104 20.863 -17.029 1.00 1.00 C ATOM 49 CE1 PHE A 4 84.178 19.249 -17.998 1.00 1.00 C ATOM 50 CE2 PHE A 4 83.428 21.122 -16.653 1.00 1.00 C ATOM 51 CZ PHE A 4 84.464 20.314 -17.136 1.00 1.00 C ATOM 0 H PHE A 4 77.763 18.464 -17.485 1.00 1.00 H new ATOM 0 HA PHE A 4 80.522 17.482 -17.603 1.00 1.00 H new ATOM 0 HB2 PHE A 4 80.347 19.275 -19.364 1.00 1.00 H new ATOM 0 HB3 PHE A 4 79.772 20.393 -18.143 1.00 1.00 H new ATOM 0 HD1 PHE A 4 82.635 18.168 -19.039 1.00 1.00 H new ATOM 0 HD2 PHE A 4 81.304 21.484 -16.653 1.00 1.00 H new ATOM 0 HE1 PHE A 4 84.978 18.627 -18.372 1.00 1.00 H new ATOM 0 HE2 PHE A 4 83.650 21.945 -15.990 1.00 1.00 H new ATOM 0 HZ PHE A 4 85.484 20.512 -16.843 1.00 1.00 H new ATOM 61 N ASP A 5 80.859 18.405 -15.266 1.00 1.00 N ATOM 62 CA ASP A 5 80.907 18.721 -13.842 1.00 1.00 C ATOM 63 C ASP A 5 82.362 18.852 -13.373 1.00 1.00 C ATOM 64 O ASP A 5 83.252 18.194 -13.906 1.00 1.00 O ATOM 65 CB ASP A 5 80.204 17.593 -13.061 1.00 1.00 C ATOM 66 CG ASP A 5 80.295 16.281 -13.836 1.00 1.00 C ATOM 67 OD1 ASP A 5 81.288 16.088 -14.516 1.00 1.00 O ATOM 68 OD2 ASP A 5 79.372 15.490 -13.737 1.00 1.00 O ATOM 0 H ASP A 5 81.681 17.916 -15.620 1.00 1.00 H new ATOM 0 HA ASP A 5 80.402 19.670 -13.662 1.00 1.00 H new ATOM 0 HB2 ASP A 5 80.665 17.477 -12.080 1.00 1.00 H new ATOM 0 HB3 ASP A 5 79.159 17.853 -12.893 1.00 1.00 H new ATOM 73 N THR A 6 82.600 19.705 -12.375 1.00 1.00 N ATOM 74 CA THR A 6 83.953 19.901 -11.853 1.00 1.00 C ATOM 75 C THR A 6 84.425 18.661 -11.079 1.00 1.00 C ATOM 76 O THR A 6 83.742 17.673 -11.042 1.00 1.00 O ATOM 77 CB THR A 6 83.986 21.140 -10.946 1.00 1.00 C ATOM 78 OG1 THR A 6 83.033 20.990 -9.903 1.00 1.00 O ATOM 79 CG2 THR A 6 83.654 22.391 -11.769 1.00 1.00 C ATOM 0 H THR A 6 81.882 20.266 -11.916 1.00 1.00 H new ATOM 0 HA THR A 6 84.631 20.054 -12.693 1.00 1.00 H new ATOM 0 HB THR A 6 84.982 21.246 -10.515 1.00 1.00 H new ATOM 0 HG1 THR A 6 83.055 21.780 -9.323 1.00 1.00 H new ATOM 0 HG21 THR A 6 83.678 23.269 -11.123 1.00 1.00 H new ATOM 0 HG22 THR A 6 84.388 22.507 -12.566 1.00 1.00 H new ATOM 0 HG23 THR A 6 82.660 22.287 -12.203 1.00 1.00 H new ATOM 87 N GLU A 7 85.628 18.730 -10.532 1.00 1.00 N ATOM 88 CA GLU A 7 86.237 17.597 -9.801 1.00 1.00 C ATOM 89 C GLU A 7 85.359 17.177 -8.623 1.00 1.00 C ATOM 90 O GLU A 7 84.968 16.017 -8.490 1.00 1.00 O ATOM 91 CB GLU A 7 87.616 18.026 -9.264 1.00 1.00 C ATOM 92 CG GLU A 7 88.261 16.894 -8.416 1.00 1.00 C ATOM 93 CD GLU A 7 88.194 17.216 -6.919 1.00 1.00 C ATOM 94 OE1 GLU A 7 87.097 17.264 -6.392 1.00 1.00 O ATOM 95 OE2 GLU A 7 89.244 17.408 -6.327 1.00 1.00 O ATOM 0 H GLU A 7 86.218 19.561 -10.574 1.00 1.00 H new ATOM 0 HA GLU A 7 86.337 16.755 -10.486 1.00 1.00 H new ATOM 0 HB2 GLU A 7 88.272 18.280 -10.097 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.510 18.925 -8.657 1.00 1.00 H new ATOM 0 HG2 GLU A 7 87.748 15.952 -8.611 1.00 1.00 H new ATOM 0 HG3 GLU A 7 89.300 16.759 -8.715 1.00 1.00 H new ATOM 102 N ARG A 8 85.089 18.146 -7.769 1.00 1.00 N ATOM 103 CA ARG A 8 84.280 17.861 -6.577 1.00 1.00 C ATOM 104 C ARG A 8 83.022 17.144 -7.061 1.00 1.00 C ATOM 105 O ARG A 8 82.716 16.023 -6.669 1.00 1.00 O ATOM 106 CB ARG A 8 83.850 19.154 -5.869 1.00 1.00 C ATOM 107 CG ARG A 8 83.116 18.805 -4.562 1.00 1.00 C ATOM 108 CD ARG A 8 82.564 20.081 -3.917 1.00 1.00 C ATOM 109 NE ARG A 8 82.049 19.799 -2.576 1.00 1.00 N ATOM 110 CZ ARG A 8 81.188 20.626 -1.986 1.00 1.00 C ATOM 111 NH1 ARG A 8 80.730 21.657 -2.638 1.00 1.00 N ATOM 112 NH2 ARG A 8 80.786 20.401 -0.763 1.00 1.00 N ATOM 0 H ARG A 8 85.402 19.112 -7.863 1.00 1.00 H new ATOM 0 HA ARG A 8 84.862 17.265 -5.874 1.00 1.00 H new ATOM 0 HB2 ARG A 8 84.723 19.771 -5.655 1.00 1.00 H new ATOM 0 HB3 ARG A 8 83.199 19.738 -6.519 1.00 1.00 H new ATOM 0 HG2 ARG A 8 82.302 18.109 -4.766 1.00 1.00 H new ATOM 0 HG3 ARG A 8 83.798 18.305 -3.874 1.00 1.00 H new ATOM 0 HD2 ARG A 8 83.349 20.835 -3.860 1.00 1.00 H new ATOM 0 HD3 ARG A 8 81.769 20.495 -4.538 1.00 1.00 H new ATOM 0 HE ARG A 8 82.354 18.957 -2.087 1.00 1.00 H new ATOM 0 HH11 ARG A 8 81.031 21.829 -3.597 1.00 1.00 H new ATOM 0 HH12 ARG A 8 80.070 22.292 -2.189 1.00 1.00 H new ATOM 0 HH21 ARG A 8 81.132 19.588 -0.254 1.00 1.00 H new ATOM 0 HH22 ARG A 8 80.126 21.039 -0.318 1.00 1.00 H new ATOM 126 N VAL A 9 82.344 17.819 -7.955 1.00 1.00 N ATOM 127 CA VAL A 9 81.129 17.265 -8.531 1.00 1.00 C ATOM 128 C VAL A 9 81.446 16.014 -9.378 1.00 1.00 C ATOM 129 O VAL A 9 80.809 15.007 -9.234 1.00 1.00 O ATOM 130 CB VAL A 9 80.368 18.314 -9.349 1.00 1.00 C ATOM 131 CG1 VAL A 9 79.062 17.703 -9.881 1.00 1.00 C ATOM 132 CG2 VAL A 9 80.022 19.502 -8.448 1.00 1.00 C ATOM 0 H VAL A 9 82.603 18.743 -8.301 1.00 1.00 H new ATOM 0 HA VAL A 9 80.479 16.960 -7.711 1.00 1.00 H new ATOM 0 HB VAL A 9 80.990 18.642 -10.182 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.521 18.450 -10.463 1.00 1.00 H new ATOM 0 HG12 VAL A 9 79.293 16.847 -10.515 1.00 1.00 H new ATOM 0 HG13 VAL A 9 78.444 17.379 -9.043 1.00 1.00 H new ATOM 0 HG21 VAL A 9 79.480 20.251 -9.026 1.00 1.00 H new ATOM 0 HG22 VAL A 9 79.399 19.162 -7.621 1.00 1.00 H new ATOM 0 HG23 VAL A 9 80.940 19.940 -8.055 1.00 1.00 H new ATOM 142 N SER A 10 82.409 16.099 -10.272 1.00 1.00 N ATOM 143 CA SER A 10 82.726 14.939 -11.132 1.00 1.00 C ATOM 144 C SER A 10 83.326 13.774 -10.343 1.00 1.00 C ATOM 145 O SER A 10 82.753 12.689 -10.315 1.00 1.00 O ATOM 146 CB SER A 10 83.727 15.336 -12.222 1.00 1.00 C ATOM 147 OG SER A 10 83.981 14.212 -13.056 1.00 1.00 O ATOM 0 H SER A 10 82.982 16.928 -10.433 1.00 1.00 H new ATOM 0 HA SER A 10 81.781 14.618 -11.571 1.00 1.00 H new ATOM 0 HB2 SER A 10 83.330 16.161 -12.814 1.00 1.00 H new ATOM 0 HB3 SER A 10 84.655 15.686 -11.770 1.00 1.00 H new ATOM 0 HG SER A 10 84.620 14.462 -13.756 1.00 1.00 H new ATOM 153 N ARG A 11 84.519 13.972 -9.783 1.00 1.00 N ATOM 154 CA ARG A 11 85.209 12.883 -9.083 1.00 1.00 C ATOM 155 C ARG A 11 84.446 12.449 -7.834 1.00 1.00 C ATOM 156 O ARG A 11 84.107 11.285 -7.682 1.00 1.00 O ATOM 157 CB ARG A 11 86.606 13.356 -8.668 1.00 1.00 C ATOM 158 CG ARG A 11 87.428 12.165 -8.166 1.00 1.00 C ATOM 159 CD ARG A 11 88.695 12.671 -7.479 1.00 1.00 C ATOM 160 NE ARG A 11 89.400 11.546 -6.864 1.00 1.00 N ATOM 161 CZ ARG A 11 90.727 11.408 -6.927 1.00 1.00 C ATOM 162 NH1 ARG A 11 91.469 12.302 -7.525 1.00 1.00 N ATOM 163 NH2 ARG A 11 91.285 10.369 -6.371 1.00 1.00 N ATOM 0 H ARG A 11 85.023 14.859 -9.798 1.00 1.00 H new ATOM 0 HA ARG A 11 85.274 12.033 -9.762 1.00 1.00 H new ATOM 0 HB2 ARG A 11 87.108 13.825 -9.514 1.00 1.00 H new ATOM 0 HB3 ARG A 11 86.527 14.111 -7.886 1.00 1.00 H new ATOM 0 HG2 ARG A 11 86.837 11.570 -7.469 1.00 1.00 H new ATOM 0 HG3 ARG A 11 87.690 11.513 -9.000 1.00 1.00 H new ATOM 0 HD2 ARG A 11 89.341 13.166 -8.204 1.00 1.00 H new ATOM 0 HD3 ARG A 11 88.439 13.412 -6.721 1.00 1.00 H new ATOM 0 HE ARG A 11 88.857 10.840 -6.368 1.00 1.00 H new ATOM 0 HH11 ARG A 11 91.036 13.121 -7.953 1.00 1.00 H new ATOM 0 HH12 ARG A 11 92.481 12.181 -7.564 1.00 1.00 H new ATOM 0 HH21 ARG A 11 90.709 9.674 -5.896 1.00 1.00 H new ATOM 0 HH22 ARG A 11 92.297 10.251 -6.412 1.00 1.00 H new ATOM 177 N ALA A 12 84.232 13.388 -6.920 1.00 1.00 N ATOM 178 CA ALA A 12 83.561 13.011 -5.664 1.00 1.00 C ATOM 179 C ALA A 12 82.305 12.229 -6.061 1.00 1.00 C ATOM 180 O ALA A 12 82.073 11.117 -5.596 1.00 1.00 O ATOM 181 CB ALA A 12 83.217 14.225 -4.780 1.00 1.00 C ATOM 0 H ALA A 12 84.494 14.370 -7.007 1.00 1.00 H new ATOM 0 HA ALA A 12 84.229 12.405 -5.052 1.00 1.00 H new ATOM 0 HB1 ALA A 12 82.725 13.884 -3.869 1.00 1.00 H new ATOM 0 HB2 ALA A 12 84.132 14.757 -4.520 1.00 1.00 H new ATOM 0 HB3 ALA A 12 82.550 14.894 -5.324 1.00 1.00 H new ATOM 187 N VAL A 13 81.551 12.797 -6.979 1.00 1.00 N ATOM 188 CA VAL A 13 80.384 12.071 -7.450 1.00 1.00 C ATOM 189 C VAL A 13 80.860 10.757 -8.075 1.00 1.00 C ATOM 190 O VAL A 13 80.348 9.719 -7.750 1.00 1.00 O ATOM 191 CB VAL A 13 79.517 12.832 -8.455 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.349 11.942 -8.888 1.00 1.00 C ATOM 193 CG2 VAL A 13 78.955 14.099 -7.796 1.00 1.00 C ATOM 0 H VAL A 13 81.710 13.713 -7.399 1.00 1.00 H new ATOM 0 HA VAL A 13 79.743 11.909 -6.583 1.00 1.00 H new ATOM 0 HB VAL A 13 80.122 13.104 -9.320 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.728 12.480 -9.604 1.00 1.00 H new ATOM 0 HG12 VAL A 13 78.736 11.035 -9.352 1.00 1.00 H new ATOM 0 HG13 VAL A 13 77.751 11.677 -8.016 1.00 1.00 H new ATOM 0 HG21 VAL A 13 78.338 14.639 -8.514 1.00 1.00 H new ATOM 0 HG22 VAL A 13 78.350 13.822 -6.933 1.00 1.00 H new ATOM 0 HG23 VAL A 13 79.778 14.737 -7.473 1.00 1.00 H new ATOM 203 N ALA A 14 81.859 10.782 -8.955 1.00 1.00 N ATOM 204 CA ALA A 14 82.295 9.508 -9.543 1.00 1.00 C ATOM 205 C ALA A 14 82.706 8.541 -8.429 1.00 1.00 C ATOM 206 O ALA A 14 82.126 7.486 -8.296 1.00 1.00 O ATOM 207 CB ALA A 14 83.471 9.724 -10.506 1.00 1.00 C ATOM 0 H ALA A 14 82.360 11.615 -9.266 1.00 1.00 H new ATOM 0 HA ALA A 14 81.464 9.084 -10.107 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.776 8.767 -10.928 1.00 1.00 H new ATOM 0 HB2 ALA A 14 83.165 10.394 -11.309 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.308 10.165 -9.965 1.00 1.00 H new ATOM 213 N ALA A 15 83.723 8.909 -7.665 1.00 1.00 N ATOM 214 CA ALA A 15 84.225 8.039 -6.587 1.00 1.00 C ATOM 215 C ALA A 15 83.066 7.618 -5.675 1.00 1.00 C ATOM 216 O ALA A 15 82.845 6.440 -5.416 1.00 1.00 O ATOM 217 CB ALA A 15 85.260 8.798 -5.752 1.00 1.00 C ATOM 0 H ALA A 15 84.220 9.794 -7.762 1.00 1.00 H new ATOM 0 HA ALA A 15 84.683 7.155 -7.032 1.00 1.00 H new ATOM 0 HB1 ALA A 15 85.629 8.152 -4.956 1.00 1.00 H new ATOM 0 HB2 ALA A 15 86.091 9.100 -6.389 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.797 9.683 -5.316 1.00 1.00 H new ATOM 223 N ALA A 16 82.372 8.613 -5.182 1.00 1.00 N ATOM 224 CA ALA A 16 81.254 8.365 -4.282 1.00 1.00 C ATOM 225 C ALA A 16 80.180 7.545 -5.027 1.00 1.00 C ATOM 226 O ALA A 16 79.722 6.499 -4.567 1.00 1.00 O ATOM 227 CB ALA A 16 80.690 9.714 -3.807 1.00 1.00 C ATOM 0 H ALA A 16 82.552 9.597 -5.381 1.00 1.00 H new ATOM 0 HA ALA A 16 81.579 7.797 -3.411 1.00 1.00 H new ATOM 0 HB1 ALA A 16 79.852 9.541 -3.132 1.00 1.00 H new ATOM 0 HB2 ALA A 16 81.468 10.270 -3.284 1.00 1.00 H new ATOM 0 HB3 ALA A 16 80.350 10.289 -4.668 1.00 1.00 H new ATOM 233 N LEU A 17 79.775 8.100 -6.154 1.00 1.00 N ATOM 234 CA LEU A 17 78.709 7.467 -6.959 1.00 1.00 C ATOM 235 C LEU A 17 79.136 6.033 -7.297 1.00 1.00 C ATOM 236 O LEU A 17 78.399 5.085 -7.032 1.00 1.00 O ATOM 237 CB LEU A 17 78.378 8.218 -8.262 1.00 1.00 C ATOM 238 CG LEU A 17 77.119 7.607 -8.923 1.00 1.00 C ATOM 239 CD1 LEU A 17 75.855 8.281 -8.375 1.00 1.00 C ATOM 240 CD2 LEU A 17 77.175 7.813 -10.440 1.00 1.00 C ATOM 0 H LEU A 17 80.148 8.968 -6.539 1.00 1.00 H new ATOM 0 HA LEU A 17 77.802 7.489 -6.355 1.00 1.00 H new ATOM 0 HB2 LEU A 17 78.211 9.274 -8.050 1.00 1.00 H new ATOM 0 HB3 LEU A 17 79.223 8.161 -8.948 1.00 1.00 H new ATOM 0 HG LEU A 17 77.091 6.541 -8.697 1.00 1.00 H new ATOM 0 HD11 LEU A 17 74.975 7.843 -8.847 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.801 8.131 -7.297 1.00 1.00 H new ATOM 0 HD13 LEU A 17 75.889 9.349 -8.591 1.00 1.00 H new ATOM 0 HD21 LEU A 17 76.286 7.381 -10.899 1.00 1.00 H new ATOM 0 HD22 LEU A 17 77.215 8.880 -10.661 1.00 1.00 H new ATOM 0 HD23 LEU A 17 78.064 7.326 -10.841 1.00 1.00 H new ATOM 252 N VAL A 18 80.326 5.873 -7.870 1.00 1.00 N ATOM 253 CA VAL A 18 80.797 4.527 -8.202 1.00 1.00 C ATOM 254 C VAL A 18 81.066 3.768 -6.900 1.00 1.00 C ATOM 255 O VAL A 18 80.500 2.698 -6.670 1.00 1.00 O ATOM 256 CB VAL A 18 82.044 4.561 -9.132 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.826 5.574 -10.297 1.00 1.00 C ATOM 258 CG2 VAL A 18 83.321 4.922 -8.344 1.00 1.00 C ATOM 0 H VAL A 18 80.966 6.631 -8.109 1.00 1.00 H new ATOM 0 HA VAL A 18 80.026 4.003 -8.766 1.00 1.00 H new ATOM 0 HB VAL A 18 82.176 3.563 -9.550 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.707 5.586 -10.938 1.00 1.00 H new ATOM 0 HG12 VAL A 18 80.956 5.275 -10.881 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.662 6.571 -9.887 1.00 1.00 H new ATOM 0 HG21 VAL A 18 84.175 4.938 -9.022 1.00 1.00 H new ATOM 0 HG22 VAL A 18 83.202 5.905 -7.888 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.490 4.179 -7.565 1.00 1.00 H new ATOM 268 N GLY A 19 81.923 4.332 -6.051 1.00 1.00 N ATOM 269 CA GLY A 19 82.256 3.715 -4.775 1.00 1.00 C ATOM 270 C GLY A 19 81.029 3.664 -3.878 1.00 1.00 C ATOM 271 O GLY A 19 79.917 3.951 -4.321 1.00 1.00 O ATOM 0 H GLY A 19 82.399 5.217 -6.227 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.637 2.707 -4.939 1.00 1.00 H new ATOM 0 HA3 GLY A 19 83.049 4.280 -4.286 1.00 1.00 H new ATOM 275 N PRO A 20 81.200 3.292 -2.643 1.00 1.00 N ATOM 276 CA PRO A 20 80.076 3.193 -1.690 1.00 1.00 C ATOM 277 C PRO A 20 79.672 4.545 -1.095 1.00 1.00 C ATOM 278 O PRO A 20 78.586 4.679 -0.578 1.00 1.00 O ATOM 279 CB PRO A 20 80.581 2.216 -0.625 1.00 1.00 C ATOM 280 CG PRO A 20 82.082 2.292 -0.674 1.00 1.00 C ATOM 281 CD PRO A 20 82.480 2.945 -2.013 1.00 1.00 C ATOM 0 HA PRO A 20 79.162 2.849 -2.175 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.208 2.488 0.363 1.00 1.00 H new ATOM 0 HB3 PRO A 20 80.234 1.203 -0.829 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.462 2.877 0.164 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.517 1.296 -0.591 1.00 1.00 H new ATOM 0 HD2 PRO A 20 83.098 3.829 -1.856 1.00 1.00 H new ATOM 0 HD3 PRO A 20 83.056 2.259 -2.634 1.00 1.00 H new ATOM 289 N GLY A 21 80.576 5.515 -1.126 1.00 1.00 N ATOM 290 CA GLY A 21 80.259 6.822 -0.522 1.00 1.00 C ATOM 291 C GLY A 21 78.987 7.407 -1.152 1.00 1.00 C ATOM 292 O GLY A 21 78.006 7.695 -0.469 1.00 1.00 O ATOM 0 H GLY A 21 81.503 5.439 -1.544 1.00 1.00 H new ATOM 0 HA2 GLY A 21 80.121 6.709 0.553 1.00 1.00 H new ATOM 0 HA3 GLY A 21 81.093 7.509 -0.666 1.00 1.00 H new ATOM 296 N GLY A 22 79.037 7.575 -2.455 1.00 1.00 N ATOM 297 CA GLY A 22 77.877 8.132 -3.167 1.00 1.00 C ATOM 298 C GLY A 22 76.716 7.178 -2.994 1.00 1.00 C ATOM 299 O GLY A 22 75.623 7.566 -2.582 1.00 1.00 O ATOM 0 H GLY A 22 79.839 7.345 -3.042 1.00 1.00 H new ATOM 0 HA2 GLY A 22 77.624 9.115 -2.771 1.00 1.00 H new ATOM 0 HA3 GLY A 22 78.107 8.264 -4.224 1.00 1.00 H new ATOM 303 N VAL A 23 76.965 5.927 -3.330 1.00 1.00 N ATOM 304 CA VAL A 23 75.920 4.918 -3.219 1.00 1.00 C ATOM 305 C VAL A 23 75.410 4.907 -1.765 1.00 1.00 C ATOM 306 O VAL A 23 74.223 4.740 -1.519 1.00 1.00 O ATOM 307 CB VAL A 23 76.449 3.524 -3.705 1.00 1.00 C ATOM 308 CG1 VAL A 23 76.460 2.483 -2.576 1.00 1.00 C ATOM 309 CG2 VAL A 23 75.566 2.985 -4.848 1.00 1.00 C ATOM 0 H VAL A 23 77.862 5.586 -3.676 1.00 1.00 H new ATOM 0 HA VAL A 23 75.077 5.155 -3.868 1.00 1.00 H new ATOM 0 HB VAL A 23 77.471 3.681 -4.049 1.00 1.00 H new ATOM 0 HG11 VAL A 23 76.834 1.534 -2.960 1.00 1.00 H new ATOM 0 HG12 VAL A 23 77.107 2.828 -1.769 1.00 1.00 H new ATOM 0 HG13 VAL A 23 75.447 2.347 -2.196 1.00 1.00 H new ATOM 0 HG21 VAL A 23 75.945 2.017 -5.175 1.00 1.00 H new ATOM 0 HG22 VAL A 23 74.541 2.873 -4.494 1.00 1.00 H new ATOM 0 HG23 VAL A 23 75.586 3.684 -5.684 1.00 1.00 H new ATOM 319 N ALA A 24 76.343 5.076 -0.830 1.00 1.00 N ATOM 320 CA ALA A 24 75.957 5.065 0.586 1.00 1.00 C ATOM 321 C ALA A 24 74.914 6.160 0.845 1.00 1.00 C ATOM 322 O ALA A 24 73.812 5.858 1.302 1.00 1.00 O ATOM 323 CB ALA A 24 77.161 5.247 1.519 1.00 1.00 C ATOM 0 H ALA A 24 77.337 5.217 -1.012 1.00 1.00 H new ATOM 0 HA ALA A 24 75.528 4.087 0.805 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.824 5.232 2.555 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.872 4.437 1.357 1.00 1.00 H new ATOM 0 HB3 ALA A 24 77.644 6.201 1.308 1.00 1.00 H new ATOM 329 N LEU A 25 75.251 7.430 0.593 1.00 1.00 N ATOM 330 CA LEU A 25 74.295 8.495 0.856 1.00 1.00 C ATOM 331 C LEU A 25 73.056 8.342 -0.010 1.00 1.00 C ATOM 332 O LEU A 25 71.949 8.549 0.476 1.00 1.00 O ATOM 333 CB LEU A 25 74.934 9.886 0.627 1.00 1.00 C ATOM 334 CG LEU A 25 75.720 10.371 1.895 1.00 1.00 C ATOM 335 CD1 LEU A 25 77.197 10.600 1.554 1.00 1.00 C ATOM 336 CD2 LEU A 25 75.126 11.696 2.411 1.00 1.00 C ATOM 0 H LEU A 25 76.150 7.733 0.219 1.00 1.00 H new ATOM 0 HA LEU A 25 73.999 8.418 1.902 1.00 1.00 H new ATOM 0 HB2 LEU A 25 75.610 9.841 -0.227 1.00 1.00 H new ATOM 0 HB3 LEU A 25 74.156 10.609 0.380 1.00 1.00 H new ATOM 0 HG LEU A 25 75.635 9.600 2.661 1.00 1.00 H new ATOM 0 HD11 LEU A 25 77.728 10.936 2.444 1.00 1.00 H new ATOM 0 HD12 LEU A 25 77.637 9.668 1.199 1.00 1.00 H new ATOM 0 HD13 LEU A 25 77.277 11.359 0.776 1.00 1.00 H new ATOM 0 HD21 LEU A 25 75.679 12.024 3.291 1.00 1.00 H new ATOM 0 HD22 LEU A 25 75.200 12.455 1.632 1.00 1.00 H new ATOM 0 HD23 LEU A 25 74.079 11.547 2.675 1.00 1.00 H new ATOM 348 N VAL A 26 73.214 8.012 -1.288 1.00 1.00 N ATOM 349 CA VAL A 26 72.038 7.901 -2.126 1.00 1.00 C ATOM 350 C VAL A 26 71.112 6.804 -1.613 1.00 1.00 C ATOM 351 O VAL A 26 69.953 7.076 -1.315 1.00 1.00 O ATOM 352 CB VAL A 26 72.485 7.597 -3.559 1.00 1.00 C ATOM 353 CG1 VAL A 26 71.269 7.311 -4.440 1.00 1.00 C ATOM 354 CG2 VAL A 26 73.257 8.801 -4.115 1.00 1.00 C ATOM 0 H VAL A 26 74.106 7.825 -1.746 1.00 1.00 H new ATOM 0 HA VAL A 26 71.484 8.840 -2.103 1.00 1.00 H new ATOM 0 HB VAL A 26 73.130 6.718 -3.556 1.00 1.00 H new ATOM 0 HG11 VAL A 26 71.599 7.096 -5.457 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.727 6.451 -4.045 1.00 1.00 H new ATOM 0 HG13 VAL A 26 70.613 8.181 -4.448 1.00 1.00 H new ATOM 0 HG21 VAL A 26 73.577 8.588 -5.135 1.00 1.00 H new ATOM 0 HG22 VAL A 26 72.612 9.680 -4.113 1.00 1.00 H new ATOM 0 HG23 VAL A 26 74.131 8.991 -3.493 1.00 1.00 H new ATOM 364 N VAL A 27 71.574 5.552 -1.567 1.00 1.00 N ATOM 365 CA VAL A 27 70.707 4.452 -1.152 1.00 1.00 C ATOM 366 C VAL A 27 70.174 4.625 0.257 1.00 1.00 C ATOM 367 O VAL A 27 69.031 4.273 0.548 1.00 1.00 O ATOM 368 CB VAL A 27 71.503 3.129 -1.228 1.00 1.00 C ATOM 369 CG1 VAL A 27 72.544 3.061 -0.089 1.00 1.00 C ATOM 370 CG2 VAL A 27 70.554 1.924 -1.116 1.00 1.00 C ATOM 0 H VAL A 27 72.527 5.280 -1.808 1.00 1.00 H new ATOM 0 HA VAL A 27 69.851 4.439 -1.826 1.00 1.00 H new ATOM 0 HB VAL A 27 72.015 3.097 -2.190 1.00 1.00 H new ATOM 0 HG11 VAL A 27 73.096 2.124 -0.156 1.00 1.00 H new ATOM 0 HG12 VAL A 27 73.237 3.898 -0.179 1.00 1.00 H new ATOM 0 HG13 VAL A 27 72.035 3.114 0.873 1.00 1.00 H new ATOM 0 HG21 VAL A 27 71.130 1.001 -1.171 1.00 1.00 H new ATOM 0 HG22 VAL A 27 70.025 1.965 -0.164 1.00 1.00 H new ATOM 0 HG23 VAL A 27 69.833 1.951 -1.933 1.00 1.00 H new ATOM 380 N LYS A 28 71.006 5.147 1.132 1.00 1.00 N ATOM 381 CA LYS A 28 70.598 5.330 2.507 1.00 1.00 C ATOM 382 C LYS A 28 69.547 6.412 2.578 1.00 1.00 C ATOM 383 O LYS A 28 68.471 6.236 3.153 1.00 1.00 O ATOM 384 CB LYS A 28 71.821 5.700 3.344 1.00 1.00 C ATOM 385 CG LYS A 28 71.463 5.735 4.828 1.00 1.00 C ATOM 386 CD LYS A 28 72.748 5.921 5.640 1.00 1.00 C ATOM 387 CE LYS A 28 72.422 5.933 7.134 1.00 1.00 C ATOM 388 NZ LYS A 28 71.836 7.250 7.499 1.00 1.00 N ATOM 0 H LYS A 28 71.957 5.449 0.920 1.00 1.00 H new ATOM 0 HA LYS A 28 70.170 4.408 2.901 1.00 1.00 H new ATOM 0 HB2 LYS A 28 72.618 4.977 3.173 1.00 1.00 H new ATOM 0 HB3 LYS A 28 72.201 6.673 3.033 1.00 1.00 H new ATOM 0 HG2 LYS A 28 70.768 6.550 5.030 1.00 1.00 H new ATOM 0 HG3 LYS A 28 70.964 4.811 5.118 1.00 1.00 H new ATOM 0 HD2 LYS A 28 73.449 5.116 5.418 1.00 1.00 H new ATOM 0 HD3 LYS A 28 73.235 6.854 5.358 1.00 1.00 H new ATOM 0 HE2 LYS A 28 71.722 5.132 7.371 1.00 1.00 H new ATOM 0 HE3 LYS A 28 73.325 5.750 7.716 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 71.707 7.299 8.530 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 72.475 8.011 7.193 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 70.915 7.362 7.030 1.00 1.00 H new ATOM 402 N VAL A 29 69.906 7.551 2.023 1.00 1.00 N ATOM 403 CA VAL A 29 69.010 8.696 2.063 1.00 1.00 C ATOM 404 C VAL A 29 67.743 8.400 1.283 1.00 1.00 C ATOM 405 O VAL A 29 66.642 8.634 1.780 1.00 1.00 O ATOM 406 CB VAL A 29 69.673 9.972 1.533 1.00 1.00 C ATOM 407 CG1 VAL A 29 68.643 11.106 1.534 1.00 1.00 C ATOM 408 CG2 VAL A 29 70.847 10.359 2.442 1.00 1.00 C ATOM 0 H VAL A 29 70.794 7.711 1.547 1.00 1.00 H new ATOM 0 HA VAL A 29 68.758 8.872 3.109 1.00 1.00 H new ATOM 0 HB VAL A 29 70.039 9.800 0.521 1.00 1.00 H new ATOM 0 HG11 VAL A 29 69.106 12.018 1.158 1.00 1.00 H new ATOM 0 HG12 VAL A 29 67.803 10.835 0.894 1.00 1.00 H new ATOM 0 HG13 VAL A 29 68.286 11.272 2.550 1.00 1.00 H new ATOM 0 HG21 VAL A 29 71.317 11.267 2.063 1.00 1.00 H new ATOM 0 HG22 VAL A 29 70.481 10.535 3.454 1.00 1.00 H new ATOM 0 HG23 VAL A 29 71.578 9.551 2.456 1.00 1.00 H new ATOM 418 N CYS A 30 67.879 7.902 0.057 1.00 1.00 N ATOM 419 CA CYS A 30 66.696 7.623 -0.722 1.00 1.00 C ATOM 420 C CYS A 30 65.904 6.478 -0.096 1.00 1.00 C ATOM 421 O CYS A 30 64.727 6.646 0.224 1.00 1.00 O ATOM 422 CB CYS A 30 67.114 7.264 -2.156 1.00 1.00 C ATOM 423 SG CYS A 30 65.668 6.804 -3.144 1.00 1.00 S ATOM 0 H CYS A 30 68.767 7.692 -0.399 1.00 1.00 H new ATOM 0 HA CYS A 30 66.057 8.506 -0.740 1.00 1.00 H new ATOM 0 HB2 CYS A 30 67.621 8.112 -2.616 1.00 1.00 H new ATOM 0 HB3 CYS A 30 67.826 6.439 -2.137 1.00 1.00 H new ATOM 0 HG CYS A 30 66.045 6.507 -4.352 1.00 1.00 H new ATOM 428 N ALA A 31 66.505 5.291 -0.001 1.00 1.00 N ATOM 429 CA ALA A 31 65.795 4.122 0.490 1.00 1.00 C ATOM 430 C ALA A 31 65.382 4.255 1.940 1.00 1.00 C ATOM 431 O ALA A 31 64.217 4.045 2.282 1.00 1.00 O ATOM 432 CB ALA A 31 66.700 2.884 0.310 1.00 1.00 C ATOM 0 H ALA A 31 67.477 5.120 -0.258 1.00 1.00 H new ATOM 0 HA ALA A 31 64.876 4.018 -0.087 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.181 1.998 0.674 1.00 1.00 H new ATOM 0 HB2 ALA A 31 66.937 2.757 -0.746 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.622 3.022 0.875 1.00 1.00 H new ATOM 438 N GLY A 32 66.341 4.553 2.799 1.00 1.00 N ATOM 439 CA GLY A 32 66.061 4.649 4.220 1.00 1.00 C ATOM 440 C GLY A 32 66.244 3.271 4.840 1.00 1.00 C ATOM 441 O GLY A 32 65.272 2.613 5.204 1.00 1.00 O ATOM 0 H GLY A 32 67.312 4.731 2.541 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.731 5.369 4.691 1.00 1.00 H new ATOM 0 HA3 GLY A 32 65.044 5.006 4.383 1.00 1.00 H new ATOM 445 N LEU A 33 67.507 2.850 4.942 1.00 1.00 N ATOM 446 CA LEU A 33 67.867 1.547 5.504 1.00 1.00 C ATOM 447 C LEU A 33 67.713 0.426 4.459 1.00 1.00 C ATOM 448 O LEU A 33 66.620 0.240 3.924 1.00 1.00 O ATOM 449 CB LEU A 33 66.988 1.214 6.723 1.00 1.00 C ATOM 450 CG LEU A 33 67.683 0.149 7.598 1.00 1.00 C ATOM 451 CD1 LEU A 33 68.680 0.814 8.556 1.00 1.00 C ATOM 452 CD2 LEU A 33 66.634 -0.611 8.416 1.00 1.00 C ATOM 0 H LEU A 33 68.308 3.403 4.637 1.00 1.00 H new ATOM 0 HA LEU A 33 68.911 1.609 5.812 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.806 2.115 7.308 1.00 1.00 H new ATOM 0 HB3 LEU A 33 66.016 0.847 6.392 1.00 1.00 H new ATOM 0 HG LEU A 33 68.218 -0.542 6.946 1.00 1.00 H new ATOM 0 HD11 LEU A 33 69.162 0.051 9.167 1.00 1.00 H new ATOM 0 HD12 LEU A 33 69.435 1.349 7.981 1.00 1.00 H new ATOM 0 HD13 LEU A 33 68.152 1.515 9.202 1.00 1.00 H new ATOM 0 HD21 LEU A 33 67.128 -1.362 9.033 1.00 1.00 H new ATOM 0 HD22 LEU A 33 66.096 0.088 9.056 1.00 1.00 H new ATOM 0 HD23 LEU A 33 65.931 -1.100 7.742 1.00 1.00 H new ATOM 464 N PRO A 34 68.756 -0.331 4.149 1.00 1.00 N ATOM 465 CA PRO A 34 68.648 -1.434 3.146 1.00 1.00 C ATOM 466 C PRO A 34 67.781 -2.610 3.618 1.00 1.00 C ATOM 467 O PRO A 34 67.349 -3.416 2.793 1.00 1.00 O ATOM 468 CB PRO A 34 70.105 -1.873 2.903 1.00 1.00 C ATOM 469 CG PRO A 34 70.853 -1.464 4.131 1.00 1.00 C ATOM 470 CD PRO A 34 70.135 -0.228 4.688 1.00 1.00 C ATOM 0 HA PRO A 34 68.148 -1.089 2.241 1.00 1.00 H new ATOM 0 HB2 PRO A 34 70.170 -2.949 2.744 1.00 1.00 H new ATOM 0 HB3 PRO A 34 70.517 -1.394 2.015 1.00 1.00 H new ATOM 0 HG2 PRO A 34 70.864 -2.270 4.865 1.00 1.00 H new ATOM 0 HG3 PRO A 34 71.892 -1.235 3.894 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.137 -0.224 5.778 1.00 1.00 H new ATOM 0 HD3 PRO A 34 70.620 0.693 4.365 1.00 1.00 H new ATOM 478 N GLY A 35 67.530 -2.740 4.926 1.00 1.00 N ATOM 479 CA GLY A 35 66.721 -3.877 5.363 1.00 1.00 C ATOM 480 C GLY A 35 65.384 -3.831 4.645 1.00 1.00 C ATOM 481 O GLY A 35 65.045 -4.731 3.875 1.00 1.00 O ATOM 0 H GLY A 35 67.854 -2.111 5.661 1.00 1.00 H new ATOM 0 HA2 GLY A 35 67.235 -4.813 5.143 1.00 1.00 H new ATOM 0 HA3 GLY A 35 66.571 -3.841 6.442 1.00 1.00 H new ATOM 485 N VAL A 36 64.646 -2.757 4.869 1.00 1.00 N ATOM 486 CA VAL A 36 63.377 -2.612 4.187 1.00 1.00 C ATOM 487 C VAL A 36 63.710 -2.379 2.727 1.00 1.00 C ATOM 488 O VAL A 36 64.742 -2.850 2.291 1.00 1.00 O ATOM 489 CB VAL A 36 62.509 -1.478 4.772 1.00 1.00 C ATOM 490 CG1 VAL A 36 63.077 -0.092 4.381 1.00 1.00 C ATOM 491 CG2 VAL A 36 61.037 -1.628 4.266 1.00 1.00 C ATOM 0 H VAL A 36 64.895 -1.995 5.499 1.00 1.00 H new ATOM 0 HA VAL A 36 62.770 -3.508 4.316 1.00 1.00 H new ATOM 0 HB VAL A 36 62.523 -1.552 5.859 1.00 1.00 H new ATOM 0 HG11 VAL A 36 62.449 0.691 4.805 1.00 1.00 H new ATOM 0 HG12 VAL A 36 64.091 0.008 4.767 1.00 1.00 H new ATOM 0 HG13 VAL A 36 63.092 0.002 3.295 1.00 1.00 H new ATOM 0 HG21 VAL A 36 60.426 -0.826 4.681 1.00 1.00 H new ATOM 0 HG22 VAL A 36 61.019 -1.572 3.178 1.00 1.00 H new ATOM 0 HG23 VAL A 36 60.638 -2.590 4.587 1.00 1.00 H new ATOM 501 N ILE A 37 62.859 -1.658 2.013 1.00 1.00 N ATOM 502 CA ILE A 37 63.063 -1.341 0.579 1.00 1.00 C ATOM 503 C ILE A 37 62.689 -2.508 -0.341 1.00 1.00 C ATOM 504 O ILE A 37 63.542 -3.166 -0.929 1.00 1.00 O ATOM 505 CB ILE A 37 64.518 -0.817 0.280 1.00 1.00 C ATOM 506 CG1 ILE A 37 64.475 0.054 -0.999 1.00 1.00 C ATOM 507 CG2 ILE A 37 65.585 -1.948 0.062 1.00 1.00 C ATOM 508 CD1 ILE A 37 63.733 1.379 -0.755 1.00 1.00 C ATOM 0 H ILE A 37 61.999 -1.268 2.399 1.00 1.00 H new ATOM 0 HA ILE A 37 62.375 -0.526 0.355 1.00 1.00 H new ATOM 0 HB ILE A 37 64.828 -0.258 1.163 1.00 1.00 H new ATOM 0 HG12 ILE A 37 65.492 0.261 -1.333 1.00 1.00 H new ATOM 0 HG13 ILE A 37 63.982 -0.498 -1.800 1.00 1.00 H new ATOM 0 HG21 ILE A 37 66.557 -1.497 -0.138 1.00 1.00 H new ATOM 0 HG22 ILE A 37 65.649 -2.566 0.958 1.00 1.00 H new ATOM 0 HG23 ILE A 37 65.291 -2.567 -0.786 1.00 1.00 H new ATOM 0 HD11 ILE A 37 63.722 1.965 -1.674 1.00 1.00 H new ATOM 0 HD12 ILE A 37 62.709 1.171 -0.446 1.00 1.00 H new ATOM 0 HD13 ILE A 37 64.241 1.942 0.028 1.00 1.00 H new ATOM 520 N HIS A 38 61.390 -2.744 -0.533 1.00 1.00 N ATOM 521 CA HIS A 38 60.939 -3.800 -1.432 1.00 1.00 C ATOM 522 C HIS A 38 59.790 -3.262 -2.279 1.00 1.00 C ATOM 523 O HIS A 38 58.841 -2.680 -1.756 1.00 1.00 O ATOM 524 CB HIS A 38 60.479 -5.023 -0.616 1.00 1.00 C ATOM 525 CG HIS A 38 61.664 -5.911 -0.337 1.00 1.00 C ATOM 526 ND1 HIS A 38 62.221 -6.035 0.925 1.00 1.00 N ATOM 527 CD2 HIS A 38 62.422 -6.704 -1.162 1.00 1.00 C ATOM 528 CE1 HIS A 38 63.271 -6.874 0.822 1.00 1.00 C ATOM 529 NE2 HIS A 38 63.436 -7.310 -0.430 1.00 1.00 N ATOM 0 H HIS A 38 60.640 -2.221 -0.081 1.00 1.00 H new ATOM 0 HA HIS A 38 61.756 -4.111 -2.082 1.00 1.00 H new ATOM 0 HB2 HIS A 38 60.024 -4.700 0.320 1.00 1.00 H new ATOM 0 HB3 HIS A 38 59.717 -5.576 -1.166 1.00 1.00 H new ATOM 0 HD2 HIS A 38 62.255 -6.837 -2.221 1.00 1.00 H new ATOM 0 HE1 HIS A 38 63.902 -7.159 1.651 1.00 1.00 H new ATOM 0 HE2 HIS A 38 64.152 -7.950 -0.774 1.00 1.00 H new ATOM 537 N THR A 39 59.886 -3.459 -3.592 1.00 1.00 N ATOM 538 CA THR A 39 58.852 -2.989 -4.515 1.00 1.00 C ATOM 539 C THR A 39 58.096 -4.186 -5.093 1.00 1.00 C ATOM 540 O THR A 39 58.687 -5.245 -5.305 1.00 1.00 O ATOM 541 CB THR A 39 59.501 -2.183 -5.642 1.00 1.00 C ATOM 542 OG1 THR A 39 60.605 -2.910 -6.163 1.00 1.00 O ATOM 543 CG2 THR A 39 59.988 -0.838 -5.092 1.00 1.00 C ATOM 0 H THR A 39 60.666 -3.939 -4.041 1.00 1.00 H new ATOM 0 HA THR A 39 58.149 -2.351 -3.980 1.00 1.00 H new ATOM 0 HB THR A 39 58.772 -2.008 -6.434 1.00 1.00 H new ATOM 0 HG1 THR A 39 60.463 -3.869 -6.019 1.00 1.00 H new ATOM 0 HG21 THR A 39 60.451 -0.263 -5.894 1.00 1.00 H new ATOM 0 HG22 THR A 39 59.142 -0.282 -4.688 1.00 1.00 H new ATOM 0 HG23 THR A 39 60.719 -1.011 -4.302 1.00 1.00 H new ATOM 551 N PRO A 40 56.811 -4.067 -5.328 1.00 1.00 N ATOM 552 CA PRO A 40 55.994 -5.195 -5.867 1.00 1.00 C ATOM 553 C PRO A 40 56.257 -5.484 -7.348 1.00 1.00 C ATOM 554 O PRO A 40 56.133 -6.625 -7.792 1.00 1.00 O ATOM 555 CB PRO A 40 54.552 -4.703 -5.665 1.00 1.00 C ATOM 556 CG PRO A 40 54.654 -3.220 -5.776 1.00 1.00 C ATOM 557 CD PRO A 40 55.984 -2.855 -5.122 1.00 1.00 C ATOM 0 HA PRO A 40 56.226 -6.134 -5.364 1.00 1.00 H new ATOM 0 HB2 PRO A 40 53.881 -5.114 -6.420 1.00 1.00 H new ATOM 0 HB3 PRO A 40 54.161 -5.004 -4.693 1.00 1.00 H new ATOM 0 HG2 PRO A 40 54.628 -2.901 -6.818 1.00 1.00 H new ATOM 0 HG3 PRO A 40 53.821 -2.730 -5.272 1.00 1.00 H new ATOM 0 HD2 PRO A 40 56.433 -1.978 -5.587 1.00 1.00 H new ATOM 0 HD3 PRO A 40 55.862 -2.627 -4.063 1.00 1.00 H new ATOM 565 N ALA A 41 56.638 -4.451 -8.104 1.00 1.00 N ATOM 566 CA ALA A 41 56.938 -4.604 -9.533 1.00 1.00 C ATOM 567 C ALA A 41 58.304 -4.030 -9.861 1.00 1.00 C ATOM 568 O ALA A 41 58.594 -2.894 -9.489 1.00 1.00 O ATOM 569 CB ALA A 41 55.875 -3.904 -10.384 1.00 1.00 C ATOM 0 H ALA A 41 56.746 -3.500 -7.752 1.00 1.00 H new ATOM 0 HA ALA A 41 56.936 -5.670 -9.761 1.00 1.00 H new ATOM 0 HB1 ALA A 41 56.114 -4.028 -11.440 1.00 1.00 H new ATOM 0 HB2 ALA A 41 54.898 -4.343 -10.179 1.00 1.00 H new ATOM 0 HB3 ALA A 41 55.854 -2.842 -10.139 1.00 1.00 H new ATOM 575 N ARG A 42 59.118 -4.753 -10.608 1.00 1.00 N ATOM 576 CA ARG A 42 60.404 -4.219 -11.016 1.00 1.00 C ATOM 577 C ARG A 42 61.048 -5.159 -12.029 1.00 1.00 C ATOM 578 O ARG A 42 60.573 -6.268 -12.268 1.00 1.00 O ATOM 579 CB ARG A 42 61.345 -3.989 -9.799 1.00 1.00 C ATOM 580 CG ARG A 42 61.591 -2.482 -9.558 1.00 1.00 C ATOM 581 CD ARG A 42 62.812 -2.297 -8.654 1.00 1.00 C ATOM 582 NE ARG A 42 62.664 -3.079 -7.434 1.00 1.00 N ATOM 583 CZ ARG A 42 63.672 -3.213 -6.578 1.00 1.00 C ATOM 584 NH1 ARG A 42 64.796 -2.581 -6.786 1.00 1.00 N ATOM 585 NH2 ARG A 42 63.535 -3.969 -5.524 1.00 1.00 N ATOM 0 H ARG A 42 58.917 -5.696 -10.940 1.00 1.00 H new ATOM 0 HA ARG A 42 60.240 -3.246 -11.480 1.00 1.00 H new ATOM 0 HB2 ARG A 42 60.906 -4.435 -8.907 1.00 1.00 H new ATOM 0 HB3 ARG A 42 62.296 -4.492 -9.972 1.00 1.00 H new ATOM 0 HG2 ARG A 42 61.750 -1.973 -10.509 1.00 1.00 H new ATOM 0 HG3 ARG A 42 60.713 -2.029 -9.097 1.00 1.00 H new ATOM 0 HD2 ARG A 42 63.714 -2.604 -9.183 1.00 1.00 H new ATOM 0 HD3 ARG A 42 62.932 -1.243 -8.405 1.00 1.00 H new ATOM 0 HE ARG A 42 61.772 -3.531 -7.233 1.00 1.00 H new ATOM 0 HH11 ARG A 42 64.901 -1.984 -7.606 1.00 1.00 H new ATOM 0 HH12 ARG A 42 65.569 -2.685 -6.128 1.00 1.00 H new ATOM 0 HH21 ARG A 42 62.655 -4.457 -5.357 1.00 1.00 H new ATOM 0 HH22 ARG A 42 64.308 -4.072 -4.867 1.00 1.00 H new ATOM 599 N ARG A 43 62.138 -4.693 -12.599 1.00 1.00 N ATOM 600 CA ARG A 43 62.869 -5.484 -13.578 1.00 1.00 C ATOM 601 C ARG A 43 63.535 -6.673 -12.864 1.00 1.00 C ATOM 602 O ARG A 43 64.415 -7.340 -13.399 1.00 1.00 O ATOM 603 CB ARG A 43 63.868 -4.568 -14.332 1.00 1.00 C ATOM 604 CG ARG A 43 64.781 -5.318 -15.340 1.00 1.00 C ATOM 605 CD ARG A 43 63.977 -6.061 -16.439 1.00 1.00 C ATOM 606 NE ARG A 43 64.121 -5.367 -17.710 1.00 1.00 N ATOM 607 CZ ARG A 43 65.270 -5.365 -18.370 1.00 1.00 C ATOM 608 NH1 ARG A 43 66.293 -6.028 -17.903 1.00 1.00 N ATOM 609 NH2 ARG A 43 65.370 -4.710 -19.493 1.00 1.00 N ATOM 0 H ARG A 43 62.540 -3.776 -12.406 1.00 1.00 H new ATOM 0 HA ARG A 43 62.203 -5.903 -14.332 1.00 1.00 H new ATOM 0 HB2 ARG A 43 63.308 -3.801 -14.867 1.00 1.00 H new ATOM 0 HB3 ARG A 43 64.495 -4.055 -13.603 1.00 1.00 H new ATOM 0 HG2 ARG A 43 65.458 -4.605 -15.810 1.00 1.00 H new ATOM 0 HG3 ARG A 43 65.399 -6.036 -14.800 1.00 1.00 H new ATOM 0 HD2 ARG A 43 64.333 -7.087 -16.532 1.00 1.00 H new ATOM 0 HD3 ARG A 43 62.925 -6.113 -16.160 1.00 1.00 H new ATOM 0 HE ARG A 43 63.320 -4.871 -18.101 1.00 1.00 H new ATOM 0 HH11 ARG A 43 66.208 -6.548 -17.030 1.00 1.00 H new ATOM 0 HH12 ARG A 43 67.177 -6.026 -18.412 1.00 1.00 H new ATOM 0 HH21 ARG A 43 64.566 -4.202 -19.860 1.00 1.00 H new ATOM 0 HH22 ARG A 43 66.253 -4.706 -20.004 1.00 1.00 H new ATOM 623 N GLY A 44 63.076 -6.949 -11.640 1.00 1.00 N ATOM 624 CA GLY A 44 63.604 -8.057 -10.857 1.00 1.00 C ATOM 625 C GLY A 44 64.710 -7.567 -9.944 1.00 1.00 C ATOM 626 O GLY A 44 65.043 -8.218 -8.952 1.00 1.00 O ATOM 0 H GLY A 44 62.340 -6.418 -11.175 1.00 1.00 H new ATOM 0 HA2 GLY A 44 62.807 -8.508 -10.266 1.00 1.00 H new ATOM 0 HA3 GLY A 44 63.986 -8.832 -11.521 1.00 1.00 H new ATOM 630 N PHE A 45 65.276 -6.410 -10.280 1.00 1.00 N ATOM 631 CA PHE A 45 66.344 -5.831 -9.487 1.00 1.00 C ATOM 632 C PHE A 45 66.581 -4.373 -9.914 1.00 1.00 C ATOM 633 O PHE A 45 66.088 -3.956 -10.954 1.00 1.00 O ATOM 634 CB PHE A 45 67.624 -6.665 -9.641 1.00 1.00 C ATOM 635 CG PHE A 45 68.331 -6.296 -10.926 1.00 1.00 C ATOM 636 CD1 PHE A 45 67.652 -6.383 -12.148 1.00 1.00 C ATOM 637 CD2 PHE A 45 69.654 -5.850 -10.895 1.00 1.00 C ATOM 638 CE1 PHE A 45 68.297 -6.021 -13.332 1.00 1.00 C ATOM 639 CE2 PHE A 45 70.298 -5.496 -12.081 1.00 1.00 C ATOM 640 CZ PHE A 45 69.621 -5.580 -13.300 1.00 1.00 C ATOM 0 H PHE A 45 65.009 -5.860 -11.096 1.00 1.00 H new ATOM 0 HA PHE A 45 66.058 -5.838 -8.435 1.00 1.00 H new ATOM 0 HB2 PHE A 45 68.284 -6.493 -8.791 1.00 1.00 H new ATOM 0 HB3 PHE A 45 67.378 -7.727 -9.644 1.00 1.00 H new ATOM 0 HD1 PHE A 45 66.630 -6.730 -12.174 1.00 1.00 H new ATOM 0 HD2 PHE A 45 70.178 -5.779 -9.954 1.00 1.00 H new ATOM 0 HE1 PHE A 45 67.771 -6.082 -14.273 1.00 1.00 H new ATOM 0 HE2 PHE A 45 71.323 -5.156 -12.057 1.00 1.00 H new ATOM 0 HZ PHE A 45 70.121 -5.304 -14.216 1.00 1.00 H new ATOM 650 N PHE A 46 67.385 -3.678 -9.092 1.00 1.00 N ATOM 651 CA PHE A 46 67.799 -2.247 -9.300 1.00 1.00 C ATOM 652 C PHE A 46 67.997 -1.547 -7.939 1.00 1.00 C ATOM 653 O PHE A 46 67.208 -0.671 -7.591 1.00 1.00 O ATOM 654 CB PHE A 46 66.722 -1.443 -10.127 1.00 1.00 C ATOM 655 CG PHE A 46 67.341 -0.365 -11.015 1.00 1.00 C ATOM 656 CD1 PHE A 46 68.361 0.475 -10.544 1.00 1.00 C ATOM 657 CD2 PHE A 46 66.864 -0.201 -12.334 1.00 1.00 C ATOM 658 CE1 PHE A 46 68.897 1.468 -11.383 1.00 1.00 C ATOM 659 CE2 PHE A 46 67.398 0.790 -13.164 1.00 1.00 C ATOM 660 CZ PHE A 46 68.414 1.623 -12.690 1.00 1.00 C ATOM 0 H PHE A 46 67.781 -4.086 -8.245 1.00 1.00 H new ATOM 0 HA PHE A 46 68.734 -2.260 -9.860 1.00 1.00 H new ATOM 0 HB2 PHE A 46 66.155 -2.137 -10.747 1.00 1.00 H new ATOM 0 HB3 PHE A 46 66.015 -0.979 -9.439 1.00 1.00 H new ATOM 0 HD1 PHE A 46 68.734 0.359 -9.537 1.00 1.00 H new ATOM 0 HD2 PHE A 46 66.081 -0.846 -12.705 1.00 1.00 H new ATOM 0 HE1 PHE A 46 69.683 2.113 -11.019 1.00 1.00 H new ATOM 0 HE2 PHE A 46 67.025 0.911 -14.170 1.00 1.00 H new ATOM 0 HZ PHE A 46 68.828 2.387 -13.331 1.00 1.00 H new ATOM 670 N ARG A 47 69.066 -1.897 -7.198 1.00 1.00 N ATOM 671 CA ARG A 47 69.385 -1.290 -5.883 1.00 1.00 C ATOM 672 C ARG A 47 69.944 -2.363 -4.972 1.00 1.00 C ATOM 673 O ARG A 47 69.499 -3.510 -5.027 1.00 1.00 O ATOM 674 CB ARG A 47 68.166 -0.627 -5.182 1.00 1.00 C ATOM 675 CG ARG A 47 68.149 0.882 -5.504 1.00 1.00 C ATOM 676 CD ARG A 47 69.046 1.618 -4.501 1.00 1.00 C ATOM 677 NE ARG A 47 69.441 2.923 -5.014 1.00 1.00 N ATOM 678 CZ ARG A 47 70.450 3.043 -5.871 1.00 1.00 C ATOM 679 NH1 ARG A 47 71.056 1.979 -6.323 1.00 1.00 N ATOM 680 NH2 ARG A 47 70.834 4.223 -6.265 1.00 1.00 N ATOM 0 H ARG A 47 69.736 -2.609 -7.491 1.00 1.00 H new ATOM 0 HA ARG A 47 70.108 -0.497 -6.073 1.00 1.00 H new ATOM 0 HB2 ARG A 47 67.240 -1.093 -5.520 1.00 1.00 H new ATOM 0 HB3 ARG A 47 68.225 -0.780 -4.104 1.00 1.00 H new ATOM 0 HG2 ARG A 47 68.502 1.054 -6.521 1.00 1.00 H new ATOM 0 HG3 ARG A 47 67.131 1.267 -5.451 1.00 1.00 H new ATOM 0 HD2 ARG A 47 68.517 1.740 -3.556 1.00 1.00 H new ATOM 0 HD3 ARG A 47 69.934 1.020 -4.295 1.00 1.00 H new ATOM 0 HE ARG A 47 68.936 3.756 -4.711 1.00 1.00 H new ATOM 0 HH11 ARG A 47 70.756 1.053 -6.019 1.00 1.00 H new ATOM 0 HH12 ARG A 47 71.830 2.074 -6.981 1.00 1.00 H new ATOM 0 HH21 ARG A 47 70.361 5.056 -5.916 1.00 1.00 H new ATOM 0 HH22 ARG A 47 71.608 4.314 -6.923 1.00 1.00 H new ATOM 694 N CYS A 48 70.927 -2.014 -4.140 1.00 1.00 N ATOM 695 CA CYS A 48 71.506 -2.998 -3.253 1.00 1.00 C ATOM 696 C CYS A 48 72.326 -3.978 -4.080 1.00 1.00 C ATOM 697 O CYS A 48 71.964 -5.145 -4.214 1.00 1.00 O ATOM 698 CB CYS A 48 70.385 -3.706 -2.480 1.00 1.00 C ATOM 699 SG CYS A 48 70.990 -4.227 -0.856 1.00 1.00 S ATOM 0 H CYS A 48 71.325 -1.077 -4.069 1.00 1.00 H new ATOM 0 HA CYS A 48 72.166 -2.525 -2.525 1.00 1.00 H new ATOM 0 HB2 CYS A 48 69.533 -3.036 -2.363 1.00 1.00 H new ATOM 0 HB3 CYS A 48 70.035 -4.572 -3.042 1.00 1.00 H new ATOM 0 HG CYS A 48 70.034 -4.824 -0.208 1.00 1.00 H new ATOM 704 N ASN A 49 73.444 -3.497 -4.640 1.00 1.00 N ATOM 705 CA ASN A 49 74.327 -4.314 -5.459 1.00 1.00 C ATOM 706 C ASN A 49 75.779 -3.926 -5.123 1.00 1.00 C ATOM 707 O ASN A 49 76.223 -2.847 -5.502 1.00 1.00 O ATOM 708 CB ASN A 49 74.062 -4.008 -6.938 1.00 1.00 C ATOM 709 CG ASN A 49 74.240 -2.512 -7.207 1.00 1.00 C ATOM 710 OD1 ASN A 49 73.284 -1.745 -7.099 1.00 1.00 O ATOM 711 ND2 ASN A 49 75.414 -2.050 -7.552 1.00 1.00 N ATOM 0 H ASN A 49 73.755 -2.531 -4.534 1.00 1.00 H new ATOM 0 HA ASN A 49 74.156 -5.373 -5.267 1.00 1.00 H new ATOM 0 HB2 ASN A 49 74.746 -4.582 -7.564 1.00 1.00 H new ATOM 0 HB3 ASN A 49 73.051 -4.315 -7.205 1.00 1.00 H new ATOM 0 HD21 ASN A 49 75.537 -1.054 -7.732 1.00 1.00 H new ATOM 0 HD22 ASN A 49 76.206 -2.686 -7.641 1.00 1.00 H new ATOM 718 N PRO A 50 76.513 -4.736 -4.399 1.00 1.00 N ATOM 719 CA PRO A 50 77.930 -4.417 -4.005 1.00 1.00 C ATOM 720 C PRO A 50 78.832 -3.967 -5.170 1.00 1.00 C ATOM 721 O PRO A 50 79.746 -4.689 -5.564 1.00 1.00 O ATOM 722 CB PRO A 50 78.435 -5.734 -3.400 1.00 1.00 C ATOM 723 CG PRO A 50 77.207 -6.427 -2.909 1.00 1.00 C ATOM 724 CD PRO A 50 76.083 -6.037 -3.860 1.00 1.00 C ATOM 0 HA PRO A 50 77.960 -3.567 -3.323 1.00 1.00 H new ATOM 0 HB2 PRO A 50 78.958 -6.336 -4.144 1.00 1.00 H new ATOM 0 HB3 PRO A 50 79.138 -5.551 -2.587 1.00 1.00 H new ATOM 0 HG2 PRO A 50 77.349 -7.508 -2.898 1.00 1.00 H new ATOM 0 HG3 PRO A 50 76.973 -6.126 -1.888 1.00 1.00 H new ATOM 0 HD2 PRO A 50 75.955 -6.775 -4.652 1.00 1.00 H new ATOM 0 HD3 PRO A 50 75.128 -5.959 -3.340 1.00 1.00 H new ATOM 732 N GLU A 51 78.561 -2.778 -5.715 1.00 1.00 N ATOM 733 CA GLU A 51 79.333 -2.226 -6.835 1.00 1.00 C ATOM 734 C GLU A 51 79.034 -2.984 -8.120 1.00 1.00 C ATOM 735 O GLU A 51 79.219 -2.458 -9.217 1.00 1.00 O ATOM 736 CB GLU A 51 80.844 -2.277 -6.576 1.00 1.00 C ATOM 737 CG GLU A 51 81.171 -1.723 -5.190 1.00 1.00 C ATOM 738 CD GLU A 51 80.702 -0.277 -5.067 1.00 1.00 C ATOM 739 OE1 GLU A 51 81.072 0.521 -5.913 1.00 1.00 O ATOM 740 OE2 GLU A 51 79.984 0.012 -4.125 1.00 1.00 O ATOM 0 H GLU A 51 77.805 -2.173 -5.396 1.00 1.00 H new ATOM 0 HA GLU A 51 79.031 -1.183 -6.935 1.00 1.00 H new ATOM 0 HB2 GLU A 51 81.198 -3.305 -6.655 1.00 1.00 H new ATOM 0 HB3 GLU A 51 81.369 -1.700 -7.337 1.00 1.00 H new ATOM 0 HG2 GLU A 51 80.690 -2.333 -4.425 1.00 1.00 H new ATOM 0 HG3 GLU A 51 82.245 -1.779 -5.014 1.00 1.00 H new ATOM 747 N ARG A 52 78.570 -4.221 -7.979 1.00 1.00 N ATOM 748 CA ARG A 52 78.250 -5.037 -9.143 1.00 1.00 C ATOM 749 C ARG A 52 77.403 -4.221 -10.113 1.00 1.00 C ATOM 750 O ARG A 52 76.275 -3.849 -9.797 1.00 1.00 O ATOM 751 CB ARG A 52 77.485 -6.300 -8.710 1.00 1.00 C ATOM 752 CG ARG A 52 78.065 -6.864 -7.398 1.00 1.00 C ATOM 753 CD ARG A 52 79.566 -7.136 -7.542 1.00 1.00 C ATOM 754 NE ARG A 52 80.085 -7.748 -6.312 1.00 1.00 N ATOM 755 CZ ARG A 52 81.092 -7.210 -5.607 1.00 1.00 C ATOM 756 NH1 ARG A 52 81.675 -6.106 -5.997 1.00 1.00 N ATOM 757 NH2 ARG A 52 81.497 -7.795 -4.514 1.00 1.00 N ATOM 0 H ARG A 52 78.409 -4.676 -7.081 1.00 1.00 H new ATOM 0 HA ARG A 52 79.174 -5.341 -9.635 1.00 1.00 H new ATOM 0 HB2 ARG A 52 76.429 -6.064 -8.575 1.00 1.00 H new ATOM 0 HB3 ARG A 52 77.545 -7.055 -9.494 1.00 1.00 H new ATOM 0 HG2 ARG A 52 77.895 -6.157 -6.586 1.00 1.00 H new ATOM 0 HG3 ARG A 52 77.547 -7.786 -7.132 1.00 1.00 H new ATOM 0 HD2 ARG A 52 79.745 -7.797 -8.390 1.00 1.00 H new ATOM 0 HD3 ARG A 52 80.095 -6.205 -7.746 1.00 1.00 H new ATOM 0 HE ARG A 52 79.664 -8.616 -5.981 1.00 1.00 H new ATOM 0 HH11 ARG A 52 81.366 -5.640 -6.850 1.00 1.00 H new ATOM 0 HH12 ARG A 52 82.439 -5.711 -5.448 1.00 1.00 H new ATOM 0 HH21 ARG A 52 81.049 -8.656 -4.200 1.00 1.00 H new ATOM 0 HH22 ARG A 52 82.262 -7.392 -3.973 1.00 1.00 H new ATOM 771 N ILE A 53 77.954 -3.932 -11.288 1.00 1.00 N ATOM 772 CA ILE A 53 77.226 -3.145 -12.270 1.00 1.00 C ATOM 773 C ILE A 53 75.874 -3.777 -12.562 1.00 1.00 C ATOM 774 O ILE A 53 75.723 -4.998 -12.557 1.00 1.00 O ATOM 775 CB ILE A 53 78.036 -3.011 -13.562 1.00 1.00 C ATOM 776 CG1 ILE A 53 77.340 -2.019 -14.499 1.00 1.00 C ATOM 777 CG2 ILE A 53 78.131 -4.371 -14.246 1.00 1.00 C ATOM 778 CD1 ILE A 53 78.285 -1.650 -15.644 1.00 1.00 C ATOM 0 H ILE A 53 78.887 -4.226 -11.578 1.00 1.00 H new ATOM 0 HA ILE A 53 77.065 -2.149 -11.857 1.00 1.00 H new ATOM 0 HB ILE A 53 79.037 -2.651 -13.327 1.00 1.00 H new ATOM 0 HG12 ILE A 53 76.425 -2.458 -14.896 1.00 1.00 H new ATOM 0 HG13 ILE A 53 77.051 -1.124 -13.949 1.00 1.00 H new ATOM 0 HG21 ILE A 53 78.708 -4.276 -15.166 1.00 1.00 H new ATOM 0 HG22 ILE A 53 78.624 -5.079 -13.580 1.00 1.00 H new ATOM 0 HG23 ILE A 53 77.129 -4.731 -14.481 1.00 1.00 H new ATOM 0 HD11 ILE A 53 77.790 -0.944 -16.311 1.00 1.00 H new ATOM 0 HD12 ILE A 53 79.188 -1.194 -15.238 1.00 1.00 H new ATOM 0 HD13 ILE A 53 78.551 -2.549 -16.200 1.00 1.00 H new ATOM 790 N GLN A 54 74.894 -2.921 -12.771 1.00 1.00 N ATOM 791 CA GLN A 54 73.554 -3.426 -13.013 1.00 1.00 C ATOM 792 C GLN A 54 73.530 -4.215 -14.320 1.00 1.00 C ATOM 793 O GLN A 54 73.035 -3.720 -15.332 1.00 1.00 O ATOM 794 CB GLN A 54 72.556 -2.268 -13.130 1.00 1.00 C ATOM 795 CG GLN A 54 72.665 -1.348 -11.915 1.00 1.00 C ATOM 796 CD GLN A 54 72.430 -2.141 -10.634 1.00 1.00 C ATOM 797 OE1 GLN A 54 73.381 -2.622 -10.019 1.00 1.00 O ATOM 798 NE2 GLN A 54 71.213 -2.309 -10.196 1.00 1.00 N ATOM 0 H GLN A 54 74.991 -1.906 -12.779 1.00 1.00 H new ATOM 0 HA GLN A 54 73.274 -4.066 -12.177 1.00 1.00 H new ATOM 0 HB2 GLN A 54 72.750 -1.702 -14.041 1.00 1.00 H new ATOM 0 HB3 GLN A 54 71.542 -2.660 -13.208 1.00 1.00 H new ATOM 0 HG2 GLN A 54 73.651 -0.883 -11.888 1.00 1.00 H new ATOM 0 HG3 GLN A 54 71.935 -0.543 -11.992 1.00 1.00 H new ATOM 0 HE21 GLN A 54 70.427 -1.909 -10.708 1.00 1.00 H new ATOM 0 HE22 GLN A 54 71.047 -2.840 -9.341 1.00 1.00 H new ATOM 807 N ILE A 55 74.031 -5.460 -14.296 1.00 1.00 N ATOM 808 CA ILE A 55 74.023 -6.320 -15.481 1.00 1.00 C ATOM 809 C ILE A 55 73.930 -7.794 -15.071 1.00 1.00 C ATOM 810 O ILE A 55 74.283 -8.150 -13.946 1.00 1.00 O ATOM 811 CB ILE A 55 75.303 -6.101 -16.316 1.00 1.00 C ATOM 812 CG1 ILE A 55 75.075 -6.581 -17.771 1.00 1.00 C ATOM 813 CG2 ILE A 55 76.477 -6.887 -15.695 1.00 1.00 C ATOM 814 CD1 ILE A 55 74.440 -5.464 -18.608 1.00 1.00 C ATOM 0 H ILE A 55 74.445 -5.889 -13.469 1.00 1.00 H new ATOM 0 HA ILE A 55 73.153 -6.059 -16.084 1.00 1.00 H new ATOM 0 HB ILE A 55 75.542 -5.037 -16.320 1.00 1.00 H new ATOM 0 HG12 ILE A 55 76.024 -6.882 -18.215 1.00 1.00 H new ATOM 0 HG13 ILE A 55 74.429 -7.459 -17.774 1.00 1.00 H new ATOM 0 HG21 ILE A 55 77.377 -6.728 -16.290 1.00 1.00 H new ATOM 0 HG22 ILE A 55 76.649 -6.540 -14.676 1.00 1.00 H new ATOM 0 HG23 ILE A 55 76.236 -7.950 -15.680 1.00 1.00 H new ATOM 0 HD11 ILE A 55 74.286 -5.816 -19.628 1.00 1.00 H new ATOM 0 HD12 ILE A 55 73.481 -5.183 -18.172 1.00 1.00 H new ATOM 0 HD13 ILE A 55 75.101 -4.597 -18.620 1.00 1.00 H new ATOM 826 N GLY A 56 73.471 -8.650 -15.977 1.00 1.00 N ATOM 827 CA GLY A 56 73.342 -10.082 -15.733 1.00 1.00 C ATOM 828 C GLY A 56 71.878 -10.486 -15.728 1.00 1.00 C ATOM 829 O GLY A 56 71.552 -11.629 -16.047 1.00 1.00 O ATOM 0 H GLY A 56 73.175 -8.367 -16.911 1.00 1.00 H new ATOM 0 HA2 GLY A 56 73.877 -10.639 -16.502 1.00 1.00 H new ATOM 0 HA3 GLY A 56 73.800 -10.338 -14.778 1.00 1.00 H new ATOM 833 N ASP A 57 70.987 -9.567 -15.378 1.00 1.00 N ATOM 834 CA ASP A 57 69.571 -9.894 -15.365 1.00 1.00 C ATOM 835 C ASP A 57 69.131 -10.377 -16.734 1.00 1.00 C ATOM 836 O ASP A 57 68.938 -9.586 -17.658 1.00 1.00 O ATOM 837 CB ASP A 57 68.765 -8.660 -15.003 1.00 1.00 C ATOM 838 CG ASP A 57 69.164 -7.507 -15.921 1.00 1.00 C ATOM 839 OD1 ASP A 57 70.352 -7.242 -16.022 1.00 1.00 O ATOM 840 OD2 ASP A 57 68.280 -6.915 -16.515 1.00 1.00 O ATOM 0 H ASP A 57 71.214 -8.611 -15.105 1.00 1.00 H new ATOM 0 HA ASP A 57 69.404 -10.681 -14.629 1.00 1.00 H new ATOM 0 HB2 ASP A 57 67.699 -8.866 -15.102 1.00 1.00 H new ATOM 0 HB3 ASP A 57 68.942 -8.389 -13.962 1.00 1.00 H new ATOM 845 N TRP A 58 68.993 -11.684 -16.855 1.00 1.00 N ATOM 846 CA TRP A 58 68.596 -12.316 -18.101 1.00 1.00 C ATOM 847 C TRP A 58 67.069 -12.372 -18.252 1.00 1.00 C ATOM 848 O TRP A 58 66.302 -11.995 -17.366 1.00 1.00 O ATOM 849 CB TRP A 58 69.247 -13.714 -18.218 1.00 1.00 C ATOM 850 CG TRP A 58 70.333 -13.726 -19.270 1.00 1.00 C ATOM 851 CD1 TRP A 58 70.155 -13.408 -20.576 1.00 1.00 C ATOM 852 CD2 TRP A 58 71.746 -14.067 -19.125 1.00 1.00 C ATOM 853 NE1 TRP A 58 71.364 -13.537 -21.237 1.00 1.00 N ATOM 854 CE2 TRP A 58 72.374 -13.940 -20.388 1.00 1.00 C ATOM 855 CE3 TRP A 58 72.537 -14.472 -18.032 1.00 1.00 C ATOM 856 CZ2 TRP A 58 73.735 -14.206 -20.562 1.00 1.00 C ATOM 857 CZ3 TRP A 58 73.906 -14.738 -18.204 1.00 1.00 C ATOM 858 CH2 TRP A 58 74.503 -14.607 -19.466 1.00 1.00 C ATOM 0 H TRP A 58 69.153 -12.340 -16.090 1.00 1.00 H new ATOM 0 HA TRP A 58 68.959 -11.705 -18.928 1.00 1.00 H new ATOM 0 HB2 TRP A 58 69.667 -14.004 -17.255 1.00 1.00 H new ATOM 0 HB3 TRP A 58 68.486 -14.453 -18.469 1.00 1.00 H new ATOM 0 HD1 TRP A 58 69.222 -13.104 -21.027 1.00 1.00 H new ATOM 0 HE1 TRP A 58 71.493 -13.356 -22.232 1.00 1.00 H new ATOM 0 HE3 TRP A 58 72.088 -14.579 -17.055 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 74.190 -14.102 -21.536 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 74.503 -15.046 -17.358 1.00 1.00 H new ATOM 0 HH2 TRP A 58 75.555 -14.816 -19.591 1.00 1.00 H new ATOM 869 N ARG A 59 66.690 -12.866 -19.411 1.00 1.00 N ATOM 870 CA ARG A 59 65.275 -13.012 -19.762 1.00 1.00 C ATOM 871 C ARG A 59 64.716 -14.384 -19.361 1.00 1.00 C ATOM 872 O ARG A 59 63.725 -14.482 -18.637 1.00 1.00 O ATOM 873 CB ARG A 59 65.067 -12.763 -21.265 1.00 1.00 C ATOM 874 CG ARG A 59 65.669 -13.896 -22.110 1.00 1.00 C ATOM 875 CD ARG A 59 65.795 -13.439 -23.572 1.00 1.00 C ATOM 876 NE ARG A 59 65.838 -14.599 -24.462 1.00 1.00 N ATOM 877 CZ ARG A 59 66.984 -15.169 -24.833 1.00 1.00 C ATOM 878 NH1 ARG A 59 68.124 -14.700 -24.406 1.00 1.00 N ATOM 879 NH2 ARG A 59 66.964 -16.202 -25.630 1.00 1.00 N ATOM 0 H ARG A 59 67.337 -13.177 -20.135 1.00 1.00 H new ATOM 0 HA ARG A 59 64.722 -12.262 -19.197 1.00 1.00 H new ATOM 0 HB2 ARG A 59 64.001 -12.676 -21.477 1.00 1.00 H new ATOM 0 HB3 ARG A 59 65.526 -11.815 -21.545 1.00 1.00 H new ATOM 0 HG2 ARG A 59 66.648 -14.173 -21.720 1.00 1.00 H new ATOM 0 HG3 ARG A 59 65.039 -14.783 -22.049 1.00 1.00 H new ATOM 0 HD2 ARG A 59 64.951 -12.801 -23.835 1.00 1.00 H new ATOM 0 HD3 ARG A 59 66.698 -12.842 -23.697 1.00 1.00 H new ATOM 0 HE ARG A 59 64.961 -14.985 -24.811 1.00 1.00 H new ATOM 0 HH11 ARG A 59 68.142 -13.892 -23.784 1.00 1.00 H new ATOM 0 HH12 ARG A 59 68.997 -15.141 -24.694 1.00 1.00 H new ATOM 0 HH21 ARG A 59 66.074 -16.570 -25.966 1.00 1.00 H new ATOM 0 HH22 ARG A 59 67.838 -16.642 -25.917 1.00 1.00 H new ATOM 893 N TYR A 60 65.357 -15.421 -19.858 1.00 1.00 N ATOM 894 CA TYR A 60 64.957 -16.816 -19.601 1.00 1.00 C ATOM 895 C TYR A 60 65.647 -17.420 -18.383 1.00 1.00 C ATOM 896 O TYR A 60 65.177 -18.405 -17.779 1.00 1.00 O ATOM 897 CB TYR A 60 65.236 -17.679 -20.848 1.00 1.00 C ATOM 898 CG TYR A 60 66.670 -18.183 -20.849 1.00 1.00 C ATOM 899 CD1 TYR A 60 67.734 -17.287 -20.687 1.00 1.00 C ATOM 900 CD2 TYR A 60 66.928 -19.551 -21.014 1.00 1.00 C ATOM 901 CE1 TYR A 60 69.052 -17.758 -20.688 1.00 1.00 C ATOM 902 CE2 TYR A 60 68.247 -20.020 -21.013 1.00 1.00 C ATOM 903 CZ TYR A 60 69.308 -19.122 -20.852 1.00 1.00 C ATOM 904 OH TYR A 60 70.607 -19.583 -20.855 1.00 1.00 O ATOM 0 H TYR A 60 66.178 -15.334 -20.457 1.00 1.00 H new ATOM 0 HA TYR A 60 63.889 -16.805 -19.384 1.00 1.00 H new ATOM 0 HB2 TYR A 60 64.549 -18.525 -20.871 1.00 1.00 H new ATOM 0 HB3 TYR A 60 65.051 -17.094 -21.749 1.00 1.00 H new ATOM 0 HD1 TYR A 60 67.538 -16.232 -20.561 1.00 1.00 H new ATOM 0 HD2 TYR A 60 66.109 -20.243 -21.142 1.00 1.00 H new ATOM 0 HE1 TYR A 60 69.872 -17.067 -20.562 1.00 1.00 H new ATOM 0 HE2 TYR A 60 68.446 -21.074 -21.136 1.00 1.00 H new ATOM 0 HH TYR A 60 70.609 -20.555 -20.978 1.00 1.00 H new ATOM 914 N GLU A 61 66.760 -16.832 -17.996 1.00 1.00 N ATOM 915 CA GLU A 61 67.500 -17.312 -16.863 1.00 1.00 C ATOM 916 C GLU A 61 66.843 -16.831 -15.595 1.00 1.00 C ATOM 917 O GLU A 61 67.217 -17.239 -14.510 1.00 1.00 O ATOM 918 CB GLU A 61 68.950 -16.798 -16.935 1.00 1.00 C ATOM 919 CG GLU A 61 69.928 -17.824 -16.347 1.00 1.00 C ATOM 920 CD GLU A 61 71.227 -17.129 -15.943 1.00 1.00 C ATOM 921 OE1 GLU A 61 71.147 -16.050 -15.379 1.00 1.00 O ATOM 922 OE2 GLU A 61 72.280 -17.684 -16.204 1.00 1.00 O ATOM 0 H GLU A 61 67.168 -16.018 -18.456 1.00 1.00 H new ATOM 0 HA GLU A 61 67.511 -18.402 -16.869 1.00 1.00 H new ATOM 0 HB2 GLU A 61 69.215 -16.591 -17.972 1.00 1.00 H new ATOM 0 HB3 GLU A 61 69.033 -15.857 -16.391 1.00 1.00 H new ATOM 0 HG2 GLU A 61 69.481 -18.311 -15.480 1.00 1.00 H new ATOM 0 HG3 GLU A 61 70.135 -18.604 -17.080 1.00 1.00 H new ATOM 929 N VAL A 62 65.920 -15.885 -15.708 1.00 1.00 N ATOM 930 CA VAL A 62 65.319 -15.315 -14.506 1.00 1.00 C ATOM 931 C VAL A 62 64.920 -16.418 -13.563 1.00 1.00 C ATOM 932 O VAL A 62 65.317 -16.408 -12.418 1.00 1.00 O ATOM 933 CB VAL A 62 64.092 -14.468 -14.879 1.00 1.00 C ATOM 934 CG1 VAL A 62 63.094 -15.306 -15.700 1.00 1.00 C ATOM 935 CG2 VAL A 62 63.410 -13.964 -13.600 1.00 1.00 C ATOM 0 H VAL A 62 65.578 -15.504 -16.590 1.00 1.00 H new ATOM 0 HA VAL A 62 66.050 -14.674 -14.013 1.00 1.00 H new ATOM 0 HB VAL A 62 64.418 -13.619 -15.480 1.00 1.00 H new ATOM 0 HG11 VAL A 62 62.230 -14.694 -15.957 1.00 1.00 H new ATOM 0 HG12 VAL A 62 63.576 -15.655 -16.613 1.00 1.00 H new ATOM 0 HG13 VAL A 62 62.768 -16.164 -15.111 1.00 1.00 H new ATOM 0 HG21 VAL A 62 62.540 -13.363 -13.864 1.00 1.00 H new ATOM 0 HG22 VAL A 62 63.094 -14.815 -12.997 1.00 1.00 H new ATOM 0 HG23 VAL A 62 64.111 -13.355 -13.029 1.00 1.00 H new ATOM 945 N ALA A 63 64.116 -17.350 -14.012 1.00 1.00 N ATOM 946 CA ALA A 63 63.700 -18.420 -13.151 1.00 1.00 C ATOM 947 C ALA A 63 64.903 -19.261 -12.771 1.00 1.00 C ATOM 948 O ALA A 63 65.190 -19.445 -11.587 1.00 1.00 O ATOM 949 CB ALA A 63 62.687 -19.294 -13.894 1.00 1.00 C ATOM 0 H ALA A 63 63.742 -17.387 -14.960 1.00 1.00 H new ATOM 0 HA ALA A 63 63.245 -18.010 -12.250 1.00 1.00 H new ATOM 0 HB1 ALA A 63 62.366 -20.110 -13.246 1.00 1.00 H new ATOM 0 HB2 ALA A 63 61.823 -18.691 -14.174 1.00 1.00 H new ATOM 0 HB3 ALA A 63 63.150 -19.704 -14.792 1.00 1.00 H new ATOM 955 N HIS A 64 65.619 -19.738 -13.796 1.00 1.00 N ATOM 956 CA HIS A 64 66.797 -20.571 -13.541 1.00 1.00 C ATOM 957 C HIS A 64 67.696 -19.908 -12.484 1.00 1.00 C ATOM 958 O HIS A 64 67.966 -20.482 -11.434 1.00 1.00 O ATOM 959 CB HIS A 64 67.567 -20.801 -14.868 1.00 1.00 C ATOM 960 CG HIS A 64 67.578 -22.265 -15.248 1.00 1.00 C ATOM 961 ND1 HIS A 64 68.721 -23.045 -15.152 1.00 1.00 N ATOM 962 CD2 HIS A 64 66.599 -23.097 -15.735 1.00 1.00 C ATOM 963 CE1 HIS A 64 68.406 -24.284 -15.573 1.00 1.00 C ATOM 964 NE2 HIS A 64 67.125 -24.370 -15.941 1.00 1.00 N ATOM 0 H HIS A 64 65.412 -19.568 -14.780 1.00 1.00 H new ATOM 0 HA HIS A 64 66.482 -21.539 -13.152 1.00 1.00 H new ATOM 0 HB2 HIS A 64 67.104 -20.219 -15.665 1.00 1.00 H new ATOM 0 HB3 HIS A 64 68.591 -20.442 -14.764 1.00 1.00 H new ATOM 0 HD2 HIS A 64 65.577 -22.808 -15.929 1.00 1.00 H new ATOM 0 HE1 HIS A 64 69.104 -25.108 -15.609 1.00 1.00 H new ATOM 0 HE2 HIS A 64 66.637 -25.192 -16.297 1.00 1.00 H new ATOM 972 N ASP A 65 68.130 -18.698 -12.767 1.00 1.00 N ATOM 973 CA ASP A 65 68.976 -17.949 -11.844 1.00 1.00 C ATOM 974 C ASP A 65 68.170 -17.527 -10.610 1.00 1.00 C ATOM 975 O ASP A 65 68.571 -17.734 -9.452 1.00 1.00 O ATOM 976 CB ASP A 65 69.525 -16.704 -12.568 1.00 1.00 C ATOM 977 CG ASP A 65 70.926 -16.361 -12.079 1.00 1.00 C ATOM 978 OD1 ASP A 65 71.854 -17.022 -12.513 1.00 1.00 O ATOM 979 OD2 ASP A 65 71.048 -15.441 -11.287 1.00 1.00 O ATOM 0 H ASP A 65 67.913 -18.204 -13.633 1.00 1.00 H new ATOM 0 HA ASP A 65 69.803 -18.578 -11.516 1.00 1.00 H new ATOM 0 HB2 ASP A 65 69.545 -16.883 -13.643 1.00 1.00 H new ATOM 0 HB3 ASP A 65 68.860 -15.858 -12.399 1.00 1.00 H new ATOM 984 N GLY A 66 66.984 -16.999 -10.846 1.00 1.00 N ATOM 985 CA GLY A 66 66.105 -16.604 -9.767 1.00 1.00 C ATOM 986 C GLY A 66 65.562 -17.839 -9.076 1.00 1.00 C ATOM 987 O GLY A 66 64.507 -17.809 -8.444 1.00 1.00 O ATOM 0 H GLY A 66 66.608 -16.834 -11.780 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.646 -15.983 -9.053 1.00 1.00 H new ATOM 0 HA3 GLY A 66 65.284 -16.001 -10.155 1.00 1.00 H new ATOM 991 N ARG A 67 66.342 -18.905 -9.145 1.00 1.00 N ATOM 992 CA ARG A 67 66.017 -20.139 -8.476 1.00 1.00 C ATOM 993 C ARG A 67 66.286 -19.951 -6.998 1.00 1.00 C ATOM 994 O ARG A 67 66.193 -20.915 -6.239 1.00 1.00 O ATOM 995 CB ARG A 67 66.841 -21.338 -8.966 1.00 1.00 C ATOM 996 CG ARG A 67 66.195 -22.036 -10.165 1.00 1.00 C ATOM 997 CD ARG A 67 65.079 -22.968 -9.689 1.00 1.00 C ATOM 998 NE ARG A 67 64.478 -23.641 -10.830 1.00 1.00 N ATOM 999 CZ ARG A 67 64.964 -24.786 -11.293 1.00 1.00 C ATOM 1000 NH1 ARG A 67 65.973 -25.363 -10.695 1.00 1.00 N ATOM 1001 NH2 ARG A 67 64.424 -25.339 -12.341 1.00 1.00 N ATOM 0 H ARG A 67 67.217 -18.932 -9.668 1.00 1.00 H new ATOM 0 HA ARG A 67 64.972 -20.361 -8.690 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.841 -21.001 -9.240 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.957 -22.053 -8.152 1.00 1.00 H new ATOM 0 HG2 ARG A 67 65.791 -21.294 -10.854 1.00 1.00 H new ATOM 0 HG3 ARG A 67 66.946 -22.605 -10.713 1.00 1.00 H new ATOM 0 HD2 ARG A 67 65.480 -23.703 -8.991 1.00 1.00 H new ATOM 0 HD3 ARG A 67 64.321 -22.398 -9.151 1.00 1.00 H new ATOM 0 HE ARG A 67 63.665 -23.224 -11.284 1.00 1.00 H new ATOM 0 HH11 ARG A 67 66.390 -24.933 -9.869 1.00 1.00 H new ATOM 0 HH12 ARG A 67 66.343 -26.243 -11.054 1.00 1.00 H new ATOM 0 HH21 ARG A 67 63.631 -24.892 -12.802 1.00 1.00 H new ATOM 0 HH22 ARG A 67 64.794 -26.219 -12.701 1.00 1.00 H new ATOM 1015 N LEU A 68 66.724 -18.732 -6.613 1.00 1.00 N ATOM 1016 CA LEU A 68 67.101 -18.462 -5.213 1.00 1.00 C ATOM 1017 C LEU A 68 66.227 -19.288 -4.284 1.00 1.00 C ATOM 1018 O LEU A 68 66.621 -19.602 -3.171 1.00 1.00 O ATOM 1019 CB LEU A 68 66.934 -16.967 -4.845 1.00 1.00 C ATOM 1020 CG LEU A 68 65.457 -16.498 -5.055 1.00 1.00 C ATOM 1021 CD1 LEU A 68 64.844 -15.992 -3.740 1.00 1.00 C ATOM 1022 CD2 LEU A 68 65.402 -15.355 -6.072 1.00 1.00 C ATOM 0 H LEU A 68 66.823 -17.934 -7.241 1.00 1.00 H new ATOM 0 HA LEU A 68 68.152 -18.729 -5.101 1.00 1.00 H new ATOM 0 HB2 LEU A 68 67.225 -16.810 -3.806 1.00 1.00 H new ATOM 0 HB3 LEU A 68 67.602 -16.361 -5.458 1.00 1.00 H new ATOM 0 HG LEU A 68 64.892 -17.358 -5.416 1.00 1.00 H new ATOM 0 HD11 LEU A 68 63.817 -15.673 -3.917 1.00 1.00 H new ATOM 0 HD12 LEU A 68 64.853 -16.794 -3.002 1.00 1.00 H new ATOM 0 HD13 LEU A 68 65.427 -15.150 -3.367 1.00 1.00 H new ATOM 0 HD21 LEU A 68 64.368 -15.039 -6.208 1.00 1.00 H new ATOM 0 HD22 LEU A 68 65.993 -14.515 -5.708 1.00 1.00 H new ATOM 0 HD23 LEU A 68 65.806 -15.696 -7.025 1.00 1.00 H new ATOM 1034 N LEU A 69 65.050 -19.655 -4.769 1.00 1.00 N ATOM 1035 CA LEU A 69 64.165 -20.492 -3.951 1.00 1.00 C ATOM 1036 C LEU A 69 64.790 -21.888 -3.773 1.00 1.00 C ATOM 1037 O LEU A 69 65.179 -22.254 -2.666 1.00 1.00 O ATOM 1038 CB LEU A 69 62.800 -20.663 -4.626 1.00 1.00 C ATOM 1039 CG LEU A 69 62.043 -19.312 -4.690 1.00 1.00 C ATOM 1040 CD1 LEU A 69 62.272 -18.639 -6.052 1.00 1.00 C ATOM 1041 CD2 LEU A 69 60.538 -19.555 -4.499 1.00 1.00 C ATOM 0 H LEU A 69 64.689 -19.402 -5.689 1.00 1.00 H new ATOM 0 HA LEU A 69 64.036 -20.002 -2.986 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.934 -21.057 -5.633 1.00 1.00 H new ATOM 0 HB3 LEU A 69 62.206 -21.392 -4.075 1.00 1.00 H new ATOM 0 HG LEU A 69 62.418 -18.663 -3.899 1.00 1.00 H new ATOM 0 HD11 LEU A 69 61.735 -17.691 -6.084 1.00 1.00 H new ATOM 0 HD12 LEU A 69 63.337 -18.458 -6.194 1.00 1.00 H new ATOM 0 HD13 LEU A 69 61.906 -19.290 -6.846 1.00 1.00 H new ATOM 0 HD21 LEU A 69 60.007 -18.604 -4.544 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.173 -20.212 -5.288 1.00 1.00 H new ATOM 0 HD23 LEU A 69 60.365 -20.021 -3.529 1.00 1.00 H new ATOM 1053 N ALA A 70 64.941 -22.647 -4.872 1.00 1.00 N ATOM 1054 CA ALA A 70 65.594 -23.960 -4.736 1.00 1.00 C ATOM 1055 C ALA A 70 67.087 -23.685 -4.708 1.00 1.00 C ATOM 1056 O ALA A 70 67.699 -23.737 -3.649 1.00 1.00 O ATOM 1057 CB ALA A 70 65.227 -24.883 -5.897 1.00 1.00 C ATOM 0 H ALA A 70 64.640 -22.395 -5.813 1.00 1.00 H new ATOM 0 HA ALA A 70 65.268 -24.470 -3.829 1.00 1.00 H new ATOM 0 HB1 ALA A 70 65.724 -25.844 -5.769 1.00 1.00 H new ATOM 0 HB2 ALA A 70 64.147 -25.032 -5.916 1.00 1.00 H new ATOM 0 HB3 ALA A 70 65.547 -24.432 -6.836 1.00 1.00 H new ATOM 1063 N ALA A 71 67.664 -23.412 -5.885 1.00 1.00 N ATOM 1064 CA ALA A 71 69.091 -23.114 -6.066 1.00 1.00 C ATOM 1065 C ALA A 71 69.647 -22.180 -4.997 1.00 1.00 C ATOM 1066 O ALA A 71 70.826 -21.827 -5.058 1.00 1.00 O ATOM 1067 CB ALA A 71 69.325 -22.516 -7.456 1.00 1.00 C ATOM 0 H ALA A 71 67.139 -23.392 -6.759 1.00 1.00 H new ATOM 0 HA ALA A 71 69.627 -24.058 -5.968 1.00 1.00 H new ATOM 0 HB1 ALA A 71 70.385 -22.297 -7.584 1.00 1.00 H new ATOM 0 HB2 ALA A 71 69.007 -23.229 -8.217 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.750 -21.596 -7.558 1.00 1.00 H new ATOM 1073 N HIS A 72 68.805 -21.761 -4.040 1.00 1.00 N ATOM 1074 CA HIS A 72 69.210 -20.844 -2.977 1.00 1.00 C ATOM 1075 C HIS A 72 70.708 -20.940 -2.694 1.00 1.00 C ATOM 1076 O HIS A 72 71.428 -19.953 -2.849 1.00 1.00 O ATOM 1077 CB HIS A 72 68.398 -21.198 -1.709 1.00 1.00 C ATOM 1078 CG HIS A 72 68.845 -22.511 -1.110 1.00 1.00 C ATOM 1079 ND1 HIS A 72 69.252 -23.589 -1.881 1.00 1.00 N ATOM 1080 CD2 HIS A 72 68.922 -22.941 0.192 1.00 1.00 C ATOM 1081 CE1 HIS A 72 69.556 -24.601 -1.048 1.00 1.00 C ATOM 1082 NE2 HIS A 72 69.371 -24.259 0.228 1.00 1.00 N ATOM 0 H HIS A 72 67.828 -22.050 -3.986 1.00 1.00 H new ATOM 0 HA HIS A 72 69.011 -19.818 -3.287 1.00 1.00 H new ATOM 0 HB2 HIS A 72 68.510 -20.404 -0.971 1.00 1.00 H new ATOM 0 HB3 HIS A 72 67.338 -21.253 -1.959 1.00 1.00 H new ATOM 0 HD1 HIS A 72 69.311 -23.611 -2.899 1.00 1.00 H new ATOM 0 HD2 HIS A 72 68.672 -22.346 1.058 1.00 1.00 H new ATOM 0 HE1 HIS A 72 69.906 -25.570 -1.372 1.00 1.00 H new ATOM 1090 N MET A 73 71.188 -22.116 -2.331 1.00 1.00 N ATOM 1091 CA MET A 73 72.609 -22.293 -2.101 1.00 1.00 C ATOM 1092 C MET A 73 73.348 -22.349 -3.436 1.00 1.00 C ATOM 1093 O MET A 73 74.386 -21.710 -3.602 1.00 1.00 O ATOM 1094 CB MET A 73 72.851 -23.559 -1.277 1.00 1.00 C ATOM 1095 CG MET A 73 72.518 -23.252 0.187 1.00 1.00 C ATOM 1096 SD MET A 73 72.655 -24.743 1.197 1.00 1.00 S ATOM 1097 CE MET A 73 72.460 -23.914 2.794 1.00 1.00 C ATOM 0 H MET A 73 70.622 -22.953 -2.191 1.00 1.00 H new ATOM 0 HA MET A 73 72.995 -21.445 -1.536 1.00 1.00 H new ATOM 0 HB2 MET A 73 72.230 -24.376 -1.644 1.00 1.00 H new ATOM 0 HB3 MET A 73 73.888 -23.881 -1.371 1.00 1.00 H new ATOM 0 HG2 MET A 73 73.194 -22.486 0.566 1.00 1.00 H new ATOM 0 HG3 MET A 73 71.508 -22.849 0.259 1.00 1.00 H new ATOM 0 HE1 MET A 73 72.511 -24.651 3.595 1.00 1.00 H new ATOM 0 HE2 MET A 73 73.257 -23.182 2.923 1.00 1.00 H new ATOM 0 HE3 MET A 73 71.494 -23.409 2.826 1.00 1.00 H new ATOM 1107 N VAL A 74 72.864 -23.186 -4.361 1.00 1.00 N ATOM 1108 CA VAL A 74 73.560 -23.382 -5.630 1.00 1.00 C ATOM 1109 C VAL A 74 74.019 -22.065 -6.236 1.00 1.00 C ATOM 1110 O VAL A 74 75.157 -22.009 -6.693 1.00 1.00 O ATOM 1111 CB VAL A 74 72.665 -24.112 -6.622 1.00 1.00 C ATOM 1112 CG1 VAL A 74 73.405 -24.326 -7.944 1.00 1.00 C ATOM 1113 CG2 VAL A 74 72.237 -25.465 -6.050 1.00 1.00 C ATOM 0 H VAL A 74 72.007 -23.729 -4.255 1.00 1.00 H new ATOM 0 HA VAL A 74 74.443 -23.985 -5.420 1.00 1.00 H new ATOM 0 HB VAL A 74 71.779 -23.503 -6.803 1.00 1.00 H new ATOM 0 HG11 VAL A 74 72.754 -24.849 -8.645 1.00 1.00 H new ATOM 0 HG12 VAL A 74 73.688 -23.360 -8.363 1.00 1.00 H new ATOM 0 HG13 VAL A 74 74.301 -24.921 -7.767 1.00 1.00 H new ATOM 0 HG21 VAL A 74 71.597 -25.978 -6.768 1.00 1.00 H new ATOM 0 HG22 VAL A 74 73.120 -26.072 -5.852 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.688 -25.310 -5.121 1.00 1.00 H new ATOM 1123 N ASN A 75 73.220 -20.978 -6.226 1.00 1.00 N ATOM 1124 CA ASN A 75 73.670 -19.670 -6.746 1.00 1.00 C ATOM 1125 C ASN A 75 75.127 -19.365 -6.367 1.00 1.00 C ATOM 1126 O ASN A 75 75.768 -18.489 -6.943 1.00 1.00 O ATOM 1127 CB ASN A 75 72.745 -18.606 -6.117 1.00 1.00 C ATOM 1128 CG ASN A 75 72.667 -17.329 -6.947 1.00 1.00 C ATOM 1129 OD1 ASN A 75 72.585 -17.383 -8.170 1.00 1.00 O ATOM 1130 ND2 ASN A 75 72.654 -16.172 -6.336 1.00 1.00 N ATOM 0 H ASN A 75 72.266 -20.979 -5.866 1.00 1.00 H new ATOM 0 HA ASN A 75 73.621 -19.673 -7.835 1.00 1.00 H new ATOM 0 HB2 ASN A 75 71.744 -19.022 -6.003 1.00 1.00 H new ATOM 0 HB3 ASN A 75 73.105 -18.363 -5.117 1.00 1.00 H new ATOM 0 HD21 ASN A 75 72.575 -15.311 -6.877 1.00 1.00 H new ATOM 0 HD22 ASN A 75 72.722 -16.131 -5.319 1.00 1.00 H new ATOM 1137 N GLY A 76 75.626 -20.134 -5.417 1.00 1.00 N ATOM 1138 CA GLY A 76 77.005 -19.990 -4.958 1.00 1.00 C ATOM 1139 C GLY A 76 77.924 -19.863 -6.186 1.00 1.00 C ATOM 1140 O GLY A 76 79.037 -19.339 -6.119 1.00 1.00 O ATOM 0 H GLY A 76 75.099 -20.868 -4.944 1.00 1.00 H new ATOM 0 HA2 GLY A 76 77.101 -19.110 -4.322 1.00 1.00 H new ATOM 0 HA3 GLY A 76 77.295 -20.852 -4.357 1.00 1.00 H new ATOM 1144 N ILE A 77 77.426 -20.392 -7.297 1.00 1.00 N ATOM 1145 CA ILE A 77 78.178 -20.385 -8.564 1.00 1.00 C ATOM 1146 C ILE A 77 77.873 -19.121 -9.365 1.00 1.00 C ATOM 1147 O ILE A 77 78.788 -18.359 -9.686 1.00 1.00 O ATOM 1148 CB ILE A 77 77.903 -21.657 -9.389 1.00 1.00 C ATOM 1149 CG1 ILE A 77 76.396 -21.790 -9.685 1.00 1.00 C ATOM 1150 CG2 ILE A 77 78.406 -22.884 -8.607 1.00 1.00 C ATOM 1151 CD1 ILE A 77 76.048 -23.244 -10.039 1.00 1.00 C ATOM 0 H ILE A 77 76.508 -20.832 -7.355 1.00 1.00 H new ATOM 0 HA ILE A 77 79.241 -20.382 -8.325 1.00 1.00 H new ATOM 0 HB ILE A 77 78.431 -21.592 -10.340 1.00 1.00 H new ATOM 0 HG12 ILE A 77 75.819 -21.472 -8.817 1.00 1.00 H new ATOM 0 HG13 ILE A 77 76.121 -21.132 -10.509 1.00 1.00 H new ATOM 0 HG21 ILE A 77 78.214 -23.788 -9.185 1.00 1.00 H new ATOM 0 HG22 ILE A 77 79.477 -22.788 -8.428 1.00 1.00 H new ATOM 0 HG23 ILE A 77 77.883 -22.946 -7.653 1.00 1.00 H new ATOM 0 HD11 ILE A 77 74.981 -23.323 -10.246 1.00 1.00 H new ATOM 0 HD12 ILE A 77 76.612 -23.549 -10.921 1.00 1.00 H new ATOM 0 HD13 ILE A 77 76.304 -23.894 -9.202 1.00 1.00 H new ATOM 1163 N VAL A 78 76.604 -18.943 -9.746 1.00 1.00 N ATOM 1164 CA VAL A 78 76.204 -17.813 -10.559 1.00 1.00 C ATOM 1165 C VAL A 78 76.998 -16.592 -10.143 1.00 1.00 C ATOM 1166 O VAL A 78 77.288 -15.718 -10.961 1.00 1.00 O ATOM 1167 CB VAL A 78 74.711 -17.573 -10.371 1.00 1.00 C ATOM 1168 CG1 VAL A 78 74.232 -16.415 -11.251 1.00 1.00 C ATOM 1169 CG2 VAL A 78 73.951 -18.850 -10.745 1.00 1.00 C ATOM 0 H VAL A 78 75.842 -19.574 -9.499 1.00 1.00 H new ATOM 0 HA VAL A 78 76.401 -18.014 -11.612 1.00 1.00 H new ATOM 0 HB VAL A 78 74.522 -17.314 -9.329 1.00 1.00 H new ATOM 0 HG11 VAL A 78 73.163 -16.262 -11.101 1.00 1.00 H new ATOM 0 HG12 VAL A 78 74.771 -15.506 -10.982 1.00 1.00 H new ATOM 0 HG13 VAL A 78 74.421 -16.652 -12.298 1.00 1.00 H new ATOM 0 HG21 VAL A 78 72.881 -18.688 -10.614 1.00 1.00 H new ATOM 0 HG22 VAL A 78 74.155 -19.103 -11.785 1.00 1.00 H new ATOM 0 HG23 VAL A 78 74.276 -19.668 -10.102 1.00 1.00 H new ATOM 1179 N ILE A 79 77.376 -16.546 -8.872 1.00 1.00 N ATOM 1180 CA ILE A 79 78.156 -15.428 -8.413 1.00 1.00 C ATOM 1181 C ILE A 79 79.514 -15.426 -9.116 1.00 1.00 C ATOM 1182 O ILE A 79 79.907 -14.425 -9.694 1.00 1.00 O ATOM 1183 CB ILE A 79 78.357 -15.448 -6.879 1.00 1.00 C ATOM 1184 CG1 ILE A 79 79.415 -16.509 -6.515 1.00 1.00 C ATOM 1185 CG2 ILE A 79 77.017 -15.736 -6.161 1.00 1.00 C ATOM 1186 CD1 ILE A 79 79.368 -16.856 -5.022 1.00 1.00 C ATOM 0 H ILE A 79 77.159 -17.251 -8.167 1.00 1.00 H new ATOM 0 HA ILE A 79 77.608 -14.518 -8.658 1.00 1.00 H new ATOM 0 HB ILE A 79 78.709 -14.471 -6.548 1.00 1.00 H new ATOM 0 HG12 ILE A 79 79.247 -17.410 -7.105 1.00 1.00 H new ATOM 0 HG13 ILE A 79 80.407 -16.139 -6.773 1.00 1.00 H new ATOM 0 HG21 ILE A 79 77.177 -15.746 -5.083 1.00 1.00 H new ATOM 0 HG22 ILE A 79 76.295 -14.960 -6.413 1.00 1.00 H new ATOM 0 HG23 ILE A 79 76.634 -16.705 -6.480 1.00 1.00 H new ATOM 0 HD11 ILE A 79 80.126 -17.607 -4.799 1.00 1.00 H new ATOM 0 HD12 ILE A 79 79.561 -15.959 -4.434 1.00 1.00 H new ATOM 0 HD13 ILE A 79 78.383 -17.249 -4.771 1.00 1.00 H new ATOM 1198 N ALA A 80 80.250 -16.539 -9.082 1.00 1.00 N ATOM 1199 CA ALA A 80 81.554 -16.521 -9.723 1.00 1.00 C ATOM 1200 C ALA A 80 81.442 -16.109 -11.187 1.00 1.00 C ATOM 1201 O ALA A 80 81.977 -15.081 -11.550 1.00 1.00 O ATOM 1202 CB ALA A 80 82.239 -17.887 -9.605 1.00 1.00 C ATOM 0 H ALA A 80 79.980 -17.418 -8.641 1.00 1.00 H new ATOM 0 HA ALA A 80 82.166 -15.781 -9.207 1.00 1.00 H new ATOM 0 HB1 ALA A 80 83.213 -17.849 -10.092 1.00 1.00 H new ATOM 0 HB2 ALA A 80 82.369 -18.139 -8.553 1.00 1.00 H new ATOM 0 HB3 ALA A 80 81.622 -18.646 -10.086 1.00 1.00 H new ATOM 1208 N GLU A 81 80.753 -16.896 -12.022 1.00 1.00 N ATOM 1209 CA GLU A 81 80.647 -16.533 -13.432 1.00 1.00 C ATOM 1210 C GLU A 81 80.200 -15.076 -13.574 1.00 1.00 C ATOM 1211 O GLU A 81 80.970 -14.227 -14.018 1.00 1.00 O ATOM 1212 CB GLU A 81 79.664 -17.462 -14.128 1.00 1.00 C ATOM 1213 CG GLU A 81 80.184 -18.895 -14.010 1.00 1.00 C ATOM 1214 CD GLU A 81 79.174 -19.875 -14.594 1.00 1.00 C ATOM 1215 OE1 GLU A 81 78.899 -19.776 -15.776 1.00 1.00 O ATOM 1216 OE2 GLU A 81 78.694 -20.712 -13.847 1.00 1.00 O ATOM 0 H GLU A 81 80.277 -17.758 -11.755 1.00 1.00 H new ATOM 0 HA GLU A 81 81.625 -16.638 -13.902 1.00 1.00 H new ATOM 0 HB2 GLU A 81 78.677 -17.379 -13.673 1.00 1.00 H new ATOM 0 HB3 GLU A 81 79.557 -17.183 -15.176 1.00 1.00 H new ATOM 0 HG2 GLU A 81 81.135 -18.988 -14.534 1.00 1.00 H new ATOM 0 HG3 GLU A 81 80.371 -19.136 -12.964 1.00 1.00 H new ATOM 1223 N ASP A 82 78.950 -14.779 -13.260 1.00 1.00 N ATOM 1224 CA ASP A 82 78.497 -13.405 -13.432 1.00 1.00 C ATOM 1225 C ASP A 82 79.293 -12.475 -12.517 1.00 1.00 C ATOM 1226 O ASP A 82 79.988 -11.578 -12.992 1.00 1.00 O ATOM 1227 CB ASP A 82 77.007 -13.287 -13.123 1.00 1.00 C ATOM 1228 CG ASP A 82 76.491 -11.923 -13.572 1.00 1.00 C ATOM 1229 OD1 ASP A 82 76.338 -11.736 -14.768 1.00 1.00 O ATOM 1230 OD2 ASP A 82 76.256 -11.090 -12.714 1.00 1.00 O ATOM 0 H ASP A 82 78.257 -15.435 -12.901 1.00 1.00 H new ATOM 0 HA ASP A 82 78.660 -13.115 -14.470 1.00 1.00 H new ATOM 0 HB2 ASP A 82 76.457 -14.079 -13.631 1.00 1.00 H new ATOM 0 HB3 ASP A 82 76.837 -13.416 -12.054 1.00 1.00 H new ATOM 1235 N ALA A 83 79.159 -12.656 -11.209 1.00 1.00 N ATOM 1236 CA ALA A 83 79.863 -11.759 -10.304 1.00 1.00 C ATOM 1237 C ALA A 83 81.360 -11.699 -10.641 1.00 1.00 C ATOM 1238 O ALA A 83 82.037 -10.808 -10.129 1.00 1.00 O ATOM 1239 CB ALA A 83 79.643 -12.072 -8.802 1.00 1.00 C ATOM 0 H ALA A 83 78.596 -13.382 -10.766 1.00 1.00 H new ATOM 0 HA ALA A 83 79.422 -10.775 -10.466 1.00 1.00 H new ATOM 0 HB1 ALA A 83 80.201 -11.358 -8.196 1.00 1.00 H new ATOM 0 HB2 ALA A 83 78.582 -11.996 -8.566 1.00 1.00 H new ATOM 0 HB3 ALA A 83 79.991 -13.082 -8.586 1.00 1.00 H new ATOM 1245 N LEU A 84 81.922 -12.629 -11.476 1.00 1.00 N ATOM 1246 CA LEU A 84 83.362 -12.591 -11.808 1.00 1.00 C ATOM 1247 C LEU A 84 83.854 -11.179 -12.042 1.00 1.00 C ATOM 1248 O LEU A 84 85.055 -10.918 -12.028 1.00 1.00 O ATOM 1249 CB LEU A 84 83.654 -13.392 -13.106 1.00 1.00 C ATOM 1250 CG LEU A 84 85.131 -13.868 -13.141 1.00 1.00 C ATOM 1251 CD1 LEU A 84 85.226 -15.322 -12.651 1.00 1.00 C ATOM 1252 CD2 LEU A 84 85.679 -13.792 -14.573 1.00 1.00 C ATOM 0 H LEU A 84 81.405 -13.391 -11.915 1.00 1.00 H new ATOM 0 HA LEU A 84 83.877 -13.028 -10.953 1.00 1.00 H new ATOM 0 HB2 LEU A 84 82.988 -14.253 -13.164 1.00 1.00 H new ATOM 0 HB3 LEU A 84 83.447 -12.770 -13.977 1.00 1.00 H new ATOM 0 HG LEU A 84 85.717 -13.219 -12.490 1.00 1.00 H new ATOM 0 HD11 LEU A 84 86.266 -15.648 -12.679 1.00 1.00 H new ATOM 0 HD12 LEU A 84 84.853 -15.387 -11.629 1.00 1.00 H new ATOM 0 HD13 LEU A 84 84.627 -15.964 -13.297 1.00 1.00 H new ATOM 0 HD21 LEU A 84 86.716 -14.128 -14.584 1.00 1.00 H new ATOM 0 HD22 LEU A 84 85.083 -14.431 -15.225 1.00 1.00 H new ATOM 0 HD23 LEU A 84 85.628 -12.763 -14.928 1.00 1.00 H new ATOM 1264 N ILE A 85 82.926 -10.280 -12.253 1.00 1.00 N ATOM 1265 CA ILE A 85 83.291 -8.912 -12.481 1.00 1.00 C ATOM 1266 C ILE A 85 83.997 -8.374 -11.250 1.00 1.00 C ATOM 1267 O ILE A 85 84.993 -7.657 -11.368 1.00 1.00 O ATOM 1268 CB ILE A 85 82.052 -8.089 -12.830 1.00 1.00 C ATOM 1269 CG1 ILE A 85 80.972 -8.314 -11.773 1.00 1.00 C ATOM 1270 CG2 ILE A 85 81.521 -8.534 -14.194 1.00 1.00 C ATOM 1271 CD1 ILE A 85 79.744 -7.464 -12.103 1.00 1.00 C ATOM 0 H ILE A 85 81.924 -10.471 -12.271 1.00 1.00 H new ATOM 0 HA ILE A 85 83.975 -8.843 -13.327 1.00 1.00 H new ATOM 0 HB ILE A 85 82.315 -7.032 -12.861 1.00 1.00 H new ATOM 0 HG12 ILE A 85 80.698 -9.368 -11.738 1.00 1.00 H new ATOM 0 HG13 ILE A 85 81.354 -8.051 -10.787 1.00 1.00 H new ATOM 0 HG21 ILE A 85 80.637 -7.950 -14.448 1.00 1.00 H new ATOM 0 HG22 ILE A 85 82.289 -8.378 -14.952 1.00 1.00 H new ATOM 0 HG23 ILE A 85 81.259 -9.591 -14.155 1.00 1.00 H new ATOM 0 HD11 ILE A 85 78.975 -7.626 -11.347 1.00 1.00 H new ATOM 0 HD12 ILE A 85 80.023 -6.411 -12.116 1.00 1.00 H new ATOM 0 HD13 ILE A 85 79.357 -7.748 -13.081 1.00 1.00 H new ATOM 1283 N ALA A 86 83.489 -8.712 -10.055 1.00 1.00 N ATOM 1284 CA ALA A 86 84.063 -8.271 -8.786 1.00 1.00 C ATOM 1285 C ALA A 86 84.993 -9.326 -8.162 1.00 1.00 C ATOM 1286 O ALA A 86 85.597 -9.104 -7.114 1.00 1.00 O ATOM 1287 CB ALA A 86 82.947 -7.915 -7.804 1.00 1.00 C ATOM 0 H ALA A 86 82.664 -9.302 -9.947 1.00 1.00 H new ATOM 0 HA ALA A 86 84.669 -7.389 -8.996 1.00 1.00 H new ATOM 0 HB1 ALA A 86 83.383 -7.587 -6.860 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.338 -7.112 -8.220 1.00 1.00 H new ATOM 0 HB3 ALA A 86 82.322 -8.791 -7.630 1.00 1.00 H new ATOM 1293 N GLU A 87 85.082 -10.463 -8.826 1.00 1.00 N ATOM 1294 CA GLU A 87 85.939 -11.547 -8.326 1.00 1.00 C ATOM 1295 C GLU A 87 87.341 -11.008 -8.034 1.00 1.00 C ATOM 1296 O GLU A 87 88.083 -11.597 -7.249 1.00 1.00 O ATOM 1297 CB GLU A 87 85.997 -12.741 -9.289 1.00 1.00 C ATOM 1298 CG GLU A 87 87.114 -13.724 -8.889 1.00 1.00 C ATOM 1299 CD GLU A 87 86.853 -14.259 -7.484 1.00 1.00 C ATOM 1300 OE1 GLU A 87 85.700 -14.277 -7.084 1.00 1.00 O ATOM 1301 OE2 GLU A 87 87.808 -14.638 -6.828 1.00 1.00 O ATOM 0 H GLU A 87 84.588 -10.668 -9.694 1.00 1.00 H new ATOM 0 HA GLU A 87 85.498 -11.919 -7.401 1.00 1.00 H new ATOM 0 HB2 GLU A 87 85.037 -13.258 -9.290 1.00 1.00 H new ATOM 0 HB3 GLU A 87 86.169 -12.385 -10.305 1.00 1.00 H new ATOM 0 HG2 GLU A 87 87.157 -14.549 -9.600 1.00 1.00 H new ATOM 0 HG3 GLU A 87 88.081 -13.223 -8.923 1.00 1.00 H new ATOM 1308 N ALA A 88 87.691 -9.872 -8.642 1.00 1.00 N ATOM 1309 CA ALA A 88 89.009 -9.251 -8.410 1.00 1.00 C ATOM 1310 C ALA A 88 88.825 -7.817 -7.907 1.00 1.00 C ATOM 1311 O ALA A 88 89.768 -7.028 -7.857 1.00 1.00 O ATOM 1312 CB ALA A 88 89.851 -9.280 -9.691 1.00 1.00 C ATOM 0 H ALA A 88 87.092 -9.364 -9.293 1.00 1.00 H new ATOM 0 HA ALA A 88 89.541 -9.821 -7.648 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.819 -8.818 -9.500 1.00 1.00 H new ATOM 0 HB2 ALA A 88 89.998 -10.313 -10.007 1.00 1.00 H new ATOM 0 HB3 ALA A 88 89.335 -8.730 -10.478 1.00 1.00 H new ATOM 1318 N VAL A 89 87.593 -7.529 -7.494 1.00 1.00 N ATOM 1319 CA VAL A 89 87.249 -6.215 -6.937 1.00 1.00 C ATOM 1320 C VAL A 89 87.001 -6.342 -5.445 1.00 1.00 C ATOM 1321 O VAL A 89 86.268 -5.553 -4.858 1.00 1.00 O ATOM 1322 CB VAL A 89 86.049 -5.571 -7.645 1.00 1.00 C ATOM 1323 CG1 VAL A 89 85.833 -4.119 -7.146 1.00 1.00 C ATOM 1324 CG2 VAL A 89 86.332 -5.551 -9.160 1.00 1.00 C ATOM 0 H VAL A 89 86.813 -8.185 -7.533 1.00 1.00 H new ATOM 0 HA VAL A 89 88.095 -5.549 -7.106 1.00 1.00 H new ATOM 0 HB VAL A 89 85.150 -6.148 -7.428 1.00 1.00 H new ATOM 0 HG11 VAL A 89 84.978 -3.681 -7.660 1.00 1.00 H new ATOM 0 HG12 VAL A 89 85.645 -4.127 -6.072 1.00 1.00 H new ATOM 0 HG13 VAL A 89 86.724 -3.526 -7.354 1.00 1.00 H new ATOM 0 HG21 VAL A 89 85.490 -5.096 -9.682 1.00 1.00 H new ATOM 0 HG22 VAL A 89 87.234 -4.971 -9.354 1.00 1.00 H new ATOM 0 HG23 VAL A 89 86.472 -6.571 -9.517 1.00 1.00 H new ATOM 1334 N GLY A 90 87.671 -7.312 -4.818 1.00 1.00 N ATOM 1335 CA GLY A 90 87.562 -7.490 -3.385 1.00 1.00 C ATOM 1336 C GLY A 90 88.229 -6.319 -2.671 1.00 1.00 C ATOM 1337 O GLY A 90 87.673 -5.783 -1.713 1.00 1.00 O ATOM 0 H GLY A 90 88.288 -7.977 -5.284 1.00 1.00 H new ATOM 0 HA2 GLY A 90 86.513 -7.556 -3.095 1.00 1.00 H new ATOM 0 HA3 GLY A 90 88.034 -8.427 -3.088 1.00 1.00 H new ATOM 1341 N PRO A 91 89.397 -5.888 -3.123 1.00 1.00 N ATOM 1342 CA PRO A 91 90.099 -4.733 -2.499 1.00 1.00 C ATOM 1343 C PRO A 91 89.134 -3.588 -2.254 1.00 1.00 C ATOM 1344 O PRO A 91 89.436 -2.649 -1.519 1.00 1.00 O ATOM 1345 CB PRO A 91 91.175 -4.363 -3.522 1.00 1.00 C ATOM 1346 CG PRO A 91 91.493 -5.649 -4.207 1.00 1.00 C ATOM 1347 CD PRO A 91 90.177 -6.439 -4.256 1.00 1.00 C ATOM 0 HA PRO A 91 90.525 -4.965 -1.523 1.00 1.00 H new ATOM 0 HB2 PRO A 91 90.812 -3.616 -4.228 1.00 1.00 H new ATOM 0 HB3 PRO A 91 92.056 -3.942 -3.037 1.00 1.00 H new ATOM 0 HG2 PRO A 91 91.879 -5.471 -5.211 1.00 1.00 H new ATOM 0 HG3 PRO A 91 92.260 -6.201 -3.664 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.660 -6.298 -5.205 1.00 1.00 H new ATOM 0 HD3 PRO A 91 90.348 -7.510 -4.142 1.00 1.00 H new ATOM 1355 N HIS A 92 87.963 -3.680 -2.876 1.00 1.00 N ATOM 1356 CA HIS A 92 86.966 -2.642 -2.716 1.00 1.00 C ATOM 1357 C HIS A 92 86.670 -2.505 -1.243 1.00 1.00 C ATOM 1358 O HIS A 92 86.142 -1.510 -0.818 1.00 1.00 O ATOM 1359 CB HIS A 92 85.679 -2.977 -3.472 1.00 1.00 C ATOM 1360 CG HIS A 92 84.782 -1.762 -3.506 1.00 1.00 C ATOM 1361 ND1 HIS A 92 83.644 -1.652 -2.717 1.00 1.00 N ATOM 1362 CD2 HIS A 92 84.845 -0.592 -4.229 1.00 1.00 C ATOM 1363 CE1 HIS A 92 83.077 -0.458 -2.982 1.00 1.00 C ATOM 1364 NE2 HIS A 92 83.769 0.227 -3.895 1.00 1.00 N ATOM 0 H HIS A 92 87.689 -4.451 -3.485 1.00 1.00 H new ATOM 0 HA HIS A 92 87.352 -1.709 -3.126 1.00 1.00 H new ATOM 0 HB2 HIS A 92 85.914 -3.297 -4.487 1.00 1.00 H new ATOM 0 HB3 HIS A 92 85.166 -3.807 -2.987 1.00 1.00 H new ATOM 0 HD1 HIS A 92 83.300 -2.349 -2.056 1.00 1.00 H new ATOM 0 HD2 HIS A 92 85.613 -0.346 -4.947 1.00 1.00 H new ATOM 0 HE1 HIS A 92 82.173 -0.099 -2.513 1.00 1.00 H new ATOM 1372 N LEU A 93 87.045 -3.514 -0.470 1.00 1.00 N ATOM 1373 CA LEU A 93 86.836 -3.448 0.973 1.00 1.00 C ATOM 1374 C LEU A 93 87.646 -2.277 1.544 1.00 1.00 C ATOM 1375 O LEU A 93 87.094 -1.387 2.195 1.00 1.00 O ATOM 1376 CB LEU A 93 87.238 -4.773 1.643 1.00 1.00 C ATOM 1377 CG LEU A 93 88.726 -5.117 1.346 1.00 1.00 C ATOM 1378 CD1 LEU A 93 89.640 -4.680 2.518 1.00 1.00 C ATOM 1379 CD2 LEU A 93 88.874 -6.631 1.121 1.00 1.00 C ATOM 0 H LEU A 93 87.486 -4.371 -0.805 1.00 1.00 H new ATOM 0 HA LEU A 93 85.778 -3.285 1.178 1.00 1.00 H new ATOM 0 HB2 LEU A 93 87.085 -4.702 2.720 1.00 1.00 H new ATOM 0 HB3 LEU A 93 86.596 -5.577 1.283 1.00 1.00 H new ATOM 0 HG LEU A 93 89.029 -4.578 0.448 1.00 1.00 H new ATOM 0 HD11 LEU A 93 90.675 -4.932 2.286 1.00 1.00 H new ATOM 0 HD12 LEU A 93 89.553 -3.604 2.666 1.00 1.00 H new ATOM 0 HD13 LEU A 93 89.337 -5.197 3.428 1.00 1.00 H new ATOM 0 HD21 LEU A 93 89.918 -6.868 0.913 1.00 1.00 H new ATOM 0 HD22 LEU A 93 88.552 -7.165 2.015 1.00 1.00 H new ATOM 0 HD23 LEU A 93 88.258 -6.935 0.275 1.00 1.00 H new ATOM 1391 N ALA A 94 88.953 -2.282 1.285 1.00 1.00 N ATOM 1392 CA ALA A 94 89.821 -1.217 1.765 1.00 1.00 C ATOM 1393 C ALA A 94 89.311 0.102 1.227 1.00 1.00 C ATOM 1394 O ALA A 94 89.059 1.044 1.980 1.00 1.00 O ATOM 1395 CB ALA A 94 91.254 -1.441 1.288 1.00 1.00 C ATOM 0 H ALA A 94 89.428 -3.008 0.749 1.00 1.00 H new ATOM 0 HA ALA A 94 89.815 -1.210 2.855 1.00 1.00 H new ATOM 0 HB1 ALA A 94 91.890 -0.636 1.656 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.619 -2.395 1.669 1.00 1.00 H new ATOM 0 HB3 ALA A 94 91.277 -1.453 0.198 1.00 1.00 H new ATOM 1401 N ARG A 95 89.126 0.151 -0.087 1.00 1.00 N ATOM 1402 CA ARG A 95 88.610 1.351 -0.708 1.00 1.00 C ATOM 1403 C ARG A 95 87.268 1.638 -0.055 1.00 1.00 C ATOM 1404 O ARG A 95 87.049 2.656 0.602 1.00 1.00 O ATOM 1405 CB ARG A 95 88.456 1.139 -2.225 1.00 1.00 C ATOM 1406 CG ARG A 95 88.285 2.493 -2.931 1.00 1.00 C ATOM 1407 CD ARG A 95 88.076 2.282 -4.436 1.00 1.00 C ATOM 1408 NE ARG A 95 86.717 1.803 -4.692 1.00 1.00 N ATOM 1409 CZ ARG A 95 86.052 2.138 -5.801 1.00 1.00 C ATOM 1410 NH1 ARG A 95 86.621 2.880 -6.714 1.00 1.00 N ATOM 1411 NH2 ARG A 95 84.829 1.719 -5.974 1.00 1.00 N ATOM 0 H ARG A 95 89.324 -0.616 -0.729 1.00 1.00 H new ATOM 0 HA ARG A 95 89.288 2.194 -0.571 1.00 1.00 H new ATOM 0 HB2 ARG A 95 89.331 0.622 -2.619 1.00 1.00 H new ATOM 0 HB3 ARG A 95 87.594 0.503 -2.426 1.00 1.00 H new ATOM 0 HG2 ARG A 95 87.433 3.026 -2.509 1.00 1.00 H new ATOM 0 HG3 ARG A 95 89.165 3.113 -2.762 1.00 1.00 H new ATOM 0 HD2 ARG A 95 88.247 3.217 -4.970 1.00 1.00 H new ATOM 0 HD3 ARG A 95 88.801 1.562 -4.814 1.00 1.00 H new ATOM 0 HE ARG A 95 86.266 1.198 -4.006 1.00 1.00 H new ATOM 0 HH11 ARG A 95 87.578 3.207 -6.582 1.00 1.00 H new ATOM 0 HH12 ARG A 95 86.108 3.132 -7.559 1.00 1.00 H new ATOM 0 HH21 ARG A 95 84.384 1.138 -5.264 1.00 1.00 H new ATOM 0 HH22 ARG A 95 84.318 1.973 -6.819 1.00 1.00 H new ATOM 1425 N ALA A 96 86.347 0.725 -0.123 1.00 1.00 N ATOM 1426 CA ALA A 96 85.084 0.949 0.515 1.00 1.00 C ATOM 1427 C ALA A 96 85.260 1.461 1.933 1.00 1.00 C ATOM 1428 O ALA A 96 84.266 1.581 2.631 1.00 1.00 O ATOM 1429 CB ALA A 96 84.241 -0.290 0.455 1.00 1.00 C ATOM 0 H ALA A 96 86.442 -0.169 -0.605 1.00 1.00 H new ATOM 0 HA ALA A 96 84.556 1.732 -0.030 1.00 1.00 H new ATOM 0 HB1 ALA A 96 83.285 -0.104 0.944 1.00 1.00 H new ATOM 0 HB2 ALA A 96 84.069 -0.563 -0.586 1.00 1.00 H new ATOM 0 HB3 ALA A 96 84.756 -1.105 0.964 1.00 1.00 H new ATOM 1435 N LEU A 97 86.511 1.406 2.442 1.00 1.00 N ATOM 1436 CA LEU A 97 86.830 1.548 3.875 1.00 1.00 C ATOM 1437 C LEU A 97 85.587 1.533 4.742 1.00 1.00 C ATOM 1438 O LEU A 97 85.564 0.784 5.699 1.00 1.00 O ATOM 1439 CB LEU A 97 87.493 2.938 4.042 1.00 1.00 C ATOM 1440 CG LEU A 97 86.472 4.076 3.681 1.00 1.00 C ATOM 1441 CD1 LEU A 97 85.748 4.618 4.939 1.00 1.00 C ATOM 1442 CD2 LEU A 97 87.190 5.233 2.967 1.00 1.00 C ATOM 0 H LEU A 97 87.336 1.260 1.860 1.00 1.00 H new ATOM 0 HA LEU A 97 87.468 0.719 4.181 1.00 1.00 H new ATOM 0 HB2 LEU A 97 87.839 3.063 5.068 1.00 1.00 H new ATOM 0 HB3 LEU A 97 88.370 3.010 3.399 1.00 1.00 H new ATOM 0 HG LEU A 97 85.725 3.641 3.017 1.00 1.00 H new ATOM 0 HD11 LEU A 97 85.051 5.403 4.647 1.00 1.00 H new ATOM 0 HD12 LEU A 97 85.201 3.808 5.421 1.00 1.00 H new ATOM 0 HD13 LEU A 97 86.482 5.025 5.634 1.00 1.00 H new ATOM 0 HD21 LEU A 97 86.469 6.014 2.723 1.00 1.00 H new ATOM 0 HD22 LEU A 97 87.960 5.642 3.621 1.00 1.00 H new ATOM 0 HD23 LEU A 97 87.650 4.865 2.050 1.00 1.00 H new ATOM 1454 N GLY A 98 84.534 2.221 4.435 1.00 1.00 N ATOM 1455 CA GLY A 98 83.347 2.047 5.218 1.00 1.00 C ATOM 1456 C GLY A 98 83.052 0.541 5.230 1.00 1.00 C ATOM 1457 O GLY A 98 82.445 0.033 6.167 1.00 1.00 O ATOM 0 H GLY A 98 84.467 2.892 3.670 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.492 2.422 6.231 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.513 2.603 4.788 1.00 1.00 H new ATOM 1461 N GLN A 99 83.551 -0.216 4.207 1.00 1.00 N ATOM 1462 CA GLN A 99 83.321 -1.670 4.254 1.00 1.00 C ATOM 1463 C GLN A 99 83.928 -2.158 5.542 1.00 1.00 C ATOM 1464 O GLN A 99 83.568 -3.198 6.089 1.00 1.00 O ATOM 1465 CB GLN A 99 83.984 -2.375 3.074 1.00 1.00 C ATOM 1466 CG GLN A 99 83.647 -3.877 3.024 1.00 1.00 C ATOM 1467 CD GLN A 99 82.518 -4.128 2.019 1.00 1.00 C ATOM 1468 OE1 GLN A 99 81.348 -3.908 2.330 1.00 1.00 O ATOM 1469 NE2 GLN A 99 82.808 -4.555 0.819 1.00 1.00 N ATOM 0 H GLN A 99 84.074 0.133 3.404 1.00 1.00 H new ATOM 0 HA GLN A 99 82.254 -1.886 4.200 1.00 1.00 H new ATOM 0 HB2 GLN A 99 83.664 -1.902 2.145 1.00 1.00 H new ATOM 0 HB3 GLN A 99 85.065 -2.250 3.140 1.00 1.00 H new ATOM 0 HG2 GLN A 99 84.531 -4.447 2.740 1.00 1.00 H new ATOM 0 HG3 GLN A 99 83.348 -4.224 4.013 1.00 1.00 H new ATOM 0 HE21 GLN A 99 83.778 -4.737 0.563 1.00 1.00 H new ATOM 0 HE22 GLN A 99 82.064 -4.707 0.138 1.00 1.00 H new ATOM 1478 N ILE A 100 84.836 -1.345 6.035 1.00 1.00 N ATOM 1479 CA ILE A 100 85.493 -1.649 7.306 1.00 1.00 C ATOM 1480 C ILE A 100 84.470 -1.595 8.434 1.00 1.00 C ATOM 1481 O ILE A 100 84.507 -2.427 9.340 1.00 1.00 O ATOM 1482 CB ILE A 100 86.646 -0.685 7.652 1.00 1.00 C ATOM 1483 CG1 ILE A 100 87.779 -0.846 6.634 1.00 1.00 C ATOM 1484 CG2 ILE A 100 87.199 -1.034 9.040 1.00 1.00 C ATOM 1485 CD1 ILE A 100 88.740 0.344 6.741 1.00 1.00 C ATOM 0 H ILE A 100 85.139 -0.479 5.590 1.00 1.00 H new ATOM 0 HA ILE A 100 85.921 -2.645 7.196 1.00 1.00 H new ATOM 0 HB ILE A 100 86.270 0.338 7.635 1.00 1.00 H new ATOM 0 HG12 ILE A 100 88.316 -1.777 6.816 1.00 1.00 H new ATOM 0 HG13 ILE A 100 87.370 -0.906 5.626 1.00 1.00 H new ATOM 0 HG21 ILE A 100 88.014 -0.355 9.288 1.00 1.00 H new ATOM 0 HG22 ILE A 100 86.407 -0.937 9.782 1.00 1.00 H new ATOM 0 HG23 ILE A 100 87.569 -2.059 9.037 1.00 1.00 H new ATOM 0 HD11 ILE A 100 89.545 0.228 6.016 1.00 1.00 H new ATOM 0 HD12 ILE A 100 88.199 1.268 6.537 1.00 1.00 H new ATOM 0 HD13 ILE A 100 89.160 0.384 7.746 1.00 1.00 H new ATOM 1497 N VAL A 101 83.582 -0.588 8.423 1.00 1.00 N ATOM 1498 CA VAL A 101 82.626 -0.470 9.529 1.00 1.00 C ATOM 1499 C VAL A 101 81.865 -1.777 9.759 1.00 1.00 C ATOM 1500 O VAL A 101 81.943 -2.366 10.837 1.00 1.00 O ATOM 1501 CB VAL A 101 81.645 0.722 9.331 1.00 1.00 C ATOM 1502 CG1 VAL A 101 80.485 0.381 8.380 1.00 1.00 C ATOM 1503 CG2 VAL A 101 81.051 1.111 10.695 1.00 1.00 C ATOM 0 H VAL A 101 83.507 0.124 7.696 1.00 1.00 H new ATOM 0 HA VAL A 101 83.210 -0.263 10.426 1.00 1.00 H new ATOM 0 HB VAL A 101 82.213 1.541 8.890 1.00 1.00 H new ATOM 0 HG11 VAL A 101 79.832 1.247 8.278 1.00 1.00 H new ATOM 0 HG12 VAL A 101 80.884 0.110 7.402 1.00 1.00 H new ATOM 0 HG13 VAL A 101 79.917 -0.456 8.785 1.00 1.00 H new ATOM 0 HG21 VAL A 101 80.362 1.946 10.567 1.00 1.00 H new ATOM 0 HG22 VAL A 101 80.515 0.260 11.115 1.00 1.00 H new ATOM 0 HG23 VAL A 101 81.854 1.404 11.371 1.00 1.00 H new ATOM 1513 N CYS A 102 81.104 -2.194 8.769 1.00 1.00 N ATOM 1514 CA CYS A 102 80.292 -3.395 8.889 1.00 1.00 C ATOM 1515 C CYS A 102 81.095 -4.595 9.410 1.00 1.00 C ATOM 1516 O CYS A 102 80.515 -5.501 9.994 1.00 1.00 O ATOM 1517 CB CYS A 102 79.703 -3.723 7.509 1.00 1.00 C ATOM 1518 SG CYS A 102 80.888 -3.243 6.240 1.00 1.00 S ATOM 0 H CYS A 102 81.028 -1.720 7.869 1.00 1.00 H new ATOM 0 HA CYS A 102 79.502 -3.203 9.615 1.00 1.00 H new ATOM 0 HB2 CYS A 102 79.484 -4.788 7.436 1.00 1.00 H new ATOM 0 HB3 CYS A 102 78.761 -3.193 7.365 1.00 1.00 H new ATOM 0 HG CYS A 102 82.096 -3.377 6.701 1.00 1.00 H new ATOM 1523 N ARG A 103 82.417 -4.542 9.237 1.00 1.00 N ATOM 1524 CA ARG A 103 83.322 -5.622 9.696 1.00 1.00 C ATOM 1525 C ARG A 103 83.720 -5.462 11.159 1.00 1.00 C ATOM 1526 O ARG A 103 83.660 -6.393 11.963 1.00 1.00 O ATOM 1527 CB ARG A 103 84.589 -5.603 8.839 1.00 1.00 C ATOM 1528 CG ARG A 103 85.376 -6.896 9.038 1.00 1.00 C ATOM 1529 CD ARG A 103 86.576 -6.896 8.087 1.00 1.00 C ATOM 1530 NE ARG A 103 87.231 -8.197 8.095 1.00 1.00 N ATOM 1531 CZ ARG A 103 87.951 -8.593 9.136 1.00 1.00 C ATOM 1532 NH1 ARG A 103 88.117 -7.792 10.151 1.00 1.00 N ATOM 1533 NH2 ARG A 103 88.504 -9.776 9.136 1.00 1.00 N ATOM 0 H ARG A 103 82.895 -3.764 8.782 1.00 1.00 H new ATOM 0 HA ARG A 103 82.788 -6.567 9.596 1.00 1.00 H new ATOM 0 HB2 ARG A 103 84.325 -5.487 7.788 1.00 1.00 H new ATOM 0 HB3 ARG A 103 85.207 -4.747 9.109 1.00 1.00 H new ATOM 0 HG2 ARG A 103 85.714 -6.977 10.071 1.00 1.00 H new ATOM 0 HG3 ARG A 103 84.740 -7.759 8.842 1.00 1.00 H new ATOM 0 HD2 ARG A 103 86.247 -6.654 7.076 1.00 1.00 H new ATOM 0 HD3 ARG A 103 87.285 -6.123 8.385 1.00 1.00 H new ATOM 0 HE ARG A 103 87.134 -8.813 7.288 1.00 1.00 H new ATOM 0 HH11 ARG A 103 87.694 -6.864 10.143 1.00 1.00 H new ATOM 0 HH12 ARG A 103 88.670 -8.093 10.953 1.00 1.00 H new ATOM 0 HH21 ARG A 103 88.382 -10.396 8.335 1.00 1.00 H new ATOM 0 HH22 ARG A 103 89.058 -10.080 9.937 1.00 1.00 H new ATOM 1547 N TYR A 104 84.095 -4.247 11.464 1.00 1.00 N ATOM 1548 CA TYR A 104 84.500 -3.795 12.787 1.00 1.00 C ATOM 1549 C TYR A 104 83.306 -3.139 13.493 1.00 1.00 C ATOM 1550 O TYR A 104 83.498 -2.465 14.508 1.00 1.00 O ATOM 1551 CB TYR A 104 85.756 -2.863 12.716 1.00 1.00 C ATOM 1552 CG TYR A 104 85.541 -1.593 13.512 1.00 1.00 C ATOM 1553 CD1 TYR A 104 84.688 -0.633 12.999 1.00 1.00 C ATOM 1554 CD2 TYR A 104 86.137 -1.404 14.763 1.00 1.00 C ATOM 1555 CE1 TYR A 104 84.420 0.536 13.709 1.00 1.00 C ATOM 1556 CE2 TYR A 104 85.868 -0.232 15.489 1.00 1.00 C ATOM 1557 CZ TYR A 104 85.009 0.739 14.959 1.00 1.00 C ATOM 1558 OH TYR A 104 84.737 1.890 15.667 1.00 1.00 O ATOM 0 H TYR A 104 84.131 -3.502 10.768 1.00 1.00 H new ATOM 0 HA TYR A 104 84.807 -4.654 13.383 1.00 1.00 H new ATOM 0 HB2 TYR A 104 86.628 -3.393 13.100 1.00 1.00 H new ATOM 0 HB3 TYR A 104 85.968 -2.612 11.677 1.00 1.00 H new ATOM 0 HD1 TYR A 104 84.224 -0.791 12.037 1.00 1.00 H new ATOM 0 HD2 TYR A 104 86.800 -2.154 15.168 1.00 1.00 H new ATOM 0 HE1 TYR A 104 83.759 1.282 13.294 1.00 1.00 H new ATOM 0 HE2 TYR A 104 86.324 -0.080 16.456 1.00 1.00 H new ATOM 0 HH TYR A 104 85.225 1.875 16.517 1.00 1.00 H new ATOM 1568 N GLY A 105 82.047 -3.377 13.094 1.00 1.00 N ATOM 1569 CA GLY A 105 80.927 -2.823 13.820 1.00 1.00 C ATOM 1570 C GLY A 105 79.820 -3.823 13.519 1.00 1.00 C ATOM 1571 O GLY A 105 79.614 -4.785 14.260 1.00 1.00 O ATOM 0 H GLY A 105 81.796 -3.942 12.283 1.00 1.00 H new ATOM 0 HA2 GLY A 105 81.130 -2.751 14.888 1.00 1.00 H new ATOM 0 HA3 GLY A 105 80.674 -1.820 13.475 1.00 1.00 H new ATOM 1575 N ALA A 106 79.153 -3.621 12.388 1.00 1.00 N ATOM 1576 CA ALA A 106 78.129 -4.520 11.930 1.00 1.00 C ATOM 1577 C ALA A 106 76.804 -4.441 12.699 1.00 1.00 C ATOM 1578 O ALA A 106 76.423 -5.389 13.339 1.00 1.00 O ATOM 1579 CB ALA A 106 78.683 -5.972 11.911 1.00 1.00 C ATOM 0 H ALA A 106 79.316 -2.825 11.771 1.00 1.00 H new ATOM 0 HA ALA A 106 77.873 -4.198 10.921 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.906 -6.653 11.564 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.540 -6.026 11.239 1.00 1.00 H new ATOM 0 HB3 ALA A 106 78.992 -6.257 12.917 1.00 1.00 H new ATOM 1585 N THR A 107 76.135 -3.295 12.716 1.00 1.00 N ATOM 1586 CA THR A 107 74.860 -3.218 13.452 1.00 1.00 C ATOM 1587 C THR A 107 73.715 -3.771 12.569 1.00 1.00 C ATOM 1588 O THR A 107 73.013 -4.703 12.963 1.00 1.00 O ATOM 1589 CB THR A 107 74.541 -1.784 13.874 1.00 1.00 C ATOM 1590 OG1 THR A 107 75.612 -1.278 14.657 1.00 1.00 O ATOM 1591 CG2 THR A 107 73.255 -1.785 14.707 1.00 1.00 C ATOM 0 H THR A 107 76.429 -2.435 12.253 1.00 1.00 H new ATOM 0 HA THR A 107 74.955 -3.820 14.356 1.00 1.00 H new ATOM 0 HB THR A 107 74.408 -1.157 12.992 1.00 1.00 H new ATOM 0 HG1 THR A 107 75.412 -0.358 14.928 1.00 1.00 H new ATOM 0 HG21 THR A 107 73.019 -0.766 15.013 1.00 1.00 H new ATOM 0 HG22 THR A 107 72.435 -2.184 14.110 1.00 1.00 H new ATOM 0 HG23 THR A 107 73.395 -2.406 15.592 1.00 1.00 H new ATOM 1599 N VAL A 108 73.538 -3.175 11.379 1.00 1.00 N ATOM 1600 CA VAL A 108 72.478 -3.590 10.433 1.00 1.00 C ATOM 1601 C VAL A 108 72.730 -5.007 9.889 1.00 1.00 C ATOM 1602 O VAL A 108 71.901 -5.584 9.186 1.00 1.00 O ATOM 1603 CB VAL A 108 72.432 -2.608 9.260 1.00 1.00 C ATOM 1604 CG1 VAL A 108 72.170 -1.196 9.785 1.00 1.00 C ATOM 1605 CG2 VAL A 108 73.775 -2.638 8.527 1.00 1.00 C ATOM 0 H VAL A 108 74.114 -2.402 11.045 1.00 1.00 H new ATOM 0 HA VAL A 108 71.529 -3.591 10.970 1.00 1.00 H new ATOM 0 HB VAL A 108 71.633 -2.893 8.575 1.00 1.00 H new ATOM 0 HG11 VAL A 108 72.137 -0.497 8.949 1.00 1.00 H new ATOM 0 HG12 VAL A 108 71.217 -1.175 10.313 1.00 1.00 H new ATOM 0 HG13 VAL A 108 72.969 -0.908 10.468 1.00 1.00 H new ATOM 0 HG21 VAL A 108 73.748 -1.940 7.690 1.00 1.00 H new ATOM 0 HG22 VAL A 108 74.571 -2.350 9.214 1.00 1.00 H new ATOM 0 HG23 VAL A 108 73.964 -3.645 8.154 1.00 1.00 H new ATOM 1615 N ILE A 109 73.892 -5.529 10.233 1.00 1.00 N ATOM 1616 CA ILE A 109 74.281 -6.879 9.786 1.00 1.00 C ATOM 1617 C ILE A 109 73.681 -7.974 10.705 1.00 1.00 C ATOM 1618 O ILE A 109 72.864 -8.755 10.233 1.00 1.00 O ATOM 1619 CB ILE A 109 75.821 -7.005 9.595 1.00 1.00 C ATOM 1620 CG1 ILE A 109 76.261 -6.389 8.221 1.00 1.00 C ATOM 1621 CG2 ILE A 109 76.240 -8.490 9.621 1.00 1.00 C ATOM 1622 CD1 ILE A 109 76.760 -4.956 8.405 1.00 1.00 C ATOM 0 H ILE A 109 74.585 -5.056 10.813 1.00 1.00 H new ATOM 0 HA ILE A 109 73.849 -7.043 8.799 1.00 1.00 H new ATOM 0 HB ILE A 109 76.304 -6.465 10.409 1.00 1.00 H new ATOM 0 HG12 ILE A 109 77.048 -6.999 7.779 1.00 1.00 H new ATOM 0 HG13 ILE A 109 75.421 -6.400 7.526 1.00 1.00 H new ATOM 0 HG21 ILE A 109 77.319 -8.566 9.486 1.00 1.00 H new ATOM 0 HG22 ILE A 109 75.962 -8.930 10.579 1.00 1.00 H new ATOM 0 HG23 ILE A 109 75.736 -9.025 8.816 1.00 1.00 H new ATOM 0 HD11 ILE A 109 77.060 -4.548 7.440 1.00 1.00 H new ATOM 0 HD12 ILE A 109 75.962 -4.344 8.825 1.00 1.00 H new ATOM 0 HD13 ILE A 109 77.615 -4.952 9.082 1.00 1.00 H new ATOM 1634 N PRO A 110 74.048 -8.042 11.971 1.00 1.00 N ATOM 1635 CA PRO A 110 73.529 -9.056 12.953 1.00 1.00 C ATOM 1636 C PRO A 110 72.032 -8.885 13.264 1.00 1.00 C ATOM 1637 O PRO A 110 71.330 -9.860 13.522 1.00 1.00 O ATOM 1638 CB PRO A 110 74.359 -8.782 14.220 1.00 1.00 C ATOM 1639 CG PRO A 110 74.723 -7.352 14.096 1.00 1.00 C ATOM 1640 CD PRO A 110 74.983 -7.150 12.609 1.00 1.00 C ATOM 0 HA PRO A 110 73.622 -10.069 12.561 1.00 1.00 H new ATOM 0 HB2 PRO A 110 73.783 -8.972 15.126 1.00 1.00 H new ATOM 0 HB3 PRO A 110 75.243 -9.418 14.265 1.00 1.00 H new ATOM 0 HG2 PRO A 110 73.919 -6.706 14.449 1.00 1.00 H new ATOM 0 HG3 PRO A 110 75.606 -7.115 14.689 1.00 1.00 H new ATOM 0 HD2 PRO A 110 74.815 -6.115 12.311 1.00 1.00 H new ATOM 0 HD3 PRO A 110 76.012 -7.395 12.346 1.00 1.00 H new ATOM 1648 N ASN A 111 71.567 -7.630 13.269 1.00 1.00 N ATOM 1649 CA ASN A 111 70.171 -7.356 13.595 1.00 1.00 C ATOM 1650 C ASN A 111 69.264 -7.928 12.520 1.00 1.00 C ATOM 1651 O ASN A 111 68.534 -8.898 12.757 1.00 1.00 O ATOM 1652 CB ASN A 111 69.961 -5.848 13.712 1.00 1.00 C ATOM 1653 CG ASN A 111 68.508 -5.543 14.055 1.00 1.00 C ATOM 1654 OD1 ASN A 111 67.778 -6.425 14.508 1.00 1.00 O ATOM 1655 ND2 ASN A 111 68.043 -4.339 13.868 1.00 1.00 N ATOM 0 H ASN A 111 72.128 -6.805 13.055 1.00 1.00 H new ATOM 0 HA ASN A 111 69.924 -7.827 14.547 1.00 1.00 H new ATOM 0 HB2 ASN A 111 70.617 -5.441 14.482 1.00 1.00 H new ATOM 0 HB3 ASN A 111 70.230 -5.362 12.774 1.00 1.00 H new ATOM 0 HD21 ASN A 111 67.072 -4.126 14.097 1.00 1.00 H new ATOM 0 HD22 ASN A 111 68.650 -3.610 13.493 1.00 1.00 H new ATOM 1662 N ILE A 112 69.323 -7.359 11.323 1.00 1.00 N ATOM 1663 CA ILE A 112 68.516 -7.854 10.224 1.00 1.00 C ATOM 1664 C ILE A 112 68.741 -9.340 10.096 1.00 1.00 C ATOM 1665 O ILE A 112 67.953 -10.067 9.519 1.00 1.00 O ATOM 1666 CB ILE A 112 68.983 -7.165 8.939 1.00 1.00 C ATOM 1667 CG1 ILE A 112 68.743 -5.644 9.042 1.00 1.00 C ATOM 1668 CG2 ILE A 112 68.252 -7.758 7.730 1.00 1.00 C ATOM 1669 CD1 ILE A 112 67.288 -5.287 8.713 1.00 1.00 C ATOM 0 H ILE A 112 69.916 -6.562 11.093 1.00 1.00 H new ATOM 0 HA ILE A 112 67.459 -7.651 10.398 1.00 1.00 H new ATOM 0 HB ILE A 112 70.051 -7.334 8.806 1.00 1.00 H new ATOM 0 HG12 ILE A 112 68.985 -5.303 10.048 1.00 1.00 H new ATOM 0 HG13 ILE A 112 69.412 -5.121 8.359 1.00 1.00 H new ATOM 0 HG21 ILE A 112 68.591 -7.262 6.821 1.00 1.00 H new ATOM 0 HG22 ILE A 112 68.466 -8.825 7.663 1.00 1.00 H new ATOM 0 HG23 ILE A 112 67.178 -7.610 7.846 1.00 1.00 H new ATOM 0 HD11 ILE A 112 67.151 -4.209 8.794 1.00 1.00 H new ATOM 0 HD12 ILE A 112 67.056 -5.607 7.697 1.00 1.00 H new ATOM 0 HD13 ILE A 112 66.622 -5.791 9.413 1.00 1.00 H new ATOM 1681 N ASN A 113 69.867 -9.740 10.621 1.00 1.00 N ATOM 1682 CA ASN A 113 70.234 -11.141 10.536 1.00 1.00 C ATOM 1683 C ASN A 113 69.174 -11.954 11.263 1.00 1.00 C ATOM 1684 O ASN A 113 68.621 -12.896 10.714 1.00 1.00 O ATOM 1685 CB ASN A 113 71.661 -11.441 11.034 1.00 1.00 C ATOM 1686 CG ASN A 113 72.477 -12.112 9.915 1.00 1.00 C ATOM 1687 OD1 ASN A 113 71.948 -12.953 9.187 1.00 1.00 O ATOM 1688 ND2 ASN A 113 73.725 -11.780 9.715 1.00 1.00 N ATOM 0 H ASN A 113 70.536 -9.139 11.102 1.00 1.00 H new ATOM 0 HA ASN A 113 70.263 -11.430 9.485 1.00 1.00 H new ATOM 0 HB2 ASN A 113 72.148 -10.517 11.347 1.00 1.00 H new ATOM 0 HB3 ASN A 113 71.621 -12.092 11.907 1.00 1.00 H new ATOM 0 HD21 ASN A 113 74.254 -12.217 8.960 1.00 1.00 H new ATOM 0 HD22 ASN A 113 74.170 -11.084 10.314 1.00 1.00 H new ATOM 1695 N ALA A 114 68.876 -11.631 12.500 1.00 1.00 N ATOM 1696 CA ALA A 114 67.878 -12.392 13.218 1.00 1.00 C ATOM 1697 C ALA A 114 66.543 -12.435 12.463 1.00 1.00 C ATOM 1698 O ALA A 114 65.817 -13.432 12.536 1.00 1.00 O ATOM 1699 CB ALA A 114 67.662 -11.735 14.584 1.00 1.00 C ATOM 0 H ALA A 114 69.299 -10.864 13.022 1.00 1.00 H new ATOM 0 HA ALA A 114 68.233 -13.417 13.325 1.00 1.00 H new ATOM 0 HB1 ALA A 114 66.912 -12.295 15.142 1.00 1.00 H new ATOM 0 HB2 ALA A 114 68.600 -11.733 15.139 1.00 1.00 H new ATOM 0 HB3 ALA A 114 67.320 -10.709 14.445 1.00 1.00 H new ATOM 1705 N ALA A 115 66.237 -11.401 11.674 1.00 1.00 N ATOM 1706 CA ALA A 115 65.001 -11.405 10.883 1.00 1.00 C ATOM 1707 C ALA A 115 65.176 -12.171 9.568 1.00 1.00 C ATOM 1708 O ALA A 115 64.389 -13.023 9.216 1.00 1.00 O ATOM 1709 CB ALA A 115 64.591 -9.968 10.570 1.00 1.00 C ATOM 0 H ALA A 115 66.814 -10.567 11.566 1.00 1.00 H new ATOM 0 HA ALA A 115 64.230 -11.903 11.471 1.00 1.00 H new ATOM 0 HB1 ALA A 115 63.673 -9.971 9.982 1.00 1.00 H new ATOM 0 HB2 ALA A 115 64.424 -9.426 11.501 1.00 1.00 H new ATOM 0 HB3 ALA A 115 65.383 -9.479 10.003 1.00 1.00 H new ATOM 1715 N ILE A 116 66.240 -11.812 8.869 1.00 1.00 N ATOM 1716 CA ILE A 116 66.543 -12.435 7.569 1.00 1.00 C ATOM 1717 C ILE A 116 66.384 -13.958 7.732 1.00 1.00 C ATOM 1718 O ILE A 116 65.678 -14.624 6.975 1.00 1.00 O ATOM 1719 CB ILE A 116 67.959 -12.039 7.057 1.00 1.00 C ATOM 1720 CG1 ILE A 116 67.988 -12.071 5.505 1.00 1.00 C ATOM 1721 CG2 ILE A 116 69.042 -12.980 7.598 1.00 1.00 C ATOM 1722 CD1 ILE A 116 67.578 -10.710 4.941 1.00 1.00 C ATOM 0 H ILE A 116 66.908 -11.101 9.166 1.00 1.00 H new ATOM 0 HA ILE A 116 65.850 -12.075 6.808 1.00 1.00 H new ATOM 0 HB ILE A 116 68.168 -11.032 7.417 1.00 1.00 H new ATOM 0 HG12 ILE A 116 68.988 -12.330 5.158 1.00 1.00 H new ATOM 0 HG13 ILE A 116 67.313 -12.844 5.137 1.00 1.00 H new ATOM 0 HG21 ILE A 116 70.016 -12.671 7.218 1.00 1.00 H new ATOM 0 HG22 ILE A 116 69.048 -12.940 8.687 1.00 1.00 H new ATOM 0 HG23 ILE A 116 68.833 -14.000 7.274 1.00 1.00 H new ATOM 0 HD11 ILE A 116 67.602 -10.745 3.852 1.00 1.00 H new ATOM 0 HD12 ILE A 116 66.569 -10.467 5.274 1.00 1.00 H new ATOM 0 HD13 ILE A 116 68.270 -9.946 5.295 1.00 1.00 H new ATOM 1734 N GLU A 117 67.104 -14.445 8.734 1.00 1.00 N ATOM 1735 CA GLU A 117 67.100 -15.893 9.028 1.00 1.00 C ATOM 1736 C GLU A 117 65.647 -16.333 8.836 1.00 1.00 C ATOM 1737 O GLU A 117 65.342 -17.274 8.099 1.00 1.00 O ATOM 1738 CB GLU A 117 67.565 -16.294 10.433 1.00 1.00 C ATOM 1739 CG GLU A 117 67.614 -17.837 10.474 1.00 1.00 C ATOM 1740 CD GLU A 117 68.061 -18.344 11.839 1.00 1.00 C ATOM 1741 OE1 GLU A 117 67.243 -18.332 12.746 1.00 1.00 O ATOM 1742 OE2 GLU A 117 69.205 -18.750 11.957 1.00 1.00 O ATOM 0 H GLU A 117 67.690 -13.883 9.351 1.00 1.00 H new ATOM 0 HA GLU A 117 67.820 -16.375 8.366 1.00 1.00 H new ATOM 0 HB2 GLU A 117 68.547 -15.872 10.649 1.00 1.00 H new ATOM 0 HB3 GLU A 117 66.880 -15.910 11.189 1.00 1.00 H new ATOM 0 HG2 GLU A 117 66.629 -18.240 10.240 1.00 1.00 H new ATOM 0 HG3 GLU A 117 68.298 -18.201 9.707 1.00 1.00 H new ATOM 1749 N VAL A 118 64.780 -15.580 9.496 1.00 1.00 N ATOM 1750 CA VAL A 118 63.331 -15.829 9.399 1.00 1.00 C ATOM 1751 C VAL A 118 62.790 -15.448 7.988 1.00 1.00 C ATOM 1752 O VAL A 118 62.097 -16.247 7.358 1.00 1.00 O ATOM 1753 CB VAL A 118 62.569 -15.077 10.503 1.00 1.00 C ATOM 1754 CG1 VAL A 118 61.084 -15.436 10.438 1.00 1.00 C ATOM 1755 CG2 VAL A 118 63.119 -15.489 11.873 1.00 1.00 C ATOM 0 H VAL A 118 65.039 -14.799 10.099 1.00 1.00 H new ATOM 0 HA VAL A 118 63.164 -16.897 9.543 1.00 1.00 H new ATOM 0 HB VAL A 118 62.695 -14.004 10.359 1.00 1.00 H new ATOM 0 HG11 VAL A 118 60.546 -14.902 11.221 1.00 1.00 H new ATOM 0 HG12 VAL A 118 60.683 -15.153 9.465 1.00 1.00 H new ATOM 0 HG13 VAL A 118 60.963 -16.510 10.582 1.00 1.00 H new ATOM 0 HG21 VAL A 118 62.580 -14.957 12.657 1.00 1.00 H new ATOM 0 HG22 VAL A 118 62.990 -16.563 12.009 1.00 1.00 H new ATOM 0 HG23 VAL A 118 64.179 -15.241 11.929 1.00 1.00 H new ATOM 1765 N LEU A 119 63.056 -14.210 7.524 1.00 1.00 N ATOM 1766 CA LEU A 119 62.566 -13.675 6.232 1.00 1.00 C ATOM 1767 C LEU A 119 63.012 -14.473 4.975 1.00 1.00 C ATOM 1768 O LEU A 119 62.289 -14.456 3.980 1.00 1.00 O ATOM 1769 CB LEU A 119 63.063 -12.206 6.121 1.00 1.00 C ATOM 1770 CG LEU A 119 62.046 -11.256 5.434 1.00 1.00 C ATOM 1771 CD1 LEU A 119 61.577 -11.827 4.095 1.00 1.00 C ATOM 1772 CD2 LEU A 119 60.829 -10.966 6.344 1.00 1.00 C ATOM 0 H LEU A 119 63.626 -13.542 8.043 1.00 1.00 H new ATOM 0 HA LEU A 119 61.479 -13.757 6.241 1.00 1.00 H new ATOM 0 HB2 LEU A 119 63.282 -11.829 7.120 1.00 1.00 H new ATOM 0 HB3 LEU A 119 63.998 -12.189 5.562 1.00 1.00 H new ATOM 0 HG LEU A 119 62.563 -10.314 5.251 1.00 1.00 H new ATOM 0 HD11 LEU A 119 60.865 -11.141 3.636 1.00 1.00 H new ATOM 0 HD12 LEU A 119 62.434 -11.956 3.434 1.00 1.00 H new ATOM 0 HD13 LEU A 119 61.097 -12.792 4.259 1.00 1.00 H new ATOM 0 HD21 LEU A 119 60.140 -10.298 5.828 1.00 1.00 H new ATOM 0 HD22 LEU A 119 60.320 -11.901 6.580 1.00 1.00 H new ATOM 0 HD23 LEU A 119 61.169 -10.495 7.267 1.00 1.00 H new ATOM 1784 N GLY A 120 64.141 -15.223 5.003 1.00 1.00 N ATOM 1785 CA GLY A 120 64.524 -16.026 3.824 1.00 1.00 C ATOM 1786 C GLY A 120 64.987 -17.451 4.189 1.00 1.00 C ATOM 1787 O GLY A 120 64.571 -18.425 3.561 1.00 1.00 O ATOM 0 H GLY A 120 64.778 -15.287 5.797 1.00 1.00 H new ATOM 0 HA2 GLY A 120 63.675 -16.089 3.143 1.00 1.00 H new ATOM 0 HA3 GLY A 120 65.325 -15.516 3.289 1.00 1.00 H new ATOM 1791 N THR A 121 65.881 -17.564 5.166 1.00 1.00 N ATOM 1792 CA THR A 121 66.476 -18.832 5.607 1.00 1.00 C ATOM 1793 C THR A 121 67.724 -18.343 6.334 1.00 1.00 C ATOM 1794 O THR A 121 68.090 -18.794 7.419 1.00 1.00 O ATOM 1795 CB THR A 121 66.804 -19.754 4.419 1.00 1.00 C ATOM 1796 OG1 THR A 121 65.651 -20.523 4.098 1.00 1.00 O ATOM 1797 CG2 THR A 121 67.958 -20.706 4.771 1.00 1.00 C ATOM 0 H THR A 121 66.224 -16.759 5.690 1.00 1.00 H new ATOM 0 HA THR A 121 65.822 -19.443 6.229 1.00 1.00 H new ATOM 0 HB THR A 121 67.103 -19.139 3.570 1.00 1.00 H new ATOM 0 HG1 THR A 121 64.870 -19.934 4.042 1.00 1.00 H new ATOM 0 HG21 THR A 121 68.173 -21.348 3.917 1.00 1.00 H new ATOM 0 HG22 THR A 121 68.846 -20.125 5.021 1.00 1.00 H new ATOM 0 HG23 THR A 121 67.675 -21.321 5.625 1.00 1.00 H new ATOM 1805 N GLY A 122 68.287 -17.323 5.688 1.00 1.00 N ATOM 1806 CA GLY A 122 69.440 -16.557 6.148 1.00 1.00 C ATOM 1807 C GLY A 122 70.711 -16.653 5.309 1.00 1.00 C ATOM 1808 O GLY A 122 71.448 -15.670 5.273 1.00 1.00 O ATOM 0 H GLY A 122 67.934 -16.995 4.789 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.150 -15.508 6.205 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.678 -16.878 7.162 1.00 1.00 H new ATOM 1812 N THR A 123 71.026 -17.764 4.668 1.00 1.00 N ATOM 1813 CA THR A 123 72.277 -17.810 3.899 1.00 1.00 C ATOM 1814 C THR A 123 72.553 -16.510 3.123 1.00 1.00 C ATOM 1815 O THR A 123 72.053 -16.320 2.015 1.00 1.00 O ATOM 1816 CB THR A 123 72.257 -18.958 2.891 1.00 1.00 C ATOM 1817 OG1 THR A 123 71.976 -20.180 3.559 1.00 1.00 O ATOM 1818 CG2 THR A 123 73.627 -19.043 2.204 1.00 1.00 C ATOM 0 H THR A 123 70.467 -18.617 4.656 1.00 1.00 H new ATOM 0 HA THR A 123 73.066 -17.954 4.637 1.00 1.00 H new ATOM 0 HB THR A 123 71.483 -18.779 2.145 1.00 1.00 H new ATOM 0 HG1 THR A 123 71.962 -20.913 2.908 1.00 1.00 H new ATOM 0 HG21 THR A 123 73.622 -19.860 1.482 1.00 1.00 H new ATOM 0 HG22 THR A 123 73.834 -18.105 1.689 1.00 1.00 H new ATOM 0 HG23 THR A 123 74.399 -19.224 2.952 1.00 1.00 H new ATOM 1826 N ASP A 124 73.396 -15.647 3.696 1.00 1.00 N ATOM 1827 CA ASP A 124 73.806 -14.396 3.054 1.00 1.00 C ATOM 1828 C ASP A 124 75.306 -14.243 3.281 1.00 1.00 C ATOM 1829 O ASP A 124 75.792 -14.526 4.376 1.00 1.00 O ATOM 1830 CB ASP A 124 73.074 -13.196 3.663 1.00 1.00 C ATOM 1831 CG ASP A 124 71.605 -13.206 3.256 1.00 1.00 C ATOM 1832 OD1 ASP A 124 71.333 -13.012 2.083 1.00 1.00 O ATOM 1833 OD2 ASP A 124 70.773 -13.397 4.127 1.00 1.00 O ATOM 0 H ASP A 124 73.812 -15.795 4.615 1.00 1.00 H new ATOM 0 HA ASP A 124 73.562 -14.428 1.992 1.00 1.00 H new ATOM 0 HB2 ASP A 124 73.157 -13.225 4.749 1.00 1.00 H new ATOM 0 HB3 ASP A 124 73.543 -12.270 3.332 1.00 1.00 H new ATOM 1838 N TYR A 125 76.051 -13.808 2.267 1.00 1.00 N ATOM 1839 CA TYR A 125 77.490 -13.649 2.416 1.00 1.00 C ATOM 1840 C TYR A 125 78.029 -12.612 1.417 1.00 1.00 C ATOM 1841 O TYR A 125 77.474 -12.421 0.335 1.00 1.00 O ATOM 1842 CB TYR A 125 78.171 -15.021 2.176 1.00 1.00 C ATOM 1843 CG TYR A 125 78.863 -15.027 0.823 1.00 1.00 C ATOM 1844 CD1 TYR A 125 78.103 -14.932 -0.352 1.00 1.00 C ATOM 1845 CD2 TYR A 125 80.259 -15.077 0.750 1.00 1.00 C ATOM 1846 CE1 TYR A 125 78.742 -14.897 -1.597 1.00 1.00 C ATOM 1847 CE2 TYR A 125 80.897 -15.034 -0.493 1.00 1.00 C ATOM 1848 CZ TYR A 125 80.140 -14.945 -1.666 1.00 1.00 C ATOM 1849 OH TYR A 125 80.775 -14.895 -2.888 1.00 1.00 O ATOM 0 H TYR A 125 75.686 -13.563 1.347 1.00 1.00 H new ATOM 0 HA TYR A 125 77.711 -13.294 3.423 1.00 1.00 H new ATOM 0 HB2 TYR A 125 78.896 -15.220 2.965 1.00 1.00 H new ATOM 0 HB3 TYR A 125 77.428 -15.817 2.217 1.00 1.00 H new ATOM 0 HD1 TYR A 125 77.025 -14.886 -0.296 1.00 1.00 H new ATOM 0 HD2 TYR A 125 80.844 -15.149 1.655 1.00 1.00 H new ATOM 0 HE1 TYR A 125 78.158 -14.833 -2.503 1.00 1.00 H new ATOM 0 HE2 TYR A 125 81.975 -15.070 -0.548 1.00 1.00 H new ATOM 0 HH TYR A 125 81.291 -14.064 -2.955 1.00 1.00 H new ATOM 1859 N ARG A 126 79.143 -11.993 1.787 1.00 1.00 N ATOM 1860 CA ARG A 126 79.804 -11.021 0.917 1.00 1.00 C ATOM 1861 C ARG A 126 81.310 -10.992 1.154 1.00 1.00 C ATOM 1862 O ARG A 126 81.782 -11.339 2.232 1.00 1.00 O ATOM 1863 CB ARG A 126 79.192 -9.629 1.113 1.00 1.00 C ATOM 1864 CG ARG A 126 77.834 -9.539 0.369 1.00 1.00 C ATOM 1865 CD ARG A 126 77.513 -8.088 -0.020 1.00 1.00 C ATOM 1866 NE ARG A 126 78.703 -7.393 -0.530 1.00 1.00 N ATOM 1867 CZ ARG A 126 79.454 -7.881 -1.527 1.00 1.00 C ATOM 1868 NH1 ARG A 126 79.079 -8.938 -2.198 1.00 1.00 N ATOM 1869 NH2 ARG A 126 80.564 -7.275 -1.850 1.00 1.00 N ATOM 0 H ARG A 126 79.609 -12.144 2.681 1.00 1.00 H new ATOM 0 HA ARG A 126 79.643 -11.330 -0.116 1.00 1.00 H new ATOM 0 HB2 ARG A 126 79.048 -9.432 2.175 1.00 1.00 H new ATOM 0 HB3 ARG A 126 79.874 -8.866 0.737 1.00 1.00 H new ATOM 0 HG2 ARG A 126 77.864 -10.161 -0.526 1.00 1.00 H new ATOM 0 HG3 ARG A 126 77.041 -9.933 1.004 1.00 1.00 H new ATOM 0 HD2 ARG A 126 76.731 -8.078 -0.779 1.00 1.00 H new ATOM 0 HD3 ARG A 126 77.123 -7.555 0.847 1.00 1.00 H new ATOM 0 HE ARG A 126 78.968 -6.503 -0.108 1.00 1.00 H new ATOM 0 HH11 ARG A 126 78.202 -9.405 -1.966 1.00 1.00 H new ATOM 0 HH12 ARG A 126 79.663 -9.296 -2.954 1.00 1.00 H new ATOM 0 HH21 ARG A 126 80.853 -6.437 -1.345 1.00 1.00 H new ATOM 0 HH22 ARG A 126 81.142 -7.639 -2.607 1.00 1.00 H new ATOM 1883 N PHE A 127 82.079 -10.594 0.131 1.00 1.00 N ATOM 1884 CA PHE A 127 83.537 -10.538 0.241 1.00 1.00 C ATOM 1885 C PHE A 127 84.045 -9.136 -0.092 1.00 1.00 C ATOM 1886 O PHE A 127 85.032 -8.730 0.500 1.00 1.00 O ATOM 1887 CB PHE A 127 84.152 -11.547 -0.732 1.00 1.00 C ATOM 1888 CG PHE A 127 83.715 -11.226 -2.145 1.00 1.00 C ATOM 1889 CD1 PHE A 127 82.498 -11.722 -2.632 1.00 1.00 C ATOM 1890 CD2 PHE A 127 84.530 -10.442 -2.974 1.00 1.00 C ATOM 1891 CE1 PHE A 127 82.098 -11.435 -3.945 1.00 1.00 C ATOM 1892 CE2 PHE A 127 84.128 -10.154 -4.284 1.00 1.00 C ATOM 1893 CZ PHE A 127 82.913 -10.651 -4.769 1.00 1.00 C ATOM 1894 OXT PHE A 127 83.440 -8.493 -0.932 1.00 1.00 O ATOM 0 H PHE A 127 81.714 -10.308 -0.777 1.00 1.00 H new ATOM 0 HA PHE A 127 83.826 -10.780 1.264 1.00 1.00 H new ATOM 0 HB2 PHE A 127 85.239 -11.518 -0.662 1.00 1.00 H new ATOM 0 HB3 PHE A 127 83.843 -12.558 -0.466 1.00 1.00 H new ATOM 0 HD1 PHE A 127 81.868 -12.326 -1.996 1.00 1.00 H new ATOM 0 HD2 PHE A 127 85.469 -10.060 -2.602 1.00 1.00 H new ATOM 0 HE1 PHE A 127 81.161 -11.819 -4.320 1.00 1.00 H new ATOM 0 HE2 PHE A 127 84.756 -9.548 -4.920 1.00 1.00 H new ATOM 0 HZ PHE A 127 82.604 -10.429 -5.780 1.00 1.00 H new