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 Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -159:sc= 0.492 (180deg=-0.996!) USER MOD Single : A 2 SER OG : rot -34:sc= 0.998 USER MOD Single : A 6 THR OG1 : rot 180:sc= 0.0582 USER MOD Single : A 10 SER OG : rot 180:sc= 0 USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 CYS SG : rot 180:sc= 0 USER MOD Single : A 38 HIS : no HD1:sc= -0.0128 X(o=-0.013,f=-0.013) USER MOD Single : A 39 THR OG1 : rot -140:sc= -3.11! USER MOD Single : A 48 CYS SG : rot -37:sc= 0.0252 USER MOD Single : A 49 ASN :FLIP amide:sc= -5.37! C(o=-16!,f=-5.4!) USER MOD Single : A 54 GLN : amide:sc= -1.42 K(o=-1.4,f=-3.4!) USER MOD Single : A 60 TYR OH : rot 180:sc= 0 USER MOD Single : A 64 HIS : no HD1:sc=-0.00769 X(o=-0.0077,f=-0.38) USER MOD Single : A 72 HIS :FLIP no HD1:sc= -1.7! C(o=-4.5!,f=-1.7!) USER MOD Single : A 73 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 ASN : amide:sc= -0.949! X(o=-0.95!,f=-1.2) USER MOD Single : A 92 HIS : no HE2:sc= -9.14! C(o=-9.1!,f=-24!) USER MOD Single : A 99 GLN : amide:sc= -0.0169 K(o=-0.017,f=-1) USER MOD Single : A 102 CYS SG : rot 180:sc= 0 USER MOD Single : A 104 TYR OH : rot 180:sc= 0 USER MOD Single : A 107 THR OG1 : rot 49:sc= 0.875 USER MOD Single : A 111 ASN : amide:sc= -0.0196 K(o=-0.02,f=-1.5!) USER MOD Single : A 113 ASN : amide:sc= -0.742 K(o=-0.74,f=-2.4!) USER MOD Single : A 121 THR OG1 : rot 83:sc= 0.798 USER MOD Single : A 123 THR OG1 : rot 180:sc= 0 USER MOD Single : A 125 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 76.969 23.523 -21.703 1.00 1.00 N ATOM 2 CA MET A 1 77.454 22.120 -21.859 1.00 1.00 C ATOM 3 C MET A 1 76.275 21.170 -21.640 1.00 1.00 C ATOM 4 O MET A 1 75.223 21.579 -21.152 1.00 1.00 O ATOM 5 CB MET A 1 78.589 21.815 -20.852 1.00 1.00 C ATOM 6 CG MET A 1 79.208 23.113 -20.329 1.00 1.00 C ATOM 7 SD MET A 1 78.050 23.923 -19.197 1.00 1.00 S ATOM 8 CE MET A 1 79.247 25.009 -18.385 1.00 1.00 C ATOM 0 H1 MET A 1 77.626 24.173 -22.180 1.00 1.00 H new ATOM 0 H2 MET A 1 76.024 23.613 -22.128 1.00 1.00 H new ATOM 0 H3 MET A 1 76.919 23.763 -20.692 1.00 1.00 H new ATOM 0 HA MET A 1 77.858 21.984 -22.862 1.00 1.00 H new ATOM 0 HB2 MET A 1 78.197 21.232 -20.019 1.00 1.00 H new ATOM 0 HB3 MET A 1 79.356 21.208 -21.333 1.00 1.00 H new ATOM 0 HG2 MET A 1 80.146 22.900 -19.816 1.00 1.00 H new ATOM 0 HG3 MET A 1 79.444 23.777 -21.161 1.00 1.00 H new ATOM 0 HE1 MET A 1 78.739 25.612 -17.633 1.00 1.00 H new ATOM 0 HE2 MET A 1 80.019 24.406 -17.906 1.00 1.00 H new ATOM 0 HE3 MET A 1 79.706 25.664 -19.126 1.00 1.00 H new ATOM 18 N SER A 2 76.462 19.903 -22.005 1.00 1.00 N ATOM 19 CA SER A 2 75.419 18.884 -21.856 1.00 1.00 C ATOM 20 C SER A 2 75.754 17.945 -20.695 1.00 1.00 C ATOM 21 O SER A 2 75.070 16.947 -20.488 1.00 1.00 O ATOM 22 CB SER A 2 75.299 18.076 -23.151 1.00 1.00 C ATOM 23 OG SER A 2 74.247 17.130 -23.019 1.00 1.00 O ATOM 0 H SER A 2 77.331 19.554 -22.409 1.00 1.00 H new ATOM 0 HA SER A 2 74.471 19.380 -21.646 1.00 1.00 H new ATOM 0 HB2 SER A 2 75.102 18.742 -23.991 1.00 1.00 H new ATOM 0 HB3 SER A 2 76.238 17.565 -23.363 1.00 1.00 H new ATOM 0 HG SER A 2 74.206 16.813 -22.093 1.00 1.00 H new ATOM 29 N ASP A 3 76.798 18.297 -19.942 1.00 1.00 N ATOM 30 CA ASP A 3 77.227 17.501 -18.783 1.00 1.00 C ATOM 31 C ASP A 3 78.609 17.960 -18.307 1.00 1.00 C ATOM 32 O ASP A 3 79.633 17.535 -18.842 1.00 1.00 O ATOM 33 CB ASP A 3 77.250 15.998 -19.131 1.00 1.00 C ATOM 34 CG ASP A 3 78.110 15.214 -18.140 1.00 1.00 C ATOM 35 OD1 ASP A 3 78.122 15.578 -16.976 1.00 1.00 O ATOM 36 OD2 ASP A 3 78.738 14.256 -18.561 1.00 1.00 O ATOM 0 H ASP A 3 77.364 19.128 -20.112 1.00 1.00 H new ATOM 0 HA ASP A 3 76.510 17.654 -17.976 1.00 1.00 H new ATOM 0 HB2 ASP A 3 76.233 15.605 -19.125 1.00 1.00 H new ATOM 0 HB3 ASP A 3 77.638 15.862 -20.140 1.00 1.00 H new ATOM 41 N PHE A 4 78.624 18.823 -17.292 1.00 1.00 N ATOM 42 CA PHE A 4 79.879 19.333 -16.740 1.00 1.00 C ATOM 43 C PHE A 4 79.720 19.658 -15.263 1.00 1.00 C ATOM 44 O PHE A 4 78.652 20.083 -14.826 1.00 1.00 O ATOM 45 CB PHE A 4 80.305 20.600 -17.476 1.00 1.00 C ATOM 46 CG PHE A 4 81.604 21.098 -16.887 1.00 1.00 C ATOM 47 CD1 PHE A 4 82.791 20.396 -17.127 1.00 1.00 C ATOM 48 CD2 PHE A 4 81.622 22.257 -16.099 1.00 1.00 C ATOM 49 CE1 PHE A 4 83.997 20.852 -16.582 1.00 1.00 C ATOM 50 CE2 PHE A 4 82.829 22.712 -15.553 1.00 1.00 C ATOM 51 CZ PHE A 4 84.016 22.010 -15.795 1.00 1.00 C ATOM 0 H PHE A 4 77.785 19.183 -16.837 1.00 1.00 H new ATOM 0 HA PHE A 4 80.638 18.561 -16.864 1.00 1.00 H new ATOM 0 HB2 PHE A 4 80.428 20.394 -18.539 1.00 1.00 H new ATOM 0 HB3 PHE A 4 79.533 21.365 -17.387 1.00 1.00 H new ATOM 0 HD1 PHE A 4 82.776 19.502 -17.733 1.00 1.00 H new ATOM 0 HD2 PHE A 4 80.706 22.799 -15.913 1.00 1.00 H new ATOM 0 HE1 PHE A 4 84.913 20.311 -16.768 1.00 1.00 H new ATOM 0 HE2 PHE A 4 82.844 23.605 -14.945 1.00 1.00 H new ATOM 0 HZ PHE A 4 84.947 22.362 -15.375 1.00 1.00 H new ATOM 61 N ASP A 5 80.785 19.459 -14.492 1.00 1.00 N ATOM 62 CA ASP A 5 80.739 19.739 -13.064 1.00 1.00 C ATOM 63 C ASP A 5 82.150 19.946 -12.516 1.00 1.00 C ATOM 64 O ASP A 5 83.127 19.440 -13.067 1.00 1.00 O ATOM 65 CB ASP A 5 80.064 18.571 -12.341 1.00 1.00 C ATOM 66 CG ASP A 5 80.478 17.258 -12.997 1.00 1.00 C ATOM 67 OD1 ASP A 5 81.461 17.265 -13.721 1.00 1.00 O ATOM 68 OD2 ASP A 5 79.803 16.268 -12.774 1.00 1.00 O ATOM 0 H ASP A 5 81.681 19.108 -14.829 1.00 1.00 H new ATOM 0 HA ASP A 5 80.167 20.652 -12.897 1.00 1.00 H new ATOM 0 HB2 ASP A 5 80.347 18.569 -11.288 1.00 1.00 H new ATOM 0 HB3 ASP A 5 78.980 18.683 -12.380 1.00 1.00 H new ATOM 73 N THR A 6 82.242 20.703 -11.432 1.00 1.00 N ATOM 74 CA THR A 6 83.534 20.984 -10.822 1.00 1.00 C ATOM 75 C THR A 6 84.102 19.722 -10.175 1.00 1.00 C ATOM 76 O THR A 6 83.439 18.720 -10.080 1.00 1.00 O ATOM 77 CB THR A 6 83.408 22.123 -9.787 1.00 1.00 C ATOM 78 OG1 THR A 6 82.245 22.887 -10.075 1.00 1.00 O ATOM 79 CG2 THR A 6 84.640 23.039 -9.851 1.00 1.00 C ATOM 0 H THR A 6 81.445 21.130 -10.960 1.00 1.00 H new ATOM 0 HA THR A 6 84.223 21.309 -11.601 1.00 1.00 H new ATOM 0 HB THR A 6 83.337 21.691 -8.789 1.00 1.00 H new ATOM 0 HG1 THR A 6 82.159 23.611 -9.420 1.00 1.00 H new ATOM 0 HG21 THR A 6 84.538 23.838 -9.116 1.00 1.00 H new ATOM 0 HG22 THR A 6 85.537 22.458 -9.634 1.00 1.00 H new ATOM 0 HG23 THR A 6 84.720 23.472 -10.848 1.00 1.00 H new ATOM 87 N GLU A 7 85.343 19.811 -9.766 1.00 1.00 N ATOM 88 CA GLU A 7 86.047 18.683 -9.149 1.00 1.00 C ATOM 89 C GLU A 7 85.250 18.171 -7.952 1.00 1.00 C ATOM 90 O GLU A 7 84.906 17.003 -7.867 1.00 1.00 O ATOM 91 CB GLU A 7 87.433 19.164 -8.688 1.00 1.00 C ATOM 92 CG GLU A 7 88.214 18.013 -8.049 1.00 1.00 C ATOM 93 CD GLU A 7 87.754 17.796 -6.609 1.00 1.00 C ATOM 94 OE1 GLU A 7 88.131 18.590 -5.762 1.00 1.00 O ATOM 95 OE2 GLU A 7 87.041 16.834 -6.373 1.00 1.00 O ATOM 0 H GLU A 7 85.904 20.659 -9.845 1.00 1.00 H new ATOM 0 HA GLU A 7 86.157 17.872 -9.869 1.00 1.00 H new ATOM 0 HB2 GLU A 7 87.988 19.560 -9.538 1.00 1.00 H new ATOM 0 HB3 GLU A 7 87.322 19.978 -7.972 1.00 1.00 H new ATOM 0 HG2 GLU A 7 88.067 17.100 -8.626 1.00 1.00 H new ATOM 0 HG3 GLU A 7 89.281 18.234 -8.068 1.00 1.00 H new ATOM 102 N ARG A 8 85.020 19.057 -7.013 1.00 1.00 N ATOM 103 CA ARG A 8 84.309 18.644 -5.800 1.00 1.00 C ATOM 104 C ARG A 8 83.012 17.925 -6.212 1.00 1.00 C ATOM 105 O ARG A 8 82.780 16.795 -5.840 1.00 1.00 O ATOM 106 CB ARG A 8 83.973 19.846 -4.908 1.00 1.00 C ATOM 107 CG ARG A 8 83.176 19.369 -3.657 1.00 1.00 C ATOM 108 CD ARG A 8 81.676 19.717 -3.777 1.00 1.00 C ATOM 109 NE ARG A 8 81.416 21.004 -3.134 1.00 1.00 N ATOM 110 CZ ARG A 8 80.481 21.842 -3.579 1.00 1.00 C ATOM 111 NH1 ARG A 8 79.810 21.572 -4.665 1.00 1.00 N ATOM 112 NH2 ARG A 8 80.250 22.951 -2.934 1.00 1.00 N ATOM 0 H ARG A 8 85.298 20.038 -7.048 1.00 1.00 H new ATOM 0 HA ARG A 8 84.952 17.977 -5.227 1.00 1.00 H new ATOM 0 HB2 ARG A 8 84.890 20.347 -4.597 1.00 1.00 H new ATOM 0 HB3 ARG A 8 83.386 20.574 -5.469 1.00 1.00 H new ATOM 0 HG2 ARG A 8 83.293 18.292 -3.539 1.00 1.00 H new ATOM 0 HG3 ARG A 8 83.588 19.835 -2.762 1.00 1.00 H new ATOM 0 HD2 ARG A 8 81.385 19.759 -4.827 1.00 1.00 H new ATOM 0 HD3 ARG A 8 81.073 18.938 -3.310 1.00 1.00 H new ATOM 0 HE ARG A 8 81.968 21.269 -2.318 1.00 1.00 H new ATOM 0 HH11 ARG A 8 79.999 20.713 -5.181 1.00 1.00 H new ATOM 0 HH12 ARG A 8 79.096 22.220 -4.998 1.00 1.00 H new ATOM 0 HH21 ARG A 8 80.784 23.173 -2.094 1.00 1.00 H new ATOM 0 HH22 ARG A 8 79.535 23.597 -3.270 1.00 1.00 H new ATOM 126 N VAL A 9 82.217 18.599 -7.013 1.00 1.00 N ATOM 127 CA VAL A 9 80.959 17.996 -7.490 1.00 1.00 C ATOM 128 C VAL A 9 81.247 16.776 -8.403 1.00 1.00 C ATOM 129 O VAL A 9 80.650 15.714 -8.251 1.00 1.00 O ATOM 130 CB VAL A 9 80.051 19.047 -8.194 1.00 1.00 C ATOM 131 CG1 VAL A 9 78.897 19.463 -7.263 1.00 1.00 C ATOM 132 CG2 VAL A 9 80.871 20.293 -8.541 1.00 1.00 C ATOM 0 H VAL A 9 82.399 19.544 -7.350 1.00 1.00 H new ATOM 0 HA VAL A 9 80.407 17.636 -6.622 1.00 1.00 H new ATOM 0 HB VAL A 9 79.647 18.600 -9.102 1.00 1.00 H new ATOM 0 HG11 VAL A 9 78.270 20.198 -7.767 1.00 1.00 H new ATOM 0 HG12 VAL A 9 78.299 18.587 -7.011 1.00 1.00 H new ATOM 0 HG13 VAL A 9 79.304 19.899 -6.351 1.00 1.00 H new ATOM 0 HG21 VAL A 9 80.230 21.025 -9.033 1.00 1.00 H new ATOM 0 HG22 VAL A 9 81.280 20.725 -7.628 1.00 1.00 H new ATOM 0 HG23 VAL A 9 81.687 20.017 -9.209 1.00 1.00 H new ATOM 142 N SER A 10 82.135 16.968 -9.358 1.00 1.00 N ATOM 143 CA SER A 10 82.498 15.928 -10.338 1.00 1.00 C ATOM 144 C SER A 10 83.159 14.677 -9.742 1.00 1.00 C ATOM 145 O SER A 10 82.802 13.564 -10.131 1.00 1.00 O ATOM 146 CB SER A 10 83.440 16.495 -11.402 1.00 1.00 C ATOM 147 OG SER A 10 83.717 15.480 -12.362 1.00 1.00 O ATOM 0 H SER A 10 82.634 17.848 -9.488 1.00 1.00 H new ATOM 0 HA SER A 10 81.544 15.617 -10.764 1.00 1.00 H new ATOM 0 HB2 SER A 10 82.984 17.358 -11.887 1.00 1.00 H new ATOM 0 HB3 SER A 10 84.365 16.840 -10.941 1.00 1.00 H new ATOM 0 HG SER A 10 84.319 15.835 -13.049 1.00 1.00 H new ATOM 153 N ARG A 11 84.069 14.818 -8.771 1.00 1.00 N ATOM 154 CA ARG A 11 84.669 13.648 -8.131 1.00 1.00 C ATOM 155 C ARG A 11 83.702 13.102 -7.092 1.00 1.00 C ATOM 156 O ARG A 11 83.352 11.938 -7.074 1.00 1.00 O ATOM 157 CB ARG A 11 86.010 14.031 -7.490 1.00 1.00 C ATOM 158 CG ARG A 11 86.661 12.800 -6.851 1.00 1.00 C ATOM 159 CD ARG A 11 87.978 13.211 -6.189 1.00 1.00 C ATOM 160 NE ARG A 11 88.916 13.678 -7.202 1.00 1.00 N ATOM 161 CZ ARG A 11 89.483 12.831 -8.054 1.00 1.00 C ATOM 162 NH1 ARG A 11 89.212 11.556 -7.983 1.00 1.00 N ATOM 163 NH2 ARG A 11 90.306 13.273 -8.964 1.00 1.00 N ATOM 0 H ARG A 11 84.400 15.716 -8.418 1.00 1.00 H new ATOM 0 HA ARG A 11 84.862 12.874 -8.874 1.00 1.00 H new ATOM 0 HB2 ARG A 11 86.675 14.453 -8.244 1.00 1.00 H new ATOM 0 HB3 ARG A 11 85.854 14.802 -6.735 1.00 1.00 H new ATOM 0 HG2 ARG A 11 85.990 12.362 -6.112 1.00 1.00 H new ATOM 0 HG3 ARG A 11 86.844 12.037 -7.608 1.00 1.00 H new ATOM 0 HD2 ARG A 11 87.797 13.998 -5.457 1.00 1.00 H new ATOM 0 HD3 ARG A 11 88.403 12.365 -5.649 1.00 1.00 H new ATOM 0 HE ARG A 11 89.141 14.671 -7.258 1.00 1.00 H new ATOM 0 HH11 ARG A 11 88.565 11.211 -7.274 1.00 1.00 H new ATOM 0 HH12 ARG A 11 89.647 10.905 -8.637 1.00 1.00 H new ATOM 0 HH21 ARG A 11 90.515 14.270 -9.022 1.00 1.00 H new ATOM 0 HH22 ARG A 11 90.741 12.622 -9.618 1.00 1.00 H new ATOM 177 N ALA A 12 83.319 14.005 -6.192 1.00 1.00 N ATOM 178 CA ALA A 12 82.427 13.630 -5.087 1.00 1.00 C ATOM 179 C ALA A 12 81.313 12.804 -5.699 1.00 1.00 C ATOM 180 O ALA A 12 81.025 11.700 -5.253 1.00 1.00 O ATOM 181 CB ALA A 12 81.845 14.849 -4.373 1.00 1.00 C ATOM 0 H ALA A 12 83.603 14.985 -6.200 1.00 1.00 H new ATOM 0 HA ALA A 12 82.984 13.074 -4.333 1.00 1.00 H new ATOM 0 HB1 ALA A 12 81.192 14.520 -3.564 1.00 1.00 H new ATOM 0 HB2 ALA A 12 82.655 15.452 -3.963 1.00 1.00 H new ATOM 0 HB3 ALA A 12 81.271 15.446 -5.082 1.00 1.00 H new ATOM 187 N VAL A 13 80.715 13.325 -6.751 1.00 1.00 N ATOM 188 CA VAL A 13 79.680 12.551 -7.405 1.00 1.00 C ATOM 189 C VAL A 13 80.315 11.239 -7.891 1.00 1.00 C ATOM 190 O VAL A 13 79.819 10.188 -7.585 1.00 1.00 O ATOM 191 CB VAL A 13 79.002 13.310 -8.566 1.00 1.00 C ATOM 192 CG1 VAL A 13 78.044 12.371 -9.322 1.00 1.00 C ATOM 193 CG2 VAL A 13 78.186 14.485 -7.998 1.00 1.00 C ATOM 0 H VAL A 13 80.915 14.239 -7.157 1.00 1.00 H new ATOM 0 HA VAL A 13 78.882 12.352 -6.690 1.00 1.00 H new ATOM 0 HB VAL A 13 79.772 13.675 -9.246 1.00 1.00 H new ATOM 0 HG11 VAL A 13 77.570 12.915 -10.139 1.00 1.00 H new ATOM 0 HG12 VAL A 13 78.604 11.527 -9.725 1.00 1.00 H new ATOM 0 HG13 VAL A 13 77.278 12.005 -8.638 1.00 1.00 H new ATOM 0 HG21 VAL A 13 77.706 15.023 -8.815 1.00 1.00 H new ATOM 0 HG22 VAL A 13 77.424 14.104 -7.318 1.00 1.00 H new ATOM 0 HG23 VAL A 13 78.849 15.161 -7.458 1.00 1.00 H new ATOM 203 N ALA A 14 81.451 11.293 -8.593 1.00 1.00 N ATOM 204 CA ALA A 14 82.086 10.034 -9.044 1.00 1.00 C ATOM 205 C ALA A 14 82.433 9.120 -7.853 1.00 1.00 C ATOM 206 O ALA A 14 81.945 8.010 -7.762 1.00 1.00 O ATOM 207 CB ALA A 14 83.371 10.355 -9.816 1.00 1.00 C ATOM 0 H ALA A 14 81.938 12.150 -8.856 1.00 1.00 H new ATOM 0 HA ALA A 14 81.376 9.512 -9.686 1.00 1.00 H new ATOM 0 HB1 ALA A 14 83.838 9.427 -10.148 1.00 1.00 H new ATOM 0 HB2 ALA A 14 83.131 10.970 -10.683 1.00 1.00 H new ATOM 0 HB3 ALA A 14 84.060 10.896 -9.167 1.00 1.00 H new ATOM 213 N ALA A 15 83.313 9.596 -6.989 1.00 1.00 N ATOM 214 CA ALA A 15 83.764 8.799 -5.835 1.00 1.00 C ATOM 215 C ALA A 15 82.558 8.309 -5.039 1.00 1.00 C ATOM 216 O ALA A 15 82.392 7.116 -4.790 1.00 1.00 O ATOM 217 CB ALA A 15 84.623 9.667 -4.912 1.00 1.00 C ATOM 0 H ALA A 15 83.734 10.523 -7.054 1.00 1.00 H new ATOM 0 HA ALA A 15 84.341 7.951 -6.203 1.00 1.00 H new ATOM 0 HB1 ALA A 15 84.955 9.074 -4.060 1.00 1.00 H new ATOM 0 HB2 ALA A 15 85.492 10.032 -5.460 1.00 1.00 H new ATOM 0 HB3 ALA A 15 84.035 10.514 -4.558 1.00 1.00 H new ATOM 223 N ALA A 16 81.745 9.263 -4.643 1.00 1.00 N ATOM 224 CA ALA A 16 80.563 8.938 -3.861 1.00 1.00 C ATOM 225 C ALA A 16 79.620 8.072 -4.719 1.00 1.00 C ATOM 226 O ALA A 16 79.176 7.007 -4.299 1.00 1.00 O ATOM 227 CB ALA A 16 79.863 10.219 -3.375 1.00 1.00 C ATOM 0 H ALA A 16 81.873 10.255 -4.843 1.00 1.00 H new ATOM 0 HA ALA A 16 80.852 8.375 -2.974 1.00 1.00 H new ATOM 0 HB1 ALA A 16 78.981 9.953 -2.792 1.00 1.00 H new ATOM 0 HB2 ALA A 16 80.549 10.795 -2.754 1.00 1.00 H new ATOM 0 HB3 ALA A 16 79.562 10.818 -4.235 1.00 1.00 H new ATOM 233 N LEU A 17 79.296 8.585 -5.893 1.00 1.00 N ATOM 234 CA LEU A 17 78.351 7.845 -6.754 1.00 1.00 C ATOM 235 C LEU A 17 78.902 6.432 -7.004 1.00 1.00 C ATOM 236 O LEU A 17 78.210 5.449 -6.758 1.00 1.00 O ATOM 237 CB LEU A 17 78.037 8.527 -8.101 1.00 1.00 C ATOM 238 CG LEU A 17 76.902 7.771 -8.848 1.00 1.00 C ATOM 239 CD1 LEU A 17 76.008 8.776 -9.582 1.00 1.00 C ATOM 240 CD2 LEU A 17 77.494 6.805 -9.887 1.00 1.00 C ATOM 0 H LEU A 17 79.645 9.466 -6.271 1.00 1.00 H new ATOM 0 HA LEU A 17 77.405 7.816 -6.214 1.00 1.00 H new ATOM 0 HB2 LEU A 17 77.740 9.562 -7.930 1.00 1.00 H new ATOM 0 HB3 LEU A 17 78.934 8.551 -8.720 1.00 1.00 H new ATOM 0 HG LEU A 17 76.323 7.211 -8.113 1.00 1.00 H new ATOM 0 HD11 LEU A 17 75.214 8.243 -10.104 1.00 1.00 H new ATOM 0 HD12 LEU A 17 75.569 9.466 -8.862 1.00 1.00 H new ATOM 0 HD13 LEU A 17 76.605 9.335 -10.303 1.00 1.00 H new ATOM 0 HD21 LEU A 17 76.686 6.284 -10.401 1.00 1.00 H new ATOM 0 HD22 LEU A 17 78.083 7.367 -10.612 1.00 1.00 H new ATOM 0 HD23 LEU A 17 78.133 6.078 -9.386 1.00 1.00 H new ATOM 252 N VAL A 18 80.144 6.332 -7.487 1.00 1.00 N ATOM 253 CA VAL A 18 80.720 4.997 -7.735 1.00 1.00 C ATOM 254 C VAL A 18 80.958 4.277 -6.402 1.00 1.00 C ATOM 255 O VAL A 18 80.486 3.158 -6.200 1.00 1.00 O ATOM 256 CB VAL A 18 82.023 5.031 -8.592 1.00 1.00 C ATOM 257 CG1 VAL A 18 81.910 6.043 -9.767 1.00 1.00 C ATOM 258 CG2 VAL A 18 83.259 5.356 -7.731 1.00 1.00 C ATOM 0 H VAL A 18 80.752 7.120 -7.708 1.00 1.00 H new ATOM 0 HA VAL A 18 79.992 4.442 -8.327 1.00 1.00 H new ATOM 0 HB VAL A 18 82.149 4.033 -9.011 1.00 1.00 H new ATOM 0 HG11 VAL A 18 82.836 6.039 -10.341 1.00 1.00 H new ATOM 0 HG12 VAL A 18 81.081 5.758 -10.414 1.00 1.00 H new ATOM 0 HG13 VAL A 18 81.734 7.043 -9.370 1.00 1.00 H new ATOM 0 HG21 VAL A 18 84.148 5.371 -8.362 1.00 1.00 H new ATOM 0 HG22 VAL A 18 83.130 6.332 -7.263 1.00 1.00 H new ATOM 0 HG23 VAL A 18 83.375 4.595 -6.959 1.00 1.00 H new ATOM 268 N GLY A 19 81.716 4.912 -5.511 1.00 1.00 N ATOM 269 CA GLY A 19 82.035 4.307 -4.216 1.00 1.00 C ATOM 270 C GLY A 19 80.789 4.145 -3.341 1.00 1.00 C ATOM 271 O GLY A 19 79.672 4.386 -3.797 1.00 1.00 O ATOM 0 H GLY A 19 82.119 5.838 -5.658 1.00 1.00 H new ATOM 0 HA2 GLY A 19 82.497 3.333 -4.374 1.00 1.00 H new ATOM 0 HA3 GLY A 19 82.766 4.926 -3.696 1.00 1.00 H new ATOM 275 N PRO A 20 80.962 3.715 -2.108 1.00 1.00 N ATOM 276 CA PRO A 20 79.834 3.495 -1.157 1.00 1.00 C ATOM 277 C PRO A 20 79.264 4.783 -0.533 1.00 1.00 C ATOM 278 O PRO A 20 78.139 4.779 -0.055 1.00 1.00 O ATOM 279 CB PRO A 20 80.430 2.565 -0.066 1.00 1.00 C ATOM 280 CG PRO A 20 81.887 2.364 -0.412 1.00 1.00 C ATOM 281 CD PRO A 20 82.248 3.407 -1.472 1.00 1.00 C ATOM 0 HA PRO A 20 78.978 3.068 -1.680 1.00 1.00 H new ATOM 0 HB2 PRO A 20 80.326 3.012 0.922 1.00 1.00 H new ATOM 0 HB3 PRO A 20 79.903 1.611 -0.041 1.00 1.00 H new ATOM 0 HG2 PRO A 20 82.512 2.482 0.473 1.00 1.00 H new ATOM 0 HG3 PRO A 20 82.057 1.356 -0.790 1.00 1.00 H new ATOM 0 HD2 PRO A 20 82.696 4.294 -1.025 1.00 1.00 H new ATOM 0 HD3 PRO A 20 82.967 3.015 -2.191 1.00 1.00 H new ATOM 289 N GLY A 21 80.054 5.861 -0.489 1.00 1.00 N ATOM 290 CA GLY A 21 79.566 7.093 0.156 1.00 1.00 C ATOM 291 C GLY A 21 78.302 7.604 -0.532 1.00 1.00 C ATOM 292 O GLY A 21 77.257 7.768 0.096 1.00 1.00 O ATOM 0 H GLY A 21 80.997 5.912 -0.874 1.00 1.00 H new ATOM 0 HA2 GLY A 21 79.359 6.900 1.209 1.00 1.00 H new ATOM 0 HA3 GLY A 21 80.340 7.859 0.119 1.00 1.00 H new ATOM 296 N GLY A 22 78.409 7.877 -1.813 1.00 1.00 N ATOM 297 CA GLY A 22 77.242 8.398 -2.530 1.00 1.00 C ATOM 298 C GLY A 22 76.118 7.396 -2.347 1.00 1.00 C ATOM 299 O GLY A 22 75.018 7.737 -1.914 1.00 1.00 O ATOM 0 H GLY A 22 79.253 7.757 -2.372 1.00 1.00 H new ATOM 0 HA2 GLY A 22 76.955 9.374 -2.139 1.00 1.00 H new ATOM 0 HA3 GLY A 22 77.469 8.533 -3.588 1.00 1.00 H new ATOM 303 N VAL A 23 76.421 6.160 -2.681 1.00 1.00 N ATOM 304 CA VAL A 23 75.454 5.077 -2.556 1.00 1.00 C ATOM 305 C VAL A 23 74.971 4.962 -1.106 1.00 1.00 C ATOM 306 O VAL A 23 73.833 4.578 -0.853 1.00 1.00 O ATOM 307 CB VAL A 23 76.064 3.766 -3.046 1.00 1.00 C ATOM 308 CG1 VAL A 23 75.031 2.645 -2.939 1.00 1.00 C ATOM 309 CG2 VAL A 23 76.478 3.932 -4.510 1.00 1.00 C ATOM 0 H VAL A 23 77.331 5.874 -3.043 1.00 1.00 H new ATOM 0 HA VAL A 23 74.588 5.298 -3.180 1.00 1.00 H new ATOM 0 HB VAL A 23 76.932 3.514 -2.436 1.00 1.00 H new ATOM 0 HG11 VAL A 23 75.470 1.711 -3.290 1.00 1.00 H new ATOM 0 HG12 VAL A 23 74.722 2.533 -1.900 1.00 1.00 H new ATOM 0 HG13 VAL A 23 74.163 2.890 -3.551 1.00 1.00 H new ATOM 0 HG21 VAL A 23 76.916 3.002 -4.872 1.00 1.00 H new ATOM 0 HG22 VAL A 23 75.602 4.179 -5.110 1.00 1.00 H new ATOM 0 HG23 VAL A 23 77.212 4.734 -4.592 1.00 1.00 H new ATOM 319 N ALA A 24 75.849 5.291 -0.159 1.00 1.00 N ATOM 320 CA ALA A 24 75.443 5.203 1.240 1.00 1.00 C ATOM 321 C ALA A 24 74.272 6.165 1.471 1.00 1.00 C ATOM 322 O ALA A 24 73.194 5.730 1.879 1.00 1.00 O ATOM 323 CB ALA A 24 76.593 5.529 2.201 1.00 1.00 C ATOM 0 H ALA A 24 76.805 5.607 -0.324 1.00 1.00 H new ATOM 0 HA ALA A 24 75.142 4.176 1.447 1.00 1.00 H new ATOM 0 HB1 ALA A 24 76.241 5.450 3.230 1.00 1.00 H new ATOM 0 HB2 ALA A 24 77.410 4.826 2.042 1.00 1.00 H new ATOM 0 HB3 ALA A 24 76.946 6.543 2.015 1.00 1.00 H new ATOM 329 N LEU A 25 74.469 7.472 1.236 1.00 1.00 N ATOM 330 CA LEU A 25 73.401 8.435 1.456 1.00 1.00 C ATOM 331 C LEU A 25 72.181 8.184 0.565 1.00 1.00 C ATOM 332 O LEU A 25 71.047 8.219 1.048 1.00 1.00 O ATOM 333 CB LEU A 25 73.963 9.856 1.217 1.00 1.00 C ATOM 334 CG LEU A 25 72.849 10.919 1.056 1.00 1.00 C ATOM 335 CD1 LEU A 25 71.942 10.979 2.289 1.00 1.00 C ATOM 336 CD2 LEU A 25 73.500 12.293 0.871 1.00 1.00 C ATOM 0 H LEU A 25 75.345 7.872 0.900 1.00 1.00 H new ATOM 0 HA LEU A 25 73.053 8.327 2.483 1.00 1.00 H new ATOM 0 HB2 LEU A 25 74.606 10.133 2.052 1.00 1.00 H new ATOM 0 HB3 LEU A 25 74.586 9.850 0.323 1.00 1.00 H new ATOM 0 HG LEU A 25 72.243 10.645 0.192 1.00 1.00 H new ATOM 0 HD11 LEU A 25 71.173 11.736 2.138 1.00 1.00 H new ATOM 0 HD12 LEU A 25 71.470 10.008 2.441 1.00 1.00 H new ATOM 0 HD13 LEU A 25 72.537 11.235 3.166 1.00 1.00 H new ATOM 0 HD21 LEU A 25 72.725 13.051 0.756 1.00 1.00 H new ATOM 0 HD22 LEU A 25 74.110 12.527 1.744 1.00 1.00 H new ATOM 0 HD23 LEU A 25 74.129 12.281 -0.019 1.00 1.00 H new ATOM 348 N VAL A 26 72.389 7.972 -0.741 1.00 1.00 N ATOM 349 CA VAL A 26 71.237 7.781 -1.622 1.00 1.00 C ATOM 350 C VAL A 26 70.427 6.564 -1.172 1.00 1.00 C ATOM 351 O VAL A 26 69.244 6.696 -0.862 1.00 1.00 O ATOM 352 CB VAL A 26 71.729 7.594 -3.070 1.00 1.00 C ATOM 353 CG1 VAL A 26 70.545 7.339 -4.008 1.00 1.00 C ATOM 354 CG2 VAL A 26 72.463 8.859 -3.526 1.00 1.00 C ATOM 0 H VAL A 26 73.302 7.930 -1.193 1.00 1.00 H new ATOM 0 HA VAL A 26 70.593 8.659 -1.574 1.00 1.00 H new ATOM 0 HB VAL A 26 72.402 6.737 -3.103 1.00 1.00 H new ATOM 0 HG11 VAL A 26 70.910 7.209 -5.027 1.00 1.00 H new ATOM 0 HG12 VAL A 26 70.019 6.438 -3.693 1.00 1.00 H new ATOM 0 HG13 VAL A 26 69.863 8.188 -3.972 1.00 1.00 H new ATOM 0 HG21 VAL A 26 72.812 8.728 -4.550 1.00 1.00 H new ATOM 0 HG22 VAL A 26 71.784 9.710 -3.480 1.00 1.00 H new ATOM 0 HG23 VAL A 26 73.316 9.040 -2.873 1.00 1.00 H new ATOM 364 N VAL A 27 71.036 5.379 -1.156 1.00 1.00 N ATOM 365 CA VAL A 27 70.312 4.166 -0.767 1.00 1.00 C ATOM 366 C VAL A 27 69.736 4.257 0.652 1.00 1.00 C ATOM 367 O VAL A 27 68.668 3.713 0.923 1.00 1.00 O ATOM 368 CB VAL A 27 71.235 2.924 -0.890 1.00 1.00 C ATOM 369 CG1 VAL A 27 72.107 2.766 0.372 1.00 1.00 C ATOM 370 CG2 VAL A 27 70.385 1.652 -1.073 1.00 1.00 C ATOM 0 H VAL A 27 72.014 5.232 -1.404 1.00 1.00 H new ATOM 0 HA VAL A 27 69.470 4.063 -1.452 1.00 1.00 H new ATOM 0 HB VAL A 27 71.881 3.066 -1.756 1.00 1.00 H new ATOM 0 HG11 VAL A 27 72.746 1.890 0.265 1.00 1.00 H new ATOM 0 HG12 VAL A 27 72.726 3.654 0.500 1.00 1.00 H new ATOM 0 HG13 VAL A 27 71.465 2.643 1.244 1.00 1.00 H new ATOM 0 HG21 VAL A 27 71.041 0.785 -1.158 1.00 1.00 H new ATOM 0 HG22 VAL A 27 69.728 1.526 -0.212 1.00 1.00 H new ATOM 0 HG23 VAL A 27 69.784 1.743 -1.978 1.00 1.00 H new ATOM 380 N LYS A 28 70.450 4.916 1.560 1.00 1.00 N ATOM 381 CA LYS A 28 69.959 5.008 2.933 1.00 1.00 C ATOM 382 C LYS A 28 68.687 5.835 2.945 1.00 1.00 C ATOM 383 O LYS A 28 67.654 5.427 3.478 1.00 1.00 O ATOM 384 CB LYS A 28 71.012 5.686 3.842 1.00 1.00 C ATOM 385 CG LYS A 28 72.110 4.682 4.263 1.00 1.00 C ATOM 386 CD LYS A 28 71.736 4.004 5.596 1.00 1.00 C ATOM 387 CE LYS A 28 72.109 4.908 6.785 1.00 1.00 C ATOM 388 NZ LYS A 28 73.540 4.699 7.156 1.00 1.00 N ATOM 0 H LYS A 28 71.341 5.380 1.381 1.00 1.00 H new ATOM 0 HA LYS A 28 69.765 4.004 3.309 1.00 1.00 H new ATOM 0 HB2 LYS A 28 71.465 6.526 3.316 1.00 1.00 H new ATOM 0 HB3 LYS A 28 70.525 6.091 4.729 1.00 1.00 H new ATOM 0 HG2 LYS A 28 72.238 3.927 3.487 1.00 1.00 H new ATOM 0 HG3 LYS A 28 73.064 5.199 4.366 1.00 1.00 H new ATOM 0 HD2 LYS A 28 70.667 3.791 5.615 1.00 1.00 H new ATOM 0 HD3 LYS A 28 72.253 3.048 5.682 1.00 1.00 H new ATOM 0 HE2 LYS A 28 71.941 5.953 6.525 1.00 1.00 H new ATOM 0 HE3 LYS A 28 71.467 4.685 7.637 1.00 1.00 H new ATOM 0 HZ1 LYS A 28 73.784 5.313 7.959 1.00 1.00 H new ATOM 0 HZ2 LYS A 28 73.688 3.705 7.423 1.00 1.00 H new ATOM 0 HZ3 LYS A 28 74.147 4.934 6.345 1.00 1.00 H new ATOM 402 N VAL A 29 68.815 7.023 2.392 1.00 1.00 N ATOM 403 CA VAL A 29 67.701 7.965 2.376 1.00 1.00 C ATOM 404 C VAL A 29 66.565 7.448 1.519 1.00 1.00 C ATOM 405 O VAL A 29 65.416 7.454 1.963 1.00 1.00 O ATOM 406 CB VAL A 29 68.164 9.381 1.944 1.00 1.00 C ATOM 407 CG1 VAL A 29 66.981 10.197 1.390 1.00 1.00 C ATOM 408 CG2 VAL A 29 68.726 10.127 3.168 1.00 1.00 C ATOM 0 H VAL A 29 69.669 7.363 1.950 1.00 1.00 H new ATOM 0 HA VAL A 29 67.321 8.056 3.393 1.00 1.00 H new ATOM 0 HB VAL A 29 68.924 9.271 1.171 1.00 1.00 H new ATOM 0 HG11 VAL A 29 67.329 11.186 1.093 1.00 1.00 H new ATOM 0 HG12 VAL A 29 66.560 9.686 0.524 1.00 1.00 H new ATOM 0 HG13 VAL A 29 66.216 10.297 2.160 1.00 1.00 H new ATOM 0 HG21 VAL A 29 69.053 11.123 2.869 1.00 1.00 H new ATOM 0 HG22 VAL A 29 67.951 10.213 3.929 1.00 1.00 H new ATOM 0 HG23 VAL A 29 69.573 9.574 3.574 1.00 1.00 H new ATOM 418 N CYS A 30 66.840 6.998 0.304 1.00 1.00 N ATOM 419 CA CYS A 30 65.740 6.513 -0.497 1.00 1.00 C ATOM 420 C CYS A 30 65.132 5.278 0.162 1.00 1.00 C ATOM 421 O CYS A 30 63.935 5.246 0.442 1.00 1.00 O ATOM 422 CB CYS A 30 66.238 6.156 -1.907 1.00 1.00 C ATOM 423 SG CYS A 30 64.842 6.200 -3.061 1.00 1.00 S ATOM 0 H CYS A 30 67.764 6.960 -0.126 1.00 1.00 H new ATOM 0 HA CYS A 30 64.982 7.292 -0.573 1.00 1.00 H new ATOM 0 HB2 CYS A 30 67.008 6.860 -2.223 1.00 1.00 H new ATOM 0 HB3 CYS A 30 66.693 5.165 -1.905 1.00 1.00 H new ATOM 0 HG CYS A 30 65.257 5.901 -4.256 1.00 1.00 H new ATOM 428 N ALA A 31 65.937 4.231 0.324 1.00 1.00 N ATOM 429 CA ALA A 31 65.462 2.956 0.843 1.00 1.00 C ATOM 430 C ALA A 31 65.043 2.977 2.310 1.00 1.00 C ATOM 431 O ALA A 31 63.919 2.593 2.636 1.00 1.00 O ATOM 432 CB ALA A 31 66.592 1.924 0.644 1.00 1.00 C ATOM 0 H ALA A 31 66.932 4.244 0.100 1.00 1.00 H new ATOM 0 HA ALA A 31 64.556 2.701 0.293 1.00 1.00 H new ATOM 0 HB1 ALA A 31 66.270 0.954 1.023 1.00 1.00 H new ATOM 0 HB2 ALA A 31 66.825 1.840 -0.417 1.00 1.00 H new ATOM 0 HB3 ALA A 31 67.480 2.248 1.186 1.00 1.00 H new ATOM 438 N GLY A 32 65.935 3.401 3.200 1.00 1.00 N ATOM 439 CA GLY A 32 65.614 3.423 4.623 1.00 1.00 C ATOM 440 C GLY A 32 65.890 2.067 5.284 1.00 1.00 C ATOM 441 O GLY A 32 64.960 1.348 5.653 1.00 1.00 O ATOM 0 H GLY A 32 66.872 3.729 2.966 1.00 1.00 H new ATOM 0 HA2 GLY A 32 66.202 4.196 5.118 1.00 1.00 H new ATOM 0 HA3 GLY A 32 64.565 3.687 4.756 1.00 1.00 H new ATOM 445 N LEU A 33 67.173 1.743 5.468 1.00 1.00 N ATOM 446 CA LEU A 33 67.548 0.487 6.129 1.00 1.00 C ATOM 447 C LEU A 33 67.297 -0.735 5.203 1.00 1.00 C ATOM 448 O LEU A 33 66.164 -1.198 5.093 1.00 1.00 O ATOM 449 CB LEU A 33 66.711 0.368 7.424 1.00 1.00 C ATOM 450 CG LEU A 33 67.524 -0.252 8.565 1.00 1.00 C ATOM 451 CD1 LEU A 33 66.647 -0.328 9.816 1.00 1.00 C ATOM 452 CD2 LEU A 33 67.962 -1.660 8.173 1.00 1.00 C ATOM 0 H LEU A 33 67.960 2.322 5.174 1.00 1.00 H new ATOM 0 HA LEU A 33 68.613 0.496 6.361 1.00 1.00 H new ATOM 0 HB2 LEU A 33 66.358 1.355 7.722 1.00 1.00 H new ATOM 0 HB3 LEU A 33 65.828 -0.241 7.233 1.00 1.00 H new ATOM 0 HG LEU A 33 68.404 0.360 8.763 1.00 1.00 H new ATOM 0 HD11 LEU A 33 67.217 -0.768 10.634 1.00 1.00 H new ATOM 0 HD12 LEU A 33 66.325 0.675 10.096 1.00 1.00 H new ATOM 0 HD13 LEU A 33 65.772 -0.945 9.610 1.00 1.00 H new ATOM 0 HD21 LEU A 33 68.540 -2.100 8.985 1.00 1.00 H new ATOM 0 HD22 LEU A 33 67.082 -2.274 7.979 1.00 1.00 H new ATOM 0 HD23 LEU A 33 68.577 -1.613 7.274 1.00 1.00 H new ATOM 464 N PRO A 34 68.321 -1.254 4.541 1.00 1.00 N ATOM 465 CA PRO A 34 68.207 -2.429 3.598 1.00 1.00 C ATOM 466 C PRO A 34 67.334 -3.594 4.092 1.00 1.00 C ATOM 467 O PRO A 34 67.049 -4.517 3.324 1.00 1.00 O ATOM 468 CB PRO A 34 69.661 -2.884 3.442 1.00 1.00 C ATOM 469 CG PRO A 34 70.452 -1.629 3.564 1.00 1.00 C ATOM 470 CD PRO A 34 69.723 -0.782 4.608 1.00 1.00 C ATOM 0 HA PRO A 34 67.708 -2.126 2.677 1.00 1.00 H new ATOM 0 HB2 PRO A 34 69.937 -3.605 4.211 1.00 1.00 H new ATOM 0 HB3 PRO A 34 69.826 -3.367 2.479 1.00 1.00 H new ATOM 0 HG2 PRO A 34 71.475 -1.839 3.875 1.00 1.00 H new ATOM 0 HG3 PRO A 34 70.510 -1.108 2.608 1.00 1.00 H new ATOM 0 HD2 PRO A 34 70.145 -0.925 5.603 1.00 1.00 H new ATOM 0 HD3 PRO A 34 69.797 0.281 4.381 1.00 1.00 H new ATOM 478 N GLY A 35 66.927 -3.572 5.357 1.00 1.00 N ATOM 479 CA GLY A 35 66.112 -4.685 5.850 1.00 1.00 C ATOM 480 C GLY A 35 64.833 -4.779 5.017 1.00 1.00 C ATOM 481 O GLY A 35 64.567 -5.802 4.385 1.00 1.00 O ATOM 0 H GLY A 35 67.133 -2.837 6.033 1.00 1.00 H new ATOM 0 HA2 GLY A 35 66.672 -5.618 5.785 1.00 1.00 H new ATOM 0 HA3 GLY A 35 65.866 -4.533 6.901 1.00 1.00 H new ATOM 485 N VAL A 36 64.048 -3.703 5.009 1.00 1.00 N ATOM 486 CA VAL A 36 62.806 -3.671 4.239 1.00 1.00 C ATOM 487 C VAL A 36 63.114 -3.240 2.807 1.00 1.00 C ATOM 488 O VAL A 36 64.197 -3.536 2.307 1.00 1.00 O ATOM 489 CB VAL A 36 61.812 -2.706 4.908 1.00 1.00 C ATOM 490 CG1 VAL A 36 61.249 -3.357 6.170 1.00 1.00 C ATOM 491 CG2 VAL A 36 62.529 -1.405 5.287 1.00 1.00 C ATOM 0 H VAL A 36 64.249 -2.846 5.524 1.00 1.00 H new ATOM 0 HA VAL A 36 62.353 -4.662 4.212 1.00 1.00 H new ATOM 0 HB VAL A 36 61.002 -2.483 4.214 1.00 1.00 H new ATOM 0 HG11 VAL A 36 60.544 -2.676 6.647 1.00 1.00 H new ATOM 0 HG12 VAL A 36 60.737 -4.282 5.905 1.00 1.00 H new ATOM 0 HG13 VAL A 36 62.064 -3.578 6.860 1.00 1.00 H new ATOM 0 HG21 VAL A 36 61.822 -0.724 5.760 1.00 1.00 H new ATOM 0 HG22 VAL A 36 63.340 -1.625 5.981 1.00 1.00 H new ATOM 0 HG23 VAL A 36 62.936 -0.939 4.390 1.00 1.00 H new ATOM 501 N ILE A 37 62.177 -2.542 2.157 1.00 1.00 N ATOM 502 CA ILE A 37 62.367 -2.066 0.787 1.00 1.00 C ATOM 503 C ILE A 37 62.252 -3.172 -0.240 1.00 1.00 C ATOM 504 O ILE A 37 63.261 -3.657 -0.751 1.00 1.00 O ATOM 505 CB ILE A 37 63.726 -1.370 0.603 1.00 1.00 C ATOM 506 CG1 ILE A 37 63.931 -0.295 1.715 1.00 1.00 C ATOM 507 CG2 ILE A 37 63.757 -0.729 -0.797 1.00 1.00 C ATOM 508 CD1 ILE A 37 65.173 -0.622 2.562 1.00 1.00 C ATOM 0 H ILE A 37 61.275 -2.294 2.563 1.00 1.00 H new ATOM 0 HA ILE A 37 61.562 -1.349 0.623 1.00 1.00 H new ATOM 0 HB ILE A 37 64.537 -2.093 0.688 1.00 1.00 H new ATOM 0 HG12 ILE A 37 64.043 0.689 1.260 1.00 1.00 H new ATOM 0 HG13 ILE A 37 63.049 -0.252 2.354 1.00 1.00 H new ATOM 0 HG21 ILE A 37 64.714 -0.230 -0.947 1.00 1.00 H new ATOM 0 HG22 ILE A 37 63.628 -1.502 -1.554 1.00 1.00 H new ATOM 0 HG23 ILE A 37 62.950 -0.001 -0.882 1.00 1.00 H new ATOM 0 HD11 ILE A 37 65.299 0.139 3.332 1.00 1.00 H new ATOM 0 HD12 ILE A 37 65.046 -1.597 3.033 1.00 1.00 H new ATOM 0 HD13 ILE A 37 66.055 -0.640 1.922 1.00 1.00 H new ATOM 520 N HIS A 38 61.023 -3.543 -0.585 1.00 1.00 N ATOM 521 CA HIS A 38 60.781 -4.549 -1.608 1.00 1.00 C ATOM 522 C HIS A 38 59.656 -4.011 -2.488 1.00 1.00 C ATOM 523 O HIS A 38 58.599 -3.629 -1.984 1.00 1.00 O ATOM 524 CB HIS A 38 60.383 -5.886 -0.967 1.00 1.00 C ATOM 525 CG HIS A 38 61.561 -6.449 -0.212 1.00 1.00 C ATOM 526 ND1 HIS A 38 61.625 -6.445 1.174 1.00 1.00 N ATOM 527 CD2 HIS A 38 62.733 -7.024 -0.638 1.00 1.00 C ATOM 528 CE1 HIS A 38 62.799 -7.002 1.528 1.00 1.00 C ATOM 529 NE2 HIS A 38 63.513 -7.371 0.463 1.00 1.00 N ATOM 0 H HIS A 38 60.176 -3.158 -0.167 1.00 1.00 H new ATOM 0 HA HIS A 38 61.679 -4.736 -2.197 1.00 1.00 H new ATOM 0 HB2 HIS A 38 59.540 -5.742 -0.292 1.00 1.00 H new ATOM 0 HB3 HIS A 38 60.060 -6.588 -1.735 1.00 1.00 H new ATOM 0 HD2 HIS A 38 63.008 -7.183 -1.670 1.00 1.00 H new ATOM 0 HE1 HIS A 38 63.123 -7.134 2.550 1.00 1.00 H new ATOM 0 HE2 HIS A 38 64.433 -7.812 0.456 1.00 1.00 H new ATOM 537 N THR A 39 59.884 -3.965 -3.802 1.00 1.00 N ATOM 538 CA THR A 39 58.874 -3.443 -4.732 1.00 1.00 C ATOM 539 C THR A 39 58.182 -4.607 -5.457 1.00 1.00 C ATOM 540 O THR A 39 58.856 -5.546 -5.883 1.00 1.00 O ATOM 541 CB THR A 39 59.550 -2.492 -5.754 1.00 1.00 C ATOM 542 OG1 THR A 39 60.952 -2.675 -5.687 1.00 1.00 O ATOM 543 CG2 THR A 39 59.224 -1.027 -5.426 1.00 1.00 C ATOM 0 H THR A 39 60.748 -4.278 -4.245 1.00 1.00 H new ATOM 0 HA THR A 39 58.122 -2.884 -4.176 1.00 1.00 H new ATOM 0 HB THR A 39 59.178 -2.721 -6.753 1.00 1.00 H new ATOM 0 HG1 THR A 39 61.399 -1.806 -5.761 1.00 1.00 H new ATOM 0 HG21 THR A 39 59.707 -0.375 -6.154 1.00 1.00 H new ATOM 0 HG22 THR A 39 58.145 -0.877 -5.464 1.00 1.00 H new ATOM 0 HG23 THR A 39 59.588 -0.788 -4.427 1.00 1.00 H new ATOM 551 N PRO A 40 56.873 -4.590 -5.613 1.00 1.00 N ATOM 552 CA PRO A 40 56.168 -5.702 -6.303 1.00 1.00 C ATOM 553 C PRO A 40 56.725 -6.008 -7.695 1.00 1.00 C ATOM 554 O PRO A 40 56.714 -7.162 -8.123 1.00 1.00 O ATOM 555 CB PRO A 40 54.703 -5.219 -6.420 1.00 1.00 C ATOM 556 CG PRO A 40 54.539 -4.168 -5.372 1.00 1.00 C ATOM 557 CD PRO A 40 55.921 -3.544 -5.161 1.00 1.00 C ATOM 0 HA PRO A 40 56.285 -6.629 -5.742 1.00 1.00 H new ATOM 0 HB2 PRO A 40 54.502 -4.817 -7.413 1.00 1.00 H new ATOM 0 HB3 PRO A 40 54.006 -6.042 -6.262 1.00 1.00 H new ATOM 0 HG2 PRO A 40 53.817 -3.415 -5.688 1.00 1.00 H new ATOM 0 HG3 PRO A 40 54.163 -4.600 -4.445 1.00 1.00 H new ATOM 0 HD2 PRO A 40 56.035 -2.627 -5.739 1.00 1.00 H new ATOM 0 HD3 PRO A 40 56.084 -3.284 -4.115 1.00 1.00 H new ATOM 565 N ALA A 41 57.219 -4.987 -8.408 1.00 1.00 N ATOM 566 CA ALA A 41 57.770 -5.182 -9.749 1.00 1.00 C ATOM 567 C ALA A 41 59.161 -4.578 -9.866 1.00 1.00 C ATOM 568 O ALA A 41 59.352 -3.413 -9.525 1.00 1.00 O ATOM 569 CB ALA A 41 56.849 -4.532 -10.784 1.00 1.00 C ATOM 0 H ALA A 41 57.247 -4.023 -8.077 1.00 1.00 H new ATOM 0 HA ALA A 41 57.842 -6.254 -9.932 1.00 1.00 H new ATOM 0 HB1 ALA A 41 57.262 -4.679 -11.782 1.00 1.00 H new ATOM 0 HB2 ALA A 41 55.861 -4.989 -10.729 1.00 1.00 H new ATOM 0 HB3 ALA A 41 56.767 -3.465 -10.579 1.00 1.00 H new ATOM 575 N ARG A 42 60.111 -5.319 -10.407 1.00 1.00 N ATOM 576 CA ARG A 42 61.442 -4.775 -10.626 1.00 1.00 C ATOM 577 C ARG A 42 62.161 -5.620 -11.661 1.00 1.00 C ATOM 578 O ARG A 42 61.808 -6.777 -11.888 1.00 1.00 O ATOM 579 CB ARG A 42 62.278 -4.686 -9.315 1.00 1.00 C ATOM 580 CG ARG A 42 62.169 -3.273 -8.690 1.00 1.00 C ATOM 581 CD ARG A 42 63.324 -3.016 -7.709 1.00 1.00 C ATOM 582 NE ARG A 42 63.023 -3.577 -6.403 1.00 1.00 N ATOM 583 CZ ARG A 42 63.778 -3.287 -5.352 1.00 1.00 C ATOM 584 NH1 ARG A 42 64.850 -2.554 -5.504 1.00 1.00 N ATOM 585 NH2 ARG A 42 63.453 -3.735 -4.171 1.00 1.00 N ATOM 0 H ARG A 42 59.990 -6.288 -10.700 1.00 1.00 H new ATOM 0 HA ARG A 42 61.330 -3.753 -10.989 1.00 1.00 H new ATOM 0 HB2 ARG A 42 61.926 -5.432 -8.602 1.00 1.00 H new ATOM 0 HB3 ARG A 42 63.322 -4.915 -9.528 1.00 1.00 H new ATOM 0 HG2 ARG A 42 62.182 -2.520 -9.478 1.00 1.00 H new ATOM 0 HG3 ARG A 42 61.216 -3.174 -8.170 1.00 1.00 H new ATOM 0 HD2 ARG A 42 64.242 -3.457 -8.097 1.00 1.00 H new ATOM 0 HD3 ARG A 42 63.499 -1.944 -7.618 1.00 1.00 H new ATOM 0 HE ARG A 42 62.223 -4.200 -6.293 1.00 1.00 H new ATOM 0 HH11 ARG A 42 65.104 -2.207 -6.429 1.00 1.00 H new ATOM 0 HH12 ARG A 42 65.433 -2.329 -4.698 1.00 1.00 H new ATOM 0 HH21 ARG A 42 62.618 -4.309 -4.055 1.00 1.00 H new ATOM 0 HH22 ARG A 42 64.034 -3.512 -3.363 1.00 1.00 H new ATOM 599 N ARG A 43 63.169 -5.026 -12.281 1.00 1.00 N ATOM 600 CA ARG A 43 63.951 -5.719 -13.299 1.00 1.00 C ATOM 601 C ARG A 43 64.617 -6.965 -12.697 1.00 1.00 C ATOM 602 O ARG A 43 65.627 -7.446 -13.202 1.00 1.00 O ATOM 603 CB ARG A 43 65.026 -4.772 -13.853 1.00 1.00 C ATOM 604 CG ARG A 43 65.488 -5.245 -15.237 1.00 1.00 C ATOM 605 CD ARG A 43 66.621 -4.343 -15.726 1.00 1.00 C ATOM 606 NE ARG A 43 67.116 -4.807 -17.022 1.00 1.00 N ATOM 607 CZ ARG A 43 66.611 -4.356 -18.169 1.00 1.00 C ATOM 608 NH1 ARG A 43 65.656 -3.464 -18.165 1.00 1.00 N ATOM 609 NH2 ARG A 43 67.073 -4.807 -19.305 1.00 1.00 N ATOM 0 H ARG A 43 63.466 -4.067 -12.099 1.00 1.00 H new ATOM 0 HA ARG A 43 63.289 -6.030 -14.107 1.00 1.00 H new ATOM 0 HB2 ARG A 43 64.629 -3.759 -13.921 1.00 1.00 H new ATOM 0 HB3 ARG A 43 65.875 -4.736 -13.171 1.00 1.00 H new ATOM 0 HG2 ARG A 43 65.827 -6.280 -15.186 1.00 1.00 H new ATOM 0 HG3 ARG A 43 64.656 -5.217 -15.940 1.00 1.00 H new ATOM 0 HD2 ARG A 43 66.266 -3.316 -15.811 1.00 1.00 H new ATOM 0 HD3 ARG A 43 67.433 -4.341 -14.999 1.00 1.00 H new ATOM 0 HE ARG A 43 67.869 -5.495 -17.048 1.00 1.00 H new ATOM 0 HH11 ARG A 43 65.293 -3.109 -17.280 1.00 1.00 H new ATOM 0 HH12 ARG A 43 65.273 -3.123 -19.047 1.00 1.00 H new ATOM 0 HH21 ARG A 43 67.819 -5.503 -19.312 1.00 1.00 H new ATOM 0 HH22 ARG A 43 66.688 -4.463 -20.185 1.00 1.00 H new ATOM 623 N GLY A 44 64.050 -7.484 -11.610 1.00 1.00 N ATOM 624 CA GLY A 44 64.592 -8.651 -10.952 1.00 1.00 C ATOM 625 C GLY A 44 65.754 -8.255 -10.060 1.00 1.00 C ATOM 626 O GLY A 44 66.068 -8.940 -9.092 1.00 1.00 O ATOM 0 H GLY A 44 63.211 -7.106 -11.171 1.00 1.00 H new ATOM 0 HA2 GLY A 44 63.817 -9.136 -10.359 1.00 1.00 H new ATOM 0 HA3 GLY A 44 64.925 -9.375 -11.695 1.00 1.00 H new ATOM 630 N PHE A 45 66.408 -7.151 -10.413 1.00 1.00 N ATOM 631 CA PHE A 45 67.566 -6.682 -9.643 1.00 1.00 C ATOM 632 C PHE A 45 68.136 -5.384 -10.237 1.00 1.00 C ATOM 633 O PHE A 45 67.542 -4.816 -11.146 1.00 1.00 O ATOM 634 CB PHE A 45 68.648 -7.797 -9.605 1.00 1.00 C ATOM 635 CG PHE A 45 68.368 -8.789 -10.715 1.00 1.00 C ATOM 636 CD1 PHE A 45 68.359 -8.354 -12.042 1.00 1.00 C ATOM 637 CD2 PHE A 45 68.050 -10.122 -10.412 1.00 1.00 C ATOM 638 CE1 PHE A 45 68.044 -9.248 -13.071 1.00 1.00 C ATOM 639 CE2 PHE A 45 67.724 -11.014 -11.441 1.00 1.00 C ATOM 640 CZ PHE A 45 67.723 -10.576 -12.770 1.00 1.00 C ATOM 0 H PHE A 45 66.164 -6.569 -11.214 1.00 1.00 H new ATOM 0 HA PHE A 45 67.247 -6.461 -8.625 1.00 1.00 H new ATOM 0 HB2 PHE A 45 69.641 -7.364 -9.728 1.00 1.00 H new ATOM 0 HB3 PHE A 45 68.637 -8.300 -8.638 1.00 1.00 H new ATOM 0 HD1 PHE A 45 68.596 -7.326 -12.274 1.00 1.00 H new ATOM 0 HD2 PHE A 45 68.057 -10.459 -9.386 1.00 1.00 H new ATOM 0 HE1 PHE A 45 68.049 -8.913 -14.098 1.00 1.00 H new ATOM 0 HE2 PHE A 45 67.474 -12.039 -11.209 1.00 1.00 H new ATOM 0 HZ PHE A 45 67.474 -11.264 -13.564 1.00 1.00 H new ATOM 650 N PHE A 46 69.283 -4.946 -9.664 1.00 1.00 N ATOM 651 CA PHE A 46 70.011 -3.711 -10.061 1.00 1.00 C ATOM 652 C PHE A 46 70.041 -2.743 -8.886 1.00 1.00 C ATOM 653 O PHE A 46 69.023 -2.157 -8.529 1.00 1.00 O ATOM 654 CB PHE A 46 69.386 -3.062 -11.311 1.00 1.00 C ATOM 655 CG PHE A 46 70.260 -1.955 -11.873 1.00 1.00 C ATOM 656 CD1 PHE A 46 70.356 -0.728 -11.210 1.00 1.00 C ATOM 657 CD2 PHE A 46 70.950 -2.149 -13.085 1.00 1.00 C ATOM 658 CE1 PHE A 46 71.141 0.298 -11.746 1.00 1.00 C ATOM 659 CE2 PHE A 46 71.729 -1.119 -13.623 1.00 1.00 C ATOM 660 CZ PHE A 46 71.825 0.106 -12.953 1.00 1.00 C ATOM 0 H PHE A 46 69.738 -5.447 -8.901 1.00 1.00 H new ATOM 0 HA PHE A 46 71.034 -3.976 -10.327 1.00 1.00 H new ATOM 0 HB2 PHE A 46 69.229 -3.823 -12.075 1.00 1.00 H new ATOM 0 HB3 PHE A 46 68.406 -2.657 -11.058 1.00 1.00 H new ATOM 0 HD1 PHE A 46 69.824 -0.572 -10.283 1.00 1.00 H new ATOM 0 HD2 PHE A 46 70.878 -3.095 -13.601 1.00 1.00 H new ATOM 0 HE1 PHE A 46 71.220 1.242 -11.227 1.00 1.00 H new ATOM 0 HE2 PHE A 46 72.256 -1.269 -14.554 1.00 1.00 H new ATOM 0 HZ PHE A 46 72.426 0.902 -13.366 1.00 1.00 H new ATOM 670 N ARG A 47 71.233 -2.618 -8.280 1.00 1.00 N ATOM 671 CA ARG A 47 71.469 -1.768 -7.108 1.00 1.00 C ATOM 672 C ARG A 47 71.470 -2.648 -5.859 1.00 1.00 C ATOM 673 O ARG A 47 71.083 -3.812 -5.937 1.00 1.00 O ATOM 674 CB ARG A 47 70.432 -0.636 -6.969 1.00 1.00 C ATOM 675 CG ARG A 47 70.943 0.446 -5.964 1.00 1.00 C ATOM 676 CD ARG A 47 70.117 0.405 -4.673 1.00 1.00 C ATOM 677 NE ARG A 47 68.758 0.859 -4.938 1.00 1.00 N ATOM 678 CZ ARG A 47 68.488 2.150 -5.083 1.00 1.00 C ATOM 679 NH1 ARG A 47 69.444 3.031 -4.975 1.00 1.00 N ATOM 680 NH2 ARG A 47 67.267 2.537 -5.333 1.00 1.00 N ATOM 0 H ARG A 47 72.068 -3.111 -8.596 1.00 1.00 H new ATOM 0 HA ARG A 47 72.435 -1.280 -7.234 1.00 1.00 H new ATOM 0 HB2 ARG A 47 70.248 -0.181 -7.942 1.00 1.00 H new ATOM 0 HB3 ARG A 47 69.482 -1.044 -6.623 1.00 1.00 H new ATOM 0 HG2 ARG A 47 71.995 0.273 -5.736 1.00 1.00 H new ATOM 0 HG3 ARG A 47 70.873 1.435 -6.417 1.00 1.00 H new ATOM 0 HD2 ARG A 47 70.099 -0.609 -4.275 1.00 1.00 H new ATOM 0 HD3 ARG A 47 70.579 1.037 -3.915 1.00 1.00 H new ATOM 0 HE ARG A 47 68.005 0.176 -5.013 1.00 1.00 H new ATOM 0 HH11 ARG A 47 70.398 2.727 -4.779 1.00 1.00 H new ATOM 0 HH12 ARG A 47 69.238 4.024 -5.086 1.00 1.00 H new ATOM 0 HH21 ARG A 47 66.520 1.847 -5.417 1.00 1.00 H new ATOM 0 HH22 ARG A 47 67.059 3.529 -5.444 1.00 1.00 H new ATOM 694 N CYS A 48 71.924 -2.108 -4.721 1.00 1.00 N ATOM 695 CA CYS A 48 71.983 -2.878 -3.468 1.00 1.00 C ATOM 696 C CYS A 48 73.155 -3.868 -3.476 1.00 1.00 C ATOM 697 O CYS A 48 73.559 -4.371 -2.427 1.00 1.00 O ATOM 698 CB CYS A 48 70.670 -3.633 -3.225 1.00 1.00 C ATOM 699 SG CYS A 48 70.560 -4.104 -1.481 1.00 1.00 S ATOM 0 H CYS A 48 72.255 -1.146 -4.640 1.00 1.00 H new ATOM 0 HA CYS A 48 72.136 -2.165 -2.658 1.00 1.00 H new ATOM 0 HB2 CYS A 48 69.821 -3.006 -3.498 1.00 1.00 H new ATOM 0 HB3 CYS A 48 70.626 -4.521 -3.856 1.00 1.00 H new ATOM 0 HG CYS A 48 71.739 -4.438 -1.046 1.00 1.00 H new ATOM 704 N ASN A 49 73.676 -4.155 -4.665 1.00 1.00 N ATOM 705 CA ASN A 49 74.789 -5.100 -4.819 1.00 1.00 C ATOM 706 C ASN A 49 76.062 -4.617 -4.085 1.00 1.00 C ATOM 707 O ASN A 49 76.324 -3.417 -4.054 1.00 1.00 O ATOM 708 CB ASN A 49 75.081 -5.263 -6.323 1.00 1.00 C ATOM 709 CG ASN A 49 76.445 -5.911 -6.553 1.00 1.00 C ATOM 710 OD1 ASN A 49 77.516 -5.304 -6.120 1.00 1.00 O flip ATOM 711 ND2 ASN A 49 76.535 -6.985 -7.147 1.00 1.00 N flip ATOM 0 H ASN A 49 73.348 -3.748 -5.541 1.00 1.00 H new ATOM 0 HA ASN A 49 74.504 -6.053 -4.374 1.00 1.00 H new ATOM 0 HB2 ASN A 49 74.303 -5.873 -6.783 1.00 1.00 H new ATOM 0 HB3 ASN A 49 75.052 -4.288 -6.810 1.00 1.00 H new ATOM 0 HD21 ASN A 49 75.694 -7.454 -7.483 1.00 1.00 H new ATOM 0 HD22 ASN A 49 77.451 -7.406 -7.304 1.00 1.00 H new ATOM 718 N PRO A 50 76.884 -5.517 -3.533 1.00 1.00 N ATOM 719 CA PRO A 50 78.164 -5.115 -2.860 1.00 1.00 C ATOM 720 C PRO A 50 79.120 -4.403 -3.834 1.00 1.00 C ATOM 721 O PRO A 50 80.207 -4.895 -4.132 1.00 1.00 O ATOM 722 CB PRO A 50 78.775 -6.445 -2.357 1.00 1.00 C ATOM 723 CG PRO A 50 77.654 -7.431 -2.368 1.00 1.00 C ATOM 724 CD PRO A 50 76.693 -6.987 -3.469 1.00 1.00 C ATOM 0 HA PRO A 50 77.990 -4.405 -2.052 1.00 1.00 H new ATOM 0 HB2 PRO A 50 79.590 -6.771 -3.003 1.00 1.00 H new ATOM 0 HB3 PRO A 50 79.188 -6.332 -1.355 1.00 1.00 H new ATOM 0 HG2 PRO A 50 78.025 -8.438 -2.561 1.00 1.00 H new ATOM 0 HG3 PRO A 50 77.151 -7.456 -1.401 1.00 1.00 H new ATOM 0 HD2 PRO A 50 76.928 -7.463 -4.421 1.00 1.00 H new ATOM 0 HD3 PRO A 50 75.662 -7.246 -3.229 1.00 1.00 H new ATOM 732 N GLU A 51 78.724 -3.222 -4.281 1.00 1.00 N ATOM 733 CA GLU A 51 79.557 -2.419 -5.178 1.00 1.00 C ATOM 734 C GLU A 51 80.150 -3.240 -6.356 1.00 1.00 C ATOM 735 O GLU A 51 81.362 -3.246 -6.556 1.00 1.00 O ATOM 736 CB GLU A 51 80.701 -1.783 -4.369 1.00 1.00 C ATOM 737 CG GLU A 51 80.192 -1.324 -2.990 1.00 1.00 C ATOM 738 CD GLU A 51 79.090 -0.280 -3.144 1.00 1.00 C ATOM 739 OE1 GLU A 51 79.069 0.387 -4.166 1.00 1.00 O ATOM 740 OE2 GLU A 51 78.277 -0.168 -2.240 1.00 1.00 O ATOM 0 H GLU A 51 77.831 -2.793 -4.040 1.00 1.00 H new ATOM 0 HA GLU A 51 78.916 -1.654 -5.616 1.00 1.00 H new ATOM 0 HB2 GLU A 51 81.510 -2.502 -4.244 1.00 1.00 H new ATOM 0 HB3 GLU A 51 81.111 -0.933 -4.914 1.00 1.00 H new ATOM 0 HG2 GLU A 51 79.813 -2.181 -2.433 1.00 1.00 H new ATOM 0 HG3 GLU A 51 81.017 -0.907 -2.412 1.00 1.00 H new ATOM 747 N ARG A 52 79.282 -3.911 -7.146 1.00 1.00 N ATOM 748 CA ARG A 52 79.732 -4.704 -8.334 1.00 1.00 C ATOM 749 C ARG A 52 78.716 -4.591 -9.471 1.00 1.00 C ATOM 750 O ARG A 52 77.572 -4.216 -9.225 1.00 1.00 O ATOM 751 CB ARG A 52 79.912 -6.176 -7.994 1.00 1.00 C ATOM 752 CG ARG A 52 81.085 -6.358 -7.029 1.00 1.00 C ATOM 753 CD ARG A 52 81.281 -7.857 -6.695 1.00 1.00 C ATOM 754 NE ARG A 52 81.276 -8.043 -5.251 1.00 1.00 N ATOM 755 CZ ARG A 52 82.340 -7.748 -4.521 1.00 1.00 C ATOM 756 NH1 ARG A 52 83.416 -7.279 -5.095 1.00 1.00 N ATOM 757 NH2 ARG A 52 82.312 -7.928 -3.229 1.00 1.00 N ATOM 0 H ARG A 52 78.274 -3.926 -6.993 1.00 1.00 H new ATOM 0 HA ARG A 52 80.692 -4.291 -8.644 1.00 1.00 H new ATOM 0 HB2 ARG A 52 78.999 -6.567 -7.545 1.00 1.00 H new ATOM 0 HB3 ARG A 52 80.089 -6.748 -8.905 1.00 1.00 H new ATOM 0 HG2 ARG A 52 81.995 -5.956 -7.473 1.00 1.00 H new ATOM 0 HG3 ARG A 52 80.902 -5.796 -6.113 1.00 1.00 H new ATOM 0 HD2 ARG A 52 80.486 -8.448 -7.150 1.00 1.00 H new ATOM 0 HD3 ARG A 52 82.222 -8.213 -7.114 1.00 1.00 H new ATOM 0 HE ARG A 52 80.439 -8.406 -4.795 1.00 1.00 H new ATOM 0 HH11 ARG A 52 83.436 -7.140 -6.105 1.00 1.00 H new ATOM 0 HH12 ARG A 52 84.236 -7.052 -4.533 1.00 1.00 H new ATOM 0 HH21 ARG A 52 81.471 -8.295 -2.783 1.00 1.00 H new ATOM 0 HH22 ARG A 52 83.131 -7.701 -2.665 1.00 1.00 H new ATOM 771 N ILE A 53 79.145 -4.795 -10.737 1.00 1.00 N ATOM 772 CA ILE A 53 78.263 -4.585 -11.876 1.00 1.00 C ATOM 773 C ILE A 53 77.189 -5.688 -12.130 1.00 1.00 C ATOM 774 O ILE A 53 77.445 -6.890 -12.171 1.00 1.00 O ATOM 775 CB ILE A 53 79.155 -4.352 -13.104 1.00 1.00 C ATOM 776 CG1 ILE A 53 78.313 -3.929 -14.322 1.00 1.00 C ATOM 777 CG2 ILE A 53 79.943 -5.620 -13.427 1.00 1.00 C ATOM 778 CD1 ILE A 53 77.664 -2.555 -14.086 1.00 1.00 C ATOM 0 H ILE A 53 80.087 -5.101 -10.980 1.00 1.00 H new ATOM 0 HA ILE A 53 77.644 -3.716 -11.652 1.00 1.00 H new ATOM 0 HB ILE A 53 79.852 -3.546 -12.873 1.00 1.00 H new ATOM 0 HG12 ILE A 53 78.944 -3.891 -15.210 1.00 1.00 H new ATOM 0 HG13 ILE A 53 77.540 -4.674 -14.512 1.00 1.00 H new ATOM 0 HG21 ILE A 53 80.573 -5.445 -14.299 1.00 1.00 H new ATOM 0 HG22 ILE A 53 80.569 -5.886 -12.575 1.00 1.00 H new ATOM 0 HG23 ILE A 53 79.251 -6.435 -13.637 1.00 1.00 H new ATOM 0 HD11 ILE A 53 77.074 -2.276 -14.959 1.00 1.00 H new ATOM 0 HD12 ILE A 53 77.016 -2.604 -13.211 1.00 1.00 H new ATOM 0 HD13 ILE A 53 78.441 -1.809 -13.920 1.00 1.00 H new ATOM 790 N GLN A 54 75.987 -5.129 -12.232 1.00 1.00 N ATOM 791 CA GLN A 54 74.739 -5.893 -12.425 1.00 1.00 C ATOM 792 C GLN A 54 74.773 -6.589 -13.787 1.00 1.00 C ATOM 793 O GLN A 54 74.248 -6.065 -14.761 1.00 1.00 O ATOM 794 CB GLN A 54 73.522 -4.955 -12.334 1.00 1.00 C ATOM 795 CG GLN A 54 72.258 -5.769 -12.026 1.00 1.00 C ATOM 796 CD GLN A 54 72.330 -6.338 -10.609 1.00 1.00 C ATOM 797 OE1 GLN A 54 72.397 -5.594 -9.630 1.00 1.00 O ATOM 798 NE2 GLN A 54 72.351 -7.624 -10.438 1.00 1.00 N ATOM 0 H GLN A 54 75.841 -4.121 -12.184 1.00 1.00 H new ATOM 0 HA GLN A 54 74.653 -6.645 -11.641 1.00 1.00 H new ATOM 0 HB2 GLN A 54 73.684 -4.209 -11.556 1.00 1.00 H new ATOM 0 HB3 GLN A 54 73.397 -4.414 -13.272 1.00 1.00 H new ATOM 0 HG2 GLN A 54 71.376 -5.137 -12.128 1.00 1.00 H new ATOM 0 HG3 GLN A 54 72.154 -6.580 -12.747 1.00 1.00 H new ATOM 0 HE21 GLN A 54 72.296 -8.247 -11.244 1.00 1.00 H new ATOM 0 HE22 GLN A 54 72.423 -8.012 -9.498 1.00 1.00 H new ATOM 807 N ILE A 55 75.375 -7.795 -13.832 1.00 1.00 N ATOM 808 CA ILE A 55 75.444 -8.594 -15.071 1.00 1.00 C ATOM 809 C ILE A 55 75.397 -10.092 -14.725 1.00 1.00 C ATOM 810 O ILE A 55 75.766 -10.476 -13.620 1.00 1.00 O ATOM 811 CB ILE A 55 76.736 -8.266 -15.839 1.00 1.00 C ATOM 812 CG1 ILE A 55 76.737 -8.954 -17.250 1.00 1.00 C ATOM 813 CG2 ILE A 55 77.949 -8.698 -15.006 1.00 1.00 C ATOM 814 CD1 ILE A 55 77.482 -10.305 -17.249 1.00 1.00 C ATOM 0 H ILE A 55 75.819 -8.235 -13.026 1.00 1.00 H new ATOM 0 HA ILE A 55 74.591 -8.349 -15.703 1.00 1.00 H new ATOM 0 HB ILE A 55 76.792 -7.190 -16.005 1.00 1.00 H new ATOM 0 HG12 ILE A 55 75.708 -9.110 -17.575 1.00 1.00 H new ATOM 0 HG13 ILE A 55 77.202 -8.287 -17.975 1.00 1.00 H new ATOM 0 HG21 ILE A 55 78.865 -8.466 -15.550 1.00 1.00 H new ATOM 0 HG22 ILE A 55 77.946 -8.165 -14.055 1.00 1.00 H new ATOM 0 HG23 ILE A 55 77.899 -9.771 -14.820 1.00 1.00 H new ATOM 0 HD11 ILE A 55 77.452 -10.738 -18.249 1.00 1.00 H new ATOM 0 HD12 ILE A 55 78.519 -10.148 -16.952 1.00 1.00 H new ATOM 0 HD13 ILE A 55 77.002 -10.985 -16.545 1.00 1.00 H new ATOM 826 N GLY A 56 74.957 -10.946 -15.656 1.00 1.00 N ATOM 827 CA GLY A 56 74.894 -12.403 -15.402 1.00 1.00 C ATOM 828 C GLY A 56 73.455 -12.872 -15.230 1.00 1.00 C ATOM 829 O GLY A 56 73.179 -14.066 -15.141 1.00 1.00 O ATOM 0 H GLY A 56 74.641 -10.665 -16.584 1.00 1.00 H new ATOM 0 HA2 GLY A 56 75.357 -12.939 -16.230 1.00 1.00 H new ATOM 0 HA3 GLY A 56 75.467 -12.644 -14.506 1.00 1.00 H new ATOM 833 N ASP A 57 72.556 -11.909 -15.224 1.00 1.00 N ATOM 834 CA ASP A 57 71.123 -12.189 -15.110 1.00 1.00 C ATOM 835 C ASP A 57 70.457 -11.809 -16.428 1.00 1.00 C ATOM 836 O ASP A 57 70.670 -10.699 -16.918 1.00 1.00 O ATOM 837 CB ASP A 57 70.520 -11.397 -13.936 1.00 1.00 C ATOM 838 CG ASP A 57 71.593 -11.104 -12.892 1.00 1.00 C ATOM 839 OD1 ASP A 57 71.809 -11.949 -12.037 1.00 1.00 O ATOM 840 OD2 ASP A 57 72.179 -10.036 -12.957 1.00 1.00 O ATOM 0 H ASP A 57 72.785 -10.918 -15.297 1.00 1.00 H new ATOM 0 HA ASP A 57 70.957 -13.248 -14.911 1.00 1.00 H new ATOM 0 HB2 ASP A 57 70.092 -10.463 -14.300 1.00 1.00 H new ATOM 0 HB3 ASP A 57 69.708 -11.965 -13.483 1.00 1.00 H new ATOM 845 N TRP A 58 69.645 -12.702 -17.029 1.00 1.00 N ATOM 846 CA TRP A 58 68.984 -12.397 -18.291 1.00 1.00 C ATOM 847 C TRP A 58 67.505 -12.812 -18.219 1.00 1.00 C ATOM 848 O TRP A 58 67.106 -13.686 -17.459 1.00 1.00 O ATOM 849 CB TRP A 58 69.630 -13.186 -19.465 1.00 1.00 C ATOM 850 CG TRP A 58 70.858 -12.529 -20.055 1.00 1.00 C ATOM 851 CD1 TRP A 58 71.219 -11.215 -19.989 1.00 1.00 C ATOM 852 CD2 TRP A 58 71.889 -13.182 -20.853 1.00 1.00 C ATOM 853 NE1 TRP A 58 72.405 -11.043 -20.686 1.00 1.00 N ATOM 854 CE2 TRP A 58 72.857 -12.226 -21.236 1.00 1.00 C ATOM 855 CE3 TRP A 58 72.072 -14.513 -21.270 1.00 1.00 C ATOM 856 CZ2 TRP A 58 73.969 -12.579 -22.008 1.00 1.00 C ATOM 857 CZ3 TRP A 58 73.184 -14.871 -22.046 1.00 1.00 C ATOM 858 CH2 TRP A 58 74.131 -13.907 -22.415 1.00 1.00 C ATOM 0 H TRP A 58 69.439 -13.629 -16.656 1.00 1.00 H new ATOM 0 HA TRP A 58 69.085 -11.325 -18.463 1.00 1.00 H new ATOM 0 HB2 TRP A 58 69.899 -14.182 -19.114 1.00 1.00 H new ATOM 0 HB3 TRP A 58 68.888 -13.315 -20.253 1.00 1.00 H new ATOM 0 HD1 TRP A 58 70.671 -10.437 -19.478 1.00 1.00 H new ATOM 0 HE1 TRP A 58 72.886 -10.149 -20.781 1.00 1.00 H new ATOM 0 HE3 TRP A 58 71.350 -15.266 -20.990 1.00 1.00 H new ATOM 0 HZ2 TRP A 58 74.697 -11.832 -22.288 1.00 1.00 H new ATOM 0 HZ3 TRP A 58 73.311 -15.896 -22.361 1.00 1.00 H new ATOM 0 HH2 TRP A 58 74.985 -14.189 -23.013 1.00 1.00 H new ATOM 869 N ARG A 59 66.733 -12.100 -19.005 1.00 1.00 N ATOM 870 CA ARG A 59 65.279 -12.293 -19.037 1.00 1.00 C ATOM 871 C ARG A 59 64.919 -13.802 -18.898 1.00 1.00 C ATOM 872 O ARG A 59 63.953 -14.153 -18.225 1.00 1.00 O ATOM 873 CB ARG A 59 64.680 -11.698 -20.351 1.00 1.00 C ATOM 874 CG ARG A 59 64.173 -12.804 -21.305 1.00 1.00 C ATOM 875 CD ARG A 59 63.790 -12.210 -22.659 1.00 1.00 C ATOM 876 NE ARG A 59 64.980 -12.027 -23.486 1.00 1.00 N ATOM 877 CZ ARG A 59 65.625 -13.070 -24.003 1.00 1.00 C ATOM 878 NH1 ARG A 59 65.238 -14.285 -23.719 1.00 1.00 N ATOM 879 NH2 ARG A 59 66.652 -12.881 -24.786 1.00 1.00 N ATOM 0 H ARG A 59 67.076 -11.377 -19.637 1.00 1.00 H new ATOM 0 HA ARG A 59 64.842 -11.764 -18.190 1.00 1.00 H new ATOM 0 HB2 ARG A 59 63.858 -11.027 -20.104 1.00 1.00 H new ATOM 0 HB3 ARG A 59 65.438 -11.101 -20.858 1.00 1.00 H new ATOM 0 HG2 ARG A 59 64.947 -13.560 -21.439 1.00 1.00 H new ATOM 0 HG3 ARG A 59 63.311 -13.305 -20.864 1.00 1.00 H new ATOM 0 HD2 ARG A 59 63.084 -12.868 -23.166 1.00 1.00 H new ATOM 0 HD3 ARG A 59 63.288 -11.253 -22.515 1.00 1.00 H new ATOM 0 HE ARG A 59 65.322 -11.084 -23.670 1.00 1.00 H new ATOM 0 HH11 ARG A 59 64.441 -14.435 -23.101 1.00 1.00 H new ATOM 0 HH12 ARG A 59 65.733 -15.084 -24.116 1.00 1.00 H new ATOM 0 HH21 ARG A 59 66.961 -11.933 -25.002 1.00 1.00 H new ATOM 0 HH22 ARG A 59 67.146 -13.681 -25.182 1.00 1.00 H new ATOM 893 N TYR A 60 65.692 -14.673 -19.547 1.00 1.00 N ATOM 894 CA TYR A 60 65.442 -16.132 -19.501 1.00 1.00 C ATOM 895 C TYR A 60 66.105 -16.808 -18.289 1.00 1.00 C ATOM 896 O TYR A 60 65.627 -17.835 -17.761 1.00 1.00 O ATOM 897 CB TYR A 60 65.950 -16.780 -20.801 1.00 1.00 C ATOM 898 CG TYR A 60 65.173 -18.048 -21.100 1.00 1.00 C ATOM 899 CD1 TYR A 60 63.928 -17.968 -21.737 1.00 1.00 C ATOM 900 CD2 TYR A 60 65.699 -19.299 -20.749 1.00 1.00 C ATOM 901 CE1 TYR A 60 63.208 -19.135 -22.022 1.00 1.00 C ATOM 902 CE2 TYR A 60 64.978 -20.467 -21.035 1.00 1.00 C ATOM 903 CZ TYR A 60 63.732 -20.385 -21.672 1.00 1.00 C ATOM 904 OH TYR A 60 63.023 -21.536 -21.955 1.00 1.00 O ATOM 0 H TYR A 60 66.497 -14.404 -20.112 1.00 1.00 H new ATOM 0 HA TYR A 60 64.366 -16.276 -19.399 1.00 1.00 H new ATOM 0 HB2 TYR A 60 65.846 -16.079 -21.629 1.00 1.00 H new ATOM 0 HB3 TYR A 60 67.012 -17.010 -20.709 1.00 1.00 H new ATOM 0 HD1 TYR A 60 63.523 -17.005 -22.009 1.00 1.00 H new ATOM 0 HD2 TYR A 60 66.659 -19.363 -20.259 1.00 1.00 H new ATOM 0 HE1 TYR A 60 62.248 -19.070 -22.512 1.00 1.00 H new ATOM 0 HE2 TYR A 60 65.383 -21.431 -20.764 1.00 1.00 H new ATOM 0 HH TYR A 60 63.529 -22.316 -21.647 1.00 1.00 H new ATOM 914 N GLU A 61 67.190 -16.210 -17.822 1.00 1.00 N ATOM 915 CA GLU A 61 67.902 -16.729 -16.670 1.00 1.00 C ATOM 916 C GLU A 61 67.188 -16.349 -15.396 1.00 1.00 C ATOM 917 O GLU A 61 67.530 -16.836 -14.328 1.00 1.00 O ATOM 918 CB GLU A 61 69.345 -16.202 -16.620 1.00 1.00 C ATOM 919 CG GLU A 61 70.246 -16.995 -17.563 1.00 1.00 C ATOM 920 CD GLU A 61 71.636 -16.370 -17.579 1.00 1.00 C ATOM 921 OE1 GLU A 61 71.718 -15.173 -17.796 1.00 1.00 O ATOM 922 OE2 GLU A 61 72.596 -17.096 -17.381 1.00 1.00 O ATOM 0 H GLU A 61 67.595 -15.365 -18.225 1.00 1.00 H new ATOM 0 HA GLU A 61 67.931 -17.815 -16.764 1.00 1.00 H new ATOM 0 HB2 GLU A 61 69.361 -15.148 -16.896 1.00 1.00 H new ATOM 0 HB3 GLU A 61 69.727 -16.271 -15.601 1.00 1.00 H new ATOM 0 HG2 GLU A 61 70.306 -18.034 -17.239 1.00 1.00 H new ATOM 0 HG3 GLU A 61 69.825 -16.999 -18.568 1.00 1.00 H new ATOM 929 N VAL A 62 66.238 -15.427 -15.477 1.00 1.00 N ATOM 930 CA VAL A 62 65.572 -14.980 -14.261 1.00 1.00 C ATOM 931 C VAL A 62 65.105 -16.177 -13.463 1.00 1.00 C ATOM 932 O VAL A 62 65.425 -16.295 -12.310 1.00 1.00 O ATOM 933 CB VAL A 62 64.381 -14.084 -14.622 1.00 1.00 C ATOM 934 CG1 VAL A 62 63.510 -13.842 -13.387 1.00 1.00 C ATOM 935 CG2 VAL A 62 64.897 -12.740 -15.141 1.00 1.00 C ATOM 0 H VAL A 62 65.919 -14.987 -16.340 1.00 1.00 H new ATOM 0 HA VAL A 62 66.273 -14.406 -13.655 1.00 1.00 H new ATOM 0 HB VAL A 62 63.786 -14.578 -15.390 1.00 1.00 H new ATOM 0 HG11 VAL A 62 62.667 -13.205 -13.655 1.00 1.00 H new ATOM 0 HG12 VAL A 62 63.139 -14.795 -13.011 1.00 1.00 H new ATOM 0 HG13 VAL A 62 64.103 -13.353 -12.614 1.00 1.00 H new ATOM 0 HG21 VAL A 62 64.052 -12.101 -15.398 1.00 1.00 H new ATOM 0 HG22 VAL A 62 65.495 -12.257 -14.368 1.00 1.00 H new ATOM 0 HG23 VAL A 62 65.511 -12.903 -16.026 1.00 1.00 H new ATOM 945 N ALA A 63 64.304 -17.035 -14.037 1.00 1.00 N ATOM 946 CA ALA A 63 63.817 -18.175 -13.290 1.00 1.00 C ATOM 947 C ALA A 63 64.968 -19.098 -12.932 1.00 1.00 C ATOM 948 O ALA A 63 65.216 -19.354 -11.756 1.00 1.00 O ATOM 949 CB ALA A 63 62.801 -18.950 -14.132 1.00 1.00 C ATOM 0 H ALA A 63 63.977 -16.974 -15.001 1.00 1.00 H new ATOM 0 HA ALA A 63 63.343 -17.816 -12.376 1.00 1.00 H new ATOM 0 HB1 ALA A 63 62.437 -19.807 -13.565 1.00 1.00 H new ATOM 0 HB2 ALA A 63 61.964 -18.299 -14.382 1.00 1.00 H new ATOM 0 HB3 ALA A 63 63.277 -19.297 -15.049 1.00 1.00 H new ATOM 955 N HIS A 64 65.681 -19.557 -13.968 1.00 1.00 N ATOM 956 CA HIS A 64 66.823 -20.460 -13.748 1.00 1.00 C ATOM 957 C HIS A 64 67.713 -19.900 -12.633 1.00 1.00 C ATOM 958 O HIS A 64 67.963 -20.550 -11.624 1.00 1.00 O ATOM 959 CB HIS A 64 67.617 -20.621 -15.044 1.00 1.00 C ATOM 960 CG HIS A 64 68.874 -21.419 -14.809 1.00 1.00 C ATOM 961 ND1 HIS A 64 70.088 -20.810 -14.531 1.00 1.00 N ATOM 962 CD2 HIS A 64 69.137 -22.768 -14.866 1.00 1.00 C ATOM 963 CE1 HIS A 64 71.018 -21.778 -14.440 1.00 1.00 C ATOM 964 NE2 HIS A 64 70.492 -22.990 -14.636 1.00 1.00 N ATOM 0 H HIS A 64 65.496 -19.327 -14.944 1.00 1.00 H new ATOM 0 HA HIS A 64 66.458 -21.441 -13.445 1.00 1.00 H new ATOM 0 HB2 HIS A 64 67.001 -21.118 -15.793 1.00 1.00 H new ATOM 0 HB3 HIS A 64 67.874 -19.639 -15.442 1.00 1.00 H new ATOM 0 HD2 HIS A 64 68.404 -23.537 -15.060 1.00 1.00 H new ATOM 0 HE1 HIS A 64 72.063 -21.597 -14.234 1.00 1.00 H new ATOM 0 HE2 HIS A 64 70.979 -23.886 -14.620 1.00 1.00 H new ATOM 972 N ASP A 65 68.171 -18.682 -12.832 1.00 1.00 N ATOM 973 CA ASP A 65 69.025 -18.019 -11.843 1.00 1.00 C ATOM 974 C ASP A 65 68.208 -17.554 -10.627 1.00 1.00 C ATOM 975 O ASP A 65 68.526 -17.871 -9.468 1.00 1.00 O ATOM 976 CB ASP A 65 69.730 -16.818 -12.477 1.00 1.00 C ATOM 977 CG ASP A 65 70.896 -16.375 -11.599 1.00 1.00 C ATOM 978 OD1 ASP A 65 71.457 -17.218 -10.919 1.00 1.00 O ATOM 979 OD2 ASP A 65 71.217 -15.198 -11.624 1.00 1.00 O ATOM 0 H ASP A 65 67.973 -18.125 -13.663 1.00 1.00 H new ATOM 0 HA ASP A 65 69.768 -18.741 -11.504 1.00 1.00 H new ATOM 0 HB2 ASP A 65 70.092 -17.081 -13.471 1.00 1.00 H new ATOM 0 HB3 ASP A 65 69.025 -15.996 -12.602 1.00 1.00 H new ATOM 984 N GLY A 66 67.101 -16.876 -10.867 1.00 1.00 N ATOM 985 CA GLY A 66 66.230 -16.442 -9.786 1.00 1.00 C ATOM 986 C GLY A 66 65.456 -17.630 -9.236 1.00 1.00 C ATOM 987 O GLY A 66 64.412 -17.476 -8.603 1.00 1.00 O ATOM 0 H GLY A 66 66.782 -16.613 -11.800 1.00 1.00 H new ATOM 0 HA2 GLY A 66 66.821 -15.983 -8.993 1.00 1.00 H new ATOM 0 HA3 GLY A 66 65.538 -15.682 -10.148 1.00 1.00 H new ATOM 991 N ARG A 67 66.059 -18.802 -9.396 1.00 1.00 N ATOM 992 CA ARG A 67 65.546 -20.041 -8.830 1.00 1.00 C ATOM 993 C ARG A 67 65.798 -19.926 -7.344 1.00 1.00 C ATOM 994 O ARG A 67 65.619 -20.902 -6.613 1.00 1.00 O ATOM 995 CB ARG A 67 66.256 -21.318 -9.318 1.00 1.00 C ATOM 996 CG ARG A 67 65.560 -21.968 -10.514 1.00 1.00 C ATOM 997 CD ARG A 67 66.160 -23.371 -10.730 1.00 1.00 C ATOM 998 NE ARG A 67 67.580 -23.258 -11.067 1.00 1.00 N ATOM 999 CZ ARG A 67 68.326 -24.327 -11.361 1.00 1.00 C ATOM 1000 NH1 ARG A 67 67.798 -25.521 -11.401 1.00 1.00 N ATOM 1001 NH2 ARG A 67 69.599 -24.174 -11.619 1.00 1.00 N ATOM 0 H ARG A 67 66.923 -18.919 -9.926 1.00 1.00 H new ATOM 0 HA ARG A 67 64.502 -20.146 -9.126 1.00 1.00 H new ATOM 0 HB2 ARG A 67 67.283 -21.075 -9.590 1.00 1.00 H new ATOM 0 HB3 ARG A 67 66.305 -22.036 -8.499 1.00 1.00 H new ATOM 0 HG2 ARG A 67 64.487 -22.039 -10.335 1.00 1.00 H new ATOM 0 HG3 ARG A 67 65.694 -21.358 -11.407 1.00 1.00 H new ATOM 0 HD2 ARG A 67 66.038 -23.971 -9.828 1.00 1.00 H new ATOM 0 HD3 ARG A 67 65.627 -23.885 -11.530 1.00 1.00 H new ATOM 0 HE ARG A 67 68.013 -22.335 -11.078 1.00 1.00 H new ATOM 0 HH11 ARG A 67 66.805 -25.646 -11.206 1.00 1.00 H new ATOM 0 HH12 ARG A 67 68.379 -26.328 -11.627 1.00 1.00 H new ATOM 0 HH21 ARG A 67 70.016 -23.243 -11.595 1.00 1.00 H new ATOM 0 HH22 ARG A 67 70.175 -24.985 -11.844 1.00 1.00 H new ATOM 1015 N LEU A 68 66.287 -18.741 -6.919 1.00 1.00 N ATOM 1016 CA LEU A 68 66.634 -18.501 -5.508 1.00 1.00 C ATOM 1017 C LEU A 68 65.710 -19.312 -4.631 1.00 1.00 C ATOM 1018 O LEU A 68 66.076 -19.725 -3.537 1.00 1.00 O ATOM 1019 CB LEU A 68 66.464 -17.007 -5.143 1.00 1.00 C ATOM 1020 CG LEU A 68 66.774 -16.770 -3.631 1.00 1.00 C ATOM 1021 CD1 LEU A 68 67.444 -15.401 -3.438 1.00 1.00 C ATOM 1022 CD2 LEU A 68 65.477 -16.789 -2.787 1.00 1.00 C ATOM 0 H LEU A 68 66.448 -17.942 -7.532 1.00 1.00 H new ATOM 0 HA LEU A 68 67.674 -18.789 -5.354 1.00 1.00 H new ATOM 0 HB2 LEU A 68 67.130 -16.400 -5.756 1.00 1.00 H new ATOM 0 HB3 LEU A 68 65.446 -16.687 -5.365 1.00 1.00 H new ATOM 0 HG LEU A 68 67.436 -17.572 -3.303 1.00 1.00 H new ATOM 0 HD11 LEU A 68 67.656 -15.246 -2.380 1.00 1.00 H new ATOM 0 HD12 LEU A 68 68.375 -15.369 -4.003 1.00 1.00 H new ATOM 0 HD13 LEU A 68 66.777 -14.616 -3.793 1.00 1.00 H new ATOM 0 HD21 LEU A 68 65.723 -16.621 -1.738 1.00 1.00 H new ATOM 0 HD22 LEU A 68 64.806 -16.002 -3.133 1.00 1.00 H new ATOM 0 HD23 LEU A 68 64.987 -17.757 -2.895 1.00 1.00 H new ATOM 1034 N LEU A 69 64.511 -19.542 -5.137 1.00 1.00 N ATOM 1035 CA LEU A 69 63.555 -20.337 -4.376 1.00 1.00 C ATOM 1036 C LEU A 69 64.105 -21.768 -4.228 1.00 1.00 C ATOM 1037 O LEU A 69 64.450 -22.180 -3.122 1.00 1.00 O ATOM 1038 CB LEU A 69 62.201 -20.344 -5.126 1.00 1.00 C ATOM 1039 CG LEU A 69 61.186 -19.441 -4.410 1.00 1.00 C ATOM 1040 CD1 LEU A 69 60.070 -19.047 -5.378 1.00 1.00 C ATOM 1041 CD2 LEU A 69 60.587 -20.197 -3.219 1.00 1.00 C ATOM 0 H LEU A 69 64.180 -19.204 -6.041 1.00 1.00 H new ATOM 0 HA LEU A 69 63.404 -19.914 -3.383 1.00 1.00 H new ATOM 0 HB2 LEU A 69 62.344 -20.000 -6.150 1.00 1.00 H new ATOM 0 HB3 LEU A 69 61.815 -21.362 -5.183 1.00 1.00 H new ATOM 0 HG LEU A 69 61.689 -18.540 -4.058 1.00 1.00 H new ATOM 0 HD11 LEU A 69 59.353 -18.406 -4.865 1.00 1.00 H new ATOM 0 HD12 LEU A 69 60.496 -18.509 -6.225 1.00 1.00 H new ATOM 0 HD13 LEU A 69 59.565 -19.944 -5.735 1.00 1.00 H new ATOM 0 HD21 LEU A 69 59.866 -19.559 -2.708 1.00 1.00 H new ATOM 0 HD22 LEU A 69 60.087 -21.098 -3.574 1.00 1.00 H new ATOM 0 HD23 LEU A 69 61.382 -20.473 -2.526 1.00 1.00 H new ATOM 1053 N ALA A 70 64.232 -22.506 -5.341 1.00 1.00 N ATOM 1054 CA ALA A 70 64.800 -23.858 -5.238 1.00 1.00 C ATOM 1055 C ALA A 70 66.306 -23.683 -5.129 1.00 1.00 C ATOM 1056 O ALA A 70 66.867 -23.778 -4.042 1.00 1.00 O ATOM 1057 CB ALA A 70 64.435 -24.688 -6.475 1.00 1.00 C ATOM 0 H ALA A 70 63.964 -22.209 -6.279 1.00 1.00 H new ATOM 0 HA ALA A 70 64.406 -24.389 -4.372 1.00 1.00 H new ATOM 0 HB1 ALA A 70 64.863 -25.686 -6.383 1.00 1.00 H new ATOM 0 HB2 ALA A 70 63.351 -24.764 -6.555 1.00 1.00 H new ATOM 0 HB3 ALA A 70 64.831 -24.204 -7.368 1.00 1.00 H new ATOM 1063 N ALA A 71 66.942 -23.394 -6.256 1.00 1.00 N ATOM 1064 CA ALA A 71 68.376 -23.145 -6.356 1.00 1.00 C ATOM 1065 C ALA A 71 68.940 -22.262 -5.246 1.00 1.00 C ATOM 1066 O ALA A 71 70.111 -21.908 -5.323 1.00 1.00 O ATOM 1067 CB ALA A 71 68.700 -22.486 -7.692 1.00 1.00 C ATOM 0 H ALA A 71 66.461 -23.324 -7.153 1.00 1.00 H new ATOM 0 HA ALA A 71 68.844 -24.125 -6.262 1.00 1.00 H new ATOM 0 HB1 ALA A 71 69.773 -22.304 -7.757 1.00 1.00 H new ATOM 0 HB2 ALA A 71 68.393 -23.143 -8.506 1.00 1.00 H new ATOM 0 HB3 ALA A 71 68.166 -21.539 -7.770 1.00 1.00 H new ATOM 1073 N HIS A 72 68.150 -21.855 -4.244 1.00 1.00 N ATOM 1074 CA HIS A 72 68.661 -20.968 -3.193 1.00 1.00 C ATOM 1075 C HIS A 72 70.144 -21.212 -2.904 1.00 1.00 C ATOM 1076 O HIS A 72 70.945 -20.280 -2.984 1.00 1.00 O ATOM 1077 CB HIS A 72 67.825 -21.128 -1.902 1.00 1.00 C ATOM 1078 CG HIS A 72 68.380 -22.212 -1.010 1.00 1.00 C ATOM 1079 ND1 HIS A 72 68.437 -23.576 -1.150 1.00 1.00 N flip ATOM 1080 CD2 HIS A 72 68.943 -21.933 0.225 1.00 1.00 C flip ATOM 1081 CE1 HIS A 72 69.025 -24.137 -0.022 1.00 1.00 C flip ATOM 1082 NE2 HIS A 72 69.312 -23.105 0.775 1.00 1.00 N flip ATOM 0 H HIS A 72 67.171 -22.121 -4.140 1.00 1.00 H new ATOM 0 HA HIS A 72 68.567 -19.944 -3.556 1.00 1.00 H new ATOM 0 HB2 HIS A 72 67.808 -20.183 -1.359 1.00 1.00 H new ATOM 0 HB3 HIS A 72 66.793 -21.364 -2.163 1.00 1.00 H new ATOM 0 HD2 HIS A 72 69.064 -20.954 0.666 1.00 1.00 H new ATOM 0 HE1 HIS A 72 69.210 -25.184 0.169 1.00 1.00 H new ATOM 0 HE2 HIS A 72 69.756 -23.194 1.689 1.00 1.00 H new ATOM 1090 N MET A 73 70.527 -22.453 -2.613 1.00 1.00 N ATOM 1091 CA MET A 73 71.937 -22.726 -2.378 1.00 1.00 C ATOM 1092 C MET A 73 72.654 -22.683 -3.718 1.00 1.00 C ATOM 1093 O MET A 73 73.643 -21.964 -3.877 1.00 1.00 O ATOM 1094 CB MET A 73 72.146 -24.087 -1.707 1.00 1.00 C ATOM 1095 CG MET A 73 73.591 -24.185 -1.190 1.00 1.00 C ATOM 1096 SD MET A 73 73.753 -23.236 0.353 1.00 1.00 S ATOM 1097 CE MET A 73 74.034 -24.617 1.497 1.00 1.00 C ATOM 0 H MET A 73 69.905 -23.257 -2.537 1.00 1.00 H new ATOM 0 HA MET A 73 72.341 -21.973 -1.701 1.00 1.00 H new ATOM 0 HB2 MET A 73 71.444 -24.210 -0.882 1.00 1.00 H new ATOM 0 HB3 MET A 73 71.947 -24.889 -2.417 1.00 1.00 H new ATOM 0 HG2 MET A 73 73.856 -25.228 -1.017 1.00 1.00 H new ATOM 0 HG3 MET A 73 74.283 -23.801 -1.939 1.00 1.00 H new ATOM 0 HE1 MET A 73 74.159 -24.232 2.509 1.00 1.00 H new ATOM 0 HE2 MET A 73 73.179 -25.293 1.469 1.00 1.00 H new ATOM 0 HE3 MET A 73 74.933 -25.157 1.201 1.00 1.00 H new ATOM 1107 N VAL A 74 72.199 -23.512 -4.666 1.00 1.00 N ATOM 1108 CA VAL A 74 72.856 -23.608 -5.958 1.00 1.00 C ATOM 1109 C VAL A 74 73.180 -22.220 -6.523 1.00 1.00 C ATOM 1110 O VAL A 74 74.286 -22.071 -7.032 1.00 1.00 O ATOM 1111 CB VAL A 74 72.013 -24.456 -6.910 1.00 1.00 C ATOM 1112 CG1 VAL A 74 72.715 -24.593 -8.261 1.00 1.00 C ATOM 1113 CG2 VAL A 74 71.824 -25.848 -6.293 1.00 1.00 C ATOM 0 H VAL A 74 71.385 -24.117 -4.556 1.00 1.00 H new ATOM 0 HA VAL A 74 73.815 -24.112 -5.835 1.00 1.00 H new ATOM 0 HB VAL A 74 71.047 -23.975 -7.064 1.00 1.00 H new ATOM 0 HG11 VAL A 74 72.103 -25.199 -8.929 1.00 1.00 H new ATOM 0 HG12 VAL A 74 72.859 -23.605 -8.698 1.00 1.00 H new ATOM 0 HG13 VAL A 74 73.684 -25.073 -8.121 1.00 1.00 H new ATOM 0 HG21 VAL A 74 71.224 -26.464 -6.962 1.00 1.00 H new ATOM 0 HG22 VAL A 74 72.797 -26.315 -6.145 1.00 1.00 H new ATOM 0 HG23 VAL A 74 71.316 -25.755 -5.333 1.00 1.00 H new ATOM 1123 N ASN A 75 72.284 -21.186 -6.454 1.00 1.00 N ATOM 1124 CA ASN A 75 72.617 -19.815 -6.965 1.00 1.00 C ATOM 1125 C ASN A 75 74.088 -19.462 -6.699 1.00 1.00 C ATOM 1126 O ASN A 75 74.678 -18.585 -7.336 1.00 1.00 O ATOM 1127 CB ASN A 75 71.689 -18.765 -6.289 1.00 1.00 C ATOM 1128 CG ASN A 75 70.748 -18.134 -7.318 1.00 1.00 C ATOM 1129 OD1 ASN A 75 71.204 -17.538 -8.293 1.00 1.00 O ATOM 1130 ND2 ASN A 75 69.458 -18.237 -7.160 1.00 1.00 N ATOM 0 H ASN A 75 71.347 -21.271 -6.059 1.00 1.00 H new ATOM 0 HA ASN A 75 72.459 -19.805 -8.043 1.00 1.00 H new ATOM 0 HB2 ASN A 75 71.107 -19.241 -5.500 1.00 1.00 H new ATOM 0 HB3 ASN A 75 72.292 -17.990 -5.817 1.00 1.00 H new ATOM 0 HD21 ASN A 75 68.826 -17.823 -7.845 1.00 1.00 H new ATOM 0 HD22 ASN A 75 69.081 -18.731 -6.351 1.00 1.00 H new ATOM 1137 N GLY A 76 74.684 -20.259 -5.853 1.00 1.00 N ATOM 1138 CA GLY A 76 76.101 -20.164 -5.602 1.00 1.00 C ATOM 1139 C GLY A 76 76.789 -20.134 -6.974 1.00 1.00 C ATOM 1140 O GLY A 76 77.931 -19.707 -7.111 1.00 1.00 O ATOM 0 H GLY A 76 74.208 -20.987 -5.321 1.00 1.00 H new ATOM 0 HA2 GLY A 76 76.334 -19.265 -5.032 1.00 1.00 H new ATOM 0 HA3 GLY A 76 76.448 -21.013 -5.013 1.00 1.00 H new ATOM 1144 N ILE A 77 76.058 -20.625 -7.998 1.00 1.00 N ATOM 1145 CA ILE A 77 76.592 -20.673 -9.335 1.00 1.00 C ATOM 1146 C ILE A 77 76.936 -19.284 -9.868 1.00 1.00 C ATOM 1147 O ILE A 77 78.054 -19.135 -10.362 1.00 1.00 O ATOM 1148 CB ILE A 77 75.677 -21.454 -10.304 1.00 1.00 C ATOM 1149 CG1 ILE A 77 74.241 -20.931 -10.285 1.00 1.00 C ATOM 1150 CG2 ILE A 77 75.649 -22.930 -9.898 1.00 1.00 C ATOM 1151 CD1 ILE A 77 73.415 -21.696 -11.330 1.00 1.00 C ATOM 0 H ILE A 77 75.108 -20.985 -7.905 1.00 1.00 H new ATOM 0 HA ILE A 77 77.528 -21.228 -9.274 1.00 1.00 H new ATOM 0 HB ILE A 77 76.082 -21.325 -11.308 1.00 1.00 H new ATOM 0 HG12 ILE A 77 73.807 -21.060 -9.294 1.00 1.00 H new ATOM 0 HG13 ILE A 77 74.227 -19.863 -10.502 1.00 1.00 H new ATOM 0 HG21 ILE A 77 75.004 -23.483 -10.581 1.00 1.00 H new ATOM 0 HG22 ILE A 77 76.659 -23.339 -9.942 1.00 1.00 H new ATOM 0 HG23 ILE A 77 75.265 -23.021 -8.882 1.00 1.00 H new ATOM 0 HD11 ILE A 77 72.389 -21.329 -11.323 1.00 1.00 H new ATOM 0 HD12 ILE A 77 73.848 -21.544 -12.319 1.00 1.00 H new ATOM 0 HD13 ILE A 77 73.421 -22.760 -11.091 1.00 1.00 H new ATOM 1163 N VAL A 78 76.075 -18.230 -9.799 1.00 1.00 N ATOM 1164 CA VAL A 78 76.448 -16.915 -10.310 1.00 1.00 C ATOM 1165 C VAL A 78 77.709 -16.360 -9.664 1.00 1.00 C ATOM 1166 O VAL A 78 78.357 -15.473 -10.221 1.00 1.00 O ATOM 1167 CB VAL A 78 75.273 -15.950 -10.032 1.00 1.00 C ATOM 1168 CG1 VAL A 78 75.173 -15.636 -8.518 1.00 1.00 C ATOM 1169 CG2 VAL A 78 75.467 -14.652 -10.824 1.00 1.00 C ATOM 0 H VAL A 78 75.138 -18.280 -9.399 1.00 1.00 H new ATOM 0 HA VAL A 78 76.657 -17.013 -11.375 1.00 1.00 H new ATOM 0 HB VAL A 78 74.346 -16.429 -10.348 1.00 1.00 H new ATOM 0 HG11 VAL A 78 74.340 -14.955 -8.342 1.00 1.00 H new ATOM 0 HG12 VAL A 78 75.009 -16.561 -7.965 1.00 1.00 H new ATOM 0 HG13 VAL A 78 76.099 -15.171 -8.181 1.00 1.00 H new ATOM 0 HG21 VAL A 78 74.636 -13.976 -10.624 1.00 1.00 H new ATOM 0 HG22 VAL A 78 76.401 -14.178 -10.522 1.00 1.00 H new ATOM 0 HG23 VAL A 78 75.502 -14.878 -11.890 1.00 1.00 H new ATOM 1179 N ILE A 79 78.090 -16.897 -8.513 1.00 1.00 N ATOM 1180 CA ILE A 79 79.320 -16.435 -7.869 1.00 1.00 C ATOM 1181 C ILE A 79 80.464 -17.307 -8.406 1.00 1.00 C ATOM 1182 O ILE A 79 81.559 -16.830 -8.699 1.00 1.00 O ATOM 1183 CB ILE A 79 79.197 -16.469 -6.308 1.00 1.00 C ATOM 1184 CG1 ILE A 79 79.986 -17.647 -5.691 1.00 1.00 C ATOM 1185 CG2 ILE A 79 77.717 -16.576 -5.923 1.00 1.00 C ATOM 1186 CD1 ILE A 79 79.658 -17.781 -4.194 1.00 1.00 C ATOM 0 H ILE A 79 77.586 -17.631 -8.015 1.00 1.00 H new ATOM 0 HA ILE A 79 79.521 -15.391 -8.108 1.00 1.00 H new ATOM 0 HB ILE A 79 79.625 -15.548 -5.914 1.00 1.00 H new ATOM 0 HG12 ILE A 79 79.736 -18.573 -6.210 1.00 1.00 H new ATOM 0 HG13 ILE A 79 81.056 -17.486 -5.823 1.00 1.00 H new ATOM 0 HG21 ILE A 79 77.624 -16.600 -4.837 1.00 1.00 H new ATOM 0 HG22 ILE A 79 77.176 -15.714 -6.314 1.00 1.00 H new ATOM 0 HG23 ILE A 79 77.297 -17.490 -6.343 1.00 1.00 H new ATOM 0 HD11 ILE A 79 80.220 -18.614 -3.772 1.00 1.00 H new ATOM 0 HD12 ILE A 79 79.931 -16.860 -3.678 1.00 1.00 H new ATOM 0 HD13 ILE A 79 78.591 -17.964 -4.070 1.00 1.00 H new ATOM 1198 N ALA A 80 80.156 -18.591 -8.575 1.00 1.00 N ATOM 1199 CA ALA A 80 81.110 -19.564 -9.106 1.00 1.00 C ATOM 1200 C ALA A 80 81.225 -19.536 -10.639 1.00 1.00 C ATOM 1201 O ALA A 80 82.177 -20.091 -11.187 1.00 1.00 O ATOM 1202 CB ALA A 80 80.717 -20.975 -8.659 1.00 1.00 C ATOM 0 H ALA A 80 79.243 -18.986 -8.349 1.00 1.00 H new ATOM 0 HA ALA A 80 82.085 -19.286 -8.706 1.00 1.00 H new ATOM 0 HB1 ALA A 80 81.431 -21.695 -9.058 1.00 1.00 H new ATOM 0 HB2 ALA A 80 80.720 -21.026 -7.570 1.00 1.00 H new ATOM 0 HB3 ALA A 80 79.720 -21.210 -9.030 1.00 1.00 H new ATOM 1208 N GLU A 81 80.262 -18.927 -11.351 1.00 1.00 N ATOM 1209 CA GLU A 81 80.317 -18.910 -12.798 1.00 1.00 C ATOM 1210 C GLU A 81 80.996 -17.645 -13.345 1.00 1.00 C ATOM 1211 O GLU A 81 82.111 -17.746 -13.864 1.00 1.00 O ATOM 1212 CB GLU A 81 78.875 -19.026 -13.329 1.00 1.00 C ATOM 1213 CG GLU A 81 78.851 -19.041 -14.861 1.00 1.00 C ATOM 1214 CD GLU A 81 77.407 -19.141 -15.349 1.00 1.00 C ATOM 1215 OE1 GLU A 81 76.576 -18.412 -14.832 1.00 1.00 O ATOM 1216 OE2 GLU A 81 77.153 -19.944 -16.232 1.00 1.00 O ATOM 0 H GLU A 81 79.456 -18.452 -10.945 1.00 1.00 H new ATOM 0 HA GLU A 81 80.923 -19.749 -13.138 1.00 1.00 H new ATOM 0 HB2 GLU A 81 78.415 -19.937 -12.946 1.00 1.00 H new ATOM 0 HB3 GLU A 81 78.280 -18.190 -12.961 1.00 1.00 H new ATOM 0 HG2 GLU A 81 79.316 -18.135 -15.251 1.00 1.00 H new ATOM 0 HG3 GLU A 81 79.432 -19.884 -15.236 1.00 1.00 H new ATOM 1223 N ASP A 82 80.360 -16.459 -13.277 1.00 1.00 N ATOM 1224 CA ASP A 82 80.972 -15.238 -13.831 1.00 1.00 C ATOM 1225 C ASP A 82 81.871 -14.436 -12.858 1.00 1.00 C ATOM 1226 O ASP A 82 82.613 -13.561 -13.302 1.00 1.00 O ATOM 1227 CB ASP A 82 79.854 -14.352 -14.370 1.00 1.00 C ATOM 1228 CG ASP A 82 78.994 -15.166 -15.331 1.00 1.00 C ATOM 1229 OD1 ASP A 82 79.484 -15.505 -16.397 1.00 1.00 O ATOM 1230 OD2 ASP A 82 77.861 -15.458 -14.980 1.00 1.00 O ATOM 0 H ASP A 82 79.442 -16.322 -12.853 1.00 1.00 H new ATOM 0 HA ASP A 82 81.656 -15.564 -14.615 1.00 1.00 H new ATOM 0 HB2 ASP A 82 79.245 -13.973 -13.549 1.00 1.00 H new ATOM 0 HB3 ASP A 82 80.274 -13.486 -14.882 1.00 1.00 H new ATOM 1235 N ALA A 83 81.787 -14.688 -11.548 1.00 1.00 N ATOM 1236 CA ALA A 83 82.608 -13.890 -10.618 1.00 1.00 C ATOM 1237 C ALA A 83 84.096 -13.931 -10.989 1.00 1.00 C ATOM 1238 O ALA A 83 84.739 -12.893 -11.003 1.00 1.00 O ATOM 1239 CB ALA A 83 82.410 -14.294 -9.158 1.00 1.00 C ATOM 0 H ALA A 83 81.194 -15.398 -11.119 1.00 1.00 H new ATOM 0 HA ALA A 83 82.258 -12.863 -10.721 1.00 1.00 H new ATOM 0 HB1 ALA A 83 83.039 -13.673 -8.520 1.00 1.00 H new ATOM 0 HB2 ALA A 83 81.365 -14.157 -8.881 1.00 1.00 H new ATOM 0 HB3 ALA A 83 82.685 -15.341 -9.030 1.00 1.00 H new ATOM 1245 N LEU A 84 84.654 -15.100 -11.308 1.00 1.00 N ATOM 1246 CA LEU A 84 86.074 -15.189 -11.677 1.00 1.00 C ATOM 1247 C LEU A 84 86.493 -14.000 -12.562 1.00 1.00 C ATOM 1248 O LEU A 84 87.642 -13.561 -12.527 1.00 1.00 O ATOM 1249 CB LEU A 84 86.283 -16.546 -12.404 1.00 1.00 C ATOM 1250 CG LEU A 84 87.771 -16.862 -12.696 1.00 1.00 C ATOM 1251 CD1 LEU A 84 88.320 -15.973 -13.839 1.00 1.00 C ATOM 1252 CD2 LEU A 84 88.617 -16.683 -11.420 1.00 1.00 C ATOM 0 H LEU A 84 84.155 -15.989 -11.320 1.00 1.00 H new ATOM 0 HA LEU A 84 86.703 -15.143 -10.788 1.00 1.00 H new ATOM 0 HB2 LEU A 84 85.862 -17.345 -11.794 1.00 1.00 H new ATOM 0 HB3 LEU A 84 85.730 -16.536 -13.343 1.00 1.00 H new ATOM 0 HG LEU A 84 87.838 -17.901 -13.019 1.00 1.00 H new ATOM 0 HD11 LEU A 84 89.366 -16.219 -14.020 1.00 1.00 H new ATOM 0 HD12 LEU A 84 87.743 -16.150 -14.747 1.00 1.00 H new ATOM 0 HD13 LEU A 84 88.237 -14.924 -13.556 1.00 1.00 H new ATOM 0 HD21 LEU A 84 89.660 -16.909 -11.641 1.00 1.00 H new ATOM 0 HD22 LEU A 84 88.534 -15.654 -11.070 1.00 1.00 H new ATOM 0 HD23 LEU A 84 88.255 -17.360 -10.646 1.00 1.00 H new ATOM 1264 N ILE A 85 85.542 -13.460 -13.323 1.00 1.00 N ATOM 1265 CA ILE A 85 85.819 -12.300 -14.181 1.00 1.00 C ATOM 1266 C ILE A 85 85.713 -10.992 -13.384 1.00 1.00 C ATOM 1267 O ILE A 85 86.488 -10.061 -13.611 1.00 1.00 O ATOM 1268 CB ILE A 85 84.862 -12.262 -15.381 1.00 1.00 C ATOM 1269 CG1 ILE A 85 84.992 -13.574 -16.172 1.00 1.00 C ATOM 1270 CG2 ILE A 85 85.223 -11.078 -16.292 1.00 1.00 C ATOM 1271 CD1 ILE A 85 83.983 -13.603 -17.329 1.00 1.00 C ATOM 0 H ILE A 85 84.581 -13.800 -13.366 1.00 1.00 H new ATOM 0 HA ILE A 85 86.839 -12.401 -14.553 1.00 1.00 H new ATOM 0 HB ILE A 85 83.838 -12.145 -15.027 1.00 1.00 H new ATOM 0 HG12 ILE A 85 86.005 -13.672 -16.562 1.00 1.00 H new ATOM 0 HG13 ILE A 85 84.821 -14.423 -15.511 1.00 1.00 H new ATOM 0 HG21 ILE A 85 84.542 -11.053 -17.143 1.00 1.00 H new ATOM 0 HG22 ILE A 85 85.137 -10.148 -15.731 1.00 1.00 H new ATOM 0 HG23 ILE A 85 86.246 -11.193 -16.649 1.00 1.00 H new ATOM 0 HD11 ILE A 85 84.087 -14.538 -17.879 1.00 1.00 H new ATOM 0 HD12 ILE A 85 82.971 -13.527 -16.931 1.00 1.00 H new ATOM 0 HD13 ILE A 85 84.173 -12.764 -17.999 1.00 1.00 H new ATOM 1283 N ALA A 86 84.753 -10.919 -12.447 1.00 1.00 N ATOM 1284 CA ALA A 86 84.572 -9.710 -11.628 1.00 1.00 C ATOM 1285 C ALA A 86 85.345 -9.810 -10.308 1.00 1.00 C ATOM 1286 O ALA A 86 85.720 -8.804 -9.723 1.00 1.00 O ATOM 1287 CB ALA A 86 83.087 -9.498 -11.329 1.00 1.00 C ATOM 0 H ALA A 86 84.098 -11.673 -12.240 1.00 1.00 H new ATOM 0 HA ALA A 86 84.961 -8.863 -12.194 1.00 1.00 H new ATOM 0 HB1 ALA A 86 82.962 -8.601 -10.722 1.00 1.00 H new ATOM 0 HB2 ALA A 86 82.540 -9.382 -12.265 1.00 1.00 H new ATOM 0 HB3 ALA A 86 82.698 -10.360 -10.786 1.00 1.00 H new ATOM 1293 N GLU A 87 85.570 -11.025 -9.832 1.00 1.00 N ATOM 1294 CA GLU A 87 86.285 -11.231 -8.579 1.00 1.00 C ATOM 1295 C GLU A 87 87.634 -10.518 -8.622 1.00 1.00 C ATOM 1296 O GLU A 87 88.298 -10.351 -7.600 1.00 1.00 O ATOM 1297 CB GLU A 87 86.480 -12.736 -8.339 1.00 1.00 C ATOM 1298 CG GLU A 87 86.956 -12.991 -6.903 1.00 1.00 C ATOM 1299 CD GLU A 87 85.843 -12.667 -5.910 1.00 1.00 C ATOM 1300 OE1 GLU A 87 84.737 -12.399 -6.351 1.00 1.00 O ATOM 1301 OE2 GLU A 87 86.113 -12.693 -4.721 1.00 1.00 O ATOM 0 H GLU A 87 85.269 -11.884 -10.293 1.00 1.00 H new ATOM 0 HA GLU A 87 85.701 -10.815 -7.758 1.00 1.00 H new ATOM 0 HB2 GLU A 87 85.543 -13.264 -8.517 1.00 1.00 H new ATOM 0 HB3 GLU A 87 87.209 -13.132 -9.046 1.00 1.00 H new ATOM 0 HG2 GLU A 87 87.259 -14.032 -6.793 1.00 1.00 H new ATOM 0 HG3 GLU A 87 87.833 -12.379 -6.689 1.00 1.00 H new ATOM 1308 N ALA A 88 88.020 -10.061 -9.805 1.00 1.00 N ATOM 1309 CA ALA A 88 89.283 -9.332 -9.940 1.00 1.00 C ATOM 1310 C ALA A 88 89.093 -7.933 -9.366 1.00 1.00 C ATOM 1311 O ALA A 88 89.990 -7.089 -9.372 1.00 1.00 O ATOM 1312 CB ALA A 88 89.715 -9.246 -11.404 1.00 1.00 C ATOM 0 H ALA A 88 87.493 -10.176 -10.671 1.00 1.00 H new ATOM 0 HA ALA A 88 90.066 -9.861 -9.397 1.00 1.00 H new ATOM 0 HB1 ALA A 88 90.656 -8.700 -11.474 1.00 1.00 H new ATOM 0 HB2 ALA A 88 89.849 -10.251 -11.804 1.00 1.00 H new ATOM 0 HB3 ALA A 88 88.949 -8.726 -11.979 1.00 1.00 H new ATOM 1318 N VAL A 89 87.884 -7.747 -8.859 1.00 1.00 N ATOM 1319 CA VAL A 89 87.476 -6.496 -8.233 1.00 1.00 C ATOM 1320 C VAL A 89 87.206 -6.710 -6.749 1.00 1.00 C ATOM 1321 O VAL A 89 86.306 -6.107 -6.185 1.00 1.00 O ATOM 1322 CB VAL A 89 86.299 -5.826 -8.976 1.00 1.00 C ATOM 1323 CG1 VAL A 89 86.522 -5.967 -10.494 1.00 1.00 C ATOM 1324 CG2 VAL A 89 84.934 -6.434 -8.562 1.00 1.00 C ATOM 0 H VAL A 89 87.155 -8.461 -8.869 1.00 1.00 H new ATOM 0 HA VAL A 89 88.301 -5.788 -8.313 1.00 1.00 H new ATOM 0 HB VAL A 89 86.269 -4.771 -8.703 1.00 1.00 H new ATOM 0 HG11 VAL A 89 85.696 -5.497 -11.028 1.00 1.00 H new ATOM 0 HG12 VAL A 89 87.457 -5.480 -10.771 1.00 1.00 H new ATOM 0 HG13 VAL A 89 86.571 -7.023 -10.758 1.00 1.00 H new ATOM 0 HG21 VAL A 89 84.133 -5.935 -9.107 1.00 1.00 H new ATOM 0 HG22 VAL A 89 84.924 -7.499 -8.796 1.00 1.00 H new ATOM 0 HG23 VAL A 89 84.784 -6.297 -7.491 1.00 1.00 H new ATOM 1334 N GLY A 90 87.997 -7.579 -6.108 1.00 1.00 N ATOM 1335 CA GLY A 90 87.835 -7.839 -4.684 1.00 1.00 C ATOM 1336 C GLY A 90 88.442 -6.699 -3.856 1.00 1.00 C ATOM 1337 O GLY A 90 87.875 -6.305 -2.838 1.00 1.00 O ATOM 0 H GLY A 90 88.748 -8.107 -6.554 1.00 1.00 H new ATOM 0 HA2 GLY A 90 86.777 -7.945 -4.446 1.00 1.00 H new ATOM 0 HA3 GLY A 90 88.316 -8.782 -4.424 1.00 1.00 H new ATOM 1341 N PRO A 91 89.561 -6.137 -4.280 1.00 1.00 N ATOM 1342 CA PRO A 91 90.212 -4.996 -3.558 1.00 1.00 C ATOM 1343 C PRO A 91 89.200 -3.892 -3.280 1.00 1.00 C ATOM 1344 O PRO A 91 89.465 -2.931 -2.557 1.00 1.00 O ATOM 1345 CB PRO A 91 91.325 -4.559 -4.513 1.00 1.00 C ATOM 1346 CG PRO A 91 91.664 -5.801 -5.264 1.00 1.00 C ATOM 1347 CD PRO A 91 90.336 -6.520 -5.474 1.00 1.00 C ATOM 0 HA PRO A 91 90.607 -5.261 -2.577 1.00 1.00 H new ATOM 0 HB2 PRO A 91 90.989 -3.767 -5.182 1.00 1.00 H new ATOM 0 HB3 PRO A 91 92.188 -4.173 -3.970 1.00 1.00 H new ATOM 0 HG2 PRO A 91 92.139 -5.567 -6.217 1.00 1.00 H new ATOM 0 HG3 PRO A 91 92.363 -6.422 -4.703 1.00 1.00 H new ATOM 0 HD2 PRO A 91 89.845 -6.201 -6.394 1.00 1.00 H new ATOM 0 HD3 PRO A 91 90.468 -7.600 -5.541 1.00 1.00 H new ATOM 1355 N HIS A 92 88.026 -4.075 -3.858 1.00 1.00 N ATOM 1356 CA HIS A 92 86.931 -3.143 -3.687 1.00 1.00 C ATOM 1357 C HIS A 92 86.661 -3.008 -2.191 1.00 1.00 C ATOM 1358 O HIS A 92 85.954 -2.104 -1.760 1.00 1.00 O ATOM 1359 CB HIS A 92 85.673 -3.645 -4.424 1.00 1.00 C ATOM 1360 CG HIS A 92 84.924 -4.654 -3.585 1.00 1.00 C ATOM 1361 ND1 HIS A 92 85.567 -5.510 -2.702 1.00 1.00 N ATOM 1362 CD2 HIS A 92 83.586 -4.917 -3.455 1.00 1.00 C ATOM 1363 CE1 HIS A 92 84.617 -6.237 -2.081 1.00 1.00 C ATOM 1364 NE2 HIS A 92 83.393 -5.912 -2.503 1.00 1.00 N ATOM 0 H HIS A 92 87.808 -4.871 -4.457 1.00 1.00 H new ATOM 0 HA HIS A 92 87.192 -2.173 -4.110 1.00 1.00 H new ATOM 0 HB2 HIS A 92 85.021 -2.802 -4.655 1.00 1.00 H new ATOM 0 HB3 HIS A 92 85.959 -4.096 -5.374 1.00 1.00 H new ATOM 0 HD1 HIS A 92 86.574 -5.577 -2.551 1.00 1.00 H new ATOM 0 HD2 HIS A 92 82.799 -4.426 -4.008 1.00 1.00 H new ATOM 0 HE1 HIS A 92 84.821 -6.990 -1.334 1.00 1.00 H new ATOM 1372 N LEU A 93 87.263 -3.915 -1.413 1.00 1.00 N ATOM 1373 CA LEU A 93 87.118 -3.871 0.037 1.00 1.00 C ATOM 1374 C LEU A 93 87.838 -2.636 0.576 1.00 1.00 C ATOM 1375 O LEU A 93 87.211 -1.781 1.196 1.00 1.00 O ATOM 1376 CB LEU A 93 87.658 -5.154 0.708 1.00 1.00 C ATOM 1377 CG LEU A 93 89.132 -5.444 0.289 1.00 1.00 C ATOM 1378 CD1 LEU A 93 90.119 -5.021 1.405 1.00 1.00 C ATOM 1379 CD2 LEU A 93 89.309 -6.947 0.015 1.00 1.00 C ATOM 0 H LEU A 93 87.846 -4.676 -1.761 1.00 1.00 H new ATOM 0 HA LEU A 93 86.056 -3.811 0.276 1.00 1.00 H new ATOM 0 HB2 LEU A 93 87.601 -5.050 1.792 1.00 1.00 H new ATOM 0 HB3 LEU A 93 87.028 -6.001 0.435 1.00 1.00 H new ATOM 0 HG LEU A 93 89.346 -4.869 -0.612 1.00 1.00 H new ATOM 0 HD11 LEU A 93 91.140 -5.234 1.088 1.00 1.00 H new ATOM 0 HD12 LEU A 93 90.014 -3.953 1.598 1.00 1.00 H new ATOM 0 HD13 LEU A 93 89.899 -5.578 2.316 1.00 1.00 H new ATOM 0 HD21 LEU A 93 90.340 -7.145 -0.277 1.00 1.00 H new ATOM 0 HD22 LEU A 93 89.073 -7.512 0.917 1.00 1.00 H new ATOM 0 HD23 LEU A 93 88.639 -7.252 -0.789 1.00 1.00 H new ATOM 1391 N ALA A 94 89.152 -2.529 0.339 1.00 1.00 N ATOM 1392 CA ALA A 94 89.888 -1.370 0.825 1.00 1.00 C ATOM 1393 C ALA A 94 89.272 -0.105 0.251 1.00 1.00 C ATOM 1394 O ALA A 94 88.980 0.839 0.981 1.00 1.00 O ATOM 1395 CB ALA A 94 91.363 -1.445 0.428 1.00 1.00 C ATOM 0 H ALA A 94 89.709 -3.214 -0.172 1.00 1.00 H new ATOM 0 HA ALA A 94 89.828 -1.356 1.913 1.00 1.00 H new ATOM 0 HB1 ALA A 94 91.886 -0.566 0.805 1.00 1.00 H new ATOM 0 HB2 ALA A 94 91.809 -2.344 0.854 1.00 1.00 H new ATOM 0 HB3 ALA A 94 91.446 -1.479 -0.658 1.00 1.00 H new ATOM 1401 N ARG A 95 89.076 -0.094 -1.065 1.00 1.00 N ATOM 1402 CA ARG A 95 88.478 1.069 -1.697 1.00 1.00 C ATOM 1403 C ARG A 95 87.123 1.318 -1.023 1.00 1.00 C ATOM 1404 O ARG A 95 86.852 2.360 -0.425 1.00 1.00 O ATOM 1405 CB ARG A 95 88.298 0.834 -3.205 1.00 1.00 C ATOM 1406 CG ARG A 95 87.755 2.106 -3.878 1.00 1.00 C ATOM 1407 CD ARG A 95 88.797 3.239 -3.836 1.00 1.00 C ATOM 1408 NE ARG A 95 88.579 4.150 -4.959 1.00 1.00 N ATOM 1409 CZ ARG A 95 89.199 5.329 -5.040 1.00 1.00 C ATOM 1410 NH1 ARG A 95 90.011 5.713 -4.094 1.00 1.00 N ATOM 1411 NH2 ARG A 95 88.994 6.105 -6.072 1.00 1.00 N ATOM 0 H ARG A 95 89.317 -0.858 -1.697 1.00 1.00 H new ATOM 0 HA ARG A 95 89.125 1.938 -1.580 1.00 1.00 H new ATOM 0 HB2 ARG A 95 89.251 0.555 -3.654 1.00 1.00 H new ATOM 0 HB3 ARG A 95 87.612 0.004 -3.372 1.00 1.00 H new ATOM 0 HG2 ARG A 95 87.489 1.889 -4.913 1.00 1.00 H new ATOM 0 HG3 ARG A 95 86.843 2.427 -3.375 1.00 1.00 H new ATOM 0 HD2 ARG A 95 88.720 3.782 -2.894 1.00 1.00 H new ATOM 0 HD3 ARG A 95 89.803 2.823 -3.883 1.00 1.00 H new ATOM 0 HE ARG A 95 87.935 3.877 -5.701 1.00 1.00 H new ATOM 0 HH11 ARG A 95 90.175 5.111 -3.287 1.00 1.00 H new ATOM 0 HH12 ARG A 95 90.482 6.615 -4.161 1.00 1.00 H new ATOM 0 HH21 ARG A 95 88.360 5.809 -6.815 1.00 1.00 H new ATOM 0 HH22 ARG A 95 89.468 7.006 -6.134 1.00 1.00 H new ATOM 1425 N ALA A 96 86.241 0.358 -1.037 1.00 1.00 N ATOM 1426 CA ALA A 96 84.969 0.574 -0.396 1.00 1.00 C ATOM 1427 C ALA A 96 85.151 1.134 1.015 1.00 1.00 C ATOM 1428 O ALA A 96 84.155 1.285 1.695 1.00 1.00 O ATOM 1429 CB ALA A 96 84.117 -0.680 -0.417 1.00 1.00 C ATOM 0 H ALA A 96 86.369 -0.556 -1.470 1.00 1.00 H new ATOM 0 HA ALA A 96 84.427 1.327 -0.968 1.00 1.00 H new ATOM 0 HB1 ALA A 96 83.165 -0.481 0.075 1.00 1.00 H new ATOM 0 HB2 ALA A 96 83.937 -0.980 -1.449 1.00 1.00 H new ATOM 0 HB3 ALA A 96 84.636 -1.482 0.108 1.00 1.00 H new ATOM 1435 N LEU A 97 86.419 1.159 1.541 1.00 1.00 N ATOM 1436 CA LEU A 97 86.722 1.403 2.988 1.00 1.00 C ATOM 1437 C LEU A 97 85.441 1.407 3.763 1.00 1.00 C ATOM 1438 O LEU A 97 85.369 0.674 4.720 1.00 1.00 O ATOM 1439 CB LEU A 97 87.460 2.780 3.067 1.00 1.00 C ATOM 1440 CG LEU A 97 87.171 3.633 4.340 1.00 1.00 C ATOM 1441 CD1 LEU A 97 85.760 4.254 4.309 1.00 1.00 C ATOM 1442 CD2 LEU A 97 87.375 2.825 5.633 1.00 1.00 C ATOM 0 H LEU A 97 87.254 1.011 0.974 1.00 1.00 H new ATOM 0 HA LEU A 97 87.354 0.626 3.417 1.00 1.00 H new ATOM 0 HB2 LEU A 97 88.533 2.599 3.010 1.00 1.00 H new ATOM 0 HB3 LEU A 97 87.188 3.367 2.190 1.00 1.00 H new ATOM 0 HG LEU A 97 87.897 4.446 4.335 1.00 1.00 H new ATOM 0 HD11 LEU A 97 85.600 4.840 5.214 1.00 1.00 H new ATOM 0 HD12 LEU A 97 85.666 4.901 3.437 1.00 1.00 H new ATOM 0 HD13 LEU A 97 85.014 3.461 4.254 1.00 1.00 H new ATOM 0 HD21 LEU A 97 87.163 3.458 6.495 1.00 1.00 H new ATOM 0 HD22 LEU A 97 86.701 1.969 5.637 1.00 1.00 H new ATOM 0 HD23 LEU A 97 88.406 2.475 5.685 1.00 1.00 H new ATOM 1454 N GLY A 98 84.402 2.073 3.396 1.00 1.00 N ATOM 1455 CA GLY A 98 83.179 1.865 4.118 1.00 1.00 C ATOM 1456 C GLY A 98 82.975 0.332 4.236 1.00 1.00 C ATOM 1457 O GLY A 98 82.348 -0.128 5.193 1.00 1.00 O ATOM 0 H GLY A 98 84.363 2.745 2.630 1.00 1.00 H new ATOM 0 HA2 GLY A 98 83.232 2.324 5.105 1.00 1.00 H new ATOM 0 HA3 GLY A 98 82.340 2.326 3.596 1.00 1.00 H new ATOM 1461 N GLN A 99 83.583 -0.485 3.296 1.00 1.00 N ATOM 1462 CA GLN A 99 83.463 -1.958 3.473 1.00 1.00 C ATOM 1463 C GLN A 99 84.296 -2.349 4.683 1.00 1.00 C ATOM 1464 O GLN A 99 84.018 -3.350 5.344 1.00 1.00 O ATOM 1465 CB GLN A 99 83.971 -2.801 2.278 1.00 1.00 C ATOM 1466 CG GLN A 99 82.842 -3.066 1.257 1.00 1.00 C ATOM 1467 CD GLN A 99 81.991 -4.260 1.693 1.00 1.00 C ATOM 1468 OE1 GLN A 99 81.151 -4.129 2.582 1.00 1.00 O ATOM 1469 NE2 GLN A 99 82.149 -5.423 1.111 1.00 1.00 N ATOM 0 H GLN A 99 84.112 -0.170 2.483 1.00 1.00 H new ATOM 0 HA GLN A 99 82.398 -2.167 3.579 1.00 1.00 H new ATOM 0 HB2 GLN A 99 84.793 -2.281 1.787 1.00 1.00 H new ATOM 0 HB3 GLN A 99 84.366 -3.750 2.641 1.00 1.00 H new ATOM 0 HG2 GLN A 99 82.214 -2.180 1.163 1.00 1.00 H new ATOM 0 HG3 GLN A 99 83.271 -3.258 0.274 1.00 1.00 H new ATOM 0 HE21 GLN A 99 82.845 -5.534 0.374 1.00 1.00 H new ATOM 0 HE22 GLN A 99 81.576 -6.218 1.395 1.00 1.00 H new ATOM 1478 N ILE A 100 85.290 -1.522 4.996 1.00 1.00 N ATOM 1479 CA ILE A 100 86.115 -1.785 6.191 1.00 1.00 C ATOM 1480 C ILE A 100 85.246 -1.648 7.438 1.00 1.00 C ATOM 1481 O ILE A 100 85.297 -2.505 8.308 1.00 1.00 O ATOM 1482 CB ILE A 100 87.369 -0.863 6.291 1.00 1.00 C ATOM 1483 CG1 ILE A 100 88.531 -1.447 5.468 1.00 1.00 C ATOM 1484 CG2 ILE A 100 87.803 -0.702 7.754 1.00 1.00 C ATOM 1485 CD1 ILE A 100 89.713 -0.460 5.405 1.00 1.00 C ATOM 0 H ILE A 100 85.545 -0.689 4.465 1.00 1.00 H new ATOM 0 HA ILE A 100 86.499 -2.802 6.106 1.00 1.00 H new ATOM 0 HB ILE A 100 87.105 0.116 5.890 1.00 1.00 H new ATOM 0 HG12 ILE A 100 88.860 -2.386 5.912 1.00 1.00 H new ATOM 0 HG13 ILE A 100 88.188 -1.675 4.459 1.00 1.00 H new ATOM 0 HG21 ILE A 100 88.679 -0.056 7.805 1.00 1.00 H new ATOM 0 HG22 ILE A 100 86.990 -0.257 8.328 1.00 1.00 H new ATOM 0 HG23 ILE A 100 88.048 -1.679 8.170 1.00 1.00 H new ATOM 0 HD11 ILE A 100 90.521 -0.897 4.818 1.00 1.00 H new ATOM 0 HD12 ILE A 100 89.387 0.469 4.938 1.00 1.00 H new ATOM 0 HD13 ILE A 100 90.069 -0.254 6.414 1.00 1.00 H new ATOM 1497 N VAL A 101 84.428 -0.589 7.527 1.00 1.00 N ATOM 1498 CA VAL A 101 83.565 -0.445 8.693 1.00 1.00 C ATOM 1499 C VAL A 101 82.739 -1.706 8.824 1.00 1.00 C ATOM 1500 O VAL A 101 82.809 -2.396 9.820 1.00 1.00 O ATOM 1501 CB VAL A 101 82.634 0.767 8.544 1.00 1.00 C ATOM 1502 CG1 VAL A 101 81.888 1.001 9.861 1.00 1.00 C ATOM 1503 CG2 VAL A 101 83.457 2.012 8.213 1.00 1.00 C ATOM 0 H VAL A 101 84.350 0.152 6.830 1.00 1.00 H new ATOM 0 HA VAL A 101 84.178 -0.289 9.580 1.00 1.00 H new ATOM 0 HB VAL A 101 81.922 0.574 7.742 1.00 1.00 H new ATOM 0 HG11 VAL A 101 81.227 1.861 9.757 1.00 1.00 H new ATOM 0 HG12 VAL A 101 81.299 0.118 10.107 1.00 1.00 H new ATOM 0 HG13 VAL A 101 82.607 1.191 10.658 1.00 1.00 H new ATOM 0 HG21 VAL A 101 82.793 2.870 8.108 1.00 1.00 H new ATOM 0 HG22 VAL A 101 84.170 2.201 9.016 1.00 1.00 H new ATOM 0 HG23 VAL A 101 83.996 1.854 7.279 1.00 1.00 H new ATOM 1513 N CYS A 102 81.946 -1.992 7.813 1.00 1.00 N ATOM 1514 CA CYS A 102 81.092 -3.165 7.830 1.00 1.00 C ATOM 1515 C CYS A 102 81.847 -4.442 8.207 1.00 1.00 C ATOM 1516 O CYS A 102 81.242 -5.367 8.684 1.00 1.00 O ATOM 1517 CB CYS A 102 80.465 -3.336 6.430 1.00 1.00 C ATOM 1518 SG CYS A 102 78.748 -3.907 6.565 1.00 1.00 S ATOM 0 H CYS A 102 81.874 -1.428 6.966 1.00 1.00 H new ATOM 0 HA CYS A 102 80.327 -3.010 8.591 1.00 1.00 H new ATOM 0 HB2 CYS A 102 80.498 -2.388 5.893 1.00 1.00 H new ATOM 0 HB3 CYS A 102 81.047 -4.052 5.850 1.00 1.00 H new ATOM 0 HG CYS A 102 78.241 -4.042 5.376 1.00 1.00 H new ATOM 1523 N ARG A 103 83.160 -4.434 8.022 1.00 1.00 N ATOM 1524 CA ARG A 103 84.021 -5.597 8.355 1.00 1.00 C ATOM 1525 C ARG A 103 84.519 -5.552 9.800 1.00 1.00 C ATOM 1526 O ARG A 103 84.425 -6.502 10.575 1.00 1.00 O ATOM 1527 CB ARG A 103 85.198 -5.612 7.372 1.00 1.00 C ATOM 1528 CG ARG A 103 86.245 -6.662 7.764 1.00 1.00 C ATOM 1529 CD ARG A 103 87.316 -6.724 6.669 1.00 1.00 C ATOM 1530 NE ARG A 103 88.511 -7.403 7.159 1.00 1.00 N ATOM 1531 CZ ARG A 103 89.494 -6.724 7.748 1.00 1.00 C ATOM 1532 NH1 ARG A 103 89.380 -5.435 7.929 1.00 1.00 N ATOM 1533 NH2 ARG A 103 90.565 -7.347 8.153 1.00 1.00 N ATOM 0 H ARG A 103 83.670 -3.637 7.641 1.00 1.00 H new ATOM 0 HA ARG A 103 83.436 -6.512 8.264 1.00 1.00 H new ATOM 0 HB2 ARG A 103 84.831 -5.820 6.367 1.00 1.00 H new ATOM 0 HB3 ARG A 103 85.663 -4.626 7.344 1.00 1.00 H new ATOM 0 HG2 ARG A 103 86.698 -6.404 8.721 1.00 1.00 H new ATOM 0 HG3 ARG A 103 85.774 -7.637 7.887 1.00 1.00 H new ATOM 0 HD2 ARG A 103 86.924 -7.249 5.798 1.00 1.00 H new ATOM 0 HD3 ARG A 103 87.571 -5.715 6.345 1.00 1.00 H new ATOM 0 HE ARG A 103 88.595 -8.414 7.049 1.00 1.00 H new ATOM 0 HH11 ARG A 103 88.538 -4.949 7.619 1.00 1.00 H new ATOM 0 HH12 ARG A 103 90.133 -4.915 8.380 1.00 1.00 H new ATOM 0 HH21 ARG A 103 90.650 -8.355 8.019 1.00 1.00 H new ATOM 0 HH22 ARG A 103 91.318 -6.827 8.604 1.00 1.00 H new ATOM 1547 N TYR A 104 85.002 -4.387 10.104 1.00 1.00 N ATOM 1548 CA TYR A 104 85.521 -3.974 11.396 1.00 1.00 C ATOM 1549 C TYR A 104 84.404 -3.202 12.106 1.00 1.00 C ATOM 1550 O TYR A 104 84.658 -2.389 12.990 1.00 1.00 O ATOM 1551 CB TYR A 104 86.856 -3.187 11.235 1.00 1.00 C ATOM 1552 CG TYR A 104 86.800 -1.814 11.872 1.00 1.00 C ATOM 1553 CD1 TYR A 104 87.099 -1.635 13.229 1.00 1.00 C ATOM 1554 CD2 TYR A 104 86.432 -0.727 11.094 1.00 1.00 C ATOM 1555 CE1 TYR A 104 87.023 -0.355 13.795 1.00 1.00 C ATOM 1556 CE2 TYR A 104 86.357 0.551 11.651 1.00 1.00 C ATOM 1557 CZ TYR A 104 86.650 0.739 13.003 1.00 1.00 C ATOM 1558 OH TYR A 104 86.570 1.998 13.555 1.00 1.00 O ATOM 0 H TYR A 104 85.053 -3.637 9.414 1.00 1.00 H new ATOM 0 HA TYR A 104 85.791 -4.827 12.019 1.00 1.00 H new ATOM 0 HB2 TYR A 104 87.668 -3.759 11.684 1.00 1.00 H new ATOM 0 HB3 TYR A 104 87.087 -3.083 10.175 1.00 1.00 H new ATOM 0 HD1 TYR A 104 87.387 -2.480 13.837 1.00 1.00 H new ATOM 0 HD2 TYR A 104 86.201 -0.870 10.049 1.00 1.00 H new ATOM 0 HE1 TYR A 104 87.252 -0.212 14.841 1.00 1.00 H new ATOM 0 HE2 TYR A 104 86.073 1.393 11.037 1.00 1.00 H new ATOM 0 HH TYR A 104 86.299 2.640 12.866 1.00 1.00 H new ATOM 1568 N GLY A 105 83.142 -3.472 11.756 1.00 1.00 N ATOM 1569 CA GLY A 105 82.044 -2.791 12.395 1.00 1.00 C ATOM 1570 C GLY A 105 80.749 -3.504 12.032 1.00 1.00 C ATOM 1571 O GLY A 105 80.410 -4.527 12.627 1.00 1.00 O ATOM 0 H GLY A 105 82.872 -4.149 11.043 1.00 1.00 H new ATOM 0 HA2 GLY A 105 82.181 -2.785 13.476 1.00 1.00 H new ATOM 0 HA3 GLY A 105 82.006 -1.751 12.072 1.00 1.00 H new ATOM 1575 N ALA A 106 80.013 -2.950 11.075 1.00 1.00 N ATOM 1576 CA ALA A 106 78.752 -3.520 10.668 1.00 1.00 C ATOM 1577 C ALA A 106 77.670 -3.274 11.717 1.00 1.00 C ATOM 1578 O ALA A 106 77.057 -4.229 12.181 1.00 1.00 O ATOM 1579 CB ALA A 106 78.926 -5.038 10.442 1.00 1.00 C ATOM 0 H ALA A 106 80.277 -2.104 10.570 1.00 1.00 H new ATOM 0 HA ALA A 106 78.439 -3.040 9.741 1.00 1.00 H new ATOM 0 HB1 ALA A 106 77.974 -5.471 10.134 1.00 1.00 H new ATOM 0 HB2 ALA A 106 79.670 -5.207 9.664 1.00 1.00 H new ATOM 0 HB3 ALA A 106 79.256 -5.508 11.368 1.00 1.00 H new ATOM 1585 N THR A 107 77.334 -2.027 12.080 1.00 1.00 N ATOM 1586 CA THR A 107 76.242 -1.870 13.022 1.00 1.00 C ATOM 1587 C THR A 107 74.969 -2.005 12.222 1.00 1.00 C ATOM 1588 O THR A 107 73.872 -1.848 12.755 1.00 1.00 O ATOM 1589 CB THR A 107 76.262 -0.497 13.754 1.00 1.00 C ATOM 1590 OG1 THR A 107 74.981 0.117 13.666 1.00 1.00 O ATOM 1591 CG2 THR A 107 77.304 0.436 13.141 1.00 1.00 C ATOM 0 H THR A 107 77.777 -1.168 11.754 1.00 1.00 H new ATOM 0 HA THR A 107 76.328 -2.625 13.804 1.00 1.00 H new ATOM 0 HB THR A 107 76.520 -0.676 14.798 1.00 1.00 H new ATOM 0 HG1 THR A 107 74.290 -0.531 13.917 1.00 1.00 H new ATOM 0 HG21 THR A 107 77.297 1.388 13.671 1.00 1.00 H new ATOM 0 HG22 THR A 107 78.292 -0.018 13.223 1.00 1.00 H new ATOM 0 HG23 THR A 107 77.068 0.604 12.090 1.00 1.00 H new ATOM 1599 N VAL A 108 75.116 -2.337 10.925 1.00 1.00 N ATOM 1600 CA VAL A 108 73.948 -2.531 10.079 1.00 1.00 C ATOM 1601 C VAL A 108 73.399 -3.950 10.237 1.00 1.00 C ATOM 1602 O VAL A 108 72.202 -4.107 10.463 1.00 1.00 O ATOM 1603 CB VAL A 108 74.225 -2.221 8.597 1.00 1.00 C ATOM 1604 CG1 VAL A 108 74.459 -0.718 8.423 1.00 1.00 C ATOM 1605 CG2 VAL A 108 75.450 -2.993 8.082 1.00 1.00 C ATOM 0 H VAL A 108 76.013 -2.471 10.459 1.00 1.00 H new ATOM 0 HA VAL A 108 73.196 -1.816 10.414 1.00 1.00 H new ATOM 0 HB VAL A 108 73.357 -2.534 8.017 1.00 1.00 H new ATOM 0 HG11 VAL A 108 74.655 -0.499 7.373 1.00 1.00 H new ATOM 0 HG12 VAL A 108 73.573 -0.172 8.748 1.00 1.00 H new ATOM 0 HG13 VAL A 108 75.315 -0.411 9.024 1.00 1.00 H new ATOM 0 HG21 VAL A 108 75.618 -2.751 7.032 1.00 1.00 H new ATOM 0 HG22 VAL A 108 76.328 -2.712 8.664 1.00 1.00 H new ATOM 0 HG23 VAL A 108 75.274 -4.064 8.184 1.00 1.00 H new ATOM 1615 N ILE A 109 74.225 -5.004 10.063 1.00 1.00 N ATOM 1616 CA ILE A 109 73.723 -6.386 10.139 1.00 1.00 C ATOM 1617 C ILE A 109 72.860 -6.703 11.365 1.00 1.00 C ATOM 1618 O ILE A 109 71.927 -7.476 11.234 1.00 1.00 O ATOM 1619 CB ILE A 109 74.905 -7.426 10.010 1.00 1.00 C ATOM 1620 CG1 ILE A 109 75.141 -8.241 11.315 1.00 1.00 C ATOM 1621 CG2 ILE A 109 76.176 -6.672 9.665 1.00 1.00 C ATOM 1622 CD1 ILE A 109 76.413 -9.085 11.207 1.00 1.00 C ATOM 0 H ILE A 109 75.224 -4.924 9.873 1.00 1.00 H new ATOM 0 HA ILE A 109 73.050 -6.480 9.286 1.00 1.00 H new ATOM 0 HB ILE A 109 74.634 -8.137 9.230 1.00 1.00 H new ATOM 0 HG12 ILE A 109 75.221 -7.562 12.164 1.00 1.00 H new ATOM 0 HG13 ILE A 109 74.285 -8.888 11.505 1.00 1.00 H new ATOM 0 HG21 ILE A 109 77.003 -7.376 9.572 1.00 1.00 H new ATOM 0 HG22 ILE A 109 76.041 -6.144 8.721 1.00 1.00 H new ATOM 0 HG23 ILE A 109 76.398 -5.953 10.454 1.00 1.00 H new ATOM 0 HD11 ILE A 109 76.557 -9.646 12.131 1.00 1.00 H new ATOM 0 HD12 ILE A 109 76.319 -9.779 10.372 1.00 1.00 H new ATOM 0 HD13 ILE A 109 77.270 -8.432 11.041 1.00 1.00 H new ATOM 1634 N PRO A 110 73.116 -6.207 12.551 1.00 1.00 N ATOM 1635 CA PRO A 110 72.284 -6.618 13.716 1.00 1.00 C ATOM 1636 C PRO A 110 70.779 -6.468 13.464 1.00 1.00 C ATOM 1637 O PRO A 110 70.029 -7.404 13.741 1.00 1.00 O ATOM 1638 CB PRO A 110 72.793 -5.738 14.864 1.00 1.00 C ATOM 1639 CG PRO A 110 74.193 -5.403 14.475 1.00 1.00 C ATOM 1640 CD PRO A 110 74.147 -5.227 12.958 1.00 1.00 C ATOM 0 HA PRO A 110 72.386 -7.680 13.938 1.00 1.00 H new ATOM 0 HB2 PRO A 110 72.185 -4.840 14.977 1.00 1.00 H new ATOM 0 HB3 PRO A 110 72.760 -6.267 15.816 1.00 1.00 H new ATOM 0 HG2 PRO A 110 74.533 -4.493 14.968 1.00 1.00 H new ATOM 0 HG3 PRO A 110 74.883 -6.197 14.760 1.00 1.00 H new ATOM 0 HD2 PRO A 110 73.874 -4.210 12.676 1.00 1.00 H new ATOM 0 HD3 PRO A 110 75.111 -5.438 12.496 1.00 1.00 H new ATOM 1648 N ASN A 111 70.302 -5.319 12.970 1.00 1.00 N ATOM 1649 CA ASN A 111 68.863 -5.186 12.761 1.00 1.00 C ATOM 1650 C ASN A 111 68.398 -6.057 11.592 1.00 1.00 C ATOM 1651 O ASN A 111 67.690 -7.042 11.811 1.00 1.00 O ATOM 1652 CB ASN A 111 68.525 -3.716 12.502 1.00 1.00 C ATOM 1653 CG ASN A 111 68.858 -2.895 13.746 1.00 1.00 C ATOM 1654 OD1 ASN A 111 68.872 -3.431 14.855 1.00 1.00 O ATOM 1655 ND2 ASN A 111 69.138 -1.626 13.630 1.00 1.00 N ATOM 0 H ASN A 111 70.863 -4.505 12.719 1.00 1.00 H new ATOM 0 HA ASN A 111 68.341 -5.526 13.656 1.00 1.00 H new ATOM 0 HB2 ASN A 111 69.090 -3.346 11.646 1.00 1.00 H new ATOM 0 HB3 ASN A 111 67.468 -3.612 12.255 1.00 1.00 H new ATOM 0 HD21 ASN A 111 69.369 -1.077 14.458 1.00 1.00 H new ATOM 0 HD22 ASN A 111 69.126 -1.183 12.711 1.00 1.00 H new ATOM 1662 N ILE A 112 68.774 -5.723 10.350 1.00 1.00 N ATOM 1663 CA ILE A 112 68.338 -6.528 9.202 1.00 1.00 C ATOM 1664 C ILE A 112 68.534 -8.011 9.508 1.00 1.00 C ATOM 1665 O ILE A 112 67.842 -8.878 8.981 1.00 1.00 O ATOM 1666 CB ILE A 112 69.179 -6.145 7.963 1.00 1.00 C ATOM 1667 CG1 ILE A 112 70.619 -6.639 8.166 1.00 1.00 C ATOM 1668 CG2 ILE A 112 69.190 -4.620 7.791 1.00 1.00 C ATOM 1669 CD1 ILE A 112 71.568 -6.042 7.109 1.00 1.00 C ATOM 0 H ILE A 112 69.363 -4.923 10.118 1.00 1.00 H new ATOM 0 HA ILE A 112 67.283 -6.337 9.005 1.00 1.00 H new ATOM 0 HB ILE A 112 68.746 -6.604 7.074 1.00 1.00 H new ATOM 0 HG12 ILE A 112 70.963 -6.365 9.163 1.00 1.00 H new ATOM 0 HG13 ILE A 112 70.644 -7.727 8.108 1.00 1.00 H new ATOM 0 HG21 ILE A 112 69.784 -4.357 6.916 1.00 1.00 H new ATOM 0 HG22 ILE A 112 68.169 -4.262 7.657 1.00 1.00 H new ATOM 0 HG23 ILE A 112 69.624 -4.157 8.677 1.00 1.00 H new ATOM 0 HD11 ILE A 112 72.580 -6.410 7.279 1.00 1.00 H new ATOM 0 HD12 ILE A 112 71.236 -6.338 6.114 1.00 1.00 H new ATOM 0 HD13 ILE A 112 71.560 -4.955 7.186 1.00 1.00 H new ATOM 1681 N ASN A 113 69.514 -8.266 10.354 1.00 1.00 N ATOM 1682 CA ASN A 113 69.804 -9.656 10.700 1.00 1.00 C ATOM 1683 C ASN A 113 68.582 -10.229 11.368 1.00 1.00 C ATOM 1684 O ASN A 113 68.081 -11.258 10.931 1.00 1.00 O ATOM 1685 CB ASN A 113 71.036 -9.899 11.583 1.00 1.00 C ATOM 1686 CG ASN A 113 71.120 -11.402 11.886 1.00 1.00 C ATOM 1687 OD1 ASN A 113 70.495 -12.201 11.188 1.00 1.00 O ATOM 1688 ND2 ASN A 113 71.858 -11.844 12.868 1.00 1.00 N ATOM 0 H ASN A 113 70.105 -7.566 10.802 1.00 1.00 H new ATOM 0 HA ASN A 113 70.053 -10.151 9.761 1.00 1.00 H new ATOM 0 HB2 ASN A 113 71.940 -9.562 11.075 1.00 1.00 H new ATOM 0 HB3 ASN A 113 70.959 -9.328 12.508 1.00 1.00 H new ATOM 0 HD21 ASN A 113 71.914 -12.846 13.053 1.00 1.00 H new ATOM 0 HD22 ASN A 113 72.378 -11.188 13.450 1.00 1.00 H new ATOM 1695 N ALA A 114 68.080 -9.606 12.437 1.00 1.00 N ATOM 1696 CA ALA A 114 66.925 -10.145 13.106 1.00 1.00 C ATOM 1697 C ALA A 114 65.706 -10.190 12.207 1.00 1.00 C ATOM 1698 O ALA A 114 64.932 -11.141 12.311 1.00 1.00 O ATOM 1699 CB ALA A 114 66.610 -9.318 14.357 1.00 1.00 C ATOM 0 H ALA A 114 68.455 -8.747 12.840 1.00 1.00 H new ATOM 0 HA ALA A 114 67.166 -11.170 13.386 1.00 1.00 H new ATOM 0 HB1 ALA A 114 65.735 -9.733 14.857 1.00 1.00 H new ATOM 0 HB2 ALA A 114 67.462 -9.346 15.036 1.00 1.00 H new ATOM 0 HB3 ALA A 114 66.408 -8.286 14.070 1.00 1.00 H new ATOM 1705 N ALA A 115 65.482 -9.207 11.311 1.00 1.00 N ATOM 1706 CA ALA A 115 64.309 -9.295 10.465 1.00 1.00 C ATOM 1707 C ALA A 115 64.528 -10.326 9.376 1.00 1.00 C ATOM 1708 O ALA A 115 63.756 -11.270 9.264 1.00 1.00 O ATOM 1709 CB ALA A 115 64.021 -7.946 9.819 1.00 1.00 C ATOM 0 H ALA A 115 66.073 -8.388 11.169 1.00 1.00 H new ATOM 0 HA ALA A 115 63.462 -9.590 11.084 1.00 1.00 H new ATOM 0 HB1 ALA A 115 63.137 -8.027 9.186 1.00 1.00 H new ATOM 0 HB2 ALA A 115 63.845 -7.201 10.595 1.00 1.00 H new ATOM 0 HB3 ALA A 115 64.875 -7.643 9.213 1.00 1.00 H new ATOM 1715 N ILE A 116 65.561 -10.145 8.540 1.00 1.00 N ATOM 1716 CA ILE A 116 65.805 -11.084 7.440 1.00 1.00 C ATOM 1717 C ILE A 116 65.777 -12.493 7.976 1.00 1.00 C ATOM 1718 O ILE A 116 65.114 -13.373 7.437 1.00 1.00 O ATOM 1719 CB ILE A 116 67.187 -10.808 6.832 1.00 1.00 C ATOM 1720 CG1 ILE A 116 67.210 -9.405 6.171 1.00 1.00 C ATOM 1721 CG2 ILE A 116 67.530 -11.893 5.798 1.00 1.00 C ATOM 1722 CD1 ILE A 116 66.670 -9.446 4.733 1.00 1.00 C ATOM 0 H ILE A 116 66.226 -9.374 8.603 1.00 1.00 H new ATOM 0 HA ILE A 116 65.036 -10.961 6.677 1.00 1.00 H new ATOM 0 HB ILE A 116 67.935 -10.829 7.625 1.00 1.00 H new ATOM 0 HG12 ILE A 116 66.613 -8.713 6.765 1.00 1.00 H new ATOM 0 HG13 ILE A 116 68.230 -9.022 6.166 1.00 1.00 H new ATOM 0 HG21 ILE A 116 68.512 -11.691 5.371 1.00 1.00 H new ATOM 0 HG22 ILE A 116 67.540 -12.869 6.284 1.00 1.00 H new ATOM 0 HG23 ILE A 116 66.782 -11.890 5.005 1.00 1.00 H new ATOM 0 HD11 ILE A 116 66.702 -8.445 4.304 1.00 1.00 H new ATOM 0 HD12 ILE A 116 67.284 -10.118 4.133 1.00 1.00 H new ATOM 0 HD13 ILE A 116 65.641 -9.805 4.741 1.00 1.00 H new ATOM 1734 N GLU A 117 66.518 -12.665 9.057 1.00 1.00 N ATOM 1735 CA GLU A 117 66.580 -13.977 9.704 1.00 1.00 C ATOM 1736 C GLU A 117 65.170 -14.539 9.659 1.00 1.00 C ATOM 1737 O GLU A 117 64.911 -15.555 9.045 1.00 1.00 O ATOM 1738 CB GLU A 117 67.049 -13.934 11.155 1.00 1.00 C ATOM 1739 CG GLU A 117 67.043 -15.373 11.691 1.00 1.00 C ATOM 1740 CD GLU A 117 67.794 -15.469 13.011 1.00 1.00 C ATOM 1741 OE1 GLU A 117 67.585 -14.615 13.853 1.00 1.00 O ATOM 1742 OE2 GLU A 117 68.565 -16.406 13.164 1.00 1.00 O ATOM 0 H GLU A 117 67.075 -11.936 9.502 1.00 1.00 H new ATOM 0 HA GLU A 117 67.311 -14.588 9.175 1.00 1.00 H new ATOM 0 HB2 GLU A 117 68.049 -13.506 11.221 1.00 1.00 H new ATOM 0 HB3 GLU A 117 66.391 -13.301 11.751 1.00 1.00 H new ATOM 0 HG2 GLU A 117 66.015 -15.709 11.829 1.00 1.00 H new ATOM 0 HG3 GLU A 117 67.501 -16.039 10.959 1.00 1.00 H new ATOM 1749 N VAL A 118 64.265 -13.820 10.288 1.00 1.00 N ATOM 1750 CA VAL A 118 62.859 -14.238 10.292 1.00 1.00 C ATOM 1751 C VAL A 118 62.334 -14.324 8.842 1.00 1.00 C ATOM 1752 O VAL A 118 61.777 -15.347 8.439 1.00 1.00 O ATOM 1753 CB VAL A 118 62.017 -13.238 11.111 1.00 1.00 C ATOM 1754 CG1 VAL A 118 60.532 -13.606 11.035 1.00 1.00 C ATOM 1755 CG2 VAL A 118 62.462 -13.275 12.578 1.00 1.00 C ATOM 0 H VAL A 118 64.461 -12.958 10.797 1.00 1.00 H new ATOM 0 HA VAL A 118 62.777 -15.222 10.753 1.00 1.00 H new ATOM 0 HB VAL A 118 62.163 -12.239 10.699 1.00 1.00 H new ATOM 0 HG11 VAL A 118 59.950 -12.892 11.617 1.00 1.00 H new ATOM 0 HG12 VAL A 118 60.203 -13.580 9.996 1.00 1.00 H new ATOM 0 HG13 VAL A 118 60.384 -14.608 11.437 1.00 1.00 H new ATOM 0 HG21 VAL A 118 61.867 -12.568 13.157 1.00 1.00 H new ATOM 0 HG22 VAL A 118 62.320 -14.280 12.976 1.00 1.00 H new ATOM 0 HG23 VAL A 118 63.515 -13.003 12.646 1.00 1.00 H new ATOM 1765 N LEU A 119 62.486 -13.234 8.086 1.00 1.00 N ATOM 1766 CA LEU A 119 61.982 -13.220 6.705 1.00 1.00 C ATOM 1767 C LEU A 119 62.562 -14.456 5.968 1.00 1.00 C ATOM 1768 O LEU A 119 61.835 -15.406 5.683 1.00 1.00 O ATOM 1769 CB LEU A 119 62.447 -11.908 6.042 1.00 1.00 C ATOM 1770 CG LEU A 119 61.411 -11.344 5.040 1.00 1.00 C ATOM 1771 CD1 LEU A 119 60.946 -12.435 4.067 1.00 1.00 C ATOM 1772 CD2 LEU A 119 60.193 -10.742 5.777 1.00 1.00 C ATOM 0 H LEU A 119 62.939 -12.373 8.391 1.00 1.00 H new ATOM 0 HA LEU A 119 60.894 -13.268 6.668 1.00 1.00 H new ATOM 0 HB2 LEU A 119 62.641 -11.164 6.815 1.00 1.00 H new ATOM 0 HB3 LEU A 119 63.390 -12.082 5.524 1.00 1.00 H new ATOM 0 HG LEU A 119 61.899 -10.551 4.474 1.00 1.00 H new ATOM 0 HD11 LEU A 119 60.218 -12.016 3.372 1.00 1.00 H new ATOM 0 HD12 LEU A 119 61.803 -12.815 3.510 1.00 1.00 H new ATOM 0 HD13 LEU A 119 60.486 -13.250 4.627 1.00 1.00 H new ATOM 0 HD21 LEU A 119 59.482 -10.354 5.048 1.00 1.00 H new ATOM 0 HD22 LEU A 119 59.712 -11.515 6.377 1.00 1.00 H new ATOM 0 HD23 LEU A 119 60.525 -9.932 6.427 1.00 1.00 H new ATOM 1784 N GLY A 120 63.867 -14.436 5.673 1.00 1.00 N ATOM 1785 CA GLY A 120 64.471 -15.583 4.981 1.00 1.00 C ATOM 1786 C GLY A 120 64.460 -16.828 5.884 1.00 1.00 C ATOM 1787 O GLY A 120 63.666 -17.751 5.717 1.00 1.00 O ATOM 0 H GLY A 120 64.505 -13.671 5.892 1.00 1.00 H new ATOM 0 HA2 GLY A 120 63.923 -15.789 4.062 1.00 1.00 H new ATOM 0 HA3 GLY A 120 65.495 -15.344 4.695 1.00 1.00 H new ATOM 1791 N THR A 121 65.406 -16.768 6.803 1.00 1.00 N ATOM 1792 CA THR A 121 65.671 -17.835 7.803 1.00 1.00 C ATOM 1793 C THR A 121 67.158 -17.939 8.109 1.00 1.00 C ATOM 1794 O THR A 121 67.550 -18.377 9.191 1.00 1.00 O ATOM 1795 CB THR A 121 65.133 -19.193 7.264 1.00 1.00 C ATOM 1796 OG1 THR A 121 63.725 -19.250 7.468 1.00 1.00 O ATOM 1797 CG2 THR A 121 65.779 -20.391 7.969 1.00 1.00 C ATOM 0 H THR A 121 66.034 -15.969 6.893 1.00 1.00 H new ATOM 0 HA THR A 121 65.157 -17.583 8.730 1.00 1.00 H new ATOM 0 HB THR A 121 65.381 -19.250 6.204 1.00 1.00 H new ATOM 0 HG1 THR A 121 63.270 -18.779 6.739 1.00 1.00 H new ATOM 0 HG21 THR A 121 65.373 -21.316 7.560 1.00 1.00 H new ATOM 0 HG22 THR A 121 66.857 -20.367 7.812 1.00 1.00 H new ATOM 0 HG23 THR A 121 65.567 -20.342 9.037 1.00 1.00 H new ATOM 1805 N GLY A 122 67.978 -17.593 7.129 1.00 1.00 N ATOM 1806 CA GLY A 122 69.426 -17.713 7.255 1.00 1.00 C ATOM 1807 C GLY A 122 69.869 -18.891 6.405 1.00 1.00 C ATOM 1808 O GLY A 122 71.043 -19.041 6.085 1.00 1.00 O ATOM 0 H GLY A 122 67.665 -17.224 6.231 1.00 1.00 H new ATOM 0 HA2 GLY A 122 69.916 -16.797 6.924 1.00 1.00 H new ATOM 0 HA3 GLY A 122 69.708 -17.866 8.297 1.00 1.00 H new ATOM 1812 N THR A 123 68.882 -19.710 6.048 1.00 1.00 N ATOM 1813 CA THR A 123 69.169 -20.865 5.213 1.00 1.00 C ATOM 1814 C THR A 123 69.771 -20.334 3.902 1.00 1.00 C ATOM 1815 O THR A 123 69.114 -20.195 2.871 1.00 1.00 O ATOM 1816 CB THR A 123 67.912 -21.727 5.000 1.00 1.00 C ATOM 1817 OG1 THR A 123 68.271 -22.906 4.293 1.00 1.00 O ATOM 1818 CG2 THR A 123 66.833 -20.965 4.217 1.00 1.00 C ATOM 0 H THR A 123 67.904 -19.598 6.316 1.00 1.00 H new ATOM 0 HA THR A 123 69.885 -21.532 5.693 1.00 1.00 H new ATOM 0 HB THR A 123 67.500 -21.982 5.976 1.00 1.00 H new ATOM 0 HG1 THR A 123 67.475 -23.460 4.155 1.00 1.00 H new ATOM 0 HG21 THR A 123 65.960 -21.604 4.085 1.00 1.00 H new ATOM 0 HG22 THR A 123 66.547 -20.069 4.769 1.00 1.00 H new ATOM 0 HG23 THR A 123 67.225 -20.680 3.241 1.00 1.00 H new ATOM 1826 N ASP A 124 71.074 -20.077 4.017 1.00 1.00 N ATOM 1827 CA ASP A 124 71.914 -19.588 2.937 1.00 1.00 C ATOM 1828 C ASP A 124 73.384 -19.783 3.268 1.00 1.00 C ATOM 1829 O ASP A 124 73.748 -20.095 4.401 1.00 1.00 O ATOM 1830 CB ASP A 124 71.673 -18.097 2.715 1.00 1.00 C ATOM 1831 CG ASP A 124 70.204 -17.834 2.428 1.00 1.00 C ATOM 1832 OD1 ASP A 124 69.767 -18.163 1.337 1.00 1.00 O ATOM 1833 OD2 ASP A 124 69.536 -17.301 3.300 1.00 1.00 O ATOM 0 H ASP A 124 71.583 -20.209 4.891 1.00 1.00 H new ATOM 0 HA ASP A 124 71.659 -20.151 2.039 1.00 1.00 H new ATOM 0 HB2 ASP A 124 71.984 -17.537 3.597 1.00 1.00 H new ATOM 0 HB3 ASP A 124 72.282 -17.744 1.882 1.00 1.00 H new ATOM 1838 N TYR A 125 74.219 -19.516 2.281 1.00 1.00 N ATOM 1839 CA TYR A 125 75.660 -19.565 2.455 1.00 1.00 C ATOM 1840 C TYR A 125 76.262 -18.438 1.601 1.00 1.00 C ATOM 1841 O TYR A 125 75.798 -18.185 0.490 1.00 1.00 O ATOM 1842 CB TYR A 125 76.210 -20.973 2.094 1.00 1.00 C ATOM 1843 CG TYR A 125 77.060 -20.929 0.848 1.00 1.00 C ATOM 1844 CD1 TYR A 125 76.460 -21.005 -0.409 1.00 1.00 C ATOM 1845 CD2 TYR A 125 78.449 -20.797 0.961 1.00 1.00 C ATOM 1846 CE1 TYR A 125 77.249 -20.954 -1.562 1.00 1.00 C ATOM 1847 CE2 TYR A 125 79.239 -20.743 -0.191 1.00 1.00 C ATOM 1848 CZ TYR A 125 78.639 -20.821 -1.452 1.00 1.00 C ATOM 1849 OH TYR A 125 79.415 -20.763 -2.590 1.00 1.00 O ATOM 0 H TYR A 125 73.920 -19.260 1.340 1.00 1.00 H new ATOM 0 HA TYR A 125 75.943 -19.406 3.496 1.00 1.00 H new ATOM 0 HB2 TYR A 125 76.800 -21.359 2.925 1.00 1.00 H new ATOM 0 HB3 TYR A 125 75.379 -21.663 1.945 1.00 1.00 H new ATOM 0 HD1 TYR A 125 75.388 -21.103 -0.491 1.00 1.00 H new ATOM 0 HD2 TYR A 125 78.909 -20.737 1.936 1.00 1.00 H new ATOM 0 HE1 TYR A 125 76.787 -21.017 -2.536 1.00 1.00 H new ATOM 0 HE2 TYR A 125 80.311 -20.641 -0.107 1.00 1.00 H new ATOM 0 HH TYR A 125 80.358 -20.669 -2.339 1.00 1.00 H new ATOM 1859 N ARG A 126 77.303 -17.786 2.112 1.00 1.00 N ATOM 1860 CA ARG A 126 77.975 -16.716 1.385 1.00 1.00 C ATOM 1861 C ARG A 126 79.453 -16.666 1.771 1.00 1.00 C ATOM 1862 O ARG A 126 79.825 -17.053 2.879 1.00 1.00 O ATOM 1863 CB ARG A 126 77.297 -15.368 1.677 1.00 1.00 C ATOM 1864 CG ARG A 126 77.545 -14.383 0.513 1.00 1.00 C ATOM 1865 CD ARG A 126 76.483 -14.568 -0.585 1.00 1.00 C ATOM 1866 NE ARG A 126 76.731 -15.802 -1.329 1.00 1.00 N ATOM 1867 CZ ARG A 126 75.752 -16.438 -1.963 1.00 1.00 C ATOM 1868 NH1 ARG A 126 74.535 -15.972 -1.922 1.00 1.00 N ATOM 1869 NH2 ARG A 126 76.009 -17.536 -2.622 1.00 1.00 N ATOM 0 H ARG A 126 77.700 -17.982 3.031 1.00 1.00 H new ATOM 0 HA ARG A 126 77.901 -16.916 0.316 1.00 1.00 H new ATOM 0 HB2 ARG A 126 76.226 -15.514 1.817 1.00 1.00 H new ATOM 0 HB3 ARG A 126 77.686 -14.950 2.606 1.00 1.00 H new ATOM 0 HG2 ARG A 126 77.518 -13.358 0.884 1.00 1.00 H new ATOM 0 HG3 ARG A 126 78.539 -14.546 0.097 1.00 1.00 H new ATOM 0 HD2 ARG A 126 75.489 -14.599 -0.138 1.00 1.00 H new ATOM 0 HD3 ARG A 126 76.501 -13.716 -1.265 1.00 1.00 H new ATOM 0 HE ARG A 126 77.677 -16.183 -1.362 1.00 1.00 H new ATOM 0 HH11 ARG A 126 74.333 -15.118 -1.403 1.00 1.00 H new ATOM 0 HH12 ARG A 126 73.785 -16.462 -2.409 1.00 1.00 H new ATOM 0 HH21 ARG A 126 76.960 -17.904 -2.649 1.00 1.00 H new ATOM 0 HH22 ARG A 126 75.259 -18.026 -3.109 1.00 1.00 H new ATOM 1883 N PHE A 127 80.294 -16.192 0.848 1.00 1.00 N ATOM 1884 CA PHE A 127 81.740 -16.097 1.099 1.00 1.00 C ATOM 1885 C PHE A 127 82.242 -14.665 0.897 1.00 1.00 C ATOM 1886 O PHE A 127 83.349 -14.383 1.325 1.00 1.00 O ATOM 1887 CB PHE A 127 82.491 -17.090 0.184 1.00 1.00 C ATOM 1888 CG PHE A 127 82.893 -16.449 -1.135 1.00 1.00 C ATOM 1889 CD1 PHE A 127 81.935 -16.215 -2.130 1.00 1.00 C ATOM 1890 CD2 PHE A 127 84.233 -16.105 -1.360 1.00 1.00 C ATOM 1891 CE1 PHE A 127 82.318 -15.640 -3.349 1.00 1.00 C ATOM 1892 CE2 PHE A 127 84.614 -15.526 -2.577 1.00 1.00 C ATOM 1893 CZ PHE A 127 83.657 -15.294 -3.572 1.00 1.00 C ATOM 1894 OXT PHE A 127 81.511 -13.875 0.324 1.00 1.00 O ATOM 0 H PHE A 127 80.004 -15.869 -0.075 1.00 1.00 H new ATOM 0 HA PHE A 127 81.936 -16.362 2.138 1.00 1.00 H new ATOM 0 HB2 PHE A 127 83.381 -17.455 0.697 1.00 1.00 H new ATOM 0 HB3 PHE A 127 81.858 -17.955 -0.011 1.00 1.00 H new ATOM 0 HD1 PHE A 127 80.902 -16.478 -1.958 1.00 1.00 H new ATOM 0 HD2 PHE A 127 84.972 -16.287 -0.594 1.00 1.00 H new ATOM 0 HE1 PHE A 127 81.580 -15.463 -4.118 1.00 1.00 H new ATOM 0 HE2 PHE A 127 85.646 -15.258 -2.748 1.00 1.00 H new ATOM 0 HZ PHE A 127 83.951 -14.849 -4.511 1.00 1.00 H new