USER MOD reduce.3.24.130724 H: found=0, std=0, add=1001, rem=0, adj=12 USER MOD reduce.3.24.130724 removed 999 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 37 SER OG : rot -15:sc= 0.365 USER MOD Set 1.2: A 39 HIS : no HD1:sc= -0.643 K(o=-0.28,f=-3.2!) USER MOD Set 2.1: A 24 GLN : amide:sc= 0.768 K(o=1.8,f=-4.5) USER MOD Set 2.2: A 50 ASN : amide:sc= 1.06 K(o=1.8,f=-4.1!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 K(o=0,f=-0.63) USER MOD Single : A 5 HIS : no HE2:sc= 0.625 K(o=0.62,f=-6.3!) USER MOD Single : A 12 HIS : no HE2:sc= -2.11! C(o=-2.1!,f=-3.3!) USER MOD Single : A 20 SER OG : rot 180:sc= 0 USER MOD Single : A 34 HIS : no HD1:sc= -0.398 X(o=-0.4,f=-0.11) USER MOD Single : A 45 GLN : amide:sc= 0.911 K(o=0.91,f=-1.3) USER MOD Single : A 47 GLN : amide:sc= -0.937 K(o=-0.94,f=-1.8) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 62 TYR OH : rot 130:sc= 0 USER MOD Single : A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 87 CYS SG : rot -0:sc= 0.765 USER MOD Single : A 88 GLN :FLIP amide:sc= -1.59 F(o=-2.2,f=-1.6) USER MOD Single : A 89 HIS : no HD1:sc= -0.0858 X(o=-0.086,f=-0.00096) USER MOD Single : A 94 SER OG : rot 124:sc= 0.0846 USER MOD Single : A 96 SER OG : rot 8:sc= 0.735 USER MOD Single : A 97 HIS : no HD1:sc= -0.416 K(o=-0.42,f=-2) USER MOD Single : A 105 ASN : amide:sc= 0.242 K(o=0.24,f=-1.6!) USER MOD Single : A 121 SER OG : rot 47:sc= 0.625 USER MOD Single : A 123 HIS : no HD1:sc= -0.42 X(o=-0.42,f=-0.032) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -4.417 14.902 -36.344 1.00 0.00 N ATOM 2 CA MET A 1 -3.300 13.933 -36.261 1.00 0.00 C ATOM 3 C MET A 1 -1.998 14.561 -36.742 1.00 0.00 C ATOM 4 O MET A 1 -1.939 15.149 -37.822 1.00 0.00 O ATOM 5 CB MET A 1 -3.606 12.681 -37.090 1.00 0.00 C ATOM 6 CG MET A 1 -2.535 11.605 -36.990 1.00 0.00 C ATOM 7 SD MET A 1 -2.889 10.172 -38.025 1.00 0.00 S ATOM 8 CE MET A 1 -1.484 9.124 -37.653 1.00 0.00 C ATOM 0 H1 MET A 1 -5.293 14.451 -36.011 1.00 0.00 H new ATOM 0 H2 MET A 1 -4.205 15.728 -35.749 1.00 0.00 H new ATOM 0 H3 MET A 1 -4.538 15.208 -37.330 1.00 0.00 H new ATOM 0 HA MET A 1 -3.186 13.647 -35.215 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.559 12.264 -36.764 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.724 12.968 -38.135 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.573 12.028 -37.279 1.00 0.00 H new ATOM 0 HG3 MET A 1 -2.443 11.285 -35.952 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.562 8.196 -38.220 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.563 9.640 -37.925 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.471 8.897 -36.587 1.00 0.00 H new ATOM 18 N SER A 2 -0.963 14.431 -35.925 1.00 0.00 N ATOM 19 CA SER A 2 0.369 14.905 -36.268 1.00 0.00 C ATOM 20 C SER A 2 1.384 13.894 -35.749 1.00 0.00 C ATOM 21 O SER A 2 0.992 12.831 -35.257 1.00 0.00 O ATOM 22 CB SER A 2 0.621 16.275 -35.630 1.00 0.00 C ATOM 23 OG SER A 2 -0.463 17.160 -35.863 1.00 0.00 O ATOM 0 H SER A 2 -1.023 13.994 -35.005 1.00 0.00 H new ATOM 0 HA SER A 2 0.462 15.009 -37.349 1.00 0.00 H new ATOM 0 HB2 SER A 2 0.772 16.156 -34.557 1.00 0.00 H new ATOM 0 HB3 SER A 2 1.537 16.704 -36.035 1.00 0.00 H new ATOM 0 HG SER A 2 -0.275 18.025 -35.443 1.00 0.00 H new ATOM 29 N ASP A 3 2.671 14.201 -35.863 1.00 0.00 N ATOM 30 CA ASP A 3 3.689 13.380 -35.221 1.00 0.00 C ATOM 31 C ASP A 3 3.584 13.547 -33.711 1.00 0.00 C ATOM 32 O ASP A 3 4.098 14.508 -33.135 1.00 0.00 O ATOM 33 CB ASP A 3 5.096 13.744 -35.701 1.00 0.00 C ATOM 34 CG ASP A 3 6.164 12.899 -35.030 1.00 0.00 C ATOM 35 OD1 ASP A 3 7.319 13.360 -34.925 1.00 0.00 O ATOM 36 OD2 ASP A 3 5.851 11.772 -34.590 1.00 0.00 O ATOM 0 H ASP A 3 3.030 15.000 -36.386 1.00 0.00 H new ATOM 0 HA ASP A 3 3.516 12.339 -35.492 1.00 0.00 H new ATOM 0 HB2 ASP A 3 5.156 13.612 -36.781 1.00 0.00 H new ATOM 0 HB3 ASP A 3 5.287 14.798 -35.497 1.00 0.00 H new ATOM 41 N GLN A 4 2.878 12.618 -33.085 1.00 0.00 N ATOM 42 CA GLN A 4 2.562 12.711 -31.668 1.00 0.00 C ATOM 43 C GLN A 4 3.622 12.006 -30.826 1.00 0.00 C ATOM 44 O GLN A 4 3.593 12.064 -29.595 1.00 0.00 O ATOM 45 CB GLN A 4 1.177 12.104 -31.411 1.00 0.00 C ATOM 46 CG GLN A 4 0.620 12.393 -30.025 1.00 0.00 C ATOM 47 CD GLN A 4 -0.740 11.765 -29.797 1.00 0.00 C ATOM 48 OE1 GLN A 4 -1.056 10.716 -30.359 1.00 0.00 O ATOM 49 NE2 GLN A 4 -1.555 12.399 -28.967 1.00 0.00 N ATOM 0 H GLN A 4 2.510 11.783 -33.541 1.00 0.00 H new ATOM 0 HA GLN A 4 2.552 13.762 -31.378 1.00 0.00 H new ATOM 0 HB2 GLN A 4 0.481 12.486 -32.158 1.00 0.00 H new ATOM 0 HB3 GLN A 4 1.234 11.024 -31.550 1.00 0.00 H new ATOM 0 HG2 GLN A 4 1.317 12.022 -29.274 1.00 0.00 H new ATOM 0 HG3 GLN A 4 0.545 13.471 -29.886 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.255 13.266 -28.521 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -2.482 12.020 -28.774 1.00 0.00 H new ATOM 58 N HIS A 5 4.566 11.352 -31.489 1.00 0.00 N ATOM 59 CA HIS A 5 5.598 10.605 -30.785 1.00 0.00 C ATOM 60 C HIS A 5 6.633 11.568 -30.207 1.00 0.00 C ATOM 61 O HIS A 5 6.933 12.602 -30.807 1.00 0.00 O ATOM 62 CB HIS A 5 6.241 9.557 -31.720 1.00 0.00 C ATOM 63 CG HIS A 5 7.616 9.893 -32.238 1.00 0.00 C ATOM 64 ND1 HIS A 5 7.839 10.673 -33.348 1.00 0.00 N ATOM 65 CD2 HIS A 5 8.841 9.521 -31.797 1.00 0.00 C ATOM 66 CE1 HIS A 5 9.136 10.763 -33.570 1.00 0.00 C ATOM 67 NE2 HIS A 5 9.771 10.071 -32.640 1.00 0.00 N ATOM 0 H HIS A 5 4.638 11.324 -32.506 1.00 0.00 H new ATOM 0 HA HIS A 5 5.148 10.061 -29.954 1.00 0.00 H new ATOM 0 HB2 HIS A 5 6.297 8.608 -31.187 1.00 0.00 H new ATOM 0 HB3 HIS A 5 5.580 9.405 -32.573 1.00 0.00 H new ATOM 0 HD1 HIS A 5 7.113 11.114 -33.913 1.00 0.00 H new ATOM 0 HD2 HIS A 5 9.048 8.902 -30.936 1.00 0.00 H new ATOM 0 HE1 HIS A 5 9.601 11.310 -34.376 1.00 0.00 H new ATOM 76 N ASP A 6 7.164 11.230 -29.044 1.00 0.00 N ATOM 77 CA ASP A 6 8.144 12.078 -28.370 1.00 0.00 C ATOM 78 C ASP A 6 9.169 11.240 -27.632 1.00 0.00 C ATOM 79 O ASP A 6 10.371 11.397 -27.844 1.00 0.00 O ATOM 80 CB ASP A 6 7.471 13.035 -27.377 1.00 0.00 C ATOM 81 CG ASP A 6 8.484 13.759 -26.495 1.00 0.00 C ATOM 82 OD1 ASP A 6 9.009 14.810 -26.921 1.00 0.00 O ATOM 83 OD2 ASP A 6 8.763 13.277 -25.377 1.00 0.00 O ATOM 0 H ASP A 6 6.935 10.372 -28.542 1.00 0.00 H new ATOM 0 HA ASP A 6 8.642 12.664 -29.143 1.00 0.00 H new ATOM 0 HB2 ASP A 6 6.880 13.769 -27.926 1.00 0.00 H new ATOM 0 HB3 ASP A 6 6.779 12.475 -26.748 1.00 0.00 H new ATOM 88 N GLU A 7 8.678 10.339 -26.781 1.00 0.00 N ATOM 89 CA GLU A 7 9.539 9.583 -25.884 1.00 0.00 C ATOM 90 C GLU A 7 10.656 8.880 -26.644 1.00 0.00 C ATOM 91 O GLU A 7 10.478 8.427 -27.780 1.00 0.00 O ATOM 92 CB GLU A 7 8.744 8.576 -25.055 1.00 0.00 C ATOM 93 CG GLU A 7 8.985 8.725 -23.558 1.00 0.00 C ATOM 94 CD GLU A 7 10.462 8.828 -23.219 1.00 0.00 C ATOM 95 OE1 GLU A 7 10.945 9.953 -22.966 1.00 0.00 O ATOM 96 OE2 GLU A 7 11.156 7.794 -23.245 1.00 0.00 O ATOM 0 H GLU A 7 7.686 10.118 -26.697 1.00 0.00 H new ATOM 0 HA GLU A 7 9.991 10.301 -25.200 1.00 0.00 H new ATOM 0 HB2 GLU A 7 7.681 8.700 -25.262 1.00 0.00 H new ATOM 0 HB3 GLU A 7 9.013 7.566 -25.363 1.00 0.00 H new ATOM 0 HG2 GLU A 7 8.469 9.614 -23.196 1.00 0.00 H new ATOM 0 HG3 GLU A 7 8.553 7.871 -23.036 1.00 0.00 H new ATOM 103 N ARG A 8 11.792 8.792 -25.987 1.00 0.00 N ATOM 104 CA ARG A 8 13.034 8.387 -26.614 1.00 0.00 C ATOM 105 C ARG A 8 13.583 7.110 -25.984 1.00 0.00 C ATOM 106 O ARG A 8 14.538 6.518 -26.488 1.00 0.00 O ATOM 107 CB ARG A 8 14.028 9.543 -26.473 1.00 0.00 C ATOM 108 CG ARG A 8 14.013 10.153 -25.077 1.00 0.00 C ATOM 109 CD ARG A 8 14.439 11.615 -25.073 1.00 0.00 C ATOM 110 NE ARG A 8 13.650 12.442 -25.998 1.00 0.00 N ATOM 111 CZ ARG A 8 12.386 12.842 -25.791 1.00 0.00 C ATOM 112 NH1 ARG A 8 11.697 12.426 -24.735 1.00 0.00 N ATOM 113 NH2 ARG A 8 11.805 13.657 -26.666 1.00 0.00 N ATOM 0 H ARG A 8 11.882 9.001 -24.993 1.00 0.00 H new ATOM 0 HA ARG A 8 12.863 8.165 -27.667 1.00 0.00 H new ATOM 0 HB2 ARG A 8 15.032 9.185 -26.700 1.00 0.00 H new ATOM 0 HB3 ARG A 8 13.791 10.314 -27.206 1.00 0.00 H new ATOM 0 HG2 ARG A 8 13.010 10.069 -24.659 1.00 0.00 H new ATOM 0 HG3 ARG A 8 14.678 9.583 -24.428 1.00 0.00 H new ATOM 0 HD2 ARG A 8 14.342 12.014 -24.063 1.00 0.00 H new ATOM 0 HD3 ARG A 8 15.493 11.682 -25.342 1.00 0.00 H new ATOM 0 HE ARG A 8 14.099 12.735 -26.866 1.00 0.00 H new ATOM 0 HH11 ARG A 8 12.128 11.791 -24.063 1.00 0.00 H new ATOM 0 HH12 ARG A 8 10.737 12.742 -24.596 1.00 0.00 H new ATOM 0 HH21 ARG A 8 12.320 13.974 -27.488 1.00 0.00 H new ATOM 0 HH22 ARG A 8 10.844 13.966 -26.516 1.00 0.00 H new ATOM 127 N ARG A 9 12.978 6.686 -24.884 1.00 0.00 N ATOM 128 CA ARG A 9 13.432 5.499 -24.175 1.00 0.00 C ATOM 129 C ARG A 9 12.265 4.583 -23.829 1.00 0.00 C ATOM 130 O ARG A 9 12.180 3.451 -24.309 1.00 0.00 O ATOM 131 CB ARG A 9 14.161 5.895 -22.891 1.00 0.00 C ATOM 132 CG ARG A 9 15.458 6.652 -23.123 1.00 0.00 C ATOM 133 CD ARG A 9 16.045 7.152 -21.818 1.00 0.00 C ATOM 134 NE ARG A 9 17.337 7.802 -22.013 1.00 0.00 N ATOM 135 CZ ARG A 9 17.857 8.702 -21.181 1.00 0.00 C ATOM 136 NH1 ARG A 9 17.169 9.107 -20.119 1.00 0.00 N ATOM 137 NH2 ARG A 9 19.061 9.203 -21.425 1.00 0.00 N ATOM 0 H ARG A 9 12.171 7.147 -24.463 1.00 0.00 H new ATOM 0 HA ARG A 9 14.115 4.962 -24.833 1.00 0.00 H new ATOM 0 HB2 ARG A 9 13.497 6.510 -22.284 1.00 0.00 H new ATOM 0 HB3 ARG A 9 14.376 4.995 -22.315 1.00 0.00 H new ATOM 0 HG2 ARG A 9 16.177 6.002 -23.622 1.00 0.00 H new ATOM 0 HG3 ARG A 9 15.275 7.495 -23.789 1.00 0.00 H new ATOM 0 HD2 ARG A 9 15.352 7.854 -21.354 1.00 0.00 H new ATOM 0 HD3 ARG A 9 16.160 6.316 -21.128 1.00 0.00 H new ATOM 0 HE ARG A 9 17.877 7.550 -22.841 1.00 0.00 H new ATOM 0 HH11 ARG A 9 16.239 8.728 -19.939 1.00 0.00 H new ATOM 0 HH12 ARG A 9 17.571 9.797 -19.484 1.00 0.00 H new ATOM 0 HH21 ARG A 9 19.583 8.898 -22.247 1.00 0.00 H new ATOM 0 HH22 ARG A 9 19.464 9.893 -20.791 1.00 0.00 H new ATOM 151 N ARG A 10 11.358 5.086 -23.006 1.00 0.00 N ATOM 152 CA ARG A 10 10.273 4.276 -22.476 1.00 0.00 C ATOM 153 C ARG A 10 9.246 5.178 -21.807 1.00 0.00 C ATOM 154 O ARG A 10 9.602 6.198 -21.216 1.00 0.00 O ATOM 155 CB ARG A 10 10.824 3.269 -21.460 1.00 0.00 C ATOM 156 CG ARG A 10 9.925 2.066 -21.222 1.00 0.00 C ATOM 157 CD ARG A 10 10.233 0.931 -22.189 1.00 0.00 C ATOM 158 NE ARG A 10 10.074 1.320 -23.589 1.00 0.00 N ATOM 159 CZ ARG A 10 9.191 0.758 -24.415 1.00 0.00 C ATOM 160 NH1 ARG A 10 8.369 -0.187 -23.971 1.00 0.00 N ATOM 161 NH2 ARG A 10 9.133 1.130 -25.688 1.00 0.00 N ATOM 0 H ARG A 10 11.352 6.056 -22.690 1.00 0.00 H new ATOM 0 HA ARG A 10 9.797 3.731 -23.291 1.00 0.00 H new ATOM 0 HB2 ARG A 10 11.797 2.918 -21.804 1.00 0.00 H new ATOM 0 HB3 ARG A 10 10.987 3.780 -20.511 1.00 0.00 H new ATOM 0 HG2 ARG A 10 10.051 1.715 -20.198 1.00 0.00 H new ATOM 0 HG3 ARG A 10 8.882 2.364 -21.331 1.00 0.00 H new ATOM 0 HD2 ARG A 10 11.255 0.588 -22.026 1.00 0.00 H new ATOM 0 HD3 ARG A 10 9.576 0.088 -21.974 1.00 0.00 H new ATOM 0 HE ARG A 10 10.671 2.062 -23.954 1.00 0.00 H new ATOM 0 HH11 ARG A 10 8.413 -0.484 -22.996 1.00 0.00 H new ATOM 0 HH12 ARG A 10 7.694 -0.615 -24.605 1.00 0.00 H new ATOM 0 HH21 ARG A 10 9.766 1.849 -26.039 1.00 0.00 H new ATOM 0 HH22 ARG A 10 8.456 0.697 -26.316 1.00 0.00 H new ATOM 175 N PHE A 11 7.981 4.802 -21.887 1.00 0.00 N ATOM 176 CA PHE A 11 6.908 5.613 -21.327 1.00 0.00 C ATOM 177 C PHE A 11 7.000 5.665 -19.802 1.00 0.00 C ATOM 178 O PHE A 11 6.672 4.700 -19.112 1.00 0.00 O ATOM 179 CB PHE A 11 5.547 5.062 -21.763 1.00 0.00 C ATOM 180 CG PHE A 11 4.380 5.903 -21.323 1.00 0.00 C ATOM 181 CD1 PHE A 11 4.087 7.093 -21.968 1.00 0.00 C ATOM 182 CD2 PHE A 11 3.579 5.501 -20.268 1.00 0.00 C ATOM 183 CE1 PHE A 11 3.014 7.868 -21.569 1.00 0.00 C ATOM 184 CE2 PHE A 11 2.506 6.272 -19.864 1.00 0.00 C ATOM 185 CZ PHE A 11 2.222 7.456 -20.515 1.00 0.00 C ATOM 0 H PHE A 11 7.669 3.940 -22.334 1.00 0.00 H new ATOM 0 HA PHE A 11 7.014 6.630 -21.706 1.00 0.00 H new ATOM 0 HB2 PHE A 11 5.532 4.977 -22.850 1.00 0.00 H new ATOM 0 HB3 PHE A 11 5.428 4.055 -21.362 1.00 0.00 H new ATOM 0 HD1 PHE A 11 4.704 7.419 -22.792 1.00 0.00 H new ATOM 0 HD2 PHE A 11 3.795 4.575 -19.755 1.00 0.00 H new ATOM 0 HE1 PHE A 11 2.795 8.794 -22.080 1.00 0.00 H new ATOM 0 HE2 PHE A 11 1.889 5.948 -19.039 1.00 0.00 H new ATOM 0 HZ PHE A 11 1.383 8.059 -20.201 1.00 0.00 H new ATOM 195 N HIS A 12 7.478 6.787 -19.279 1.00 0.00 N ATOM 196 CA HIS A 12 7.544 6.990 -17.838 1.00 0.00 C ATOM 197 C HIS A 12 6.951 8.344 -17.466 1.00 0.00 C ATOM 198 O HIS A 12 7.678 9.319 -17.316 1.00 0.00 O ATOM 199 CB HIS A 12 8.987 6.934 -17.316 1.00 0.00 C ATOM 200 CG HIS A 12 9.726 5.657 -17.587 1.00 0.00 C ATOM 201 ND1 HIS A 12 9.510 4.487 -16.892 1.00 0.00 N ATOM 202 CD2 HIS A 12 10.722 5.389 -18.462 1.00 0.00 C ATOM 203 CE1 HIS A 12 10.343 3.560 -17.327 1.00 0.00 C ATOM 204 NE2 HIS A 12 11.095 4.080 -18.280 1.00 0.00 N ATOM 0 H HIS A 12 7.826 7.571 -19.832 1.00 0.00 H new ATOM 0 HA HIS A 12 6.972 6.184 -17.379 1.00 0.00 H new ATOM 0 HB2 HIS A 12 9.547 7.758 -17.759 1.00 0.00 H new ATOM 0 HB3 HIS A 12 8.971 7.102 -16.239 1.00 0.00 H new ATOM 0 HD1 HIS A 12 8.815 4.357 -16.157 1.00 0.00 H new ATOM 0 HD2 HIS A 12 11.147 6.080 -19.175 1.00 0.00 H new ATOM 0 HE1 HIS A 12 10.400 2.545 -16.964 1.00 0.00 H new ATOM 213 N ARG A 13 5.632 8.417 -17.357 1.00 0.00 N ATOM 214 CA ARG A 13 4.972 9.637 -16.898 1.00 0.00 C ATOM 215 C ARG A 13 3.985 9.282 -15.794 1.00 0.00 C ATOM 216 O ARG A 13 4.364 9.150 -14.634 1.00 0.00 O ATOM 217 CB ARG A 13 4.248 10.354 -18.048 1.00 0.00 C ATOM 218 CG ARG A 13 5.139 10.701 -19.233 1.00 0.00 C ATOM 219 CD ARG A 13 6.272 11.640 -18.843 1.00 0.00 C ATOM 220 NE ARG A 13 7.193 11.871 -19.957 1.00 0.00 N ATOM 221 CZ ARG A 13 8.514 11.719 -19.876 1.00 0.00 C ATOM 222 NH1 ARG A 13 9.080 11.365 -18.729 1.00 0.00 N ATOM 223 NH2 ARG A 13 9.264 11.926 -20.946 1.00 0.00 N ATOM 0 H ARG A 13 4.997 7.650 -17.579 1.00 0.00 H new ATOM 0 HA ARG A 13 5.730 10.320 -16.515 1.00 0.00 H new ATOM 0 HB2 ARG A 13 3.431 9.723 -18.396 1.00 0.00 H new ATOM 0 HB3 ARG A 13 3.801 11.271 -17.664 1.00 0.00 H new ATOM 0 HG2 ARG A 13 5.556 9.785 -19.653 1.00 0.00 H new ATOM 0 HG3 ARG A 13 4.537 11.165 -20.015 1.00 0.00 H new ATOM 0 HD2 ARG A 13 5.857 12.592 -18.511 1.00 0.00 H new ATOM 0 HD3 ARG A 13 6.819 11.219 -18.000 1.00 0.00 H new ATOM 0 HE ARG A 13 6.799 12.167 -20.850 1.00 0.00 H new ATOM 0 HH11 ARG A 13 8.503 11.208 -17.903 1.00 0.00 H new ATOM 0 HH12 ARG A 13 10.092 11.250 -18.674 1.00 0.00 H new ATOM 0 HH21 ARG A 13 8.830 12.201 -21.827 1.00 0.00 H new ATOM 0 HH22 ARG A 13 10.276 11.811 -20.890 1.00 0.00 H new ATOM 237 N ILE A 14 2.725 9.112 -16.167 1.00 0.00 N ATOM 238 CA ILE A 14 1.730 8.534 -15.282 1.00 0.00 C ATOM 239 C ILE A 14 1.409 7.142 -15.819 1.00 0.00 C ATOM 240 O ILE A 14 1.639 6.894 -17.006 1.00 0.00 O ATOM 241 CB ILE A 14 0.449 9.402 -15.206 1.00 0.00 C ATOM 242 CG1 ILE A 14 -0.434 8.986 -14.027 1.00 0.00 C ATOM 243 CG2 ILE A 14 -0.334 9.316 -16.500 1.00 0.00 C ATOM 244 CD1 ILE A 14 0.150 9.339 -12.675 1.00 0.00 C ATOM 0 H ILE A 14 2.367 9.370 -17.087 1.00 0.00 H new ATOM 0 HA ILE A 14 2.122 8.482 -14.266 1.00 0.00 H new ATOM 0 HB ILE A 14 0.759 10.435 -15.051 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.408 9.464 -14.128 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -0.601 7.910 -14.071 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -1.230 9.933 -16.425 1.00 0.00 H new ATOM 0 HG22 ILE A 14 0.284 9.673 -17.324 1.00 0.00 H new ATOM 0 HG23 ILE A 14 -0.621 8.281 -16.684 1.00 0.00 H new ATOM 0 HD11 ILE A 14 -0.531 9.014 -11.888 1.00 0.00 H new ATOM 0 HD12 ILE A 14 1.111 8.840 -12.552 1.00 0.00 H new ATOM 0 HD13 ILE A 14 0.291 10.418 -12.610 1.00 0.00 H new ATOM 256 N ALA A 15 0.925 6.243 -14.959 1.00 0.00 N ATOM 257 CA ALA A 15 0.723 4.828 -15.312 1.00 0.00 C ATOM 258 C ALA A 15 2.068 4.115 -15.460 1.00 0.00 C ATOM 259 O ALA A 15 2.306 3.101 -14.810 1.00 0.00 O ATOM 260 CB ALA A 15 -0.114 4.674 -16.577 1.00 0.00 C ATOM 0 H ALA A 15 0.662 6.470 -14.000 1.00 0.00 H new ATOM 0 HA ALA A 15 0.169 4.361 -14.498 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -0.240 3.615 -16.803 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -1.092 5.131 -16.424 1.00 0.00 H new ATOM 0 HB3 ALA A 15 0.390 5.165 -17.409 1.00 0.00 H new ATOM 266 N PHE A 16 2.934 4.687 -16.308 1.00 0.00 N ATOM 267 CA PHE A 16 4.343 4.281 -16.475 1.00 0.00 C ATOM 268 C PHE A 16 4.556 2.772 -16.626 1.00 0.00 C ATOM 269 O PHE A 16 3.622 2.005 -16.857 1.00 0.00 O ATOM 270 CB PHE A 16 5.237 4.850 -15.343 1.00 0.00 C ATOM 271 CG PHE A 16 4.572 4.988 -13.996 1.00 0.00 C ATOM 272 CD1 PHE A 16 3.953 6.178 -13.648 1.00 0.00 C ATOM 273 CD2 PHE A 16 4.554 3.938 -13.087 1.00 0.00 C ATOM 274 CE1 PHE A 16 3.326 6.322 -12.431 1.00 0.00 C ATOM 275 CE2 PHE A 16 3.928 4.078 -11.861 1.00 0.00 C ATOM 276 CZ PHE A 16 3.314 5.272 -11.533 1.00 0.00 C ATOM 0 H PHE A 16 2.671 5.465 -16.913 1.00 0.00 H new ATOM 0 HA PHE A 16 4.648 4.719 -17.425 1.00 0.00 H new ATOM 0 HB2 PHE A 16 6.109 4.205 -15.234 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.602 5.830 -15.650 1.00 0.00 H new ATOM 0 HD1 PHE A 16 3.963 7.005 -14.342 1.00 0.00 H new ATOM 0 HD2 PHE A 16 5.033 3.004 -13.339 1.00 0.00 H new ATOM 0 HE1 PHE A 16 2.844 7.255 -12.178 1.00 0.00 H new ATOM 0 HE2 PHE A 16 3.919 3.255 -11.161 1.00 0.00 H new ATOM 0 HZ PHE A 16 2.826 5.384 -10.576 1.00 0.00 H new ATOM 286 N ASP A 17 5.820 2.370 -16.562 1.00 0.00 N ATOM 287 CA ASP A 17 6.192 0.967 -16.659 1.00 0.00 C ATOM 288 C ASP A 17 6.311 0.380 -15.264 1.00 0.00 C ATOM 289 O ASP A 17 7.290 0.631 -14.556 1.00 0.00 O ATOM 290 CB ASP A 17 7.523 0.820 -17.411 1.00 0.00 C ATOM 291 CG ASP A 17 7.931 -0.627 -17.639 1.00 0.00 C ATOM 292 OD1 ASP A 17 8.498 -1.249 -16.711 1.00 0.00 O ATOM 293 OD2 ASP A 17 7.719 -1.139 -18.759 1.00 0.00 O ATOM 0 H ASP A 17 6.610 3.004 -16.442 1.00 0.00 H new ATOM 0 HA ASP A 17 5.423 0.429 -17.213 1.00 0.00 H new ATOM 0 HB2 ASP A 17 7.445 1.324 -18.374 1.00 0.00 H new ATOM 0 HB3 ASP A 17 8.307 1.327 -16.849 1.00 0.00 H new ATOM 298 N ALA A 18 5.289 -0.343 -14.848 1.00 0.00 N ATOM 299 CA ALA A 18 5.281 -0.977 -13.543 1.00 0.00 C ATOM 300 C ALA A 18 4.784 -2.406 -13.646 1.00 0.00 C ATOM 301 O ALA A 18 3.842 -2.692 -14.389 1.00 0.00 O ATOM 302 CB ALA A 18 4.421 -0.182 -12.572 1.00 0.00 C ATOM 0 H ALA A 18 4.447 -0.507 -15.400 1.00 0.00 H new ATOM 0 HA ALA A 18 6.303 -0.997 -13.164 1.00 0.00 H new ATOM 0 HB1 ALA A 18 4.425 -0.671 -11.598 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.821 0.827 -12.474 1.00 0.00 H new ATOM 0 HB3 ALA A 18 3.399 -0.132 -12.948 1.00 0.00 H new ATOM 308 N ASP A 19 5.423 -3.304 -12.915 1.00 0.00 N ATOM 309 CA ASP A 19 4.960 -4.679 -12.844 1.00 0.00 C ATOM 310 C ASP A 19 3.883 -4.760 -11.773 1.00 0.00 C ATOM 311 O ASP A 19 4.153 -4.534 -10.592 1.00 0.00 O ATOM 312 CB ASP A 19 6.117 -5.631 -12.525 1.00 0.00 C ATOM 313 CG ASP A 19 5.814 -7.064 -12.918 1.00 0.00 C ATOM 314 OD1 ASP A 19 6.249 -7.487 -14.012 1.00 0.00 O ATOM 315 OD2 ASP A 19 5.144 -7.774 -12.139 1.00 0.00 O ATOM 0 H ASP A 19 6.259 -3.107 -12.365 1.00 0.00 H new ATOM 0 HA ASP A 19 4.552 -4.982 -13.808 1.00 0.00 H new ATOM 0 HB2 ASP A 19 7.013 -5.296 -13.047 1.00 0.00 H new ATOM 0 HB3 ASP A 19 6.335 -5.588 -11.458 1.00 0.00 H new ATOM 320 N SER A 20 2.657 -5.034 -12.187 1.00 0.00 N ATOM 321 CA SER A 20 1.524 -4.949 -11.282 1.00 0.00 C ATOM 322 C SER A 20 0.890 -6.313 -11.038 1.00 0.00 C ATOM 323 O SER A 20 0.719 -7.116 -11.961 1.00 0.00 O ATOM 324 CB SER A 20 0.481 -3.977 -11.847 1.00 0.00 C ATOM 325 OG SER A 20 -0.611 -3.810 -10.956 1.00 0.00 O ATOM 0 H SER A 20 2.422 -5.316 -13.139 1.00 0.00 H new ATOM 0 HA SER A 20 1.889 -4.580 -10.323 1.00 0.00 H new ATOM 0 HB2 SER A 20 0.948 -3.011 -12.037 1.00 0.00 H new ATOM 0 HB3 SER A 20 0.117 -4.349 -12.805 1.00 0.00 H new ATOM 0 HG SER A 20 -1.257 -3.184 -11.344 1.00 0.00 H new ATOM 331 N GLU A 21 0.552 -6.564 -9.782 1.00 0.00 N ATOM 332 CA GLU A 21 -0.196 -7.748 -9.404 1.00 0.00 C ATOM 333 C GLU A 21 -1.290 -7.375 -8.407 1.00 0.00 C ATOM 334 O GLU A 21 -1.045 -6.662 -7.429 1.00 0.00 O ATOM 335 CB GLU A 21 0.729 -8.822 -8.820 1.00 0.00 C ATOM 336 CG GLU A 21 1.646 -8.318 -7.719 1.00 0.00 C ATOM 337 CD GLU A 21 2.442 -9.429 -7.065 1.00 0.00 C ATOM 338 OE1 GLU A 21 3.406 -9.928 -7.676 1.00 0.00 O ATOM 339 OE2 GLU A 21 2.120 -9.800 -5.926 1.00 0.00 O ATOM 0 H GLU A 21 0.789 -5.953 -9.000 1.00 0.00 H new ATOM 0 HA GLU A 21 -0.661 -8.164 -10.298 1.00 0.00 H new ATOM 0 HB2 GLU A 21 0.120 -9.636 -8.427 1.00 0.00 H new ATOM 0 HB3 GLU A 21 1.337 -9.238 -9.623 1.00 0.00 H new ATOM 0 HG2 GLU A 21 2.333 -7.580 -8.134 1.00 0.00 H new ATOM 0 HG3 GLU A 21 1.051 -7.809 -6.961 1.00 0.00 H new ATOM 346 N ILE A 22 -2.502 -7.827 -8.681 1.00 0.00 N ATOM 347 CA ILE A 22 -3.638 -7.553 -7.814 1.00 0.00 C ATOM 348 C ILE A 22 -3.899 -8.746 -6.912 1.00 0.00 C ATOM 349 O ILE A 22 -4.219 -9.827 -7.384 1.00 0.00 O ATOM 350 CB ILE A 22 -4.902 -7.233 -8.636 1.00 0.00 C ATOM 351 CG1 ILE A 22 -4.654 -6.008 -9.518 1.00 0.00 C ATOM 352 CG2 ILE A 22 -6.096 -6.998 -7.719 1.00 0.00 C ATOM 353 CD1 ILE A 22 -5.776 -5.720 -10.493 1.00 0.00 C ATOM 0 H ILE A 22 -2.726 -8.389 -9.502 1.00 0.00 H new ATOM 0 HA ILE A 22 -3.398 -6.681 -7.205 1.00 0.00 H new ATOM 0 HB ILE A 22 -5.129 -8.087 -9.274 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -4.507 -5.136 -8.880 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -3.729 -6.155 -10.076 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.977 -6.774 -8.320 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -6.280 -7.893 -7.125 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -5.886 -6.159 -7.056 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -5.528 -4.838 -11.083 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -5.910 -6.574 -11.157 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.699 -5.540 -9.942 1.00 0.00 H new ATOM 365 N LEU A 23 -3.751 -8.552 -5.618 1.00 0.00 N ATOM 366 CA LEU A 23 -3.855 -9.651 -4.675 1.00 0.00 C ATOM 367 C LEU A 23 -5.253 -9.731 -4.087 1.00 0.00 C ATOM 368 O LEU A 23 -6.042 -8.790 -4.187 1.00 0.00 O ATOM 369 CB LEU A 23 -2.867 -9.466 -3.519 1.00 0.00 C ATOM 370 CG LEU A 23 -1.556 -8.770 -3.871 1.00 0.00 C ATOM 371 CD1 LEU A 23 -0.759 -8.483 -2.611 1.00 0.00 C ATOM 372 CD2 LEU A 23 -0.741 -9.621 -4.821 1.00 0.00 C ATOM 0 H LEU A 23 -3.558 -7.645 -5.193 1.00 0.00 H new ATOM 0 HA LEU A 23 -3.629 -10.567 -5.221 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.360 -8.895 -2.733 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -2.636 -10.447 -3.103 1.00 0.00 H new ATOM 0 HG LEU A 23 -1.788 -7.826 -4.364 1.00 0.00 H new ATOM 0 HD11 LEU A 23 0.174 -7.986 -2.876 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -1.340 -7.837 -1.952 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -0.539 -9.419 -2.099 1.00 0.00 H new ATOM 0 HD21 LEU A 23 0.191 -9.108 -5.061 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -0.518 -10.579 -4.351 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -1.308 -9.790 -5.736 1.00 0.00 H new ATOM 384 N GLN A 24 -5.543 -10.866 -3.483 1.00 0.00 N ATOM 385 CA GLN A 24 -6.709 -11.009 -2.632 1.00 0.00 C ATOM 386 C GLN A 24 -6.360 -11.942 -1.483 1.00 0.00 C ATOM 387 O GLN A 24 -6.715 -13.125 -1.489 1.00 0.00 O ATOM 388 CB GLN A 24 -7.922 -11.534 -3.404 1.00 0.00 C ATOM 389 CG GLN A 24 -9.209 -11.496 -2.591 1.00 0.00 C ATOM 390 CD GLN A 24 -10.416 -11.974 -3.369 1.00 0.00 C ATOM 391 OE1 GLN A 24 -10.764 -13.154 -3.343 1.00 0.00 O ATOM 392 NE2 GLN A 24 -11.069 -11.057 -4.062 1.00 0.00 N ATOM 0 H GLN A 24 -4.980 -11.712 -3.567 1.00 0.00 H new ATOM 0 HA GLN A 24 -6.985 -10.027 -2.248 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -8.053 -10.941 -4.309 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -7.729 -12.559 -3.719 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -9.089 -12.115 -1.702 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -9.385 -10.476 -2.248 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -10.747 -10.089 -4.057 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -11.894 -11.317 -4.602 1.00 0.00 H new ATOM 401 N GLY A 25 -5.584 -11.428 -0.540 1.00 0.00 N ATOM 402 CA GLY A 25 -5.177 -12.214 0.603 1.00 0.00 C ATOM 403 C GLY A 25 -3.964 -13.076 0.310 1.00 0.00 C ATOM 404 O GLY A 25 -2.962 -13.013 1.022 1.00 0.00 O ATOM 0 H GLY A 25 -5.227 -10.472 -0.548 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -4.954 -11.549 1.437 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -6.005 -12.851 0.916 1.00 0.00 H new ATOM 408 N GLU A 26 -4.047 -13.869 -0.750 1.00 0.00 N ATOM 409 CA GLU A 26 -2.991 -14.815 -1.079 1.00 0.00 C ATOM 410 C GLU A 26 -2.653 -14.786 -2.567 1.00 0.00 C ATOM 411 O GLU A 26 -1.494 -14.592 -2.946 1.00 0.00 O ATOM 412 CB GLU A 26 -3.423 -16.222 -0.675 1.00 0.00 C ATOM 413 CG GLU A 26 -2.356 -17.281 -0.883 1.00 0.00 C ATOM 414 CD GLU A 26 -2.852 -18.664 -0.528 1.00 0.00 C ATOM 415 OE1 GLU A 26 -3.037 -19.492 -1.445 1.00 0.00 O ATOM 416 OE2 GLU A 26 -3.077 -18.925 0.671 1.00 0.00 O ATOM 0 H GLU A 26 -4.836 -13.875 -1.397 1.00 0.00 H new ATOM 0 HA GLU A 26 -2.096 -14.527 -0.528 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -3.712 -16.214 0.376 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -4.309 -16.497 -1.247 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -2.031 -17.269 -1.923 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -1.484 -17.041 -0.274 1.00 0.00 H new ATOM 423 N ARG A 27 -3.668 -14.970 -3.403 1.00 0.00 N ATOM 424 CA ARG A 27 -3.461 -15.099 -4.841 1.00 0.00 C ATOM 425 C ARG A 27 -3.247 -13.739 -5.486 1.00 0.00 C ATOM 426 O ARG A 27 -3.689 -12.718 -4.955 1.00 0.00 O ATOM 427 CB ARG A 27 -4.648 -15.803 -5.499 1.00 0.00 C ATOM 428 CG ARG A 27 -4.751 -17.281 -5.162 1.00 0.00 C ATOM 429 CD ARG A 27 -5.896 -17.935 -5.916 1.00 0.00 C ATOM 430 NE ARG A 27 -5.942 -19.379 -5.705 1.00 0.00 N ATOM 431 CZ ARG A 27 -6.735 -20.204 -6.383 1.00 0.00 C ATOM 432 NH1 ARG A 27 -7.575 -19.723 -7.297 1.00 0.00 N ATOM 433 NH2 ARG A 27 -6.686 -21.506 -6.155 1.00 0.00 N ATOM 0 H ARG A 27 -4.643 -15.033 -3.110 1.00 0.00 H new ATOM 0 HA ARG A 27 -2.565 -15.701 -4.992 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -5.568 -15.306 -5.193 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -4.570 -15.691 -6.580 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -3.815 -17.780 -5.412 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -4.901 -17.403 -4.089 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -6.839 -17.493 -5.596 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -5.792 -17.728 -6.981 1.00 0.00 H new ATOM 0 HE ARG A 27 -5.329 -19.779 -4.995 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -7.611 -18.720 -7.479 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -8.182 -20.358 -7.816 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -6.040 -21.878 -5.459 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -7.294 -22.138 -6.675 1.00 0.00 H new ATOM 447 N ARG A 28 -2.572 -13.735 -6.628 1.00 0.00 N ATOM 448 CA ARG A 28 -2.266 -12.499 -7.327 1.00 0.00 C ATOM 449 C ARG A 28 -2.573 -12.599 -8.818 1.00 0.00 C ATOM 450 O ARG A 28 -2.198 -13.564 -9.490 1.00 0.00 O ATOM 451 CB ARG A 28 -0.801 -12.105 -7.119 1.00 0.00 C ATOM 452 CG ARG A 28 0.202 -13.198 -7.456 1.00 0.00 C ATOM 453 CD ARG A 28 1.625 -12.694 -7.288 1.00 0.00 C ATOM 454 NE ARG A 28 2.615 -13.757 -7.439 1.00 0.00 N ATOM 455 CZ ARG A 28 3.920 -13.590 -7.242 1.00 0.00 C ATOM 456 NH1 ARG A 28 4.411 -12.377 -7.010 1.00 0.00 N ATOM 457 NH2 ARG A 28 4.743 -14.628 -7.313 1.00 0.00 N ATOM 0 H ARG A 28 -2.226 -14.577 -7.089 1.00 0.00 H new ATOM 0 HA ARG A 28 -2.906 -11.725 -6.904 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -0.584 -11.229 -7.730 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -0.662 -11.810 -6.079 1.00 0.00 H new ATOM 0 HG2 ARG A 28 0.038 -14.060 -6.810 1.00 0.00 H new ATOM 0 HG3 ARG A 28 0.049 -13.535 -8.481 1.00 0.00 H new ATOM 0 HD2 ARG A 28 1.820 -11.913 -8.023 1.00 0.00 H new ATOM 0 HD3 ARG A 28 1.732 -12.239 -6.303 1.00 0.00 H new ATOM 0 HE ARG A 28 2.286 -14.683 -7.712 1.00 0.00 H new ATOM 0 HH11 ARG A 28 3.787 -11.571 -6.983 1.00 0.00 H new ATOM 0 HH12 ARG A 28 5.412 -12.252 -6.859 1.00 0.00 H new ATOM 0 HH21 ARG A 28 4.376 -15.557 -7.519 1.00 0.00 H new ATOM 0 HH22 ARG A 28 5.743 -14.497 -7.162 1.00 0.00 H new ATOM 471 N TRP A 29 -3.278 -11.598 -9.314 1.00 0.00 N ATOM 472 CA TRP A 29 -3.548 -11.462 -10.736 1.00 0.00 C ATOM 473 C TRP A 29 -2.531 -10.526 -11.370 1.00 0.00 C ATOM 474 O TRP A 29 -2.493 -9.338 -11.048 1.00 0.00 O ATOM 475 CB TRP A 29 -4.955 -10.901 -10.975 1.00 0.00 C ATOM 476 CG TRP A 29 -6.066 -11.863 -10.682 1.00 0.00 C ATOM 477 CD1 TRP A 29 -6.701 -12.668 -11.581 1.00 0.00 C ATOM 478 CD2 TRP A 29 -6.685 -12.111 -9.413 1.00 0.00 C ATOM 479 NE1 TRP A 29 -7.682 -13.397 -10.951 1.00 0.00 N ATOM 480 CE2 TRP A 29 -7.686 -13.077 -9.617 1.00 0.00 C ATOM 481 CE3 TRP A 29 -6.486 -11.611 -8.124 1.00 0.00 C ATOM 482 CZ2 TRP A 29 -8.486 -13.548 -8.580 1.00 0.00 C ATOM 483 CZ3 TRP A 29 -7.278 -12.080 -7.095 1.00 0.00 C ATOM 484 CH2 TRP A 29 -8.267 -13.041 -7.328 1.00 0.00 C ATOM 0 H TRP A 29 -3.680 -10.855 -8.742 1.00 0.00 H new ATOM 0 HA TRP A 29 -3.478 -12.451 -11.188 1.00 0.00 H new ATOM 0 HB2 TRP A 29 -5.088 -10.013 -10.357 1.00 0.00 H new ATOM 0 HB3 TRP A 29 -5.033 -10.581 -12.014 1.00 0.00 H new ATOM 0 HD1 TRP A 29 -6.468 -12.725 -12.634 1.00 0.00 H new ATOM 0 HE1 TRP A 29 -8.305 -14.067 -11.402 1.00 0.00 H new ATOM 0 HE3 TRP A 29 -5.724 -10.869 -7.935 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 -9.253 -14.288 -8.757 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 -7.132 -11.699 -6.095 1.00 0.00 H new ATOM 0 HH2 TRP A 29 -8.870 -13.390 -6.503 1.00 0.00 H new ATOM 495 N GLU A 30 -1.700 -11.060 -12.250 1.00 0.00 N ATOM 496 CA GLU A 30 -0.761 -10.236 -12.997 1.00 0.00 C ATOM 497 C GLU A 30 -1.538 -9.372 -13.983 1.00 0.00 C ATOM 498 O GLU A 30 -2.364 -9.886 -14.735 1.00 0.00 O ATOM 499 CB GLU A 30 0.235 -11.113 -13.752 1.00 0.00 C ATOM 500 CG GLU A 30 1.314 -10.323 -14.472 1.00 0.00 C ATOM 501 CD GLU A 30 1.955 -11.112 -15.591 1.00 0.00 C ATOM 502 OE1 GLU A 30 2.739 -12.038 -15.301 1.00 0.00 O ATOM 503 OE2 GLU A 30 1.657 -10.819 -16.766 1.00 0.00 O ATOM 0 H GLU A 30 -1.655 -12.056 -12.465 1.00 0.00 H new ATOM 0 HA GLU A 30 -0.207 -9.603 -12.304 1.00 0.00 H new ATOM 0 HB2 GLU A 30 0.707 -11.800 -13.050 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -0.305 -11.720 -14.478 1.00 0.00 H new ATOM 0 HG2 GLU A 30 0.882 -9.408 -14.877 1.00 0.00 H new ATOM 0 HG3 GLU A 30 2.080 -10.024 -13.757 1.00 0.00 H new ATOM 510 N VAL A 31 -1.285 -8.074 -13.987 1.00 0.00 N ATOM 511 CA VAL A 31 -2.052 -7.176 -14.833 1.00 0.00 C ATOM 512 C VAL A 31 -1.207 -5.997 -15.310 1.00 0.00 C ATOM 513 O VAL A 31 -0.290 -5.553 -14.616 1.00 0.00 O ATOM 514 CB VAL A 31 -3.308 -6.659 -14.090 1.00 0.00 C ATOM 515 CG1 VAL A 31 -2.925 -5.799 -12.894 1.00 0.00 C ATOM 516 CG2 VAL A 31 -4.225 -5.899 -15.034 1.00 0.00 C ATOM 0 H VAL A 31 -0.565 -7.623 -13.422 1.00 0.00 H new ATOM 0 HA VAL A 31 -2.367 -7.745 -15.708 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.853 -7.526 -13.716 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -3.828 -5.451 -12.392 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.328 -6.389 -12.198 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.345 -4.941 -13.234 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -5.099 -5.547 -14.487 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -3.691 -5.046 -15.452 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -4.544 -6.559 -15.841 1.00 0.00 H new ATOM 526 N LEU A 32 -1.508 -5.514 -16.508 1.00 0.00 N ATOM 527 CA LEU A 32 -0.838 -4.346 -17.057 1.00 0.00 C ATOM 528 C LEU A 32 -1.511 -3.074 -16.563 1.00 0.00 C ATOM 529 O LEU A 32 -2.723 -2.888 -16.737 1.00 0.00 O ATOM 530 CB LEU A 32 -0.851 -4.369 -18.593 1.00 0.00 C ATOM 531 CG LEU A 32 0.110 -5.360 -19.263 1.00 0.00 C ATOM 532 CD1 LEU A 32 -0.322 -6.802 -19.032 1.00 0.00 C ATOM 533 CD2 LEU A 32 0.208 -5.066 -20.750 1.00 0.00 C ATOM 0 H LEU A 32 -2.217 -5.917 -17.121 1.00 0.00 H new ATOM 0 HA LEU A 32 0.198 -4.366 -16.719 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -1.864 -4.597 -18.924 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -0.616 -3.367 -18.953 1.00 0.00 H new ATOM 0 HG LEU A 32 1.093 -5.235 -18.809 1.00 0.00 H new ATOM 0 HD11 LEU A 32 0.382 -7.475 -19.521 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -0.340 -7.010 -17.962 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -1.318 -6.954 -19.447 1.00 0.00 H new ATOM 0 HD21 LEU A 32 0.892 -5.775 -21.217 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -0.778 -5.160 -21.205 1.00 0.00 H new ATOM 0 HD23 LEU A 32 0.580 -4.052 -20.897 1.00 0.00 H new ATOM 545 N LEU A 33 -0.726 -2.203 -15.946 1.00 0.00 N ATOM 546 CA LEU A 33 -1.238 -0.946 -15.432 1.00 0.00 C ATOM 547 C LEU A 33 -1.545 0.007 -16.584 1.00 0.00 C ATOM 548 O LEU A 33 -0.826 0.042 -17.581 1.00 0.00 O ATOM 549 CB LEU A 33 -0.220 -0.318 -14.473 1.00 0.00 C ATOM 550 CG LEU A 33 -0.704 0.927 -13.729 1.00 0.00 C ATOM 551 CD1 LEU A 33 -1.938 0.604 -12.903 1.00 0.00 C ATOM 552 CD2 LEU A 33 0.397 1.480 -12.837 1.00 0.00 C ATOM 0 H LEU A 33 0.272 -2.347 -15.790 1.00 0.00 H new ATOM 0 HA LEU A 33 -2.161 -1.136 -14.885 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.074 -1.068 -13.739 1.00 0.00 H new ATOM 0 HB3 LEU A 33 0.675 -0.058 -15.039 1.00 0.00 H new ATOM 0 HG LEU A 33 -0.966 1.687 -14.466 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -2.270 1.500 -12.379 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -2.733 0.252 -13.560 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -1.697 -0.172 -12.177 1.00 0.00 H new ATOM 0 HD21 LEU A 33 0.033 2.366 -12.316 1.00 0.00 H new ATOM 0 HD22 LEU A 33 0.688 0.724 -12.108 1.00 0.00 H new ATOM 0 HD23 LEU A 33 1.260 1.747 -13.447 1.00 0.00 H new ATOM 564 N HIS A 34 -2.636 0.752 -16.467 1.00 0.00 N ATOM 565 CA HIS A 34 -3.009 1.709 -17.501 1.00 0.00 C ATOM 566 C HIS A 34 -3.183 3.108 -16.928 1.00 0.00 C ATOM 567 O HIS A 34 -3.157 4.086 -17.675 1.00 0.00 O ATOM 568 CB HIS A 34 -4.274 1.263 -18.241 1.00 0.00 C ATOM 569 CG HIS A 34 -4.014 0.209 -19.280 1.00 0.00 C ATOM 570 ND1 HIS A 34 -3.726 0.506 -20.595 1.00 0.00 N ATOM 571 CD2 HIS A 34 -3.990 -1.144 -19.194 1.00 0.00 C ATOM 572 CE1 HIS A 34 -3.541 -0.612 -21.270 1.00 0.00 C ATOM 573 NE2 HIS A 34 -3.695 -1.628 -20.443 1.00 0.00 N ATOM 0 H HIS A 34 -3.275 0.713 -15.673 1.00 0.00 H new ATOM 0 HA HIS A 34 -2.192 1.743 -18.221 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -4.994 0.880 -17.518 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -4.732 2.129 -18.719 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -4.170 -1.732 -18.306 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -3.304 -0.683 -22.321 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -3.609 -2.613 -20.692 1.00 0.00 H new ATOM 582 N ASP A 35 -3.370 3.188 -15.609 1.00 0.00 N ATOM 583 CA ASP A 35 -3.394 4.465 -14.892 1.00 0.00 C ATOM 584 C ASP A 35 -3.514 4.194 -13.394 1.00 0.00 C ATOM 585 O ASP A 35 -3.958 3.118 -12.995 1.00 0.00 O ATOM 586 CB ASP A 35 -4.553 5.351 -15.358 1.00 0.00 C ATOM 587 CG ASP A 35 -4.330 6.813 -15.013 1.00 0.00 C ATOM 588 OD1 ASP A 35 -4.514 7.190 -13.837 1.00 0.00 O ATOM 589 OD2 ASP A 35 -3.958 7.592 -15.916 1.00 0.00 O ATOM 0 H ASP A 35 -3.508 2.374 -15.010 1.00 0.00 H new ATOM 0 HA ASP A 35 -2.467 4.998 -15.104 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -4.676 5.248 -16.436 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.479 5.008 -14.897 1.00 0.00 H new ATOM 594 N VAL A 36 -3.127 5.157 -12.569 1.00 0.00 N ATOM 595 CA VAL A 36 -3.156 4.984 -11.123 1.00 0.00 C ATOM 596 C VAL A 36 -3.136 6.341 -10.420 1.00 0.00 C ATOM 597 O VAL A 36 -2.455 7.269 -10.857 1.00 0.00 O ATOM 598 CB VAL A 36 -1.974 4.115 -10.628 1.00 0.00 C ATOM 599 CG1 VAL A 36 -0.637 4.746 -10.991 1.00 0.00 C ATOM 600 CG2 VAL A 36 -2.070 3.873 -9.127 1.00 0.00 C ATOM 0 H VAL A 36 -2.788 6.068 -12.877 1.00 0.00 H new ATOM 0 HA VAL A 36 -4.082 4.466 -10.875 1.00 0.00 H new ATOM 0 HB VAL A 36 -2.035 3.151 -11.132 1.00 0.00 H new ATOM 0 HG11 VAL A 36 0.174 4.113 -10.630 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -0.564 4.847 -12.074 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -0.562 5.730 -10.529 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -1.229 3.260 -8.803 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -2.047 4.828 -8.602 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -3.003 3.357 -8.901 1.00 0.00 H new ATOM 610 N SER A 37 -3.893 6.456 -9.338 1.00 0.00 N ATOM 611 CA SER A 37 -3.981 7.703 -8.602 1.00 0.00 C ATOM 612 C SER A 37 -4.455 7.457 -7.173 1.00 0.00 C ATOM 613 O SER A 37 -4.496 6.317 -6.714 1.00 0.00 O ATOM 614 CB SER A 37 -4.940 8.645 -9.323 1.00 0.00 C ATOM 615 OG SER A 37 -6.217 8.050 -9.450 1.00 0.00 O ATOM 0 H SER A 37 -4.455 5.697 -8.952 1.00 0.00 H new ATOM 0 HA SER A 37 -2.991 8.157 -8.553 1.00 0.00 H new ATOM 0 HB2 SER A 37 -5.022 9.582 -8.772 1.00 0.00 H new ATOM 0 HB3 SER A 37 -4.546 8.889 -10.310 1.00 0.00 H new ATOM 0 HG SER A 37 -6.149 7.088 -9.275 1.00 0.00 H new ATOM 621 N LEU A 38 -4.841 8.527 -6.486 1.00 0.00 N ATOM 622 CA LEU A 38 -5.268 8.437 -5.092 1.00 0.00 C ATOM 623 C LEU A 38 -6.788 8.478 -4.994 1.00 0.00 C ATOM 624 O LEU A 38 -7.352 8.790 -3.950 1.00 0.00 O ATOM 625 CB LEU A 38 -4.659 9.576 -4.270 1.00 0.00 C ATOM 626 CG LEU A 38 -3.129 9.615 -4.244 1.00 0.00 C ATOM 627 CD1 LEU A 38 -2.639 10.772 -3.389 1.00 0.00 C ATOM 628 CD2 LEU A 38 -2.566 8.296 -3.729 1.00 0.00 C ATOM 0 H LEU A 38 -4.867 9.471 -6.873 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.917 7.487 -4.689 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -5.024 10.524 -4.666 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.022 9.498 -3.245 1.00 0.00 H new ATOM 0 HG LEU A 38 -2.774 9.765 -5.264 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -1.549 10.784 -3.382 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -3.009 11.711 -3.801 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -3.007 10.653 -2.370 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.477 8.345 -3.718 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.931 8.115 -2.718 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.887 7.484 -4.382 1.00 0.00 H new ATOM 640 N HIS A 39 -7.438 8.168 -6.104 1.00 0.00 N ATOM 641 CA HIS A 39 -8.901 8.099 -6.160 1.00 0.00 C ATOM 642 C HIS A 39 -9.327 6.943 -7.048 1.00 0.00 C ATOM 643 O HIS A 39 -10.472 6.875 -7.499 1.00 0.00 O ATOM 644 CB HIS A 39 -9.496 9.403 -6.702 1.00 0.00 C ATOM 645 CG HIS A 39 -8.786 9.909 -7.909 1.00 0.00 C ATOM 646 ND1 HIS A 39 -9.132 9.559 -9.190 1.00 0.00 N ATOM 647 CD2 HIS A 39 -7.712 10.715 -8.013 1.00 0.00 C ATOM 648 CE1 HIS A 39 -8.294 10.125 -10.035 1.00 0.00 C ATOM 649 NE2 HIS A 39 -7.425 10.835 -9.344 1.00 0.00 N ATOM 0 H HIS A 39 -6.977 7.957 -6.989 1.00 0.00 H new ATOM 0 HA HIS A 39 -9.272 7.945 -5.147 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -10.546 9.243 -6.946 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -9.462 10.163 -5.922 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -7.178 11.180 -7.197 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -8.316 10.024 -11.110 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -6.662 11.385 -9.738 1.00 0.00 H new ATOM 658 N GLY A 40 -8.389 6.050 -7.318 1.00 0.00 N ATOM 659 CA GLY A 40 -8.682 4.913 -8.157 1.00 0.00 C ATOM 660 C GLY A 40 -7.493 4.489 -8.985 1.00 0.00 C ATOM 661 O GLY A 40 -6.541 5.253 -9.161 1.00 0.00 O ATOM 0 H GLY A 40 -7.431 6.094 -6.971 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -9.004 4.078 -7.534 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.514 5.157 -8.818 1.00 0.00 H new ATOM 665 N ILE A 41 -7.556 3.273 -9.491 1.00 0.00 N ATOM 666 CA ILE A 41 -6.500 2.721 -10.323 1.00 0.00 C ATOM 667 C ILE A 41 -7.113 1.967 -11.499 1.00 0.00 C ATOM 668 O ILE A 41 -8.054 1.189 -11.324 1.00 0.00 O ATOM 669 CB ILE A 41 -5.563 1.790 -9.506 1.00 0.00 C ATOM 670 CG1 ILE A 41 -4.525 1.121 -10.412 1.00 0.00 C ATOM 671 CG2 ILE A 41 -6.364 0.741 -8.749 1.00 0.00 C ATOM 672 CD1 ILE A 41 -3.565 0.209 -9.673 1.00 0.00 C ATOM 0 H ILE A 41 -8.340 2.638 -9.338 1.00 0.00 H new ATOM 0 HA ILE A 41 -5.894 3.545 -10.701 1.00 0.00 H new ATOM 0 HB ILE A 41 -5.034 2.407 -8.780 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -5.043 0.544 -11.178 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -3.954 1.894 -10.927 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -5.685 0.102 -8.185 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -7.052 1.234 -8.063 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -6.929 0.135 -9.456 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -2.860 -0.228 -10.381 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -3.019 0.785 -8.926 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.125 -0.586 -9.181 1.00 0.00 H new ATOM 684 N LEU A 42 -6.593 2.213 -12.692 1.00 0.00 N ATOM 685 CA LEU A 42 -7.150 1.632 -13.903 1.00 0.00 C ATOM 686 C LEU A 42 -6.176 0.639 -14.524 1.00 0.00 C ATOM 687 O LEU A 42 -5.036 0.982 -14.851 1.00 0.00 O ATOM 688 CB LEU A 42 -7.484 2.733 -14.911 1.00 0.00 C ATOM 689 CG LEU A 42 -8.105 2.249 -16.224 1.00 0.00 C ATOM 690 CD1 LEU A 42 -9.510 1.717 -15.992 1.00 0.00 C ATOM 691 CD2 LEU A 42 -8.116 3.367 -17.255 1.00 0.00 C ATOM 0 H LEU A 42 -5.783 2.813 -12.847 1.00 0.00 H new ATOM 0 HA LEU A 42 -8.064 1.101 -13.637 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.170 3.437 -14.441 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -6.571 3.282 -15.140 1.00 0.00 H new ATOM 0 HG LEU A 42 -7.494 1.434 -16.610 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.932 1.379 -16.938 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -9.472 0.882 -15.292 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -10.135 2.508 -15.578 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -8.561 3.003 -18.181 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -8.700 4.205 -16.876 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.094 3.694 -17.448 1.00 0.00 H new ATOM 703 N VAL A 43 -6.625 -0.594 -14.687 1.00 0.00 N ATOM 704 CA VAL A 43 -5.806 -1.629 -15.293 1.00 0.00 C ATOM 705 C VAL A 43 -6.540 -2.289 -16.452 1.00 0.00 C ATOM 706 O VAL A 43 -7.749 -2.112 -16.617 1.00 0.00 O ATOM 707 CB VAL A 43 -5.399 -2.713 -14.275 1.00 0.00 C ATOM 708 CG1 VAL A 43 -4.546 -2.125 -13.164 1.00 0.00 C ATOM 709 CG2 VAL A 43 -6.625 -3.403 -13.697 1.00 0.00 C ATOM 0 H VAL A 43 -7.556 -0.903 -14.407 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.903 -1.140 -15.658 1.00 0.00 H new ATOM 0 HB VAL A 43 -4.804 -3.458 -14.803 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.273 -2.911 -12.460 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.642 -1.690 -13.591 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.110 -1.351 -12.643 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -6.311 -4.163 -12.982 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.253 -2.668 -13.193 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.191 -3.873 -14.501 1.00 0.00 H new ATOM 719 N GLY A 44 -5.802 -3.042 -17.251 1.00 0.00 N ATOM 720 CA GLY A 44 -6.401 -3.784 -18.342 1.00 0.00 C ATOM 721 C GLY A 44 -6.251 -5.268 -18.118 1.00 0.00 C ATOM 722 O GLY A 44 -5.225 -5.851 -18.467 1.00 0.00 O ATOM 0 H GLY A 44 -4.792 -3.154 -17.163 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -7.457 -3.528 -18.427 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -5.928 -3.503 -19.283 1.00 0.00 H new ATOM 726 N GLN A 45 -7.262 -5.875 -17.519 1.00 0.00 N ATOM 727 CA GLN A 45 -7.158 -7.253 -17.070 1.00 0.00 C ATOM 728 C GLN A 45 -8.123 -8.168 -17.813 1.00 0.00 C ATOM 729 O GLN A 45 -9.341 -8.044 -17.684 1.00 0.00 O ATOM 730 CB GLN A 45 -7.417 -7.330 -15.568 1.00 0.00 C ATOM 731 CG GLN A 45 -7.420 -8.748 -15.018 1.00 0.00 C ATOM 732 CD GLN A 45 -7.590 -8.798 -13.515 1.00 0.00 C ATOM 733 OE1 GLN A 45 -7.127 -7.917 -12.794 1.00 0.00 O ATOM 734 NE2 GLN A 45 -8.277 -9.821 -13.036 1.00 0.00 N ATOM 0 H GLN A 45 -8.163 -5.436 -17.333 1.00 0.00 H new ATOM 0 HA GLN A 45 -6.147 -7.597 -17.287 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.655 -6.750 -15.047 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.378 -6.864 -15.350 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.225 -9.313 -15.488 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.485 -9.239 -15.289 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -8.644 -10.531 -13.670 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -8.440 -9.901 -12.032 1.00 0.00 H new ATOM 743 N PRO A 46 -7.575 -9.084 -18.621 1.00 0.00 N ATOM 744 CA PRO A 46 -8.337 -10.146 -19.269 1.00 0.00 C ATOM 745 C PRO A 46 -8.531 -11.346 -18.339 1.00 0.00 C ATOM 746 O PRO A 46 -9.290 -12.266 -18.640 1.00 0.00 O ATOM 747 CB PRO A 46 -7.463 -10.540 -20.475 1.00 0.00 C ATOM 748 CG PRO A 46 -6.228 -9.691 -20.398 1.00 0.00 C ATOM 749 CD PRO A 46 -6.167 -9.136 -19.003 1.00 0.00 C ATOM 0 HA PRO A 46 -9.339 -9.821 -19.549 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -7.209 -11.599 -20.441 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -7.994 -10.370 -21.412 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -5.339 -10.282 -20.618 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -6.266 -8.887 -21.132 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -5.589 -9.776 -18.337 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -5.703 -8.150 -18.979 1.00 0.00 H new ATOM 757 N GLN A 47 -7.832 -11.325 -17.211 1.00 0.00 N ATOM 758 CA GLN A 47 -7.916 -12.400 -16.233 1.00 0.00 C ATOM 759 C GLN A 47 -9.247 -12.336 -15.498 1.00 0.00 C ATOM 760 O GLN A 47 -9.708 -11.258 -15.124 1.00 0.00 O ATOM 761 CB GLN A 47 -6.755 -12.331 -15.234 1.00 0.00 C ATOM 762 CG GLN A 47 -5.411 -12.785 -15.796 1.00 0.00 C ATOM 763 CD GLN A 47 -4.906 -11.918 -16.934 1.00 0.00 C ATOM 764 OE1 GLN A 47 -5.189 -12.179 -18.102 1.00 0.00 O ATOM 765 NE2 GLN A 47 -4.157 -10.881 -16.604 1.00 0.00 N ATOM 0 H GLN A 47 -7.197 -10.570 -16.951 1.00 0.00 H new ATOM 0 HA GLN A 47 -7.847 -13.349 -16.765 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -6.658 -11.305 -14.878 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -7.000 -12.947 -14.368 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -4.672 -12.785 -14.994 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -5.501 -13.813 -16.146 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -3.944 -10.697 -15.624 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -3.792 -10.264 -17.330 1.00 0.00 H new ATOM 774 N ASP A 48 -9.848 -13.492 -15.285 1.00 0.00 N ATOM 775 CA ASP A 48 -11.188 -13.568 -14.722 1.00 0.00 C ATOM 776 C ASP A 48 -11.171 -13.384 -13.214 1.00 0.00 C ATOM 777 O ASP A 48 -10.211 -13.765 -12.537 1.00 0.00 O ATOM 778 CB ASP A 48 -11.841 -14.906 -15.068 1.00 0.00 C ATOM 779 CG ASP A 48 -12.173 -15.023 -16.538 1.00 0.00 C ATOM 780 OD1 ASP A 48 -11.354 -15.585 -17.299 1.00 0.00 O ATOM 781 OD2 ASP A 48 -13.259 -14.559 -16.942 1.00 0.00 O ATOM 0 H ASP A 48 -9.428 -14.398 -15.494 1.00 0.00 H new ATOM 0 HA ASP A 48 -11.771 -12.758 -15.160 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -11.172 -15.718 -14.784 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -12.752 -15.025 -14.482 1.00 0.00 H new ATOM 786 N TRP A 49 -12.241 -12.794 -12.694 1.00 0.00 N ATOM 787 CA TRP A 49 -12.384 -12.596 -11.262 1.00 0.00 C ATOM 788 C TRP A 49 -12.750 -13.910 -10.578 1.00 0.00 C ATOM 789 O TRP A 49 -13.622 -14.641 -11.044 1.00 0.00 O ATOM 790 CB TRP A 49 -13.420 -11.499 -10.964 1.00 0.00 C ATOM 791 CG TRP A 49 -12.876 -10.114 -11.183 1.00 0.00 C ATOM 792 CD1 TRP A 49 -13.485 -9.058 -11.819 1.00 0.00 C ATOM 793 CD2 TRP A 49 -11.590 -9.641 -10.765 1.00 0.00 C ATOM 794 NE1 TRP A 49 -12.650 -7.965 -11.809 1.00 0.00 N ATOM 795 CE2 TRP A 49 -11.484 -8.299 -11.172 1.00 0.00 C ATOM 796 CE3 TRP A 49 -10.516 -10.225 -10.085 1.00 0.00 C ATOM 797 CZ2 TRP A 49 -10.351 -7.535 -10.918 1.00 0.00 C ATOM 798 CZ3 TRP A 49 -9.391 -9.464 -9.835 1.00 0.00 C ATOM 799 CH2 TRP A 49 -9.316 -8.131 -10.250 1.00 0.00 C ATOM 0 H TRP A 49 -13.023 -12.444 -13.247 1.00 0.00 H new ATOM 0 HA TRP A 49 -11.428 -12.263 -10.859 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -14.293 -11.647 -11.599 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -13.757 -11.594 -9.932 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -14.471 -9.083 -12.260 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -12.864 -7.053 -12.211 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -10.566 -11.254 -9.761 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -10.290 -6.505 -11.237 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -8.556 -9.905 -9.311 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -8.424 -7.560 -10.039 1.00 0.00 H new ATOM 810 N ASN A 50 -12.069 -14.198 -9.473 1.00 0.00 N ATOM 811 CA ASN A 50 -12.180 -15.497 -8.803 1.00 0.00 C ATOM 812 C ASN A 50 -13.571 -15.739 -8.231 1.00 0.00 C ATOM 813 O ASN A 50 -14.027 -16.880 -8.162 1.00 0.00 O ATOM 814 CB ASN A 50 -11.138 -15.621 -7.686 1.00 0.00 C ATOM 815 CG ASN A 50 -11.349 -14.631 -6.547 1.00 0.00 C ATOM 816 OD1 ASN A 50 -11.822 -13.509 -6.752 1.00 0.00 O ATOM 817 ND2 ASN A 50 -11.008 -15.043 -5.337 1.00 0.00 N ATOM 0 H ASN A 50 -11.430 -13.547 -9.017 1.00 0.00 H new ATOM 0 HA ASN A 50 -11.995 -16.256 -9.563 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -11.165 -16.635 -7.286 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -10.144 -15.471 -8.108 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -11.133 -14.426 -4.534 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -10.620 -15.977 -5.207 1.00 0.00 H new ATOM 824 N GLY A 51 -14.235 -14.678 -7.807 1.00 0.00 N ATOM 825 CA GLY A 51 -15.566 -14.819 -7.262 1.00 0.00 C ATOM 826 C GLY A 51 -16.466 -13.676 -7.661 1.00 0.00 C ATOM 827 O GLY A 51 -17.392 -13.853 -8.450 1.00 0.00 O ATOM 0 H GLY A 51 -13.877 -13.723 -7.830 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -16.000 -15.758 -7.605 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -15.508 -14.872 -6.175 1.00 0.00 H new ATOM 831 N ASP A 52 -16.178 -12.502 -7.124 1.00 0.00 N ATOM 832 CA ASP A 52 -16.961 -11.310 -7.408 1.00 0.00 C ATOM 833 C ASP A 52 -16.076 -10.077 -7.266 1.00 0.00 C ATOM 834 O ASP A 52 -15.259 -10.008 -6.351 1.00 0.00 O ATOM 835 CB ASP A 52 -18.152 -11.223 -6.449 1.00 0.00 C ATOM 836 CG ASP A 52 -19.111 -10.102 -6.799 1.00 0.00 C ATOM 837 OD1 ASP A 52 -20.107 -10.362 -7.507 1.00 0.00 O ATOM 838 OD2 ASP A 52 -18.883 -8.961 -6.358 1.00 0.00 O ATOM 0 H ASP A 52 -15.400 -12.348 -6.483 1.00 0.00 H new ATOM 0 HA ASP A 52 -17.342 -11.361 -8.428 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -18.690 -12.171 -6.459 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -17.784 -11.076 -5.433 1.00 0.00 H new ATOM 843 N PRO A 53 -16.209 -9.105 -8.179 1.00 0.00 N ATOM 844 CA PRO A 53 -15.391 -7.883 -8.173 1.00 0.00 C ATOM 845 C PRO A 53 -15.563 -7.026 -6.914 1.00 0.00 C ATOM 846 O PRO A 53 -14.716 -6.189 -6.614 1.00 0.00 O ATOM 847 CB PRO A 53 -15.869 -7.115 -9.410 1.00 0.00 C ATOM 848 CG PRO A 53 -17.200 -7.693 -9.743 1.00 0.00 C ATOM 849 CD PRO A 53 -17.147 -9.130 -9.314 1.00 0.00 C ATOM 0 HA PRO A 53 -14.330 -8.131 -8.184 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -15.944 -6.047 -9.205 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -15.171 -7.232 -10.239 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -17.997 -7.160 -9.225 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -17.404 -7.612 -10.811 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -18.129 -9.499 -9.017 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -16.792 -9.777 -10.116 1.00 0.00 H new ATOM 857 N GLN A 54 -16.639 -7.236 -6.164 1.00 0.00 N ATOM 858 CA GLN A 54 -16.893 -6.421 -4.977 1.00 0.00 C ATOM 859 C GLN A 54 -16.083 -6.923 -3.787 1.00 0.00 C ATOM 860 O GLN A 54 -16.173 -6.382 -2.686 1.00 0.00 O ATOM 861 CB GLN A 54 -18.379 -6.410 -4.625 1.00 0.00 C ATOM 862 CG GLN A 54 -19.257 -5.808 -5.706 1.00 0.00 C ATOM 863 CD GLN A 54 -20.716 -5.798 -5.310 1.00 0.00 C ATOM 864 OE1 GLN A 54 -21.445 -6.754 -5.561 1.00 0.00 O ATOM 865 NE2 GLN A 54 -21.152 -4.719 -4.691 1.00 0.00 N ATOM 0 H GLN A 54 -17.341 -7.952 -6.351 1.00 0.00 H new ATOM 0 HA GLN A 54 -16.582 -5.402 -5.208 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -18.705 -7.432 -4.432 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -18.520 -5.850 -3.701 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -18.930 -4.789 -5.913 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -19.136 -6.375 -6.629 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -20.513 -3.947 -4.501 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -22.128 -4.656 -4.402 1.00 0.00 H new ATOM 874 N ARG A 55 -15.304 -7.968 -4.012 1.00 0.00 N ATOM 875 CA ARG A 55 -14.414 -8.492 -2.994 1.00 0.00 C ATOM 876 C ARG A 55 -13.161 -7.628 -2.914 1.00 0.00 C ATOM 877 O ARG A 55 -12.720 -7.076 -3.919 1.00 0.00 O ATOM 878 CB ARG A 55 -14.049 -9.943 -3.307 1.00 0.00 C ATOM 879 CG ARG A 55 -15.250 -10.872 -3.325 1.00 0.00 C ATOM 880 CD ARG A 55 -14.857 -12.286 -3.702 1.00 0.00 C ATOM 881 NE ARG A 55 -13.977 -12.902 -2.712 1.00 0.00 N ATOM 882 CZ ARG A 55 -14.319 -13.961 -1.982 1.00 0.00 C ATOM 883 NH1 ARG A 55 -15.523 -14.506 -2.119 1.00 0.00 N ATOM 884 NH2 ARG A 55 -13.458 -14.470 -1.112 1.00 0.00 N ATOM 0 H ARG A 55 -15.272 -8.472 -4.898 1.00 0.00 H new ATOM 0 HA ARG A 55 -14.919 -8.468 -2.029 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.551 -9.985 -4.276 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -13.334 -10.299 -2.566 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -15.723 -10.875 -2.343 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -15.989 -10.498 -4.034 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -15.756 -12.893 -3.813 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.358 -12.275 -4.671 1.00 0.00 H new ATOM 0 HE ARG A 55 -13.050 -12.499 -2.573 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -16.188 -14.113 -2.785 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -15.782 -15.318 -1.558 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -12.535 -14.050 -1.003 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -13.719 -15.282 -0.552 1.00 0.00 H new ATOM 898 N PRO A 56 -12.583 -7.488 -1.718 1.00 0.00 N ATOM 899 CA PRO A 56 -11.419 -6.630 -1.500 1.00 0.00 C ATOM 900 C PRO A 56 -10.177 -7.124 -2.236 1.00 0.00 C ATOM 901 O PRO A 56 -9.832 -8.307 -2.182 1.00 0.00 O ATOM 902 CB PRO A 56 -11.206 -6.673 0.016 1.00 0.00 C ATOM 903 CG PRO A 56 -11.901 -7.906 0.481 1.00 0.00 C ATOM 904 CD PRO A 56 -13.026 -8.155 -0.486 1.00 0.00 C ATOM 0 HA PRO A 56 -11.587 -5.624 -1.884 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -10.145 -6.704 0.262 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -11.619 -5.785 0.496 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -11.215 -8.753 0.504 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -12.282 -7.777 1.494 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -13.189 -9.221 -0.645 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -13.966 -7.740 -0.122 1.00 0.00 H new ATOM 912 N PHE A 57 -9.518 -6.208 -2.931 1.00 0.00 N ATOM 913 CA PHE A 57 -8.307 -6.522 -3.670 1.00 0.00 C ATOM 914 C PHE A 57 -7.143 -5.694 -3.140 1.00 0.00 C ATOM 915 O PHE A 57 -7.342 -4.726 -2.404 1.00 0.00 O ATOM 916 CB PHE A 57 -8.497 -6.247 -5.165 1.00 0.00 C ATOM 917 CG PHE A 57 -9.560 -7.088 -5.815 1.00 0.00 C ATOM 918 CD1 PHE A 57 -9.393 -8.456 -5.949 1.00 0.00 C ATOM 919 CD2 PHE A 57 -10.723 -6.509 -6.298 1.00 0.00 C ATOM 920 CE1 PHE A 57 -10.366 -9.231 -6.551 1.00 0.00 C ATOM 921 CE2 PHE A 57 -11.700 -7.279 -6.900 1.00 0.00 C ATOM 922 CZ PHE A 57 -11.521 -8.643 -7.026 1.00 0.00 C ATOM 0 H PHE A 57 -9.807 -5.232 -2.998 1.00 0.00 H new ATOM 0 HA PHE A 57 -8.089 -7.581 -3.535 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -8.748 -5.195 -5.301 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -7.550 -6.417 -5.678 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -8.492 -8.923 -5.579 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -10.867 -5.443 -6.203 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -10.223 -10.297 -6.650 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -12.602 -6.815 -7.271 1.00 0.00 H new ATOM 0 HZ PHE A 57 -12.283 -9.248 -7.495 1.00 0.00 H new ATOM 932 N GLU A 58 -5.933 -6.071 -3.518 1.00 0.00 N ATOM 933 CA GLU A 58 -4.742 -5.366 -3.077 1.00 0.00 C ATOM 934 C GLU A 58 -3.895 -4.981 -4.280 1.00 0.00 C ATOM 935 O GLU A 58 -3.646 -5.800 -5.159 1.00 0.00 O ATOM 936 CB GLU A 58 -3.930 -6.245 -2.127 1.00 0.00 C ATOM 937 CG GLU A 58 -4.728 -6.749 -0.938 1.00 0.00 C ATOM 938 CD GLU A 58 -3.987 -7.805 -0.144 1.00 0.00 C ATOM 939 OE1 GLU A 58 -3.088 -7.443 0.645 1.00 0.00 O ATOM 940 OE2 GLU A 58 -4.318 -9.002 -0.288 1.00 0.00 O ATOM 0 H GLU A 58 -5.750 -6.865 -4.132 1.00 0.00 H new ATOM 0 HA GLU A 58 -5.043 -4.462 -2.548 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -3.538 -7.099 -2.680 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -3.072 -5.679 -1.765 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -4.968 -5.910 -0.285 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -5.674 -7.161 -1.289 1.00 0.00 H new ATOM 947 N ALA A 59 -3.469 -3.735 -4.330 1.00 0.00 N ATOM 948 CA ALA A 59 -2.642 -3.267 -5.430 1.00 0.00 C ATOM 949 C ALA A 59 -1.177 -3.263 -5.029 1.00 0.00 C ATOM 950 O ALA A 59 -0.758 -2.449 -4.207 1.00 0.00 O ATOM 951 CB ALA A 59 -3.078 -1.877 -5.872 1.00 0.00 C ATOM 0 H ALA A 59 -3.680 -3.028 -3.625 1.00 0.00 H new ATOM 0 HA ALA A 59 -2.768 -3.950 -6.270 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -2.448 -1.543 -6.696 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -4.117 -1.909 -6.200 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -2.982 -1.183 -5.037 1.00 0.00 H new ATOM 957 N ARG A 60 -0.408 -4.190 -5.583 1.00 0.00 N ATOM 958 CA ARG A 60 1.019 -4.252 -5.310 1.00 0.00 C ATOM 959 C ARG A 60 1.813 -3.935 -6.577 1.00 0.00 C ATOM 960 O ARG A 60 1.802 -4.700 -7.543 1.00 0.00 O ATOM 961 CB ARG A 60 1.401 -5.625 -4.737 1.00 0.00 C ATOM 962 CG ARG A 60 2.858 -5.718 -4.307 1.00 0.00 C ATOM 963 CD ARG A 60 3.071 -6.778 -3.233 1.00 0.00 C ATOM 964 NE ARG A 60 2.740 -8.126 -3.692 1.00 0.00 N ATOM 965 CZ ARG A 60 2.618 -9.184 -2.885 1.00 0.00 C ATOM 966 NH1 ARG A 60 2.808 -9.065 -1.574 1.00 0.00 N ATOM 967 NH2 ARG A 60 2.300 -10.366 -3.395 1.00 0.00 N ATOM 0 H ARG A 60 -0.748 -4.908 -6.223 1.00 0.00 H new ATOM 0 HA ARG A 60 1.267 -3.501 -4.560 1.00 0.00 H new ATOM 0 HB2 ARG A 60 0.763 -5.843 -3.881 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.202 -6.391 -5.486 1.00 0.00 H new ATOM 0 HG2 ARG A 60 3.477 -5.950 -5.173 1.00 0.00 H new ATOM 0 HG3 ARG A 60 3.187 -4.749 -3.931 1.00 0.00 H new ATOM 0 HD2 ARG A 60 4.111 -6.755 -2.908 1.00 0.00 H new ATOM 0 HD3 ARG A 60 2.460 -6.535 -2.364 1.00 0.00 H new ATOM 0 HE ARG A 60 2.593 -8.268 -4.691 1.00 0.00 H new ATOM 0 HH11 ARG A 60 3.050 -8.158 -1.174 1.00 0.00 H new ATOM 0 HH12 ARG A 60 2.712 -9.880 -0.969 1.00 0.00 H new ATOM 0 HH21 ARG A 60 2.150 -10.464 -4.399 1.00 0.00 H new ATOM 0 HH22 ARG A 60 2.206 -11.177 -2.783 1.00 0.00 H new ATOM 981 N LEU A 61 2.481 -2.789 -6.561 1.00 0.00 N ATOM 982 CA LEU A 61 3.232 -2.306 -7.715 1.00 0.00 C ATOM 983 C LEU A 61 4.731 -2.467 -7.505 1.00 0.00 C ATOM 984 O LEU A 61 5.284 -1.987 -6.511 1.00 0.00 O ATOM 985 CB LEU A 61 2.918 -0.827 -7.967 1.00 0.00 C ATOM 986 CG LEU A 61 1.514 -0.530 -8.494 1.00 0.00 C ATOM 987 CD1 LEU A 61 1.241 0.964 -8.450 1.00 0.00 C ATOM 988 CD2 LEU A 61 1.362 -1.048 -9.915 1.00 0.00 C ATOM 0 H LEU A 61 2.518 -2.169 -5.752 1.00 0.00 H new ATOM 0 HA LEU A 61 2.933 -2.902 -8.577 1.00 0.00 H new ATOM 0 HB2 LEU A 61 3.060 -0.280 -7.035 1.00 0.00 H new ATOM 0 HB3 LEU A 61 3.644 -0.436 -8.680 1.00 0.00 H new ATOM 0 HG LEU A 61 0.790 -1.038 -7.858 1.00 0.00 H new ATOM 0 HD11 LEU A 61 0.238 1.162 -8.828 1.00 0.00 H new ATOM 0 HD12 LEU A 61 1.318 1.318 -7.422 1.00 0.00 H new ATOM 0 HD13 LEU A 61 1.971 1.486 -9.069 1.00 0.00 H new ATOM 0 HD21 LEU A 61 0.357 -0.829 -10.277 1.00 0.00 H new ATOM 0 HD22 LEU A 61 2.094 -0.561 -10.560 1.00 0.00 H new ATOM 0 HD23 LEU A 61 1.526 -2.126 -9.929 1.00 0.00 H new ATOM 1000 N TYR A 62 5.384 -3.140 -8.444 1.00 0.00 N ATOM 1001 CA TYR A 62 6.832 -3.292 -8.414 1.00 0.00 C ATOM 1002 C TYR A 62 7.492 -2.196 -9.233 1.00 0.00 C ATOM 1003 O TYR A 62 7.361 -2.157 -10.459 1.00 0.00 O ATOM 1004 CB TYR A 62 7.248 -4.658 -8.960 1.00 0.00 C ATOM 1005 CG TYR A 62 6.754 -5.824 -8.139 1.00 0.00 C ATOM 1006 CD1 TYR A 62 7.606 -6.500 -7.278 1.00 0.00 C ATOM 1007 CD2 TYR A 62 5.437 -6.248 -8.224 1.00 0.00 C ATOM 1008 CE1 TYR A 62 7.160 -7.569 -6.527 1.00 0.00 C ATOM 1009 CE2 TYR A 62 4.982 -7.312 -7.478 1.00 0.00 C ATOM 1010 CZ TYR A 62 5.846 -7.970 -6.632 1.00 0.00 C ATOM 1011 OH TYR A 62 5.390 -9.034 -5.890 1.00 0.00 O ATOM 0 H TYR A 62 4.931 -3.591 -9.239 1.00 0.00 H new ATOM 0 HA TYR A 62 7.158 -3.215 -7.377 1.00 0.00 H new ATOM 0 HB2 TYR A 62 6.874 -4.760 -9.979 1.00 0.00 H new ATOM 0 HB3 TYR A 62 8.336 -4.700 -9.014 1.00 0.00 H new ATOM 0 HD1 TYR A 62 8.636 -6.185 -7.194 1.00 0.00 H new ATOM 0 HD2 TYR A 62 4.756 -5.735 -8.887 1.00 0.00 H new ATOM 0 HE1 TYR A 62 7.836 -8.087 -5.862 1.00 0.00 H new ATOM 0 HE2 TYR A 62 3.952 -7.629 -7.556 1.00 0.00 H new ATOM 0 HH TYR A 62 4.565 -8.780 -5.426 1.00 0.00 H new ATOM 1021 N LEU A 63 8.182 -1.295 -8.555 1.00 0.00 N ATOM 1022 CA LEU A 63 8.898 -0.221 -9.229 1.00 0.00 C ATOM 1023 C LEU A 63 10.397 -0.471 -9.164 1.00 0.00 C ATOM 1024 O LEU A 63 11.192 0.200 -9.827 1.00 0.00 O ATOM 1025 CB LEU A 63 8.559 1.119 -8.579 1.00 0.00 C ATOM 1026 CG LEU A 63 7.072 1.474 -8.553 1.00 0.00 C ATOM 1027 CD1 LEU A 63 6.866 2.818 -7.882 1.00 0.00 C ATOM 1028 CD2 LEU A 63 6.496 1.486 -9.961 1.00 0.00 C ATOM 0 H LEU A 63 8.263 -1.284 -7.538 1.00 0.00 H new ATOM 0 HA LEU A 63 8.593 -0.193 -10.275 1.00 0.00 H new ATOM 0 HB2 LEU A 63 8.932 1.112 -7.555 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.095 1.907 -9.108 1.00 0.00 H new ATOM 0 HG LEU A 63 6.545 0.712 -7.978 1.00 0.00 H new ATOM 0 HD11 LEU A 63 5.803 3.059 -7.870 1.00 0.00 H new ATOM 0 HD12 LEU A 63 7.240 2.775 -6.859 1.00 0.00 H new ATOM 0 HD13 LEU A 63 7.406 3.587 -8.434 1.00 0.00 H new ATOM 0 HD21 LEU A 63 5.437 1.741 -9.919 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.023 2.225 -10.564 1.00 0.00 H new ATOM 0 HD23 LEU A 63 6.614 0.500 -10.411 1.00 0.00 H new ATOM 1040 N GLY A 64 10.763 -1.455 -8.360 1.00 0.00 N ATOM 1041 CA GLY A 64 12.149 -1.814 -8.175 1.00 0.00 C ATOM 1042 C GLY A 64 12.277 -2.920 -7.156 1.00 0.00 C ATOM 1043 O GLY A 64 11.290 -3.590 -6.847 1.00 0.00 O ATOM 0 H GLY A 64 10.108 -2.022 -7.822 1.00 0.00 H new ATOM 0 HA2 GLY A 64 12.578 -2.135 -9.124 1.00 0.00 H new ATOM 0 HA3 GLY A 64 12.716 -0.943 -7.848 1.00 0.00 H new ATOM 1047 N LEU A 65 13.470 -3.110 -6.618 1.00 0.00 N ATOM 1048 CA LEU A 65 13.678 -4.122 -5.591 1.00 0.00 C ATOM 1049 C LEU A 65 13.471 -3.525 -4.206 1.00 0.00 C ATOM 1050 O LEU A 65 13.311 -4.247 -3.220 1.00 0.00 O ATOM 1051 CB LEU A 65 15.080 -4.741 -5.694 1.00 0.00 C ATOM 1052 CG LEU A 65 15.290 -5.722 -6.856 1.00 0.00 C ATOM 1053 CD1 LEU A 65 15.358 -4.994 -8.190 1.00 0.00 C ATOM 1054 CD2 LEU A 65 16.547 -6.546 -6.630 1.00 0.00 C ATOM 0 H LEU A 65 14.305 -2.582 -6.872 1.00 0.00 H new ATOM 0 HA LEU A 65 12.945 -4.913 -5.750 1.00 0.00 H new ATOM 0 HB2 LEU A 65 15.807 -3.935 -5.787 1.00 0.00 H new ATOM 0 HB3 LEU A 65 15.298 -5.260 -4.761 1.00 0.00 H new ATOM 0 HG LEU A 65 14.432 -6.394 -6.890 1.00 0.00 H new ATOM 0 HD11 LEU A 65 15.507 -5.717 -8.992 1.00 0.00 H new ATOM 0 HD12 LEU A 65 14.426 -4.454 -8.357 1.00 0.00 H new ATOM 0 HD13 LEU A 65 16.189 -4.289 -8.178 1.00 0.00 H new ATOM 0 HD21 LEU A 65 16.683 -7.237 -7.462 1.00 0.00 H new ATOM 0 HD22 LEU A 65 17.410 -5.883 -6.564 1.00 0.00 H new ATOM 0 HD23 LEU A 65 16.451 -7.110 -5.702 1.00 0.00 H new ATOM 1066 N ASP A 66 13.485 -2.200 -4.140 1.00 0.00 N ATOM 1067 CA ASP A 66 13.274 -1.492 -2.882 1.00 0.00 C ATOM 1068 C ASP A 66 11.907 -0.816 -2.858 1.00 0.00 C ATOM 1069 O ASP A 66 11.198 -0.854 -1.851 1.00 0.00 O ATOM 1070 CB ASP A 66 14.372 -0.448 -2.669 1.00 0.00 C ATOM 1071 CG ASP A 66 14.152 0.383 -1.421 1.00 0.00 C ATOM 1072 OD1 ASP A 66 14.232 -0.177 -0.309 1.00 0.00 O ATOM 1073 OD2 ASP A 66 13.917 1.605 -1.541 1.00 0.00 O ATOM 0 H ASP A 66 13.641 -1.592 -4.944 1.00 0.00 H new ATOM 0 HA ASP A 66 13.313 -2.223 -2.074 1.00 0.00 H new ATOM 0 HB2 ASP A 66 15.337 -0.950 -2.601 1.00 0.00 H new ATOM 0 HB3 ASP A 66 14.415 0.210 -3.537 1.00 0.00 H new ATOM 1078 N VAL A 67 11.535 -0.208 -3.973 1.00 0.00 N ATOM 1079 CA VAL A 67 10.277 0.518 -4.053 1.00 0.00 C ATOM 1080 C VAL A 67 9.119 -0.423 -4.375 1.00 0.00 C ATOM 1081 O VAL A 67 8.885 -0.770 -5.535 1.00 0.00 O ATOM 1082 CB VAL A 67 10.332 1.641 -5.108 1.00 0.00 C ATOM 1083 CG1 VAL A 67 9.072 2.492 -5.059 1.00 0.00 C ATOM 1084 CG2 VAL A 67 11.563 2.507 -4.907 1.00 0.00 C ATOM 0 H VAL A 67 12.084 -0.202 -4.833 1.00 0.00 H new ATOM 0 HA VAL A 67 10.112 0.969 -3.074 1.00 0.00 H new ATOM 0 HB VAL A 67 10.394 1.176 -6.092 1.00 0.00 H new ATOM 0 HG11 VAL A 67 9.134 3.277 -5.812 1.00 0.00 H new ATOM 0 HG12 VAL A 67 8.202 1.866 -5.258 1.00 0.00 H new ATOM 0 HG13 VAL A 67 8.976 2.943 -4.071 1.00 0.00 H new ATOM 0 HG21 VAL A 67 11.582 3.293 -5.662 1.00 0.00 H new ATOM 0 HG22 VAL A 67 11.533 2.957 -3.915 1.00 0.00 H new ATOM 0 HG23 VAL A 67 12.459 1.893 -5.000 1.00 0.00 H new ATOM 1094 N LEU A 68 8.418 -0.845 -3.336 1.00 0.00 N ATOM 1095 CA LEU A 68 7.243 -1.685 -3.490 1.00 0.00 C ATOM 1096 C LEU A 68 6.014 -0.946 -2.970 1.00 0.00 C ATOM 1097 O LEU A 68 5.970 -0.543 -1.807 1.00 0.00 O ATOM 1098 CB LEU A 68 7.427 -3.005 -2.733 1.00 0.00 C ATOM 1099 CG LEU A 68 6.318 -4.038 -2.946 1.00 0.00 C ATOM 1100 CD1 LEU A 68 6.244 -4.448 -4.408 1.00 0.00 C ATOM 1101 CD2 LEU A 68 6.547 -5.255 -2.063 1.00 0.00 C ATOM 0 H LEU A 68 8.646 -0.617 -2.368 1.00 0.00 H new ATOM 0 HA LEU A 68 7.104 -1.911 -4.547 1.00 0.00 H new ATOM 0 HB2 LEU A 68 8.377 -3.448 -3.033 1.00 0.00 H new ATOM 0 HB3 LEU A 68 7.499 -2.787 -1.667 1.00 0.00 H new ATOM 0 HG LEU A 68 5.367 -3.584 -2.668 1.00 0.00 H new ATOM 0 HD11 LEU A 68 5.450 -5.183 -4.540 1.00 0.00 H new ATOM 0 HD12 LEU A 68 6.033 -3.572 -5.021 1.00 0.00 H new ATOM 0 HD13 LEU A 68 7.196 -4.884 -4.712 1.00 0.00 H new ATOM 0 HD21 LEU A 68 5.749 -5.979 -2.227 1.00 0.00 H new ATOM 0 HD22 LEU A 68 7.506 -5.709 -2.311 1.00 0.00 H new ATOM 0 HD23 LEU A 68 6.550 -4.950 -1.017 1.00 0.00 H new ATOM 1113 N ILE A 69 5.036 -0.744 -3.839 1.00 0.00 N ATOM 1114 CA ILE A 69 3.812 -0.049 -3.460 1.00 0.00 C ATOM 1115 C ILE A 69 2.700 -1.049 -3.159 1.00 0.00 C ATOM 1116 O ILE A 69 2.555 -2.047 -3.863 1.00 0.00 O ATOM 1117 CB ILE A 69 3.339 0.909 -4.576 1.00 0.00 C ATOM 1118 CG1 ILE A 69 4.424 1.942 -4.895 1.00 0.00 C ATOM 1119 CG2 ILE A 69 2.041 1.603 -4.180 1.00 0.00 C ATOM 1120 CD1 ILE A 69 4.038 2.907 -5.996 1.00 0.00 C ATOM 0 H ILE A 69 5.064 -1.051 -4.811 1.00 0.00 H new ATOM 0 HA ILE A 69 4.034 0.534 -2.566 1.00 0.00 H new ATOM 0 HB ILE A 69 3.150 0.319 -5.473 1.00 0.00 H new ATOM 0 HG12 ILE A 69 4.652 2.507 -3.991 1.00 0.00 H new ATOM 0 HG13 ILE A 69 5.337 1.421 -5.184 1.00 0.00 H new ATOM 0 HG21 ILE A 69 1.727 2.272 -4.981 1.00 0.00 H new ATOM 0 HG22 ILE A 69 1.267 0.855 -4.008 1.00 0.00 H new ATOM 0 HG23 ILE A 69 2.200 2.178 -3.268 1.00 0.00 H new ATOM 0 HD11 ILE A 69 4.854 3.609 -6.167 1.00 0.00 H new ATOM 0 HD12 ILE A 69 3.838 2.352 -6.913 1.00 0.00 H new ATOM 0 HD13 ILE A 69 3.143 3.456 -5.702 1.00 0.00 H new ATOM 1132 N ARG A 70 1.936 -0.791 -2.106 1.00 0.00 N ATOM 1133 CA ARG A 70 0.781 -1.614 -1.777 1.00 0.00 C ATOM 1134 C ARG A 70 -0.351 -0.749 -1.232 1.00 0.00 C ATOM 1135 O ARG A 70 -0.104 0.244 -0.553 1.00 0.00 O ATOM 1136 CB ARG A 70 1.157 -2.719 -0.776 1.00 0.00 C ATOM 1137 CG ARG A 70 1.909 -2.230 0.458 1.00 0.00 C ATOM 1138 CD ARG A 70 1.071 -2.348 1.727 1.00 0.00 C ATOM 1139 NE ARG A 70 0.042 -1.311 1.819 1.00 0.00 N ATOM 1140 CZ ARG A 70 -1.229 -1.541 2.135 1.00 0.00 C ATOM 1141 NH1 ARG A 70 -1.651 -2.772 2.385 1.00 0.00 N ATOM 1142 NH2 ARG A 70 -2.078 -0.527 2.207 1.00 0.00 N ATOM 0 H ARG A 70 2.097 -0.015 -1.463 1.00 0.00 H new ATOM 0 HA ARG A 70 0.436 -2.097 -2.691 1.00 0.00 H new ATOM 0 HB2 ARG A 70 0.246 -3.224 -0.454 1.00 0.00 H new ATOM 0 HB3 ARG A 70 1.769 -3.461 -1.288 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.826 -2.807 0.575 1.00 0.00 H new ATOM 0 HG3 ARG A 70 2.203 -1.190 0.314 1.00 0.00 H new ATOM 0 HD2 ARG A 70 0.597 -3.329 1.755 1.00 0.00 H new ATOM 0 HD3 ARG A 70 1.725 -2.285 2.597 1.00 0.00 H new ATOM 0 HE ARG A 70 0.318 -0.348 1.628 1.00 0.00 H new ATOM 0 HH11 ARG A 70 -0.999 -3.555 2.336 1.00 0.00 H new ATOM 0 HH12 ARG A 70 -2.628 -2.937 2.626 1.00 0.00 H new ATOM 0 HH21 ARG A 70 -1.755 0.423 2.021 1.00 0.00 H new ATOM 0 HH22 ARG A 70 -3.054 -0.696 2.449 1.00 0.00 H new ATOM 1156 N MET A 71 -1.585 -1.106 -1.566 1.00 0.00 N ATOM 1157 CA MET A 71 -2.757 -0.418 -1.030 1.00 0.00 C ATOM 1158 C MET A 71 -4.001 -1.278 -1.203 1.00 0.00 C ATOM 1159 O MET A 71 -4.067 -2.106 -2.116 1.00 0.00 O ATOM 1160 CB MET A 71 -2.965 0.944 -1.707 1.00 0.00 C ATOM 1161 CG MET A 71 -3.274 0.866 -3.194 1.00 0.00 C ATOM 1162 SD MET A 71 -3.598 2.487 -3.917 1.00 0.00 S ATOM 1163 CE MET A 71 -3.864 2.054 -5.634 1.00 0.00 C ATOM 0 H MET A 71 -1.802 -1.869 -2.207 1.00 0.00 H new ATOM 0 HA MET A 71 -2.584 -0.247 0.032 1.00 0.00 H new ATOM 0 HB2 MET A 71 -3.781 1.464 -1.206 1.00 0.00 H new ATOM 0 HB3 MET A 71 -2.068 1.547 -1.566 1.00 0.00 H new ATOM 0 HG2 MET A 71 -2.435 0.401 -3.712 1.00 0.00 H new ATOM 0 HG3 MET A 71 -4.140 0.223 -3.349 1.00 0.00 H new ATOM 0 HE1 MET A 71 -4.076 2.956 -6.208 1.00 0.00 H new ATOM 0 HE2 MET A 71 -2.970 1.573 -6.031 1.00 0.00 H new ATOM 0 HE3 MET A 71 -4.708 1.369 -5.710 1.00 0.00 H new ATOM 1173 N GLU A 72 -4.979 -1.083 -0.327 1.00 0.00 N ATOM 1174 CA GLU A 72 -6.225 -1.838 -0.386 1.00 0.00 C ATOM 1175 C GLU A 72 -7.208 -1.168 -1.335 1.00 0.00 C ATOM 1176 O GLU A 72 -7.474 0.031 -1.228 1.00 0.00 O ATOM 1177 CB GLU A 72 -6.873 -1.975 1.000 1.00 0.00 C ATOM 1178 CG GLU A 72 -6.147 -2.910 1.959 1.00 0.00 C ATOM 1179 CD GLU A 72 -4.906 -2.301 2.582 1.00 0.00 C ATOM 1180 OE1 GLU A 72 -4.154 -3.038 3.254 1.00 0.00 O ATOM 1181 OE2 GLU A 72 -4.677 -1.086 2.419 1.00 0.00 O ATOM 0 H GLU A 72 -4.933 -0.406 0.435 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.980 -2.835 -0.752 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -6.934 -0.987 1.456 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -7.895 -2.331 0.873 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -6.833 -3.206 2.753 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -5.866 -3.818 1.425 1.00 0.00 H new ATOM 1188 N ILE A 73 -7.757 -1.947 -2.251 1.00 0.00 N ATOM 1189 CA ILE A 73 -8.678 -1.427 -3.252 1.00 0.00 C ATOM 1190 C ILE A 73 -9.915 -2.313 -3.364 1.00 0.00 C ATOM 1191 O ILE A 73 -9.926 -3.442 -2.877 1.00 0.00 O ATOM 1192 CB ILE A 73 -8.002 -1.320 -4.639 1.00 0.00 C ATOM 1193 CG1 ILE A 73 -7.323 -2.646 -5.002 1.00 0.00 C ATOM 1194 CG2 ILE A 73 -6.997 -0.172 -4.661 1.00 0.00 C ATOM 1195 CD1 ILE A 73 -6.678 -2.654 -6.370 1.00 0.00 C ATOM 0 H ILE A 73 -7.580 -2.949 -2.324 1.00 0.00 H new ATOM 0 HA ILE A 73 -8.975 -0.430 -2.927 1.00 0.00 H new ATOM 0 HB ILE A 73 -8.769 -1.110 -5.384 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -6.564 -2.870 -4.253 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -8.063 -3.445 -4.956 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -6.533 -0.114 -5.645 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -7.510 0.765 -4.446 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -6.229 -0.346 -3.907 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -6.220 -3.627 -6.551 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -7.435 -2.462 -7.130 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -5.913 -1.879 -6.416 1.00 0.00 H new ATOM 1207 N SER A 74 -10.959 -1.785 -3.975 1.00 0.00 N ATOM 1208 CA SER A 74 -12.166 -2.551 -4.241 1.00 0.00 C ATOM 1209 C SER A 74 -12.679 -2.200 -5.629 1.00 0.00 C ATOM 1210 O SER A 74 -12.691 -1.029 -6.012 1.00 0.00 O ATOM 1211 CB SER A 74 -13.238 -2.249 -3.188 1.00 0.00 C ATOM 1212 OG SER A 74 -14.343 -3.129 -3.309 1.00 0.00 O ATOM 0 H SER A 74 -10.996 -0.819 -4.300 1.00 0.00 H new ATOM 0 HA SER A 74 -11.936 -3.615 -4.193 1.00 0.00 H new ATOM 0 HB2 SER A 74 -12.807 -2.339 -2.191 1.00 0.00 H new ATOM 0 HB3 SER A 74 -13.577 -1.219 -3.297 1.00 0.00 H new ATOM 0 HG SER A 74 -15.009 -2.914 -2.624 1.00 0.00 H new ATOM 1218 N LEU A 75 -13.087 -3.201 -6.391 1.00 0.00 N ATOM 1219 CA LEU A 75 -13.545 -2.972 -7.749 1.00 0.00 C ATOM 1220 C LEU A 75 -14.957 -2.393 -7.721 1.00 0.00 C ATOM 1221 O LEU A 75 -15.909 -3.060 -7.311 1.00 0.00 O ATOM 1222 CB LEU A 75 -13.497 -4.286 -8.546 1.00 0.00 C ATOM 1223 CG LEU A 75 -13.573 -4.168 -10.079 1.00 0.00 C ATOM 1224 CD1 LEU A 75 -14.889 -3.561 -10.524 1.00 0.00 C ATOM 1225 CD2 LEU A 75 -12.415 -3.345 -10.610 1.00 0.00 C ATOM 0 H LEU A 75 -13.110 -4.176 -6.093 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.890 -2.255 -8.243 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -12.574 -4.806 -8.290 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.321 -4.917 -8.212 1.00 0.00 H new ATOM 0 HG LEU A 75 -13.509 -5.176 -10.489 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -14.909 -3.492 -11.612 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -15.713 -4.189 -10.185 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -14.993 -2.564 -10.096 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -12.487 -3.273 -11.695 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -12.451 -2.345 -10.177 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -11.474 -3.824 -10.340 1.00 0.00 H new ATOM 1237 N ALA A 76 -15.080 -1.140 -8.135 1.00 0.00 N ATOM 1238 CA ALA A 76 -16.380 -0.491 -8.236 1.00 0.00 C ATOM 1239 C ALA A 76 -16.607 0.014 -9.653 1.00 0.00 C ATOM 1240 O ALA A 76 -17.680 0.513 -9.992 1.00 0.00 O ATOM 1241 CB ALA A 76 -16.478 0.654 -7.240 1.00 0.00 C ATOM 0 H ALA A 76 -14.293 -0.551 -8.407 1.00 0.00 H new ATOM 0 HA ALA A 76 -17.155 -1.220 -8.000 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -17.455 1.129 -7.327 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -16.351 0.268 -6.228 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -15.698 1.386 -7.449 1.00 0.00 H new ATOM 1247 N TRP A 77 -15.582 -0.131 -10.481 1.00 0.00 N ATOM 1248 CA TRP A 77 -15.622 0.340 -11.852 1.00 0.00 C ATOM 1249 C TRP A 77 -15.129 -0.740 -12.766 1.00 0.00 C ATOM 1250 O TRP A 77 -14.099 -1.370 -12.537 1.00 0.00 O ATOM 1251 CB TRP A 77 -14.756 1.569 -11.985 1.00 0.00 C ATOM 1252 CG TRP A 77 -15.039 2.511 -13.120 1.00 0.00 C ATOM 1253 CD1 TRP A 77 -15.908 3.564 -13.093 1.00 0.00 C ATOM 1254 CD2 TRP A 77 -14.410 2.545 -14.409 1.00 0.00 C ATOM 1255 NE1 TRP A 77 -15.854 4.253 -14.278 1.00 0.00 N ATOM 1256 CE2 TRP A 77 -14.949 3.644 -15.104 1.00 0.00 C ATOM 1257 CE3 TRP A 77 -13.450 1.754 -15.051 1.00 0.00 C ATOM 1258 CZ2 TRP A 77 -14.550 3.979 -16.394 1.00 0.00 C ATOM 1259 CZ3 TRP A 77 -13.060 2.088 -16.331 1.00 0.00 C ATOM 1260 CH2 TRP A 77 -13.608 3.190 -16.991 1.00 0.00 C ATOM 0 H TRP A 77 -14.703 -0.578 -10.219 1.00 0.00 H new ATOM 0 HA TRP A 77 -16.646 0.595 -12.124 1.00 0.00 H new ATOM 0 HB2 TRP A 77 -14.832 2.133 -11.056 1.00 0.00 H new ATOM 0 HB3 TRP A 77 -13.721 1.240 -12.074 1.00 0.00 H new ATOM 0 HD1 TRP A 77 -16.546 3.818 -12.259 1.00 0.00 H new ATOM 0 HE1 TRP A 77 -16.400 5.084 -14.506 1.00 0.00 H new ATOM 0 HE3 TRP A 77 -13.022 0.897 -14.552 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 -14.970 4.833 -16.905 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 -12.317 1.486 -16.832 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -13.281 3.423 -17.993 1.00 0.00 H new ATOM 1271 N ALA A 78 -15.863 -0.912 -13.805 1.00 0.00 N ATOM 1272 CA ALA A 78 -15.611 -1.984 -14.761 1.00 0.00 C ATOM 1273 C ALA A 78 -16.167 -1.625 -16.125 1.00 0.00 C ATOM 1274 O ALA A 78 -17.363 -1.745 -16.385 1.00 0.00 O ATOM 1275 CB ALA A 78 -16.193 -3.314 -14.270 1.00 0.00 C ATOM 0 H ALA A 78 -16.663 -0.324 -14.037 1.00 0.00 H new ATOM 0 HA ALA A 78 -14.532 -2.106 -14.851 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -15.989 -4.094 -15.004 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -15.734 -3.583 -13.318 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -17.270 -3.213 -14.138 1.00 0.00 H new ATOM 1281 N ARG A 79 -15.278 -1.165 -16.983 1.00 0.00 N ATOM 1282 CA ARG A 79 -15.627 -0.807 -18.346 1.00 0.00 C ATOM 1283 C ARG A 79 -15.157 -1.901 -19.301 1.00 0.00 C ATOM 1284 O ARG A 79 -14.135 -1.749 -19.973 1.00 0.00 O ATOM 1285 CB ARG A 79 -14.980 0.531 -18.707 1.00 0.00 C ATOM 1286 CG ARG A 79 -15.931 1.550 -19.321 1.00 0.00 C ATOM 1287 CD ARG A 79 -16.415 1.130 -20.701 1.00 0.00 C ATOM 1288 NE ARG A 79 -17.152 2.201 -21.375 1.00 0.00 N ATOM 1289 CZ ARG A 79 -17.329 2.274 -22.693 1.00 0.00 C ATOM 1290 NH1 ARG A 79 -16.855 1.327 -23.491 1.00 0.00 N ATOM 1291 NH2 ARG A 79 -17.984 3.300 -23.215 1.00 0.00 N ATOM 0 H ARG A 79 -14.293 -1.028 -16.756 1.00 0.00 H new ATOM 0 HA ARG A 79 -16.709 -0.708 -18.432 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -14.539 0.961 -17.808 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -14.164 0.348 -19.406 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -16.789 1.685 -18.663 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -15.429 2.515 -19.393 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -15.560 0.839 -21.311 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -17.055 0.252 -20.609 1.00 0.00 H new ATOM 0 HE ARG A 79 -17.556 2.939 -20.798 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -16.350 0.534 -23.097 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -16.996 1.392 -24.499 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -18.352 4.032 -22.608 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -18.121 3.358 -24.224 1.00 0.00 H new ATOM 1305 N ASP A 80 -15.899 -3.006 -19.320 1.00 0.00 N ATOM 1306 CA ASP A 80 -15.577 -4.180 -20.139 1.00 0.00 C ATOM 1307 C ASP A 80 -14.242 -4.803 -19.720 1.00 0.00 C ATOM 1308 O ASP A 80 -14.212 -5.682 -18.860 1.00 0.00 O ATOM 1309 CB ASP A 80 -15.583 -3.835 -21.634 1.00 0.00 C ATOM 1310 CG ASP A 80 -15.383 -5.047 -22.524 1.00 0.00 C ATOM 1311 OD1 ASP A 80 -14.341 -5.118 -23.209 1.00 0.00 O ATOM 1312 OD2 ASP A 80 -16.274 -5.927 -22.549 1.00 0.00 O ATOM 0 H ASP A 80 -16.747 -3.116 -18.765 1.00 0.00 H new ATOM 0 HA ASP A 80 -16.356 -4.923 -19.968 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -16.530 -3.358 -21.887 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -14.796 -3.109 -21.837 1.00 0.00 H new ATOM 1317 N GLY A 81 -13.144 -4.337 -20.302 1.00 0.00 N ATOM 1318 CA GLY A 81 -11.838 -4.876 -19.966 1.00 0.00 C ATOM 1319 C GLY A 81 -11.007 -3.908 -19.153 1.00 0.00 C ATOM 1320 O GLY A 81 -9.962 -4.275 -18.610 1.00 0.00 O ATOM 0 H GLY A 81 -13.134 -3.595 -21.002 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -11.963 -5.803 -19.406 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -11.305 -5.128 -20.883 1.00 0.00 H new ATOM 1324 N LEU A 82 -11.458 -2.666 -19.082 1.00 0.00 N ATOM 1325 CA LEU A 82 -10.795 -1.662 -18.268 1.00 0.00 C ATOM 1326 C LEU A 82 -11.353 -1.708 -16.858 1.00 0.00 C ATOM 1327 O LEU A 82 -12.520 -1.391 -16.631 1.00 0.00 O ATOM 1328 CB LEU A 82 -10.978 -0.266 -18.868 1.00 0.00 C ATOM 1329 CG LEU A 82 -10.347 -0.060 -20.247 1.00 0.00 C ATOM 1330 CD1 LEU A 82 -10.637 1.342 -20.762 1.00 0.00 C ATOM 1331 CD2 LEU A 82 -8.846 -0.299 -20.183 1.00 0.00 C ATOM 0 H LEU A 82 -12.282 -2.329 -19.580 1.00 0.00 H new ATOM 0 HA LEU A 82 -9.727 -1.878 -18.242 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -12.045 -0.056 -18.940 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.555 0.466 -18.180 1.00 0.00 H new ATOM 0 HG LEU A 82 -10.786 -0.780 -20.938 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -10.181 1.471 -21.744 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.715 1.485 -20.841 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -10.224 2.076 -20.071 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.411 -0.149 -21.171 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -8.396 0.400 -19.478 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -8.654 -1.320 -19.853 1.00 0.00 H new ATOM 1343 N LEU A 83 -10.527 -2.110 -15.917 1.00 0.00 N ATOM 1344 CA LEU A 83 -10.972 -2.293 -14.549 1.00 0.00 C ATOM 1345 C LEU A 83 -10.530 -1.129 -13.678 1.00 0.00 C ATOM 1346 O LEU A 83 -9.338 -0.830 -13.580 1.00 0.00 O ATOM 1347 CB LEU A 83 -10.437 -3.615 -14.000 1.00 0.00 C ATOM 1348 CG LEU A 83 -10.935 -4.864 -14.735 1.00 0.00 C ATOM 1349 CD1 LEU A 83 -10.233 -6.108 -14.216 1.00 0.00 C ATOM 1350 CD2 LEU A 83 -12.441 -5.005 -14.585 1.00 0.00 C ATOM 0 H LEU A 83 -9.541 -2.317 -16.073 1.00 0.00 H new ATOM 0 HA LEU A 83 -12.061 -2.324 -14.536 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.348 -3.596 -14.042 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -10.714 -3.694 -12.949 1.00 0.00 H new ATOM 0 HG LEU A 83 -10.700 -4.753 -15.794 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -10.601 -6.983 -14.751 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -9.159 -6.012 -14.373 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -10.435 -6.222 -13.151 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -12.777 -5.897 -15.113 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -12.695 -5.091 -13.529 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -12.932 -4.128 -15.006 1.00 0.00 H new ATOM 1362 N GLY A 84 -11.498 -0.476 -13.057 1.00 0.00 N ATOM 1363 CA GLY A 84 -11.215 0.653 -12.203 1.00 0.00 C ATOM 1364 C GLY A 84 -11.451 0.327 -10.747 1.00 0.00 C ATOM 1365 O GLY A 84 -12.592 0.178 -10.305 1.00 0.00 O ATOM 0 H GLY A 84 -12.487 -0.713 -13.132 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -10.180 0.964 -12.343 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -11.843 1.495 -12.494 1.00 0.00 H new ATOM 1369 N PHE A 85 -10.376 0.196 -10.000 1.00 0.00 N ATOM 1370 CA PHE A 85 -10.479 -0.110 -8.585 1.00 0.00 C ATOM 1371 C PHE A 85 -10.475 1.168 -7.778 1.00 0.00 C ATOM 1372 O PHE A 85 -9.603 2.016 -7.957 1.00 0.00 O ATOM 1373 CB PHE A 85 -9.319 -0.993 -8.131 1.00 0.00 C ATOM 1374 CG PHE A 85 -9.218 -2.302 -8.856 1.00 0.00 C ATOM 1375 CD1 PHE A 85 -9.684 -3.464 -8.269 1.00 0.00 C ATOM 1376 CD2 PHE A 85 -8.655 -2.370 -10.119 1.00 0.00 C ATOM 1377 CE1 PHE A 85 -9.589 -4.670 -8.926 1.00 0.00 C ATOM 1378 CE2 PHE A 85 -8.559 -3.575 -10.782 1.00 0.00 C ATOM 1379 CZ PHE A 85 -9.028 -4.724 -10.186 1.00 0.00 C ATOM 0 H PHE A 85 -9.422 0.296 -10.346 1.00 0.00 H new ATOM 0 HA PHE A 85 -11.414 -0.646 -8.424 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -8.387 -0.444 -8.264 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -9.423 -1.189 -7.064 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -10.127 -3.425 -7.285 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -8.287 -1.470 -10.590 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -9.953 -5.572 -8.457 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -8.117 -3.617 -11.766 1.00 0.00 H new ATOM 0 HZ PHE A 85 -8.957 -5.669 -10.705 1.00 0.00 H new ATOM 1389 N GLU A 86 -11.452 1.313 -6.902 1.00 0.00 N ATOM 1390 CA GLU A 86 -11.464 2.442 -5.988 1.00 0.00 C ATOM 1391 C GLU A 86 -10.580 2.109 -4.792 1.00 0.00 C ATOM 1392 O GLU A 86 -10.593 0.979 -4.290 1.00 0.00 O ATOM 1393 CB GLU A 86 -12.893 2.769 -5.537 1.00 0.00 C ATOM 1394 CG GLU A 86 -13.160 4.263 -5.369 1.00 0.00 C ATOM 1395 CD GLU A 86 -12.391 4.896 -4.220 1.00 0.00 C ATOM 1396 OE1 GLU A 86 -11.254 5.368 -4.441 1.00 0.00 O ATOM 1397 OE2 GLU A 86 -12.928 4.932 -3.093 1.00 0.00 O ATOM 0 H GLU A 86 -12.239 0.672 -6.803 1.00 0.00 H new ATOM 0 HA GLU A 86 -11.076 3.325 -6.496 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -13.595 2.364 -6.265 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -13.089 2.266 -4.590 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -12.900 4.776 -6.295 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -14.227 4.417 -5.209 1.00 0.00 H new ATOM 1404 N CYS A 87 -9.804 3.081 -4.359 1.00 0.00 N ATOM 1405 CA CYS A 87 -8.836 2.883 -3.298 1.00 0.00 C ATOM 1406 C CYS A 87 -9.487 3.040 -1.927 1.00 0.00 C ATOM 1407 O CYS A 87 -9.938 4.123 -1.556 1.00 0.00 O ATOM 1408 CB CYS A 87 -7.687 3.874 -3.472 1.00 0.00 C ATOM 1409 SG CYS A 87 -8.230 5.557 -3.849 1.00 0.00 S ATOM 0 H CYS A 87 -9.826 4.030 -4.732 1.00 0.00 H new ATOM 0 HA CYS A 87 -8.445 1.867 -3.358 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -7.091 3.890 -2.559 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -7.035 3.524 -4.272 1.00 0.00 H new ATOM 0 HG CYS A 87 -9.528 5.592 -3.904 1.00 0.00 H new ATOM 1415 N GLN A 88 -9.536 1.951 -1.178 1.00 0.00 N ATOM 1416 CA GLN A 88 -10.160 1.963 0.137 1.00 0.00 C ATOM 1417 C GLN A 88 -9.187 2.489 1.183 1.00 0.00 C ATOM 1418 O GLN A 88 -9.476 3.459 1.886 1.00 0.00 O ATOM 1419 CB GLN A 88 -10.628 0.558 0.524 1.00 0.00 C ATOM 1420 CG GLN A 88 -11.567 -0.074 -0.486 1.00 0.00 C ATOM 1421 CD GLN A 88 -12.116 -1.403 -0.010 1.00 0.00 C ATOM 1422 OE1 GLN A 88 -11.400 -2.480 -0.297 1.00 0.00 O flip ATOM 1423 NE2 GLN A 88 -13.170 -1.459 0.615 1.00 0.00 N flip ATOM 0 H GLN A 88 -9.152 1.048 -1.456 1.00 0.00 H new ATOM 0 HA GLN A 88 -11.026 2.623 0.095 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -9.756 -0.084 0.647 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -11.128 0.605 1.491 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -12.394 0.607 -0.685 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -11.039 -0.219 -1.428 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -13.690 -0.605 0.815 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -13.526 -2.360 0.935 1.00 0.00 H new ATOM 1432 N HIS A 89 -8.023 1.859 1.260 1.00 0.00 N ATOM 1433 CA HIS A 89 -7.023 2.211 2.257 1.00 0.00 C ATOM 1434 C HIS A 89 -5.687 2.495 1.589 1.00 0.00 C ATOM 1435 O HIS A 89 -5.056 1.596 1.034 1.00 0.00 O ATOM 1436 CB HIS A 89 -6.870 1.073 3.274 1.00 0.00 C ATOM 1437 CG HIS A 89 -5.909 1.363 4.391 1.00 0.00 C ATOM 1438 ND1 HIS A 89 -6.314 1.777 5.637 1.00 0.00 N ATOM 1439 CD2 HIS A 89 -4.558 1.287 4.443 1.00 0.00 C ATOM 1440 CE1 HIS A 89 -5.257 1.947 6.408 1.00 0.00 C ATOM 1441 NE2 HIS A 89 -4.177 1.656 5.708 1.00 0.00 N ATOM 0 H HIS A 89 -7.747 1.097 0.640 1.00 0.00 H new ATOM 0 HA HIS A 89 -7.352 3.110 2.778 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -7.848 0.850 3.701 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -6.539 0.176 2.750 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -3.902 0.991 3.638 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -5.273 2.270 7.438 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -3.217 1.698 6.051 1.00 0.00 H new ATOM 1450 N ILE A 90 -5.265 3.746 1.635 1.00 0.00 N ATOM 1451 CA ILE A 90 -3.972 4.121 1.093 1.00 0.00 C ATOM 1452 C ILE A 90 -3.085 4.676 2.199 1.00 0.00 C ATOM 1453 O ILE A 90 -3.390 5.708 2.799 1.00 0.00 O ATOM 1454 CB ILE A 90 -4.068 5.169 -0.045 1.00 0.00 C ATOM 1455 CG1 ILE A 90 -5.248 4.890 -0.984 1.00 0.00 C ATOM 1456 CG2 ILE A 90 -2.772 5.177 -0.840 1.00 0.00 C ATOM 1457 CD1 ILE A 90 -6.562 5.485 -0.516 1.00 0.00 C ATOM 0 H ILE A 90 -5.797 4.516 2.040 1.00 0.00 H new ATOM 0 HA ILE A 90 -3.542 3.213 0.669 1.00 0.00 H new ATOM 0 HB ILE A 90 -4.234 6.144 0.413 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -5.014 5.285 -1.973 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -5.367 3.812 -1.091 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -2.840 5.914 -1.640 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -1.942 5.433 -0.181 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -2.603 4.190 -1.270 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -7.347 5.244 -1.233 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -6.822 5.072 0.459 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -6.463 6.568 -0.436 1.00 0.00 H new ATOM 1469 N ASP A 91 -2.001 3.976 2.474 1.00 0.00 N ATOM 1470 CA ASP A 91 -1.068 4.375 3.517 1.00 0.00 C ATOM 1471 C ASP A 91 -0.088 5.422 2.996 1.00 0.00 C ATOM 1472 O ASP A 91 0.108 5.556 1.786 1.00 0.00 O ATOM 1473 CB ASP A 91 -0.311 3.152 4.039 1.00 0.00 C ATOM 1474 CG ASP A 91 0.314 2.344 2.922 1.00 0.00 C ATOM 1475 OD1 ASP A 91 -0.419 1.590 2.250 1.00 0.00 O ATOM 1476 OD2 ASP A 91 1.539 2.453 2.714 1.00 0.00 O ATOM 0 H ASP A 91 -1.741 3.119 1.985 1.00 0.00 H new ATOM 0 HA ASP A 91 -1.635 4.818 4.336 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.468 3.477 4.729 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -0.994 2.518 4.604 1.00 0.00 H new ATOM 1481 N LEU A 92 0.527 6.159 3.918 1.00 0.00 N ATOM 1482 CA LEU A 92 1.448 7.234 3.565 1.00 0.00 C ATOM 1483 C LEU A 92 2.662 6.695 2.818 1.00 0.00 C ATOM 1484 O LEU A 92 3.244 7.388 1.984 1.00 0.00 O ATOM 1485 CB LEU A 92 1.899 7.981 4.821 1.00 0.00 C ATOM 1486 CG LEU A 92 2.746 9.232 4.570 1.00 0.00 C ATOM 1487 CD1 LEU A 92 1.957 10.266 3.782 1.00 0.00 C ATOM 1488 CD2 LEU A 92 3.226 9.818 5.888 1.00 0.00 C ATOM 0 H LEU A 92 0.402 6.029 4.922 1.00 0.00 H new ATOM 0 HA LEU A 92 0.920 7.925 2.908 1.00 0.00 H new ATOM 0 HB2 LEU A 92 1.015 8.269 5.390 1.00 0.00 H new ATOM 0 HB3 LEU A 92 2.470 7.295 5.446 1.00 0.00 H new ATOM 0 HG LEU A 92 3.617 8.946 3.980 1.00 0.00 H new ATOM 0 HD11 LEU A 92 2.577 11.147 3.615 1.00 0.00 H new ATOM 0 HD12 LEU A 92 1.660 9.843 2.822 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.067 10.550 4.344 1.00 0.00 H new ATOM 0 HD21 LEU A 92 3.827 10.707 5.694 1.00 0.00 H new ATOM 0 HD22 LEU A 92 2.366 10.088 6.501 1.00 0.00 H new ATOM 0 HD23 LEU A 92 3.830 9.080 6.416 1.00 0.00 H new ATOM 1500 N ASP A 93 3.038 5.460 3.114 1.00 0.00 N ATOM 1501 CA ASP A 93 4.164 4.831 2.433 1.00 0.00 C ATOM 1502 C ASP A 93 3.821 4.610 0.967 1.00 0.00 C ATOM 1503 O ASP A 93 4.596 4.958 0.076 1.00 0.00 O ATOM 1504 CB ASP A 93 4.531 3.506 3.096 1.00 0.00 C ATOM 1505 CG ASP A 93 5.667 2.805 2.381 1.00 0.00 C ATOM 1506 OD1 ASP A 93 5.401 1.828 1.653 1.00 0.00 O ATOM 1507 OD2 ASP A 93 6.831 3.242 2.530 1.00 0.00 O ATOM 0 H ASP A 93 2.585 4.875 3.816 1.00 0.00 H new ATOM 0 HA ASP A 93 5.026 5.494 2.504 1.00 0.00 H new ATOM 0 HB2 ASP A 93 4.813 3.686 4.133 1.00 0.00 H new ATOM 0 HB3 ASP A 93 3.657 2.855 3.112 1.00 0.00 H new ATOM 1512 N SER A 94 2.646 4.053 0.727 1.00 0.00 N ATOM 1513 CA SER A 94 2.141 3.870 -0.625 1.00 0.00 C ATOM 1514 C SER A 94 2.104 5.209 -1.361 1.00 0.00 C ATOM 1515 O SER A 94 2.618 5.334 -2.477 1.00 0.00 O ATOM 1516 CB SER A 94 0.741 3.253 -0.575 1.00 0.00 C ATOM 1517 OG SER A 94 0.266 2.933 -1.869 1.00 0.00 O ATOM 0 H SER A 94 2.018 3.717 1.457 1.00 0.00 H new ATOM 0 HA SER A 94 2.806 3.197 -1.165 1.00 0.00 H new ATOM 0 HB2 SER A 94 0.761 2.352 0.039 1.00 0.00 H new ATOM 0 HB3 SER A 94 0.053 3.949 -0.096 1.00 0.00 H new ATOM 0 HG SER A 94 0.024 1.984 -1.903 1.00 0.00 H new ATOM 1523 N ILE A 95 1.524 6.214 -0.707 1.00 0.00 N ATOM 1524 CA ILE A 95 1.421 7.554 -1.276 1.00 0.00 C ATOM 1525 C ILE A 95 2.797 8.118 -1.630 1.00 0.00 C ATOM 1526 O ILE A 95 3.006 8.610 -2.738 1.00 0.00 O ATOM 1527 CB ILE A 95 0.717 8.529 -0.305 1.00 0.00 C ATOM 1528 CG1 ILE A 95 -0.698 8.040 0.018 1.00 0.00 C ATOM 1529 CG2 ILE A 95 0.677 9.935 -0.892 1.00 0.00 C ATOM 1530 CD1 ILE A 95 -1.414 8.892 1.046 1.00 0.00 C ATOM 0 H ILE A 95 1.116 6.123 0.223 1.00 0.00 H new ATOM 0 HA ILE A 95 0.826 7.460 -2.184 1.00 0.00 H new ATOM 0 HB ILE A 95 1.289 8.561 0.622 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -1.286 8.022 -0.900 1.00 0.00 H new ATOM 0 HG13 ILE A 95 -0.645 7.014 0.382 1.00 0.00 H new ATOM 0 HG21 ILE A 95 0.178 10.607 -0.194 1.00 0.00 H new ATOM 0 HG22 ILE A 95 1.694 10.285 -1.068 1.00 0.00 H new ATOM 0 HG23 ILE A 95 0.131 9.920 -1.835 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -2.410 8.486 1.225 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.849 8.890 1.978 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -1.500 9.914 0.676 1.00 0.00 H new ATOM 1542 N SER A 96 3.734 8.028 -0.695 1.00 0.00 N ATOM 1543 CA SER A 96 5.054 8.617 -0.882 1.00 0.00 C ATOM 1544 C SER A 96 5.811 7.954 -2.035 1.00 0.00 C ATOM 1545 O SER A 96 6.501 8.630 -2.799 1.00 0.00 O ATOM 1546 CB SER A 96 5.862 8.545 0.419 1.00 0.00 C ATOM 1547 OG SER A 96 5.822 7.246 0.987 1.00 0.00 O ATOM 0 H SER A 96 3.605 7.554 0.199 1.00 0.00 H new ATOM 0 HA SER A 96 4.916 9.665 -1.147 1.00 0.00 H new ATOM 0 HB2 SER A 96 6.897 8.825 0.221 1.00 0.00 H new ATOM 0 HB3 SER A 96 5.468 9.268 1.133 1.00 0.00 H new ATOM 0 HG SER A 96 5.394 6.627 0.359 1.00 0.00 H new ATOM 1553 N HIS A 97 5.668 6.639 -2.181 1.00 0.00 N ATOM 1554 CA HIS A 97 6.336 5.929 -3.270 1.00 0.00 C ATOM 1555 C HIS A 97 5.711 6.299 -4.614 1.00 0.00 C ATOM 1556 O HIS A 97 6.421 6.554 -5.585 1.00 0.00 O ATOM 1557 CB HIS A 97 6.280 4.408 -3.076 1.00 0.00 C ATOM 1558 CG HIS A 97 7.069 3.900 -1.906 1.00 0.00 C ATOM 1559 ND1 HIS A 97 8.413 4.149 -1.727 1.00 0.00 N ATOM 1560 CD2 HIS A 97 6.689 3.147 -0.851 1.00 0.00 C ATOM 1561 CE1 HIS A 97 8.819 3.571 -0.610 1.00 0.00 C ATOM 1562 NE2 HIS A 97 7.792 2.957 -0.055 1.00 0.00 N ATOM 0 H HIS A 97 5.104 6.050 -1.569 1.00 0.00 H new ATOM 0 HA HIS A 97 7.382 6.234 -3.260 1.00 0.00 H new ATOM 0 HB2 HIS A 97 5.239 4.108 -2.954 1.00 0.00 H new ATOM 0 HB3 HIS A 97 6.646 3.925 -3.982 1.00 0.00 H new ATOM 0 HD2 HIS A 97 5.696 2.763 -0.667 1.00 0.00 H new ATOM 0 HE1 HIS A 97 9.825 3.597 -0.217 1.00 0.00 H new ATOM 0 HE2 HIS A 97 7.813 2.430 0.818 1.00 0.00 H new ATOM 1571 N LEU A 98 4.383 6.343 -4.651 1.00 0.00 N ATOM 1572 CA LEU A 98 3.654 6.640 -5.881 1.00 0.00 C ATOM 1573 C LEU A 98 3.927 8.077 -6.323 1.00 0.00 C ATOM 1574 O LEU A 98 4.356 8.318 -7.453 1.00 0.00 O ATOM 1575 CB LEU A 98 2.146 6.411 -5.653 1.00 0.00 C ATOM 1576 CG LEU A 98 1.267 6.288 -6.914 1.00 0.00 C ATOM 1577 CD1 LEU A 98 1.057 7.638 -7.587 1.00 0.00 C ATOM 1578 CD2 LEU A 98 1.874 5.294 -7.893 1.00 0.00 C ATOM 0 H LEU A 98 3.787 6.176 -3.840 1.00 0.00 H new ATOM 0 HA LEU A 98 3.993 5.974 -6.674 1.00 0.00 H new ATOM 0 HB2 LEU A 98 2.025 5.502 -5.064 1.00 0.00 H new ATOM 0 HB3 LEU A 98 1.764 7.235 -5.050 1.00 0.00 H new ATOM 0 HG LEU A 98 0.290 5.920 -6.600 1.00 0.00 H new ATOM 0 HD11 LEU A 98 0.433 7.510 -8.472 1.00 0.00 H new ATOM 0 HD12 LEU A 98 0.566 8.319 -6.892 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.022 8.052 -7.880 1.00 0.00 H new ATOM 0 HD21 LEU A 98 1.240 5.220 -8.777 1.00 0.00 H new ATOM 0 HD22 LEU A 98 2.868 5.633 -8.186 1.00 0.00 H new ATOM 0 HD23 LEU A 98 1.950 4.316 -7.418 1.00 0.00 H new ATOM 1590 N ARG A 99 3.698 9.022 -5.417 1.00 0.00 N ATOM 1591 CA ARG A 99 3.875 10.438 -5.715 1.00 0.00 C ATOM 1592 C ARG A 99 5.296 10.740 -6.173 1.00 0.00 C ATOM 1593 O ARG A 99 5.503 11.434 -7.170 1.00 0.00 O ATOM 1594 CB ARG A 99 3.545 11.292 -4.486 1.00 0.00 C ATOM 1595 CG ARG A 99 3.894 12.761 -4.671 1.00 0.00 C ATOM 1596 CD ARG A 99 3.638 13.579 -3.413 1.00 0.00 C ATOM 1597 NE ARG A 99 4.094 14.958 -3.581 1.00 0.00 N ATOM 1598 CZ ARG A 99 3.327 15.940 -4.054 1.00 0.00 C ATOM 1599 NH1 ARG A 99 2.042 15.723 -4.285 1.00 0.00 N ATOM 1600 NH2 ARG A 99 3.839 17.143 -4.269 1.00 0.00 N ATOM 0 H ARG A 99 3.387 8.830 -4.464 1.00 0.00 H new ATOM 0 HA ARG A 99 3.190 10.686 -6.526 1.00 0.00 H new ATOM 0 HB2 ARG A 99 2.482 11.202 -4.263 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.086 10.902 -3.624 1.00 0.00 H new ATOM 0 HG2 ARG A 99 4.943 12.850 -4.952 1.00 0.00 H new ATOM 0 HG3 ARG A 99 3.308 13.171 -5.494 1.00 0.00 H new ATOM 0 HD2 ARG A 99 2.573 13.570 -3.180 1.00 0.00 H new ATOM 0 HD3 ARG A 99 4.153 13.123 -2.568 1.00 0.00 H new ATOM 0 HE ARG A 99 5.055 15.181 -3.321 1.00 0.00 H new ATOM 0 HH11 ARG A 99 1.639 14.804 -4.101 1.00 0.00 H new ATOM 0 HH12 ARG A 99 1.455 16.474 -4.647 1.00 0.00 H new ATOM 0 HH21 ARG A 99 4.824 17.321 -4.072 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.248 17.891 -4.631 1.00 0.00 H new ATOM 1614 N ARG A 100 6.270 10.208 -5.451 1.00 0.00 N ATOM 1615 CA ARG A 100 7.661 10.536 -5.707 1.00 0.00 C ATOM 1616 C ARG A 100 8.104 10.024 -7.073 1.00 0.00 C ATOM 1617 O ARG A 100 8.875 10.685 -7.765 1.00 0.00 O ATOM 1618 CB ARG A 100 8.554 9.967 -4.608 1.00 0.00 C ATOM 1619 CG ARG A 100 9.907 10.647 -4.519 1.00 0.00 C ATOM 1620 CD ARG A 100 10.707 10.119 -3.346 1.00 0.00 C ATOM 1621 NE ARG A 100 11.912 10.907 -3.109 1.00 0.00 N ATOM 1622 CZ ARG A 100 13.087 10.381 -2.774 1.00 0.00 C ATOM 1623 NH1 ARG A 100 13.234 9.062 -2.707 1.00 0.00 N ATOM 1624 NH2 ARG A 100 14.114 11.174 -2.507 1.00 0.00 N ATOM 0 H ARG A 100 6.122 9.550 -4.686 1.00 0.00 H new ATOM 0 HA ARG A 100 7.757 11.622 -5.708 1.00 0.00 H new ATOM 0 HB2 ARG A 100 8.044 10.063 -3.650 1.00 0.00 H new ATOM 0 HB3 ARG A 100 8.702 8.902 -4.785 1.00 0.00 H new ATOM 0 HG2 ARG A 100 10.461 10.484 -5.444 1.00 0.00 H new ATOM 0 HG3 ARG A 100 9.770 11.723 -4.415 1.00 0.00 H new ATOM 0 HD2 ARG A 100 10.086 10.127 -2.450 1.00 0.00 H new ATOM 0 HD3 ARG A 100 10.983 9.081 -3.533 1.00 0.00 H new ATOM 0 HE ARG A 100 11.850 11.920 -3.206 1.00 0.00 H new ATOM 0 HH11 ARG A 100 12.445 8.450 -2.913 1.00 0.00 H new ATOM 0 HH12 ARG A 100 14.136 8.662 -2.450 1.00 0.00 H new ATOM 0 HH21 ARG A 100 14.003 12.187 -2.558 1.00 0.00 H new ATOM 0 HH22 ARG A 100 15.015 10.772 -2.250 1.00 0.00 H new ATOM 1638 N LEU A 101 7.601 8.860 -7.474 1.00 0.00 N ATOM 1639 CA LEU A 101 7.954 8.303 -8.775 1.00 0.00 C ATOM 1640 C LEU A 101 7.440 9.198 -9.896 1.00 0.00 C ATOM 1641 O LEU A 101 8.132 9.422 -10.893 1.00 0.00 O ATOM 1642 CB LEU A 101 7.392 6.897 -8.954 1.00 0.00 C ATOM 1643 CG LEU A 101 7.833 6.205 -10.244 1.00 0.00 C ATOM 1644 CD1 LEU A 101 9.294 5.793 -10.157 1.00 0.00 C ATOM 1645 CD2 LEU A 101 6.955 5.006 -10.539 1.00 0.00 C ATOM 0 H LEU A 101 6.956 8.291 -6.925 1.00 0.00 H new ATOM 0 HA LEU A 101 9.042 8.249 -8.820 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.696 6.285 -8.105 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.303 6.948 -8.936 1.00 0.00 H new ATOM 0 HG LEU A 101 7.725 6.914 -11.065 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.589 5.302 -11.084 1.00 0.00 H new ATOM 0 HD12 LEU A 101 9.913 6.677 -10.001 1.00 0.00 H new ATOM 0 HD13 LEU A 101 9.429 5.104 -9.323 1.00 0.00 H new ATOM 0 HD21 LEU A 101 7.288 4.530 -11.461 1.00 0.00 H new ATOM 0 HD22 LEU A 101 7.024 4.293 -9.717 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.921 5.331 -10.651 1.00 0.00 H new ATOM 1657 N VAL A 102 6.225 9.708 -9.724 1.00 0.00 N ATOM 1658 CA VAL A 102 5.637 10.631 -10.689 1.00 0.00 C ATOM 1659 C VAL A 102 6.495 11.888 -10.809 1.00 0.00 C ATOM 1660 O VAL A 102 6.707 12.405 -11.902 1.00 0.00 O ATOM 1661 CB VAL A 102 4.186 11.005 -10.298 1.00 0.00 C ATOM 1662 CG1 VAL A 102 3.651 12.133 -11.167 1.00 0.00 C ATOM 1663 CG2 VAL A 102 3.278 9.787 -10.407 1.00 0.00 C ATOM 0 H VAL A 102 5.627 9.498 -8.925 1.00 0.00 H new ATOM 0 HA VAL A 102 5.605 10.130 -11.657 1.00 0.00 H new ATOM 0 HB VAL A 102 4.199 11.351 -9.264 1.00 0.00 H new ATOM 0 HG11 VAL A 102 2.631 12.371 -10.867 1.00 0.00 H new ATOM 0 HG12 VAL A 102 4.280 13.015 -11.046 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.658 11.822 -12.212 1.00 0.00 H new ATOM 0 HG21 VAL A 102 2.261 10.065 -10.129 1.00 0.00 H new ATOM 0 HG22 VAL A 102 3.286 9.418 -11.433 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.636 9.005 -9.737 1.00 0.00 H new ATOM 1673 N GLU A 103 7.015 12.355 -9.683 1.00 0.00 N ATOM 1674 CA GLU A 103 7.893 13.521 -9.668 1.00 0.00 C ATOM 1675 C GLU A 103 9.235 13.228 -10.335 1.00 0.00 C ATOM 1676 O GLU A 103 9.813 14.092 -10.996 1.00 0.00 O ATOM 1677 CB GLU A 103 8.113 13.993 -8.232 1.00 0.00 C ATOM 1678 CG GLU A 103 6.994 14.878 -7.718 1.00 0.00 C ATOM 1679 CD GLU A 103 7.046 16.263 -8.324 1.00 0.00 C ATOM 1680 OE1 GLU A 103 7.410 17.216 -7.601 1.00 0.00 O ATOM 1681 OE2 GLU A 103 6.757 16.402 -9.533 1.00 0.00 O ATOM 0 H GLU A 103 6.845 11.945 -8.765 1.00 0.00 H new ATOM 0 HA GLU A 103 7.405 14.311 -10.239 1.00 0.00 H new ATOM 0 HB2 GLU A 103 8.209 13.124 -7.581 1.00 0.00 H new ATOM 0 HB3 GLU A 103 9.055 14.539 -8.176 1.00 0.00 H new ATOM 0 HG2 GLU A 103 6.033 14.418 -7.947 1.00 0.00 H new ATOM 0 HG3 GLU A 103 7.061 14.954 -6.633 1.00 0.00 H new ATOM 1688 N LEU A 104 9.722 12.005 -10.172 1.00 0.00 N ATOM 1689 CA LEU A 104 11.006 11.609 -10.739 1.00 0.00 C ATOM 1690 C LEU A 104 10.919 11.456 -12.256 1.00 0.00 C ATOM 1691 O LEU A 104 11.933 11.509 -12.947 1.00 0.00 O ATOM 1692 CB LEU A 104 11.486 10.292 -10.115 1.00 0.00 C ATOM 1693 CG LEU A 104 11.740 10.330 -8.607 1.00 0.00 C ATOM 1694 CD1 LEU A 104 12.187 8.962 -8.108 1.00 0.00 C ATOM 1695 CD2 LEU A 104 12.777 11.389 -8.266 1.00 0.00 C ATOM 0 H LEU A 104 9.247 11.268 -9.651 1.00 0.00 H new ATOM 0 HA LEU A 104 11.723 12.398 -10.512 1.00 0.00 H new ATOM 0 HB2 LEU A 104 10.744 9.521 -10.321 1.00 0.00 H new ATOM 0 HB3 LEU A 104 12.407 9.989 -10.613 1.00 0.00 H new ATOM 0 HG LEU A 104 10.807 10.591 -8.107 1.00 0.00 H new ATOM 0 HD11 LEU A 104 12.363 9.007 -7.033 1.00 0.00 H new ATOM 0 HD12 LEU A 104 11.410 8.227 -8.318 1.00 0.00 H new ATOM 0 HD13 LEU A 104 13.107 8.673 -8.615 1.00 0.00 H new ATOM 0 HD21 LEU A 104 12.944 11.401 -7.189 1.00 0.00 H new ATOM 0 HD22 LEU A 104 13.713 11.160 -8.776 1.00 0.00 H new ATOM 0 HD23 LEU A 104 12.418 12.367 -8.588 1.00 0.00 H new ATOM 1707 N ASN A 105 9.711 11.271 -12.772 1.00 0.00 N ATOM 1708 CA ASN A 105 9.531 11.024 -14.199 1.00 0.00 C ATOM 1709 C ASN A 105 8.700 12.117 -14.862 1.00 0.00 C ATOM 1710 O ASN A 105 8.319 11.987 -16.027 1.00 0.00 O ATOM 1711 CB ASN A 105 8.881 9.658 -14.426 1.00 0.00 C ATOM 1712 CG ASN A 105 9.798 8.505 -14.060 1.00 0.00 C ATOM 1713 OD1 ASN A 105 10.580 8.029 -14.886 1.00 0.00 O ATOM 1714 ND2 ASN A 105 9.707 8.042 -12.823 1.00 0.00 N ATOM 0 H ASN A 105 8.847 11.287 -12.230 1.00 0.00 H new ATOM 0 HA ASN A 105 10.519 11.032 -14.659 1.00 0.00 H new ATOM 0 HB2 ASN A 105 7.968 9.592 -13.835 1.00 0.00 H new ATOM 0 HB3 ASN A 105 8.591 9.568 -15.473 1.00 0.00 H new ATOM 0 HD21 ASN A 105 10.296 7.265 -12.525 1.00 0.00 H new ATOM 0 HD22 ASN A 105 9.048 8.463 -12.168 1.00 0.00 H new ATOM 1721 N LEU A 106 8.431 13.189 -14.114 1.00 0.00 N ATOM 1722 CA LEU A 106 7.676 14.336 -14.625 1.00 0.00 C ATOM 1723 C LEU A 106 6.298 13.897 -15.134 1.00 0.00 C ATOM 1724 O LEU A 106 5.851 14.299 -16.213 1.00 0.00 O ATOM 1725 CB LEU A 106 8.471 15.037 -15.737 1.00 0.00 C ATOM 1726 CG LEU A 106 7.908 16.381 -16.205 1.00 0.00 C ATOM 1727 CD1 LEU A 106 7.930 17.396 -15.072 1.00 0.00 C ATOM 1728 CD2 LEU A 106 8.692 16.900 -17.399 1.00 0.00 C ATOM 0 H LEU A 106 8.728 13.287 -13.143 1.00 0.00 H new ATOM 0 HA LEU A 106 7.521 15.043 -13.810 1.00 0.00 H new ATOM 0 HB2 LEU A 106 9.491 15.193 -15.387 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.527 14.368 -16.596 1.00 0.00 H new ATOM 0 HG LEU A 106 6.873 16.231 -16.510 1.00 0.00 H new ATOM 0 HD11 LEU A 106 7.526 18.345 -15.425 1.00 0.00 H new ATOM 0 HD12 LEU A 106 7.324 17.029 -14.243 1.00 0.00 H new ATOM 0 HD13 LEU A 106 8.956 17.542 -14.734 1.00 0.00 H new ATOM 0 HD21 LEU A 106 8.278 17.856 -17.718 1.00 0.00 H new ATOM 0 HD22 LEU A 106 9.737 17.033 -17.118 1.00 0.00 H new ATOM 0 HD23 LEU A 106 8.624 16.184 -18.218 1.00 0.00 H new ATOM 1740 N GLY A 107 5.622 13.087 -14.331 1.00 0.00 N ATOM 1741 CA GLY A 107 4.328 12.559 -14.716 1.00 0.00 C ATOM 1742 C GLY A 107 3.197 13.546 -14.502 1.00 0.00 C ATOM 1743 O GLY A 107 2.057 13.254 -14.859 1.00 0.00 O ATOM 0 H GLY A 107 5.949 12.784 -13.414 1.00 0.00 H new ATOM 0 HA2 GLY A 107 4.357 12.271 -15.767 1.00 0.00 H new ATOM 0 HA3 GLY A 107 4.126 11.654 -14.143 1.00 0.00 H new ATOM 1747 N ASP A 108 3.525 14.702 -13.917 1.00 0.00 N ATOM 1748 CA ASP A 108 2.560 15.784 -13.673 1.00 0.00 C ATOM 1749 C ASP A 108 1.630 15.453 -12.505 1.00 0.00 C ATOM 1750 O ASP A 108 0.978 14.409 -12.482 1.00 0.00 O ATOM 1751 CB ASP A 108 1.747 16.098 -14.932 1.00 0.00 C ATOM 1752 CG ASP A 108 0.812 17.267 -14.735 1.00 0.00 C ATOM 1753 OD1 ASP A 108 -0.374 17.037 -14.432 1.00 0.00 O ATOM 1754 OD2 ASP A 108 1.265 18.422 -14.876 1.00 0.00 O ATOM 0 H ASP A 108 4.470 14.917 -13.598 1.00 0.00 H new ATOM 0 HA ASP A 108 3.133 16.672 -13.406 1.00 0.00 H new ATOM 0 HB2 ASP A 108 2.427 16.315 -15.756 1.00 0.00 H new ATOM 0 HB3 ASP A 108 1.170 15.218 -15.218 1.00 0.00 H new ATOM 1759 N GLU A 109 1.557 16.361 -11.537 1.00 0.00 N ATOM 1760 CA GLU A 109 0.802 16.110 -10.315 1.00 0.00 C ATOM 1761 C GLU A 109 -0.701 16.289 -10.539 1.00 0.00 C ATOM 1762 O GLU A 109 -1.515 15.835 -9.733 1.00 0.00 O ATOM 1763 CB GLU A 109 1.278 17.039 -9.195 1.00 0.00 C ATOM 1764 CG GLU A 109 0.847 16.580 -7.808 1.00 0.00 C ATOM 1765 CD GLU A 109 1.218 17.556 -6.706 1.00 0.00 C ATOM 1766 OE1 GLU A 109 2.156 18.356 -6.888 1.00 0.00 O ATOM 1767 OE2 GLU A 109 0.579 17.508 -5.632 1.00 0.00 O ATOM 0 H GLU A 109 2.010 17.274 -11.575 1.00 0.00 H new ATOM 0 HA GLU A 109 0.979 15.075 -10.023 1.00 0.00 H new ATOM 0 HB2 GLU A 109 2.365 17.107 -9.226 1.00 0.00 H new ATOM 0 HB3 GLU A 109 0.891 18.042 -9.375 1.00 0.00 H new ATOM 0 HG2 GLU A 109 -0.233 16.431 -7.802 1.00 0.00 H new ATOM 0 HG3 GLU A 109 1.303 15.613 -7.595 1.00 0.00 H new ATOM 1774 N GLU A 110 -1.076 16.931 -11.641 1.00 0.00 N ATOM 1775 CA GLU A 110 -2.482 17.194 -11.916 1.00 0.00 C ATOM 1776 C GLU A 110 -3.157 15.956 -12.487 1.00 0.00 C ATOM 1777 O GLU A 110 -4.349 15.730 -12.265 1.00 0.00 O ATOM 1778 CB GLU A 110 -2.648 18.375 -12.871 1.00 0.00 C ATOM 1779 CG GLU A 110 -2.114 19.688 -12.322 1.00 0.00 C ATOM 1780 CD GLU A 110 -2.424 20.859 -13.227 1.00 0.00 C ATOM 1781 OE1 GLU A 110 -1.671 21.080 -14.200 1.00 0.00 O ATOM 1782 OE2 GLU A 110 -3.417 21.571 -12.969 1.00 0.00 O ATOM 0 H GLU A 110 -0.431 17.276 -12.352 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.962 17.451 -10.972 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -2.137 18.148 -13.806 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.706 18.494 -13.107 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.545 19.869 -11.337 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -1.035 19.611 -12.189 1.00 0.00 H new ATOM 1789 N LEU A 111 -2.394 15.136 -13.204 1.00 0.00 N ATOM 1790 CA LEU A 111 -2.920 13.885 -13.740 1.00 0.00 C ATOM 1791 C LEU A 111 -3.340 12.958 -12.606 1.00 0.00 C ATOM 1792 O LEU A 111 -4.230 12.121 -12.761 1.00 0.00 O ATOM 1793 CB LEU A 111 -1.886 13.198 -14.638 1.00 0.00 C ATOM 1794 CG LEU A 111 -1.594 13.917 -15.956 1.00 0.00 C ATOM 1795 CD1 LEU A 111 -0.547 13.161 -16.755 1.00 0.00 C ATOM 1796 CD2 LEU A 111 -2.868 14.074 -16.773 1.00 0.00 C ATOM 0 H LEU A 111 -1.415 15.314 -13.426 1.00 0.00 H new ATOM 0 HA LEU A 111 -3.796 14.115 -14.346 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -0.954 13.098 -14.082 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.234 12.189 -14.861 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.205 14.909 -15.725 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.352 13.687 -17.689 1.00 0.00 H new ATOM 0 HD12 LEU A 111 0.375 13.095 -16.177 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -0.911 12.157 -16.973 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -2.640 14.588 -17.707 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.283 13.090 -16.992 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.594 14.657 -16.206 1.00 0.00 H new ATOM 1808 N LEU A 112 -2.713 13.135 -11.454 1.00 0.00 N ATOM 1809 CA LEU A 112 -3.044 12.357 -10.271 1.00 0.00 C ATOM 1810 C LEU A 112 -4.363 12.849 -9.667 1.00 0.00 C ATOM 1811 O LEU A 112 -5.040 12.117 -8.948 1.00 0.00 O ATOM 1812 CB LEU A 112 -1.888 12.460 -9.257 1.00 0.00 C ATOM 1813 CG LEU A 112 -1.966 11.543 -8.028 1.00 0.00 C ATOM 1814 CD1 LEU A 112 -0.566 11.210 -7.537 1.00 0.00 C ATOM 1815 CD2 LEU A 112 -2.756 12.202 -6.908 1.00 0.00 C ATOM 0 H LEU A 112 -1.967 13.816 -11.313 1.00 0.00 H new ATOM 0 HA LEU A 112 -3.176 11.310 -10.542 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -0.956 12.249 -9.781 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -1.831 13.491 -8.909 1.00 0.00 H new ATOM 0 HG LEU A 112 -2.477 10.626 -8.321 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -0.631 10.559 -6.665 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -0.014 10.702 -8.328 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.047 12.129 -7.265 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -2.797 11.532 -6.049 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -2.270 13.134 -6.619 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -3.769 12.413 -7.252 1.00 0.00 H new ATOM 1827 N GLU A 113 -4.757 14.064 -10.034 1.00 0.00 N ATOM 1828 CA GLU A 113 -5.895 14.734 -9.415 1.00 0.00 C ATOM 1829 C GLU A 113 -7.075 14.837 -10.372 1.00 0.00 C ATOM 1830 O GLU A 113 -7.895 15.749 -10.270 1.00 0.00 O ATOM 1831 CB GLU A 113 -5.484 16.123 -8.932 1.00 0.00 C ATOM 1832 CG GLU A 113 -4.723 16.104 -7.619 1.00 0.00 C ATOM 1833 CD GLU A 113 -5.625 15.862 -6.424 1.00 0.00 C ATOM 1834 OE1 GLU A 113 -6.072 16.855 -5.807 1.00 0.00 O ATOM 1835 OE2 GLU A 113 -5.883 14.688 -6.088 1.00 0.00 O ATOM 0 H GLU A 113 -4.300 14.609 -10.765 1.00 0.00 H new ATOM 0 HA GLU A 113 -6.213 14.134 -8.562 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -4.866 16.597 -9.695 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -6.376 16.738 -8.817 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -3.960 15.326 -7.657 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -4.204 17.054 -7.491 1.00 0.00 H new ATOM 1842 N ARG A 114 -7.149 13.910 -11.314 1.00 0.00 N ATOM 1843 CA ARG A 114 -8.355 13.740 -12.108 1.00 0.00 C ATOM 1844 C ARG A 114 -9.374 12.978 -11.262 1.00 0.00 C ATOM 1845 O ARG A 114 -9.283 12.971 -10.037 1.00 0.00 O ATOM 1846 CB ARG A 114 -8.042 12.969 -13.397 1.00 0.00 C ATOM 1847 CG ARG A 114 -7.223 13.749 -14.416 1.00 0.00 C ATOM 1848 CD ARG A 114 -6.685 12.840 -15.516 1.00 0.00 C ATOM 1849 NE ARG A 114 -5.711 11.886 -14.988 1.00 0.00 N ATOM 1850 CZ ARG A 114 -5.355 10.741 -15.575 1.00 0.00 C ATOM 1851 NH1 ARG A 114 -5.837 10.398 -16.764 1.00 0.00 N ATOM 1852 NH2 ARG A 114 -4.494 9.947 -14.963 1.00 0.00 N ATOM 0 H ARG A 114 -6.392 13.267 -11.547 1.00 0.00 H new ATOM 0 HA ARG A 114 -8.758 14.712 -12.393 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -7.504 12.057 -13.138 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -8.981 12.665 -13.860 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -7.840 14.531 -14.858 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -6.392 14.245 -13.914 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -7.510 12.301 -15.981 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -6.220 13.444 -16.295 1.00 0.00 H new ATOM 0 HE ARG A 114 -5.267 12.114 -14.098 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -6.492 11.014 -17.246 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -5.552 9.519 -17.195 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -4.112 10.212 -14.055 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -4.212 9.069 -15.398 1.00 0.00 H new ATOM 1866 N GLU A 115 -10.330 12.329 -11.895 1.00 0.00 N ATOM 1867 CA GLU A 115 -11.240 11.455 -11.171 1.00 0.00 C ATOM 1868 C GLU A 115 -11.259 10.098 -11.860 1.00 0.00 C ATOM 1869 O GLU A 115 -10.879 10.004 -13.017 1.00 0.00 O ATOM 1870 CB GLU A 115 -12.646 12.057 -11.111 1.00 0.00 C ATOM 1871 CG GLU A 115 -13.304 11.927 -9.745 1.00 0.00 C ATOM 1872 CD GLU A 115 -13.375 10.493 -9.266 1.00 0.00 C ATOM 1873 OE1 GLU A 115 -12.372 9.995 -8.705 1.00 0.00 O ATOM 1874 OE2 GLU A 115 -14.415 9.848 -9.473 1.00 0.00 O ATOM 0 H GLU A 115 -10.499 12.387 -12.899 1.00 0.00 H new ATOM 0 HA GLU A 115 -10.895 11.339 -10.143 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -12.593 13.112 -11.381 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -13.274 11.568 -11.856 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -12.748 12.521 -9.020 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -14.311 12.341 -9.790 1.00 0.00 H new ATOM 1881 N LEU A 116 -11.668 9.055 -11.143 1.00 0.00 N ATOM 1882 CA LEU A 116 -11.750 7.706 -11.712 1.00 0.00 C ATOM 1883 C LEU A 116 -12.521 7.705 -13.038 1.00 0.00 C ATOM 1884 O LEU A 116 -12.077 7.112 -14.020 1.00 0.00 O ATOM 1885 CB LEU A 116 -12.403 6.745 -10.707 1.00 0.00 C ATOM 1886 CG LEU A 116 -12.797 5.371 -11.257 1.00 0.00 C ATOM 1887 CD1 LEU A 116 -11.591 4.634 -11.826 1.00 0.00 C ATOM 1888 CD2 LEU A 116 -13.460 4.544 -10.166 1.00 0.00 C ATOM 0 H LEU A 116 -11.949 9.115 -10.164 1.00 0.00 H new ATOM 0 HA LEU A 116 -10.736 7.364 -11.919 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -11.715 6.598 -9.874 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -13.295 7.223 -10.303 1.00 0.00 H new ATOM 0 HG LEU A 116 -13.506 5.522 -12.071 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -11.905 3.663 -12.208 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -11.156 5.219 -12.636 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -10.848 4.492 -11.041 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -13.737 3.569 -10.566 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -12.765 4.412 -9.337 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -14.354 5.058 -9.812 1.00 0.00 H new ATOM 1900 N ALA A 117 -13.657 8.394 -13.072 1.00 0.00 N ATOM 1901 CA ALA A 117 -14.463 8.492 -14.290 1.00 0.00 C ATOM 1902 C ALA A 117 -13.776 9.340 -15.370 1.00 0.00 C ATOM 1903 O ALA A 117 -14.257 9.421 -16.503 1.00 0.00 O ATOM 1904 CB ALA A 117 -15.832 9.065 -13.963 1.00 0.00 C ATOM 0 H ALA A 117 -14.043 8.894 -12.271 1.00 0.00 H new ATOM 0 HA ALA A 117 -14.577 7.485 -14.691 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -16.425 9.134 -14.875 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -16.338 8.414 -13.250 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -15.717 10.058 -13.529 1.00 0.00 H new ATOM 1910 N LEU A 118 -12.663 9.972 -15.017 1.00 0.00 N ATOM 1911 CA LEU A 118 -11.910 10.801 -15.958 1.00 0.00 C ATOM 1912 C LEU A 118 -10.610 10.112 -16.360 1.00 0.00 C ATOM 1913 O LEU A 118 -9.898 10.584 -17.245 1.00 0.00 O ATOM 1914 CB LEU A 118 -11.549 12.155 -15.336 1.00 0.00 C ATOM 1915 CG LEU A 118 -12.698 12.947 -14.714 1.00 0.00 C ATOM 1916 CD1 LEU A 118 -12.154 14.206 -14.053 1.00 0.00 C ATOM 1917 CD2 LEU A 118 -13.741 13.299 -15.765 1.00 0.00 C ATOM 0 H LEU A 118 -12.258 9.927 -14.082 1.00 0.00 H new ATOM 0 HA LEU A 118 -12.546 10.951 -16.830 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -10.795 11.987 -14.567 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -11.087 12.772 -16.107 1.00 0.00 H new ATOM 0 HG LEU A 118 -13.182 12.331 -13.956 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -12.976 14.769 -13.610 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -11.443 13.930 -13.275 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -11.654 14.822 -14.800 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -14.550 13.863 -15.300 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -13.280 13.903 -16.547 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -14.141 12.384 -16.202 1.00 0.00 H new ATOM 1929 N LEU A 119 -10.293 9.012 -15.691 1.00 0.00 N ATOM 1930 CA LEU A 119 -9.013 8.347 -15.887 1.00 0.00 C ATOM 1931 C LEU A 119 -9.019 7.492 -17.143 1.00 0.00 C ATOM 1932 O LEU A 119 -9.516 6.366 -17.152 1.00 0.00 O ATOM 1933 CB LEU A 119 -8.635 7.513 -14.655 1.00 0.00 C ATOM 1934 CG LEU A 119 -7.580 8.154 -13.741 1.00 0.00 C ATOM 1935 CD1 LEU A 119 -7.907 9.610 -13.472 1.00 0.00 C ATOM 1936 CD2 LEU A 119 -7.463 7.402 -12.425 1.00 0.00 C ATOM 0 H LEU A 119 -10.904 8.562 -15.009 1.00 0.00 H new ATOM 0 HA LEU A 119 -8.255 9.119 -16.019 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.536 7.326 -14.071 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.265 6.544 -14.990 1.00 0.00 H new ATOM 0 HG LEU A 119 -6.623 8.098 -14.260 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -7.145 10.040 -12.823 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -7.932 10.157 -14.414 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.880 9.681 -12.986 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -6.709 7.879 -11.799 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -8.424 7.417 -11.911 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -7.172 6.370 -12.620 1.00 0.00 H new ATOM 1948 N VAL A 120 -8.495 8.066 -18.213 1.00 0.00 N ATOM 1949 CA VAL A 120 -8.324 7.356 -19.464 1.00 0.00 C ATOM 1950 C VAL A 120 -6.945 6.714 -19.480 1.00 0.00 C ATOM 1951 O VAL A 120 -6.037 7.179 -18.790 1.00 0.00 O ATOM 1952 CB VAL A 120 -8.473 8.304 -20.680 1.00 0.00 C ATOM 1953 CG1 VAL A 120 -8.504 7.524 -21.988 1.00 0.00 C ATOM 1954 CG2 VAL A 120 -9.720 9.163 -20.539 1.00 0.00 C ATOM 0 H VAL A 120 -8.178 9.035 -18.236 1.00 0.00 H new ATOM 0 HA VAL A 120 -9.100 6.594 -19.540 1.00 0.00 H new ATOM 0 HB VAL A 120 -7.602 8.959 -20.702 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -8.609 8.217 -22.823 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -7.577 6.962 -22.098 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -9.348 6.834 -21.980 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -9.807 9.822 -21.403 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -10.599 8.521 -20.482 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -9.648 9.762 -19.631 1.00 0.00 H new ATOM 1964 N SER A 121 -6.794 5.648 -20.251 1.00 0.00 N ATOM 1965 CA SER A 121 -5.534 4.925 -20.327 1.00 0.00 C ATOM 1966 C SER A 121 -4.411 5.804 -20.891 1.00 0.00 C ATOM 1967 O SER A 121 -4.659 6.914 -21.370 1.00 0.00 O ATOM 1968 CB SER A 121 -5.719 3.672 -21.187 1.00 0.00 C ATOM 1969 OG SER A 121 -6.331 3.983 -22.428 1.00 0.00 O ATOM 0 H SER A 121 -7.534 5.262 -20.837 1.00 0.00 H new ATOM 0 HA SER A 121 -5.241 4.635 -19.318 1.00 0.00 H new ATOM 0 HB2 SER A 121 -4.751 3.204 -21.364 1.00 0.00 H new ATOM 0 HB3 SER A 121 -6.330 2.947 -20.650 1.00 0.00 H new ATOM 0 HG SER A 121 -5.889 4.763 -22.824 1.00 0.00 H new ATOM 1975 N ALA A 122 -3.182 5.281 -20.836 1.00 0.00 N ATOM 1976 CA ALA A 122 -1.991 5.985 -21.323 1.00 0.00 C ATOM 1977 C ALA A 122 -2.212 6.604 -22.702 1.00 0.00 C ATOM 1978 O ALA A 122 -1.685 7.674 -22.998 1.00 0.00 O ATOM 1979 CB ALA A 122 -0.806 5.034 -21.358 1.00 0.00 C ATOM 0 H ALA A 122 -2.985 4.357 -20.452 1.00 0.00 H new ATOM 0 HA ALA A 122 -1.785 6.801 -20.631 1.00 0.00 H new ATOM 0 HB1 ALA A 122 0.075 5.564 -21.721 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -0.614 4.655 -20.354 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -1.028 4.200 -22.024 1.00 0.00 H new ATOM 1985 N HIS A 123 -2.982 5.926 -23.544 1.00 0.00 N ATOM 1986 CA HIS A 123 -3.352 6.493 -24.830 1.00 0.00 C ATOM 1987 C HIS A 123 -4.839 6.828 -24.825 1.00 0.00 C ATOM 1988 O HIS A 123 -5.641 6.108 -24.225 1.00 0.00 O ATOM 1989 CB HIS A 123 -3.000 5.538 -25.996 1.00 0.00 C ATOM 1990 CG HIS A 123 -4.010 4.459 -26.287 1.00 0.00 C ATOM 1991 ND1 HIS A 123 -3.829 3.135 -25.942 1.00 0.00 N ATOM 1992 CD2 HIS A 123 -5.204 4.514 -26.928 1.00 0.00 C ATOM 1993 CE1 HIS A 123 -4.867 2.427 -26.358 1.00 0.00 C ATOM 1994 NE2 HIS A 123 -5.713 3.243 -26.959 1.00 0.00 N ATOM 0 H HIS A 123 -3.357 4.995 -23.361 1.00 0.00 H new ATOM 0 HA HIS A 123 -2.779 7.407 -24.986 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -2.862 6.133 -26.899 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -2.043 5.064 -25.777 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -5.668 5.398 -27.339 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -4.999 1.363 -26.228 1.00 0.00 H new ATOM 0 HE2 HIS A 123 -6.602 2.971 -27.379 1.00 0.00 H new ATOM 2003 N ASP A 124 -5.201 7.913 -25.486 1.00 0.00 N ATOM 2004 CA ASP A 124 -6.597 8.309 -25.598 1.00 0.00 C ATOM 2005 C ASP A 124 -6.928 8.639 -27.045 1.00 0.00 C ATOM 2006 O ASP A 124 -6.140 9.285 -27.740 1.00 0.00 O ATOM 2007 CB ASP A 124 -6.921 9.505 -24.685 1.00 0.00 C ATOM 2008 CG ASP A 124 -6.214 10.789 -25.081 1.00 0.00 C ATOM 2009 OD1 ASP A 124 -6.840 11.640 -25.757 1.00 0.00 O ATOM 2010 OD2 ASP A 124 -5.038 10.968 -24.700 1.00 0.00 O ATOM 0 H ASP A 124 -4.546 8.539 -25.956 1.00 0.00 H new ATOM 0 HA ASP A 124 -7.213 7.471 -25.271 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -7.997 9.676 -24.695 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -6.648 9.252 -23.660 1.00 0.00 H new ATOM 2015 N ASP A 125 -8.081 8.168 -27.499 1.00 0.00 N ATOM 2016 CA ASP A 125 -8.531 8.396 -28.868 1.00 0.00 C ATOM 2017 C ASP A 125 -9.972 7.932 -29.017 1.00 0.00 C ATOM 2018 O ASP A 125 -10.206 6.707 -29.023 1.00 0.00 O ATOM 2019 CB ASP A 125 -7.637 7.660 -29.869 1.00 0.00 C ATOM 2020 CG ASP A 125 -8.011 7.956 -31.307 1.00 0.00 C ATOM 2021 OD1 ASP A 125 -8.678 7.113 -31.939 1.00 0.00 O ATOM 2022 OD2 ASP A 125 -7.626 9.032 -31.816 1.00 0.00 O ATOM 0 H ASP A 125 -8.729 7.620 -26.933 1.00 0.00 H new ATOM 0 HA ASP A 125 -8.469 9.464 -29.079 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -6.598 7.944 -29.701 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -7.706 6.587 -29.692 1.00 0.00 H new TER 2027 ASP A 125