USER MOD reduce.3.24.130724 H: found=0, std=0, add=1001, rem=0, adj=14 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 121 SER OG : rot 51:sc= 1.28 USER MOD Set 1.2: A 123 HIS :FLIP no HE2:sc= 0.368 F(o=-0.67,f=1.7) USER MOD Set 2.1: A 71 MET CE :methyl -167:sc= -0.108 (180deg=-0.18) USER MOD Set 2.2: A 87 CYS SG : rot 180:sc= -1.78 USER MOD Set 3.1: A 24 GLN : amide:sc= -0.505! K(o=-2.9!,f=-7.6) USER MOD Set 3.2: A 50 ASN : amide:sc= -2.42! C(o=-2.9!,f=-7.6!) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -174:sc= -0.294 (180deg=-0.328) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 4 GLN :FLIP amide:sc= -1.02 F(o=-5.7!,f=-1) USER MOD Single : A 5 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 12 HIS : no HD1:sc= 1.22 K(o=1.2,f=-3.8!) USER MOD Single : A 20 SER OG : rot 52:sc= 0.877 USER MOD Single : A 34 HIS : no HD1:sc= -0.237 X(o=-0.24,f=0.038) USER MOD Single : A 37 SER OG : rot -23:sc= 0.798 USER MOD Single : A 39 HIS : +bothHN:sc= -5.26! C(o=-5.3!,f=-15!) USER MOD Single : A 45 GLN : amide:sc= 1.43 K(o=1.4,f=-0.74) USER MOD Single : A 47 GLN : amide:sc=-0.000448 X(o=-0.00045,f=-0.032) USER MOD Single : A 54 GLN : amide:sc= 0 X(o=0,f=-0.44) USER MOD Single : A 62 TYR OH : rot -117:sc= 2.51 USER MOD Single : A 74 SER OG : rot 180:sc= 0 USER MOD Single : A 88 GLN : amide:sc= -2.72! C(o=-2.7!,f=-4!) USER MOD Single : A 89 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 94 SER OG : rot -149:sc= -0.26 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 HIS : no HD1:sc= 0.0684 K(o=0.068,f=-2.7!) USER MOD Single : A 105 ASN : amide:sc= 1.03 K(o=1,f=-0.075) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -0.023 32.723 -31.719 1.00 0.00 N ATOM 2 CA MET A 1 0.396 31.673 -32.678 1.00 0.00 C ATOM 3 C MET A 1 1.523 30.825 -32.097 1.00 0.00 C ATOM 4 O MET A 1 2.095 29.981 -32.787 1.00 0.00 O ATOM 5 CB MET A 1 0.854 32.301 -34.000 1.00 0.00 C ATOM 6 CG MET A 1 -0.255 33.016 -34.753 1.00 0.00 C ATOM 7 SD MET A 1 0.309 33.747 -36.303 1.00 0.00 S ATOM 8 CE MET A 1 -1.223 34.445 -36.916 1.00 0.00 C ATOM 0 H1 MET A 1 -0.856 33.221 -32.092 1.00 0.00 H new ATOM 0 H2 MET A 1 -0.262 32.285 -30.807 1.00 0.00 H new ATOM 0 H3 MET A 1 0.754 33.401 -31.585 1.00 0.00 H new ATOM 0 HA MET A 1 -0.465 31.032 -32.867 1.00 0.00 H new ATOM 0 HB2 MET A 1 1.658 33.009 -33.797 1.00 0.00 H new ATOM 0 HB3 MET A 1 1.270 31.521 -34.638 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.060 32.311 -34.961 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.673 33.798 -34.119 1.00 0.00 H new ATOM 0 HE1 MET A 1 -1.042 34.935 -37.873 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.958 33.651 -37.048 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.602 35.174 -36.200 1.00 0.00 H new ATOM 18 N SER A 2 1.835 31.036 -30.823 1.00 0.00 N ATOM 19 CA SER A 2 2.930 30.325 -30.187 1.00 0.00 C ATOM 20 C SER A 2 2.452 29.588 -28.942 1.00 0.00 C ATOM 21 O SER A 2 1.648 30.111 -28.168 1.00 0.00 O ATOM 22 CB SER A 2 4.043 31.305 -29.815 1.00 0.00 C ATOM 23 OG SER A 2 4.490 32.030 -30.950 1.00 0.00 O ATOM 0 H SER A 2 1.345 31.692 -30.215 1.00 0.00 H new ATOM 0 HA SER A 2 3.316 29.590 -30.894 1.00 0.00 H new ATOM 0 HB2 SER A 2 3.681 31.999 -29.056 1.00 0.00 H new ATOM 0 HB3 SER A 2 4.879 30.760 -29.376 1.00 0.00 H new ATOM 0 HG SER A 2 5.200 32.650 -30.683 1.00 0.00 H new ATOM 29 N ASP A 3 2.944 28.366 -28.765 1.00 0.00 N ATOM 30 CA ASP A 3 2.633 27.569 -27.582 1.00 0.00 C ATOM 31 C ASP A 3 3.144 28.264 -26.326 1.00 0.00 C ATOM 32 O ASP A 3 2.477 28.269 -25.288 1.00 0.00 O ATOM 33 CB ASP A 3 3.280 26.184 -27.680 1.00 0.00 C ATOM 34 CG ASP A 3 2.900 25.436 -28.941 1.00 0.00 C ATOM 35 OD1 ASP A 3 2.194 24.410 -28.843 1.00 0.00 O ATOM 36 OD2 ASP A 3 3.310 25.871 -30.036 1.00 0.00 O ATOM 0 H ASP A 3 3.564 27.903 -29.430 1.00 0.00 H new ATOM 0 HA ASP A 3 1.550 27.460 -27.526 1.00 0.00 H new ATOM 0 HB2 ASP A 3 4.364 26.293 -27.643 1.00 0.00 H new ATOM 0 HB3 ASP A 3 2.989 25.592 -26.812 1.00 0.00 H new ATOM 41 N GLN A 4 4.354 28.825 -26.441 1.00 0.00 N ATOM 42 CA GLN A 4 5.031 29.536 -25.348 1.00 0.00 C ATOM 43 C GLN A 4 5.523 28.563 -24.276 1.00 0.00 C ATOM 44 O GLN A 4 6.657 28.657 -23.813 1.00 0.00 O ATOM 45 CB GLN A 4 4.130 30.617 -24.730 1.00 0.00 C ATOM 46 CG GLN A 4 4.793 31.410 -23.609 1.00 0.00 C ATOM 47 CD GLN A 4 5.854 32.396 -24.089 1.00 0.00 C ATOM 48 OE1 GLN A 4 6.517 32.095 -25.197 1.00 0.00 O flip ATOM 49 NE2 GLN A 4 6.078 33.427 -23.458 1.00 0.00 N flip ATOM 0 H GLN A 4 4.897 28.798 -27.304 1.00 0.00 H new ATOM 0 HA GLN A 4 5.899 30.035 -25.778 1.00 0.00 H new ATOM 0 HB2 GLN A 4 3.818 31.307 -25.514 1.00 0.00 H new ATOM 0 HB3 GLN A 4 3.227 30.145 -24.343 1.00 0.00 H new ATOM 0 HG2 GLN A 4 4.025 31.957 -23.061 1.00 0.00 H new ATOM 0 HG3 GLN A 4 5.251 30.713 -22.907 1.00 0.00 H new ATOM 0 HE21 GLN A 4 5.551 33.630 -22.609 1.00 0.00 H new ATOM 0 HE22 GLN A 4 6.791 34.079 -23.784 1.00 0.00 H new ATOM 58 N HIS A 5 4.665 27.633 -23.887 1.00 0.00 N ATOM 59 CA HIS A 5 5.041 26.595 -22.942 1.00 0.00 C ATOM 60 C HIS A 5 5.853 25.529 -23.663 1.00 0.00 C ATOM 61 O HIS A 5 5.422 24.999 -24.687 1.00 0.00 O ATOM 62 CB HIS A 5 3.800 25.977 -22.286 1.00 0.00 C ATOM 63 CG HIS A 5 3.012 26.957 -21.472 1.00 0.00 C ATOM 64 ND1 HIS A 5 3.203 27.138 -20.122 1.00 0.00 N ATOM 65 CD2 HIS A 5 2.034 27.823 -21.831 1.00 0.00 C ATOM 66 CE1 HIS A 5 2.377 28.070 -19.684 1.00 0.00 C ATOM 67 NE2 HIS A 5 1.658 28.505 -20.702 1.00 0.00 N ATOM 0 H HIS A 5 3.700 27.576 -24.213 1.00 0.00 H new ATOM 0 HA HIS A 5 5.648 27.037 -22.151 1.00 0.00 H new ATOM 0 HB2 HIS A 5 3.158 25.559 -23.061 1.00 0.00 H new ATOM 0 HB3 HIS A 5 4.109 25.149 -21.647 1.00 0.00 H new ATOM 0 HD2 HIS A 5 1.626 27.952 -22.823 1.00 0.00 H new ATOM 0 HE1 HIS A 5 2.302 28.418 -18.664 1.00 0.00 H new ATOM 0 HE2 HIS A 5 0.941 29.229 -20.656 1.00 0.00 H new ATOM 76 N ASP A 6 7.030 25.225 -23.137 1.00 0.00 N ATOM 77 CA ASP A 6 7.964 24.340 -23.827 1.00 0.00 C ATOM 78 C ASP A 6 7.638 22.870 -23.580 1.00 0.00 C ATOM 79 O ASP A 6 8.213 21.982 -24.207 1.00 0.00 O ATOM 80 CB ASP A 6 9.398 24.647 -23.395 1.00 0.00 C ATOM 81 CG ASP A 6 10.422 23.835 -24.163 1.00 0.00 C ATOM 82 OD1 ASP A 6 11.124 23.013 -23.537 1.00 0.00 O ATOM 83 OD2 ASP A 6 10.525 24.014 -25.396 1.00 0.00 O ATOM 0 H ASP A 6 7.363 25.575 -22.239 1.00 0.00 H new ATOM 0 HA ASP A 6 7.865 24.523 -24.897 1.00 0.00 H new ATOM 0 HB2 ASP A 6 9.598 25.709 -23.540 1.00 0.00 H new ATOM 0 HB3 ASP A 6 9.504 24.445 -22.329 1.00 0.00 H new ATOM 88 N GLU A 7 6.711 22.605 -22.676 1.00 0.00 N ATOM 89 CA GLU A 7 6.288 21.235 -22.420 1.00 0.00 C ATOM 90 C GLU A 7 5.345 20.767 -23.528 1.00 0.00 C ATOM 91 O GLU A 7 4.141 20.612 -23.323 1.00 0.00 O ATOM 92 CB GLU A 7 5.618 21.113 -21.049 1.00 0.00 C ATOM 93 CG GLU A 7 6.498 21.578 -19.898 1.00 0.00 C ATOM 94 CD GLU A 7 7.839 20.870 -19.858 1.00 0.00 C ATOM 95 OE1 GLU A 7 8.829 21.434 -20.373 1.00 0.00 O ATOM 96 OE2 GLU A 7 7.912 19.745 -19.323 1.00 0.00 O ATOM 0 H GLU A 7 6.239 23.311 -22.111 1.00 0.00 H new ATOM 0 HA GLU A 7 7.170 20.595 -22.414 1.00 0.00 H new ATOM 0 HB2 GLU A 7 4.697 21.697 -21.050 1.00 0.00 H new ATOM 0 HB3 GLU A 7 5.336 20.073 -20.883 1.00 0.00 H new ATOM 0 HG2 GLU A 7 6.662 22.652 -19.984 1.00 0.00 H new ATOM 0 HG3 GLU A 7 5.975 21.409 -18.956 1.00 0.00 H new ATOM 103 N ARG A 8 5.910 20.585 -24.713 1.00 0.00 N ATOM 104 CA ARG A 8 5.150 20.196 -25.890 1.00 0.00 C ATOM 105 C ARG A 8 5.276 18.694 -26.120 1.00 0.00 C ATOM 106 O ARG A 8 6.105 18.035 -25.486 1.00 0.00 O ATOM 107 CB ARG A 8 5.642 20.973 -27.116 1.00 0.00 C ATOM 108 CG ARG A 8 5.643 22.478 -26.907 1.00 0.00 C ATOM 109 CD ARG A 8 6.283 23.215 -28.072 1.00 0.00 C ATOM 110 NE ARG A 8 5.414 23.284 -29.248 1.00 0.00 N ATOM 111 CZ ARG A 8 5.845 23.617 -30.465 1.00 0.00 C ATOM 112 NH1 ARG A 8 7.140 23.820 -30.681 1.00 0.00 N ATOM 113 NH2 ARG A 8 4.984 23.736 -31.469 1.00 0.00 N ATOM 0 H ARG A 8 6.909 20.703 -24.885 1.00 0.00 H new ATOM 0 HA ARG A 8 4.099 20.435 -25.730 1.00 0.00 H new ATOM 0 HB2 ARG A 8 6.652 20.646 -27.365 1.00 0.00 H new ATOM 0 HB3 ARG A 8 5.009 20.731 -27.970 1.00 0.00 H new ATOM 0 HG2 ARG A 8 4.618 22.826 -26.777 1.00 0.00 H new ATOM 0 HG3 ARG A 8 6.180 22.716 -25.989 1.00 0.00 H new ATOM 0 HD2 ARG A 8 6.542 24.226 -27.758 1.00 0.00 H new ATOM 0 HD3 ARG A 8 7.214 22.717 -28.343 1.00 0.00 H new ATOM 0 HE ARG A 8 4.425 23.065 -29.130 1.00 0.00 H new ATOM 0 HH11 ARG A 8 7.806 23.721 -29.915 1.00 0.00 H new ATOM 0 HH12 ARG A 8 7.468 24.075 -31.613 1.00 0.00 H new ATOM 0 HH21 ARG A 8 3.990 23.573 -31.310 1.00 0.00 H new ATOM 0 HH22 ARG A 8 5.317 23.991 -32.399 1.00 0.00 H new ATOM 127 N ARG A 9 4.478 18.170 -27.050 1.00 0.00 N ATOM 128 CA ARG A 9 4.364 16.729 -27.260 1.00 0.00 C ATOM 129 C ARG A 9 4.007 16.030 -25.954 1.00 0.00 C ATOM 130 O ARG A 9 2.911 16.229 -25.430 1.00 0.00 O ATOM 131 CB ARG A 9 5.649 16.141 -27.862 1.00 0.00 C ATOM 132 CG ARG A 9 5.690 16.187 -29.380 1.00 0.00 C ATOM 133 CD ARG A 9 4.574 15.348 -29.984 1.00 0.00 C ATOM 134 NE ARG A 9 4.634 15.308 -31.441 1.00 0.00 N ATOM 135 CZ ARG A 9 3.596 15.003 -32.222 1.00 0.00 C ATOM 136 NH1 ARG A 9 2.420 14.696 -31.687 1.00 0.00 N ATOM 137 NH2 ARG A 9 3.734 15.001 -33.537 1.00 0.00 N ATOM 0 H ARG A 9 3.897 18.729 -27.675 1.00 0.00 H new ATOM 0 HA ARG A 9 3.562 16.558 -27.978 1.00 0.00 H new ATOM 0 HB2 ARG A 9 6.507 16.686 -27.468 1.00 0.00 H new ATOM 0 HB3 ARG A 9 5.752 15.106 -27.536 1.00 0.00 H new ATOM 0 HG2 ARG A 9 5.597 17.219 -29.718 1.00 0.00 H new ATOM 0 HG3 ARG A 9 6.655 15.822 -29.732 1.00 0.00 H new ATOM 0 HD2 ARG A 9 4.634 14.332 -29.593 1.00 0.00 H new ATOM 0 HD3 ARG A 9 3.611 15.753 -29.674 1.00 0.00 H new ATOM 0 HE ARG A 9 5.523 15.526 -31.890 1.00 0.00 H new ATOM 0 HH11 ARG A 9 2.306 14.692 -30.673 1.00 0.00 H new ATOM 0 HH12 ARG A 9 1.631 14.464 -32.290 1.00 0.00 H new ATOM 0 HH21 ARG A 9 4.635 15.233 -33.956 1.00 0.00 H new ATOM 0 HH22 ARG A 9 2.940 14.768 -34.133 1.00 0.00 H new ATOM 151 N ARG A 10 4.937 15.228 -25.434 1.00 0.00 N ATOM 152 CA ARG A 10 4.752 14.542 -24.158 1.00 0.00 C ATOM 153 C ARG A 10 3.459 13.730 -24.150 1.00 0.00 C ATOM 154 O ARG A 10 2.779 13.643 -23.128 1.00 0.00 O ATOM 155 CB ARG A 10 4.745 15.555 -23.007 1.00 0.00 C ATOM 156 CG ARG A 10 5.879 15.358 -22.015 1.00 0.00 C ATOM 157 CD ARG A 10 7.237 15.505 -22.681 1.00 0.00 C ATOM 158 NE ARG A 10 8.330 15.222 -21.757 1.00 0.00 N ATOM 159 CZ ARG A 10 9.600 15.070 -22.120 1.00 0.00 C ATOM 160 NH1 ARG A 10 9.962 15.222 -23.388 1.00 0.00 N ATOM 161 NH2 ARG A 10 10.512 14.782 -21.202 1.00 0.00 N ATOM 0 H ARG A 10 5.833 15.038 -25.883 1.00 0.00 H new ATOM 0 HA ARG A 10 5.586 13.853 -24.022 1.00 0.00 H new ATOM 0 HB2 ARG A 10 4.806 16.562 -23.420 1.00 0.00 H new ATOM 0 HB3 ARG A 10 3.795 15.484 -22.478 1.00 0.00 H new ATOM 0 HG2 ARG A 10 5.788 16.086 -21.208 1.00 0.00 H new ATOM 0 HG3 ARG A 10 5.800 14.369 -21.563 1.00 0.00 H new ATOM 0 HD2 ARG A 10 7.298 14.829 -23.534 1.00 0.00 H new ATOM 0 HD3 ARG A 10 7.343 16.518 -23.069 1.00 0.00 H new ATOM 0 HE ARG A 10 8.105 15.135 -20.766 1.00 0.00 H new ATOM 0 HH11 ARG A 10 9.264 15.457 -24.093 1.00 0.00 H new ATOM 0 HH12 ARG A 10 10.939 15.103 -23.657 1.00 0.00 H new ATOM 0 HH21 ARG A 10 10.237 14.679 -20.225 1.00 0.00 H new ATOM 0 HH22 ARG A 10 11.488 14.664 -21.473 1.00 0.00 H new ATOM 175 N PHE A 11 3.130 13.121 -25.283 1.00 0.00 N ATOM 176 CA PHE A 11 1.902 12.346 -25.391 1.00 0.00 C ATOM 177 C PHE A 11 2.065 10.979 -24.740 1.00 0.00 C ATOM 178 O PHE A 11 2.232 9.960 -25.414 1.00 0.00 O ATOM 179 CB PHE A 11 1.455 12.205 -26.849 1.00 0.00 C ATOM 180 CG PHE A 11 0.888 13.472 -27.424 1.00 0.00 C ATOM 181 CD1 PHE A 11 1.666 14.311 -28.205 1.00 0.00 C ATOM 182 CD2 PHE A 11 -0.427 13.828 -27.173 1.00 0.00 C ATOM 183 CE1 PHE A 11 1.141 15.480 -28.723 1.00 0.00 C ATOM 184 CE2 PHE A 11 -0.956 14.994 -27.689 1.00 0.00 C ATOM 185 CZ PHE A 11 -0.170 15.821 -28.465 1.00 0.00 C ATOM 0 H PHE A 11 3.692 13.149 -26.134 1.00 0.00 H new ATOM 0 HA PHE A 11 1.122 12.888 -24.857 1.00 0.00 H new ATOM 0 HB2 PHE A 11 2.306 11.889 -27.453 1.00 0.00 H new ATOM 0 HB3 PHE A 11 0.705 11.417 -26.917 1.00 0.00 H new ATOM 0 HD1 PHE A 11 2.693 14.049 -28.411 1.00 0.00 H new ATOM 0 HD2 PHE A 11 -1.047 13.185 -26.566 1.00 0.00 H new ATOM 0 HE1 PHE A 11 1.758 16.126 -29.330 1.00 0.00 H new ATOM 0 HE2 PHE A 11 -1.983 15.258 -27.486 1.00 0.00 H new ATOM 0 HZ PHE A 11 -0.581 16.734 -28.870 1.00 0.00 H new ATOM 195 N HIS A 12 2.059 10.990 -23.418 1.00 0.00 N ATOM 196 CA HIS A 12 2.150 9.783 -22.622 1.00 0.00 C ATOM 197 C HIS A 12 1.724 10.102 -21.198 1.00 0.00 C ATOM 198 O HIS A 12 2.496 10.671 -20.428 1.00 0.00 O ATOM 199 CB HIS A 12 3.583 9.231 -22.635 1.00 0.00 C ATOM 200 CG HIS A 12 3.722 7.878 -22.002 1.00 0.00 C ATOM 201 ND1 HIS A 12 3.575 6.704 -22.705 1.00 0.00 N ATOM 202 CD2 HIS A 12 4.013 7.516 -20.728 1.00 0.00 C ATOM 203 CE1 HIS A 12 3.768 5.679 -21.896 1.00 0.00 C ATOM 204 NE2 HIS A 12 4.035 6.144 -20.691 1.00 0.00 N ATOM 0 H HIS A 12 1.990 11.844 -22.865 1.00 0.00 H new ATOM 0 HA HIS A 12 1.493 9.022 -23.044 1.00 0.00 H new ATOM 0 HB2 HIS A 12 3.931 9.175 -23.667 1.00 0.00 H new ATOM 0 HB3 HIS A 12 4.236 9.932 -22.116 1.00 0.00 H new ATOM 0 HD2 HIS A 12 4.194 8.183 -19.898 1.00 0.00 H new ATOM 0 HE1 HIS A 12 3.716 4.637 -22.174 1.00 0.00 H new ATOM 0 HE2 HIS A 12 4.227 5.576 -19.866 1.00 0.00 H new ATOM 213 N ARG A 13 0.488 9.767 -20.861 1.00 0.00 N ATOM 214 CA ARG A 13 -0.038 10.044 -19.532 1.00 0.00 C ATOM 215 C ARG A 13 0.512 9.057 -18.511 1.00 0.00 C ATOM 216 O ARG A 13 1.517 8.387 -18.759 1.00 0.00 O ATOM 217 CB ARG A 13 -1.565 9.989 -19.535 1.00 0.00 C ATOM 218 CG ARG A 13 -2.217 11.156 -20.255 1.00 0.00 C ATOM 219 CD ARG A 13 -3.730 11.067 -20.174 1.00 0.00 C ATOM 220 NE ARG A 13 -4.390 12.232 -20.762 1.00 0.00 N ATOM 221 CZ ARG A 13 -5.680 12.266 -21.086 1.00 0.00 C ATOM 222 NH1 ARG A 13 -6.455 11.214 -20.860 1.00 0.00 N ATOM 223 NH2 ARG A 13 -6.203 13.363 -21.619 1.00 0.00 N ATOM 0 H ARG A 13 -0.169 9.303 -21.488 1.00 0.00 H new ATOM 0 HA ARG A 13 0.280 11.048 -19.251 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -1.885 9.059 -20.005 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -1.921 9.965 -18.505 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -1.880 12.094 -19.814 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -1.905 11.164 -21.299 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -4.066 10.166 -20.686 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -4.030 10.971 -19.131 1.00 0.00 H new ATOM 0 HE ARG A 13 -3.829 13.066 -20.934 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -6.063 10.373 -20.436 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -7.443 11.245 -21.110 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -5.616 14.181 -21.781 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -7.192 13.388 -21.867 1.00 0.00 H new ATOM 237 N ILE A 14 -0.148 8.979 -17.362 1.00 0.00 N ATOM 238 CA ILE A 14 0.275 8.090 -16.295 1.00 0.00 C ATOM 239 C ILE A 14 0.285 6.647 -16.774 1.00 0.00 C ATOM 240 O ILE A 14 -0.764 6.078 -17.065 1.00 0.00 O ATOM 241 CB ILE A 14 -0.638 8.210 -15.053 1.00 0.00 C ATOM 242 CG1 ILE A 14 -0.633 9.646 -14.517 1.00 0.00 C ATOM 243 CG2 ILE A 14 -0.197 7.233 -13.969 1.00 0.00 C ATOM 244 CD1 ILE A 14 0.739 10.148 -14.113 1.00 0.00 C ATOM 0 H ILE A 14 -0.982 9.525 -17.148 1.00 0.00 H new ATOM 0 HA ILE A 14 1.284 8.389 -16.011 1.00 0.00 H new ATOM 0 HB ILE A 14 -1.656 7.958 -15.350 1.00 0.00 H new ATOM 0 HG12 ILE A 14 -1.041 10.309 -15.280 1.00 0.00 H new ATOM 0 HG13 ILE A 14 -1.298 9.704 -13.655 1.00 0.00 H new ATOM 0 HG21 ILE A 14 -0.851 7.332 -13.102 1.00 0.00 H new ATOM 0 HG22 ILE A 14 -0.254 6.214 -14.352 1.00 0.00 H new ATOM 0 HG23 ILE A 14 0.829 7.454 -13.676 1.00 0.00 H new ATOM 0 HD11 ILE A 14 0.658 11.171 -13.745 1.00 0.00 H new ATOM 0 HD12 ILE A 14 1.143 9.510 -13.327 1.00 0.00 H new ATOM 0 HD13 ILE A 14 1.404 10.125 -14.977 1.00 0.00 H new ATOM 256 N ALA A 15 1.492 6.103 -16.904 1.00 0.00 N ATOM 257 CA ALA A 15 1.712 4.705 -17.258 1.00 0.00 C ATOM 258 C ALA A 15 3.204 4.437 -17.349 1.00 0.00 C ATOM 259 O ALA A 15 3.849 4.762 -18.349 1.00 0.00 O ATOM 260 CB ALA A 15 1.030 4.333 -18.567 1.00 0.00 C ATOM 0 H ALA A 15 2.355 6.628 -16.765 1.00 0.00 H new ATOM 0 HA ALA A 15 1.270 4.086 -16.478 1.00 0.00 H new ATOM 0 HB1 ALA A 15 1.221 3.283 -18.791 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -0.044 4.496 -18.477 1.00 0.00 H new ATOM 0 HB3 ALA A 15 1.424 4.953 -19.372 1.00 0.00 H new ATOM 266 N PHE A 16 3.753 3.878 -16.289 1.00 0.00 N ATOM 267 CA PHE A 16 5.174 3.582 -16.223 1.00 0.00 C ATOM 268 C PHE A 16 5.390 2.080 -16.139 1.00 0.00 C ATOM 269 O PHE A 16 4.496 1.347 -15.714 1.00 0.00 O ATOM 270 CB PHE A 16 5.815 4.296 -15.024 1.00 0.00 C ATOM 271 CG PHE A 16 5.022 4.199 -13.746 1.00 0.00 C ATOM 272 CD1 PHE A 16 5.146 3.100 -12.908 1.00 0.00 C ATOM 273 CD2 PHE A 16 4.155 5.217 -13.381 1.00 0.00 C ATOM 274 CE1 PHE A 16 4.422 3.024 -11.732 1.00 0.00 C ATOM 275 CE2 PHE A 16 3.427 5.144 -12.208 1.00 0.00 C ATOM 276 CZ PHE A 16 3.561 4.045 -11.383 1.00 0.00 C ATOM 0 H PHE A 16 3.232 3.617 -15.452 1.00 0.00 H new ATOM 0 HA PHE A 16 5.654 3.949 -17.130 1.00 0.00 H new ATOM 0 HB2 PHE A 16 6.807 3.877 -14.855 1.00 0.00 H new ATOM 0 HB3 PHE A 16 5.952 5.348 -15.274 1.00 0.00 H new ATOM 0 HD1 PHE A 16 5.815 2.296 -13.177 1.00 0.00 H new ATOM 0 HD2 PHE A 16 4.047 6.079 -14.022 1.00 0.00 H new ATOM 0 HE1 PHE A 16 4.530 2.165 -11.086 1.00 0.00 H new ATOM 0 HE2 PHE A 16 2.755 5.945 -11.938 1.00 0.00 H new ATOM 0 HZ PHE A 16 2.993 3.984 -10.466 1.00 0.00 H new ATOM 286 N ASP A 17 6.564 1.625 -16.552 1.00 0.00 N ATOM 287 CA ASP A 17 6.870 0.201 -16.524 1.00 0.00 C ATOM 288 C ASP A 17 7.093 -0.267 -15.088 1.00 0.00 C ATOM 289 O ASP A 17 8.148 -0.058 -14.492 1.00 0.00 O ATOM 290 CB ASP A 17 8.083 -0.136 -17.414 1.00 0.00 C ATOM 291 CG ASP A 17 9.360 0.564 -16.996 1.00 0.00 C ATOM 292 OD1 ASP A 17 9.414 1.808 -17.079 1.00 0.00 O ATOM 293 OD2 ASP A 17 10.325 -0.126 -16.601 1.00 0.00 O ATOM 0 H ASP A 17 7.316 2.215 -16.908 1.00 0.00 H new ATOM 0 HA ASP A 17 6.013 -0.335 -16.932 1.00 0.00 H new ATOM 0 HB2 ASP A 17 8.247 -1.213 -17.396 1.00 0.00 H new ATOM 0 HB3 ASP A 17 7.852 0.134 -18.445 1.00 0.00 H new ATOM 298 N ALA A 18 6.050 -0.845 -14.526 1.00 0.00 N ATOM 299 CA ALA A 18 6.116 -1.434 -13.204 1.00 0.00 C ATOM 300 C ALA A 18 5.422 -2.785 -13.222 1.00 0.00 C ATOM 301 O ALA A 18 4.508 -3.005 -14.015 1.00 0.00 O ATOM 302 CB ALA A 18 5.470 -0.520 -12.175 1.00 0.00 C ATOM 0 H ALA A 18 5.136 -0.919 -14.972 1.00 0.00 H new ATOM 0 HA ALA A 18 7.161 -1.567 -12.925 1.00 0.00 H new ATOM 0 HB1 ALA A 18 5.531 -0.982 -11.189 1.00 0.00 H new ATOM 0 HB2 ALA A 18 5.991 0.437 -12.160 1.00 0.00 H new ATOM 0 HB3 ALA A 18 4.424 -0.359 -12.437 1.00 0.00 H new ATOM 308 N ASP A 19 5.864 -3.686 -12.365 1.00 0.00 N ATOM 309 CA ASP A 19 5.232 -4.989 -12.268 1.00 0.00 C ATOM 310 C ASP A 19 4.075 -4.903 -11.284 1.00 0.00 C ATOM 311 O ASP A 19 4.235 -4.382 -10.183 1.00 0.00 O ATOM 312 CB ASP A 19 6.246 -6.039 -11.821 1.00 0.00 C ATOM 313 CG ASP A 19 5.779 -7.446 -12.112 1.00 0.00 C ATOM 314 OD1 ASP A 19 5.900 -7.878 -13.278 1.00 0.00 O ATOM 315 OD2 ASP A 19 5.303 -8.124 -11.187 1.00 0.00 O ATOM 0 H ASP A 19 6.650 -3.543 -11.731 1.00 0.00 H new ATOM 0 HA ASP A 19 4.852 -5.287 -13.245 1.00 0.00 H new ATOM 0 HB2 ASP A 19 7.196 -5.862 -12.326 1.00 0.00 H new ATOM 0 HB3 ASP A 19 6.429 -5.933 -10.752 1.00 0.00 H new ATOM 320 N SER A 20 2.909 -5.384 -11.680 1.00 0.00 N ATOM 321 CA SER A 20 1.718 -5.195 -10.870 1.00 0.00 C ATOM 322 C SER A 20 0.940 -6.490 -10.656 1.00 0.00 C ATOM 323 O SER A 20 0.563 -7.177 -11.611 1.00 0.00 O ATOM 324 CB SER A 20 0.825 -4.130 -11.511 1.00 0.00 C ATOM 325 OG SER A 20 0.764 -4.281 -12.920 1.00 0.00 O ATOM 0 H SER A 20 2.762 -5.902 -12.546 1.00 0.00 H new ATOM 0 HA SER A 20 2.041 -4.861 -9.884 1.00 0.00 H new ATOM 0 HB2 SER A 20 -0.180 -4.197 -11.093 1.00 0.00 H new ATOM 0 HB3 SER A 20 1.207 -3.139 -11.267 1.00 0.00 H new ATOM 0 HG SER A 20 0.517 -5.204 -13.140 1.00 0.00 H new ATOM 331 N GLU A 21 0.717 -6.815 -9.389 1.00 0.00 N ATOM 332 CA GLU A 21 -0.140 -7.927 -9.011 1.00 0.00 C ATOM 333 C GLU A 21 -1.429 -7.398 -8.401 1.00 0.00 C ATOM 334 O GLU A 21 -1.393 -6.589 -7.471 1.00 0.00 O ATOM 335 CB GLU A 21 0.535 -8.841 -7.983 1.00 0.00 C ATOM 336 CG GLU A 21 1.786 -9.539 -8.474 1.00 0.00 C ATOM 337 CD GLU A 21 2.301 -10.557 -7.470 1.00 0.00 C ATOM 338 OE1 GLU A 21 3.499 -10.514 -7.117 1.00 0.00 O ATOM 339 OE2 GLU A 21 1.499 -11.390 -7.001 1.00 0.00 O ATOM 0 H GLU A 21 1.124 -6.316 -8.598 1.00 0.00 H new ATOM 0 HA GLU A 21 -0.343 -8.501 -9.915 1.00 0.00 H new ATOM 0 HB2 GLU A 21 0.788 -8.249 -7.103 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -0.183 -9.596 -7.663 1.00 0.00 H new ATOM 0 HG2 GLU A 21 1.575 -10.037 -9.420 1.00 0.00 H new ATOM 0 HG3 GLU A 21 2.561 -8.798 -8.670 1.00 0.00 H new ATOM 346 N ILE A 22 -2.554 -7.833 -8.934 1.00 0.00 N ATOM 347 CA ILE A 22 -3.845 -7.556 -8.323 1.00 0.00 C ATOM 348 C ILE A 22 -4.392 -8.852 -7.742 1.00 0.00 C ATOM 349 O ILE A 22 -4.722 -9.784 -8.474 1.00 0.00 O ATOM 350 CB ILE A 22 -4.858 -6.924 -9.318 1.00 0.00 C ATOM 351 CG1 ILE A 22 -4.574 -5.427 -9.522 1.00 0.00 C ATOM 352 CG2 ILE A 22 -6.288 -7.110 -8.831 1.00 0.00 C ATOM 353 CD1 ILE A 22 -3.269 -5.123 -10.227 1.00 0.00 C ATOM 0 H ILE A 22 -2.603 -8.382 -9.792 1.00 0.00 H new ATOM 0 HA ILE A 22 -3.701 -6.817 -7.534 1.00 0.00 H new ATOM 0 HB ILE A 22 -4.739 -7.437 -10.272 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -5.392 -4.990 -10.095 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -4.569 -4.936 -8.549 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -6.977 -6.659 -9.545 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -6.506 -8.174 -8.739 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -6.407 -6.630 -7.859 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -3.152 -4.044 -10.327 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -2.439 -5.525 -9.646 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -3.275 -5.581 -11.216 1.00 0.00 H new ATOM 365 N LEU A 23 -4.447 -8.927 -6.424 1.00 0.00 N ATOM 366 CA LEU A 23 -4.785 -10.172 -5.747 1.00 0.00 C ATOM 367 C LEU A 23 -5.881 -9.982 -4.714 1.00 0.00 C ATOM 368 O LEU A 23 -5.994 -8.930 -4.095 1.00 0.00 O ATOM 369 CB LEU A 23 -3.547 -10.769 -5.066 1.00 0.00 C ATOM 370 CG LEU A 23 -2.873 -9.892 -4.005 1.00 0.00 C ATOM 371 CD1 LEU A 23 -2.091 -10.759 -3.033 1.00 0.00 C ATOM 372 CD2 LEU A 23 -1.938 -8.878 -4.652 1.00 0.00 C ATOM 0 H LEU A 23 -4.262 -8.142 -5.799 1.00 0.00 H new ATOM 0 HA LEU A 23 -5.153 -10.856 -6.512 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -3.833 -11.712 -4.601 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -2.811 -11.003 -5.836 1.00 0.00 H new ATOM 0 HG LEU A 23 -3.652 -9.352 -3.466 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -1.616 -10.127 -2.283 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -2.769 -11.458 -2.542 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -1.327 -11.315 -3.576 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -1.472 -8.268 -3.879 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -1.166 -9.402 -5.215 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -2.506 -8.237 -5.326 1.00 0.00 H new ATOM 384 N GLN A 24 -6.690 -11.010 -4.543 1.00 0.00 N ATOM 385 CA GLN A 24 -7.672 -11.037 -3.478 1.00 0.00 C ATOM 386 C GLN A 24 -7.359 -12.185 -2.527 1.00 0.00 C ATOM 387 O GLN A 24 -7.641 -13.350 -2.818 1.00 0.00 O ATOM 388 CB GLN A 24 -9.102 -11.143 -4.028 1.00 0.00 C ATOM 389 CG GLN A 24 -9.314 -12.278 -5.017 1.00 0.00 C ATOM 390 CD GLN A 24 -10.760 -12.397 -5.461 1.00 0.00 C ATOM 391 OE1 GLN A 24 -11.686 -12.082 -4.714 1.00 0.00 O ATOM 392 NE2 GLN A 24 -10.965 -12.846 -6.686 1.00 0.00 N ATOM 0 H GLN A 24 -6.685 -11.842 -5.133 1.00 0.00 H new ATOM 0 HA GLN A 24 -7.616 -10.097 -2.930 1.00 0.00 H new ATOM 0 HB2 GLN A 24 -9.790 -11.272 -3.193 1.00 0.00 H new ATOM 0 HB3 GLN A 24 -9.362 -10.202 -4.513 1.00 0.00 H new ATOM 0 HG2 GLN A 24 -8.681 -12.118 -5.890 1.00 0.00 H new ATOM 0 HG3 GLN A 24 -8.998 -13.217 -4.562 1.00 0.00 H new ATOM 0 HE21 GLN A 24 -10.172 -13.097 -7.276 1.00 0.00 H new ATOM 0 HE22 GLN A 24 -11.916 -12.941 -7.042 1.00 0.00 H new ATOM 401 N GLY A 25 -6.734 -11.848 -1.411 1.00 0.00 N ATOM 402 CA GLY A 25 -6.352 -12.847 -0.435 1.00 0.00 C ATOM 403 C GLY A 25 -5.242 -13.760 -0.928 1.00 0.00 C ATOM 404 O GLY A 25 -4.059 -13.431 -0.822 1.00 0.00 O ATOM 0 H GLY A 25 -6.482 -10.892 -1.161 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -6.028 -12.350 0.479 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -7.224 -13.449 -0.178 1.00 0.00 H new ATOM 408 N GLU A 26 -5.631 -14.902 -1.479 1.00 0.00 N ATOM 409 CA GLU A 26 -4.678 -15.924 -1.891 1.00 0.00 C ATOM 410 C GLU A 26 -4.593 -16.045 -3.413 1.00 0.00 C ATOM 411 O GLU A 26 -3.694 -16.702 -3.942 1.00 0.00 O ATOM 412 CB GLU A 26 -5.076 -17.269 -1.283 1.00 0.00 C ATOM 413 CG GLU A 26 -5.041 -17.275 0.235 1.00 0.00 C ATOM 414 CD GLU A 26 -5.774 -18.456 0.832 1.00 0.00 C ATOM 415 OE1 GLU A 26 -5.242 -19.585 0.780 1.00 0.00 O ATOM 416 OE2 GLU A 26 -6.890 -18.257 1.359 1.00 0.00 O ATOM 0 H GLU A 26 -6.606 -15.145 -1.652 1.00 0.00 H new ATOM 0 HA GLU A 26 -3.693 -15.629 -1.530 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -6.080 -17.528 -1.618 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -4.406 -18.042 -1.658 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -4.004 -17.289 0.570 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -5.484 -16.352 0.608 1.00 0.00 H new ATOM 423 N ARG A 27 -5.519 -15.407 -4.117 1.00 0.00 N ATOM 424 CA ARG A 27 -5.549 -15.484 -5.573 1.00 0.00 C ATOM 425 C ARG A 27 -5.002 -14.200 -6.183 1.00 0.00 C ATOM 426 O ARG A 27 -5.585 -13.130 -6.013 1.00 0.00 O ATOM 427 CB ARG A 27 -6.976 -15.737 -6.067 1.00 0.00 C ATOM 428 CG ARG A 27 -7.090 -15.805 -7.580 1.00 0.00 C ATOM 429 CD ARG A 27 -6.323 -16.985 -8.152 1.00 0.00 C ATOM 430 NE ARG A 27 -6.979 -18.255 -7.862 1.00 0.00 N ATOM 431 CZ ARG A 27 -6.379 -19.295 -7.290 1.00 0.00 C ATOM 432 NH1 ARG A 27 -5.113 -19.211 -6.899 1.00 0.00 N ATOM 433 NH2 ARG A 27 -7.047 -20.424 -7.107 1.00 0.00 N ATOM 0 H ARG A 27 -6.256 -14.833 -3.707 1.00 0.00 H new ATOM 0 HA ARG A 27 -4.919 -16.317 -5.887 1.00 0.00 H new ATOM 0 HB2 ARG A 27 -7.339 -16.672 -5.641 1.00 0.00 H new ATOM 0 HB3 ARG A 27 -7.626 -14.944 -5.697 1.00 0.00 H new ATOM 0 HG2 ARG A 27 -8.140 -15.883 -7.862 1.00 0.00 H new ATOM 0 HG3 ARG A 27 -6.711 -14.880 -8.015 1.00 0.00 H new ATOM 0 HD2 ARG A 27 -6.225 -16.865 -9.231 1.00 0.00 H new ATOM 0 HD3 ARG A 27 -5.314 -16.996 -7.740 1.00 0.00 H new ATOM 0 HE ARG A 27 -7.963 -18.352 -8.114 1.00 0.00 H new ATOM 0 HH11 ARG A 27 -4.593 -18.344 -7.036 1.00 0.00 H new ATOM 0 HH12 ARG A 27 -4.660 -20.013 -6.461 1.00 0.00 H new ATOM 0 HH21 ARG A 27 -8.020 -20.495 -7.405 1.00 0.00 H new ATOM 0 HH22 ARG A 27 -6.588 -21.223 -6.668 1.00 0.00 H new ATOM 447 N ARG A 28 -3.895 -14.314 -6.901 1.00 0.00 N ATOM 448 CA ARG A 28 -3.220 -13.143 -7.446 1.00 0.00 C ATOM 449 C ARG A 28 -3.200 -13.164 -8.970 1.00 0.00 C ATOM 450 O ARG A 28 -3.019 -14.213 -9.588 1.00 0.00 O ATOM 451 CB ARG A 28 -1.792 -13.056 -6.897 1.00 0.00 C ATOM 452 CG ARG A 28 -0.916 -14.251 -7.244 1.00 0.00 C ATOM 453 CD ARG A 28 0.394 -14.214 -6.477 1.00 0.00 C ATOM 454 NE ARG A 28 0.179 -14.343 -5.036 1.00 0.00 N ATOM 455 CZ ARG A 28 0.381 -13.368 -4.155 1.00 0.00 C ATOM 456 NH1 ARG A 28 0.797 -12.170 -4.562 1.00 0.00 N ATOM 457 NH2 ARG A 28 0.163 -13.588 -2.864 1.00 0.00 N ATOM 0 H ARG A 28 -3.445 -15.203 -7.120 1.00 0.00 H new ATOM 0 HA ARG A 28 -3.779 -12.260 -7.135 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -1.321 -12.151 -7.282 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -1.837 -12.956 -5.813 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -1.448 -15.174 -7.015 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -0.713 -14.258 -8.315 1.00 0.00 H new ATOM 0 HD2 ARG A 28 1.041 -15.020 -6.822 1.00 0.00 H new ATOM 0 HD3 ARG A 28 0.912 -13.278 -6.686 1.00 0.00 H new ATOM 0 HE ARG A 28 -0.148 -15.242 -4.683 1.00 0.00 H new ATOM 0 HH11 ARG A 28 0.962 -11.997 -5.554 1.00 0.00 H new ATOM 0 HH12 ARG A 28 0.950 -11.425 -3.882 1.00 0.00 H new ATOM 0 HH21 ARG A 28 -0.159 -14.504 -2.550 1.00 0.00 H new ATOM 0 HH22 ARG A 28 0.317 -12.841 -2.186 1.00 0.00 H new ATOM 471 N TRP A 29 -3.413 -12.000 -9.564 1.00 0.00 N ATOM 472 CA TRP A 29 -3.330 -11.841 -11.006 1.00 0.00 C ATOM 473 C TRP A 29 -2.217 -10.870 -11.374 1.00 0.00 C ATOM 474 O TRP A 29 -2.323 -9.664 -11.136 1.00 0.00 O ATOM 475 CB TRP A 29 -4.654 -11.336 -11.584 1.00 0.00 C ATOM 476 CG TRP A 29 -5.752 -12.354 -11.574 1.00 0.00 C ATOM 477 CD1 TRP A 29 -6.007 -13.289 -12.535 1.00 0.00 C ATOM 478 CD2 TRP A 29 -6.749 -12.537 -10.562 1.00 0.00 C ATOM 479 NE1 TRP A 29 -7.102 -14.041 -12.184 1.00 0.00 N ATOM 480 CE2 TRP A 29 -7.577 -13.596 -10.978 1.00 0.00 C ATOM 481 CE3 TRP A 29 -7.024 -11.903 -9.346 1.00 0.00 C ATOM 482 CZ2 TRP A 29 -8.656 -14.040 -10.220 1.00 0.00 C ATOM 483 CZ3 TRP A 29 -8.096 -12.343 -8.595 1.00 0.00 C ATOM 484 CH2 TRP A 29 -8.901 -13.399 -9.035 1.00 0.00 C ATOM 0 H TRP A 29 -3.647 -11.143 -9.062 1.00 0.00 H new ATOM 0 HA TRP A 29 -3.112 -12.821 -11.432 1.00 0.00 H new ATOM 0 HB2 TRP A 29 -4.977 -10.463 -11.016 1.00 0.00 H new ATOM 0 HB3 TRP A 29 -4.488 -11.006 -12.609 1.00 0.00 H new ATOM 0 HD1 TRP A 29 -5.432 -13.419 -13.440 1.00 0.00 H new ATOM 0 HE1 TRP A 29 -7.497 -14.806 -12.732 1.00 0.00 H new ATOM 0 HE3 TRP A 29 -6.409 -11.085 -9.001 1.00 0.00 H new ATOM 0 HZ2 TRP A 29 -9.276 -14.859 -10.553 1.00 0.00 H new ATOM 0 HZ3 TRP A 29 -8.317 -11.864 -7.652 1.00 0.00 H new ATOM 0 HH2 TRP A 29 -9.735 -13.716 -8.426 1.00 0.00 H new ATOM 495 N GLU A 30 -1.140 -11.407 -11.923 1.00 0.00 N ATOM 496 CA GLU A 30 -0.071 -10.590 -12.473 1.00 0.00 C ATOM 497 C GLU A 30 -0.567 -9.942 -13.764 1.00 0.00 C ATOM 498 O GLU A 30 -0.698 -10.609 -14.792 1.00 0.00 O ATOM 499 CB GLU A 30 1.159 -11.460 -12.736 1.00 0.00 C ATOM 500 CG GLU A 30 2.369 -10.695 -13.242 1.00 0.00 C ATOM 501 CD GLU A 30 3.489 -11.625 -13.653 1.00 0.00 C ATOM 502 OE1 GLU A 30 4.447 -11.801 -12.874 1.00 0.00 O ATOM 503 OE2 GLU A 30 3.404 -12.203 -14.755 1.00 0.00 O ATOM 0 H GLU A 30 -0.983 -12.412 -12.000 1.00 0.00 H new ATOM 0 HA GLU A 30 0.212 -9.809 -11.767 1.00 0.00 H new ATOM 0 HB2 GLU A 30 1.429 -11.975 -11.814 1.00 0.00 H new ATOM 0 HB3 GLU A 30 0.898 -12.227 -13.465 1.00 0.00 H new ATOM 0 HG2 GLU A 30 2.079 -10.077 -14.092 1.00 0.00 H new ATOM 0 HG3 GLU A 30 2.724 -10.020 -12.463 1.00 0.00 H new ATOM 510 N VAL A 31 -0.861 -8.653 -13.701 1.00 0.00 N ATOM 511 CA VAL A 31 -1.555 -7.980 -14.790 1.00 0.00 C ATOM 512 C VAL A 31 -0.847 -6.671 -15.173 1.00 0.00 C ATOM 513 O VAL A 31 0.193 -6.336 -14.607 1.00 0.00 O ATOM 514 CB VAL A 31 -3.030 -7.716 -14.395 1.00 0.00 C ATOM 515 CG1 VAL A 31 -3.139 -6.556 -13.417 1.00 0.00 C ATOM 516 CG2 VAL A 31 -3.903 -7.491 -15.621 1.00 0.00 C ATOM 0 H VAL A 31 -0.631 -8.052 -12.910 1.00 0.00 H new ATOM 0 HA VAL A 31 -1.538 -8.630 -15.665 1.00 0.00 H new ATOM 0 HB VAL A 31 -3.400 -8.609 -13.891 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -4.186 -6.395 -13.159 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -2.574 -6.787 -12.514 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.736 -5.654 -13.877 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -4.931 -7.309 -15.307 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -3.535 -6.628 -16.176 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.869 -8.374 -16.259 1.00 0.00 H new ATOM 526 N LEU A 32 -1.419 -5.942 -16.131 1.00 0.00 N ATOM 527 CA LEU A 32 -0.795 -4.745 -16.680 1.00 0.00 C ATOM 528 C LEU A 32 -1.317 -3.470 -16.022 1.00 0.00 C ATOM 529 O LEU A 32 -2.514 -3.164 -16.087 1.00 0.00 O ATOM 530 CB LEU A 32 -1.050 -4.672 -18.187 1.00 0.00 C ATOM 531 CG LEU A 32 -0.405 -5.787 -19.008 1.00 0.00 C ATOM 532 CD1 LEU A 32 -0.877 -5.730 -20.452 1.00 0.00 C ATOM 533 CD2 LEU A 32 1.106 -5.673 -18.941 1.00 0.00 C ATOM 0 H LEU A 32 -2.324 -6.166 -16.545 1.00 0.00 H new ATOM 0 HA LEU A 32 0.274 -4.815 -16.478 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -2.126 -4.691 -18.359 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -0.685 -3.713 -18.555 1.00 0.00 H new ATOM 0 HG LEU A 32 -0.705 -6.747 -18.588 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -0.406 -6.532 -21.021 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -1.960 -5.848 -20.486 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -0.603 -4.769 -20.887 1.00 0.00 H new ATOM 0 HD21 LEU A 32 1.558 -6.472 -19.529 1.00 0.00 H new ATOM 0 HD22 LEU A 32 1.416 -4.708 -19.341 1.00 0.00 H new ATOM 0 HD23 LEU A 32 1.432 -5.757 -17.904 1.00 0.00 H new ATOM 545 N LEU A 33 -0.410 -2.732 -15.396 1.00 0.00 N ATOM 546 CA LEU A 33 -0.715 -1.405 -14.868 1.00 0.00 C ATOM 547 C LEU A 33 -0.874 -0.407 -16.014 1.00 0.00 C ATOM 548 O LEU A 33 -0.216 -0.529 -17.046 1.00 0.00 O ATOM 549 CB LEU A 33 0.406 -0.946 -13.923 1.00 0.00 C ATOM 550 CG LEU A 33 0.382 0.537 -13.530 1.00 0.00 C ATOM 551 CD1 LEU A 33 -0.871 0.876 -12.740 1.00 0.00 C ATOM 552 CD2 LEU A 33 1.628 0.892 -12.735 1.00 0.00 C ATOM 0 H LEU A 33 0.552 -3.032 -15.240 1.00 0.00 H new ATOM 0 HA LEU A 33 -1.651 -1.454 -14.311 1.00 0.00 H new ATOM 0 HB2 LEU A 33 0.356 -1.544 -13.013 1.00 0.00 H new ATOM 0 HB3 LEU A 33 1.365 -1.162 -14.395 1.00 0.00 H new ATOM 0 HG LEU A 33 0.369 1.130 -14.445 1.00 0.00 H new ATOM 0 HD11 LEU A 33 -0.860 1.933 -12.476 1.00 0.00 H new ATOM 0 HD12 LEU A 33 -1.752 0.663 -13.346 1.00 0.00 H new ATOM 0 HD13 LEU A 33 -0.902 0.275 -11.831 1.00 0.00 H new ATOM 0 HD21 LEU A 33 1.598 1.947 -12.463 1.00 0.00 H new ATOM 0 HD22 LEU A 33 1.668 0.285 -11.831 1.00 0.00 H new ATOM 0 HD23 LEU A 33 2.513 0.699 -13.341 1.00 0.00 H new ATOM 564 N HIS A 34 -1.762 0.567 -15.845 1.00 0.00 N ATOM 565 CA HIS A 34 -1.948 1.602 -16.850 1.00 0.00 C ATOM 566 C HIS A 34 -1.992 2.987 -16.202 1.00 0.00 C ATOM 567 O HIS A 34 -0.954 3.613 -16.041 1.00 0.00 O ATOM 568 CB HIS A 34 -3.201 1.338 -17.699 1.00 0.00 C ATOM 569 CG HIS A 34 -3.021 0.251 -18.724 1.00 0.00 C ATOM 570 ND1 HIS A 34 -2.911 0.500 -20.073 1.00 0.00 N ATOM 571 CD2 HIS A 34 -2.939 -1.097 -18.591 1.00 0.00 C ATOM 572 CE1 HIS A 34 -2.773 -0.642 -20.721 1.00 0.00 C ATOM 573 NE2 HIS A 34 -2.789 -1.629 -19.845 1.00 0.00 N ATOM 0 H HIS A 34 -2.361 0.660 -15.025 1.00 0.00 H new ATOM 0 HA HIS A 34 -1.091 1.576 -17.522 1.00 0.00 H new ATOM 0 HB2 HIS A 34 -4.026 1.069 -17.039 1.00 0.00 H new ATOM 0 HB3 HIS A 34 -3.486 2.260 -18.206 1.00 0.00 H new ATOM 0 HD2 HIS A 34 -2.984 -1.650 -17.665 1.00 0.00 H new ATOM 0 HE1 HIS A 34 -2.665 -0.750 -21.790 1.00 0.00 H new ATOM 0 HE2 HIS A 34 -2.704 -2.621 -20.065 1.00 0.00 H new ATOM 582 N ASP A 35 -3.173 3.426 -15.772 1.00 0.00 N ATOM 583 CA ASP A 35 -3.350 4.798 -15.273 1.00 0.00 C ATOM 584 C ASP A 35 -3.795 4.759 -13.812 1.00 0.00 C ATOM 585 O ASP A 35 -4.254 3.721 -13.332 1.00 0.00 O ATOM 586 CB ASP A 35 -4.395 5.530 -16.130 1.00 0.00 C ATOM 587 CG ASP A 35 -4.249 7.049 -16.133 1.00 0.00 C ATOM 588 OD1 ASP A 35 -4.497 7.670 -17.193 1.00 0.00 O ATOM 589 OD2 ASP A 35 -3.907 7.639 -15.085 1.00 0.00 O ATOM 0 H ASP A 35 -4.021 2.859 -15.757 1.00 0.00 H new ATOM 0 HA ASP A 35 -2.403 5.334 -15.339 1.00 0.00 H new ATOM 0 HB2 ASP A 35 -4.326 5.168 -17.156 1.00 0.00 H new ATOM 0 HB3 ASP A 35 -5.390 5.273 -15.768 1.00 0.00 H new ATOM 594 N VAL A 36 -3.669 5.875 -13.103 1.00 0.00 N ATOM 595 CA VAL A 36 -3.976 5.904 -11.676 1.00 0.00 C ATOM 596 C VAL A 36 -4.150 7.338 -11.158 1.00 0.00 C ATOM 597 O VAL A 36 -3.485 8.270 -11.612 1.00 0.00 O ATOM 598 CB VAL A 36 -2.878 5.177 -10.854 1.00 0.00 C ATOM 599 CG1 VAL A 36 -1.540 5.892 -10.960 1.00 0.00 C ATOM 600 CG2 VAL A 36 -3.291 5.026 -9.395 1.00 0.00 C ATOM 0 H VAL A 36 -3.359 6.767 -13.489 1.00 0.00 H new ATOM 0 HA VAL A 36 -4.922 5.379 -11.546 1.00 0.00 H new ATOM 0 HB VAL A 36 -2.761 4.180 -11.279 1.00 0.00 H new ATOM 0 HG11 VAL A 36 -0.794 5.357 -10.373 1.00 0.00 H new ATOM 0 HG12 VAL A 36 -1.226 5.924 -12.003 1.00 0.00 H new ATOM 0 HG13 VAL A 36 -1.640 6.909 -10.580 1.00 0.00 H new ATOM 0 HG21 VAL A 36 -2.502 4.513 -8.845 1.00 0.00 H new ATOM 0 HG22 VAL A 36 -3.456 6.012 -8.960 1.00 0.00 H new ATOM 0 HG23 VAL A 36 -4.211 4.445 -9.336 1.00 0.00 H new ATOM 610 N SER A 37 -5.074 7.500 -10.218 1.00 0.00 N ATOM 611 CA SER A 37 -5.263 8.759 -9.519 1.00 0.00 C ATOM 612 C SER A 37 -5.178 8.506 -8.020 1.00 0.00 C ATOM 613 O SER A 37 -4.933 7.382 -7.589 1.00 0.00 O ATOM 614 CB SER A 37 -6.624 9.389 -9.858 1.00 0.00 C ATOM 615 OG SER A 37 -7.687 8.491 -9.580 1.00 0.00 O ATOM 0 H SER A 37 -5.711 6.761 -9.921 1.00 0.00 H new ATOM 0 HA SER A 37 -4.484 9.453 -9.834 1.00 0.00 H new ATOM 0 HB2 SER A 37 -6.758 10.305 -9.282 1.00 0.00 H new ATOM 0 HB3 SER A 37 -6.646 9.669 -10.911 1.00 0.00 H new ATOM 0 HG SER A 37 -7.347 7.572 -9.580 1.00 0.00 H new ATOM 621 N LEU A 38 -5.410 9.537 -7.230 1.00 0.00 N ATOM 622 CA LEU A 38 -5.403 9.398 -5.781 1.00 0.00 C ATOM 623 C LEU A 38 -6.764 8.925 -5.279 1.00 0.00 C ATOM 624 O LEU A 38 -6.974 8.761 -4.081 1.00 0.00 O ATOM 625 CB LEU A 38 -5.030 10.728 -5.125 1.00 0.00 C ATOM 626 CG LEU A 38 -3.657 11.282 -5.521 1.00 0.00 C ATOM 627 CD1 LEU A 38 -3.425 12.642 -4.882 1.00 0.00 C ATOM 628 CD2 LEU A 38 -2.555 10.309 -5.123 1.00 0.00 C ATOM 0 H LEU A 38 -5.606 10.481 -7.564 1.00 0.00 H new ATOM 0 HA LEU A 38 -4.658 8.650 -5.510 1.00 0.00 H new ATOM 0 HB2 LEU A 38 -5.790 11.467 -5.378 1.00 0.00 H new ATOM 0 HB3 LEU A 38 -5.056 10.602 -4.043 1.00 0.00 H new ATOM 0 HG LEU A 38 -3.634 11.404 -6.604 1.00 0.00 H new ATOM 0 HD11 LEU A 38 -2.445 13.019 -5.175 1.00 0.00 H new ATOM 0 HD12 LEU A 38 -4.196 13.337 -5.215 1.00 0.00 H new ATOM 0 HD13 LEU A 38 -3.468 12.546 -3.797 1.00 0.00 H new ATOM 0 HD21 LEU A 38 -1.587 10.718 -5.412 1.00 0.00 H new ATOM 0 HD22 LEU A 38 -2.577 10.156 -4.044 1.00 0.00 H new ATOM 0 HD23 LEU A 38 -2.711 9.356 -5.628 1.00 0.00 H new ATOM 640 N HIS A 39 -7.691 8.709 -6.208 1.00 0.00 N ATOM 641 CA HIS A 39 -9.044 8.279 -5.847 1.00 0.00 C ATOM 642 C HIS A 39 -9.305 6.873 -6.358 1.00 0.00 C ATOM 643 O HIS A 39 -10.210 6.183 -5.888 1.00 0.00 O ATOM 644 CB HIS A 39 -10.147 9.197 -6.417 1.00 0.00 C ATOM 645 CG HIS A 39 -9.709 10.520 -6.983 1.00 0.00 C ATOM 646 ND1 HIS A 39 -10.366 11.128 -8.019 1.00 0.00 N ATOM 647 CD2 HIS A 39 -8.691 11.348 -6.663 1.00 0.00 C ATOM 648 CE1 HIS A 39 -9.764 12.262 -8.315 1.00 0.00 C ATOM 649 NE2 HIS A 39 -8.745 12.424 -7.503 1.00 0.00 N ATOM 0 H HIS A 39 -7.535 8.823 -7.210 1.00 0.00 H new ATOM 0 HA HIS A 39 -9.087 8.322 -4.759 1.00 0.00 H new ATOM 0 HB2 HIS A 39 -10.671 8.650 -7.201 1.00 0.00 H new ATOM 0 HB3 HIS A 39 -10.870 9.390 -5.625 1.00 0.00 H new ATOM 0 HD1 HIS A 39 -11.193 10.760 -8.489 1.00 0.00 H new ATOM 0 HD2 HIS A 39 -7.963 11.188 -5.881 1.00 0.00 H new ATOM 0 HE1 HIS A 39 -10.060 12.946 -9.097 1.00 0.00 H new ATOM 0 HE2 HIS A 39 -8.104 13.217 -7.500 1.00 0.00 H new ATOM 658 N GLY A 40 -8.500 6.445 -7.315 1.00 0.00 N ATOM 659 CA GLY A 40 -8.761 5.194 -7.984 1.00 0.00 C ATOM 660 C GLY A 40 -7.713 4.868 -9.022 1.00 0.00 C ATOM 661 O GLY A 40 -7.018 5.759 -9.509 1.00 0.00 O ATOM 0 H GLY A 40 -7.671 6.942 -7.640 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -8.801 4.392 -7.247 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -9.740 5.237 -8.461 1.00 0.00 H new ATOM 665 N ILE A 41 -7.617 3.599 -9.371 1.00 0.00 N ATOM 666 CA ILE A 41 -6.621 3.132 -10.320 1.00 0.00 C ATOM 667 C ILE A 41 -7.298 2.436 -11.499 1.00 0.00 C ATOM 668 O ILE A 41 -8.334 1.791 -11.330 1.00 0.00 O ATOM 669 CB ILE A 41 -5.613 2.171 -9.637 1.00 0.00 C ATOM 670 CG1 ILE A 41 -4.548 1.695 -10.630 1.00 0.00 C ATOM 671 CG2 ILE A 41 -6.336 0.983 -9.019 1.00 0.00 C ATOM 672 CD1 ILE A 41 -3.484 0.816 -10.008 1.00 0.00 C ATOM 0 H ILE A 41 -8.224 2.865 -9.007 1.00 0.00 H new ATOM 0 HA ILE A 41 -6.071 3.998 -10.689 1.00 0.00 H new ATOM 0 HB ILE A 41 -5.112 2.721 -8.841 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -5.035 1.146 -11.436 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -4.070 2.565 -11.081 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -5.610 0.322 -8.545 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -7.046 1.338 -8.272 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -6.870 0.438 -9.797 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -2.766 0.518 -10.772 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -2.970 1.368 -9.222 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -3.950 -0.073 -9.582 1.00 0.00 H new ATOM 684 N LEU A 42 -6.728 2.593 -12.686 1.00 0.00 N ATOM 685 CA LEU A 42 -7.267 1.973 -13.886 1.00 0.00 C ATOM 686 C LEU A 42 -6.252 1.012 -14.491 1.00 0.00 C ATOM 687 O LEU A 42 -5.207 1.429 -14.999 1.00 0.00 O ATOM 688 CB LEU A 42 -7.649 3.033 -14.921 1.00 0.00 C ATOM 689 CG LEU A 42 -8.194 2.476 -16.239 1.00 0.00 C ATOM 690 CD1 LEU A 42 -9.556 1.832 -16.032 1.00 0.00 C ATOM 691 CD2 LEU A 42 -8.276 3.570 -17.286 1.00 0.00 C ATOM 0 H LEU A 42 -5.887 3.148 -12.843 1.00 0.00 H new ATOM 0 HA LEU A 42 -8.162 1.418 -13.604 1.00 0.00 H new ATOM 0 HB2 LEU A 42 -8.398 3.694 -14.484 1.00 0.00 H new ATOM 0 HB3 LEU A 42 -6.772 3.644 -15.136 1.00 0.00 H new ATOM 0 HG LEU A 42 -7.506 1.709 -16.594 1.00 0.00 H new ATOM 0 HD11 LEU A 42 -9.923 1.444 -16.982 1.00 0.00 H new ATOM 0 HD12 LEU A 42 -9.467 1.015 -15.316 1.00 0.00 H new ATOM 0 HD13 LEU A 42 -10.256 2.575 -15.649 1.00 0.00 H new ATOM 0 HD21 LEU A 42 -8.665 3.155 -18.216 1.00 0.00 H new ATOM 0 HD22 LEU A 42 -8.940 4.360 -16.935 1.00 0.00 H new ATOM 0 HD23 LEU A 42 -7.282 3.982 -17.461 1.00 0.00 H new ATOM 703 N VAL A 43 -6.557 -0.270 -14.433 1.00 0.00 N ATOM 704 CA VAL A 43 -5.688 -1.279 -15.013 1.00 0.00 C ATOM 705 C VAL A 43 -6.361 -1.930 -16.208 1.00 0.00 C ATOM 706 O VAL A 43 -7.575 -1.817 -16.388 1.00 0.00 O ATOM 707 CB VAL A 43 -5.299 -2.372 -13.996 1.00 0.00 C ATOM 708 CG1 VAL A 43 -4.504 -1.775 -12.846 1.00 0.00 C ATOM 709 CG2 VAL A 43 -6.532 -3.099 -13.482 1.00 0.00 C ATOM 0 H VAL A 43 -7.399 -0.639 -13.991 1.00 0.00 H new ATOM 0 HA VAL A 43 -4.777 -0.768 -15.326 1.00 0.00 H new ATOM 0 HB VAL A 43 -4.668 -3.101 -14.505 1.00 0.00 H new ATOM 0 HG11 VAL A 43 -4.239 -2.562 -12.140 1.00 0.00 H new ATOM 0 HG12 VAL A 43 -3.595 -1.314 -13.233 1.00 0.00 H new ATOM 0 HG13 VAL A 43 -5.107 -1.021 -12.340 1.00 0.00 H new ATOM 0 HG21 VAL A 43 -6.231 -3.864 -12.767 1.00 0.00 H new ATOM 0 HG22 VAL A 43 -7.197 -2.387 -12.993 1.00 0.00 H new ATOM 0 HG23 VAL A 43 -7.053 -3.567 -14.317 1.00 0.00 H new ATOM 719 N GLY A 44 -5.571 -2.604 -17.023 1.00 0.00 N ATOM 720 CA GLY A 44 -6.118 -3.277 -18.174 1.00 0.00 C ATOM 721 C GLY A 44 -6.098 -4.775 -17.991 1.00 0.00 C ATOM 722 O GLY A 44 -5.122 -5.440 -18.345 1.00 0.00 O ATOM 0 H GLY A 44 -4.562 -2.697 -16.908 1.00 0.00 H new ATOM 0 HA2 GLY A 44 -7.142 -2.942 -18.342 1.00 0.00 H new ATOM 0 HA3 GLY A 44 -5.545 -3.009 -19.062 1.00 0.00 H new ATOM 726 N GLN A 45 -7.172 -5.301 -17.433 1.00 0.00 N ATOM 727 CA GLN A 45 -7.246 -6.709 -17.100 1.00 0.00 C ATOM 728 C GLN A 45 -8.341 -7.399 -17.903 1.00 0.00 C ATOM 729 O GLN A 45 -9.522 -7.272 -17.596 1.00 0.00 O ATOM 730 CB GLN A 45 -7.498 -6.884 -15.598 1.00 0.00 C ATOM 731 CG GLN A 45 -7.652 -8.333 -15.164 1.00 0.00 C ATOM 732 CD GLN A 45 -7.812 -8.479 -13.664 1.00 0.00 C ATOM 733 OE1 GLN A 45 -7.275 -7.687 -12.891 1.00 0.00 O ATOM 734 NE2 GLN A 45 -8.566 -9.481 -13.243 1.00 0.00 N ATOM 0 H GLN A 45 -8.010 -4.769 -17.200 1.00 0.00 H new ATOM 0 HA GLN A 45 -6.293 -7.172 -17.355 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -6.672 -6.436 -15.046 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -8.399 -6.335 -15.324 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -8.519 -8.767 -15.662 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -6.780 -8.900 -15.489 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -8.994 -10.116 -13.917 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -8.720 -9.619 -12.244 1.00 0.00 H new ATOM 743 N PRO A 46 -7.960 -8.127 -18.960 1.00 0.00 N ATOM 744 CA PRO A 46 -8.886 -8.934 -19.745 1.00 0.00 C ATOM 745 C PRO A 46 -9.056 -10.321 -19.130 1.00 0.00 C ATOM 746 O PRO A 46 -9.507 -11.263 -19.786 1.00 0.00 O ATOM 747 CB PRO A 46 -8.206 -9.031 -21.120 1.00 0.00 C ATOM 748 CG PRO A 46 -6.848 -8.408 -20.971 1.00 0.00 C ATOM 749 CD PRO A 46 -6.605 -8.216 -19.499 1.00 0.00 C ATOM 0 HA PRO A 46 -9.885 -8.502 -19.793 1.00 0.00 H new ATOM 0 HB2 PRO A 46 -8.123 -10.070 -21.439 1.00 0.00 H new ATOM 0 HB3 PRO A 46 -8.790 -8.510 -21.879 1.00 0.00 H new ATOM 0 HG2 PRO A 46 -6.081 -9.048 -21.407 1.00 0.00 H new ATOM 0 HG3 PRO A 46 -6.803 -7.454 -21.496 1.00 0.00 H new ATOM 0 HD2 PRO A 46 -6.051 -9.050 -19.068 1.00 0.00 H new ATOM 0 HD3 PRO A 46 -6.029 -7.313 -19.298 1.00 0.00 H new ATOM 757 N GLN A 47 -8.688 -10.422 -17.860 1.00 0.00 N ATOM 758 CA GLN A 47 -8.725 -11.679 -17.129 1.00 0.00 C ATOM 759 C GLN A 47 -9.920 -11.692 -16.186 1.00 0.00 C ATOM 760 O GLN A 47 -9.984 -10.900 -15.246 1.00 0.00 O ATOM 761 CB GLN A 47 -7.427 -11.852 -16.332 1.00 0.00 C ATOM 762 CG GLN A 47 -6.170 -11.720 -17.180 1.00 0.00 C ATOM 763 CD GLN A 47 -6.004 -12.864 -18.157 1.00 0.00 C ATOM 764 OE1 GLN A 47 -6.514 -12.826 -19.279 1.00 0.00 O ATOM 765 NE2 GLN A 47 -5.272 -13.883 -17.740 1.00 0.00 N ATOM 0 H GLN A 47 -8.355 -9.632 -17.307 1.00 0.00 H new ATOM 0 HA GLN A 47 -8.822 -12.503 -17.836 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -7.398 -11.109 -15.535 1.00 0.00 H new ATOM 0 HB3 GLN A 47 -7.432 -12.832 -15.854 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -6.204 -10.780 -17.730 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -5.299 -11.676 -16.527 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -4.869 -13.872 -16.803 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -5.110 -14.680 -18.355 1.00 0.00 H new ATOM 774 N ASP A 48 -10.864 -12.585 -16.448 1.00 0.00 N ATOM 775 CA ASP A 48 -12.083 -12.662 -15.651 1.00 0.00 C ATOM 776 C ASP A 48 -11.797 -13.217 -14.266 1.00 0.00 C ATOM 777 O ASP A 48 -10.815 -13.933 -14.055 1.00 0.00 O ATOM 778 CB ASP A 48 -13.136 -13.542 -16.333 1.00 0.00 C ATOM 779 CG ASP A 48 -13.608 -12.993 -17.664 1.00 0.00 C ATOM 780 OD1 ASP A 48 -12.947 -13.268 -18.686 1.00 0.00 O ATOM 781 OD2 ASP A 48 -14.656 -12.313 -17.703 1.00 0.00 O ATOM 0 H ASP A 48 -10.811 -13.266 -17.205 1.00 0.00 H new ATOM 0 HA ASP A 48 -12.469 -11.647 -15.560 1.00 0.00 H new ATOM 0 HB2 ASP A 48 -12.722 -14.539 -16.486 1.00 0.00 H new ATOM 0 HB3 ASP A 48 -13.993 -13.651 -15.669 1.00 0.00 H new ATOM 786 N TRP A 49 -12.668 -12.885 -13.332 1.00 0.00 N ATOM 787 CA TRP A 49 -12.572 -13.371 -11.967 1.00 0.00 C ATOM 788 C TRP A 49 -13.966 -13.509 -11.370 1.00 0.00 C ATOM 789 O TRP A 49 -14.957 -13.443 -12.097 1.00 0.00 O ATOM 790 CB TRP A 49 -11.692 -12.450 -11.105 1.00 0.00 C ATOM 791 CG TRP A 49 -11.997 -10.975 -11.195 1.00 0.00 C ATOM 792 CD1 TRP A 49 -13.114 -10.368 -11.700 1.00 0.00 C ATOM 793 CD2 TRP A 49 -11.144 -9.920 -10.742 1.00 0.00 C ATOM 794 NE1 TRP A 49 -13.000 -9.003 -11.589 1.00 0.00 N ATOM 795 CE2 TRP A 49 -11.798 -8.705 -11.005 1.00 0.00 C ATOM 796 CE3 TRP A 49 -9.885 -9.888 -10.139 1.00 0.00 C ATOM 797 CZ2 TRP A 49 -11.238 -7.473 -10.686 1.00 0.00 C ATOM 798 CZ3 TRP A 49 -9.329 -8.665 -9.824 1.00 0.00 C ATOM 799 CH2 TRP A 49 -10.005 -7.473 -10.097 1.00 0.00 C ATOM 0 H TRP A 49 -13.464 -12.269 -13.498 1.00 0.00 H new ATOM 0 HA TRP A 49 -12.096 -14.351 -11.982 1.00 0.00 H new ATOM 0 HB2 TRP A 49 -11.788 -12.758 -10.064 1.00 0.00 H new ATOM 0 HB3 TRP A 49 -10.651 -12.604 -11.389 1.00 0.00 H new ATOM 0 HD1 TRP A 49 -13.962 -10.886 -12.124 1.00 0.00 H new ATOM 0 HE1 TRP A 49 -13.697 -8.323 -11.892 1.00 0.00 H new ATOM 0 HE3 TRP A 49 -9.356 -10.804 -9.923 1.00 0.00 H new ATOM 0 HZ2 TRP A 49 -11.758 -6.550 -10.896 1.00 0.00 H new ATOM 0 HZ3 TRP A 49 -8.355 -8.629 -9.359 1.00 0.00 H new ATOM 0 HH2 TRP A 49 -9.543 -6.532 -9.837 1.00 0.00 H new ATOM 810 N ASN A 50 -14.042 -13.700 -10.055 1.00 0.00 N ATOM 811 CA ASN A 50 -15.323 -13.830 -9.366 1.00 0.00 C ATOM 812 C ASN A 50 -16.166 -12.571 -9.561 1.00 0.00 C ATOM 813 O ASN A 50 -17.386 -12.646 -9.706 1.00 0.00 O ATOM 814 CB ASN A 50 -15.114 -14.125 -7.872 1.00 0.00 C ATOM 815 CG ASN A 50 -14.362 -13.032 -7.128 1.00 0.00 C ATOM 816 OD1 ASN A 50 -13.558 -12.299 -7.707 1.00 0.00 O ATOM 817 ND2 ASN A 50 -14.598 -12.931 -5.829 1.00 0.00 N ATOM 0 H ASN A 50 -13.228 -13.768 -9.444 1.00 0.00 H new ATOM 0 HA ASN A 50 -15.862 -14.672 -9.801 1.00 0.00 H new ATOM 0 HB2 ASN A 50 -16.086 -14.269 -7.401 1.00 0.00 H new ATOM 0 HB3 ASN A 50 -14.568 -15.063 -7.770 1.00 0.00 H new ATOM 0 HD21 ASN A 50 -14.107 -12.229 -5.275 1.00 0.00 H new ATOM 0 HD22 ASN A 50 -15.271 -13.555 -5.383 1.00 0.00 H new ATOM 824 N GLY A 51 -15.504 -11.419 -9.553 1.00 0.00 N ATOM 825 CA GLY A 51 -16.151 -10.185 -9.951 1.00 0.00 C ATOM 826 C GLY A 51 -17.157 -9.687 -8.939 1.00 0.00 C ATOM 827 O GLY A 51 -18.256 -9.279 -9.302 1.00 0.00 O ATOM 0 H GLY A 51 -14.527 -11.319 -9.277 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -15.392 -9.418 -10.107 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -16.652 -10.337 -10.907 1.00 0.00 H new ATOM 831 N ASP A 52 -16.781 -9.720 -7.672 1.00 0.00 N ATOM 832 CA ASP A 52 -17.634 -9.204 -6.615 1.00 0.00 C ATOM 833 C ASP A 52 -16.993 -7.969 -5.998 1.00 0.00 C ATOM 834 O ASP A 52 -15.868 -8.028 -5.501 1.00 0.00 O ATOM 835 CB ASP A 52 -17.884 -10.274 -5.550 1.00 0.00 C ATOM 836 CG ASP A 52 -18.733 -9.765 -4.402 1.00 0.00 C ATOM 837 OD1 ASP A 52 -18.237 -9.737 -3.259 1.00 0.00 O ATOM 838 OD2 ASP A 52 -19.899 -9.388 -4.638 1.00 0.00 O ATOM 0 H ASP A 52 -15.890 -10.099 -7.350 1.00 0.00 H new ATOM 0 HA ASP A 52 -18.598 -8.927 -7.042 1.00 0.00 H new ATOM 0 HB2 ASP A 52 -18.377 -11.131 -6.010 1.00 0.00 H new ATOM 0 HB3 ASP A 52 -16.928 -10.626 -5.162 1.00 0.00 H new ATOM 843 N PRO A 53 -17.697 -6.826 -6.043 1.00 0.00 N ATOM 844 CA PRO A 53 -17.174 -5.546 -5.548 1.00 0.00 C ATOM 845 C PRO A 53 -16.874 -5.564 -4.051 1.00 0.00 C ATOM 846 O PRO A 53 -16.166 -4.700 -3.542 1.00 0.00 O ATOM 847 CB PRO A 53 -18.298 -4.549 -5.850 1.00 0.00 C ATOM 848 CG PRO A 53 -19.522 -5.380 -6.015 1.00 0.00 C ATOM 849 CD PRO A 53 -19.056 -6.687 -6.590 1.00 0.00 C ATOM 0 HA PRO A 53 -16.224 -5.299 -6.023 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -18.416 -3.831 -5.039 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -18.085 -3.977 -6.753 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -20.024 -5.530 -5.059 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -20.238 -4.894 -6.678 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -19.699 -7.513 -6.287 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -19.052 -6.670 -7.680 1.00 0.00 H new ATOM 857 N GLN A 54 -17.393 -6.564 -3.351 1.00 0.00 N ATOM 858 CA GLN A 54 -17.202 -6.660 -1.909 1.00 0.00 C ATOM 859 C GLN A 54 -15.960 -7.486 -1.588 1.00 0.00 C ATOM 860 O GLN A 54 -15.689 -7.802 -0.429 1.00 0.00 O ATOM 861 CB GLN A 54 -18.438 -7.266 -1.242 1.00 0.00 C ATOM 862 CG GLN A 54 -19.709 -6.475 -1.506 1.00 0.00 C ATOM 863 CD GLN A 54 -20.904 -7.022 -0.750 1.00 0.00 C ATOM 864 OE1 GLN A 54 -20.981 -8.217 -0.459 1.00 0.00 O ATOM 865 NE2 GLN A 54 -21.848 -6.154 -0.422 1.00 0.00 N ATOM 0 H GLN A 54 -17.948 -7.318 -3.756 1.00 0.00 H new ATOM 0 HA GLN A 54 -17.058 -5.655 -1.514 1.00 0.00 H new ATOM 0 HB2 GLN A 54 -18.572 -8.287 -1.600 1.00 0.00 H new ATOM 0 HB3 GLN A 54 -18.271 -7.324 -0.166 1.00 0.00 H new ATOM 0 HG2 GLN A 54 -19.550 -5.434 -1.223 1.00 0.00 H new ATOM 0 HG3 GLN A 54 -19.924 -6.486 -2.575 1.00 0.00 H new ATOM 0 HE21 GLN A 54 -21.750 -5.172 -0.680 1.00 0.00 H new ATOM 0 HE22 GLN A 54 -22.674 -6.467 0.089 1.00 0.00 H new ATOM 874 N ARG A 55 -15.203 -7.821 -2.625 1.00 0.00 N ATOM 875 CA ARG A 55 -13.968 -8.563 -2.467 1.00 0.00 C ATOM 876 C ARG A 55 -12.786 -7.615 -2.597 1.00 0.00 C ATOM 877 O ARG A 55 -12.522 -7.081 -3.671 1.00 0.00 O ATOM 878 CB ARG A 55 -13.880 -9.689 -3.503 1.00 0.00 C ATOM 879 CG ARG A 55 -15.083 -10.614 -3.474 1.00 0.00 C ATOM 880 CD ARG A 55 -15.294 -11.211 -2.092 1.00 0.00 C ATOM 881 NE ARG A 55 -16.700 -11.521 -1.839 1.00 0.00 N ATOM 882 CZ ARG A 55 -17.121 -12.393 -0.922 1.00 0.00 C ATOM 883 NH1 ARG A 55 -16.241 -13.101 -0.223 1.00 0.00 N ATOM 884 NH2 ARG A 55 -18.420 -12.561 -0.712 1.00 0.00 N ATOM 0 H ARG A 55 -15.429 -7.586 -3.591 1.00 0.00 H new ATOM 0 HA ARG A 55 -13.948 -9.019 -1.477 1.00 0.00 H new ATOM 0 HB2 ARG A 55 -13.787 -9.254 -4.498 1.00 0.00 H new ATOM 0 HB3 ARG A 55 -12.976 -10.271 -3.324 1.00 0.00 H new ATOM 0 HG2 ARG A 55 -15.974 -10.063 -3.773 1.00 0.00 H new ATOM 0 HG3 ARG A 55 -14.945 -11.415 -4.200 1.00 0.00 H new ATOM 0 HD2 ARG A 55 -14.699 -12.119 -1.995 1.00 0.00 H new ATOM 0 HD3 ARG A 55 -14.935 -10.512 -1.336 1.00 0.00 H new ATOM 0 HE ARG A 55 -17.404 -11.040 -2.399 1.00 0.00 H new ATOM 0 HH11 ARG A 55 -15.242 -12.978 -0.387 1.00 0.00 H new ATOM 0 HH12 ARG A 55 -16.564 -13.768 0.478 1.00 0.00 H new ATOM 0 HH21 ARG A 55 -19.098 -12.023 -1.252 1.00 0.00 H new ATOM 0 HH22 ARG A 55 -18.741 -13.228 -0.010 1.00 0.00 H new ATOM 898 N PRO A 56 -12.095 -7.367 -1.480 1.00 0.00 N ATOM 899 CA PRO A 56 -10.935 -6.472 -1.434 1.00 0.00 C ATOM 900 C PRO A 56 -9.834 -6.895 -2.397 1.00 0.00 C ATOM 901 O PRO A 56 -9.336 -8.021 -2.329 1.00 0.00 O ATOM 902 CB PRO A 56 -10.438 -6.593 0.010 1.00 0.00 C ATOM 903 CG PRO A 56 -11.607 -7.094 0.785 1.00 0.00 C ATOM 904 CD PRO A 56 -12.407 -7.940 -0.163 1.00 0.00 C ATOM 0 HA PRO A 56 -11.204 -5.457 -1.727 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -9.595 -7.281 0.080 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -10.096 -5.630 0.391 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -11.282 -7.677 1.647 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -12.204 -6.266 1.167 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -12.120 -8.990 -0.104 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -13.474 -7.888 0.055 1.00 0.00 H new ATOM 912 N PHE A 57 -9.456 -5.996 -3.288 1.00 0.00 N ATOM 913 CA PHE A 57 -8.403 -6.276 -4.244 1.00 0.00 C ATOM 914 C PHE A 57 -7.148 -5.485 -3.886 1.00 0.00 C ATOM 915 O PHE A 57 -7.216 -4.310 -3.545 1.00 0.00 O ATOM 916 CB PHE A 57 -8.874 -5.957 -5.669 1.00 0.00 C ATOM 917 CG PHE A 57 -9.986 -6.860 -6.144 1.00 0.00 C ATOM 918 CD1 PHE A 57 -11.200 -6.345 -6.584 1.00 0.00 C ATOM 919 CD2 PHE A 57 -9.813 -8.235 -6.142 1.00 0.00 C ATOM 920 CE1 PHE A 57 -12.212 -7.188 -7.006 1.00 0.00 C ATOM 921 CE2 PHE A 57 -10.821 -9.078 -6.566 1.00 0.00 C ATOM 922 CZ PHE A 57 -12.022 -8.555 -6.998 1.00 0.00 C ATOM 0 H PHE A 57 -9.864 -5.065 -3.368 1.00 0.00 H new ATOM 0 HA PHE A 57 -8.159 -7.338 -4.204 1.00 0.00 H new ATOM 0 HB2 PHE A 57 -9.213 -4.922 -5.709 1.00 0.00 H new ATOM 0 HB3 PHE A 57 -8.029 -6.042 -6.352 1.00 0.00 H new ATOM 0 HD1 PHE A 57 -11.354 -5.276 -6.596 1.00 0.00 H new ATOM 0 HD2 PHE A 57 -8.876 -8.653 -5.804 1.00 0.00 H new ATOM 0 HE1 PHE A 57 -13.152 -6.776 -7.342 1.00 0.00 H new ATOM 0 HE2 PHE A 57 -10.669 -10.147 -6.559 1.00 0.00 H new ATOM 0 HZ PHE A 57 -12.812 -9.213 -7.329 1.00 0.00 H new ATOM 932 N GLU A 58 -6.013 -6.149 -3.932 1.00 0.00 N ATOM 933 CA GLU A 58 -4.745 -5.529 -3.592 1.00 0.00 C ATOM 934 C GLU A 58 -3.954 -5.221 -4.850 1.00 0.00 C ATOM 935 O GLU A 58 -3.770 -6.092 -5.698 1.00 0.00 O ATOM 936 CB GLU A 58 -3.931 -6.458 -2.692 1.00 0.00 C ATOM 937 CG GLU A 58 -4.601 -6.769 -1.366 1.00 0.00 C ATOM 938 CD GLU A 58 -3.923 -7.902 -0.629 1.00 0.00 C ATOM 939 OE1 GLU A 58 -2.732 -7.771 -0.285 1.00 0.00 O ATOM 940 OE2 GLU A 58 -4.583 -8.933 -0.382 1.00 0.00 O ATOM 0 H GLU A 58 -5.940 -7.129 -4.204 1.00 0.00 H new ATOM 0 HA GLU A 58 -4.947 -4.598 -3.062 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -3.746 -7.392 -3.223 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -2.960 -6.003 -2.500 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -4.594 -5.876 -0.740 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -5.645 -7.027 -1.541 1.00 0.00 H new ATOM 947 N ALA A 59 -3.501 -3.985 -4.973 1.00 0.00 N ATOM 948 CA ALA A 59 -2.635 -3.603 -6.073 1.00 0.00 C ATOM 949 C ALA A 59 -1.215 -3.440 -5.564 1.00 0.00 C ATOM 950 O ALA A 59 -0.913 -2.490 -4.837 1.00 0.00 O ATOM 951 CB ALA A 59 -3.126 -2.316 -6.724 1.00 0.00 C ATOM 0 H ALA A 59 -3.719 -3.229 -4.324 1.00 0.00 H new ATOM 0 HA ALA A 59 -2.654 -4.386 -6.831 1.00 0.00 H new ATOM 0 HB1 ALA A 59 -2.462 -2.048 -7.546 1.00 0.00 H new ATOM 0 HB2 ALA A 59 -4.136 -2.464 -7.106 1.00 0.00 H new ATOM 0 HB3 ALA A 59 -3.132 -1.514 -5.986 1.00 0.00 H new ATOM 957 N ARG A 60 -0.355 -4.384 -5.911 1.00 0.00 N ATOM 958 CA ARG A 60 1.012 -4.361 -5.434 1.00 0.00 C ATOM 959 C ARG A 60 1.958 -4.053 -6.586 1.00 0.00 C ATOM 960 O ARG A 60 2.095 -4.848 -7.519 1.00 0.00 O ATOM 961 CB ARG A 60 1.350 -5.700 -4.771 1.00 0.00 C ATOM 962 CG ARG A 60 2.405 -5.592 -3.684 1.00 0.00 C ATOM 963 CD ARG A 60 2.256 -6.696 -2.643 1.00 0.00 C ATOM 964 NE ARG A 60 2.623 -8.016 -3.156 1.00 0.00 N ATOM 965 CZ ARG A 60 2.326 -9.163 -2.548 1.00 0.00 C ATOM 966 NH1 ARG A 60 1.567 -9.170 -1.459 1.00 0.00 N ATOM 967 NH2 ARG A 60 2.777 -10.307 -3.041 1.00 0.00 N ATOM 0 H ARG A 60 -0.581 -5.171 -6.519 1.00 0.00 H new ATOM 0 HA ARG A 60 1.128 -3.575 -4.687 1.00 0.00 H new ATOM 0 HB2 ARG A 60 0.441 -6.123 -4.343 1.00 0.00 H new ATOM 0 HB3 ARG A 60 1.697 -6.396 -5.534 1.00 0.00 H new ATOM 0 HG2 ARG A 60 3.397 -5.646 -4.133 1.00 0.00 H new ATOM 0 HG3 ARG A 60 2.328 -4.620 -3.197 1.00 0.00 H new ATOM 0 HD2 ARG A 60 2.879 -6.461 -1.780 1.00 0.00 H new ATOM 0 HD3 ARG A 60 1.224 -6.722 -2.293 1.00 0.00 H new ATOM 0 HE ARG A 60 3.139 -8.061 -4.035 1.00 0.00 H new ATOM 0 HH11 ARG A 60 1.207 -8.293 -1.083 1.00 0.00 H new ATOM 0 HH12 ARG A 60 1.344 -10.052 -0.999 1.00 0.00 H new ATOM 0 HH21 ARG A 60 3.350 -10.308 -3.885 1.00 0.00 H new ATOM 0 HH22 ARG A 60 2.551 -11.187 -2.577 1.00 0.00 H new ATOM 981 N LEU A 61 2.579 -2.884 -6.529 1.00 0.00 N ATOM 982 CA LEU A 61 3.454 -2.408 -7.595 1.00 0.00 C ATOM 983 C LEU A 61 4.914 -2.637 -7.241 1.00 0.00 C ATOM 984 O LEU A 61 5.398 -2.171 -6.205 1.00 0.00 O ATOM 985 CB LEU A 61 3.223 -0.916 -7.855 1.00 0.00 C ATOM 986 CG LEU A 61 1.829 -0.543 -8.364 1.00 0.00 C ATOM 987 CD1 LEU A 61 1.681 0.968 -8.442 1.00 0.00 C ATOM 988 CD2 LEU A 61 1.578 -1.168 -9.724 1.00 0.00 C ATOM 0 H LEU A 61 2.492 -2.238 -5.744 1.00 0.00 H new ATOM 0 HA LEU A 61 3.215 -2.972 -8.496 1.00 0.00 H new ATOM 0 HB2 LEU A 61 3.411 -0.371 -6.930 1.00 0.00 H new ATOM 0 HB3 LEU A 61 3.960 -0.574 -8.582 1.00 0.00 H new ATOM 0 HG LEU A 61 1.089 -0.929 -7.663 1.00 0.00 H new ATOM 0 HD11 LEU A 61 0.684 1.218 -8.806 1.00 0.00 H new ATOM 0 HD12 LEU A 61 1.824 1.399 -7.451 1.00 0.00 H new ATOM 0 HD13 LEU A 61 2.428 1.372 -9.125 1.00 0.00 H new ATOM 0 HD21 LEU A 61 0.582 -0.893 -10.072 1.00 0.00 H new ATOM 0 HD22 LEU A 61 2.323 -0.807 -10.433 1.00 0.00 H new ATOM 0 HD23 LEU A 61 1.648 -2.253 -9.644 1.00 0.00 H new ATOM 1000 N TYR A 62 5.616 -3.345 -8.105 1.00 0.00 N ATOM 1001 CA TYR A 62 7.013 -3.661 -7.876 1.00 0.00 C ATOM 1002 C TYR A 62 7.914 -2.802 -8.744 1.00 0.00 C ATOM 1003 O TYR A 62 7.896 -2.911 -9.973 1.00 0.00 O ATOM 1004 CB TYR A 62 7.297 -5.131 -8.177 1.00 0.00 C ATOM 1005 CG TYR A 62 6.452 -6.099 -7.391 1.00 0.00 C ATOM 1006 CD1 TYR A 62 6.894 -6.614 -6.181 1.00 0.00 C ATOM 1007 CD2 TYR A 62 5.218 -6.512 -7.870 1.00 0.00 C ATOM 1008 CE1 TYR A 62 6.127 -7.513 -5.468 1.00 0.00 C ATOM 1009 CE2 TYR A 62 4.445 -7.406 -7.160 1.00 0.00 C ATOM 1010 CZ TYR A 62 4.905 -7.905 -5.964 1.00 0.00 C ATOM 1011 OH TYR A 62 4.139 -8.806 -5.267 1.00 0.00 O ATOM 0 H TYR A 62 5.239 -3.714 -8.978 1.00 0.00 H new ATOM 0 HA TYR A 62 7.221 -3.458 -6.825 1.00 0.00 H new ATOM 0 HB2 TYR A 62 7.139 -5.309 -9.241 1.00 0.00 H new ATOM 0 HB3 TYR A 62 8.348 -5.335 -7.973 1.00 0.00 H new ATOM 0 HD1 TYR A 62 7.853 -6.307 -5.791 1.00 0.00 H new ATOM 0 HD2 TYR A 62 4.857 -6.128 -8.813 1.00 0.00 H new ATOM 0 HE1 TYR A 62 6.484 -7.906 -4.527 1.00 0.00 H new ATOM 0 HE2 TYR A 62 3.482 -7.713 -7.541 1.00 0.00 H new ATOM 0 HH TYR A 62 4.019 -9.617 -5.803 1.00 0.00 H new ATOM 1021 N LEU A 63 8.668 -1.926 -8.108 1.00 0.00 N ATOM 1022 CA LEU A 63 9.754 -1.228 -8.776 1.00 0.00 C ATOM 1023 C LEU A 63 11.061 -1.907 -8.390 1.00 0.00 C ATOM 1024 O LEU A 63 12.104 -1.703 -9.007 1.00 0.00 O ATOM 1025 CB LEU A 63 9.779 0.257 -8.389 1.00 0.00 C ATOM 1026 CG LEU A 63 8.755 1.152 -9.105 1.00 0.00 C ATOM 1027 CD1 LEU A 63 8.908 1.038 -10.615 1.00 0.00 C ATOM 1028 CD2 LEU A 63 7.332 0.810 -8.683 1.00 0.00 C ATOM 0 H LEU A 63 8.549 -1.679 -7.126 1.00 0.00 H new ATOM 0 HA LEU A 63 9.611 -1.274 -9.856 1.00 0.00 H new ATOM 0 HB2 LEU A 63 9.614 0.336 -7.314 1.00 0.00 H new ATOM 0 HB3 LEU A 63 10.777 0.648 -8.588 1.00 0.00 H new ATOM 0 HG LEU A 63 8.951 2.184 -8.813 1.00 0.00 H new ATOM 0 HD11 LEU A 63 8.175 1.679 -11.104 1.00 0.00 H new ATOM 0 HD12 LEU A 63 9.912 1.349 -10.904 1.00 0.00 H new ATOM 0 HD13 LEU A 63 8.747 0.004 -10.920 1.00 0.00 H new ATOM 0 HD21 LEU A 63 6.631 1.460 -9.207 1.00 0.00 H new ATOM 0 HD22 LEU A 63 7.118 -0.229 -8.932 1.00 0.00 H new ATOM 0 HD23 LEU A 63 7.227 0.954 -7.608 1.00 0.00 H new ATOM 1040 N GLY A 64 10.966 -2.717 -7.347 1.00 0.00 N ATOM 1041 CA GLY A 64 12.074 -3.514 -6.881 1.00 0.00 C ATOM 1042 C GLY A 64 11.669 -4.262 -5.635 1.00 0.00 C ATOM 1043 O GLY A 64 10.537 -4.115 -5.178 1.00 0.00 O ATOM 0 H GLY A 64 10.112 -2.836 -6.802 1.00 0.00 H new ATOM 0 HA2 GLY A 64 12.381 -4.217 -7.656 1.00 0.00 H new ATOM 0 HA3 GLY A 64 12.932 -2.875 -6.671 1.00 0.00 H new ATOM 1047 N LEU A 65 12.561 -5.063 -5.075 1.00 0.00 N ATOM 1048 CA LEU A 65 12.265 -5.742 -3.821 1.00 0.00 C ATOM 1049 C LEU A 65 12.396 -4.771 -2.654 1.00 0.00 C ATOM 1050 O LEU A 65 11.934 -5.042 -1.546 1.00 0.00 O ATOM 1051 CB LEU A 65 13.179 -6.953 -3.619 1.00 0.00 C ATOM 1052 CG LEU A 65 12.975 -8.095 -4.620 1.00 0.00 C ATOM 1053 CD1 LEU A 65 13.901 -9.255 -4.299 1.00 0.00 C ATOM 1054 CD2 LEU A 65 11.524 -8.557 -4.616 1.00 0.00 C ATOM 0 H LEU A 65 13.485 -5.258 -5.461 1.00 0.00 H new ATOM 0 HA LEU A 65 11.238 -6.104 -3.864 1.00 0.00 H new ATOM 0 HB2 LEU A 65 14.215 -6.620 -3.677 1.00 0.00 H new ATOM 0 HB3 LEU A 65 13.025 -7.341 -2.612 1.00 0.00 H new ATOM 0 HG LEU A 65 13.216 -7.725 -5.617 1.00 0.00 H new ATOM 0 HD11 LEU A 65 13.743 -10.057 -5.020 1.00 0.00 H new ATOM 0 HD12 LEU A 65 14.937 -8.919 -4.351 1.00 0.00 H new ATOM 0 HD13 LEU A 65 13.689 -9.622 -3.295 1.00 0.00 H new ATOM 0 HD21 LEU A 65 11.399 -9.368 -5.333 1.00 0.00 H new ATOM 0 HD22 LEU A 65 11.257 -8.909 -3.620 1.00 0.00 H new ATOM 0 HD23 LEU A 65 10.876 -7.725 -4.893 1.00 0.00 H new ATOM 1066 N ASP A 66 13.025 -3.636 -2.917 1.00 0.00 N ATOM 1067 CA ASP A 66 13.158 -2.585 -1.918 1.00 0.00 C ATOM 1068 C ASP A 66 12.010 -1.588 -2.040 1.00 0.00 C ATOM 1069 O ASP A 66 11.338 -1.274 -1.057 1.00 0.00 O ATOM 1070 CB ASP A 66 14.494 -1.861 -2.071 1.00 0.00 C ATOM 1071 CG ASP A 66 14.641 -0.713 -1.092 1.00 0.00 C ATOM 1072 OD1 ASP A 66 15.135 -0.941 0.032 1.00 0.00 O ATOM 1073 OD2 ASP A 66 14.271 0.425 -1.444 1.00 0.00 O ATOM 0 H ASP A 66 13.453 -3.418 -3.817 1.00 0.00 H new ATOM 0 HA ASP A 66 13.123 -3.047 -0.931 1.00 0.00 H new ATOM 0 HB2 ASP A 66 15.308 -2.570 -1.921 1.00 0.00 H new ATOM 0 HB3 ASP A 66 14.585 -1.482 -3.089 1.00 0.00 H new ATOM 1078 N VAL A 67 11.784 -1.102 -3.252 1.00 0.00 N ATOM 1079 CA VAL A 67 10.728 -0.135 -3.499 1.00 0.00 C ATOM 1080 C VAL A 67 9.427 -0.846 -3.847 1.00 0.00 C ATOM 1081 O VAL A 67 9.231 -1.290 -4.984 1.00 0.00 O ATOM 1082 CB VAL A 67 11.093 0.840 -4.638 1.00 0.00 C ATOM 1083 CG1 VAL A 67 10.015 1.899 -4.805 1.00 0.00 C ATOM 1084 CG2 VAL A 67 12.443 1.491 -4.379 1.00 0.00 C ATOM 0 H VAL A 67 12.320 -1.363 -4.080 1.00 0.00 H new ATOM 0 HA VAL A 67 10.603 0.441 -2.582 1.00 0.00 H new ATOM 0 HB VAL A 67 11.160 0.269 -5.564 1.00 0.00 H new ATOM 0 HG11 VAL A 67 10.292 2.576 -5.613 1.00 0.00 H new ATOM 0 HG12 VAL A 67 9.066 1.418 -5.044 1.00 0.00 H new ATOM 0 HG13 VAL A 67 9.913 2.463 -3.878 1.00 0.00 H new ATOM 0 HG21 VAL A 67 12.680 2.174 -5.195 1.00 0.00 H new ATOM 0 HG22 VAL A 67 12.406 2.045 -3.441 1.00 0.00 H new ATOM 0 HG23 VAL A 67 13.212 0.721 -4.316 1.00 0.00 H new ATOM 1094 N LEU A 68 8.550 -0.965 -2.864 1.00 0.00 N ATOM 1095 CA LEU A 68 7.278 -1.635 -3.054 1.00 0.00 C ATOM 1096 C LEU A 68 6.130 -0.657 -2.852 1.00 0.00 C ATOM 1097 O LEU A 68 6.043 0.013 -1.821 1.00 0.00 O ATOM 1098 CB LEU A 68 7.146 -2.806 -2.078 1.00 0.00 C ATOM 1099 CG LEU A 68 5.861 -3.626 -2.210 1.00 0.00 C ATOM 1100 CD1 LEU A 68 5.788 -4.287 -3.579 1.00 0.00 C ATOM 1101 CD2 LEU A 68 5.779 -4.669 -1.109 1.00 0.00 C ATOM 0 H LEU A 68 8.699 -0.603 -1.922 1.00 0.00 H new ATOM 0 HA LEU A 68 7.237 -2.019 -4.073 1.00 0.00 H new ATOM 0 HB2 LEU A 68 7.998 -3.471 -2.217 1.00 0.00 H new ATOM 0 HB3 LEU A 68 7.207 -2.419 -1.061 1.00 0.00 H new ATOM 0 HG LEU A 68 5.011 -2.952 -2.108 1.00 0.00 H new ATOM 0 HD11 LEU A 68 4.868 -4.866 -3.655 1.00 0.00 H new ATOM 0 HD12 LEU A 68 5.800 -3.521 -4.354 1.00 0.00 H new ATOM 0 HD13 LEU A 68 6.644 -4.948 -3.710 1.00 0.00 H new ATOM 0 HD21 LEU A 68 4.859 -5.243 -1.219 1.00 0.00 H new ATOM 0 HD22 LEU A 68 6.635 -5.340 -1.179 1.00 0.00 H new ATOM 0 HD23 LEU A 68 5.784 -4.174 -0.138 1.00 0.00 H new ATOM 1113 N ILE A 69 5.263 -0.557 -3.843 1.00 0.00 N ATOM 1114 CA ILE A 69 4.078 0.274 -3.722 1.00 0.00 C ATOM 1115 C ILE A 69 2.880 -0.608 -3.393 1.00 0.00 C ATOM 1116 O ILE A 69 2.665 -1.638 -4.029 1.00 0.00 O ATOM 1117 CB ILE A 69 3.813 1.089 -5.007 1.00 0.00 C ATOM 1118 CG1 ILE A 69 5.071 1.865 -5.411 1.00 0.00 C ATOM 1119 CG2 ILE A 69 2.647 2.043 -4.795 1.00 0.00 C ATOM 1120 CD1 ILE A 69 4.903 2.706 -6.658 1.00 0.00 C ATOM 0 H ILE A 69 5.356 -1.039 -4.737 1.00 0.00 H new ATOM 0 HA ILE A 69 4.241 0.991 -2.918 1.00 0.00 H new ATOM 0 HB ILE A 69 3.556 0.400 -5.812 1.00 0.00 H new ATOM 0 HG12 ILE A 69 5.366 2.513 -4.586 1.00 0.00 H new ATOM 0 HG13 ILE A 69 5.886 1.159 -5.569 1.00 0.00 H new ATOM 0 HG21 ILE A 69 2.471 2.611 -5.708 1.00 0.00 H new ATOM 0 HG22 ILE A 69 1.752 1.474 -4.544 1.00 0.00 H new ATOM 0 HG23 ILE A 69 2.881 2.729 -3.981 1.00 0.00 H new ATOM 0 HD11 ILE A 69 5.837 3.223 -6.877 1.00 0.00 H new ATOM 0 HD12 ILE A 69 4.639 2.063 -7.498 1.00 0.00 H new ATOM 0 HD13 ILE A 69 4.111 3.438 -6.499 1.00 0.00 H new ATOM 1132 N ARG A 70 2.117 -0.208 -2.392 1.00 0.00 N ATOM 1133 CA ARG A 70 1.060 -1.048 -1.844 1.00 0.00 C ATOM 1134 C ARG A 70 -0.207 -0.237 -1.582 1.00 0.00 C ATOM 1135 O ARG A 70 -0.196 0.729 -0.814 1.00 0.00 O ATOM 1136 CB ARG A 70 1.555 -1.711 -0.553 1.00 0.00 C ATOM 1137 CG ARG A 70 2.230 -0.738 0.402 1.00 0.00 C ATOM 1138 CD ARG A 70 2.859 -1.442 1.593 1.00 0.00 C ATOM 1139 NE ARG A 70 3.619 -0.508 2.421 1.00 0.00 N ATOM 1140 CZ ARG A 70 4.443 -0.858 3.404 1.00 0.00 C ATOM 1141 NH1 ARG A 70 4.567 -2.131 3.766 1.00 0.00 N ATOM 1142 NH2 ARG A 70 5.116 0.086 4.050 1.00 0.00 N ATOM 0 H ARG A 70 2.209 0.700 -1.937 1.00 0.00 H new ATOM 0 HA ARG A 70 0.810 -1.820 -2.572 1.00 0.00 H new ATOM 0 HB2 ARG A 70 0.711 -2.180 -0.047 1.00 0.00 H new ATOM 0 HB3 ARG A 70 2.256 -2.506 -0.807 1.00 0.00 H new ATOM 0 HG2 ARG A 70 2.997 -0.180 -0.134 1.00 0.00 H new ATOM 0 HG3 ARG A 70 1.497 -0.013 0.757 1.00 0.00 H new ATOM 0 HD2 ARG A 70 2.080 -1.913 2.193 1.00 0.00 H new ATOM 0 HD3 ARG A 70 3.516 -2.238 1.242 1.00 0.00 H new ATOM 0 HE ARG A 70 3.509 0.488 2.230 1.00 0.00 H new ATOM 0 HH11 ARG A 70 4.027 -2.852 3.288 1.00 0.00 H new ATOM 0 HH12 ARG A 70 5.203 -2.387 4.522 1.00 0.00 H new ATOM 0 HH21 ARG A 70 4.998 1.065 3.790 1.00 0.00 H new ATOM 0 HH22 ARG A 70 5.752 -0.168 4.806 1.00 0.00 H new ATOM 1156 N MET A 71 -1.295 -0.625 -2.230 1.00 0.00 N ATOM 1157 CA MET A 71 -2.563 0.066 -2.068 1.00 0.00 C ATOM 1158 C MET A 71 -3.731 -0.915 -2.146 1.00 0.00 C ATOM 1159 O MET A 71 -3.818 -1.727 -3.069 1.00 0.00 O ATOM 1160 CB MET A 71 -2.697 1.166 -3.130 1.00 0.00 C ATOM 1161 CG MET A 71 -2.566 0.662 -4.561 1.00 0.00 C ATOM 1162 SD MET A 71 -2.281 1.986 -5.753 1.00 0.00 S ATOM 1163 CE MET A 71 -3.712 3.022 -5.474 1.00 0.00 C ATOM 0 H MET A 71 -1.324 -1.416 -2.874 1.00 0.00 H new ATOM 0 HA MET A 71 -2.587 0.529 -1.082 1.00 0.00 H new ATOM 0 HB2 MET A 71 -3.665 1.653 -3.014 1.00 0.00 H new ATOM 0 HB3 MET A 71 -1.935 1.925 -2.951 1.00 0.00 H new ATOM 0 HG2 MET A 71 -1.743 -0.051 -4.615 1.00 0.00 H new ATOM 0 HG3 MET A 71 -3.473 0.123 -4.835 1.00 0.00 H new ATOM 0 HE1 MET A 71 -3.799 3.747 -6.283 1.00 0.00 H new ATOM 0 HE2 MET A 71 -4.609 2.403 -5.443 1.00 0.00 H new ATOM 0 HE3 MET A 71 -3.601 3.548 -4.526 1.00 0.00 H new ATOM 1173 N GLU A 72 -4.611 -0.852 -1.154 1.00 0.00 N ATOM 1174 CA GLU A 72 -5.800 -1.691 -1.129 1.00 0.00 C ATOM 1175 C GLU A 72 -6.950 -0.969 -1.818 1.00 0.00 C ATOM 1176 O GLU A 72 -7.234 0.198 -1.522 1.00 0.00 O ATOM 1177 CB GLU A 72 -6.177 -2.055 0.310 1.00 0.00 C ATOM 1178 CG GLU A 72 -7.414 -2.935 0.414 1.00 0.00 C ATOM 1179 CD GLU A 72 -7.691 -3.395 1.830 1.00 0.00 C ATOM 1180 OE1 GLU A 72 -8.281 -4.484 2.003 1.00 0.00 O ATOM 1181 OE2 GLU A 72 -7.308 -2.680 2.776 1.00 0.00 O ATOM 0 H GLU A 72 -4.522 -0.226 -0.354 1.00 0.00 H new ATOM 0 HA GLU A 72 -5.590 -2.617 -1.664 1.00 0.00 H new ATOM 0 HB2 GLU A 72 -5.337 -2.568 0.778 1.00 0.00 H new ATOM 0 HB3 GLU A 72 -6.345 -1.138 0.875 1.00 0.00 H new ATOM 0 HG2 GLU A 72 -8.278 -2.385 0.040 1.00 0.00 H new ATOM 0 HG3 GLU A 72 -7.289 -3.807 -0.228 1.00 0.00 H new ATOM 1188 N ILE A 73 -7.601 -1.662 -2.736 1.00 0.00 N ATOM 1189 CA ILE A 73 -8.623 -1.061 -3.571 1.00 0.00 C ATOM 1190 C ILE A 73 -9.870 -1.940 -3.644 1.00 0.00 C ATOM 1191 O ILE A 73 -9.801 -3.158 -3.474 1.00 0.00 O ATOM 1192 CB ILE A 73 -8.077 -0.816 -4.995 1.00 0.00 C ATOM 1193 CG1 ILE A 73 -7.485 -2.115 -5.560 1.00 0.00 C ATOM 1194 CG2 ILE A 73 -7.031 0.296 -4.978 1.00 0.00 C ATOM 1195 CD1 ILE A 73 -6.816 -1.966 -6.907 1.00 0.00 C ATOM 0 H ILE A 73 -7.437 -2.651 -2.922 1.00 0.00 H new ATOM 0 HA ILE A 73 -8.900 -0.108 -3.120 1.00 0.00 H new ATOM 0 HB ILE A 73 -8.897 -0.500 -5.641 1.00 0.00 H new ATOM 0 HG12 ILE A 73 -6.758 -2.507 -4.849 1.00 0.00 H new ATOM 0 HG13 ILE A 73 -8.280 -2.855 -5.644 1.00 0.00 H new ATOM 0 HG21 ILE A 73 -6.655 0.458 -5.988 1.00 0.00 H new ATOM 0 HG22 ILE A 73 -7.484 1.216 -4.608 1.00 0.00 H new ATOM 0 HG23 ILE A 73 -6.206 0.010 -4.326 1.00 0.00 H new ATOM 0 HD11 ILE A 73 -6.427 -2.932 -7.229 1.00 0.00 H new ATOM 0 HD12 ILE A 73 -7.542 -1.606 -7.636 1.00 0.00 H new ATOM 0 HD13 ILE A 73 -5.996 -1.252 -6.829 1.00 0.00 H new ATOM 1207 N SER A 74 -11.003 -1.310 -3.885 1.00 0.00 N ATOM 1208 CA SER A 74 -12.262 -2.019 -4.028 1.00 0.00 C ATOM 1209 C SER A 74 -12.694 -1.996 -5.489 1.00 0.00 C ATOM 1210 O SER A 74 -12.440 -1.027 -6.196 1.00 0.00 O ATOM 1211 CB SER A 74 -13.321 -1.350 -3.149 1.00 0.00 C ATOM 1212 OG SER A 74 -14.552 -2.049 -3.174 1.00 0.00 O ATOM 0 H SER A 74 -11.078 -0.298 -3.987 1.00 0.00 H new ATOM 0 HA SER A 74 -12.142 -3.056 -3.713 1.00 0.00 H new ATOM 0 HB2 SER A 74 -12.957 -1.294 -2.123 1.00 0.00 H new ATOM 0 HB3 SER A 74 -13.479 -0.326 -3.488 1.00 0.00 H new ATOM 0 HG SER A 74 -15.200 -1.591 -2.599 1.00 0.00 H new ATOM 1218 N LEU A 75 -13.330 -3.059 -5.951 1.00 0.00 N ATOM 1219 CA LEU A 75 -13.765 -3.122 -7.339 1.00 0.00 C ATOM 1220 C LEU A 75 -14.974 -2.222 -7.561 1.00 0.00 C ATOM 1221 O LEU A 75 -16.058 -2.485 -7.046 1.00 0.00 O ATOM 1222 CB LEU A 75 -14.096 -4.558 -7.746 1.00 0.00 C ATOM 1223 CG LEU A 75 -14.550 -4.721 -9.196 1.00 0.00 C ATOM 1224 CD1 LEU A 75 -13.467 -4.250 -10.156 1.00 0.00 C ATOM 1225 CD2 LEU A 75 -14.928 -6.165 -9.482 1.00 0.00 C ATOM 0 H LEU A 75 -13.556 -3.883 -5.394 1.00 0.00 H new ATOM 0 HA LEU A 75 -12.944 -2.770 -7.964 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -13.216 -5.180 -7.583 1.00 0.00 H new ATOM 0 HB3 LEU A 75 -14.879 -4.936 -7.089 1.00 0.00 H new ATOM 0 HG LEU A 75 -15.433 -4.100 -9.347 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -13.811 -4.375 -11.183 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -13.250 -3.198 -9.972 1.00 0.00 H new ATOM 0 HD13 LEU A 75 -12.563 -4.839 -10.002 1.00 0.00 H new ATOM 0 HD21 LEU A 75 -15.248 -6.259 -10.520 1.00 0.00 H new ATOM 0 HD22 LEU A 75 -14.065 -6.808 -9.309 1.00 0.00 H new ATOM 0 HD23 LEU A 75 -15.742 -6.465 -8.823 1.00 0.00 H new ATOM 1237 N ALA A 76 -14.775 -1.151 -8.316 1.00 0.00 N ATOM 1238 CA ALA A 76 -15.849 -0.215 -8.608 1.00 0.00 C ATOM 1239 C ALA A 76 -16.566 -0.600 -9.896 1.00 0.00 C ATOM 1240 O ALA A 76 -17.790 -0.748 -9.916 1.00 0.00 O ATOM 1241 CB ALA A 76 -15.307 1.202 -8.699 1.00 0.00 C ATOM 0 H ALA A 76 -13.878 -0.909 -8.738 1.00 0.00 H new ATOM 0 HA ALA A 76 -16.572 -0.257 -7.793 1.00 0.00 H new ATOM 0 HB1 ALA A 76 -16.123 1.890 -8.918 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -14.845 1.477 -7.751 1.00 0.00 H new ATOM 0 HB3 ALA A 76 -14.563 1.257 -9.494 1.00 0.00 H new ATOM 1247 N TRP A 77 -15.802 -0.773 -10.971 1.00 0.00 N ATOM 1248 CA TRP A 77 -16.376 -1.125 -12.262 1.00 0.00 C ATOM 1249 C TRP A 77 -15.373 -1.880 -13.133 1.00 0.00 C ATOM 1250 O TRP A 77 -14.179 -1.574 -13.140 1.00 0.00 O ATOM 1251 CB TRP A 77 -16.884 0.130 -12.996 1.00 0.00 C ATOM 1252 CG TRP A 77 -15.874 1.239 -13.112 1.00 0.00 C ATOM 1253 CD1 TRP A 77 -15.623 2.215 -12.191 1.00 0.00 C ATOM 1254 CD2 TRP A 77 -14.997 1.497 -14.216 1.00 0.00 C ATOM 1255 NE1 TRP A 77 -14.639 3.057 -12.649 1.00 0.00 N ATOM 1256 CE2 TRP A 77 -14.241 2.639 -13.891 1.00 0.00 C ATOM 1257 CE3 TRP A 77 -14.775 0.873 -15.444 1.00 0.00 C ATOM 1258 CZ2 TRP A 77 -13.281 3.168 -14.751 1.00 0.00 C ATOM 1259 CZ3 TRP A 77 -13.822 1.400 -16.297 1.00 0.00 C ATOM 1260 CH2 TRP A 77 -13.087 2.536 -15.947 1.00 0.00 C ATOM 0 H TRP A 77 -14.787 -0.675 -10.972 1.00 0.00 H new ATOM 0 HA TRP A 77 -17.222 -1.786 -12.074 1.00 0.00 H new ATOM 0 HB2 TRP A 77 -17.207 -0.156 -13.997 1.00 0.00 H new ATOM 0 HB3 TRP A 77 -17.763 0.509 -12.474 1.00 0.00 H new ATOM 0 HD1 TRP A 77 -16.125 2.311 -11.240 1.00 0.00 H new ATOM 0 HE1 TRP A 77 -14.266 3.862 -12.146 1.00 0.00 H new ATOM 0 HE3 TRP A 77 -15.337 -0.006 -15.724 1.00 0.00 H new ATOM 0 HZ2 TRP A 77 -12.711 4.045 -14.482 1.00 0.00 H new ATOM 0 HZ3 TRP A 77 -13.643 0.925 -17.250 1.00 0.00 H new ATOM 0 HH2 TRP A 77 -12.350 2.922 -16.636 1.00 0.00 H new ATOM 1271 N ALA A 78 -15.870 -2.879 -13.847 1.00 0.00 N ATOM 1272 CA ALA A 78 -15.057 -3.647 -14.776 1.00 0.00 C ATOM 1273 C ALA A 78 -15.606 -3.494 -16.191 1.00 0.00 C ATOM 1274 O ALA A 78 -16.592 -4.131 -16.555 1.00 0.00 O ATOM 1275 CB ALA A 78 -15.027 -5.114 -14.366 1.00 0.00 C ATOM 0 H ALA A 78 -16.844 -3.179 -13.799 1.00 0.00 H new ATOM 0 HA ALA A 78 -14.036 -3.267 -14.754 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -14.415 -5.676 -15.071 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -14.604 -5.204 -13.366 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -16.041 -5.513 -14.368 1.00 0.00 H new ATOM 1281 N ARG A 79 -14.980 -2.628 -16.976 1.00 0.00 N ATOM 1282 CA ARG A 79 -15.463 -2.338 -18.320 1.00 0.00 C ATOM 1283 C ARG A 79 -14.711 -3.175 -19.356 1.00 0.00 C ATOM 1284 O ARG A 79 -13.834 -2.665 -20.060 1.00 0.00 O ATOM 1285 CB ARG A 79 -15.314 -0.845 -18.630 1.00 0.00 C ATOM 1286 CG ARG A 79 -16.027 -0.407 -19.900 1.00 0.00 C ATOM 1287 CD ARG A 79 -17.452 0.066 -19.629 1.00 0.00 C ATOM 1288 NE ARG A 79 -18.248 -0.904 -18.870 1.00 0.00 N ATOM 1289 CZ ARG A 79 -18.870 -1.952 -19.414 1.00 0.00 C ATOM 1290 NH1 ARG A 79 -18.687 -2.251 -20.697 1.00 0.00 N ATOM 1291 NH2 ARG A 79 -19.662 -2.711 -18.667 1.00 0.00 N ATOM 0 H ARG A 79 -14.140 -2.116 -16.707 1.00 0.00 H new ATOM 0 HA ARG A 79 -16.520 -2.600 -18.369 1.00 0.00 H new ATOM 0 HB2 ARG A 79 -15.702 -0.269 -17.790 1.00 0.00 H new ATOM 0 HB3 ARG A 79 -14.254 -0.606 -18.719 1.00 0.00 H new ATOM 0 HG2 ARG A 79 -15.463 0.397 -20.372 1.00 0.00 H new ATOM 0 HG3 ARG A 79 -16.050 -1.237 -20.606 1.00 0.00 H new ATOM 0 HD2 ARG A 79 -17.417 1.007 -19.080 1.00 0.00 H new ATOM 0 HD3 ARG A 79 -17.947 0.269 -20.578 1.00 0.00 H new ATOM 0 HE ARG A 79 -18.332 -0.769 -17.862 1.00 0.00 H new ATOM 0 HH11 ARG A 79 -18.068 -1.678 -21.271 1.00 0.00 H new ATOM 0 HH12 ARG A 79 -19.165 -3.053 -21.107 1.00 0.00 H new ATOM 0 HH21 ARG A 79 -19.794 -2.493 -17.679 1.00 0.00 H new ATOM 0 HH22 ARG A 79 -20.138 -3.512 -19.080 1.00 0.00 H new ATOM 1305 N ASP A 80 -15.049 -4.467 -19.409 1.00 0.00 N ATOM 1306 CA ASP A 80 -14.462 -5.423 -20.362 1.00 0.00 C ATOM 1307 C ASP A 80 -12.957 -5.591 -20.169 1.00 0.00 C ATOM 1308 O ASP A 80 -12.504 -6.583 -19.595 1.00 0.00 O ATOM 1309 CB ASP A 80 -14.761 -5.028 -21.815 1.00 0.00 C ATOM 1310 CG ASP A 80 -16.164 -5.401 -22.249 1.00 0.00 C ATOM 1311 OD1 ASP A 80 -17.069 -4.539 -22.177 1.00 0.00 O ATOM 1312 OD2 ASP A 80 -16.374 -6.559 -22.670 1.00 0.00 O ATOM 0 H ASP A 80 -15.742 -4.885 -18.789 1.00 0.00 H new ATOM 0 HA ASP A 80 -14.935 -6.383 -20.154 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -14.624 -3.953 -21.930 1.00 0.00 H new ATOM 0 HB3 ASP A 80 -14.041 -5.513 -22.474 1.00 0.00 H new ATOM 1317 N GLY A 81 -12.187 -4.628 -20.656 1.00 0.00 N ATOM 1318 CA GLY A 81 -10.746 -4.706 -20.560 1.00 0.00 C ATOM 1319 C GLY A 81 -10.175 -3.691 -19.590 1.00 0.00 C ATOM 1320 O GLY A 81 -9.075 -3.870 -19.075 1.00 0.00 O ATOM 0 H GLY A 81 -12.539 -3.790 -21.118 1.00 0.00 H new ATOM 0 HA2 GLY A 81 -10.460 -5.709 -20.243 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -10.310 -4.547 -21.546 1.00 0.00 H new ATOM 1324 N LEU A 82 -10.920 -2.626 -19.336 1.00 0.00 N ATOM 1325 CA LEU A 82 -10.462 -1.577 -18.438 1.00 0.00 C ATOM 1326 C LEU A 82 -11.206 -1.645 -17.114 1.00 0.00 C ATOM 1327 O LEU A 82 -12.425 -1.482 -17.068 1.00 0.00 O ATOM 1328 CB LEU A 82 -10.647 -0.196 -19.075 1.00 0.00 C ATOM 1329 CG LEU A 82 -9.730 0.097 -20.265 1.00 0.00 C ATOM 1330 CD1 LEU A 82 -10.031 1.472 -20.843 1.00 0.00 C ATOM 1331 CD2 LEU A 82 -8.270 0.001 -19.848 1.00 0.00 C ATOM 0 H LEU A 82 -11.843 -2.465 -19.739 1.00 0.00 H new ATOM 0 HA LEU A 82 -9.399 -1.733 -18.252 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -11.682 -0.099 -19.401 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -10.481 0.564 -18.312 1.00 0.00 H new ATOM 0 HG LEU A 82 -9.917 -0.649 -21.037 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -9.370 1.664 -21.688 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -11.068 1.507 -21.178 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -9.871 2.231 -20.078 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -7.632 0.212 -20.706 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -8.069 0.726 -19.059 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -8.062 -1.004 -19.480 1.00 0.00 H new ATOM 1343 N LEU A 83 -10.476 -1.903 -16.044 1.00 0.00 N ATOM 1344 CA LEU A 83 -11.085 -2.002 -14.727 1.00 0.00 C ATOM 1345 C LEU A 83 -10.661 -0.845 -13.835 1.00 0.00 C ATOM 1346 O LEU A 83 -9.469 -0.584 -13.656 1.00 0.00 O ATOM 1347 CB LEU A 83 -10.745 -3.335 -14.050 1.00 0.00 C ATOM 1348 CG LEU A 83 -11.515 -4.550 -14.570 1.00 0.00 C ATOM 1349 CD1 LEU A 83 -11.002 -4.984 -15.932 1.00 0.00 C ATOM 1350 CD2 LEU A 83 -11.428 -5.696 -13.579 1.00 0.00 C ATOM 0 H LEU A 83 -9.466 -2.047 -16.059 1.00 0.00 H new ATOM 0 HA LEU A 83 -12.164 -1.954 -14.871 1.00 0.00 H new ATOM 0 HB2 LEU A 83 -9.678 -3.523 -14.171 1.00 0.00 H new ATOM 0 HB3 LEU A 83 -10.932 -3.238 -12.981 1.00 0.00 H new ATOM 0 HG LEU A 83 -12.561 -4.263 -14.682 1.00 0.00 H new ATOM 0 HD11 LEU A 83 -11.569 -5.850 -16.275 1.00 0.00 H new ATOM 0 HD12 LEU A 83 -11.122 -4.167 -16.643 1.00 0.00 H new ATOM 0 HD13 LEU A 83 -9.947 -5.248 -15.856 1.00 0.00 H new ATOM 0 HD21 LEU A 83 -11.981 -6.553 -13.964 1.00 0.00 H new ATOM 0 HD22 LEU A 83 -10.384 -5.973 -13.434 1.00 0.00 H new ATOM 0 HD23 LEU A 83 -11.857 -5.386 -12.626 1.00 0.00 H new ATOM 1362 N GLY A 84 -11.651 -0.163 -13.277 1.00 0.00 N ATOM 1363 CA GLY A 84 -11.388 0.951 -12.393 1.00 0.00 C ATOM 1364 C GLY A 84 -11.679 0.595 -10.954 1.00 0.00 C ATOM 1365 O GLY A 84 -12.756 0.080 -10.639 1.00 0.00 O ATOM 0 H GLY A 84 -12.640 -0.365 -13.424 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -10.346 1.256 -12.490 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -11.999 1.804 -12.689 1.00 0.00 H new ATOM 1369 N PHE A 85 -10.723 0.854 -10.082 1.00 0.00 N ATOM 1370 CA PHE A 85 -10.859 0.495 -8.680 1.00 0.00 C ATOM 1371 C PHE A 85 -10.923 1.727 -7.793 1.00 0.00 C ATOM 1372 O PHE A 85 -10.327 2.755 -8.097 1.00 0.00 O ATOM 1373 CB PHE A 85 -9.696 -0.386 -8.230 1.00 0.00 C ATOM 1374 CG PHE A 85 -9.615 -1.704 -8.943 1.00 0.00 C ATOM 1375 CD1 PHE A 85 -10.202 -2.833 -8.400 1.00 0.00 C ATOM 1376 CD2 PHE A 85 -8.941 -1.817 -10.148 1.00 0.00 C ATOM 1377 CE1 PHE A 85 -10.121 -4.050 -9.046 1.00 0.00 C ATOM 1378 CE2 PHE A 85 -8.859 -3.032 -10.799 1.00 0.00 C ATOM 1379 CZ PHE A 85 -9.450 -4.148 -10.247 1.00 0.00 C ATOM 0 H PHE A 85 -9.843 1.312 -10.318 1.00 0.00 H new ATOM 0 HA PHE A 85 -11.793 -0.057 -8.581 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -8.763 0.156 -8.384 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -9.786 -0.569 -7.159 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -10.729 -2.761 -7.460 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -8.475 -0.945 -10.583 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -10.582 -4.924 -8.612 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -8.333 -3.108 -11.739 1.00 0.00 H new ATOM 0 HZ PHE A 85 -9.388 -5.099 -10.755 1.00 0.00 H new ATOM 1389 N GLU A 86 -11.644 1.591 -6.697 1.00 0.00 N ATOM 1390 CA GLU A 86 -11.755 2.627 -5.682 1.00 0.00 C ATOM 1391 C GLU A 86 -10.615 2.487 -4.676 1.00 0.00 C ATOM 1392 O GLU A 86 -10.432 1.422 -4.088 1.00 0.00 O ATOM 1393 CB GLU A 86 -13.110 2.486 -4.981 1.00 0.00 C ATOM 1394 CG GLU A 86 -13.267 3.316 -3.720 1.00 0.00 C ATOM 1395 CD GLU A 86 -14.560 3.005 -2.994 1.00 0.00 C ATOM 1396 OE1 GLU A 86 -14.909 1.810 -2.882 1.00 0.00 O ATOM 1397 OE2 GLU A 86 -15.231 3.947 -2.530 1.00 0.00 O ATOM 0 H GLU A 86 -12.177 0.748 -6.481 1.00 0.00 H new ATOM 0 HA GLU A 86 -11.687 3.613 -6.143 1.00 0.00 H new ATOM 0 HB2 GLU A 86 -13.896 2.765 -5.682 1.00 0.00 H new ATOM 0 HB3 GLU A 86 -13.265 1.437 -4.729 1.00 0.00 H new ATOM 0 HG2 GLU A 86 -12.424 3.129 -3.055 1.00 0.00 H new ATOM 0 HG3 GLU A 86 -13.241 4.375 -3.977 1.00 0.00 H new ATOM 1404 N CYS A 87 -9.846 3.548 -4.490 1.00 0.00 N ATOM 1405 CA CYS A 87 -8.726 3.521 -3.557 1.00 0.00 C ATOM 1406 C CYS A 87 -9.212 3.677 -2.116 1.00 0.00 C ATOM 1407 O CYS A 87 -9.847 4.674 -1.767 1.00 0.00 O ATOM 1408 CB CYS A 87 -7.721 4.618 -3.913 1.00 0.00 C ATOM 1409 SG CYS A 87 -6.863 4.336 -5.475 1.00 0.00 S ATOM 0 H CYS A 87 -9.975 4.438 -4.971 1.00 0.00 H new ATOM 0 HA CYS A 87 -8.230 2.554 -3.638 1.00 0.00 H new ATOM 0 HB2 CYS A 87 -8.242 5.574 -3.962 1.00 0.00 H new ATOM 0 HB3 CYS A 87 -6.985 4.697 -3.113 1.00 0.00 H new ATOM 0 HG CYS A 87 -6.035 5.313 -5.698 1.00 0.00 H new ATOM 1415 N GLN A 88 -8.909 2.684 -1.284 1.00 0.00 N ATOM 1416 CA GLN A 88 -9.396 2.661 0.092 1.00 0.00 C ATOM 1417 C GLN A 88 -8.262 2.879 1.082 1.00 0.00 C ATOM 1418 O GLN A 88 -8.201 3.905 1.757 1.00 0.00 O ATOM 1419 CB GLN A 88 -10.066 1.321 0.389 1.00 0.00 C ATOM 1420 CG GLN A 88 -11.065 0.893 -0.668 1.00 0.00 C ATOM 1421 CD GLN A 88 -11.625 -0.484 -0.398 1.00 0.00 C ATOM 1422 OE1 GLN A 88 -11.058 -1.491 -0.813 1.00 0.00 O ATOM 1423 NE2 GLN A 88 -12.742 -0.544 0.295 1.00 0.00 N ATOM 0 H GLN A 88 -8.329 1.885 -1.539 1.00 0.00 H new ATOM 0 HA GLN A 88 -10.118 3.470 0.202 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -9.298 0.553 0.483 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -10.573 1.384 1.352 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -11.881 1.614 -0.708 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -10.584 0.903 -1.646 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -13.185 0.314 0.624 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -13.165 -1.449 0.504 1.00 0.00 H new ATOM 1432 N HIS A 89 -7.358 1.911 1.155 1.00 0.00 N ATOM 1433 CA HIS A 89 -6.274 1.938 2.127 1.00 0.00 C ATOM 1434 C HIS A 89 -4.926 2.010 1.423 1.00 0.00 C ATOM 1435 O HIS A 89 -4.416 1.006 0.925 1.00 0.00 O ATOM 1436 CB HIS A 89 -6.343 0.699 3.035 1.00 0.00 C ATOM 1437 CG HIS A 89 -5.210 0.587 4.015 1.00 0.00 C ATOM 1438 ND1 HIS A 89 -5.142 1.326 5.175 1.00 0.00 N ATOM 1439 CD2 HIS A 89 -4.092 -0.183 3.999 1.00 0.00 C ATOM 1440 CE1 HIS A 89 -4.036 1.023 5.826 1.00 0.00 C ATOM 1441 NE2 HIS A 89 -3.382 0.109 5.137 1.00 0.00 N ATOM 0 H HIS A 89 -7.355 1.092 0.548 1.00 0.00 H new ATOM 0 HA HIS A 89 -6.384 2.829 2.745 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -7.284 0.718 3.586 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -6.358 -0.194 2.411 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -3.813 -0.893 3.234 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -3.719 1.451 6.765 1.00 0.00 H new ATOM 0 HE2 HIS A 89 -2.493 -0.313 5.406 1.00 0.00 H new ATOM 1450 N ILE A 90 -4.359 3.199 1.380 1.00 0.00 N ATOM 1451 CA ILE A 90 -3.063 3.408 0.758 1.00 0.00 C ATOM 1452 C ILE A 90 -2.020 3.704 1.827 1.00 0.00 C ATOM 1453 O ILE A 90 -2.249 4.513 2.726 1.00 0.00 O ATOM 1454 CB ILE A 90 -3.101 4.567 -0.265 1.00 0.00 C ATOM 1455 CG1 ILE A 90 -4.261 4.374 -1.247 1.00 0.00 C ATOM 1456 CG2 ILE A 90 -1.780 4.647 -1.021 1.00 0.00 C ATOM 1457 CD1 ILE A 90 -4.431 5.522 -2.222 1.00 0.00 C ATOM 0 H ILE A 90 -4.778 4.043 1.771 1.00 0.00 H new ATOM 0 HA ILE A 90 -2.799 2.496 0.223 1.00 0.00 H new ATOM 0 HB ILE A 90 -3.253 5.502 0.275 1.00 0.00 H new ATOM 0 HG12 ILE A 90 -4.101 3.453 -1.808 1.00 0.00 H new ATOM 0 HG13 ILE A 90 -5.185 4.248 -0.683 1.00 0.00 H new ATOM 0 HG21 ILE A 90 -1.820 5.467 -1.738 1.00 0.00 H new ATOM 0 HG22 ILE A 90 -0.967 4.821 -0.316 1.00 0.00 H new ATOM 0 HG23 ILE A 90 -1.607 3.710 -1.551 1.00 0.00 H new ATOM 0 HD11 ILE A 90 -5.271 5.315 -2.885 1.00 0.00 H new ATOM 0 HD12 ILE A 90 -4.623 6.442 -1.670 1.00 0.00 H new ATOM 0 HD13 ILE A 90 -3.522 5.636 -2.812 1.00 0.00 H new ATOM 1469 N ASP A 91 -0.888 3.022 1.741 1.00 0.00 N ATOM 1470 CA ASP A 91 0.186 3.197 2.711 1.00 0.00 C ATOM 1471 C ASP A 91 0.951 4.495 2.457 1.00 0.00 C ATOM 1472 O ASP A 91 1.130 4.904 1.312 1.00 0.00 O ATOM 1473 CB ASP A 91 1.128 1.996 2.657 1.00 0.00 C ATOM 1474 CG ASP A 91 2.415 2.222 3.420 1.00 0.00 C ATOM 1475 OD1 ASP A 91 2.364 2.375 4.657 1.00 0.00 O ATOM 1476 OD2 ASP A 91 3.484 2.233 2.781 1.00 0.00 O ATOM 0 H ASP A 91 -0.688 2.341 1.009 1.00 0.00 H new ATOM 0 HA ASP A 91 -0.251 3.262 3.707 1.00 0.00 H new ATOM 0 HB2 ASP A 91 0.619 1.123 3.064 1.00 0.00 H new ATOM 0 HB3 ASP A 91 1.363 1.772 1.617 1.00 0.00 H new ATOM 1481 N LEU A 92 1.405 5.133 3.531 1.00 0.00 N ATOM 1482 CA LEU A 92 2.078 6.426 3.435 1.00 0.00 C ATOM 1483 C LEU A 92 3.408 6.316 2.690 1.00 0.00 C ATOM 1484 O LEU A 92 3.731 7.169 1.861 1.00 0.00 O ATOM 1485 CB LEU A 92 2.292 7.013 4.831 1.00 0.00 C ATOM 1486 CG LEU A 92 1.007 7.320 5.604 1.00 0.00 C ATOM 1487 CD1 LEU A 92 1.334 7.821 7.001 1.00 0.00 C ATOM 1488 CD2 LEU A 92 0.162 8.344 4.858 1.00 0.00 C ATOM 0 H LEU A 92 1.319 4.775 4.482 1.00 0.00 H new ATOM 0 HA LEU A 92 1.437 7.095 2.862 1.00 0.00 H new ATOM 0 HB2 LEU A 92 2.892 6.315 5.415 1.00 0.00 H new ATOM 0 HB3 LEU A 92 2.871 7.932 4.738 1.00 0.00 H new ATOM 0 HG LEU A 92 0.432 6.398 5.691 1.00 0.00 H new ATOM 0 HD11 LEU A 92 0.409 8.034 7.537 1.00 0.00 H new ATOM 0 HD12 LEU A 92 1.897 7.058 7.539 1.00 0.00 H new ATOM 0 HD13 LEU A 92 1.931 8.730 6.931 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -0.747 8.548 5.424 1.00 0.00 H new ATOM 0 HD22 LEU A 92 0.730 9.267 4.738 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -0.103 7.951 3.876 1.00 0.00 H new ATOM 1500 N ASP A 93 4.175 5.270 2.979 1.00 0.00 N ATOM 1501 CA ASP A 93 5.433 5.027 2.271 1.00 0.00 C ATOM 1502 C ASP A 93 5.151 4.761 0.795 1.00 0.00 C ATOM 1503 O ASP A 93 5.874 5.229 -0.088 1.00 0.00 O ATOM 1504 CB ASP A 93 6.184 3.847 2.896 1.00 0.00 C ATOM 1505 CG ASP A 93 7.483 3.529 2.179 1.00 0.00 C ATOM 1506 OD1 ASP A 93 8.391 4.387 2.177 1.00 0.00 O ATOM 1507 OD2 ASP A 93 7.609 2.411 1.629 1.00 0.00 O ATOM 0 H ASP A 93 3.952 4.578 3.695 1.00 0.00 H new ATOM 0 HA ASP A 93 6.063 5.912 2.357 1.00 0.00 H new ATOM 0 HB2 ASP A 93 6.397 4.071 3.941 1.00 0.00 H new ATOM 0 HB3 ASP A 93 5.542 2.966 2.883 1.00 0.00 H new ATOM 1512 N SER A 94 4.080 4.017 0.543 1.00 0.00 N ATOM 1513 CA SER A 94 3.583 3.786 -0.802 1.00 0.00 C ATOM 1514 C SER A 94 3.311 5.119 -1.510 1.00 0.00 C ATOM 1515 O SER A 94 3.755 5.334 -2.642 1.00 0.00 O ATOM 1516 CB SER A 94 2.305 2.947 -0.719 1.00 0.00 C ATOM 1517 OG SER A 94 1.823 2.588 -1.995 1.00 0.00 O ATOM 0 H SER A 94 3.532 3.557 1.270 1.00 0.00 H new ATOM 0 HA SER A 94 4.333 3.248 -1.383 1.00 0.00 H new ATOM 0 HB2 SER A 94 2.501 2.045 -0.139 1.00 0.00 H new ATOM 0 HB3 SER A 94 1.537 3.508 -0.186 1.00 0.00 H new ATOM 0 HG SER A 94 0.846 2.514 -1.967 1.00 0.00 H new ATOM 1523 N ILE A 95 2.600 6.016 -0.823 1.00 0.00 N ATOM 1524 CA ILE A 95 2.297 7.345 -1.354 1.00 0.00 C ATOM 1525 C ILE A 95 3.584 8.100 -1.676 1.00 0.00 C ATOM 1526 O ILE A 95 3.704 8.723 -2.735 1.00 0.00 O ATOM 1527 CB ILE A 95 1.454 8.179 -0.360 1.00 0.00 C ATOM 1528 CG1 ILE A 95 0.127 7.475 -0.064 1.00 0.00 C ATOM 1529 CG2 ILE A 95 1.202 9.580 -0.908 1.00 0.00 C ATOM 1530 CD1 ILE A 95 -0.728 8.190 0.959 1.00 0.00 C ATOM 0 H ILE A 95 2.222 5.843 0.108 1.00 0.00 H new ATOM 0 HA ILE A 95 1.717 7.201 -2.266 1.00 0.00 H new ATOM 0 HB ILE A 95 2.015 8.271 0.570 1.00 0.00 H new ATOM 0 HG12 ILE A 95 -0.437 7.378 -0.992 1.00 0.00 H new ATOM 0 HG13 ILE A 95 0.333 6.465 0.290 1.00 0.00 H new ATOM 0 HG21 ILE A 95 0.608 10.149 -0.193 1.00 0.00 H new ATOM 0 HG22 ILE A 95 2.155 10.084 -1.070 1.00 0.00 H new ATOM 0 HG23 ILE A 95 0.663 9.510 -1.853 1.00 0.00 H new ATOM 0 HD11 ILE A 95 -1.651 7.632 1.116 1.00 0.00 H new ATOM 0 HD12 ILE A 95 -0.184 8.263 1.901 1.00 0.00 H new ATOM 0 HD13 ILE A 95 -0.966 9.191 0.599 1.00 0.00 H new ATOM 1542 N SER A 96 4.543 8.030 -0.759 1.00 0.00 N ATOM 1543 CA SER A 96 5.838 8.672 -0.943 1.00 0.00 C ATOM 1544 C SER A 96 6.503 8.189 -2.231 1.00 0.00 C ATOM 1545 O SER A 96 7.014 8.991 -3.012 1.00 0.00 O ATOM 1546 CB SER A 96 6.747 8.396 0.262 1.00 0.00 C ATOM 1547 OG SER A 96 8.017 9.012 0.106 1.00 0.00 O ATOM 0 H SER A 96 4.446 7.531 0.125 1.00 0.00 H new ATOM 0 HA SER A 96 5.679 9.747 -1.022 1.00 0.00 H new ATOM 0 HB2 SER A 96 6.271 8.765 1.170 1.00 0.00 H new ATOM 0 HB3 SER A 96 6.875 7.320 0.384 1.00 0.00 H new ATOM 0 HG SER A 96 8.573 8.819 0.890 1.00 0.00 H new ATOM 1553 N HIS A 97 6.478 6.879 -2.455 1.00 0.00 N ATOM 1554 CA HIS A 97 7.067 6.302 -3.659 1.00 0.00 C ATOM 1555 C HIS A 97 6.340 6.797 -4.901 1.00 0.00 C ATOM 1556 O HIS A 97 6.962 7.274 -5.847 1.00 0.00 O ATOM 1557 CB HIS A 97 7.016 4.770 -3.628 1.00 0.00 C ATOM 1558 CG HIS A 97 7.783 4.142 -2.507 1.00 0.00 C ATOM 1559 ND1 HIS A 97 9.029 4.567 -2.109 1.00 0.00 N ATOM 1560 CD2 HIS A 97 7.465 3.110 -1.693 1.00 0.00 C ATOM 1561 CE1 HIS A 97 9.443 3.822 -1.104 1.00 0.00 C ATOM 1562 NE2 HIS A 97 8.512 2.931 -0.828 1.00 0.00 N ATOM 0 H HIS A 97 6.058 6.199 -1.821 1.00 0.00 H new ATOM 0 HA HIS A 97 8.109 6.619 -3.692 1.00 0.00 H new ATOM 0 HB2 HIS A 97 5.975 4.456 -3.558 1.00 0.00 H new ATOM 0 HB3 HIS A 97 7.402 4.388 -4.573 1.00 0.00 H new ATOM 0 HD2 HIS A 97 6.553 2.533 -1.720 1.00 0.00 H new ATOM 0 HE1 HIS A 97 10.388 3.925 -0.592 1.00 0.00 H new ATOM 0 HE2 HIS A 97 8.563 2.226 -0.093 1.00 0.00 H new ATOM 1571 N LEU A 98 5.019 6.700 -4.873 1.00 0.00 N ATOM 1572 CA LEU A 98 4.197 7.008 -6.034 1.00 0.00 C ATOM 1573 C LEU A 98 4.289 8.482 -6.424 1.00 0.00 C ATOM 1574 O LEU A 98 4.624 8.806 -7.564 1.00 0.00 O ATOM 1575 CB LEU A 98 2.742 6.628 -5.754 1.00 0.00 C ATOM 1576 CG LEU A 98 1.781 6.809 -6.932 1.00 0.00 C ATOM 1577 CD1 LEU A 98 2.171 5.907 -8.091 1.00 0.00 C ATOM 1578 CD2 LEU A 98 0.353 6.522 -6.498 1.00 0.00 C ATOM 0 H LEU A 98 4.490 6.408 -4.051 1.00 0.00 H new ATOM 0 HA LEU A 98 4.574 6.424 -6.873 1.00 0.00 H new ATOM 0 HB2 LEU A 98 2.710 5.585 -5.437 1.00 0.00 H new ATOM 0 HB3 LEU A 98 2.382 7.226 -4.917 1.00 0.00 H new ATOM 0 HG LEU A 98 1.844 7.844 -7.268 1.00 0.00 H new ATOM 0 HD11 LEU A 98 1.474 6.053 -8.916 1.00 0.00 H new ATOM 0 HD12 LEU A 98 3.180 6.154 -8.420 1.00 0.00 H new ATOM 0 HD13 LEU A 98 2.139 4.866 -7.769 1.00 0.00 H new ATOM 0 HD21 LEU A 98 -0.319 6.655 -7.346 1.00 0.00 H new ATOM 0 HD22 LEU A 98 0.282 5.496 -6.136 1.00 0.00 H new ATOM 0 HD23 LEU A 98 0.070 7.209 -5.700 1.00 0.00 H new ATOM 1590 N ARG A 99 4.011 9.375 -5.480 1.00 0.00 N ATOM 1591 CA ARG A 99 3.934 10.799 -5.792 1.00 0.00 C ATOM 1592 C ARG A 99 5.303 11.366 -6.153 1.00 0.00 C ATOM 1593 O ARG A 99 5.416 12.208 -7.044 1.00 0.00 O ATOM 1594 CB ARG A 99 3.321 11.587 -4.629 1.00 0.00 C ATOM 1595 CG ARG A 99 2.937 13.008 -5.016 1.00 0.00 C ATOM 1596 CD ARG A 99 2.155 13.719 -3.923 1.00 0.00 C ATOM 1597 NE ARG A 99 2.992 14.111 -2.788 1.00 0.00 N ATOM 1598 CZ ARG A 99 2.770 15.205 -2.056 1.00 0.00 C ATOM 1599 NH1 ARG A 99 1.772 16.025 -2.369 1.00 0.00 N ATOM 1600 NH2 ARG A 99 3.556 15.490 -1.023 1.00 0.00 N ATOM 0 H ARG A 99 3.837 9.142 -4.502 1.00 0.00 H new ATOM 0 HA ARG A 99 3.284 10.905 -6.661 1.00 0.00 H new ATOM 0 HB2 ARG A 99 2.437 11.062 -4.267 1.00 0.00 H new ATOM 0 HB3 ARG A 99 4.032 11.620 -3.804 1.00 0.00 H new ATOM 0 HG2 ARG A 99 3.840 13.576 -5.241 1.00 0.00 H new ATOM 0 HG3 ARG A 99 2.340 12.984 -5.928 1.00 0.00 H new ATOM 0 HD2 ARG A 99 1.680 14.606 -4.341 1.00 0.00 H new ATOM 0 HD3 ARG A 99 1.356 13.066 -3.571 1.00 0.00 H new ATOM 0 HE ARG A 99 3.785 13.518 -2.544 1.00 0.00 H new ATOM 0 HH11 ARG A 99 1.174 15.819 -3.169 1.00 0.00 H new ATOM 0 HH12 ARG A 99 1.604 16.861 -1.809 1.00 0.00 H new ATOM 0 HH21 ARG A 99 4.332 14.872 -0.787 1.00 0.00 H new ATOM 0 HH22 ARG A 99 3.383 16.327 -0.466 1.00 0.00 H new ATOM 1614 N ARG A 100 6.348 10.892 -5.484 1.00 0.00 N ATOM 1615 CA ARG A 100 7.694 11.374 -5.762 1.00 0.00 C ATOM 1616 C ARG A 100 8.166 10.874 -7.125 1.00 0.00 C ATOM 1617 O ARG A 100 8.940 11.546 -7.809 1.00 0.00 O ATOM 1618 CB ARG A 100 8.667 10.951 -4.655 1.00 0.00 C ATOM 1619 CG ARG A 100 10.077 11.490 -4.845 1.00 0.00 C ATOM 1620 CD ARG A 100 10.918 11.343 -3.584 1.00 0.00 C ATOM 1621 NE ARG A 100 11.019 9.957 -3.125 1.00 0.00 N ATOM 1622 CZ ARG A 100 12.123 9.219 -3.226 1.00 0.00 C ATOM 1623 NH1 ARG A 100 13.186 9.687 -3.874 1.00 0.00 N ATOM 1624 NH2 ARG A 100 12.157 8.005 -2.691 1.00 0.00 N ATOM 0 H ARG A 100 6.290 10.182 -4.753 1.00 0.00 H new ATOM 0 HA ARG A 100 7.671 12.464 -5.785 1.00 0.00 H new ATOM 0 HB2 ARG A 100 8.282 11.294 -3.694 1.00 0.00 H new ATOM 0 HB3 ARG A 100 8.706 9.862 -4.613 1.00 0.00 H new ATOM 0 HG2 ARG A 100 10.560 10.961 -5.667 1.00 0.00 H new ATOM 0 HG3 ARG A 100 10.028 12.542 -5.128 1.00 0.00 H new ATOM 0 HD2 ARG A 100 11.919 11.731 -3.773 1.00 0.00 H new ATOM 0 HD3 ARG A 100 10.484 11.952 -2.791 1.00 0.00 H new ATOM 0 HE ARG A 100 10.194 9.531 -2.702 1.00 0.00 H new ATOM 0 HH11 ARG A 100 13.158 10.615 -4.296 1.00 0.00 H new ATOM 0 HH12 ARG A 100 14.029 9.118 -3.949 1.00 0.00 H new ATOM 0 HH21 ARG A 100 11.339 7.639 -2.204 1.00 0.00 H new ATOM 0 HH22 ARG A 100 13.001 7.438 -2.767 1.00 0.00 H new ATOM 1638 N LEU A 101 7.679 9.707 -7.529 1.00 0.00 N ATOM 1639 CA LEU A 101 7.983 9.168 -8.847 1.00 0.00 C ATOM 1640 C LEU A 101 7.398 10.073 -9.928 1.00 0.00 C ATOM 1641 O LEU A 101 8.032 10.332 -10.952 1.00 0.00 O ATOM 1642 CB LEU A 101 7.428 7.746 -8.983 1.00 0.00 C ATOM 1643 CG LEU A 101 7.747 7.035 -10.303 1.00 0.00 C ATOM 1644 CD1 LEU A 101 9.246 6.865 -10.475 1.00 0.00 C ATOM 1645 CD2 LEU A 101 7.055 5.683 -10.356 1.00 0.00 C ATOM 0 H LEU A 101 7.071 9.116 -6.962 1.00 0.00 H new ATOM 0 HA LEU A 101 9.065 9.128 -8.970 1.00 0.00 H new ATOM 0 HB2 LEU A 101 7.817 7.143 -8.163 1.00 0.00 H new ATOM 0 HB3 LEU A 101 6.345 7.785 -8.864 1.00 0.00 H new ATOM 0 HG LEU A 101 7.375 7.652 -11.121 1.00 0.00 H new ATOM 0 HD11 LEU A 101 9.449 6.358 -11.418 1.00 0.00 H new ATOM 0 HD12 LEU A 101 9.725 7.844 -10.479 1.00 0.00 H new ATOM 0 HD13 LEU A 101 9.642 6.271 -9.651 1.00 0.00 H new ATOM 0 HD21 LEU A 101 7.291 5.190 -11.299 1.00 0.00 H new ATOM 0 HD22 LEU A 101 7.400 5.065 -9.527 1.00 0.00 H new ATOM 0 HD23 LEU A 101 5.977 5.823 -10.280 1.00 0.00 H new ATOM 1657 N VAL A 102 6.190 10.565 -9.683 1.00 0.00 N ATOM 1658 CA VAL A 102 5.539 11.494 -10.597 1.00 0.00 C ATOM 1659 C VAL A 102 6.318 12.804 -10.663 1.00 0.00 C ATOM 1660 O VAL A 102 6.509 13.368 -11.742 1.00 0.00 O ATOM 1661 CB VAL A 102 4.080 11.769 -10.172 1.00 0.00 C ATOM 1662 CG1 VAL A 102 3.402 12.733 -11.133 1.00 0.00 C ATOM 1663 CG2 VAL A 102 3.301 10.467 -10.090 1.00 0.00 C ATOM 0 H VAL A 102 5.640 10.335 -8.856 1.00 0.00 H new ATOM 0 HA VAL A 102 5.524 11.035 -11.586 1.00 0.00 H new ATOM 0 HB VAL A 102 4.096 12.233 -9.186 1.00 0.00 H new ATOM 0 HG11 VAL A 102 2.376 12.908 -10.809 1.00 0.00 H new ATOM 0 HG12 VAL A 102 3.945 13.678 -11.144 1.00 0.00 H new ATOM 0 HG13 VAL A 102 3.398 12.305 -12.135 1.00 0.00 H new ATOM 0 HG21 VAL A 102 2.274 10.676 -9.789 1.00 0.00 H new ATOM 0 HG22 VAL A 102 3.302 9.980 -11.065 1.00 0.00 H new ATOM 0 HG23 VAL A 102 3.767 9.810 -9.356 1.00 0.00 H new ATOM 1673 N GLU A 103 6.777 13.266 -9.502 1.00 0.00 N ATOM 1674 CA GLU A 103 7.632 14.449 -9.411 1.00 0.00 C ATOM 1675 C GLU A 103 8.879 14.284 -10.283 1.00 0.00 C ATOM 1676 O GLU A 103 9.203 15.150 -11.094 1.00 0.00 O ATOM 1677 CB GLU A 103 8.041 14.681 -7.951 1.00 0.00 C ATOM 1678 CG GLU A 103 9.102 15.756 -7.758 1.00 0.00 C ATOM 1679 CD GLU A 103 8.590 17.158 -8.018 1.00 0.00 C ATOM 1680 OE1 GLU A 103 8.605 17.596 -9.183 1.00 0.00 O ATOM 1681 OE2 GLU A 103 8.188 17.837 -7.048 1.00 0.00 O ATOM 0 H GLU A 103 6.569 12.834 -8.602 1.00 0.00 H new ATOM 0 HA GLU A 103 7.072 15.312 -9.772 1.00 0.00 H new ATOM 0 HB2 GLU A 103 7.155 14.955 -7.377 1.00 0.00 H new ATOM 0 HB3 GLU A 103 8.412 13.743 -7.537 1.00 0.00 H new ATOM 0 HG2 GLU A 103 9.485 15.700 -6.739 1.00 0.00 H new ATOM 0 HG3 GLU A 103 9.940 15.553 -8.425 1.00 0.00 H new ATOM 1688 N LEU A 104 9.560 13.152 -10.118 1.00 0.00 N ATOM 1689 CA LEU A 104 10.794 12.869 -10.851 1.00 0.00 C ATOM 1690 C LEU A 104 10.566 12.842 -12.362 1.00 0.00 C ATOM 1691 O LEU A 104 11.462 13.172 -13.139 1.00 0.00 O ATOM 1692 CB LEU A 104 11.385 11.531 -10.398 1.00 0.00 C ATOM 1693 CG LEU A 104 11.843 11.479 -8.939 1.00 0.00 C ATOM 1694 CD1 LEU A 104 12.348 10.087 -8.593 1.00 0.00 C ATOM 1695 CD2 LEU A 104 12.925 12.520 -8.680 1.00 0.00 C ATOM 0 H LEU A 104 9.276 12.410 -9.478 1.00 0.00 H new ATOM 0 HA LEU A 104 11.494 13.675 -10.630 1.00 0.00 H new ATOM 0 HB2 LEU A 104 10.640 10.751 -10.556 1.00 0.00 H new ATOM 0 HB3 LEU A 104 12.235 11.293 -11.037 1.00 0.00 H new ATOM 0 HG LEU A 104 10.990 11.707 -8.300 1.00 0.00 H new ATOM 0 HD11 LEU A 104 12.670 10.065 -7.552 1.00 0.00 H new ATOM 0 HD12 LEU A 104 11.547 9.362 -8.740 1.00 0.00 H new ATOM 0 HD13 LEU A 104 13.189 9.834 -9.239 1.00 0.00 H new ATOM 0 HD21 LEU A 104 13.238 12.468 -7.637 1.00 0.00 H new ATOM 0 HD22 LEU A 104 13.781 12.324 -9.326 1.00 0.00 H new ATOM 0 HD23 LEU A 104 12.531 13.514 -8.891 1.00 0.00 H new ATOM 1707 N ASN A 105 9.368 12.448 -12.770 1.00 0.00 N ATOM 1708 CA ASN A 105 9.037 12.352 -14.189 1.00 0.00 C ATOM 1709 C ASN A 105 8.418 13.647 -14.705 1.00 0.00 C ATOM 1710 O ASN A 105 8.366 13.876 -15.915 1.00 0.00 O ATOM 1711 CB ASN A 105 8.080 11.180 -14.446 1.00 0.00 C ATOM 1712 CG ASN A 105 8.780 9.831 -14.439 1.00 0.00 C ATOM 1713 OD1 ASN A 105 9.237 9.355 -15.475 1.00 0.00 O ATOM 1714 ND2 ASN A 105 8.867 9.204 -13.276 1.00 0.00 N ATOM 0 H ASN A 105 8.608 12.189 -12.141 1.00 0.00 H new ATOM 0 HA ASN A 105 9.967 12.177 -14.729 1.00 0.00 H new ATOM 0 HB2 ASN A 105 7.299 11.182 -13.686 1.00 0.00 H new ATOM 0 HB3 ASN A 105 7.588 11.323 -15.408 1.00 0.00 H new ATOM 0 HD21 ASN A 105 9.325 8.295 -13.220 1.00 0.00 H new ATOM 0 HD22 ASN A 105 8.476 9.630 -12.436 1.00 0.00 H new ATOM 1721 N LEU A 106 7.965 14.493 -13.774 1.00 0.00 N ATOM 1722 CA LEU A 106 7.274 15.740 -14.109 1.00 0.00 C ATOM 1723 C LEU A 106 6.061 15.457 -14.990 1.00 0.00 C ATOM 1724 O LEU A 106 5.745 16.219 -15.903 1.00 0.00 O ATOM 1725 CB LEU A 106 8.214 16.736 -14.803 1.00 0.00 C ATOM 1726 CG LEU A 106 9.363 17.271 -13.943 1.00 0.00 C ATOM 1727 CD1 LEU A 106 10.519 16.284 -13.901 1.00 0.00 C ATOM 1728 CD2 LEU A 106 9.826 18.621 -14.460 1.00 0.00 C ATOM 0 H LEU A 106 8.067 14.333 -12.772 1.00 0.00 H new ATOM 0 HA LEU A 106 6.937 16.192 -13.176 1.00 0.00 H new ATOM 0 HB2 LEU A 106 8.637 16.255 -15.685 1.00 0.00 H new ATOM 0 HB3 LEU A 106 7.623 17.582 -15.155 1.00 0.00 H new ATOM 0 HG LEU A 106 8.996 17.398 -12.925 1.00 0.00 H new ATOM 0 HD11 LEU A 106 11.321 16.689 -13.284 1.00 0.00 H new ATOM 0 HD12 LEU A 106 10.176 15.340 -13.477 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.890 16.114 -14.912 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.643 18.988 -13.838 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.171 18.518 -15.489 1.00 0.00 H new ATOM 0 HD23 LEU A 106 8.997 19.328 -14.424 1.00 0.00 H new ATOM 1740 N GLY A 107 5.363 14.371 -14.676 1.00 0.00 N ATOM 1741 CA GLY A 107 4.253 13.935 -15.500 1.00 0.00 C ATOM 1742 C GLY A 107 2.925 14.527 -15.078 1.00 0.00 C ATOM 1743 O GLY A 107 1.882 13.913 -15.304 1.00 0.00 O ATOM 0 H GLY A 107 5.548 13.784 -13.863 1.00 0.00 H new ATOM 0 HA2 GLY A 107 4.451 14.206 -16.537 1.00 0.00 H new ATOM 0 HA3 GLY A 107 4.187 12.848 -15.462 1.00 0.00 H new ATOM 1747 N ASP A 108 2.973 15.715 -14.463 1.00 0.00 N ATOM 1748 CA ASP A 108 1.769 16.460 -14.060 1.00 0.00 C ATOM 1749 C ASP A 108 1.037 15.786 -12.895 1.00 0.00 C ATOM 1750 O ASP A 108 0.772 14.584 -12.916 1.00 0.00 O ATOM 1751 CB ASP A 108 0.827 16.643 -15.257 1.00 0.00 C ATOM 1752 CG ASP A 108 -0.431 17.403 -14.903 1.00 0.00 C ATOM 1753 OD1 ASP A 108 -0.402 18.655 -14.922 1.00 0.00 O ATOM 1754 OD2 ASP A 108 -1.456 16.762 -14.616 1.00 0.00 O ATOM 0 H ASP A 108 3.846 16.189 -14.230 1.00 0.00 H new ATOM 0 HA ASP A 108 2.094 17.440 -13.712 1.00 0.00 H new ATOM 0 HB2 ASP A 108 1.354 17.172 -16.051 1.00 0.00 H new ATOM 0 HB3 ASP A 108 0.555 15.664 -15.652 1.00 0.00 H new ATOM 1759 N GLU A 109 0.704 16.569 -11.873 1.00 0.00 N ATOM 1760 CA GLU A 109 0.039 16.037 -10.689 1.00 0.00 C ATOM 1761 C GLU A 109 -1.475 16.018 -10.857 1.00 0.00 C ATOM 1762 O GLU A 109 -2.175 15.296 -10.145 1.00 0.00 O ATOM 1763 CB GLU A 109 0.396 16.843 -9.440 1.00 0.00 C ATOM 1764 CG GLU A 109 1.827 16.655 -8.969 1.00 0.00 C ATOM 1765 CD GLU A 109 2.051 17.245 -7.593 1.00 0.00 C ATOM 1766 OE1 GLU A 109 2.267 18.470 -7.492 1.00 0.00 O ATOM 1767 OE2 GLU A 109 1.986 16.492 -6.600 1.00 0.00 O ATOM 0 H GLU A 109 0.884 17.573 -11.841 1.00 0.00 H new ATOM 0 HA GLU A 109 0.393 15.013 -10.567 1.00 0.00 H new ATOM 0 HB2 GLU A 109 0.228 17.901 -9.643 1.00 0.00 H new ATOM 0 HB3 GLU A 109 -0.281 16.561 -8.633 1.00 0.00 H new ATOM 0 HG2 GLU A 109 2.067 15.592 -8.951 1.00 0.00 H new ATOM 0 HG3 GLU A 109 2.508 17.123 -9.680 1.00 0.00 H new ATOM 1774 N GLU A 110 -1.984 16.798 -11.801 1.00 0.00 N ATOM 1775 CA GLU A 110 -3.421 16.844 -12.041 1.00 0.00 C ATOM 1776 C GLU A 110 -3.892 15.540 -12.666 1.00 0.00 C ATOM 1777 O GLU A 110 -5.074 15.213 -12.618 1.00 0.00 O ATOM 1778 CB GLU A 110 -3.815 18.031 -12.927 1.00 0.00 C ATOM 1779 CG GLU A 110 -3.928 19.356 -12.187 1.00 0.00 C ATOM 1780 CD GLU A 110 -2.613 19.829 -11.608 1.00 0.00 C ATOM 1781 OE1 GLU A 110 -2.369 19.590 -10.409 1.00 0.00 O ATOM 1782 OE2 GLU A 110 -1.825 20.454 -12.346 1.00 0.00 O ATOM 0 H GLU A 110 -1.430 17.402 -12.408 1.00 0.00 H new ATOM 0 HA GLU A 110 -3.911 16.978 -11.077 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.078 18.135 -13.723 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.771 17.812 -13.404 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -4.311 20.115 -12.870 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -4.656 19.255 -11.382 1.00 0.00 H new ATOM 1789 N LEU A 111 -2.961 14.787 -13.243 1.00 0.00 N ATOM 1790 CA LEU A 111 -3.276 13.463 -13.747 1.00 0.00 C ATOM 1791 C LEU A 111 -3.568 12.510 -12.591 1.00 0.00 C ATOM 1792 O LEU A 111 -4.276 11.521 -12.754 1.00 0.00 O ATOM 1793 CB LEU A 111 -2.152 12.909 -14.625 1.00 0.00 C ATOM 1794 CG LEU A 111 -1.894 13.683 -15.922 1.00 0.00 C ATOM 1795 CD1 LEU A 111 -0.799 13.010 -16.734 1.00 0.00 C ATOM 1796 CD2 LEU A 111 -3.171 13.794 -16.742 1.00 0.00 C ATOM 0 H LEU A 111 -1.990 15.072 -13.371 1.00 0.00 H new ATOM 0 HA LEU A 111 -4.167 13.550 -14.369 1.00 0.00 H new ATOM 0 HB2 LEU A 111 -1.232 12.893 -14.041 1.00 0.00 H new ATOM 0 HB3 LEU A 111 -2.387 11.875 -14.878 1.00 0.00 H new ATOM 0 HG LEU A 111 -1.564 14.689 -15.662 1.00 0.00 H new ATOM 0 HD11 LEU A 111 -0.629 13.573 -17.652 1.00 0.00 H new ATOM 0 HD12 LEU A 111 0.121 12.981 -16.150 1.00 0.00 H new ATOM 0 HD13 LEU A 111 -1.103 11.993 -16.983 1.00 0.00 H new ATOM 0 HD21 LEU A 111 -2.968 14.347 -17.659 1.00 0.00 H new ATOM 0 HD22 LEU A 111 -3.531 12.796 -16.992 1.00 0.00 H new ATOM 0 HD23 LEU A 111 -3.931 14.319 -16.163 1.00 0.00 H new ATOM 1808 N LEU A 112 -3.045 12.827 -11.419 1.00 0.00 N ATOM 1809 CA LEU A 112 -3.347 12.058 -10.222 1.00 0.00 C ATOM 1810 C LEU A 112 -4.607 12.604 -9.570 1.00 0.00 C ATOM 1811 O LEU A 112 -5.174 11.993 -8.661 1.00 0.00 O ATOM 1812 CB LEU A 112 -2.189 12.121 -9.225 1.00 0.00 C ATOM 1813 CG LEU A 112 -0.869 11.524 -9.708 1.00 0.00 C ATOM 1814 CD1 LEU A 112 0.209 11.707 -8.654 1.00 0.00 C ATOM 1815 CD2 LEU A 112 -1.040 10.048 -10.041 1.00 0.00 C ATOM 0 H LEU A 112 -2.410 13.611 -11.270 1.00 0.00 H new ATOM 0 HA LEU A 112 -3.499 11.018 -10.511 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -2.019 13.164 -8.958 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -2.489 11.604 -8.314 1.00 0.00 H new ATOM 0 HG LEU A 112 -0.564 12.048 -10.614 1.00 0.00 H new ATOM 0 HD11 LEU A 112 1.144 11.277 -9.012 1.00 0.00 H new ATOM 0 HD12 LEU A 112 0.350 12.770 -8.458 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -0.093 11.206 -7.734 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -0.089 9.640 -10.383 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -1.367 9.510 -9.151 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -1.787 9.937 -10.827 1.00 0.00 H new ATOM 1827 N GLU A 113 -5.055 13.749 -10.061 1.00 0.00 N ATOM 1828 CA GLU A 113 -6.160 14.459 -9.447 1.00 0.00 C ATOM 1829 C GLU A 113 -7.300 14.687 -10.445 1.00 0.00 C ATOM 1830 O GLU A 113 -8.040 15.665 -10.346 1.00 0.00 O ATOM 1831 CB GLU A 113 -5.659 15.796 -8.885 1.00 0.00 C ATOM 1832 CG GLU A 113 -6.593 16.421 -7.859 1.00 0.00 C ATOM 1833 CD GLU A 113 -6.785 15.548 -6.637 1.00 0.00 C ATOM 1834 OE1 GLU A 113 -7.663 14.657 -6.667 1.00 0.00 O ATOM 1835 OE2 GLU A 113 -6.073 15.756 -5.635 1.00 0.00 O ATOM 0 H GLU A 113 -4.667 14.206 -10.886 1.00 0.00 H new ATOM 0 HA GLU A 113 -6.555 13.850 -8.634 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -4.682 15.643 -8.427 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -5.519 16.496 -9.709 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -6.194 17.387 -7.551 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -7.562 16.609 -8.322 1.00 0.00 H new ATOM 1842 N ARG A 114 -7.454 13.783 -11.409 1.00 0.00 N ATOM 1843 CA ARG A 114 -8.608 13.847 -12.297 1.00 0.00 C ATOM 1844 C ARG A 114 -9.822 13.300 -11.563 1.00 0.00 C ATOM 1845 O ARG A 114 -10.457 14.008 -10.780 1.00 0.00 O ATOM 1846 CB ARG A 114 -8.379 13.060 -13.595 1.00 0.00 C ATOM 1847 CG ARG A 114 -7.308 13.650 -14.492 1.00 0.00 C ATOM 1848 CD ARG A 114 -6.193 12.654 -14.753 1.00 0.00 C ATOM 1849 NE ARG A 114 -6.601 11.539 -15.609 1.00 0.00 N ATOM 1850 CZ ARG A 114 -5.889 10.422 -15.780 1.00 0.00 C ATOM 1851 NH1 ARG A 114 -4.823 10.172 -15.031 1.00 0.00 N ATOM 1852 NH2 ARG A 114 -6.275 9.529 -16.674 1.00 0.00 N ATOM 0 H ARG A 114 -6.809 13.014 -11.592 1.00 0.00 H new ATOM 0 HA ARG A 114 -8.770 14.888 -12.577 1.00 0.00 H new ATOM 0 HB2 ARG A 114 -8.104 12.036 -13.343 1.00 0.00 H new ATOM 0 HB3 ARG A 114 -9.317 13.012 -14.149 1.00 0.00 H new ATOM 0 HG2 ARG A 114 -7.753 13.957 -15.439 1.00 0.00 H new ATOM 0 HG3 ARG A 114 -6.896 14.546 -14.028 1.00 0.00 H new ATOM 0 HD2 ARG A 114 -5.354 13.172 -15.218 1.00 0.00 H new ATOM 0 HD3 ARG A 114 -5.837 12.261 -13.801 1.00 0.00 H new ATOM 0 HE ARG A 114 -7.487 11.620 -16.108 1.00 0.00 H new ATOM 0 HH11 ARG A 114 -4.537 10.837 -14.313 1.00 0.00 H new ATOM 0 HH12 ARG A 114 -4.289 9.314 -15.173 1.00 0.00 H new ATOM 0 HH21 ARG A 114 -7.114 9.694 -17.230 1.00 0.00 H new ATOM 0 HH22 ARG A 114 -5.734 8.675 -16.808 1.00 0.00 H new ATOM 1866 N GLU A 115 -10.115 12.031 -11.807 1.00 0.00 N ATOM 1867 CA GLU A 115 -11.136 11.296 -11.081 1.00 0.00 C ATOM 1868 C GLU A 115 -11.196 9.903 -11.689 1.00 0.00 C ATOM 1869 O GLU A 115 -10.778 9.731 -12.822 1.00 0.00 O ATOM 1870 CB GLU A 115 -12.501 11.992 -11.203 1.00 0.00 C ATOM 1871 CG GLU A 115 -13.303 12.012 -9.912 1.00 0.00 C ATOM 1872 CD GLU A 115 -13.586 10.627 -9.390 1.00 0.00 C ATOM 1873 OE1 GLU A 115 -12.695 10.057 -8.725 1.00 0.00 O ATOM 1874 OE2 GLU A 115 -14.674 10.095 -9.670 1.00 0.00 O ATOM 0 H GLU A 115 -9.644 11.478 -12.523 1.00 0.00 H new ATOM 0 HA GLU A 115 -10.892 11.249 -10.020 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -12.346 13.018 -11.538 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -13.086 11.490 -11.974 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -12.757 12.577 -9.157 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -14.245 12.533 -10.081 1.00 0.00 H new ATOM 1881 N LEU A 116 -11.707 8.925 -10.962 1.00 0.00 N ATOM 1882 CA LEU A 116 -11.773 7.559 -11.470 1.00 0.00 C ATOM 1883 C LEU A 116 -12.584 7.518 -12.761 1.00 0.00 C ATOM 1884 O LEU A 116 -12.218 6.836 -13.717 1.00 0.00 O ATOM 1885 CB LEU A 116 -12.377 6.621 -10.419 1.00 0.00 C ATOM 1886 CG LEU A 116 -12.449 5.145 -10.820 1.00 0.00 C ATOM 1887 CD1 LEU A 116 -11.055 4.594 -11.096 1.00 0.00 C ATOM 1888 CD2 LEU A 116 -13.143 4.334 -9.733 1.00 0.00 C ATOM 0 H LEU A 116 -12.082 9.047 -10.021 1.00 0.00 H new ATOM 0 HA LEU A 116 -10.761 7.217 -11.685 1.00 0.00 H new ATOM 0 HB2 LEU A 116 -11.791 6.703 -9.504 1.00 0.00 H new ATOM 0 HB3 LEU A 116 -13.384 6.966 -10.185 1.00 0.00 H new ATOM 0 HG LEU A 116 -13.033 5.064 -11.737 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -11.128 3.544 -11.379 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -10.595 5.158 -11.908 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -10.443 4.686 -10.199 1.00 0.00 H new ATOM 0 HD21 LEU A 116 -13.187 3.287 -10.032 1.00 0.00 H new ATOM 0 HD22 LEU A 116 -12.585 4.422 -8.801 1.00 0.00 H new ATOM 0 HD23 LEU A 116 -14.155 4.712 -9.587 1.00 0.00 H new ATOM 1900 N ALA A 117 -13.660 8.297 -12.797 1.00 0.00 N ATOM 1901 CA ALA A 117 -14.499 8.395 -13.987 1.00 0.00 C ATOM 1902 C ALA A 117 -13.827 9.237 -15.073 1.00 0.00 C ATOM 1903 O ALA A 117 -14.286 9.276 -16.214 1.00 0.00 O ATOM 1904 CB ALA A 117 -15.852 8.989 -13.624 1.00 0.00 C ATOM 0 H ALA A 117 -13.973 8.871 -12.014 1.00 0.00 H new ATOM 0 HA ALA A 117 -14.643 7.390 -14.383 1.00 0.00 H new ATOM 0 HB1 ALA A 117 -16.471 9.058 -14.519 1.00 0.00 H new ATOM 0 HB2 ALA A 117 -16.345 8.351 -12.890 1.00 0.00 H new ATOM 0 HB3 ALA A 117 -15.711 9.984 -13.203 1.00 0.00 H new ATOM 1910 N LEU A 118 -12.742 9.908 -14.711 1.00 0.00 N ATOM 1911 CA LEU A 118 -12.000 10.742 -15.649 1.00 0.00 C ATOM 1912 C LEU A 118 -10.716 10.049 -16.090 1.00 0.00 C ATOM 1913 O LEU A 118 -9.938 10.600 -16.872 1.00 0.00 O ATOM 1914 CB LEU A 118 -11.645 12.093 -15.025 1.00 0.00 C ATOM 1915 CG LEU A 118 -12.825 12.991 -14.652 1.00 0.00 C ATOM 1916 CD1 LEU A 118 -12.316 14.313 -14.098 1.00 0.00 C ATOM 1917 CD2 LEU A 118 -13.726 13.226 -15.858 1.00 0.00 C ATOM 0 H LEU A 118 -12.353 9.891 -13.768 1.00 0.00 H new ATOM 0 HA LEU A 118 -12.642 10.905 -16.514 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -11.054 11.912 -14.127 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -11.007 12.636 -15.722 1.00 0.00 H new ATOM 0 HG LEU A 118 -13.415 12.492 -13.883 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -13.162 14.947 -13.835 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -11.712 14.127 -13.210 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -11.708 14.814 -14.852 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -14.559 13.867 -15.570 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -13.154 13.708 -16.651 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -14.110 12.271 -16.217 1.00 0.00 H new ATOM 1929 N LEU A 119 -10.478 8.855 -15.569 1.00 0.00 N ATOM 1930 CA LEU A 119 -9.268 8.125 -15.903 1.00 0.00 C ATOM 1931 C LEU A 119 -9.469 7.240 -17.126 1.00 0.00 C ATOM 1932 O LEU A 119 -10.130 6.205 -17.066 1.00 0.00 O ATOM 1933 CB LEU A 119 -8.777 7.308 -14.706 1.00 0.00 C ATOM 1934 CG LEU A 119 -7.641 7.958 -13.906 1.00 0.00 C ATOM 1935 CD1 LEU A 119 -7.988 9.378 -13.498 1.00 0.00 C ATOM 1936 CD2 LEU A 119 -7.327 7.144 -12.676 1.00 0.00 C ATOM 0 H LEU A 119 -11.101 8.376 -14.919 1.00 0.00 H new ATOM 0 HA LEU A 119 -8.499 8.856 -16.153 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -9.618 7.130 -14.036 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -8.441 6.334 -15.062 1.00 0.00 H new ATOM 0 HG LEU A 119 -6.765 7.990 -14.554 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -7.160 9.807 -12.933 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -8.169 9.979 -14.389 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -8.885 9.370 -12.878 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -6.519 7.620 -12.121 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -8.213 7.082 -12.045 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -7.022 6.140 -12.972 1.00 0.00 H new ATOM 1948 N VAL A 120 -8.921 7.695 -18.243 1.00 0.00 N ATOM 1949 CA VAL A 120 -8.894 6.917 -19.470 1.00 0.00 C ATOM 1950 C VAL A 120 -7.547 6.192 -19.548 1.00 0.00 C ATOM 1951 O VAL A 120 -6.810 6.163 -18.565 1.00 0.00 O ATOM 1952 CB VAL A 120 -9.095 7.830 -20.710 1.00 0.00 C ATOM 1953 CG1 VAL A 120 -9.548 7.029 -21.924 1.00 0.00 C ATOM 1954 CG2 VAL A 120 -10.093 8.939 -20.406 1.00 0.00 C ATOM 0 H VAL A 120 -8.483 8.613 -18.323 1.00 0.00 H new ATOM 0 HA VAL A 120 -9.709 6.193 -19.464 1.00 0.00 H new ATOM 0 HB VAL A 120 -8.131 8.281 -20.946 1.00 0.00 H new ATOM 0 HG11 VAL A 120 -9.679 7.699 -22.774 1.00 0.00 H new ATOM 0 HG12 VAL A 120 -8.795 6.279 -22.166 1.00 0.00 H new ATOM 0 HG13 VAL A 120 -10.494 6.535 -21.702 1.00 0.00 H new ATOM 0 HG21 VAL A 120 -10.219 9.567 -21.288 1.00 0.00 H new ATOM 0 HG22 VAL A 120 -11.053 8.500 -20.133 1.00 0.00 H new ATOM 0 HG23 VAL A 120 -9.723 9.545 -19.579 1.00 0.00 H new ATOM 1964 N SER A 121 -7.209 5.620 -20.691 1.00 0.00 N ATOM 1965 CA SER A 121 -5.953 4.903 -20.831 1.00 0.00 C ATOM 1966 C SER A 121 -4.802 5.883 -21.065 1.00 0.00 C ATOM 1967 O SER A 121 -5.036 7.076 -21.265 1.00 0.00 O ATOM 1968 CB SER A 121 -6.059 3.887 -21.969 1.00 0.00 C ATOM 1969 OG SER A 121 -6.684 4.457 -23.108 1.00 0.00 O ATOM 0 H SER A 121 -7.784 5.638 -21.533 1.00 0.00 H new ATOM 0 HA SER A 121 -5.744 4.362 -19.908 1.00 0.00 H new ATOM 0 HB2 SER A 121 -5.064 3.531 -22.237 1.00 0.00 H new ATOM 0 HB3 SER A 121 -6.628 3.020 -21.634 1.00 0.00 H new ATOM 0 HG SER A 121 -6.247 5.305 -23.331 1.00 0.00 H new ATOM 1975 N ALA A 122 -3.570 5.373 -21.038 1.00 0.00 N ATOM 1976 CA ALA A 122 -2.374 6.196 -21.233 1.00 0.00 C ATOM 1977 C ALA A 122 -2.498 7.058 -22.485 1.00 0.00 C ATOM 1978 O ALA A 122 -2.095 8.224 -22.495 1.00 0.00 O ATOM 1979 CB ALA A 122 -1.142 5.312 -21.314 1.00 0.00 C ATOM 0 H ALA A 122 -3.373 4.385 -20.881 1.00 0.00 H new ATOM 0 HA ALA A 122 -2.274 6.864 -20.378 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -0.258 5.933 -21.459 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -1.040 4.745 -20.389 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -1.243 4.623 -22.152 1.00 0.00 H new ATOM 1985 N HIS A 123 -3.054 6.474 -23.537 1.00 0.00 N ATOM 1986 CA HIS A 123 -3.420 7.236 -24.718 1.00 0.00 C ATOM 1987 C HIS A 123 -4.926 7.472 -24.717 1.00 0.00 C ATOM 1988 O HIS A 123 -5.687 6.639 -24.227 1.00 0.00 O ATOM 1989 CB HIS A 123 -2.967 6.534 -26.020 1.00 0.00 C ATOM 1990 CG HIS A 123 -3.461 5.122 -26.222 1.00 0.00 C ATOM 1991 ND1 HIS A 123 -4.602 4.502 -25.832 1.00 0.00 N flip ATOM 1992 CD2 HIS A 123 -2.742 4.170 -26.921 1.00 0.00 C flip ATOM 1993 CE1 HIS A 123 -4.551 3.215 -26.301 1.00 0.00 C flip ATOM 1994 NE2 HIS A 123 -3.422 3.039 -26.953 1.00 0.00 N flip ATOM 0 H HIS A 123 -3.260 5.477 -23.595 1.00 0.00 H new ATOM 0 HA HIS A 123 -2.904 8.195 -24.686 1.00 0.00 H new ATOM 0 HB2 HIS A 123 -3.296 7.137 -26.867 1.00 0.00 H new ATOM 0 HB3 HIS A 123 -1.877 6.522 -26.042 1.00 0.00 H new ATOM 0 HD1 HIS A 123 -5.359 4.917 -25.289 1.00 0.00 H new ATOM 0 HD2 HIS A 123 -1.773 4.327 -27.371 1.00 0.00 H new ATOM 0 HE1 HIS A 123 -5.315 2.465 -26.158 1.00 0.00 H new ATOM 2003 N ASP A 124 -5.356 8.605 -25.234 1.00 0.00 N ATOM 2004 CA ASP A 124 -6.779 8.907 -25.299 1.00 0.00 C ATOM 2005 C ASP A 124 -7.261 8.801 -26.736 1.00 0.00 C ATOM 2006 O ASP A 124 -6.819 9.552 -27.610 1.00 0.00 O ATOM 2007 CB ASP A 124 -7.065 10.296 -24.722 1.00 0.00 C ATOM 2008 CG ASP A 124 -8.511 10.724 -24.893 1.00 0.00 C ATOM 2009 OD1 ASP A 124 -8.806 11.476 -25.848 1.00 0.00 O ATOM 2010 OD2 ASP A 124 -9.357 10.331 -24.064 1.00 0.00 O ATOM 0 H ASP A 124 -4.748 9.330 -25.614 1.00 0.00 H new ATOM 0 HA ASP A 124 -7.324 8.181 -24.695 1.00 0.00 H new ATOM 0 HB2 ASP A 124 -6.813 10.301 -23.661 1.00 0.00 H new ATOM 0 HB3 ASP A 124 -6.416 11.025 -25.207 1.00 0.00 H new ATOM 2015 N ASP A 125 -8.142 7.848 -26.980 1.00 0.00 N ATOM 2016 CA ASP A 125 -8.624 7.581 -28.326 1.00 0.00 C ATOM 2017 C ASP A 125 -10.052 8.073 -28.478 1.00 0.00 C ATOM 2018 O ASP A 125 -10.966 7.413 -27.943 1.00 0.00 O ATOM 2019 CB ASP A 125 -8.540 6.083 -28.635 1.00 0.00 C ATOM 2020 CG ASP A 125 -8.929 5.759 -30.062 1.00 0.00 C ATOM 2021 OD1 ASP A 125 -8.117 6.017 -30.973 1.00 0.00 O ATOM 2022 OD2 ASP A 125 -10.037 5.226 -30.284 1.00 0.00 O ATOM 0 H ASP A 125 -8.540 7.243 -26.262 1.00 0.00 H new ATOM 0 HA ASP A 125 -7.993 8.116 -29.036 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -7.524 5.735 -28.452 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -9.192 5.538 -27.952 1.00 0.00 H new TER 2027 ASP A 125