USER MOD reduce.3.24.130724 H: found=0, std=0, add=1374, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 1367 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 81 HIS : no HE2:sc= -0.64 K(o=-1.1,f=-5.7!) USER MOD Set 1.2: B 91 GLN : amide:sc= -0.432 K(o=-1.1,f=-4.9!) USER MOD Set 2.1: A 91 GLN : amide:sc= -0.905 K(o=-2.3,f=-5.3) USER MOD Set 2.2: B 81 HIS : no HD1:sc= -1.44 K(o=-2.3,f=-4.9) USER MOD Set 3.1: A 102 CYS SG : rot -49:sc= 0.421 USER MOD Set 3.2: B 57 CYS SG : rot 140:sc= 0.616 USER MOD Set 3.3: B 61 CYS SG : rot 113:sc= 1.22 USER MOD Set 4.1: B 47 THR OG1 : rot -97:sc= 1.5 USER MOD Set 4.2: B 50 ASN : amide:sc= 0.933 K(o=2.4,f=-4.2!) USER MOD Set 5.1: A 39 GLN : amide:sc= -0.0505 K(o=0.38,f=-1) USER MOD Set 5.2: A 75 TYR OH : rot 150:sc= 0.428 USER MOD Set 6.1: A 57 CYS SG : rot 16:sc= 0.0903 USER MOD Set 6.2: A 61 CYS SG : rot 86:sc= 0.0903 USER MOD Set 7.1: A 47 THR OG1 : rot -81:sc= 1.19 USER MOD Set 7.2: A 50 ASN : amide:sc= 1.06 K(o=2.3,f=1.3) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 24 CYS SG : rot -26:sc= 0.0528 USER MOD Single : A 35 CYS SG : rot 43:sc= 0.375 USER MOD Single : A 36 TYR OH : rot 180:sc= 0 USER MOD Single : A 43 HIS : no HD1:sc= 0.459 K(o=0.46,f=-2.2!) USER MOD Single : A 49 SER OG : rot 180:sc= 0 USER MOD Single : A 52 SER OG : rot 105:sc= 1.25 USER MOD Single : A 53 ASN : amide:sc= 0 K(o=0,f=-0.69) USER MOD Single : A 54 HIS : no HD1:sc=-0.00229 K(o=-0.0023,f=-0.76) USER MOD Single : A 56 SER OG : rot 180:sc= 0 USER MOD Single : A 67 THR OG1 : rot 180:sc= 0 USER MOD Single : A 68 TYR OH : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0.848 K(o=0.85,f=-7.9!) USER MOD Single : A 80 SER OG : rot 80:sc= 1.19 USER MOD Single : A 98 THR OG1 : rot -77:sc= 1.54 USER MOD Single : A 100 GLN : amide:sc= -0.616 K(o=-0.62,f=-1.9!) USER MOD Single : B 22 THR OG1 : rot 180:sc= 0.0303 USER MOD Single : B 24 CYS SG : rot 180:sc= 0 USER MOD Single : B 35 CYS SG : rot 49:sc= 0.52 USER MOD Single : B 36 TYR OH : rot 180:sc= 0 USER MOD Single : B 39 GLN : amide:sc= -0.632 K(o=-0.63,f=-1.7) USER MOD Single : B 43 HIS : no HD1:sc= 0.243 K(o=0.24,f=-2!) USER MOD Single : B 49 SER OG : rot 180:sc= 0.004 USER MOD Single : B 52 SER OG : rot 78:sc= 0.189 USER MOD Single : B 53 ASN : amide:sc= 0 X(o=0,f=-0.37) USER MOD Single : B 54 HIS : no HD1:sc= -1.03 K(o=-1,f=-2.5) USER MOD Single : B 56 SER OG : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 4:sc= 0.433 USER MOD Single : B 68 TYR OH : rot 180:sc= 0 USER MOD Single : B 72 GLN : amide:sc= 0.91 K(o=0.91,f=-8!) USER MOD Single : B 75 TYR OH : rot 180:sc= 0 USER MOD Single : B 80 SER OG : rot 79:sc= 1.1 USER MOD ----------------------------------------------------------------- ATOM 11 N LEU A 11 6.803 -2.182 -8.558 1.00 0.00 N ATOM 12 CA LEU A 11 5.628 -2.986 -8.126 1.00 0.00 C ATOM 13 C LEU A 11 5.758 -3.750 -6.791 1.00 0.00 C ATOM 14 O LEU A 11 5.432 -3.193 -5.740 1.00 0.00 O ATOM 15 CB LEU A 11 5.179 -3.884 -9.304 1.00 0.00 C ATOM 16 CG LEU A 11 4.012 -4.871 -9.063 1.00 0.00 C ATOM 17 CD1 LEU A 11 2.718 -4.186 -8.603 1.00 0.00 C ATOM 18 CD2 LEU A 11 3.734 -5.661 -10.346 1.00 0.00 C ATOM 0 HA LEU A 11 4.846 -2.269 -7.876 1.00 0.00 H new ATOM 0 HB2 LEU A 11 4.900 -3.233 -10.132 1.00 0.00 H new ATOM 0 HB3 LEU A 11 6.043 -4.462 -9.631 1.00 0.00 H new ATOM 0 HG LEU A 11 4.327 -5.533 -8.256 1.00 0.00 H new ATOM 0 HD11 LEU A 11 1.942 -4.937 -8.453 1.00 0.00 H new ATOM 0 HD12 LEU A 11 2.899 -3.659 -7.666 1.00 0.00 H new ATOM 0 HD13 LEU A 11 2.393 -3.475 -9.363 1.00 0.00 H new ATOM 0 HD21 LEU A 11 2.912 -6.356 -10.175 1.00 0.00 H new ATOM 0 HD22 LEU A 11 3.466 -4.972 -11.147 1.00 0.00 H new ATOM 0 HD23 LEU A 11 4.626 -6.218 -10.631 1.00 0.00 H new ATOM 30 N ALA A 12 6.195 -5.012 -6.800 1.00 0.00 N ATOM 31 CA ALA A 12 6.141 -5.889 -5.632 1.00 0.00 C ATOM 32 C ALA A 12 7.200 -5.507 -4.595 1.00 0.00 C ATOM 33 O ALA A 12 6.907 -5.530 -3.397 1.00 0.00 O ATOM 34 CB ALA A 12 6.269 -7.350 -6.084 1.00 0.00 C ATOM 0 H ALA A 12 6.599 -5.455 -7.625 1.00 0.00 H new ATOM 0 HA ALA A 12 5.177 -5.767 -5.138 1.00 0.00 H new ATOM 0 HB1 ALA A 12 6.229 -8.005 -5.214 1.00 0.00 H new ATOM 0 HB2 ALA A 12 5.450 -7.595 -6.760 1.00 0.00 H new ATOM 0 HB3 ALA A 12 7.219 -7.489 -6.599 1.00 0.00 H new ATOM 40 N ARG A 13 8.395 -5.087 -5.036 1.00 0.00 N ATOM 41 CA ARG A 13 9.389 -4.494 -4.136 1.00 0.00 C ATOM 42 C ARG A 13 8.815 -3.250 -3.440 1.00 0.00 C ATOM 43 O ARG A 13 8.901 -3.191 -2.218 1.00 0.00 O ATOM 44 CB ARG A 13 10.720 -4.217 -4.859 1.00 0.00 C ATOM 45 CG ARG A 13 11.759 -3.605 -3.896 1.00 0.00 C ATOM 46 CD ARG A 13 13.153 -3.416 -4.512 1.00 0.00 C ATOM 47 NE ARG A 13 14.109 -4.477 -4.129 1.00 0.00 N ATOM 48 CZ ARG A 13 14.391 -5.603 -4.773 1.00 0.00 C ATOM 49 NH1 ARG A 13 13.725 -5.995 -5.839 1.00 0.00 N ATOM 50 NH2 ARG A 13 15.419 -6.323 -4.381 1.00 0.00 N ATOM 0 H ARG A 13 8.694 -5.148 -6.009 1.00 0.00 H new ATOM 0 HA ARG A 13 9.621 -5.218 -3.355 1.00 0.00 H new ATOM 0 HB2 ARG A 13 11.110 -5.145 -5.278 1.00 0.00 H new ATOM 0 HB3 ARG A 13 10.549 -3.538 -5.694 1.00 0.00 H new ATOM 0 HG2 ARG A 13 11.393 -2.638 -3.551 1.00 0.00 H new ATOM 0 HG3 ARG A 13 11.846 -4.245 -3.018 1.00 0.00 H new ATOM 0 HD2 ARG A 13 13.063 -3.392 -5.598 1.00 0.00 H new ATOM 0 HD3 ARG A 13 13.551 -2.449 -4.204 1.00 0.00 H new ATOM 0 HE ARG A 13 14.617 -4.324 -3.258 1.00 0.00 H new ATOM 0 HH11 ARG A 13 12.959 -5.426 -6.200 1.00 0.00 H new ATOM 0 HH12 ARG A 13 13.975 -6.868 -6.304 1.00 0.00 H new ATOM 0 HH21 ARG A 13 15.987 -6.014 -3.592 1.00 0.00 H new ATOM 0 HH22 ARG A 13 15.648 -7.191 -4.866 1.00 0.00 H new ATOM 64 N LEU A 14 8.184 -2.315 -4.163 1.00 0.00 N ATOM 65 CA LEU A 14 7.610 -1.075 -3.624 1.00 0.00 C ATOM 66 C LEU A 14 6.560 -1.374 -2.557 1.00 0.00 C ATOM 67 O LEU A 14 6.680 -0.883 -1.438 1.00 0.00 O ATOM 68 CB LEU A 14 7.064 -0.220 -4.792 1.00 0.00 C ATOM 69 CG LEU A 14 6.553 1.209 -4.479 1.00 0.00 C ATOM 70 CD1 LEU A 14 5.191 1.250 -3.763 1.00 0.00 C ATOM 71 CD2 LEU A 14 7.591 2.038 -3.707 1.00 0.00 C ATOM 0 H LEU A 14 8.055 -2.404 -5.171 1.00 0.00 H new ATOM 0 HA LEU A 14 8.384 -0.495 -3.121 1.00 0.00 H new ATOM 0 HB2 LEU A 14 7.853 -0.135 -5.539 1.00 0.00 H new ATOM 0 HB3 LEU A 14 6.246 -0.772 -5.254 1.00 0.00 H new ATOM 0 HG LEU A 14 6.399 1.664 -5.457 1.00 0.00 H new ATOM 0 HD11 LEU A 14 4.907 2.286 -3.581 1.00 0.00 H new ATOM 0 HD12 LEU A 14 4.437 0.771 -4.388 1.00 0.00 H new ATOM 0 HD13 LEU A 14 5.264 0.722 -2.812 1.00 0.00 H new ATOM 0 HD21 LEU A 14 7.189 3.032 -3.510 1.00 0.00 H new ATOM 0 HD22 LEU A 14 7.820 1.545 -2.762 1.00 0.00 H new ATOM 0 HD23 LEU A 14 8.501 2.126 -4.301 1.00 0.00 H new ATOM 83 N GLY A 15 5.575 -2.236 -2.838 1.00 0.00 N ATOM 84 CA GLY A 15 4.566 -2.614 -1.838 1.00 0.00 C ATOM 85 C GLY A 15 5.192 -3.232 -0.582 1.00 0.00 C ATOM 86 O GLY A 15 4.795 -2.892 0.531 1.00 0.00 O ATOM 0 H GLY A 15 5.454 -2.684 -3.746 1.00 0.00 H new ATOM 0 HA2 GLY A 15 3.989 -1.733 -1.557 1.00 0.00 H new ATOM 0 HA3 GLY A 15 3.868 -3.325 -2.280 1.00 0.00 H new ATOM 90 N ARG A 16 6.236 -4.055 -0.752 1.00 0.00 N ATOM 91 CA ARG A 16 7.018 -4.674 0.335 1.00 0.00 C ATOM 92 C ARG A 16 8.185 -3.801 0.852 1.00 0.00 C ATOM 93 O ARG A 16 9.053 -4.304 1.570 1.00 0.00 O ATOM 94 CB ARG A 16 7.523 -6.062 -0.107 1.00 0.00 C ATOM 95 CG ARG A 16 7.563 -7.043 1.081 1.00 0.00 C ATOM 96 CD ARG A 16 8.808 -7.934 1.132 1.00 0.00 C ATOM 97 NE ARG A 16 9.933 -7.222 1.758 1.00 0.00 N ATOM 98 CZ ARG A 16 11.007 -7.791 2.296 1.00 0.00 C ATOM 99 NH1 ARG A 16 11.218 -9.083 2.226 1.00 0.00 N ATOM 100 NH2 ARG A 16 11.898 -7.072 2.942 1.00 0.00 N ATOM 0 H ARG A 16 6.573 -4.319 -1.678 1.00 0.00 H new ATOM 0 HA ARG A 16 6.340 -4.777 1.182 1.00 0.00 H new ATOM 0 HB2 ARG A 16 6.873 -6.457 -0.887 1.00 0.00 H new ATOM 0 HB3 ARG A 16 8.519 -5.969 -0.539 1.00 0.00 H new ATOM 0 HG2 ARG A 16 7.502 -6.473 2.008 1.00 0.00 H new ATOM 0 HG3 ARG A 16 6.679 -7.679 1.040 1.00 0.00 H new ATOM 0 HD2 ARG A 16 8.588 -8.842 1.694 1.00 0.00 H new ATOM 0 HD3 ARG A 16 9.082 -8.242 0.123 1.00 0.00 H new ATOM 0 HE ARG A 16 9.885 -6.203 1.781 1.00 0.00 H new ATOM 0 HH11 ARG A 16 10.547 -9.684 1.748 1.00 0.00 H new ATOM 0 HH12 ARG A 16 12.053 -9.487 2.650 1.00 0.00 H new ATOM 0 HH21 ARG A 16 11.770 -6.064 3.035 1.00 0.00 H new ATOM 0 HH22 ARG A 16 12.718 -7.522 3.350 1.00 0.00 H new ATOM 114 N ALA A 17 8.235 -2.534 0.428 1.00 0.00 N ATOM 115 CA ALA A 17 9.092 -1.457 0.923 1.00 0.00 C ATOM 116 C ALA A 17 8.260 -0.300 1.515 1.00 0.00 C ATOM 117 O ALA A 17 8.833 0.684 1.971 1.00 0.00 O ATOM 118 CB ALA A 17 10.006 -0.970 -0.213 1.00 0.00 C ATOM 0 H ALA A 17 7.630 -2.213 -0.328 1.00 0.00 H new ATOM 0 HA ALA A 17 9.711 -1.843 1.733 1.00 0.00 H new ATOM 0 HB1 ALA A 17 10.646 -0.167 0.154 1.00 0.00 H new ATOM 0 HB2 ALA A 17 10.625 -1.797 -0.562 1.00 0.00 H new ATOM 0 HB3 ALA A 17 9.396 -0.600 -1.037 1.00 0.00 H new ATOM 124 N LEU A 18 6.924 -0.367 1.472 1.00 0.00 N ATOM 125 CA LEU A 18 6.040 0.510 2.256 1.00 0.00 C ATOM 126 C LEU A 18 5.440 -0.275 3.430 1.00 0.00 C ATOM 127 O LEU A 18 5.320 0.275 4.525 1.00 0.00 O ATOM 128 CB LEU A 18 4.957 1.162 1.369 1.00 0.00 C ATOM 129 CG LEU A 18 5.327 2.593 0.924 1.00 0.00 C ATOM 130 CD1 LEU A 18 6.489 2.607 -0.076 1.00 0.00 C ATOM 131 CD2 LEU A 18 4.120 3.309 0.300 1.00 0.00 C ATOM 0 H LEU A 18 6.420 -1.035 0.889 1.00 0.00 H new ATOM 0 HA LEU A 18 6.629 1.331 2.666 1.00 0.00 H new ATOM 0 HB2 LEU A 18 4.796 0.543 0.487 1.00 0.00 H new ATOM 0 HB3 LEU A 18 4.014 1.189 1.916 1.00 0.00 H new ATOM 0 HG LEU A 18 5.640 3.121 1.825 1.00 0.00 H new ATOM 0 HD11 LEU A 18 6.713 3.635 -0.360 1.00 0.00 H new ATOM 0 HD12 LEU A 18 7.370 2.157 0.383 1.00 0.00 H new ATOM 0 HD13 LEU A 18 6.212 2.038 -0.964 1.00 0.00 H new ATOM 0 HD21 LEU A 18 4.411 4.315 -0.004 1.00 0.00 H new ATOM 0 HD22 LEU A 18 3.777 2.752 -0.572 1.00 0.00 H new ATOM 0 HD23 LEU A 18 3.315 3.370 1.032 1.00 0.00 H new ATOM 143 N ALA A 19 5.130 -1.560 3.226 1.00 0.00 N ATOM 144 CA ALA A 19 4.793 -2.487 4.297 1.00 0.00 C ATOM 145 C ALA A 19 6.084 -2.881 5.031 1.00 0.00 C ATOM 146 O ALA A 19 6.729 -3.876 4.706 1.00 0.00 O ATOM 147 CB ALA A 19 4.038 -3.677 3.694 1.00 0.00 C ATOM 0 H ALA A 19 5.108 -1.985 2.299 1.00 0.00 H new ATOM 0 HA ALA A 19 4.134 -2.036 5.039 1.00 0.00 H new ATOM 0 HB1 ALA A 19 3.778 -4.381 4.484 1.00 0.00 H new ATOM 0 HB2 ALA A 19 3.128 -3.323 3.210 1.00 0.00 H new ATOM 0 HB3 ALA A 19 4.670 -4.174 2.958 1.00 0.00 H new ATOM 153 N ASP A 20 6.450 -2.049 6.005 1.00 0.00 N ATOM 154 CA ASP A 20 7.679 -2.080 6.779 1.00 0.00 C ATOM 155 C ASP A 20 7.376 -1.987 8.286 1.00 0.00 C ATOM 156 O ASP A 20 6.341 -1.436 8.675 1.00 0.00 O ATOM 157 CB ASP A 20 8.547 -0.892 6.344 1.00 0.00 C ATOM 158 CG ASP A 20 9.663 -1.356 5.419 1.00 0.00 C ATOM 159 OD1 ASP A 20 9.412 -1.484 4.203 1.00 0.00 O ATOM 160 OD2 ASP A 20 10.790 -1.485 5.942 1.00 0.00 O ATOM 0 H ASP A 20 5.845 -1.279 6.291 1.00 0.00 H new ATOM 0 HA ASP A 20 8.202 -3.019 6.601 1.00 0.00 H new ATOM 0 HB2 ASP A 20 7.930 -0.151 5.836 1.00 0.00 H new ATOM 0 HB3 ASP A 20 8.973 -0.405 7.221 1.00 0.00 H new ATOM 165 N PRO A 21 8.288 -2.474 9.146 1.00 0.00 N ATOM 166 CA PRO A 21 8.095 -2.560 10.590 1.00 0.00 C ATOM 167 C PRO A 21 8.294 -1.169 11.221 1.00 0.00 C ATOM 168 O PRO A 21 7.682 -0.172 10.829 1.00 0.00 O ATOM 169 CB PRO A 21 9.126 -3.626 11.013 1.00 0.00 C ATOM 170 CG PRO A 21 10.307 -3.303 10.092 1.00 0.00 C ATOM 171 CD PRO A 21 9.583 -3.036 8.779 1.00 0.00 C ATOM 0 HA PRO A 21 7.097 -2.851 10.918 1.00 0.00 H new ATOM 0 HB2 PRO A 21 9.394 -3.541 12.066 1.00 0.00 H new ATOM 0 HB3 PRO A 21 8.753 -4.639 10.860 1.00 0.00 H new ATOM 0 HG2 PRO A 21 10.873 -2.437 10.435 1.00 0.00 H new ATOM 0 HG3 PRO A 21 11.009 -4.133 10.015 1.00 0.00 H new ATOM 0 HD2 PRO A 21 10.147 -2.343 8.155 1.00 0.00 H new ATOM 0 HD3 PRO A 21 9.462 -3.955 8.205 1.00 0.00 H new ATOM 179 N THR A 22 9.222 -1.049 12.171 1.00 0.00 N ATOM 180 CA THR A 22 9.667 0.235 12.728 1.00 0.00 C ATOM 181 C THR A 22 10.217 1.194 11.661 1.00 0.00 C ATOM 182 O THR A 22 10.198 2.411 11.854 1.00 0.00 O ATOM 183 CB THR A 22 10.625 -0.056 13.881 1.00 0.00 C ATOM 184 OG1 THR A 22 9.843 -0.700 14.862 1.00 0.00 O ATOM 185 CG2 THR A 22 11.237 1.179 14.533 1.00 0.00 C ATOM 0 H THR A 22 9.695 -1.853 12.584 1.00 0.00 H new ATOM 0 HA THR A 22 8.815 0.786 13.126 1.00 0.00 H new ATOM 0 HB THR A 22 11.459 -0.637 13.488 1.00 0.00 H new ATOM 0 HG1 THR A 22 10.403 -0.918 15.636 1.00 0.00 H new ATOM 0 HG21 THR A 22 11.902 0.872 15.340 1.00 0.00 H new ATOM 0 HG22 THR A 22 11.803 1.740 13.790 1.00 0.00 H new ATOM 0 HG23 THR A 22 10.444 1.808 14.936 1.00 0.00 H new ATOM 193 N ARG A 23 10.569 0.695 10.472 1.00 0.00 N ATOM 194 CA ARG A 23 10.929 1.544 9.336 1.00 0.00 C ATOM 195 C ARG A 23 9.698 2.225 8.688 1.00 0.00 C ATOM 196 O ARG A 23 9.859 3.239 8.010 1.00 0.00 O ATOM 197 CB ARG A 23 11.807 0.734 8.376 1.00 0.00 C ATOM 198 CG ARG A 23 12.689 1.616 7.470 1.00 0.00 C ATOM 199 CD ARG A 23 12.473 1.278 6.003 1.00 0.00 C ATOM 200 NE ARG A 23 11.159 1.787 5.600 1.00 0.00 N ATOM 201 CZ ARG A 23 10.568 1.555 4.446 1.00 0.00 C ATOM 202 NH1 ARG A 23 11.151 0.888 3.480 1.00 0.00 N ATOM 203 NH2 ARG A 23 9.343 1.984 4.267 1.00 0.00 N ATOM 0 H ARG A 23 10.612 -0.304 10.272 1.00 0.00 H new ATOM 0 HA ARG A 23 11.522 2.393 9.676 1.00 0.00 H new ATOM 0 HB2 ARG A 23 12.445 0.065 8.954 1.00 0.00 H new ATOM 0 HB3 ARG A 23 11.170 0.107 7.753 1.00 0.00 H new ATOM 0 HG2 ARG A 23 12.457 2.667 7.643 1.00 0.00 H new ATOM 0 HG3 ARG A 23 13.738 1.474 7.729 1.00 0.00 H new ATOM 0 HD2 ARG A 23 13.257 1.725 5.391 1.00 0.00 H new ATOM 0 HD3 ARG A 23 12.525 0.200 5.850 1.00 0.00 H new ATOM 0 HE ARG A 23 10.659 2.371 6.271 1.00 0.00 H new ATOM 0 HH11 ARG A 23 12.097 0.527 3.608 1.00 0.00 H new ATOM 0 HH12 ARG A 23 10.659 0.729 2.601 1.00 0.00 H new ATOM 0 HH21 ARG A 23 8.865 2.487 5.014 1.00 0.00 H new ATOM 0 HH22 ARG A 23 8.868 1.815 3.381 1.00 0.00 H new ATOM 217 N CYS A 24 8.465 1.750 8.914 1.00 0.00 N ATOM 218 CA CYS A 24 7.232 2.493 8.591 1.00 0.00 C ATOM 219 C CYS A 24 6.848 3.449 9.740 1.00 0.00 C ATOM 220 O CYS A 24 6.307 4.529 9.481 1.00 0.00 O ATOM 221 CB CYS A 24 6.094 1.532 8.241 1.00 0.00 C ATOM 222 SG CYS A 24 4.712 2.499 7.565 1.00 0.00 S ATOM 0 H CYS A 24 8.291 0.834 9.328 1.00 0.00 H new ATOM 0 HA CYS A 24 7.420 3.107 7.710 1.00 0.00 H new ATOM 0 HB2 CYS A 24 6.432 0.794 7.514 1.00 0.00 H new ATOM 0 HB3 CYS A 24 5.775 0.983 9.127 1.00 0.00 H new ATOM 0 HG CYS A 24 4.769 3.715 8.021 1.00 0.00 H new ATOM 228 N ARG A 25 7.194 3.115 10.998 1.00 0.00 N ATOM 229 CA ARG A 25 7.104 4.079 12.109 1.00 0.00 C ATOM 230 C ARG A 25 7.907 5.346 11.766 1.00 0.00 C ATOM 231 O ARG A 25 7.379 6.440 11.898 1.00 0.00 O ATOM 232 CB ARG A 25 7.526 3.482 13.465 1.00 0.00 C ATOM 233 CG ARG A 25 6.371 2.861 14.283 1.00 0.00 C ATOM 234 CD ARG A 25 6.506 1.359 14.589 1.00 0.00 C ATOM 235 NE ARG A 25 5.991 0.513 13.495 1.00 0.00 N ATOM 236 CZ ARG A 25 5.965 -0.819 13.487 1.00 0.00 C ATOM 237 NH1 ARG A 25 6.694 -1.554 14.296 1.00 0.00 N ATOM 238 NH2 ARG A 25 5.183 -1.462 12.653 1.00 0.00 N ATOM 0 H ARG A 25 7.536 2.193 11.268 1.00 0.00 H new ATOM 0 HA ARG A 25 6.054 4.346 12.227 1.00 0.00 H new ATOM 0 HB2 ARG A 25 8.282 2.717 13.290 1.00 0.00 H new ATOM 0 HB3 ARG A 25 7.996 4.264 14.061 1.00 0.00 H new ATOM 0 HG2 ARG A 25 6.287 3.400 15.227 1.00 0.00 H new ATOM 0 HG3 ARG A 25 5.439 3.021 13.741 1.00 0.00 H new ATOM 0 HD2 ARG A 25 7.555 1.120 14.766 1.00 0.00 H new ATOM 0 HD3 ARG A 25 5.967 1.128 15.508 1.00 0.00 H new ATOM 0 HE ARG A 25 5.622 0.990 12.672 1.00 0.00 H new ATOM 0 HH11 ARG A 25 7.316 -1.107 14.970 1.00 0.00 H new ATOM 0 HH12 ARG A 25 6.638 -2.571 14.250 1.00 0.00 H new ATOM 0 HH21 ARG A 25 4.590 -0.942 12.006 1.00 0.00 H new ATOM 0 HH22 ARG A 25 5.168 -2.482 12.652 1.00 0.00 H new ATOM 252 N ILE A 26 9.115 5.215 11.204 1.00 0.00 N ATOM 253 CA ILE A 26 9.876 6.355 10.621 1.00 0.00 C ATOM 254 C ILE A 26 9.037 7.157 9.609 1.00 0.00 C ATOM 255 O ILE A 26 8.972 8.375 9.714 1.00 0.00 O ATOM 256 CB ILE A 26 11.191 5.868 9.957 1.00 0.00 C ATOM 257 CG1 ILE A 26 12.154 5.259 10.998 1.00 0.00 C ATOM 258 CG2 ILE A 26 11.857 6.973 9.119 1.00 0.00 C ATOM 259 CD1 ILE A 26 13.331 6.111 11.479 1.00 0.00 C ATOM 0 H ILE A 26 9.602 4.322 11.135 1.00 0.00 H new ATOM 0 HA ILE A 26 10.124 7.021 11.448 1.00 0.00 H new ATOM 0 HB ILE A 26 10.930 5.072 9.260 1.00 0.00 H new ATOM 0 HG12 ILE A 26 11.566 4.979 11.872 1.00 0.00 H new ATOM 0 HG13 ILE A 26 12.559 4.338 10.578 1.00 0.00 H new ATOM 0 HG21 ILE A 26 12.774 6.588 8.673 1.00 0.00 H new ATOM 0 HG22 ILE A 26 11.176 7.292 8.330 1.00 0.00 H new ATOM 0 HG23 ILE A 26 12.094 7.823 9.760 1.00 0.00 H new ATOM 0 HD11 ILE A 26 13.915 5.547 12.207 1.00 0.00 H new ATOM 0 HD12 ILE A 26 13.963 6.371 10.630 1.00 0.00 H new ATOM 0 HD13 ILE A 26 12.955 7.022 11.944 1.00 0.00 H new ATOM 271 N LEU A 27 8.420 6.484 8.629 1.00 0.00 N ATOM 272 CA LEU A 27 7.639 7.145 7.566 1.00 0.00 C ATOM 273 C LEU A 27 6.417 7.906 8.100 1.00 0.00 C ATOM 274 O LEU A 27 6.141 8.995 7.608 1.00 0.00 O ATOM 275 CB LEU A 27 7.200 6.154 6.466 1.00 0.00 C ATOM 276 CG LEU A 27 8.300 5.609 5.532 1.00 0.00 C ATOM 277 CD1 LEU A 27 7.636 4.683 4.501 1.00 0.00 C ATOM 278 CD2 LEU A 27 9.023 6.722 4.760 1.00 0.00 C ATOM 0 H LEU A 27 8.446 5.468 8.547 1.00 0.00 H new ATOM 0 HA LEU A 27 8.317 7.877 7.128 1.00 0.00 H new ATOM 0 HB2 LEU A 27 6.715 5.306 6.949 1.00 0.00 H new ATOM 0 HB3 LEU A 27 6.446 6.644 5.850 1.00 0.00 H new ATOM 0 HG LEU A 27 9.034 5.092 6.150 1.00 0.00 H new ATOM 0 HD11 LEU A 27 8.395 4.284 3.828 1.00 0.00 H new ATOM 0 HD12 LEU A 27 7.140 3.861 5.017 1.00 0.00 H new ATOM 0 HD13 LEU A 27 6.901 5.246 3.926 1.00 0.00 H new ATOM 0 HD21 LEU A 27 9.787 6.283 4.118 1.00 0.00 H new ATOM 0 HD22 LEU A 27 8.304 7.267 4.148 1.00 0.00 H new ATOM 0 HD23 LEU A 27 9.492 7.408 5.465 1.00 0.00 H new ATOM 290 N VAL A 28 5.708 7.385 9.103 1.00 0.00 N ATOM 291 CA VAL A 28 4.573 8.113 9.727 1.00 0.00 C ATOM 292 C VAL A 28 5.024 9.194 10.736 1.00 0.00 C ATOM 293 O VAL A 28 4.377 10.231 10.853 1.00 0.00 O ATOM 294 CB VAL A 28 3.515 7.145 10.307 1.00 0.00 C ATOM 295 CG1 VAL A 28 3.982 6.422 11.576 1.00 0.00 C ATOM 296 CG2 VAL A 28 2.173 7.843 10.569 1.00 0.00 C ATOM 0 H VAL A 28 5.889 6.466 9.508 1.00 0.00 H new ATOM 0 HA VAL A 28 4.082 8.663 8.924 1.00 0.00 H new ATOM 0 HB VAL A 28 3.373 6.390 9.534 1.00 0.00 H new ATOM 0 HG11 VAL A 28 3.192 5.759 11.929 1.00 0.00 H new ATOM 0 HG12 VAL A 28 4.874 5.836 11.354 1.00 0.00 H new ATOM 0 HG13 VAL A 28 4.213 7.155 12.349 1.00 0.00 H new ATOM 0 HG21 VAL A 28 1.462 7.124 10.976 1.00 0.00 H new ATOM 0 HG22 VAL A 28 2.318 8.654 11.283 1.00 0.00 H new ATOM 0 HG23 VAL A 28 1.785 8.248 9.634 1.00 0.00 H new ATOM 306 N ALA A 29 6.181 9.018 11.390 1.00 0.00 N ATOM 307 CA ALA A 29 6.848 10.048 12.203 1.00 0.00 C ATOM 308 C ALA A 29 7.591 11.100 11.351 1.00 0.00 C ATOM 309 O ALA A 29 8.256 11.994 11.877 1.00 0.00 O ATOM 310 CB ALA A 29 7.769 9.339 13.204 1.00 0.00 C ATOM 0 H ALA A 29 6.692 8.135 11.369 1.00 0.00 H new ATOM 0 HA ALA A 29 6.096 10.623 12.743 1.00 0.00 H new ATOM 0 HB1 ALA A 29 8.277 10.081 13.820 1.00 0.00 H new ATOM 0 HB2 ALA A 29 7.177 8.682 13.841 1.00 0.00 H new ATOM 0 HB3 ALA A 29 8.509 8.749 12.663 1.00 0.00 H new ATOM 316 N LEU A 30 7.487 10.991 10.026 1.00 0.00 N ATOM 317 CA LEU A 30 7.898 12.001 9.075 1.00 0.00 C ATOM 318 C LEU A 30 6.773 13.020 8.931 1.00 0.00 C ATOM 319 O LEU A 30 7.001 14.219 9.083 1.00 0.00 O ATOM 320 CB LEU A 30 8.171 11.284 7.735 1.00 0.00 C ATOM 321 CG LEU A 30 9.150 11.995 6.819 1.00 0.00 C ATOM 322 CD1 LEU A 30 8.741 13.432 6.533 1.00 0.00 C ATOM 323 CD2 LEU A 30 10.525 11.991 7.447 1.00 0.00 C ATOM 0 H LEU A 30 7.098 10.161 9.578 1.00 0.00 H new ATOM 0 HA LEU A 30 8.796 12.526 9.399 1.00 0.00 H new ATOM 0 HB2 LEU A 30 8.552 10.285 7.945 1.00 0.00 H new ATOM 0 HB3 LEU A 30 7.226 11.160 7.207 1.00 0.00 H new ATOM 0 HG LEU A 30 9.155 11.455 5.872 1.00 0.00 H new ATOM 0 HD11 LEU A 30 9.475 13.895 5.873 1.00 0.00 H new ATOM 0 HD12 LEU A 30 7.763 13.443 6.052 1.00 0.00 H new ATOM 0 HD13 LEU A 30 8.692 13.989 7.468 1.00 0.00 H new ATOM 0 HD21 LEU A 30 11.227 12.502 6.788 1.00 0.00 H new ATOM 0 HD22 LEU A 30 10.488 12.506 8.407 1.00 0.00 H new ATOM 0 HD23 LEU A 30 10.853 10.963 7.599 1.00 0.00 H new ATOM 335 N LEU A 31 5.586 12.477 8.654 1.00 0.00 N ATOM 336 CA LEU A 31 4.293 13.140 8.487 1.00 0.00 C ATOM 337 C LEU A 31 3.990 14.106 9.642 1.00 0.00 C ATOM 338 O LEU A 31 3.752 15.283 9.394 1.00 0.00 O ATOM 339 CB LEU A 31 3.227 12.020 8.393 1.00 0.00 C ATOM 340 CG LEU A 31 2.417 12.017 7.092 1.00 0.00 C ATOM 341 CD1 LEU A 31 1.606 10.715 7.032 1.00 0.00 C ATOM 342 CD2 LEU A 31 1.505 13.251 7.002 1.00 0.00 C ATOM 0 H LEU A 31 5.499 11.468 8.530 1.00 0.00 H new ATOM 0 HA LEU A 31 4.295 13.753 7.585 1.00 0.00 H new ATOM 0 HB2 LEU A 31 3.723 11.055 8.499 1.00 0.00 H new ATOM 0 HB3 LEU A 31 2.540 12.119 9.233 1.00 0.00 H new ATOM 0 HG LEU A 31 3.092 12.066 6.237 1.00 0.00 H new ATOM 0 HD11 LEU A 31 1.021 10.693 6.112 1.00 0.00 H new ATOM 0 HD12 LEU A 31 2.285 9.862 7.051 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.935 10.664 7.890 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.943 13.221 6.068 1.00 0.00 H new ATOM 0 HD22 LEU A 31 0.812 13.253 7.843 1.00 0.00 H new ATOM 0 HD23 LEU A 31 2.113 14.155 7.031 1.00 0.00 H new ATOM 354 N ASP A 32 4.082 13.604 10.877 1.00 0.00 N ATOM 355 CA ASP A 32 3.960 14.346 12.144 1.00 0.00 C ATOM 356 C ASP A 32 5.339 14.857 12.634 1.00 0.00 C ATOM 357 O ASP A 32 5.690 14.782 13.809 1.00 0.00 O ATOM 358 CB ASP A 32 3.241 13.437 13.166 1.00 0.00 C ATOM 359 CG ASP A 32 2.615 14.206 14.343 1.00 0.00 C ATOM 360 OD1 ASP A 32 1.853 15.159 14.064 1.00 0.00 O ATOM 361 OD2 ASP A 32 2.848 13.799 15.505 1.00 0.00 O ATOM 0 H ASP A 32 4.254 12.611 11.033 1.00 0.00 H new ATOM 0 HA ASP A 32 3.361 15.246 12.005 1.00 0.00 H new ATOM 0 HB2 ASP A 32 2.460 12.876 12.653 1.00 0.00 H new ATOM 0 HB3 ASP A 32 3.953 12.709 13.556 1.00 0.00 H new ATOM 366 N GLY A 33 6.187 15.270 11.685 1.00 0.00 N ATOM 367 CA GLY A 33 7.586 15.649 11.898 1.00 0.00 C ATOM 368 C GLY A 33 8.063 16.750 10.958 1.00 0.00 C ATOM 369 O GLY A 33 7.977 17.926 11.286 1.00 0.00 O ATOM 0 H GLY A 33 5.904 15.352 10.708 1.00 0.00 H new ATOM 0 HA2 GLY A 33 7.712 15.981 12.929 1.00 0.00 H new ATOM 0 HA3 GLY A 33 8.217 14.770 11.767 1.00 0.00 H new ATOM 373 N VAL A 34 8.657 16.361 9.824 1.00 0.00 N ATOM 374 CA VAL A 34 9.374 17.219 8.838 1.00 0.00 C ATOM 375 C VAL A 34 10.238 18.355 9.429 1.00 0.00 C ATOM 376 O VAL A 34 10.425 19.396 8.806 1.00 0.00 O ATOM 377 CB VAL A 34 8.452 17.766 7.724 1.00 0.00 C ATOM 378 CG1 VAL A 34 7.914 16.663 6.826 1.00 0.00 C ATOM 379 CG2 VAL A 34 7.267 18.541 8.311 1.00 0.00 C ATOM 0 H VAL A 34 8.657 15.381 9.541 1.00 0.00 H new ATOM 0 HA VAL A 34 10.082 16.517 8.396 1.00 0.00 H new ATOM 0 HB VAL A 34 9.071 18.435 7.126 1.00 0.00 H new ATOM 0 HG11 VAL A 34 7.272 17.098 6.060 1.00 0.00 H new ATOM 0 HG12 VAL A 34 8.746 16.143 6.350 1.00 0.00 H new ATOM 0 HG13 VAL A 34 7.338 15.956 7.423 1.00 0.00 H new ATOM 0 HG21 VAL A 34 6.638 18.912 7.502 1.00 0.00 H new ATOM 0 HG22 VAL A 34 6.682 17.881 8.951 1.00 0.00 H new ATOM 0 HG23 VAL A 34 7.637 19.382 8.898 1.00 0.00 H new ATOM 389 N CYS A 35 10.762 18.146 10.634 1.00 0.00 N ATOM 390 CA CYS A 35 11.670 19.014 11.380 1.00 0.00 C ATOM 391 C CYS A 35 13.075 19.120 10.751 1.00 0.00 C ATOM 392 O CYS A 35 13.326 19.992 9.932 1.00 0.00 O ATOM 393 CB CYS A 35 11.713 18.410 12.788 1.00 0.00 C ATOM 394 SG CYS A 35 10.162 18.685 13.683 1.00 0.00 S ATOM 0 H CYS A 35 10.545 17.297 11.156 1.00 0.00 H new ATOM 0 HA CYS A 35 11.315 20.044 11.380 1.00 0.00 H new ATOM 0 HB2 CYS A 35 11.909 17.340 12.719 1.00 0.00 H new ATOM 0 HB3 CYS A 35 12.539 18.850 13.347 1.00 0.00 H new ATOM 0 HG CYS A 35 9.157 18.458 12.890 1.00 0.00 H new ATOM 400 N TYR A 36 13.991 18.222 11.139 1.00 0.00 N ATOM 401 CA TYR A 36 15.420 18.218 10.788 1.00 0.00 C ATOM 402 C TYR A 36 15.928 16.769 10.573 1.00 0.00 C ATOM 403 O TYR A 36 15.471 15.867 11.282 1.00 0.00 O ATOM 404 CB TYR A 36 16.240 18.905 11.898 1.00 0.00 C ATOM 405 CG TYR A 36 15.671 20.194 12.467 1.00 0.00 C ATOM 406 CD1 TYR A 36 15.561 21.343 11.660 1.00 0.00 C ATOM 407 CD2 TYR A 36 15.240 20.239 13.810 1.00 0.00 C ATOM 408 CE1 TYR A 36 15.019 22.529 12.186 1.00 0.00 C ATOM 409 CE2 TYR A 36 14.699 21.424 14.344 1.00 0.00 C ATOM 410 CZ TYR A 36 14.591 22.573 13.529 1.00 0.00 C ATOM 411 OH TYR A 36 14.088 23.731 14.032 1.00 0.00 O ATOM 0 H TYR A 36 13.742 17.435 11.739 1.00 0.00 H new ATOM 0 HA TYR A 36 15.547 18.770 9.857 1.00 0.00 H new ATOM 0 HB2 TYR A 36 16.364 18.197 12.717 1.00 0.00 H new ATOM 0 HB3 TYR A 36 17.235 19.116 11.505 1.00 0.00 H new ATOM 0 HD1 TYR A 36 15.894 21.313 10.633 1.00 0.00 H new ATOM 0 HD2 TYR A 36 15.326 19.360 14.431 1.00 0.00 H new ATOM 0 HE1 TYR A 36 14.931 23.406 11.562 1.00 0.00 H new ATOM 0 HE2 TYR A 36 14.368 21.455 15.372 1.00 0.00 H new ATOM 0 HH TYR A 36 13.837 23.598 14.970 1.00 0.00 H new ATOM 421 N PRO A 37 16.859 16.496 9.635 1.00 0.00 N ATOM 422 CA PRO A 37 17.283 15.136 9.303 1.00 0.00 C ATOM 423 C PRO A 37 17.949 14.456 10.503 1.00 0.00 C ATOM 424 O PRO A 37 18.750 15.061 11.211 1.00 0.00 O ATOM 425 CB PRO A 37 18.230 15.264 8.104 1.00 0.00 C ATOM 426 CG PRO A 37 18.771 16.684 8.228 1.00 0.00 C ATOM 427 CD PRO A 37 17.599 17.455 8.833 1.00 0.00 C ATOM 0 HA PRO A 37 16.434 14.502 9.049 1.00 0.00 H new ATOM 0 HB2 PRO A 37 19.030 14.525 8.144 1.00 0.00 H new ATOM 0 HB3 PRO A 37 17.705 15.115 7.160 1.00 0.00 H new ATOM 0 HG2 PRO A 37 19.652 16.724 8.868 1.00 0.00 H new ATOM 0 HG3 PRO A 37 19.062 17.090 7.259 1.00 0.00 H new ATOM 0 HD2 PRO A 37 17.952 18.285 9.445 1.00 0.00 H new ATOM 0 HD3 PRO A 37 16.968 17.880 8.053 1.00 0.00 H new ATOM 435 N GLY A 38 17.580 13.194 10.753 1.00 0.00 N ATOM 436 CA GLY A 38 18.046 12.439 11.921 1.00 0.00 C ATOM 437 C GLY A 38 17.361 12.817 13.240 1.00 0.00 C ATOM 438 O GLY A 38 17.623 12.164 14.248 1.00 0.00 O ATOM 0 H GLY A 38 16.949 12.667 10.150 1.00 0.00 H new ATOM 0 HA2 GLY A 38 17.889 11.376 11.737 1.00 0.00 H new ATOM 0 HA3 GLY A 38 19.120 12.588 12.029 1.00 0.00 H new ATOM 442 N GLN A 39 16.463 13.816 13.263 1.00 0.00 N ATOM 443 CA GLN A 39 15.717 14.166 14.480 1.00 0.00 C ATOM 444 C GLN A 39 14.685 13.108 14.868 1.00 0.00 C ATOM 445 O GLN A 39 14.314 13.057 16.035 1.00 0.00 O ATOM 446 CB GLN A 39 15.075 15.552 14.380 1.00 0.00 C ATOM 447 CG GLN A 39 13.685 15.613 13.715 1.00 0.00 C ATOM 448 CD GLN A 39 12.487 15.396 14.651 1.00 0.00 C ATOM 449 OE1 GLN A 39 12.530 15.702 15.828 1.00 0.00 O ATOM 450 NE2 GLN A 39 11.362 14.918 14.152 1.00 0.00 N ATOM 0 H GLN A 39 16.237 14.394 12.453 1.00 0.00 H new ATOM 0 HA GLN A 39 16.454 14.197 15.283 1.00 0.00 H new ATOM 0 HB2 GLN A 39 14.992 15.964 15.386 1.00 0.00 H new ATOM 0 HB3 GLN A 39 15.750 16.203 13.824 1.00 0.00 H new ATOM 0 HG2 GLN A 39 13.575 16.585 13.234 1.00 0.00 H new ATOM 0 HG3 GLN A 39 13.647 14.861 12.926 1.00 0.00 H new ATOM 0 HE21 GLN A 39 11.311 14.657 13.167 1.00 0.00 H new ATOM 0 HE22 GLN A 39 10.544 14.809 14.751 1.00 0.00 H new ATOM 459 N LEU A 40 14.302 12.214 13.939 1.00 0.00 N ATOM 460 CA LEU A 40 13.464 11.045 14.247 1.00 0.00 C ATOM 461 C LEU A 40 14.023 10.248 15.437 1.00 0.00 C ATOM 462 O LEU A 40 13.288 9.520 16.082 1.00 0.00 O ATOM 463 CB LEU A 40 13.355 10.081 13.052 1.00 0.00 C ATOM 464 CG LEU A 40 12.756 10.672 11.768 1.00 0.00 C ATOM 465 CD1 LEU A 40 13.414 9.993 10.563 1.00 0.00 C ATOM 466 CD2 LEU A 40 11.232 10.486 11.765 1.00 0.00 C ATOM 0 H LEU A 40 14.565 12.283 12.956 1.00 0.00 H new ATOM 0 HA LEU A 40 12.479 11.445 14.489 1.00 0.00 H new ATOM 0 HB2 LEU A 40 14.351 9.701 12.824 1.00 0.00 H new ATOM 0 HB3 LEU A 40 12.749 9.226 13.353 1.00 0.00 H new ATOM 0 HG LEU A 40 12.951 11.743 11.714 1.00 0.00 H new ATOM 0 HD11 LEU A 40 12.998 10.403 9.643 1.00 0.00 H new ATOM 0 HD12 LEU A 40 14.489 10.172 10.587 1.00 0.00 H new ATOM 0 HD13 LEU A 40 13.224 8.920 10.601 1.00 0.00 H new ATOM 0 HD21 LEU A 40 10.816 10.908 10.850 1.00 0.00 H new ATOM 0 HD22 LEU A 40 10.995 9.423 11.815 1.00 0.00 H new ATOM 0 HD23 LEU A 40 10.802 10.994 12.628 1.00 0.00 H new ATOM 478 N ALA A 41 15.318 10.383 15.738 1.00 0.00 N ATOM 479 CA ALA A 41 15.956 9.706 16.861 1.00 0.00 C ATOM 480 C ALA A 41 15.435 10.162 18.234 1.00 0.00 C ATOM 481 O ALA A 41 15.381 9.360 19.162 1.00 0.00 O ATOM 482 CB ALA A 41 17.473 9.902 16.737 1.00 0.00 C ATOM 0 H ALA A 41 15.955 10.972 15.201 1.00 0.00 H new ATOM 0 HA ALA A 41 15.703 8.647 16.811 1.00 0.00 H new ATOM 0 HB1 ALA A 41 17.973 9.404 17.567 1.00 0.00 H new ATOM 0 HB2 ALA A 41 17.819 9.475 15.796 1.00 0.00 H new ATOM 0 HB3 ALA A 41 17.705 10.967 16.760 1.00 0.00 H new ATOM 488 N ALA A 42 15.040 11.432 18.368 1.00 0.00 N ATOM 489 CA ALA A 42 14.316 11.925 19.542 1.00 0.00 C ATOM 490 C ALA A 42 12.838 11.513 19.473 1.00 0.00 C ATOM 491 O ALA A 42 12.284 11.016 20.445 1.00 0.00 O ATOM 492 CB ALA A 42 14.473 13.451 19.603 1.00 0.00 C ATOM 0 H ALA A 42 15.214 12.148 17.663 1.00 0.00 H new ATOM 0 HA ALA A 42 14.728 11.487 20.451 1.00 0.00 H new ATOM 0 HB1 ALA A 42 13.940 13.837 20.472 1.00 0.00 H new ATOM 0 HB2 ALA A 42 15.530 13.705 19.683 1.00 0.00 H new ATOM 0 HB3 ALA A 42 14.061 13.896 18.697 1.00 0.00 H new ATOM 498 N HIS A 43 12.223 11.667 18.297 1.00 0.00 N ATOM 499 CA HIS A 43 10.795 11.406 18.057 1.00 0.00 C ATOM 500 C HIS A 43 10.380 9.925 18.257 1.00 0.00 C ATOM 501 O HIS A 43 9.249 9.630 18.639 1.00 0.00 O ATOM 502 CB HIS A 43 10.504 11.887 16.624 1.00 0.00 C ATOM 503 CG HIS A 43 9.078 12.282 16.350 1.00 0.00 C ATOM 504 ND1 HIS A 43 8.130 12.657 17.301 1.00 0.00 N ATOM 505 CD2 HIS A 43 8.566 12.486 15.103 1.00 0.00 C ATOM 506 CE1 HIS A 43 7.057 13.060 16.602 1.00 0.00 C ATOM 507 NE2 HIS A 43 7.290 12.975 15.281 1.00 0.00 N ATOM 0 H HIS A 43 12.715 11.985 17.462 1.00 0.00 H new ATOM 0 HA HIS A 43 10.201 11.944 18.796 1.00 0.00 H new ATOM 0 HB2 HIS A 43 11.147 12.740 16.408 1.00 0.00 H new ATOM 0 HB3 HIS A 43 10.783 11.094 15.930 1.00 0.00 H new ATOM 0 HD2 HIS A 43 9.062 12.301 14.162 1.00 0.00 H new ATOM 0 HE1 HIS A 43 6.133 13.405 17.041 1.00 0.00 H new ATOM 0 HE2 HIS A 43 6.637 13.228 14.540 1.00 0.00 H new ATOM 515 N LEU A 44 11.303 8.991 17.990 1.00 0.00 N ATOM 516 CA LEU A 44 11.148 7.542 18.185 1.00 0.00 C ATOM 517 C LEU A 44 11.833 7.013 19.453 1.00 0.00 C ATOM 518 O LEU A 44 11.628 5.850 19.797 1.00 0.00 O ATOM 519 CB LEU A 44 11.731 6.798 16.961 1.00 0.00 C ATOM 520 CG LEU A 44 11.096 7.150 15.602 1.00 0.00 C ATOM 521 CD1 LEU A 44 11.546 6.170 14.524 1.00 0.00 C ATOM 522 CD2 LEU A 44 9.558 7.163 15.623 1.00 0.00 C ATOM 0 H LEU A 44 12.220 9.235 17.615 1.00 0.00 H new ATOM 0 HA LEU A 44 10.080 7.358 18.298 1.00 0.00 H new ATOM 0 HB2 LEU A 44 12.800 7.006 16.907 1.00 0.00 H new ATOM 0 HB3 LEU A 44 11.623 5.726 17.125 1.00 0.00 H new ATOM 0 HG LEU A 44 11.439 8.161 15.381 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.085 6.438 13.573 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.631 6.210 14.426 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.244 5.160 14.801 1.00 0.00 H new ATOM 0 HD21 LEU A 44 9.183 7.419 14.632 1.00 0.00 H new ATOM 0 HD22 LEU A 44 9.190 6.177 15.907 1.00 0.00 H new ATOM 0 HD23 LEU A 44 9.210 7.902 16.345 1.00 0.00 H new ATOM 534 N GLY A 45 12.714 7.794 20.087 1.00 0.00 N ATOM 535 CA GLY A 45 13.582 7.346 21.187 1.00 0.00 C ATOM 536 C GLY A 45 14.702 6.385 20.756 1.00 0.00 C ATOM 537 O GLY A 45 15.476 5.924 21.594 1.00 0.00 O ATOM 0 H GLY A 45 12.848 8.776 19.847 1.00 0.00 H new ATOM 0 HA2 GLY A 45 14.031 8.220 21.660 1.00 0.00 H new ATOM 0 HA3 GLY A 45 12.968 6.855 21.942 1.00 0.00 H new ATOM 541 N LEU A 46 14.795 6.055 19.461 1.00 0.00 N ATOM 542 CA LEU A 46 15.796 5.146 18.893 1.00 0.00 C ATOM 543 C LEU A 46 17.040 5.939 18.481 1.00 0.00 C ATOM 544 O LEU A 46 16.917 6.991 17.867 1.00 0.00 O ATOM 545 CB LEU A 46 15.190 4.402 17.689 1.00 0.00 C ATOM 546 CG LEU A 46 13.968 3.523 18.019 1.00 0.00 C ATOM 547 CD1 LEU A 46 13.365 2.982 16.718 1.00 0.00 C ATOM 548 CD2 LEU A 46 14.337 2.353 18.944 1.00 0.00 C ATOM 0 H LEU A 46 14.155 6.426 18.759 1.00 0.00 H new ATOM 0 HA LEU A 46 16.093 4.410 19.640 1.00 0.00 H new ATOM 0 HB2 LEU A 46 14.900 5.135 16.936 1.00 0.00 H new ATOM 0 HB3 LEU A 46 15.961 3.774 17.242 1.00 0.00 H new ATOM 0 HG LEU A 46 13.240 4.142 18.544 1.00 0.00 H new ATOM 0 HD11 LEU A 46 12.500 2.360 16.949 1.00 0.00 H new ATOM 0 HD12 LEU A 46 13.055 3.815 16.087 1.00 0.00 H new ATOM 0 HD13 LEU A 46 14.111 2.386 16.192 1.00 0.00 H new ATOM 0 HD21 LEU A 46 13.447 1.759 19.152 1.00 0.00 H new ATOM 0 HD22 LEU A 46 15.086 1.727 18.458 1.00 0.00 H new ATOM 0 HD23 LEU A 46 14.740 2.742 19.879 1.00 0.00 H new ATOM 560 N THR A 47 18.246 5.437 18.773 1.00 0.00 N ATOM 561 CA THR A 47 19.483 6.233 18.645 1.00 0.00 C ATOM 562 C THR A 47 19.731 6.757 17.230 1.00 0.00 C ATOM 563 O THR A 47 19.259 6.199 16.234 1.00 0.00 O ATOM 564 CB THR A 47 20.733 5.526 19.201 1.00 0.00 C ATOM 565 OG1 THR A 47 21.350 4.767 18.193 1.00 0.00 O ATOM 566 CG2 THR A 47 20.460 4.626 20.409 1.00 0.00 C ATOM 0 H THR A 47 18.397 4.483 19.100 1.00 0.00 H new ATOM 0 HA THR A 47 19.303 7.102 19.278 1.00 0.00 H new ATOM 0 HB THR A 47 21.390 6.324 19.547 1.00 0.00 H new ATOM 0 HG1 THR A 47 20.879 3.914 18.091 1.00 0.00 H new ATOM 0 HG21 THR A 47 21.392 4.166 20.738 1.00 0.00 H new ATOM 0 HG22 THR A 47 20.043 5.223 21.220 1.00 0.00 H new ATOM 0 HG23 THR A 47 19.750 3.847 20.130 1.00 0.00 H new ATOM 574 N ARG A 48 20.557 7.807 17.146 1.00 0.00 N ATOM 575 CA ARG A 48 20.979 8.412 15.877 1.00 0.00 C ATOM 576 C ARG A 48 21.596 7.373 14.925 1.00 0.00 C ATOM 577 O ARG A 48 21.421 7.504 13.716 1.00 0.00 O ATOM 578 CB ARG A 48 21.954 9.579 16.129 1.00 0.00 C ATOM 579 CG ARG A 48 21.289 10.754 16.871 1.00 0.00 C ATOM 580 CD ARG A 48 22.272 11.887 17.217 1.00 0.00 C ATOM 581 NE ARG A 48 22.657 12.704 16.048 1.00 0.00 N ATOM 582 CZ ARG A 48 22.119 13.866 15.679 1.00 0.00 C ATOM 583 NH1 ARG A 48 21.071 14.385 16.286 1.00 0.00 N ATOM 584 NH2 ARG A 48 22.643 14.541 14.678 1.00 0.00 N ATOM 0 H ARG A 48 20.955 8.265 17.966 1.00 0.00 H new ATOM 0 HA ARG A 48 20.088 8.807 15.388 1.00 0.00 H new ATOM 0 HB2 ARG A 48 22.803 9.220 16.711 1.00 0.00 H new ATOM 0 HB3 ARG A 48 22.348 9.932 15.176 1.00 0.00 H new ATOM 0 HG2 ARG A 48 20.484 11.155 16.255 1.00 0.00 H new ATOM 0 HG3 ARG A 48 20.833 10.384 17.789 1.00 0.00 H new ATOM 0 HD2 ARG A 48 21.821 12.533 17.970 1.00 0.00 H new ATOM 0 HD3 ARG A 48 23.169 11.457 17.662 1.00 0.00 H new ATOM 0 HE ARG A 48 23.411 12.342 15.464 1.00 0.00 H new ATOM 0 HH11 ARG A 48 20.641 13.894 17.070 1.00 0.00 H new ATOM 0 HH12 ARG A 48 20.690 15.277 15.972 1.00 0.00 H new ATOM 0 HH21 ARG A 48 23.458 14.174 14.187 1.00 0.00 H new ATOM 0 HH22 ARG A 48 22.234 15.431 14.393 1.00 0.00 H new ATOM 598 N SER A 49 22.241 6.321 15.431 1.00 0.00 N ATOM 599 CA SER A 49 22.664 5.174 14.615 1.00 0.00 C ATOM 600 C SER A 49 21.455 4.360 14.131 1.00 0.00 C ATOM 601 O SER A 49 21.229 4.258 12.929 1.00 0.00 O ATOM 602 CB SER A 49 23.630 4.283 15.410 1.00 0.00 C ATOM 603 OG SER A 49 24.680 5.067 15.948 1.00 0.00 O ATOM 0 H SER A 49 22.486 6.237 16.417 1.00 0.00 H new ATOM 0 HA SER A 49 23.182 5.557 13.736 1.00 0.00 H new ATOM 0 HB2 SER A 49 23.094 3.778 16.213 1.00 0.00 H new ATOM 0 HB3 SER A 49 24.039 3.507 14.762 1.00 0.00 H new ATOM 0 HG SER A 49 25.291 4.492 16.455 1.00 0.00 H new ATOM 609 N ASN A 50 20.614 3.855 15.045 1.00 0.00 N ATOM 610 CA ASN A 50 19.440 3.040 14.702 1.00 0.00 C ATOM 611 C ASN A 50 18.495 3.736 13.705 1.00 0.00 C ATOM 612 O ASN A 50 18.022 3.102 12.766 1.00 0.00 O ATOM 613 CB ASN A 50 18.663 2.672 15.975 1.00 0.00 C ATOM 614 CG ASN A 50 19.500 1.872 16.961 1.00 0.00 C ATOM 615 OD1 ASN A 50 20.169 2.431 17.815 1.00 0.00 O ATOM 616 ND2 ASN A 50 19.510 0.555 16.868 1.00 0.00 N ATOM 0 H ASN A 50 20.730 4.001 16.048 1.00 0.00 H new ATOM 0 HA ASN A 50 19.816 2.140 14.215 1.00 0.00 H new ATOM 0 HB2 ASN A 50 18.312 3.584 16.458 1.00 0.00 H new ATOM 0 HB3 ASN A 50 17.779 2.095 15.703 1.00 0.00 H new ATOM 0 HD21 ASN A 50 20.078 0.003 17.511 1.00 0.00 H new ATOM 0 HD22 ASN A 50 18.950 0.090 16.153 1.00 0.00 H new ATOM 623 N VAL A 51 18.246 5.039 13.863 1.00 0.00 N ATOM 624 CA VAL A 51 17.411 5.808 12.924 1.00 0.00 C ATOM 625 C VAL A 51 18.122 6.043 11.583 1.00 0.00 C ATOM 626 O VAL A 51 17.456 6.049 10.549 1.00 0.00 O ATOM 627 CB VAL A 51 16.956 7.137 13.589 1.00 0.00 C ATOM 628 CG1 VAL A 51 16.687 8.305 12.625 1.00 0.00 C ATOM 629 CG2 VAL A 51 15.705 6.869 14.449 1.00 0.00 C ATOM 0 H VAL A 51 18.613 5.591 14.638 1.00 0.00 H new ATOM 0 HA VAL A 51 16.522 5.222 12.692 1.00 0.00 H new ATOM 0 HB VAL A 51 17.801 7.465 14.194 1.00 0.00 H new ATOM 0 HG11 VAL A 51 16.376 9.182 13.193 1.00 0.00 H new ATOM 0 HG12 VAL A 51 17.597 8.536 12.071 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.898 8.026 11.927 1.00 0.00 H new ATOM 0 HG21 VAL A 51 15.381 7.798 14.919 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.905 6.483 13.817 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.944 6.137 15.220 1.00 0.00 H new ATOM 639 N SER A 52 19.451 6.187 11.562 1.00 0.00 N ATOM 640 CA SER A 52 20.190 6.381 10.309 1.00 0.00 C ATOM 641 C SER A 52 20.197 5.122 9.442 1.00 0.00 C ATOM 642 O SER A 52 20.063 5.248 8.229 1.00 0.00 O ATOM 643 CB SER A 52 21.608 6.888 10.568 1.00 0.00 C ATOM 644 OG SER A 52 21.540 8.171 11.170 1.00 0.00 O ATOM 0 H SER A 52 20.037 6.173 12.397 1.00 0.00 H new ATOM 0 HA SER A 52 19.661 7.150 9.747 1.00 0.00 H new ATOM 0 HB2 SER A 52 22.142 6.195 11.219 1.00 0.00 H new ATOM 0 HB3 SER A 52 22.165 6.941 9.633 1.00 0.00 H new ATOM 0 HG SER A 52 21.744 8.095 12.126 1.00 0.00 H new ATOM 650 N ASN A 53 20.219 3.928 10.043 1.00 0.00 N ATOM 651 CA ASN A 53 20.007 2.663 9.328 1.00 0.00 C ATOM 652 C ASN A 53 18.683 2.664 8.547 1.00 0.00 C ATOM 653 O ASN A 53 18.663 2.374 7.353 1.00 0.00 O ATOM 654 CB ASN A 53 20.031 1.503 10.334 1.00 0.00 C ATOM 655 CG ASN A 53 21.416 1.208 10.899 1.00 0.00 C ATOM 656 OD1 ASN A 53 22.436 1.711 10.456 1.00 0.00 O ATOM 657 ND2 ASN A 53 21.481 0.374 11.917 1.00 0.00 N ATOM 0 H ASN A 53 20.385 3.810 11.043 1.00 0.00 H new ATOM 0 HA ASN A 53 20.811 2.541 8.602 1.00 0.00 H new ATOM 0 HB2 ASN A 53 19.355 1.734 11.157 1.00 0.00 H new ATOM 0 HB3 ASN A 53 19.648 0.605 9.849 1.00 0.00 H new ATOM 0 HD21 ASN A 53 22.384 0.149 12.335 1.00 0.00 H new ATOM 0 HD22 ASN A 53 20.629 -0.046 12.287 1.00 0.00 H new ATOM 664 N HIS A 54 17.582 3.056 9.195 1.00 0.00 N ATOM 665 CA HIS A 54 16.276 3.148 8.540 1.00 0.00 C ATOM 666 C HIS A 54 16.257 4.183 7.398 1.00 0.00 C ATOM 667 O HIS A 54 15.655 3.926 6.360 1.00 0.00 O ATOM 668 CB HIS A 54 15.211 3.504 9.588 1.00 0.00 C ATOM 669 CG HIS A 54 15.116 2.547 10.752 1.00 0.00 C ATOM 670 ND1 HIS A 54 15.122 2.890 12.085 1.00 0.00 N ATOM 671 CD2 HIS A 54 15.024 1.182 10.695 1.00 0.00 C ATOM 672 CE1 HIS A 54 15.046 1.763 12.809 1.00 0.00 C ATOM 673 NE2 HIS A 54 14.978 0.692 12.003 1.00 0.00 N ATOM 0 H HIS A 54 17.571 3.317 10.181 1.00 0.00 H new ATOM 0 HA HIS A 54 16.061 2.178 8.091 1.00 0.00 H new ATOM 0 HB2 HIS A 54 15.422 4.502 9.974 1.00 0.00 H new ATOM 0 HB3 HIS A 54 14.240 3.551 9.096 1.00 0.00 H new ATOM 0 HD2 HIS A 54 14.992 0.587 9.794 1.00 0.00 H new ATOM 0 HE1 HIS A 54 15.040 1.723 13.888 1.00 0.00 H new ATOM 0 HE2 HIS A 54 14.907 -0.285 12.288 1.00 0.00 H new ATOM 681 N LEU A 55 16.910 5.337 7.597 1.00 0.00 N ATOM 682 CA LEU A 55 17.010 6.439 6.631 1.00 0.00 C ATOM 683 C LEU A 55 17.996 6.182 5.482 1.00 0.00 C ATOM 684 O LEU A 55 17.923 6.886 4.479 1.00 0.00 O ATOM 685 CB LEU A 55 17.422 7.723 7.371 1.00 0.00 C ATOM 686 CG LEU A 55 16.359 8.316 8.313 1.00 0.00 C ATOM 687 CD1 LEU A 55 17.002 9.413 9.178 1.00 0.00 C ATOM 688 CD2 LEU A 55 15.189 8.897 7.503 1.00 0.00 C ATOM 0 H LEU A 55 17.401 5.535 8.469 1.00 0.00 H new ATOM 0 HA LEU A 55 16.025 6.536 6.174 1.00 0.00 H new ATOM 0 HB2 LEU A 55 18.321 7.514 7.951 1.00 0.00 H new ATOM 0 HB3 LEU A 55 17.688 8.478 6.631 1.00 0.00 H new ATOM 0 HG LEU A 55 15.971 7.527 8.957 1.00 0.00 H new ATOM 0 HD11 LEU A 55 16.252 9.835 9.847 1.00 0.00 H new ATOM 0 HD12 LEU A 55 17.813 8.984 9.767 1.00 0.00 H new ATOM 0 HD13 LEU A 55 17.398 10.199 8.534 1.00 0.00 H new ATOM 0 HD21 LEU A 55 14.446 9.312 8.184 1.00 0.00 H new ATOM 0 HD22 LEU A 55 15.558 9.683 6.844 1.00 0.00 H new ATOM 0 HD23 LEU A 55 14.733 8.108 6.906 1.00 0.00 H new ATOM 700 N SER A 56 18.916 5.230 5.600 1.00 0.00 N ATOM 701 CA SER A 56 19.874 4.939 4.524 1.00 0.00 C ATOM 702 C SER A 56 19.178 4.369 3.274 1.00 0.00 C ATOM 703 O SER A 56 19.426 4.833 2.163 1.00 0.00 O ATOM 704 CB SER A 56 20.967 4.005 5.069 1.00 0.00 C ATOM 705 OG SER A 56 22.195 4.191 4.390 1.00 0.00 O ATOM 0 H SER A 56 19.023 4.644 6.428 1.00 0.00 H new ATOM 0 HA SER A 56 20.342 5.867 4.197 1.00 0.00 H new ATOM 0 HB2 SER A 56 21.107 4.190 6.134 1.00 0.00 H new ATOM 0 HB3 SER A 56 20.646 2.968 4.965 1.00 0.00 H new ATOM 0 HG SER A 56 22.869 3.584 4.761 1.00 0.00 H new ATOM 711 N CYS A 57 18.207 3.461 3.448 1.00 0.00 N ATOM 712 CA CYS A 57 17.314 3.019 2.381 1.00 0.00 C ATOM 713 C CYS A 57 16.375 4.166 1.937 1.00 0.00 C ATOM 714 O CYS A 57 16.225 4.486 0.759 1.00 0.00 O ATOM 715 CB CYS A 57 16.531 1.841 2.988 1.00 0.00 C ATOM 716 SG CYS A 57 15.300 1.107 1.856 1.00 0.00 S ATOM 0 H CYS A 57 18.022 3.012 4.345 1.00 0.00 H new ATOM 0 HA CYS A 57 17.854 2.720 1.483 1.00 0.00 H new ATOM 0 HB2 CYS A 57 17.236 1.068 3.293 1.00 0.00 H new ATOM 0 HB3 CYS A 57 16.023 2.182 3.890 1.00 0.00 H new ATOM 0 HG CYS A 57 15.548 1.489 0.638 1.00 0.00 H new ATOM 721 N LEU A 58 15.765 4.815 2.930 1.00 0.00 N ATOM 722 CA LEU A 58 14.675 5.775 2.775 1.00 0.00 C ATOM 723 C LEU A 58 15.045 7.028 1.972 1.00 0.00 C ATOM 724 O LEU A 58 14.208 7.507 1.202 1.00 0.00 O ATOM 725 CB LEU A 58 14.181 6.102 4.195 1.00 0.00 C ATOM 726 CG LEU A 58 12.692 5.831 4.446 1.00 0.00 C ATOM 727 CD1 LEU A 58 12.372 4.349 4.313 1.00 0.00 C ATOM 728 CD2 LEU A 58 12.350 6.260 5.878 1.00 0.00 C ATOM 0 H LEU A 58 16.030 4.679 3.906 1.00 0.00 H new ATOM 0 HA LEU A 58 13.882 5.332 2.173 1.00 0.00 H new ATOM 0 HB2 LEU A 58 14.765 5.521 4.909 1.00 0.00 H new ATOM 0 HB3 LEU A 58 14.382 7.154 4.400 1.00 0.00 H new ATOM 0 HG LEU A 58 12.113 6.389 3.710 1.00 0.00 H new ATOM 0 HD11 LEU A 58 11.310 4.188 4.496 1.00 0.00 H new ATOM 0 HD12 LEU A 58 12.622 4.012 3.307 1.00 0.00 H new ATOM 0 HD13 LEU A 58 12.955 3.784 5.040 1.00 0.00 H new ATOM 0 HD21 LEU A 58 11.294 6.073 6.071 1.00 0.00 H new ATOM 0 HD22 LEU A 58 12.954 5.689 6.583 1.00 0.00 H new ATOM 0 HD23 LEU A 58 12.559 7.323 5.999 1.00 0.00 H new ATOM 740 N ARG A 59 16.272 7.540 2.145 1.00 0.00 N ATOM 741 CA ARG A 59 16.826 8.652 1.361 1.00 0.00 C ATOM 742 C ARG A 59 17.573 8.229 0.087 1.00 0.00 C ATOM 743 O ARG A 59 18.203 9.075 -0.544 1.00 0.00 O ATOM 744 CB ARG A 59 17.693 9.569 2.242 1.00 0.00 C ATOM 745 CG ARG A 59 16.997 10.015 3.540 1.00 0.00 C ATOM 746 CD ARG A 59 17.635 11.275 4.141 1.00 0.00 C ATOM 747 NE ARG A 59 18.052 11.140 5.548 1.00 0.00 N ATOM 748 CZ ARG A 59 19.167 10.556 5.982 1.00 0.00 C ATOM 749 NH1 ARG A 59 19.915 9.808 5.200 1.00 0.00 N ATOM 750 NH2 ARG A 59 19.550 10.717 7.232 1.00 0.00 N ATOM 0 H ARG A 59 16.920 7.185 2.848 1.00 0.00 H new ATOM 0 HA ARG A 59 15.962 9.213 1.005 1.00 0.00 H new ATOM 0 HB2 ARG A 59 18.616 9.048 2.495 1.00 0.00 H new ATOM 0 HB3 ARG A 59 17.972 10.452 1.668 1.00 0.00 H new ATOM 0 HG2 ARG A 59 15.943 10.206 3.337 1.00 0.00 H new ATOM 0 HG3 ARG A 59 17.040 9.206 4.269 1.00 0.00 H new ATOM 0 HD2 ARG A 59 18.505 11.547 3.543 1.00 0.00 H new ATOM 0 HD3 ARG A 59 16.925 12.098 4.064 1.00 0.00 H new ATOM 0 HE ARG A 59 17.429 11.530 6.255 1.00 0.00 H new ATOM 0 HH11 ARG A 59 19.647 9.660 4.227 1.00 0.00 H new ATOM 0 HH12 ARG A 59 20.763 9.376 5.567 1.00 0.00 H new ATOM 0 HH21 ARG A 59 18.992 11.289 7.867 1.00 0.00 H new ATOM 0 HH22 ARG A 59 20.404 10.270 7.565 1.00 0.00 H new ATOM 764 N GLY A 60 17.509 6.948 -0.293 1.00 0.00 N ATOM 765 CA GLY A 60 18.022 6.419 -1.570 1.00 0.00 C ATOM 766 C GLY A 60 16.879 6.041 -2.508 1.00 0.00 C ATOM 767 O GLY A 60 16.730 6.599 -3.592 1.00 0.00 O ATOM 0 H GLY A 60 17.088 6.227 0.293 1.00 0.00 H new ATOM 0 HA2 GLY A 60 18.656 7.166 -2.048 1.00 0.00 H new ATOM 0 HA3 GLY A 60 18.645 5.545 -1.381 1.00 0.00 H new ATOM 771 N CYS A 61 15.996 5.176 -2.015 1.00 0.00 N ATOM 772 CA CYS A 61 14.808 4.641 -2.655 1.00 0.00 C ATOM 773 C CYS A 61 13.642 5.671 -2.724 1.00 0.00 C ATOM 774 O CYS A 61 12.476 5.321 -2.905 1.00 0.00 O ATOM 775 CB CYS A 61 14.559 3.335 -1.882 1.00 0.00 C ATOM 776 SG CYS A 61 16.033 2.246 -1.850 1.00 0.00 S ATOM 0 H CYS A 61 16.109 4.801 -1.073 1.00 0.00 H new ATOM 0 HA CYS A 61 14.917 4.427 -3.718 1.00 0.00 H new ATOM 0 HB2 CYS A 61 14.264 3.572 -0.860 1.00 0.00 H new ATOM 0 HB3 CYS A 61 13.726 2.800 -2.338 1.00 0.00 H new ATOM 0 HG CYS A 61 16.798 2.580 -0.854 1.00 0.00 H new ATOM 781 N GLY A 62 13.987 6.946 -2.496 1.00 0.00 N ATOM 782 CA GLY A 62 13.184 8.155 -2.692 1.00 0.00 C ATOM 783 C GLY A 62 12.076 8.403 -1.673 1.00 0.00 C ATOM 784 O GLY A 62 11.459 9.461 -1.732 1.00 0.00 O ATOM 0 H GLY A 62 14.915 7.174 -2.139 1.00 0.00 H new ATOM 0 HA2 GLY A 62 13.853 9.015 -2.686 1.00 0.00 H new ATOM 0 HA3 GLY A 62 12.733 8.109 -3.683 1.00 0.00 H new ATOM 788 N LEU A 63 11.815 7.476 -0.741 1.00 0.00 N ATOM 789 CA LEU A 63 10.681 7.550 0.188 1.00 0.00 C ATOM 790 C LEU A 63 10.701 8.781 1.105 1.00 0.00 C ATOM 791 O LEU A 63 9.632 9.279 1.454 1.00 0.00 O ATOM 792 CB LEU A 63 10.631 6.245 0.969 1.00 0.00 C ATOM 793 CG LEU A 63 10.387 5.028 0.055 1.00 0.00 C ATOM 794 CD1 LEU A 63 10.329 3.832 0.979 1.00 0.00 C ATOM 795 CD2 LEU A 63 9.104 5.096 -0.785 1.00 0.00 C ATOM 0 H LEU A 63 12.392 6.645 -0.610 1.00 0.00 H new ATOM 0 HA LEU A 63 9.767 7.679 -0.392 1.00 0.00 H new ATOM 0 HB2 LEU A 63 11.569 6.110 1.508 1.00 0.00 H new ATOM 0 HB3 LEU A 63 9.839 6.301 1.716 1.00 0.00 H new ATOM 0 HG LEU A 63 11.189 4.980 -0.681 1.00 0.00 H new ATOM 0 HD11 LEU A 63 10.157 2.928 0.394 1.00 0.00 H new ATOM 0 HD12 LEU A 63 11.273 3.742 1.517 1.00 0.00 H new ATOM 0 HD13 LEU A 63 9.515 3.963 1.692 1.00 0.00 H new ATOM 0 HD21 LEU A 63 9.020 4.196 -1.395 1.00 0.00 H new ATOM 0 HD22 LEU A 63 8.240 5.169 -0.124 1.00 0.00 H new ATOM 0 HD23 LEU A 63 9.140 5.971 -1.433 1.00 0.00 H new ATOM 807 N VAL A 64 11.887 9.288 1.454 1.00 0.00 N ATOM 808 CA VAL A 64 12.109 10.579 2.136 1.00 0.00 C ATOM 809 C VAL A 64 13.307 11.310 1.549 1.00 0.00 C ATOM 810 O VAL A 64 14.256 10.661 1.137 1.00 0.00 O ATOM 811 CB VAL A 64 12.415 10.430 3.640 1.00 0.00 C ATOM 812 CG1 VAL A 64 11.136 10.268 4.439 1.00 0.00 C ATOM 813 CG2 VAL A 64 13.297 9.249 3.971 1.00 0.00 C ATOM 0 H VAL A 64 12.759 8.794 1.264 1.00 0.00 H new ATOM 0 HA VAL A 64 11.177 11.126 1.994 1.00 0.00 H new ATOM 0 HB VAL A 64 12.944 11.345 3.905 1.00 0.00 H new ATOM 0 HG11 VAL A 64 11.378 10.165 5.497 1.00 0.00 H new ATOM 0 HG12 VAL A 64 10.504 11.144 4.295 1.00 0.00 H new ATOM 0 HG13 VAL A 64 10.605 9.378 4.100 1.00 0.00 H new ATOM 0 HG21 VAL A 64 13.467 9.212 5.047 1.00 0.00 H new ATOM 0 HG22 VAL A 64 12.809 8.329 3.649 1.00 0.00 H new ATOM 0 HG23 VAL A 64 14.252 9.353 3.456 1.00 0.00 H new ATOM 823 N VAL A 65 13.323 12.643 1.592 1.00 0.00 N ATOM 824 CA VAL A 65 14.465 13.452 1.132 1.00 0.00 C ATOM 825 C VAL A 65 14.597 14.775 1.900 1.00 0.00 C ATOM 826 O VAL A 65 13.606 15.372 2.305 1.00 0.00 O ATOM 827 CB VAL A 65 14.386 13.720 -0.403 1.00 0.00 C ATOM 828 CG1 VAL A 65 15.596 14.523 -0.900 1.00 0.00 C ATOM 829 CG2 VAL A 65 14.287 12.456 -1.280 1.00 0.00 C ATOM 0 H VAL A 65 12.545 13.199 1.947 1.00 0.00 H new ATOM 0 HA VAL A 65 15.360 12.866 1.339 1.00 0.00 H new ATOM 0 HB VAL A 65 13.458 14.281 -0.512 1.00 0.00 H new ATOM 0 HG11 VAL A 65 15.506 14.690 -1.973 1.00 0.00 H new ATOM 0 HG12 VAL A 65 15.632 15.483 -0.385 1.00 0.00 H new ATOM 0 HG13 VAL A 65 16.511 13.967 -0.695 1.00 0.00 H new ATOM 0 HG21 VAL A 65 14.237 12.745 -2.330 1.00 0.00 H new ATOM 0 HG22 VAL A 65 15.165 11.830 -1.117 1.00 0.00 H new ATOM 0 HG23 VAL A 65 13.389 11.898 -1.014 1.00 0.00 H new ATOM 839 N ALA A 66 15.841 15.215 2.133 1.00 0.00 N ATOM 840 CA ALA A 66 16.178 16.465 2.819 1.00 0.00 C ATOM 841 C ALA A 66 16.043 17.697 1.922 1.00 0.00 C ATOM 842 O ALA A 66 16.402 17.694 0.748 1.00 0.00 O ATOM 843 CB ALA A 66 17.581 16.333 3.427 1.00 0.00 C ATOM 0 H ALA A 66 16.666 14.692 1.839 1.00 0.00 H new ATOM 0 HA ALA A 66 15.455 16.628 3.618 1.00 0.00 H new ATOM 0 HB1 ALA A 66 17.843 17.258 3.941 1.00 0.00 H new ATOM 0 HB2 ALA A 66 17.593 15.507 4.138 1.00 0.00 H new ATOM 0 HB3 ALA A 66 18.304 16.140 2.635 1.00 0.00 H new ATOM 849 N THR A 67 15.525 18.762 2.536 1.00 0.00 N ATOM 850 CA THR A 67 15.071 19.995 1.888 1.00 0.00 C ATOM 851 C THR A 67 15.437 21.141 2.812 1.00 0.00 C ATOM 852 O THR A 67 15.139 21.043 3.993 1.00 0.00 O ATOM 853 CB THR A 67 13.540 19.937 1.764 1.00 0.00 C ATOM 854 OG1 THR A 67 13.123 18.720 1.201 1.00 0.00 O ATOM 855 CG2 THR A 67 12.934 21.076 0.958 1.00 0.00 C ATOM 0 H THR A 67 15.405 18.790 3.548 1.00 0.00 H new ATOM 0 HA THR A 67 15.522 20.121 0.904 1.00 0.00 H new ATOM 0 HB THR A 67 13.178 20.034 2.788 1.00 0.00 H new ATOM 0 HG1 THR A 67 12.145 18.708 1.135 1.00 0.00 H new ATOM 0 HG21 THR A 67 11.851 20.959 0.920 1.00 0.00 H new ATOM 0 HG22 THR A 67 13.180 22.027 1.431 1.00 0.00 H new ATOM 0 HG23 THR A 67 13.337 21.059 -0.055 1.00 0.00 H new ATOM 863 N TYR A 68 16.012 22.245 2.345 1.00 0.00 N ATOM 864 CA TYR A 68 16.219 23.411 3.224 1.00 0.00 C ATOM 865 C TYR A 68 14.878 23.964 3.740 1.00 0.00 C ATOM 866 O TYR A 68 13.996 24.261 2.929 1.00 0.00 O ATOM 867 CB TYR A 68 17.030 24.488 2.495 1.00 0.00 C ATOM 868 CG TYR A 68 18.525 24.359 2.692 1.00 0.00 C ATOM 869 CD1 TYR A 68 19.138 24.966 3.804 1.00 0.00 C ATOM 870 CD2 TYR A 68 19.303 23.624 1.774 1.00 0.00 C ATOM 871 CE1 TYR A 68 20.527 24.849 3.999 1.00 0.00 C ATOM 872 CE2 TYR A 68 20.690 23.499 1.967 1.00 0.00 C ATOM 873 CZ TYR A 68 21.308 24.115 3.080 1.00 0.00 C ATOM 874 OH TYR A 68 22.650 23.994 3.273 1.00 0.00 O ATOM 0 H TYR A 68 16.339 22.365 1.386 1.00 0.00 H new ATOM 0 HA TYR A 68 16.790 23.090 4.095 1.00 0.00 H new ATOM 0 HB2 TYR A 68 16.807 24.439 1.429 1.00 0.00 H new ATOM 0 HB3 TYR A 68 16.710 25.470 2.843 1.00 0.00 H new ATOM 0 HD1 TYR A 68 18.541 25.523 4.510 1.00 0.00 H new ATOM 0 HD2 TYR A 68 18.833 23.156 0.922 1.00 0.00 H new ATOM 0 HE1 TYR A 68 20.995 25.320 4.851 1.00 0.00 H new ATOM 0 HE2 TYR A 68 21.284 22.932 1.265 1.00 0.00 H new ATOM 0 HH TYR A 68 23.037 23.457 2.551 1.00 0.00 H new ATOM 884 N GLU A 69 14.720 24.125 5.058 1.00 0.00 N ATOM 885 CA GLU A 69 13.539 24.753 5.664 1.00 0.00 C ATOM 886 C GLU A 69 13.706 26.288 5.698 1.00 0.00 C ATOM 887 O GLU A 69 14.080 26.857 4.666 1.00 0.00 O ATOM 888 CB GLU A 69 13.109 24.002 6.947 1.00 0.00 C ATOM 889 CG GLU A 69 14.045 23.902 8.166 1.00 0.00 C ATOM 890 CD GLU A 69 14.029 25.147 9.042 1.00 0.00 C ATOM 891 OE1 GLU A 69 12.937 25.707 9.239 1.00 0.00 O ATOM 892 OE2 GLU A 69 15.122 25.636 9.397 1.00 0.00 O ATOM 0 H GLU A 69 15.414 23.821 5.741 1.00 0.00 H new ATOM 0 HA GLU A 69 12.647 24.639 5.048 1.00 0.00 H new ATOM 0 HB2 GLU A 69 12.185 24.466 7.293 1.00 0.00 H new ATOM 0 HB3 GLU A 69 12.862 22.982 6.651 1.00 0.00 H new ATOM 0 HG2 GLU A 69 13.756 23.040 8.767 1.00 0.00 H new ATOM 0 HG3 GLU A 69 15.063 23.723 7.820 1.00 0.00 H new ATOM 899 N GLY A 70 13.415 26.985 6.799 1.00 0.00 N ATOM 900 CA GLY A 70 13.620 28.429 6.937 1.00 0.00 C ATOM 901 C GLY A 70 15.093 28.824 7.073 1.00 0.00 C ATOM 902 O GLY A 70 15.487 29.842 6.507 1.00 0.00 O ATOM 0 H GLY A 70 13.023 26.553 7.636 1.00 0.00 H new ATOM 0 HA2 GLY A 70 13.195 28.933 6.069 1.00 0.00 H new ATOM 0 HA3 GLY A 70 13.074 28.784 7.811 1.00 0.00 H new ATOM 906 N ARG A 71 15.912 28.035 7.787 1.00 0.00 N ATOM 907 CA ARG A 71 17.351 28.333 7.988 1.00 0.00 C ATOM 908 C ARG A 71 18.235 27.100 8.278 1.00 0.00 C ATOM 909 O ARG A 71 19.462 27.202 8.304 1.00 0.00 O ATOM 910 CB ARG A 71 17.492 29.382 9.109 1.00 0.00 C ATOM 911 CG ARG A 71 18.755 30.253 8.969 1.00 0.00 C ATOM 912 CD ARG A 71 19.426 30.518 10.323 1.00 0.00 C ATOM 913 NE ARG A 71 20.054 29.293 10.849 1.00 0.00 N ATOM 914 CZ ARG A 71 21.267 28.830 10.581 1.00 0.00 C ATOM 915 NH1 ARG A 71 22.146 29.501 9.865 1.00 0.00 N ATOM 916 NH2 ARG A 71 21.605 27.654 11.058 1.00 0.00 N ATOM 0 H ARG A 71 15.604 27.176 8.242 1.00 0.00 H new ATOM 0 HA ARG A 71 17.724 28.721 7.040 1.00 0.00 H new ATOM 0 HB2 ARG A 71 16.612 30.026 9.108 1.00 0.00 H new ATOM 0 HB3 ARG A 71 17.514 28.874 10.073 1.00 0.00 H new ATOM 0 HG2 ARG A 71 19.464 29.759 8.304 1.00 0.00 H new ATOM 0 HG3 ARG A 71 18.490 31.203 8.504 1.00 0.00 H new ATOM 0 HD2 ARG A 71 20.179 31.299 10.213 1.00 0.00 H new ATOM 0 HD3 ARG A 71 18.686 30.886 11.034 1.00 0.00 H new ATOM 0 HE ARG A 71 19.491 28.738 11.493 1.00 0.00 H new ATOM 0 HH11 ARG A 71 21.905 30.419 9.490 1.00 0.00 H new ATOM 0 HH12 ARG A 71 23.068 29.103 9.685 1.00 0.00 H new ATOM 0 HH21 ARG A 71 20.941 27.121 11.619 1.00 0.00 H new ATOM 0 HH22 ARG A 71 22.532 27.274 10.867 1.00 0.00 H new ATOM 930 N GLN A 72 17.628 25.941 8.510 1.00 0.00 N ATOM 931 CA GLN A 72 18.241 24.625 8.633 1.00 0.00 C ATOM 932 C GLN A 72 17.804 23.791 7.420 1.00 0.00 C ATOM 933 O GLN A 72 17.159 24.285 6.494 1.00 0.00 O ATOM 934 CB GLN A 72 17.859 23.923 9.968 1.00 0.00 C ATOM 935 CG GLN A 72 18.498 24.516 11.237 1.00 0.00 C ATOM 936 CD GLN A 72 18.197 25.989 11.497 1.00 0.00 C ATOM 937 OE1 GLN A 72 19.072 26.777 11.830 1.00 0.00 O ATOM 938 NE2 GLN A 72 16.986 26.446 11.304 1.00 0.00 N ATOM 0 H GLN A 72 16.616 25.895 8.626 1.00 0.00 H new ATOM 0 HA GLN A 72 19.326 24.729 8.652 1.00 0.00 H new ATOM 0 HB2 GLN A 72 16.775 23.957 10.079 1.00 0.00 H new ATOM 0 HB3 GLN A 72 18.140 22.872 9.898 1.00 0.00 H new ATOM 0 HG2 GLN A 72 18.161 23.937 12.097 1.00 0.00 H new ATOM 0 HG3 GLN A 72 19.579 24.390 11.171 1.00 0.00 H new ATOM 0 HE21 GLN A 72 16.239 25.810 11.026 1.00 0.00 H new ATOM 0 HE22 GLN A 72 16.789 27.439 11.432 1.00 0.00 H new ATOM 947 N VAL A 73 18.151 22.509 7.430 1.00 0.00 N ATOM 948 CA VAL A 73 17.602 21.509 6.524 1.00 0.00 C ATOM 949 C VAL A 73 16.606 20.642 7.289 1.00 0.00 C ATOM 950 O VAL A 73 16.803 20.366 8.473 1.00 0.00 O ATOM 951 CB VAL A 73 18.685 20.637 5.869 1.00 0.00 C ATOM 952 CG1 VAL A 73 19.414 21.400 4.757 1.00 0.00 C ATOM 953 CG2 VAL A 73 19.711 20.067 6.866 1.00 0.00 C ATOM 0 H VAL A 73 18.837 22.129 8.082 1.00 0.00 H new ATOM 0 HA VAL A 73 17.101 22.033 5.710 1.00 0.00 H new ATOM 0 HB VAL A 73 18.151 19.788 5.443 1.00 0.00 H new ATOM 0 HG11 VAL A 73 20.174 20.757 4.313 1.00 0.00 H new ATOM 0 HG12 VAL A 73 18.698 21.699 3.991 1.00 0.00 H new ATOM 0 HG13 VAL A 73 19.889 22.287 5.176 1.00 0.00 H new ATOM 0 HG21 VAL A 73 20.443 19.463 6.330 1.00 0.00 H new ATOM 0 HG22 VAL A 73 20.219 20.887 7.374 1.00 0.00 H new ATOM 0 HG23 VAL A 73 19.198 19.447 7.601 1.00 0.00 H new ATOM 963 N ARG A 74 15.567 20.203 6.581 1.00 0.00 N ATOM 964 CA ARG A 74 14.554 19.253 7.003 1.00 0.00 C ATOM 965 C ARG A 74 14.707 17.957 6.219 1.00 0.00 C ATOM 966 O ARG A 74 15.757 17.663 5.661 1.00 0.00 O ATOM 967 CB ARG A 74 13.145 19.872 6.942 1.00 0.00 C ATOM 968 CG ARG A 74 12.365 19.912 5.613 1.00 0.00 C ATOM 969 CD ARG A 74 11.114 20.767 5.821 1.00 0.00 C ATOM 970 NE ARG A 74 10.043 20.476 4.854 1.00 0.00 N ATOM 971 CZ ARG A 74 8.749 20.641 5.105 1.00 0.00 C ATOM 972 NH1 ARG A 74 8.311 20.917 6.315 1.00 0.00 N ATOM 973 NH2 ARG A 74 7.867 20.538 4.132 1.00 0.00 N ATOM 0 H ARG A 74 15.405 20.529 5.628 1.00 0.00 H new ATOM 0 HA ARG A 74 14.699 18.998 8.053 1.00 0.00 H new ATOM 0 HB2 ARG A 74 12.527 19.336 7.662 1.00 0.00 H new ATOM 0 HB3 ARG A 74 13.229 20.899 7.297 1.00 0.00 H new ATOM 0 HG2 ARG A 74 12.985 20.331 4.820 1.00 0.00 H new ATOM 0 HG3 ARG A 74 12.090 18.904 5.303 1.00 0.00 H new ATOM 0 HD2 ARG A 74 10.736 20.606 6.831 1.00 0.00 H new ATOM 0 HD3 ARG A 74 11.385 21.820 5.746 1.00 0.00 H new ATOM 0 HE ARG A 74 10.311 20.126 3.934 1.00 0.00 H new ATOM 0 HH11 ARG A 74 8.971 21.009 7.087 1.00 0.00 H new ATOM 0 HH12 ARG A 74 7.312 21.039 6.480 1.00 0.00 H new ATOM 0 HH21 ARG A 74 8.177 20.331 3.183 1.00 0.00 H new ATOM 0 HH22 ARG A 74 6.874 20.665 4.328 1.00 0.00 H new ATOM 987 N TYR A 75 13.662 17.146 6.233 1.00 0.00 N ATOM 988 CA TYR A 75 13.596 15.794 5.710 1.00 0.00 C ATOM 989 C TYR A 75 12.105 15.484 5.482 1.00 0.00 C ATOM 990 O TYR A 75 11.367 15.238 6.431 1.00 0.00 O ATOM 991 CB TYR A 75 14.380 14.871 6.668 1.00 0.00 C ATOM 992 CG TYR A 75 13.777 14.636 8.018 1.00 0.00 C ATOM 993 CD1 TYR A 75 13.447 15.685 8.891 1.00 0.00 C ATOM 994 CD2 TYR A 75 13.438 13.318 8.336 1.00 0.00 C ATOM 995 CE1 TYR A 75 12.665 15.419 10.020 1.00 0.00 C ATOM 996 CE2 TYR A 75 12.632 13.067 9.439 1.00 0.00 C ATOM 997 CZ TYR A 75 12.197 14.117 10.276 1.00 0.00 C ATOM 998 OH TYR A 75 11.311 13.905 11.287 1.00 0.00 O ATOM 0 H TYR A 75 12.774 17.438 6.640 1.00 0.00 H new ATOM 0 HA TYR A 75 14.077 15.640 4.744 1.00 0.00 H new ATOM 0 HB2 TYR A 75 14.509 13.905 6.180 1.00 0.00 H new ATOM 0 HB3 TYR A 75 15.375 15.293 6.808 1.00 0.00 H new ATOM 0 HD1 TYR A 75 13.794 16.688 8.693 1.00 0.00 H new ATOM 0 HD2 TYR A 75 13.800 12.501 7.729 1.00 0.00 H new ATOM 0 HE1 TYR A 75 12.418 16.220 10.701 1.00 0.00 H new ATOM 0 HE2 TYR A 75 12.334 12.053 9.660 1.00 0.00 H new ATOM 0 HH TYR A 75 10.738 13.142 11.065 1.00 0.00 H new ATOM 1008 N ALA A 76 11.638 15.655 4.245 1.00 0.00 N ATOM 1009 CA ALA A 76 10.251 15.470 3.824 1.00 0.00 C ATOM 1010 C ALA A 76 10.021 14.055 3.273 1.00 0.00 C ATOM 1011 O ALA A 76 10.978 13.424 2.829 1.00 0.00 O ATOM 1012 CB ALA A 76 9.936 16.521 2.750 1.00 0.00 C ATOM 0 H ALA A 76 12.244 15.939 3.475 1.00 0.00 H new ATOM 0 HA ALA A 76 9.589 15.593 4.681 1.00 0.00 H new ATOM 0 HB1 ALA A 76 8.904 16.404 2.418 1.00 0.00 H new ATOM 0 HB2 ALA A 76 10.072 17.519 3.166 1.00 0.00 H new ATOM 0 HB3 ALA A 76 10.607 16.387 1.902 1.00 0.00 H new ATOM 1018 N LEU A 77 8.772 13.563 3.303 1.00 0.00 N ATOM 1019 CA LEU A 77 8.349 12.379 2.548 1.00 0.00 C ATOM 1020 C LEU A 77 8.510 12.688 1.053 1.00 0.00 C ATOM 1021 O LEU A 77 8.536 13.860 0.687 1.00 0.00 O ATOM 1022 CB LEU A 77 6.877 12.071 2.899 1.00 0.00 C ATOM 1023 CG LEU A 77 6.710 11.184 4.136 1.00 0.00 C ATOM 1024 CD1 LEU A 77 5.268 11.282 4.614 1.00 0.00 C ATOM 1025 CD2 LEU A 77 7.103 9.724 3.900 1.00 0.00 C ATOM 0 H LEU A 77 8.024 13.981 3.857 1.00 0.00 H new ATOM 0 HA LEU A 77 8.953 11.507 2.798 1.00 0.00 H new ATOM 0 HB2 LEU A 77 6.348 13.010 3.062 1.00 0.00 H new ATOM 0 HB3 LEU A 77 6.404 11.583 2.047 1.00 0.00 H new ATOM 0 HG LEU A 77 7.396 11.550 4.900 1.00 0.00 H new ATOM 0 HD11 LEU A 77 5.133 10.655 5.495 1.00 0.00 H new ATOM 0 HD12 LEU A 77 5.038 12.317 4.867 1.00 0.00 H new ATOM 0 HD13 LEU A 77 4.599 10.944 3.823 1.00 0.00 H new ATOM 0 HD21 LEU A 77 6.959 9.155 4.819 1.00 0.00 H new ATOM 0 HD22 LEU A 77 6.480 9.303 3.111 1.00 0.00 H new ATOM 0 HD23 LEU A 77 8.150 9.673 3.602 1.00 0.00 H new ATOM 1037 N ALA A 78 8.576 11.653 0.210 1.00 0.00 N ATOM 1038 CA ALA A 78 8.773 11.772 -1.245 1.00 0.00 C ATOM 1039 C ALA A 78 7.949 12.899 -1.901 1.00 0.00 C ATOM 1040 O ALA A 78 8.488 13.705 -2.648 1.00 0.00 O ATOM 1041 CB ALA A 78 8.412 10.421 -1.873 1.00 0.00 C ATOM 0 H ALA A 78 8.493 10.686 0.523 1.00 0.00 H new ATOM 0 HA ALA A 78 9.815 12.039 -1.421 1.00 0.00 H new ATOM 0 HB1 ALA A 78 8.547 10.474 -2.953 1.00 0.00 H new ATOM 0 HB2 ALA A 78 9.059 9.645 -1.464 1.00 0.00 H new ATOM 0 HB3 ALA A 78 7.373 10.182 -1.649 1.00 0.00 H new ATOM 1047 N ASP A 79 6.660 12.964 -1.560 1.00 0.00 N ATOM 1048 CA ASP A 79 5.700 13.977 -1.994 1.00 0.00 C ATOM 1049 C ASP A 79 4.420 13.832 -1.155 1.00 0.00 C ATOM 1050 O ASP A 79 4.211 12.860 -0.415 1.00 0.00 O ATOM 1051 CB ASP A 79 5.409 13.836 -3.523 1.00 0.00 C ATOM 1052 CG ASP A 79 4.176 14.622 -4.018 1.00 0.00 C ATOM 1053 OD1 ASP A 79 4.158 15.864 -3.841 1.00 0.00 O ATOM 1054 OD2 ASP A 79 3.141 13.987 -4.328 1.00 0.00 O ATOM 0 H ASP A 79 6.237 12.273 -0.940 1.00 0.00 H new ATOM 0 HA ASP A 79 6.111 14.975 -1.840 1.00 0.00 H new ATOM 0 HB2 ASP A 79 6.285 14.172 -4.079 1.00 0.00 H new ATOM 0 HB3 ASP A 79 5.269 12.781 -3.757 1.00 0.00 H new ATOM 1059 N SER A 80 3.533 14.803 -1.350 1.00 0.00 N ATOM 1060 CA SER A 80 2.113 14.826 -1.010 1.00 0.00 C ATOM 1061 C SER A 80 1.481 13.431 -1.162 1.00 0.00 C ATOM 1062 O SER A 80 0.679 13.033 -0.326 1.00 0.00 O ATOM 1063 CB SER A 80 1.399 15.783 -1.990 1.00 0.00 C ATOM 1064 OG SER A 80 2.172 16.929 -2.319 1.00 0.00 O ATOM 0 H SER A 80 3.817 15.677 -1.792 1.00 0.00 H new ATOM 0 HA SER A 80 2.006 15.150 0.025 1.00 0.00 H new ATOM 0 HB2 SER A 80 1.157 15.242 -2.905 1.00 0.00 H new ATOM 0 HB3 SER A 80 0.455 16.104 -1.550 1.00 0.00 H new ATOM 0 HG SER A 80 2.835 16.692 -3.001 1.00 0.00 H new ATOM 1070 N HIS A 81 1.911 12.662 -2.177 1.00 0.00 N ATOM 1071 CA HIS A 81 1.656 11.243 -2.416 1.00 0.00 C ATOM 1072 C HIS A 81 1.673 10.398 -1.145 1.00 0.00 C ATOM 1073 O HIS A 81 0.648 9.832 -0.767 1.00 0.00 O ATOM 1074 CB HIS A 81 2.742 10.712 -3.386 1.00 0.00 C ATOM 1075 CG HIS A 81 2.553 11.053 -4.837 1.00 0.00 C ATOM 1076 ND1 HIS A 81 1.566 11.842 -5.376 1.00 0.00 N ATOM 1077 CD2 HIS A 81 3.195 10.446 -5.874 1.00 0.00 C ATOM 1078 CE1 HIS A 81 1.554 11.653 -6.702 1.00 0.00 C ATOM 1079 NE2 HIS A 81 2.607 10.884 -7.045 1.00 0.00 N ATOM 0 H HIS A 81 2.497 13.059 -2.912 1.00 0.00 H new ATOM 0 HA HIS A 81 0.653 11.158 -2.835 1.00 0.00 H new ATOM 0 HB2 HIS A 81 3.709 11.100 -3.065 1.00 0.00 H new ATOM 0 HB3 HIS A 81 2.787 9.627 -3.291 1.00 0.00 H new ATOM 0 HD1 HIS A 81 0.948 12.465 -4.856 1.00 0.00 H new ATOM 0 HD2 HIS A 81 4.016 9.748 -5.795 1.00 0.00 H new ATOM 0 HE1 HIS A 81 0.820 12.052 -7.386 1.00 0.00 H new ATOM 1088 N LEU A 82 2.847 10.254 -0.522 1.00 0.00 N ATOM 1089 CA LEU A 82 3.035 9.356 0.619 1.00 0.00 C ATOM 1090 C LEU A 82 2.501 10.014 1.886 1.00 0.00 C ATOM 1091 O LEU A 82 1.838 9.340 2.663 1.00 0.00 O ATOM 1092 CB LEU A 82 4.496 8.879 0.771 1.00 0.00 C ATOM 1093 CG LEU A 82 5.202 8.411 -0.520 1.00 0.00 C ATOM 1094 CD1 LEU A 82 6.585 7.854 -0.154 1.00 0.00 C ATOM 1095 CD2 LEU A 82 4.412 7.351 -1.298 1.00 0.00 C ATOM 0 H LEU A 82 3.692 10.756 -0.795 1.00 0.00 H new ATOM 0 HA LEU A 82 2.459 8.449 0.434 1.00 0.00 H new ATOM 0 HB2 LEU A 82 5.078 9.693 1.203 1.00 0.00 H new ATOM 0 HB3 LEU A 82 4.515 8.058 1.488 1.00 0.00 H new ATOM 0 HG LEU A 82 5.284 9.278 -1.175 1.00 0.00 H new ATOM 0 HD11 LEU A 82 7.094 7.520 -1.058 1.00 0.00 H new ATOM 0 HD12 LEU A 82 7.175 8.634 0.328 1.00 0.00 H new ATOM 0 HD13 LEU A 82 6.469 7.012 0.529 1.00 0.00 H new ATOM 0 HD21 LEU A 82 4.966 7.068 -2.193 1.00 0.00 H new ATOM 0 HD22 LEU A 82 4.265 6.473 -0.669 1.00 0.00 H new ATOM 0 HD23 LEU A 82 3.442 7.758 -1.585 1.00 0.00 H new ATOM 1107 N ALA A 83 2.645 11.336 2.039 1.00 0.00 N ATOM 1108 CA ALA A 83 1.987 12.088 3.109 1.00 0.00 C ATOM 1109 C ALA A 83 0.458 11.879 3.127 1.00 0.00 C ATOM 1110 O ALA A 83 -0.139 11.836 4.197 1.00 0.00 O ATOM 1111 CB ALA A 83 2.359 13.566 2.938 1.00 0.00 C ATOM 0 H ALA A 83 3.220 11.912 1.424 1.00 0.00 H new ATOM 0 HA ALA A 83 2.334 11.722 4.075 1.00 0.00 H new ATOM 0 HB1 ALA A 83 1.883 14.154 3.722 1.00 0.00 H new ATOM 0 HB2 ALA A 83 3.441 13.679 3.006 1.00 0.00 H new ATOM 0 HB3 ALA A 83 2.018 13.917 1.964 1.00 0.00 H new ATOM 1117 N ARG A 84 -0.169 11.712 1.959 1.00 0.00 N ATOM 1118 CA ARG A 84 -1.606 11.479 1.839 1.00 0.00 C ATOM 1119 C ARG A 84 -1.962 9.996 2.044 1.00 0.00 C ATOM 1120 O ARG A 84 -2.627 9.687 3.029 1.00 0.00 O ATOM 1121 CB ARG A 84 -2.084 12.086 0.504 1.00 0.00 C ATOM 1122 CG ARG A 84 -3.588 12.028 0.230 1.00 0.00 C ATOM 1123 CD ARG A 84 -4.436 12.540 1.402 1.00 0.00 C ATOM 1124 NE ARG A 84 -5.832 12.124 1.273 1.00 0.00 N ATOM 1125 CZ ARG A 84 -6.916 12.787 1.645 1.00 0.00 C ATOM 1126 NH1 ARG A 84 -6.910 14.084 1.880 1.00 0.00 N ATOM 1127 NH2 ARG A 84 -8.033 12.122 1.804 1.00 0.00 N ATOM 0 H ARG A 84 0.315 11.736 1.061 1.00 0.00 H new ATOM 0 HA ARG A 84 -2.150 11.984 2.638 1.00 0.00 H new ATOM 0 HB2 ARG A 84 -1.771 13.130 0.472 1.00 0.00 H new ATOM 0 HB3 ARG A 84 -1.569 11.573 -0.308 1.00 0.00 H new ATOM 0 HG2 ARG A 84 -3.812 12.619 -0.658 1.00 0.00 H new ATOM 0 HG3 ARG A 84 -3.871 10.999 0.007 1.00 0.00 H new ATOM 0 HD2 ARG A 84 -4.028 12.164 2.340 1.00 0.00 H new ATOM 0 HD3 ARG A 84 -4.381 13.628 1.444 1.00 0.00 H new ATOM 0 HE ARG A 84 -5.990 11.212 0.844 1.00 0.00 H new ATOM 0 HH11 ARG A 84 -6.046 14.617 1.777 1.00 0.00 H new ATOM 0 HH12 ARG A 84 -7.769 14.555 2.165 1.00 0.00 H new ATOM 0 HH21 ARG A 84 -8.055 11.115 1.642 1.00 0.00 H new ATOM 0 HH22 ARG A 84 -8.881 12.611 2.090 1.00 0.00 H new ATOM 1141 N ALA A 85 -1.431 9.084 1.221 1.00 0.00 N ATOM 1142 CA ALA A 85 -1.767 7.652 1.278 1.00 0.00 C ATOM 1143 C ALA A 85 -1.364 6.963 2.600 1.00 0.00 C ATOM 1144 O ALA A 85 -2.055 6.051 3.057 1.00 0.00 O ATOM 1145 CB ALA A 85 -1.125 6.953 0.069 1.00 0.00 C ATOM 0 H ALA A 85 -0.754 9.317 0.494 1.00 0.00 H new ATOM 0 HA ALA A 85 -2.853 7.566 1.241 1.00 0.00 H new ATOM 0 HB1 ALA A 85 -1.364 5.890 0.095 1.00 0.00 H new ATOM 0 HB2 ALA A 85 -1.512 7.390 -0.852 1.00 0.00 H new ATOM 0 HB3 ALA A 85 -0.043 7.083 0.106 1.00 0.00 H new ATOM 1151 N LEU A 86 -0.267 7.399 3.241 1.00 0.00 N ATOM 1152 CA LEU A 86 0.082 6.967 4.602 1.00 0.00 C ATOM 1153 C LEU A 86 -0.813 7.673 5.644 1.00 0.00 C ATOM 1154 O LEU A 86 -1.204 7.049 6.627 1.00 0.00 O ATOM 1155 CB LEU A 86 1.591 7.216 4.861 1.00 0.00 C ATOM 1156 CG LEU A 86 2.294 6.203 5.786 1.00 0.00 C ATOM 1157 CD1 LEU A 86 3.739 6.664 6.000 1.00 0.00 C ATOM 1158 CD2 LEU A 86 1.638 5.991 7.154 1.00 0.00 C ATOM 0 H LEU A 86 0.398 8.056 2.833 1.00 0.00 H new ATOM 0 HA LEU A 86 -0.101 5.897 4.701 1.00 0.00 H new ATOM 0 HB2 LEU A 86 2.108 7.221 3.901 1.00 0.00 H new ATOM 0 HB3 LEU A 86 1.706 8.211 5.291 1.00 0.00 H new ATOM 0 HG LEU A 86 2.225 5.241 5.278 1.00 0.00 H new ATOM 0 HD11 LEU A 86 4.253 5.959 6.653 1.00 0.00 H new ATOM 0 HD12 LEU A 86 4.252 6.710 5.040 1.00 0.00 H new ATOM 0 HD13 LEU A 86 3.741 7.652 6.460 1.00 0.00 H new ATOM 0 HD21 LEU A 86 2.212 5.260 7.723 1.00 0.00 H new ATOM 0 HD22 LEU A 86 1.614 6.936 7.696 1.00 0.00 H new ATOM 0 HD23 LEU A 86 0.620 5.626 7.017 1.00 0.00 H new ATOM 1170 N GLY A 87 -1.168 8.943 5.411 1.00 0.00 N ATOM 1171 CA GLY A 87 -1.901 9.807 6.346 1.00 0.00 C ATOM 1172 C GLY A 87 -3.369 9.422 6.546 1.00 0.00 C ATOM 1173 O GLY A 87 -3.836 9.416 7.683 1.00 0.00 O ATOM 0 H GLY A 87 -0.945 9.414 4.534 1.00 0.00 H new ATOM 0 HA2 GLY A 87 -1.398 9.785 7.313 1.00 0.00 H new ATOM 0 HA3 GLY A 87 -1.854 10.834 5.985 1.00 0.00 H new ATOM 1177 N GLU A 88 -4.098 9.084 5.474 1.00 0.00 N ATOM 1178 CA GLU A 88 -5.444 8.481 5.585 1.00 0.00 C ATOM 1179 C GLU A 88 -5.377 6.986 5.941 1.00 0.00 C ATOM 1180 O GLU A 88 -6.312 6.444 6.534 1.00 0.00 O ATOM 1181 CB GLU A 88 -6.289 8.775 4.337 1.00 0.00 C ATOM 1182 CG GLU A 88 -5.902 8.054 3.033 1.00 0.00 C ATOM 1183 CD GLU A 88 -6.068 9.020 1.861 1.00 0.00 C ATOM 1184 OE1 GLU A 88 -7.173 9.600 1.710 1.00 0.00 O ATOM 1185 OE2 GLU A 88 -5.048 9.389 1.240 1.00 0.00 O ATOM 0 H GLU A 88 -3.781 9.217 4.514 1.00 0.00 H new ATOM 0 HA GLU A 88 -5.958 8.956 6.421 1.00 0.00 H new ATOM 0 HB2 GLU A 88 -7.325 8.525 4.565 1.00 0.00 H new ATOM 0 HB3 GLU A 88 -6.254 9.849 4.152 1.00 0.00 H new ATOM 0 HG2 GLU A 88 -4.871 7.703 3.089 1.00 0.00 H new ATOM 0 HG3 GLU A 88 -6.530 7.175 2.888 1.00 0.00 H new ATOM 1192 N LEU A 89 -4.232 6.371 5.615 1.00 0.00 N ATOM 1193 CA LEU A 89 -3.723 5.067 6.035 1.00 0.00 C ATOM 1194 C LEU A 89 -4.318 3.890 5.257 1.00 0.00 C ATOM 1195 O LEU A 89 -5.508 3.828 4.972 1.00 0.00 O ATOM 1196 CB LEU A 89 -3.857 4.918 7.570 1.00 0.00 C ATOM 1197 CG LEU A 89 -3.088 3.747 8.210 1.00 0.00 C ATOM 1198 CD1 LEU A 89 -1.570 3.856 8.007 1.00 0.00 C ATOM 1199 CD2 LEU A 89 -3.400 3.682 9.712 1.00 0.00 C ATOM 0 H LEU A 89 -3.573 6.827 4.984 1.00 0.00 H new ATOM 0 HA LEU A 89 -2.663 5.032 5.783 1.00 0.00 H new ATOM 0 HB2 LEU A 89 -3.519 5.844 8.035 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -4.914 4.807 7.812 1.00 0.00 H new ATOM 0 HG LEU A 89 -3.419 2.835 7.713 1.00 0.00 H new ATOM 0 HD11 LEU A 89 -1.078 3.005 8.478 1.00 0.00 H new ATOM 0 HD12 LEU A 89 -1.345 3.861 6.940 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -1.208 4.780 8.458 1.00 0.00 H new ATOM 0 HD21 LEU A 89 -2.854 2.852 10.161 1.00 0.00 H new ATOM 0 HD22 LEU A 89 -3.097 4.615 10.187 1.00 0.00 H new ATOM 0 HD23 LEU A 89 -4.470 3.532 9.855 1.00 0.00 H new ATOM 1211 N VAL A 90 -3.479 2.866 5.067 1.00 0.00 N ATOM 1212 CA VAL A 90 -3.704 1.595 4.339 1.00 0.00 C ATOM 1213 C VAL A 90 -4.986 0.816 4.669 1.00 0.00 C ATOM 1214 O VAL A 90 -5.249 -0.212 4.045 1.00 0.00 O ATOM 1215 CB VAL A 90 -2.540 0.608 4.587 1.00 0.00 C ATOM 1216 CG1 VAL A 90 -1.277 1.030 3.825 1.00 0.00 C ATOM 1217 CG2 VAL A 90 -2.220 0.445 6.088 1.00 0.00 C ATOM 0 H VAL A 90 -2.535 2.901 5.452 1.00 0.00 H new ATOM 0 HA VAL A 90 -3.787 1.938 3.308 1.00 0.00 H new ATOM 0 HB VAL A 90 -2.872 -0.359 4.209 1.00 0.00 H new ATOM 0 HG11 VAL A 90 -0.478 0.315 4.021 1.00 0.00 H new ATOM 0 HG12 VAL A 90 -1.488 1.054 2.756 1.00 0.00 H new ATOM 0 HG13 VAL A 90 -0.966 2.021 4.156 1.00 0.00 H new ATOM 0 HG21 VAL A 90 -1.396 -0.258 6.210 1.00 0.00 H new ATOM 0 HG22 VAL A 90 -1.938 1.411 6.507 1.00 0.00 H new ATOM 0 HG23 VAL A 90 -3.100 0.067 6.609 1.00 0.00 H new ATOM 1227 N GLN A 91 -5.740 1.239 5.684 1.00 0.00 N ATOM 1228 CA GLN A 91 -7.047 0.760 6.089 1.00 0.00 C ATOM 1229 C GLN A 91 -6.994 -0.595 6.799 1.00 0.00 C ATOM 1230 O GLN A 91 -7.632 -0.712 7.836 1.00 0.00 O ATOM 1231 CB GLN A 91 -8.006 0.779 4.885 1.00 0.00 C ATOM 1232 CG GLN A 91 -8.704 2.132 4.651 1.00 0.00 C ATOM 1233 CD GLN A 91 -9.689 2.521 5.750 1.00 0.00 C ATOM 1234 OE1 GLN A 91 -10.856 2.167 5.721 1.00 0.00 O ATOM 1235 NE2 GLN A 91 -9.262 3.220 6.781 1.00 0.00 N ATOM 0 H GLN A 91 -5.417 1.991 6.292 1.00 0.00 H new ATOM 0 HA GLN A 91 -7.441 1.443 6.841 1.00 0.00 H new ATOM 0 HB2 GLN A 91 -7.449 0.511 3.987 1.00 0.00 H new ATOM 0 HB3 GLN A 91 -8.766 0.011 5.029 1.00 0.00 H new ATOM 0 HG2 GLN A 91 -7.946 2.910 4.565 1.00 0.00 H new ATOM 0 HG3 GLN A 91 -9.233 2.096 3.699 1.00 0.00 H new ATOM 0 HE21 GLN A 91 -8.290 3.525 6.823 1.00 0.00 H new ATOM 0 HE22 GLN A 91 -9.904 3.457 7.538 1.00 0.00 H new ATOM 1244 N VAL A 92 -6.214 -1.553 6.285 1.00 0.00 N ATOM 1245 CA VAL A 92 -6.051 -3.004 6.560 1.00 0.00 C ATOM 1246 C VAL A 92 -5.830 -3.455 8.019 1.00 0.00 C ATOM 1247 O VAL A 92 -4.935 -4.223 8.358 1.00 0.00 O ATOM 1248 CB VAL A 92 -4.947 -3.502 5.597 1.00 0.00 C ATOM 1249 CG1 VAL A 92 -3.551 -3.002 6.015 1.00 0.00 C ATOM 1250 CG2 VAL A 92 -4.941 -5.005 5.327 1.00 0.00 C ATOM 0 H VAL A 92 -5.571 -1.289 5.539 1.00 0.00 H new ATOM 0 HA VAL A 92 -7.018 -3.473 6.381 1.00 0.00 H new ATOM 0 HB VAL A 92 -5.209 -3.051 4.640 1.00 0.00 H new ATOM 0 HG11 VAL A 92 -2.806 -3.375 5.312 1.00 0.00 H new ATOM 0 HG12 VAL A 92 -3.539 -1.912 6.013 1.00 0.00 H new ATOM 0 HG13 VAL A 92 -3.319 -3.365 7.016 1.00 0.00 H new ATOM 0 HG21 VAL A 92 -4.130 -5.248 4.641 1.00 0.00 H new ATOM 0 HG22 VAL A 92 -4.797 -5.542 6.264 1.00 0.00 H new ATOM 0 HG23 VAL A 92 -5.892 -5.299 4.883 1.00 0.00 H new ATOM 1260 N VAL A 93 -6.626 -2.878 8.906 1.00 0.00 N ATOM 1261 CA VAL A 93 -6.588 -2.962 10.366 1.00 0.00 C ATOM 1262 C VAL A 93 -5.251 -2.467 10.958 1.00 0.00 C ATOM 1263 O VAL A 93 -5.013 -2.631 12.150 1.00 0.00 O ATOM 1264 CB VAL A 93 -6.978 -4.374 10.902 1.00 0.00 C ATOM 1265 CG1 VAL A 93 -7.838 -4.192 12.160 1.00 0.00 C ATOM 1266 CG2 VAL A 93 -7.824 -5.235 9.941 1.00 0.00 C ATOM 0 H VAL A 93 -7.391 -2.280 8.595 1.00 0.00 H new ATOM 0 HA VAL A 93 -7.357 -2.275 10.719 1.00 0.00 H new ATOM 0 HB VAL A 93 -6.031 -4.888 11.064 1.00 0.00 H new ATOM 0 HG11 VAL A 93 -8.122 -5.169 12.551 1.00 0.00 H new ATOM 0 HG12 VAL A 93 -7.268 -3.650 12.915 1.00 0.00 H new ATOM 0 HG13 VAL A 93 -8.736 -3.627 11.908 1.00 0.00 H new ATOM 0 HG21 VAL A 93 -8.041 -6.196 10.408 1.00 0.00 H new ATOM 0 HG22 VAL A 93 -8.759 -4.720 9.719 1.00 0.00 H new ATOM 0 HG23 VAL A 93 -7.271 -5.398 9.016 1.00 0.00 H new ATOM 1276 N LEU A 94 -4.410 -1.839 10.111 1.00 0.00 N ATOM 1277 CA LEU A 94 -2.990 -1.534 10.315 1.00 0.00 C ATOM 1278 C LEU A 94 -2.238 -2.865 10.132 1.00 0.00 C ATOM 1279 O LEU A 94 -2.423 -3.808 10.897 1.00 0.00 O ATOM 1280 CB LEU A 94 -2.724 -0.847 11.675 1.00 0.00 C ATOM 1281 CG LEU A 94 -1.413 -0.038 11.765 1.00 0.00 C ATOM 1282 CD1 LEU A 94 -1.394 0.733 13.093 1.00 0.00 C ATOM 1283 CD2 LEU A 94 -0.149 -0.908 11.671 1.00 0.00 C ATOM 0 H LEU A 94 -4.735 -1.510 9.202 1.00 0.00 H new ATOM 0 HA LEU A 94 -2.631 -0.802 9.591 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -3.558 -0.180 11.895 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -2.713 -1.611 12.452 1.00 0.00 H new ATOM 0 HG LEU A 94 -1.396 0.637 10.909 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -0.471 1.308 13.167 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -2.248 1.410 13.133 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -1.450 0.029 13.923 1.00 0.00 H new ATOM 0 HD21 LEU A 94 0.735 -0.274 11.741 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -0.143 -1.631 12.487 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -0.141 -1.437 10.718 1.00 0.00 H new ATOM 1295 N ALA A 95 -1.413 -2.974 9.090 1.00 0.00 N ATOM 1296 CA ALA A 95 -0.680 -4.207 8.767 1.00 0.00 C ATOM 1297 C ALA A 95 0.382 -4.564 9.840 1.00 0.00 C ATOM 1298 O ALA A 95 1.562 -4.296 9.656 1.00 0.00 O ATOM 1299 CB ALA A 95 -0.095 -4.069 7.351 1.00 0.00 C ATOM 0 H ALA A 95 -1.231 -2.208 8.441 1.00 0.00 H new ATOM 0 HA ALA A 95 -1.367 -5.053 8.778 1.00 0.00 H new ATOM 0 HB1 ALA A 95 0.453 -4.975 7.094 1.00 0.00 H new ATOM 0 HB2 ALA A 95 -0.904 -3.919 6.636 1.00 0.00 H new ATOM 0 HB3 ALA A 95 0.581 -3.215 7.318 1.00 0.00 H new ATOM 1305 N VAL A 96 -0.052 -5.125 10.970 1.00 0.00 N ATOM 1306 CA VAL A 96 0.779 -5.442 12.152 1.00 0.00 C ATOM 1307 C VAL A 96 1.956 -6.381 11.867 1.00 0.00 C ATOM 1308 O VAL A 96 1.804 -7.363 11.139 1.00 0.00 O ATOM 1309 CB VAL A 96 -0.054 -6.060 13.302 1.00 0.00 C ATOM 1310 CG1 VAL A 96 -0.859 -4.969 14.012 1.00 0.00 C ATOM 1311 CG2 VAL A 96 -1.021 -7.167 12.836 1.00 0.00 C ATOM 0 H VAL A 96 -1.030 -5.385 11.100 1.00 0.00 H new ATOM 0 HA VAL A 96 1.182 -4.473 12.447 1.00 0.00 H new ATOM 0 HB VAL A 96 0.664 -6.520 13.980 1.00 0.00 H new ATOM 0 HG11 VAL A 96 -1.441 -5.414 14.819 1.00 0.00 H new ATOM 0 HG12 VAL A 96 -0.178 -4.224 14.424 1.00 0.00 H new ATOM 0 HG13 VAL A 96 -1.532 -4.491 13.300 1.00 0.00 H new ATOM 0 HG21 VAL A 96 -1.571 -7.554 13.694 1.00 0.00 H new ATOM 0 HG22 VAL A 96 -1.723 -6.756 12.110 1.00 0.00 H new ATOM 0 HG23 VAL A 96 -0.454 -7.975 12.374 1.00 0.00 H new ATOM 1321 N ASP A 97 3.096 -6.093 12.510 1.00 0.00 N ATOM 1322 CA ASP A 97 4.326 -6.896 12.573 1.00 0.00 C ATOM 1323 C ASP A 97 3.996 -8.345 12.986 1.00 0.00 C ATOM 1324 O ASP A 97 3.679 -8.614 14.148 1.00 0.00 O ATOM 1325 CB ASP A 97 5.348 -6.250 13.552 1.00 0.00 C ATOM 1326 CG ASP A 97 5.554 -4.727 13.428 1.00 0.00 C ATOM 1327 OD1 ASP A 97 4.559 -3.973 13.505 1.00 0.00 O ATOM 1328 OD2 ASP A 97 6.701 -4.233 13.331 1.00 0.00 O ATOM 0 H ASP A 97 3.190 -5.227 13.040 1.00 0.00 H new ATOM 0 HA ASP A 97 4.782 -6.921 11.583 1.00 0.00 H new ATOM 0 HB2 ASP A 97 5.029 -6.469 14.571 1.00 0.00 H new ATOM 0 HB3 ASP A 97 6.312 -6.737 13.408 1.00 0.00 H new ATOM 1333 N THR A 98 4.016 -9.272 12.016 1.00 0.00 N ATOM 1334 CA THR A 98 3.510 -10.653 12.168 1.00 0.00 C ATOM 1335 C THR A 98 4.222 -11.602 11.220 1.00 0.00 C ATOM 1336 O THR A 98 4.999 -12.435 11.668 1.00 0.00 O ATOM 1337 CB THR A 98 1.985 -10.758 11.954 1.00 0.00 C ATOM 1338 OG1 THR A 98 1.594 -10.024 10.816 1.00 0.00 O ATOM 1339 CG2 THR A 98 1.159 -10.278 13.145 1.00 0.00 C ATOM 0 H THR A 98 4.390 -9.084 11.086 1.00 0.00 H new ATOM 0 HA THR A 98 3.721 -10.940 13.198 1.00 0.00 H new ATOM 0 HB THR A 98 1.785 -11.821 11.823 1.00 0.00 H new ATOM 0 HG1 THR A 98 1.584 -9.068 11.031 1.00 0.00 H new ATOM 0 HG21 THR A 98 0.098 -10.383 12.918 1.00 0.00 H new ATOM 0 HG22 THR A 98 1.403 -10.877 14.022 1.00 0.00 H new ATOM 0 HG23 THR A 98 1.385 -9.231 13.346 1.00 0.00 H new ATOM 1347 N ASP A 99 3.899 -11.482 9.935 1.00 0.00 N ATOM 1348 CA ASP A 99 4.543 -12.138 8.788 1.00 0.00 C ATOM 1349 C ASP A 99 4.397 -13.661 8.811 1.00 0.00 C ATOM 1350 O ASP A 99 5.310 -14.442 8.534 1.00 0.00 O ATOM 1351 CB ASP A 99 5.962 -11.604 8.554 1.00 0.00 C ATOM 1352 CG ASP A 99 5.859 -10.186 7.998 1.00 0.00 C ATOM 1353 OD1 ASP A 99 5.369 -10.065 6.851 1.00 0.00 O ATOM 1354 OD2 ASP A 99 6.182 -9.228 8.729 1.00 0.00 O ATOM 0 H ASP A 99 3.127 -10.883 9.642 1.00 0.00 H new ATOM 0 HA ASP A 99 3.995 -11.857 7.889 1.00 0.00 H new ATOM 0 HB2 ASP A 99 6.526 -11.605 9.487 1.00 0.00 H new ATOM 0 HB3 ASP A 99 6.499 -12.247 7.856 1.00 0.00 H new ATOM 1359 N GLN A 100 3.176 -14.078 9.138 1.00 0.00 N ATOM 1360 CA GLN A 100 2.739 -15.450 8.981 1.00 0.00 C ATOM 1361 C GLN A 100 2.675 -15.827 7.485 1.00 0.00 C ATOM 1362 O GLN A 100 2.534 -14.934 6.635 1.00 0.00 O ATOM 1363 CB GLN A 100 1.366 -15.645 9.658 1.00 0.00 C ATOM 1364 CG GLN A 100 1.454 -15.948 11.161 1.00 0.00 C ATOM 1365 CD GLN A 100 1.856 -14.736 11.991 1.00 0.00 C ATOM 1366 OE1 GLN A 100 1.024 -13.937 12.379 1.00 0.00 O ATOM 1367 NE2 GLN A 100 3.127 -14.545 12.277 1.00 0.00 N ATOM 0 H GLN A 100 2.460 -13.461 9.523 1.00 0.00 H new ATOM 0 HA GLN A 100 3.460 -16.110 9.464 1.00 0.00 H new ATOM 0 HB2 GLN A 100 0.768 -14.745 9.513 1.00 0.00 H new ATOM 0 HB3 GLN A 100 0.839 -16.461 9.163 1.00 0.00 H new ATOM 0 HG2 GLN A 100 0.489 -16.315 11.509 1.00 0.00 H new ATOM 0 HG3 GLN A 100 2.177 -16.748 11.323 1.00 0.00 H new ATOM 0 HE21 GLN A 100 3.828 -15.212 11.954 1.00 0.00 H new ATOM 0 HE22 GLN A 100 3.410 -13.730 12.821 1.00 0.00 H new ATOM 1376 N PRO A 101 2.732 -17.137 7.156 1.00 0.00 N ATOM 1377 CA PRO A 101 2.460 -17.642 5.815 1.00 0.00 C ATOM 1378 C PRO A 101 1.042 -17.291 5.365 1.00 0.00 C ATOM 1379 O PRO A 101 0.177 -16.961 6.179 1.00 0.00 O ATOM 1380 CB PRO A 101 2.696 -19.155 5.866 1.00 0.00 C ATOM 1381 CG PRO A 101 2.495 -19.503 7.337 1.00 0.00 C ATOM 1382 CD PRO A 101 2.996 -18.254 8.058 1.00 0.00 C ATOM 0 HA PRO A 101 3.117 -17.181 5.078 1.00 0.00 H new ATOM 0 HB2 PRO A 101 1.994 -19.692 5.228 1.00 0.00 H new ATOM 0 HB3 PRO A 101 3.698 -19.416 5.526 1.00 0.00 H new ATOM 0 HG2 PRO A 101 1.449 -19.707 7.564 1.00 0.00 H new ATOM 0 HG3 PRO A 101 3.062 -20.389 7.623 1.00 0.00 H new ATOM 0 HD2 PRO A 101 2.480 -18.119 9.009 1.00 0.00 H new ATOM 0 HD3 PRO A 101 4.060 -18.332 8.281 1.00 0.00 H new ATOM 1390 N CYS A 102 0.808 -17.361 4.051 1.00 0.00 N ATOM 1391 CA CYS A 102 -0.473 -17.028 3.457 1.00 0.00 C ATOM 1392 C CYS A 102 -1.593 -17.941 4.007 1.00 0.00 C ATOM 1393 O CYS A 102 -1.390 -19.131 4.240 1.00 0.00 O ATOM 1394 CB CYS A 102 -0.306 -17.089 1.926 1.00 0.00 C ATOM 1395 SG CYS A 102 -0.730 -15.580 1.014 1.00 0.00 S ATOM 0 H CYS A 102 1.512 -17.653 3.373 1.00 0.00 H new ATOM 0 HA CYS A 102 -0.786 -16.019 3.725 1.00 0.00 H new ATOM 0 HB2 CYS A 102 0.730 -17.344 1.704 1.00 0.00 H new ATOM 0 HB3 CYS A 102 -0.923 -17.904 1.546 1.00 0.00 H new ATOM 0 HG CYS A 102 -1.890 -15.146 1.409 1.00 0.00 H new ATOM 1476 N LEU B 11 1.749 -7.980 7.876 1.00 0.00 N ATOM 1477 CA LEU B 11 2.708 -6.916 7.473 1.00 0.00 C ATOM 1478 C LEU B 11 3.298 -7.017 6.053 1.00 0.00 C ATOM 1479 O LEU B 11 2.664 -6.558 5.100 1.00 0.00 O ATOM 1480 CB LEU B 11 3.772 -6.705 8.580 1.00 0.00 C ATOM 1481 CG LEU B 11 4.887 -5.664 8.308 1.00 0.00 C ATOM 1482 CD1 LEU B 11 4.348 -4.295 7.872 1.00 0.00 C ATOM 1483 CD2 LEU B 11 5.772 -5.467 9.543 1.00 0.00 C ATOM 0 HA LEU B 11 2.110 -6.009 7.383 1.00 0.00 H new ATOM 0 HB2 LEU B 11 3.254 -6.413 9.494 1.00 0.00 H new ATOM 0 HB3 LEU B 11 4.249 -7.665 8.777 1.00 0.00 H new ATOM 0 HG LEU B 11 5.470 -6.076 7.484 1.00 0.00 H new ATOM 0 HD11 LEU B 11 5.181 -3.614 7.698 1.00 0.00 H new ATOM 0 HD12 LEU B 11 3.773 -4.406 6.953 1.00 0.00 H new ATOM 0 HD13 LEU B 11 3.706 -3.890 8.655 1.00 0.00 H new ATOM 0 HD21 LEU B 11 6.545 -4.731 9.323 1.00 0.00 H new ATOM 0 HD22 LEU B 11 5.162 -5.115 10.375 1.00 0.00 H new ATOM 0 HD23 LEU B 11 6.239 -6.415 9.811 1.00 0.00 H new ATOM 1495 N ALA B 12 4.500 -7.578 5.884 1.00 0.00 N ATOM 1496 CA ALA B 12 5.246 -7.524 4.629 1.00 0.00 C ATOM 1497 C ALA B 12 4.636 -8.462 3.587 1.00 0.00 C ATOM 1498 O ALA B 12 4.589 -8.106 2.407 1.00 0.00 O ATOM 1499 CB ALA B 12 6.727 -7.819 4.909 1.00 0.00 C ATOM 0 H ALA B 12 4.984 -8.087 6.624 1.00 0.00 H new ATOM 0 HA ALA B 12 5.181 -6.523 4.202 1.00 0.00 H new ATOM 0 HB1 ALA B 12 7.289 -7.780 3.976 1.00 0.00 H new ATOM 0 HB2 ALA B 12 7.122 -7.075 5.601 1.00 0.00 H new ATOM 0 HB3 ALA B 12 6.823 -8.811 5.349 1.00 0.00 H new ATOM 1505 N ARG B 13 4.078 -9.611 3.999 1.00 0.00 N ATOM 1506 CA ARG B 13 3.273 -10.446 3.095 1.00 0.00 C ATOM 1507 C ARG B 13 2.129 -9.631 2.478 1.00 0.00 C ATOM 1508 O ARG B 13 1.968 -9.674 1.259 1.00 0.00 O ATOM 1509 CB ARG B 13 2.772 -11.720 3.799 1.00 0.00 C ATOM 1510 CG ARG B 13 1.779 -12.512 2.920 1.00 0.00 C ATOM 1511 CD ARG B 13 1.438 -13.913 3.449 1.00 0.00 C ATOM 1512 NE ARG B 13 2.269 -14.959 2.826 1.00 0.00 N ATOM 1513 CZ ARG B 13 3.468 -15.366 3.230 1.00 0.00 C ATOM 1514 NH1 ARG B 13 4.065 -14.868 4.293 1.00 0.00 N ATOM 1515 NH2 ARG B 13 4.094 -16.335 2.605 1.00 0.00 N ATOM 0 H ARG B 13 4.169 -9.981 4.945 1.00 0.00 H new ATOM 0 HA ARG B 13 3.913 -10.777 2.277 1.00 0.00 H new ATOM 0 HB2 ARG B 13 3.622 -12.355 4.048 1.00 0.00 H new ATOM 0 HB3 ARG B 13 2.290 -11.450 4.738 1.00 0.00 H new ATOM 0 HG2 ARG B 13 0.857 -11.938 2.828 1.00 0.00 H new ATOM 0 HG3 ARG B 13 2.197 -12.608 1.918 1.00 0.00 H new ATOM 0 HD2 ARG B 13 1.578 -13.936 4.530 1.00 0.00 H new ATOM 0 HD3 ARG B 13 0.386 -14.126 3.259 1.00 0.00 H new ATOM 0 HE ARG B 13 1.884 -15.418 2.000 1.00 0.00 H new ATOM 0 HH11 ARG B 13 3.606 -14.141 4.842 1.00 0.00 H new ATOM 0 HH12 ARG B 13 4.986 -15.210 4.568 1.00 0.00 H new ATOM 0 HH21 ARG B 13 3.661 -16.785 1.799 1.00 0.00 H new ATOM 0 HH22 ARG B 13 5.014 -16.638 2.925 1.00 0.00 H new ATOM 1529 N LEU B 14 1.379 -8.854 3.274 1.00 0.00 N ATOM 1530 CA LEU B 14 0.251 -8.028 2.822 1.00 0.00 C ATOM 1531 C LEU B 14 0.691 -7.042 1.740 1.00 0.00 C ATOM 1532 O LEU B 14 0.086 -7.035 0.667 1.00 0.00 O ATOM 1533 CB LEU B 14 -0.431 -7.360 4.041 1.00 0.00 C ATOM 1534 CG LEU B 14 -1.630 -6.410 3.803 1.00 0.00 C ATOM 1535 CD1 LEU B 14 -1.225 -5.026 3.265 1.00 0.00 C ATOM 1536 CD2 LEU B 14 -2.717 -7.021 2.906 1.00 0.00 C ATOM 0 H LEU B 14 1.546 -8.781 4.278 1.00 0.00 H new ATOM 0 HA LEU B 14 -0.502 -8.658 2.348 1.00 0.00 H new ATOM 0 HB2 LEU B 14 -0.768 -8.155 4.706 1.00 0.00 H new ATOM 0 HB3 LEU B 14 0.333 -6.798 4.578 1.00 0.00 H new ATOM 0 HG LEU B 14 -2.051 -6.267 4.798 1.00 0.00 H new ATOM 0 HD11 LEU B 14 -2.117 -4.416 3.123 1.00 0.00 H new ATOM 0 HD12 LEU B 14 -0.561 -4.538 3.979 1.00 0.00 H new ATOM 0 HD13 LEU B 14 -0.710 -5.143 2.312 1.00 0.00 H new ATOM 0 HD21 LEU B 14 -3.529 -6.305 2.779 1.00 0.00 H new ATOM 0 HD22 LEU B 14 -2.291 -7.264 1.932 1.00 0.00 H new ATOM 0 HD23 LEU B 14 -3.103 -7.929 3.370 1.00 0.00 H new ATOM 1548 N GLY B 15 1.770 -6.280 1.948 1.00 0.00 N ATOM 1549 CA GLY B 15 2.266 -5.352 0.918 1.00 0.00 C ATOM 1550 C GLY B 15 2.635 -6.059 -0.392 1.00 0.00 C ATOM 1551 O GLY B 15 2.407 -5.509 -1.466 1.00 0.00 O ATOM 0 H GLY B 15 2.314 -6.284 2.811 1.00 0.00 H new ATOM 0 HA2 GLY B 15 1.504 -4.599 0.717 1.00 0.00 H new ATOM 0 HA3 GLY B 15 3.141 -4.826 1.300 1.00 0.00 H new ATOM 1555 N ARG B 16 3.092 -7.315 -0.309 1.00 0.00 N ATOM 1556 CA ARG B 16 3.385 -8.190 -1.455 1.00 0.00 C ATOM 1557 C ARG B 16 2.202 -9.064 -1.924 1.00 0.00 C ATOM 1558 O ARG B 16 2.383 -9.889 -2.820 1.00 0.00 O ATOM 1559 CB ARG B 16 4.608 -9.073 -1.137 1.00 0.00 C ATOM 1560 CG ARG B 16 5.554 -9.176 -2.346 1.00 0.00 C ATOM 1561 CD ARG B 16 6.145 -10.575 -2.531 1.00 0.00 C ATOM 1562 NE ARG B 16 5.183 -11.464 -3.201 1.00 0.00 N ATOM 1563 CZ ARG B 16 5.521 -12.495 -3.973 1.00 0.00 C ATOM 1564 NH1 ARG B 16 6.756 -12.933 -4.058 1.00 0.00 N ATOM 1565 NH2 ARG B 16 4.614 -13.101 -4.699 1.00 0.00 N ATOM 0 H ARG B 16 3.275 -7.767 0.587 1.00 0.00 H new ATOM 0 HA ARG B 16 3.596 -7.523 -2.291 1.00 0.00 H new ATOM 0 HB2 ARG B 16 5.147 -8.658 -0.285 1.00 0.00 H new ATOM 0 HB3 ARG B 16 4.274 -10.070 -0.848 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.011 -8.896 -3.249 1.00 0.00 H new ATOM 0 HG3 ARG B 16 6.366 -8.459 -2.226 1.00 0.00 H new ATOM 0 HD2 ARG B 16 7.061 -10.513 -3.119 1.00 0.00 H new ATOM 0 HD3 ARG B 16 6.417 -10.991 -1.561 1.00 0.00 H new ATOM 0 HE ARG B 16 4.189 -11.278 -3.065 1.00 0.00 H new ATOM 0 HH11 ARG B 16 7.496 -12.480 -3.521 1.00 0.00 H new ATOM 0 HH12 ARG B 16 6.976 -13.726 -4.661 1.00 0.00 H new ATOM 0 HH21 ARG B 16 3.645 -12.783 -4.674 1.00 0.00 H new ATOM 0 HH22 ARG B 16 4.877 -13.890 -5.289 1.00 0.00 H new ATOM 1579 N ALA B 17 1.017 -8.923 -1.319 1.00 0.00 N ATOM 1580 CA ALA B 17 -0.261 -9.537 -1.699 1.00 0.00 C ATOM 1581 C ALA B 17 -1.218 -8.511 -2.345 1.00 0.00 C ATOM 1582 O ALA B 17 -2.175 -8.899 -3.026 1.00 0.00 O ATOM 1583 CB ALA B 17 -0.874 -10.182 -0.440 1.00 0.00 C ATOM 0 H ALA B 17 0.919 -8.335 -0.492 1.00 0.00 H new ATOM 0 HA ALA B 17 -0.092 -10.302 -2.456 1.00 0.00 H new ATOM 0 HB1 ALA B 17 -1.826 -10.646 -0.696 1.00 0.00 H new ATOM 0 HB2 ALA B 17 -0.194 -10.940 -0.052 1.00 0.00 H new ATOM 0 HB3 ALA B 17 -1.036 -9.417 0.319 1.00 0.00 H new ATOM 1589 N LEU B 18 -0.951 -7.210 -2.154 1.00 0.00 N ATOM 1590 CA LEU B 18 -1.610 -6.131 -2.901 1.00 0.00 C ATOM 1591 C LEU B 18 -0.781 -5.730 -4.125 1.00 0.00 C ATOM 1592 O LEU B 18 -1.334 -5.610 -5.217 1.00 0.00 O ATOM 1593 CB LEU B 18 -1.913 -4.926 -1.983 1.00 0.00 C ATOM 1594 CG LEU B 18 -3.392 -4.901 -1.536 1.00 0.00 C ATOM 1595 CD1 LEU B 18 -3.680 -6.001 -0.509 1.00 0.00 C ATOM 1596 CD2 LEU B 18 -3.777 -3.543 -0.933 1.00 0.00 C ATOM 0 H LEU B 18 -0.268 -6.877 -1.473 1.00 0.00 H new ATOM 0 HA LEU B 18 -2.567 -6.501 -3.267 1.00 0.00 H new ATOM 0 HB2 LEU B 18 -1.269 -4.967 -1.105 1.00 0.00 H new ATOM 0 HB3 LEU B 18 -1.677 -4.001 -2.508 1.00 0.00 H new ATOM 0 HG LEU B 18 -3.991 -5.075 -2.430 1.00 0.00 H new ATOM 0 HD11 LEU B 18 -4.728 -5.958 -0.214 1.00 0.00 H new ATOM 0 HD12 LEU B 18 -3.467 -6.975 -0.950 1.00 0.00 H new ATOM 0 HD13 LEU B 18 -3.050 -5.854 0.368 1.00 0.00 H new ATOM 0 HD21 LEU B 18 -4.824 -3.563 -0.630 1.00 0.00 H new ATOM 0 HD22 LEU B 18 -3.152 -3.341 -0.064 1.00 0.00 H new ATOM 0 HD23 LEU B 18 -3.629 -2.760 -1.676 1.00 0.00 H new ATOM 1608 N ALA B 19 0.535 -5.574 -3.969 1.00 0.00 N ATOM 1609 CA ALA B 19 1.453 -5.347 -5.079 1.00 0.00 C ATOM 1610 C ALA B 19 1.802 -6.674 -5.781 1.00 0.00 C ATOM 1611 O ALA B 19 2.908 -7.197 -5.662 1.00 0.00 O ATOM 1612 CB ALA B 19 2.664 -4.572 -4.561 1.00 0.00 C ATOM 0 H ALA B 19 0.994 -5.603 -3.059 1.00 0.00 H new ATOM 0 HA ALA B 19 0.986 -4.736 -5.852 1.00 0.00 H new ATOM 0 HB1 ALA B 19 3.360 -4.395 -5.381 1.00 0.00 H new ATOM 0 HB2 ALA B 19 2.336 -3.617 -4.150 1.00 0.00 H new ATOM 0 HB3 ALA B 19 3.160 -5.151 -3.782 1.00 0.00 H new ATOM 1618 N ASP B 20 0.811 -7.218 -6.482 1.00 0.00 N ATOM 1619 CA ASP B 20 0.848 -8.425 -7.312 1.00 0.00 C ATOM 1620 C ASP B 20 0.295 -8.009 -8.702 1.00 0.00 C ATOM 1621 O ASP B 20 -0.732 -7.326 -8.742 1.00 0.00 O ATOM 1622 CB ASP B 20 0.028 -9.499 -6.569 1.00 0.00 C ATOM 1623 CG ASP B 20 -0.009 -10.882 -7.232 1.00 0.00 C ATOM 1624 OD1 ASP B 20 -0.375 -10.942 -8.425 1.00 0.00 O ATOM 1625 OD2 ASP B 20 0.203 -11.888 -6.517 1.00 0.00 O ATOM 0 H ASP B 20 -0.116 -6.793 -6.486 1.00 0.00 H new ATOM 0 HA ASP B 20 1.837 -8.853 -7.478 1.00 0.00 H new ATOM 0 HB2 ASP B 20 0.434 -9.609 -5.563 1.00 0.00 H new ATOM 0 HB3 ASP B 20 -0.996 -9.140 -6.462 1.00 0.00 H new ATOM 1630 N PRO B 21 0.943 -8.369 -9.833 1.00 0.00 N ATOM 1631 CA PRO B 21 0.720 -7.822 -11.190 1.00 0.00 C ATOM 1632 C PRO B 21 -0.737 -7.846 -11.692 1.00 0.00 C ATOM 1633 O PRO B 21 -1.522 -6.921 -11.453 1.00 0.00 O ATOM 1634 CB PRO B 21 1.693 -8.620 -12.089 1.00 0.00 C ATOM 1635 CG PRO B 21 1.784 -9.954 -11.343 1.00 0.00 C ATOM 1636 CD PRO B 21 1.941 -9.427 -9.921 1.00 0.00 C ATOM 0 HA PRO B 21 0.917 -6.750 -11.202 1.00 0.00 H new ATOM 0 HB2 PRO B 21 1.307 -8.743 -13.101 1.00 0.00 H new ATOM 0 HB3 PRO B 21 2.664 -8.132 -12.175 1.00 0.00 H new ATOM 0 HG2 PRO B 21 0.891 -10.567 -11.468 1.00 0.00 H new ATOM 0 HG3 PRO B 21 2.633 -10.558 -11.664 1.00 0.00 H new ATOM 0 HD2 PRO B 21 1.762 -10.208 -9.182 1.00 0.00 H new ATOM 0 HD3 PRO B 21 2.946 -9.045 -9.744 1.00 0.00 H new ATOM 1644 N THR B 22 -1.109 -8.902 -12.427 1.00 0.00 N ATOM 1645 CA THR B 22 -2.451 -9.133 -12.973 1.00 0.00 C ATOM 1646 C THR B 22 -3.497 -9.170 -11.867 1.00 0.00 C ATOM 1647 O THR B 22 -4.660 -8.856 -12.096 1.00 0.00 O ATOM 1648 CB THR B 22 -2.466 -10.463 -13.729 1.00 0.00 C ATOM 1649 OG1 THR B 22 -1.303 -10.569 -14.513 1.00 0.00 O ATOM 1650 CG2 THR B 22 -3.660 -10.572 -14.672 1.00 0.00 C ATOM 0 H THR B 22 -0.456 -9.648 -12.667 1.00 0.00 H new ATOM 0 HA THR B 22 -2.694 -8.312 -13.647 1.00 0.00 H new ATOM 0 HB THR B 22 -2.525 -11.255 -12.982 1.00 0.00 H new ATOM 0 HG1 THR B 22 -1.311 -11.421 -14.996 1.00 0.00 H new ATOM 0 HG21 THR B 22 -3.630 -11.532 -15.188 1.00 0.00 H new ATOM 0 HG22 THR B 22 -4.584 -10.496 -14.099 1.00 0.00 H new ATOM 0 HG23 THR B 22 -3.620 -9.766 -15.404 1.00 0.00 H new ATOM 1658 N ARG B 23 -3.089 -9.514 -10.648 1.00 0.00 N ATOM 1659 CA ARG B 23 -3.957 -9.590 -9.485 1.00 0.00 C ATOM 1660 C ARG B 23 -4.374 -8.225 -8.925 1.00 0.00 C ATOM 1661 O ARG B 23 -5.527 -8.085 -8.530 1.00 0.00 O ATOM 1662 CB ARG B 23 -3.233 -10.427 -8.454 1.00 0.00 C ATOM 1663 CG ARG B 23 -4.176 -11.054 -7.449 1.00 0.00 C ATOM 1664 CD ARG B 23 -3.337 -11.928 -6.512 1.00 0.00 C ATOM 1665 NE ARG B 23 -2.957 -11.236 -5.267 1.00 0.00 N ATOM 1666 CZ ARG B 23 -2.385 -11.920 -4.290 1.00 0.00 C ATOM 1667 NH1 ARG B 23 -1.537 -12.884 -4.554 1.00 0.00 N ATOM 1668 NH2 ARG B 23 -2.695 -11.685 -3.036 1.00 0.00 N ATOM 0 H ARG B 23 -2.119 -9.753 -10.441 1.00 0.00 H new ATOM 0 HA ARG B 23 -4.903 -10.048 -9.775 1.00 0.00 H new ATOM 0 HB2 ARG B 23 -2.671 -11.213 -8.959 1.00 0.00 H new ATOM 0 HB3 ARG B 23 -2.509 -9.804 -7.929 1.00 0.00 H new ATOM 0 HG2 ARG B 23 -4.703 -10.284 -6.885 1.00 0.00 H new ATOM 0 HG3 ARG B 23 -4.933 -11.652 -7.956 1.00 0.00 H new ATOM 0 HD2 ARG B 23 -3.899 -12.829 -6.264 1.00 0.00 H new ATOM 0 HD3 ARG B 23 -2.435 -12.248 -7.033 1.00 0.00 H new ATOM 0 HE ARG B 23 -3.134 -10.237 -5.160 1.00 0.00 H new ATOM 0 HH11 ARG B 23 -1.312 -13.114 -5.522 1.00 0.00 H new ATOM 0 HH12 ARG B 23 -1.103 -13.404 -3.792 1.00 0.00 H new ATOM 0 HH21 ARG B 23 -3.384 -10.968 -2.807 1.00 0.00 H new ATOM 0 HH22 ARG B 23 -2.247 -12.219 -2.291 1.00 0.00 H new ATOM 1682 N CYS B 24 -3.529 -7.188 -8.960 1.00 0.00 N ATOM 1683 CA CYS B 24 -3.958 -5.806 -8.687 1.00 0.00 C ATOM 1684 C CYS B 24 -4.983 -5.364 -9.750 1.00 0.00 C ATOM 1685 O CYS B 24 -5.987 -4.718 -9.440 1.00 0.00 O ATOM 1686 CB CYS B 24 -2.720 -4.895 -8.660 1.00 0.00 C ATOM 1687 SG CYS B 24 -3.222 -3.180 -8.320 1.00 0.00 S ATOM 0 H CYS B 24 -2.536 -7.279 -9.176 1.00 0.00 H new ATOM 0 HA CYS B 24 -4.447 -5.739 -7.715 1.00 0.00 H new ATOM 0 HB2 CYS B 24 -2.022 -5.237 -7.896 1.00 0.00 H new ATOM 0 HB3 CYS B 24 -2.198 -4.948 -9.615 1.00 0.00 H new ATOM 0 HG CYS B 24 -2.170 -2.416 -8.297 1.00 0.00 H new ATOM 1693 N ARG B 25 -4.772 -5.803 -11.000 1.00 0.00 N ATOM 1694 CA ARG B 25 -5.745 -5.668 -12.092 1.00 0.00 C ATOM 1695 C ARG B 25 -7.063 -6.420 -11.801 1.00 0.00 C ATOM 1696 O ARG B 25 -8.127 -5.849 -11.994 1.00 0.00 O ATOM 1697 CB ARG B 25 -5.093 -6.066 -13.430 1.00 0.00 C ATOM 1698 CG ARG B 25 -4.545 -4.860 -14.219 1.00 0.00 C ATOM 1699 CD ARG B 25 -3.113 -5.073 -14.737 1.00 0.00 C ATOM 1700 NE ARG B 25 -2.102 -4.731 -13.719 1.00 0.00 N ATOM 1701 CZ ARG B 25 -0.783 -4.831 -13.865 1.00 0.00 C ATOM 1702 NH1 ARG B 25 -0.219 -5.432 -14.887 1.00 0.00 N ATOM 1703 NH2 ARG B 25 0.025 -4.303 -12.978 1.00 0.00 N ATOM 0 H ARG B 25 -3.909 -6.268 -11.283 1.00 0.00 H new ATOM 0 HA ARG B 25 -6.036 -4.621 -12.171 1.00 0.00 H new ATOM 0 HB2 ARG B 25 -4.280 -6.766 -13.237 1.00 0.00 H new ATOM 0 HB3 ARG B 25 -5.826 -6.590 -14.043 1.00 0.00 H new ATOM 0 HG2 ARG B 25 -5.203 -4.658 -15.064 1.00 0.00 H new ATOM 0 HG3 ARG B 25 -4.566 -3.977 -13.580 1.00 0.00 H new ATOM 0 HD2 ARG B 25 -2.987 -6.113 -15.038 1.00 0.00 H new ATOM 0 HD3 ARG B 25 -2.954 -4.462 -15.626 1.00 0.00 H new ATOM 0 HE ARG B 25 -2.445 -4.387 -12.822 1.00 0.00 H new ATOM 0 HH11 ARG B 25 -0.798 -5.849 -15.616 1.00 0.00 H new ATOM 0 HH12 ARG B 25 0.798 -5.481 -14.952 1.00 0.00 H new ATOM 0 HH21 ARG B 25 -0.356 -3.812 -12.169 1.00 0.00 H new ATOM 0 HH22 ARG B 25 1.035 -4.384 -13.096 1.00 0.00 H new ATOM 1717 N ILE B 26 -7.036 -7.636 -11.241 1.00 0.00 N ATOM 1718 CA ILE B 26 -8.246 -8.339 -10.738 1.00 0.00 C ATOM 1719 C ILE B 26 -8.922 -7.555 -9.615 1.00 0.00 C ATOM 1720 O ILE B 26 -10.127 -7.369 -9.671 1.00 0.00 O ATOM 1721 CB ILE B 26 -7.912 -9.774 -10.259 1.00 0.00 C ATOM 1722 CG1 ILE B 26 -7.324 -10.614 -11.413 1.00 0.00 C ATOM 1723 CG2 ILE B 26 -9.101 -10.477 -9.569 1.00 0.00 C ATOM 1724 CD1 ILE B 26 -8.221 -11.680 -12.043 1.00 0.00 C ATOM 0 H ILE B 26 -6.176 -8.171 -11.119 1.00 0.00 H new ATOM 0 HA ILE B 26 -8.941 -8.410 -11.575 1.00 0.00 H new ATOM 0 HB ILE B 26 -7.147 -9.681 -9.488 1.00 0.00 H new ATOM 0 HG12 ILE B 26 -7.012 -9.929 -12.201 1.00 0.00 H new ATOM 0 HG13 ILE B 26 -6.424 -11.107 -11.045 1.00 0.00 H new ATOM 0 HG21 ILE B 26 -8.801 -11.478 -9.258 1.00 0.00 H new ATOM 0 HG22 ILE B 26 -9.407 -9.901 -8.695 1.00 0.00 H new ATOM 0 HG23 ILE B 26 -9.936 -10.549 -10.266 1.00 0.00 H new ATOM 0 HD11 ILE B 26 -7.677 -12.190 -12.838 1.00 0.00 H new ATOM 0 HD12 ILE B 26 -8.515 -12.404 -11.283 1.00 0.00 H new ATOM 0 HD13 ILE B 26 -9.111 -11.208 -12.458 1.00 0.00 H new ATOM 1736 N LEU B 27 -8.167 -7.080 -8.621 1.00 0.00 N ATOM 1737 CA LEU B 27 -8.699 -6.326 -7.480 1.00 0.00 C ATOM 1738 C LEU B 27 -9.353 -5.011 -7.913 1.00 0.00 C ATOM 1739 O LEU B 27 -10.422 -4.694 -7.404 1.00 0.00 O ATOM 1740 CB LEU B 27 -7.604 -6.061 -6.426 1.00 0.00 C ATOM 1741 CG LEU B 27 -7.202 -7.247 -5.534 1.00 0.00 C ATOM 1742 CD1 LEU B 27 -5.992 -6.883 -4.658 1.00 0.00 C ATOM 1743 CD2 LEU B 27 -8.352 -7.662 -4.601 1.00 0.00 C ATOM 0 H LEU B 27 -7.156 -7.209 -8.584 1.00 0.00 H new ATOM 0 HA LEU B 27 -9.473 -6.946 -7.028 1.00 0.00 H new ATOM 0 HB2 LEU B 27 -6.712 -5.707 -6.943 1.00 0.00 H new ATOM 0 HB3 LEU B 27 -7.942 -5.250 -5.781 1.00 0.00 H new ATOM 0 HG LEU B 27 -6.953 -8.073 -6.201 1.00 0.00 H new ATOM 0 HD11 LEU B 27 -5.724 -7.736 -4.035 1.00 0.00 H new ATOM 0 HD12 LEU B 27 -5.148 -6.620 -5.295 1.00 0.00 H new ATOM 0 HD13 LEU B 27 -6.245 -6.035 -4.022 1.00 0.00 H new ATOM 0 HD21 LEU B 27 -8.035 -8.503 -3.984 1.00 0.00 H new ATOM 0 HD22 LEU B 27 -8.621 -6.823 -3.960 1.00 0.00 H new ATOM 0 HD23 LEU B 27 -9.216 -7.955 -5.197 1.00 0.00 H new ATOM 1755 N VAL B 28 -8.772 -4.271 -8.863 1.00 0.00 N ATOM 1756 CA VAL B 28 -9.380 -3.017 -9.367 1.00 0.00 C ATOM 1757 C VAL B 28 -10.546 -3.239 -10.361 1.00 0.00 C ATOM 1758 O VAL B 28 -11.469 -2.431 -10.406 1.00 0.00 O ATOM 1759 CB VAL B 28 -8.311 -2.042 -9.913 1.00 0.00 C ATOM 1760 CG1 VAL B 28 -7.821 -2.397 -11.323 1.00 0.00 C ATOM 1761 CG2 VAL B 28 -8.792 -0.585 -9.889 1.00 0.00 C ATOM 0 H VAL B 28 -7.884 -4.511 -9.303 1.00 0.00 H new ATOM 0 HA VAL B 28 -9.841 -2.542 -8.501 1.00 0.00 H new ATOM 0 HB VAL B 28 -7.465 -2.150 -9.234 1.00 0.00 H new ATOM 0 HG11 VAL B 28 -7.073 -1.671 -11.642 1.00 0.00 H new ATOM 0 HG12 VAL B 28 -7.379 -3.393 -11.315 1.00 0.00 H new ATOM 0 HG13 VAL B 28 -8.662 -2.379 -12.016 1.00 0.00 H new ATOM 0 HG21 VAL B 28 -8.009 0.063 -10.281 1.00 0.00 H new ATOM 0 HG22 VAL B 28 -9.686 -0.487 -10.504 1.00 0.00 H new ATOM 0 HG23 VAL B 28 -9.023 -0.295 -8.864 1.00 0.00 H new ATOM 1771 N ALA B 29 -10.560 -4.351 -11.112 1.00 0.00 N ATOM 1772 CA ALA B 29 -11.707 -4.772 -11.933 1.00 0.00 C ATOM 1773 C ALA B 29 -12.813 -5.475 -11.117 1.00 0.00 C ATOM 1774 O ALA B 29 -13.922 -5.678 -11.609 1.00 0.00 O ATOM 1775 CB ALA B 29 -11.166 -5.669 -13.051 1.00 0.00 C ATOM 0 H ALA B 29 -9.767 -4.990 -11.167 1.00 0.00 H new ATOM 0 HA ALA B 29 -12.193 -3.890 -12.350 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -11.990 -6.001 -13.682 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -10.451 -5.108 -13.653 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -10.671 -6.536 -12.614 1.00 0.00 H new ATOM 1781 N LEU B 30 -12.519 -5.843 -9.868 1.00 0.00 N ATOM 1782 CA LEU B 30 -13.499 -6.307 -8.898 1.00 0.00 C ATOM 1783 C LEU B 30 -14.391 -5.136 -8.502 1.00 0.00 C ATOM 1784 O LEU B 30 -15.607 -5.247 -8.624 1.00 0.00 O ATOM 1785 CB LEU B 30 -12.734 -6.867 -7.684 1.00 0.00 C ATOM 1786 CG LEU B 30 -13.458 -7.858 -6.785 1.00 0.00 C ATOM 1787 CD1 LEU B 30 -14.709 -7.271 -6.150 1.00 0.00 C ATOM 1788 CD2 LEU B 30 -13.795 -9.129 -7.559 1.00 0.00 C ATOM 0 H LEU B 30 -11.568 -5.824 -9.499 1.00 0.00 H new ATOM 0 HA LEU B 30 -14.133 -7.091 -9.311 1.00 0.00 H new ATOM 0 HB2 LEU B 30 -11.828 -7.349 -8.052 1.00 0.00 H new ATOM 0 HB3 LEU B 30 -12.419 -6.024 -7.068 1.00 0.00 H new ATOM 0 HG LEU B 30 -12.778 -8.103 -5.969 1.00 0.00 H new ATOM 0 HD11 LEU B 30 -15.184 -8.023 -5.520 1.00 0.00 H new ATOM 0 HD12 LEU B 30 -14.438 -6.407 -5.543 1.00 0.00 H new ATOM 0 HD13 LEU B 30 -15.403 -6.962 -6.932 1.00 0.00 H new ATOM 0 HD21 LEU B 30 -14.313 -9.828 -6.902 1.00 0.00 H new ATOM 0 HD22 LEU B 30 -14.437 -8.881 -8.404 1.00 0.00 H new ATOM 0 HD23 LEU B 30 -12.876 -9.587 -7.924 1.00 0.00 H new ATOM 1800 N LEU B 31 -13.745 -4.052 -8.063 1.00 0.00 N ATOM 1801 CA LEU B 31 -14.303 -2.731 -7.739 1.00 0.00 C ATOM 1802 C LEU B 31 -15.357 -2.304 -8.773 1.00 0.00 C ATOM 1803 O LEU B 31 -16.546 -2.294 -8.460 1.00 0.00 O ATOM 1804 CB LEU B 31 -13.132 -1.719 -7.634 1.00 0.00 C ATOM 1805 CG LEU B 31 -12.792 -1.242 -6.212 1.00 0.00 C ATOM 1806 CD1 LEU B 31 -11.484 -0.442 -6.247 1.00 0.00 C ATOM 1807 CD2 LEU B 31 -13.910 -0.365 -5.632 1.00 0.00 C ATOM 0 H LEU B 31 -12.737 -4.075 -7.912 1.00 0.00 H new ATOM 0 HA LEU B 31 -14.823 -2.768 -6.782 1.00 0.00 H new ATOM 0 HB2 LEU B 31 -12.242 -2.174 -8.068 1.00 0.00 H new ATOM 0 HB3 LEU B 31 -13.373 -0.847 -8.243 1.00 0.00 H new ATOM 0 HG LEU B 31 -12.684 -2.119 -5.574 1.00 0.00 H new ATOM 0 HD11 LEU B 31 -11.239 -0.102 -5.241 1.00 0.00 H new ATOM 0 HD12 LEU B 31 -10.680 -1.075 -6.622 1.00 0.00 H new ATOM 0 HD13 LEU B 31 -11.602 0.420 -6.903 1.00 0.00 H new ATOM 0 HD21 LEU B 31 -13.637 -0.045 -4.626 1.00 0.00 H new ATOM 0 HD22 LEU B 31 -14.051 0.511 -6.265 1.00 0.00 H new ATOM 0 HD23 LEU B 31 -14.837 -0.937 -5.592 1.00 0.00 H new ATOM 1819 N ASP B 32 -14.919 -2.064 -10.010 1.00 0.00 N ATOM 1820 CA ASP B 32 -15.740 -1.687 -11.179 1.00 0.00 C ATOM 1821 C ASP B 32 -16.443 -2.906 -11.824 1.00 0.00 C ATOM 1822 O ASP B 32 -16.587 -3.009 -13.041 1.00 0.00 O ATOM 1823 CB ASP B 32 -14.854 -0.899 -12.171 1.00 0.00 C ATOM 1824 CG ASP B 32 -15.656 -0.026 -13.154 1.00 0.00 C ATOM 1825 OD1 ASP B 32 -16.461 0.796 -12.659 1.00 0.00 O ATOM 1826 OD2 ASP B 32 -15.414 -0.137 -14.379 1.00 0.00 O ATOM 0 H ASP B 32 -13.928 -2.129 -10.244 1.00 0.00 H new ATOM 0 HA ASP B 32 -16.557 -1.042 -10.856 1.00 0.00 H new ATOM 0 HB2 ASP B 32 -14.170 -0.264 -11.609 1.00 0.00 H new ATOM 0 HB3 ASP B 32 -14.243 -1.602 -12.737 1.00 0.00 H new ATOM 1831 N GLY B 33 -16.799 -3.903 -11.005 1.00 0.00 N ATOM 1832 CA GLY B 33 -17.355 -5.187 -11.437 1.00 0.00 C ATOM 1833 C GLY B 33 -18.416 -5.746 -10.497 1.00 0.00 C ATOM 1834 O GLY B 33 -19.600 -5.669 -10.790 1.00 0.00 O ATOM 0 H GLY B 33 -16.704 -3.834 -9.992 1.00 0.00 H new ATOM 0 HA2 GLY B 33 -17.789 -5.069 -12.430 1.00 0.00 H new ATOM 0 HA3 GLY B 33 -16.545 -5.911 -11.527 1.00 0.00 H new ATOM 1838 N VAL B 34 -17.989 -6.385 -9.403 1.00 0.00 N ATOM 1839 CA VAL B 34 -18.809 -7.099 -8.387 1.00 0.00 C ATOM 1840 C VAL B 34 -20.047 -7.903 -8.868 1.00 0.00 C ATOM 1841 O VAL B 34 -20.948 -8.143 -8.070 1.00 0.00 O ATOM 1842 CB VAL B 34 -19.202 -6.197 -7.186 1.00 0.00 C ATOM 1843 CG1 VAL B 34 -18.009 -5.776 -6.332 1.00 0.00 C ATOM 1844 CG2 VAL B 34 -20.007 -4.953 -7.600 1.00 0.00 C ATOM 0 H VAL B 34 -16.995 -6.427 -9.178 1.00 0.00 H new ATOM 0 HA VAL B 34 -18.102 -7.868 -8.077 1.00 0.00 H new ATOM 0 HB VAL B 34 -19.846 -6.831 -6.577 1.00 0.00 H new ATOM 0 HG11 VAL B 34 -18.353 -5.148 -5.511 1.00 0.00 H new ATOM 0 HG12 VAL B 34 -17.518 -6.662 -5.930 1.00 0.00 H new ATOM 0 HG13 VAL B 34 -17.302 -5.217 -6.945 1.00 0.00 H new ATOM 0 HG21 VAL B 34 -20.250 -4.366 -6.715 1.00 0.00 H new ATOM 0 HG22 VAL B 34 -19.414 -4.348 -8.286 1.00 0.00 H new ATOM 0 HG23 VAL B 34 -20.928 -5.263 -8.093 1.00 0.00 H new ATOM 1854 N CYS B 35 -20.136 -8.341 -10.128 1.00 0.00 N ATOM 1855 CA CYS B 35 -21.301 -9.106 -10.597 1.00 0.00 C ATOM 1856 C CYS B 35 -21.300 -10.565 -10.121 1.00 0.00 C ATOM 1857 O CYS B 35 -22.110 -10.949 -9.285 1.00 0.00 O ATOM 1858 CB CYS B 35 -21.412 -8.975 -12.125 1.00 0.00 C ATOM 1859 SG CYS B 35 -21.859 -7.265 -12.539 1.00 0.00 S ATOM 0 H CYS B 35 -19.422 -8.182 -10.839 1.00 0.00 H new ATOM 0 HA CYS B 35 -22.195 -8.678 -10.145 1.00 0.00 H new ATOM 0 HB2 CYS B 35 -20.466 -9.242 -12.596 1.00 0.00 H new ATOM 0 HB3 CYS B 35 -22.164 -9.664 -12.509 1.00 0.00 H new ATOM 0 HG CYS B 35 -21.071 -6.446 -11.908 1.00 0.00 H new ATOM 1865 N TYR B 36 -20.384 -11.389 -10.640 1.00 0.00 N ATOM 1866 CA TYR B 36 -20.410 -12.852 -10.468 1.00 0.00 C ATOM 1867 C TYR B 36 -18.995 -13.465 -10.333 1.00 0.00 C ATOM 1868 O TYR B 36 -18.028 -12.846 -10.792 1.00 0.00 O ATOM 1869 CB TYR B 36 -21.161 -13.516 -11.651 1.00 0.00 C ATOM 1870 CG TYR B 36 -22.221 -12.692 -12.366 1.00 0.00 C ATOM 1871 CD1 TYR B 36 -23.432 -12.378 -11.724 1.00 0.00 C ATOM 1872 CD2 TYR B 36 -21.995 -12.242 -13.683 1.00 0.00 C ATOM 1873 CE1 TYR B 36 -24.409 -11.614 -12.388 1.00 0.00 C ATOM 1874 CE2 TYR B 36 -22.970 -11.477 -14.352 1.00 0.00 C ATOM 1875 CZ TYR B 36 -24.187 -11.163 -13.706 1.00 0.00 C ATOM 1876 OH TYR B 36 -25.133 -10.415 -14.337 1.00 0.00 O ATOM 0 H TYR B 36 -19.595 -11.060 -11.197 1.00 0.00 H new ATOM 0 HA TYR B 36 -20.937 -13.051 -9.535 1.00 0.00 H new ATOM 0 HB2 TYR B 36 -20.420 -13.823 -12.389 1.00 0.00 H new ATOM 0 HB3 TYR B 36 -21.636 -14.424 -11.280 1.00 0.00 H new ATOM 0 HD1 TYR B 36 -23.613 -12.725 -10.717 1.00 0.00 H new ATOM 0 HD2 TYR B 36 -21.069 -12.485 -14.182 1.00 0.00 H new ATOM 0 HE1 TYR B 36 -25.334 -11.371 -11.886 1.00 0.00 H new ATOM 0 HE2 TYR B 36 -22.788 -11.130 -15.358 1.00 0.00 H new ATOM 0 HH TYR B 36 -24.822 -10.186 -15.238 1.00 0.00 H new ATOM 1886 N PRO B 37 -18.833 -14.682 -9.761 1.00 0.00 N ATOM 1887 CA PRO B 37 -17.552 -15.393 -9.708 1.00 0.00 C ATOM 1888 C PRO B 37 -17.009 -15.687 -11.106 1.00 0.00 C ATOM 1889 O PRO B 37 -17.762 -16.066 -12.001 1.00 0.00 O ATOM 1890 CB PRO B 37 -17.816 -16.706 -8.963 1.00 0.00 C ATOM 1891 CG PRO B 37 -19.316 -16.927 -9.130 1.00 0.00 C ATOM 1892 CD PRO B 37 -19.859 -15.502 -9.132 1.00 0.00 C ATOM 0 HA PRO B 37 -16.803 -14.782 -9.204 1.00 0.00 H new ATOM 0 HB2 PRO B 37 -17.241 -17.529 -9.388 1.00 0.00 H new ATOM 0 HB3 PRO B 37 -17.538 -16.632 -7.912 1.00 0.00 H new ATOM 0 HG2 PRO B 37 -19.549 -17.452 -10.057 1.00 0.00 H new ATOM 0 HG3 PRO B 37 -19.733 -17.519 -8.315 1.00 0.00 H new ATOM 0 HD2 PRO B 37 -20.798 -15.443 -9.683 1.00 0.00 H new ATOM 0 HD3 PRO B 37 -20.063 -15.161 -8.117 1.00 0.00 H new ATOM 1900 N GLY B 38 -15.697 -15.504 -11.298 1.00 0.00 N ATOM 1901 CA GLY B 38 -15.020 -15.789 -12.572 1.00 0.00 C ATOM 1902 C GLY B 38 -15.436 -14.878 -13.733 1.00 0.00 C ATOM 1903 O GLY B 38 -14.914 -15.037 -14.834 1.00 0.00 O ATOM 0 H GLY B 38 -15.072 -15.153 -10.573 1.00 0.00 H new ATOM 0 HA2 GLY B 38 -13.944 -15.699 -12.425 1.00 0.00 H new ATOM 0 HA3 GLY B 38 -15.218 -16.824 -12.850 1.00 0.00 H new ATOM 1907 N GLN B 39 -16.351 -13.923 -13.516 1.00 0.00 N ATOM 1908 CA GLN B 39 -16.843 -13.029 -14.567 1.00 0.00 C ATOM 1909 C GLN B 39 -15.747 -12.084 -15.045 1.00 0.00 C ATOM 1910 O GLN B 39 -15.721 -11.742 -16.223 1.00 0.00 O ATOM 1911 CB GLN B 39 -18.097 -12.274 -14.090 1.00 0.00 C ATOM 1912 CG GLN B 39 -17.844 -10.952 -13.330 1.00 0.00 C ATOM 1913 CD GLN B 39 -17.628 -9.727 -14.225 1.00 0.00 C ATOM 1914 OE1 GLN B 39 -18.044 -9.682 -15.367 1.00 0.00 O ATOM 1915 NE2 GLN B 39 -16.976 -8.685 -13.749 1.00 0.00 N ATOM 0 H GLN B 39 -16.771 -13.750 -12.602 1.00 0.00 H new ATOM 0 HA GLN B 39 -17.133 -13.632 -15.427 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -18.719 -12.057 -14.959 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -18.672 -12.937 -13.444 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -18.692 -10.759 -12.673 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -16.969 -11.078 -12.693 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -16.618 -8.700 -12.794 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -16.830 -7.864 -14.336 1.00 0.00 H new ATOM 1924 N LEU B 40 -14.794 -11.744 -14.161 1.00 0.00 N ATOM 1925 CA LEU B 40 -13.648 -10.890 -14.474 1.00 0.00 C ATOM 1926 C LEU B 40 -12.817 -11.415 -15.648 1.00 0.00 C ATOM 1927 O LEU B 40 -12.018 -10.667 -16.186 1.00 0.00 O ATOM 1928 CB LEU B 40 -12.731 -10.687 -13.252 1.00 0.00 C ATOM 1929 CG LEU B 40 -13.444 -10.297 -11.938 1.00 0.00 C ATOM 1930 CD1 LEU B 40 -13.500 -11.495 -10.978 1.00 0.00 C ATOM 1931 CD2 LEU B 40 -12.713 -9.125 -11.276 1.00 0.00 C ATOM 0 H LEU B 40 -14.804 -12.064 -13.192 1.00 0.00 H new ATOM 0 HA LEU B 40 -14.076 -9.930 -14.764 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -12.173 -11.608 -13.082 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -12.002 -9.913 -13.492 1.00 0.00 H new ATOM 0 HG LEU B 40 -14.465 -9.995 -12.172 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -14.006 -11.201 -10.058 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -14.047 -12.312 -11.448 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -12.487 -11.823 -10.746 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -13.221 -8.855 -10.350 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -11.686 -9.415 -11.055 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -12.711 -8.269 -11.951 1.00 0.00 H new ATOM 1943 N ALA B 41 -12.997 -12.675 -16.049 1.00 0.00 N ATOM 1944 CA ALA B 41 -12.413 -13.227 -17.268 1.00 0.00 C ATOM 1945 C ALA B 41 -12.803 -12.406 -18.509 1.00 0.00 C ATOM 1946 O ALA B 41 -11.924 -12.044 -19.283 1.00 0.00 O ATOM 1947 CB ALA B 41 -12.848 -14.696 -17.362 1.00 0.00 C ATOM 0 H ALA B 41 -13.560 -13.347 -15.528 1.00 0.00 H new ATOM 0 HA ALA B 41 -11.325 -13.174 -17.230 1.00 0.00 H new ATOM 0 HB1 ALA B 41 -12.429 -15.143 -18.264 1.00 0.00 H new ATOM 0 HB2 ALA B 41 -12.489 -15.239 -16.488 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -13.936 -14.752 -17.402 1.00 0.00 H new ATOM 1953 N ALA B 42 -14.079 -12.040 -18.672 1.00 0.00 N ATOM 1954 CA ALA B 42 -14.504 -11.158 -19.766 1.00 0.00 C ATOM 1955 C ALA B 42 -13.981 -9.726 -19.568 1.00 0.00 C ATOM 1956 O ALA B 42 -13.480 -9.108 -20.500 1.00 0.00 O ATOM 1957 CB ALA B 42 -16.036 -11.191 -19.846 1.00 0.00 C ATOM 0 H ALA B 42 -14.837 -12.341 -18.059 1.00 0.00 H new ATOM 0 HA ALA B 42 -14.082 -11.512 -20.707 1.00 0.00 H new ATOM 0 HB1 ALA B 42 -16.372 -10.541 -20.654 1.00 0.00 H new ATOM 0 HB2 ALA B 42 -16.368 -12.211 -20.039 1.00 0.00 H new ATOM 0 HB3 ALA B 42 -16.457 -10.844 -18.902 1.00 0.00 H new ATOM 1963 N HIS B 43 -14.050 -9.231 -18.331 1.00 0.00 N ATOM 1964 CA HIS B 43 -13.655 -7.874 -17.943 1.00 0.00 C ATOM 1965 C HIS B 43 -12.148 -7.581 -18.146 1.00 0.00 C ATOM 1966 O HIS B 43 -11.755 -6.453 -18.434 1.00 0.00 O ATOM 1967 CB HIS B 43 -14.083 -7.719 -16.473 1.00 0.00 C ATOM 1968 CG HIS B 43 -14.438 -6.327 -16.036 1.00 0.00 C ATOM 1969 ND1 HIS B 43 -14.953 -5.318 -16.847 1.00 0.00 N ATOM 1970 CD2 HIS B 43 -14.476 -5.921 -14.736 1.00 0.00 C ATOM 1971 CE1 HIS B 43 -15.257 -4.309 -16.013 1.00 0.00 C ATOM 1972 NE2 HIS B 43 -14.989 -4.642 -14.740 1.00 0.00 N ATOM 0 H HIS B 43 -14.394 -9.782 -17.544 1.00 0.00 H new ATOM 0 HA HIS B 43 -14.144 -7.143 -18.586 1.00 0.00 H new ATOM 0 HB2 HIS B 43 -14.943 -8.365 -16.295 1.00 0.00 H new ATOM 0 HB3 HIS B 43 -13.274 -8.083 -15.839 1.00 0.00 H new ATOM 0 HD2 HIS B 43 -14.165 -6.490 -13.872 1.00 0.00 H new ATOM 0 HE1 HIS B 43 -15.662 -3.358 -16.325 1.00 0.00 H new ATOM 0 HE2 HIS B 43 -15.139 -4.053 -13.921 1.00 0.00 H new ATOM 1980 N LEU B 44 -11.300 -8.613 -18.009 1.00 0.00 N ATOM 1981 CA LEU B 44 -9.853 -8.567 -18.253 1.00 0.00 C ATOM 1982 C LEU B 44 -9.446 -9.117 -19.630 1.00 0.00 C ATOM 1983 O LEU B 44 -8.272 -9.025 -19.979 1.00 0.00 O ATOM 1984 CB LEU B 44 -9.125 -9.368 -17.149 1.00 0.00 C ATOM 1985 CG LEU B 44 -9.322 -8.852 -15.713 1.00 0.00 C ATOM 1986 CD1 LEU B 44 -8.361 -9.533 -14.745 1.00 0.00 C ATOM 1987 CD2 LEU B 44 -9.140 -7.331 -15.576 1.00 0.00 C ATOM 0 H LEU B 44 -11.618 -9.536 -17.714 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.563 -7.516 -18.235 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -9.463 -10.403 -17.193 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -8.058 -9.371 -17.371 1.00 0.00 H new ATOM 0 HG LEU B 44 -10.355 -9.096 -15.466 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -8.524 -9.148 -13.739 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -8.537 -10.609 -14.754 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -7.334 -9.330 -15.049 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -9.294 -7.038 -14.537 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -8.132 -7.056 -15.885 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -9.866 -6.819 -16.208 1.00 0.00 H new ATOM 1999 N GLY B 45 -10.359 -9.760 -20.367 1.00 0.00 N ATOM 2000 CA GLY B 45 -10.042 -10.521 -21.584 1.00 0.00 C ATOM 2001 C GLY B 45 -9.235 -11.802 -21.320 1.00 0.00 C ATOM 2002 O GLY B 45 -8.748 -12.424 -22.264 1.00 0.00 O ATOM 0 H GLY B 45 -11.352 -9.767 -20.133 1.00 0.00 H new ATOM 0 HA2 GLY B 45 -10.971 -10.785 -22.089 1.00 0.00 H new ATOM 0 HA3 GLY B 45 -9.480 -9.882 -22.265 1.00 0.00 H new ATOM 2006 N LEU B 46 -9.045 -12.190 -20.054 1.00 0.00 N ATOM 2007 CA LEU B 46 -8.248 -13.356 -19.659 1.00 0.00 C ATOM 2008 C LEU B 46 -9.095 -14.633 -19.611 1.00 0.00 C ATOM 2009 O LEU B 46 -10.319 -14.579 -19.523 1.00 0.00 O ATOM 2010 CB LEU B 46 -7.590 -13.068 -18.298 1.00 0.00 C ATOM 2011 CG LEU B 46 -6.510 -11.970 -18.325 1.00 0.00 C ATOM 2012 CD1 LEU B 46 -6.020 -11.734 -16.892 1.00 0.00 C ATOM 2013 CD2 LEU B 46 -5.312 -12.348 -19.210 1.00 0.00 C ATOM 0 H LEU B 46 -9.449 -11.693 -19.260 1.00 0.00 H new ATOM 0 HA LEU B 46 -7.474 -13.529 -20.407 1.00 0.00 H new ATOM 0 HB2 LEU B 46 -8.365 -12.779 -17.589 1.00 0.00 H new ATOM 0 HB3 LEU B 46 -7.143 -13.989 -17.924 1.00 0.00 H new ATOM 0 HG LEU B 46 -6.956 -11.069 -18.747 1.00 0.00 H new ATOM 0 HD11 LEU B 46 -5.254 -10.959 -16.892 1.00 0.00 H new ATOM 0 HD12 LEU B 46 -6.856 -11.417 -16.269 1.00 0.00 H new ATOM 0 HD13 LEU B 46 -5.601 -12.658 -16.494 1.00 0.00 H new ATOM 0 HD21 LEU B 46 -4.580 -11.541 -19.195 1.00 0.00 H new ATOM 0 HD22 LEU B 46 -4.853 -13.261 -18.831 1.00 0.00 H new ATOM 0 HD23 LEU B 46 -5.652 -12.510 -20.233 1.00 0.00 H new ATOM 2025 N THR B 47 -8.461 -15.816 -19.613 1.00 0.00 N ATOM 2026 CA THR B 47 -9.223 -17.068 -19.463 1.00 0.00 C ATOM 2027 C THR B 47 -9.756 -17.195 -18.041 1.00 0.00 C ATOM 2028 O THR B 47 -9.167 -16.692 -17.073 1.00 0.00 O ATOM 2029 CB THR B 47 -8.480 -18.336 -19.903 1.00 0.00 C ATOM 2030 OG1 THR B 47 -7.576 -18.730 -18.911 1.00 0.00 O ATOM 2031 CG2 THR B 47 -7.718 -18.182 -21.217 1.00 0.00 C ATOM 0 H THR B 47 -7.453 -15.933 -19.714 1.00 0.00 H new ATOM 0 HA THR B 47 -10.057 -16.991 -20.160 1.00 0.00 H new ATOM 0 HB THR B 47 -9.252 -19.090 -20.061 1.00 0.00 H new ATOM 0 HG1 THR B 47 -6.681 -18.399 -19.134 1.00 0.00 H new ATOM 0 HG21 THR B 47 -7.219 -19.120 -21.461 1.00 0.00 H new ATOM 0 HG22 THR B 47 -8.415 -17.924 -22.014 1.00 0.00 H new ATOM 0 HG23 THR B 47 -6.974 -17.391 -21.116 1.00 0.00 H new ATOM 2039 N ARG B 48 -10.848 -17.956 -17.913 1.00 0.00 N ATOM 2040 CA ARG B 48 -11.417 -18.343 -16.620 1.00 0.00 C ATOM 2041 C ARG B 48 -10.340 -19.011 -15.747 1.00 0.00 C ATOM 2042 O ARG B 48 -10.231 -18.685 -14.573 1.00 0.00 O ATOM 2043 CB ARG B 48 -12.644 -19.255 -16.823 1.00 0.00 C ATOM 2044 CG ARG B 48 -13.793 -18.547 -17.572 1.00 0.00 C ATOM 2045 CD ARG B 48 -14.952 -19.488 -17.951 1.00 0.00 C ATOM 2046 NE ARG B 48 -15.831 -19.835 -16.811 1.00 0.00 N ATOM 2047 CZ ARG B 48 -16.967 -19.229 -16.467 1.00 0.00 C ATOM 2048 NH1 ARG B 48 -17.391 -18.137 -17.070 1.00 0.00 N ATOM 2049 NH2 ARG B 48 -17.701 -19.724 -15.490 1.00 0.00 N ATOM 0 H ARG B 48 -11.365 -18.323 -18.712 1.00 0.00 H new ATOM 0 HA ARG B 48 -11.760 -17.451 -16.096 1.00 0.00 H new ATOM 0 HB2 ARG B 48 -12.344 -20.142 -17.381 1.00 0.00 H new ATOM 0 HB3 ARG B 48 -13.004 -19.595 -15.852 1.00 0.00 H new ATOM 0 HG2 ARG B 48 -14.179 -17.740 -16.949 1.00 0.00 H new ATOM 0 HG3 ARG B 48 -13.397 -18.088 -18.478 1.00 0.00 H new ATOM 0 HD2 ARG B 48 -15.551 -19.017 -18.731 1.00 0.00 H new ATOM 0 HD3 ARG B 48 -14.541 -20.405 -18.374 1.00 0.00 H new ATOM 0 HE ARG B 48 -15.537 -20.619 -16.229 1.00 0.00 H new ATOM 0 HH11 ARG B 48 -16.844 -17.728 -17.828 1.00 0.00 H new ATOM 0 HH12 ARG B 48 -18.266 -17.701 -16.779 1.00 0.00 H new ATOM 0 HH21 ARG B 48 -17.398 -20.567 -15.001 1.00 0.00 H new ATOM 0 HH22 ARG B 48 -18.571 -19.264 -15.223 1.00 0.00 H new ATOM 2063 N SER B 49 -9.483 -19.859 -16.322 1.00 0.00 N ATOM 2064 CA SER B 49 -8.322 -20.452 -15.638 1.00 0.00 C ATOM 2065 C SER B 49 -7.337 -19.398 -15.111 1.00 0.00 C ATOM 2066 O SER B 49 -6.990 -19.421 -13.933 1.00 0.00 O ATOM 2067 CB SER B 49 -7.581 -21.408 -16.588 1.00 0.00 C ATOM 2068 OG SER B 49 -8.488 -22.260 -17.266 1.00 0.00 O ATOM 0 H SER B 49 -9.575 -20.160 -17.292 1.00 0.00 H new ATOM 0 HA SER B 49 -8.711 -20.996 -14.778 1.00 0.00 H new ATOM 0 HB2 SER B 49 -7.007 -20.832 -17.314 1.00 0.00 H new ATOM 0 HB3 SER B 49 -6.868 -22.008 -16.022 1.00 0.00 H new ATOM 0 HG SER B 49 -7.992 -22.856 -17.865 1.00 0.00 H new ATOM 2074 N ASN B 50 -6.932 -18.428 -15.944 1.00 0.00 N ATOM 2075 CA ASN B 50 -6.016 -17.370 -15.506 1.00 0.00 C ATOM 2076 C ASN B 50 -6.638 -16.540 -14.370 1.00 0.00 C ATOM 2077 O ASN B 50 -5.988 -16.298 -13.356 1.00 0.00 O ATOM 2078 CB ASN B 50 -5.628 -16.431 -16.657 1.00 0.00 C ATOM 2079 CG ASN B 50 -4.998 -17.111 -17.862 1.00 0.00 C ATOM 2080 OD1 ASN B 50 -5.546 -17.041 -18.951 1.00 0.00 O ATOM 2081 ND2 ASN B 50 -3.875 -17.792 -17.729 1.00 0.00 N ATOM 0 H ASN B 50 -7.224 -18.356 -16.919 1.00 0.00 H new ATOM 0 HA ASN B 50 -5.116 -17.868 -15.147 1.00 0.00 H new ATOM 0 HB2 ASN B 50 -6.520 -15.897 -16.986 1.00 0.00 H new ATOM 0 HB3 ASN B 50 -4.932 -15.684 -16.276 1.00 0.00 H new ATOM 0 HD21 ASN B 50 -3.464 -18.261 -18.536 1.00 0.00 H new ATOM 0 HD22 ASN B 50 -3.418 -17.850 -16.819 1.00 0.00 H new ATOM 2088 N VAL B 51 -7.900 -16.121 -14.505 1.00 0.00 N ATOM 2089 CA VAL B 51 -8.557 -15.308 -13.468 1.00 0.00 C ATOM 2090 C VAL B 51 -8.768 -16.119 -12.184 1.00 0.00 C ATOM 2091 O VAL B 51 -8.531 -15.577 -11.110 1.00 0.00 O ATOM 2092 CB VAL B 51 -9.877 -14.673 -13.995 1.00 0.00 C ATOM 2093 CG1 VAL B 51 -10.839 -14.166 -12.908 1.00 0.00 C ATOM 2094 CG2 VAL B 51 -9.538 -13.546 -14.988 1.00 0.00 C ATOM 0 H VAL B 51 -8.486 -16.327 -15.314 1.00 0.00 H new ATOM 0 HA VAL B 51 -7.894 -14.480 -13.216 1.00 0.00 H new ATOM 0 HB VAL B 51 -10.422 -15.478 -14.488 1.00 0.00 H new ATOM 0 HG11 VAL B 51 -11.727 -13.742 -13.377 1.00 0.00 H new ATOM 0 HG12 VAL B 51 -11.130 -14.996 -12.264 1.00 0.00 H new ATOM 0 HG13 VAL B 51 -10.343 -13.400 -12.312 1.00 0.00 H new ATOM 0 HG21 VAL B 51 -10.460 -13.099 -15.359 1.00 0.00 H new ATOM 0 HG22 VAL B 51 -8.942 -12.784 -14.485 1.00 0.00 H new ATOM 0 HG23 VAL B 51 -8.971 -13.956 -15.824 1.00 0.00 H new ATOM 2104 N SER B 52 -9.092 -17.413 -12.261 1.00 0.00 N ATOM 2105 CA SER B 52 -9.118 -18.290 -11.079 1.00 0.00 C ATOM 2106 C SER B 52 -7.767 -18.363 -10.363 1.00 0.00 C ATOM 2107 O SER B 52 -7.747 -18.271 -9.138 1.00 0.00 O ATOM 2108 CB SER B 52 -9.529 -19.719 -11.431 1.00 0.00 C ATOM 2109 OG SER B 52 -10.897 -19.791 -11.798 1.00 0.00 O ATOM 0 H SER B 52 -9.342 -17.881 -13.132 1.00 0.00 H new ATOM 0 HA SER B 52 -9.856 -17.837 -10.417 1.00 0.00 H new ATOM 0 HB2 SER B 52 -8.911 -20.085 -12.251 1.00 0.00 H new ATOM 0 HB3 SER B 52 -9.345 -20.372 -10.578 1.00 0.00 H new ATOM 0 HG SER B 52 -11.006 -19.472 -12.718 1.00 0.00 H new ATOM 2115 N ASN B 53 -6.649 -18.477 -11.093 1.00 0.00 N ATOM 2116 CA ASN B 53 -5.307 -18.476 -10.499 1.00 0.00 C ATOM 2117 C ASN B 53 -5.067 -17.207 -9.666 1.00 0.00 C ATOM 2118 O ASN B 53 -4.661 -17.287 -8.507 1.00 0.00 O ATOM 2119 CB ASN B 53 -4.246 -18.629 -11.603 1.00 0.00 C ATOM 2120 CG ASN B 53 -4.087 -20.052 -12.138 1.00 0.00 C ATOM 2121 OD1 ASN B 53 -4.840 -20.964 -11.831 1.00 0.00 O ATOM 2122 ND2 ASN B 53 -3.077 -20.286 -12.957 1.00 0.00 N ATOM 0 H ASN B 53 -6.650 -18.572 -12.109 1.00 0.00 H new ATOM 0 HA ASN B 53 -5.227 -19.325 -9.820 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -4.505 -17.970 -12.432 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -3.285 -18.291 -11.215 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -2.929 -21.224 -13.329 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -2.445 -19.529 -13.217 1.00 0.00 H new ATOM 2129 N HIS B 54 -5.412 -16.037 -10.210 1.00 0.00 N ATOM 2130 CA HIS B 54 -5.293 -14.773 -9.481 1.00 0.00 C ATOM 2131 C HIS B 54 -6.258 -14.697 -8.277 1.00 0.00 C ATOM 2132 O HIS B 54 -5.864 -14.248 -7.201 1.00 0.00 O ATOM 2133 CB HIS B 54 -5.547 -13.615 -10.453 1.00 0.00 C ATOM 2134 CG HIS B 54 -4.714 -13.620 -11.712 1.00 0.00 C ATOM 2135 ND1 HIS B 54 -5.202 -13.603 -12.996 1.00 0.00 N ATOM 2136 CD2 HIS B 54 -3.351 -13.700 -11.808 1.00 0.00 C ATOM 2137 CE1 HIS B 54 -4.166 -13.727 -13.839 1.00 0.00 C ATOM 2138 NE2 HIS B 54 -3.011 -13.769 -13.161 1.00 0.00 N ATOM 0 H HIS B 54 -5.778 -15.940 -11.157 1.00 0.00 H new ATOM 0 HA HIS B 54 -4.285 -14.705 -9.073 1.00 0.00 H new ATOM 0 HB2 HIS B 54 -6.600 -13.627 -10.736 1.00 0.00 H new ATOM 0 HB3 HIS B 54 -5.370 -12.677 -9.926 1.00 0.00 H new ATOM 0 HD2 HIS B 54 -2.658 -13.708 -10.980 1.00 0.00 H new ATOM 0 HE1 HIS B 54 -4.251 -13.785 -14.914 1.00 0.00 H new ATOM 0 HE2 HIS B 54 -2.072 -13.838 -13.554 1.00 0.00 H new ATOM 2146 N LEU B 55 -7.500 -15.175 -8.439 1.00 0.00 N ATOM 2147 CA LEU B 55 -8.491 -15.262 -7.360 1.00 0.00 C ATOM 2148 C LEU B 55 -8.127 -16.305 -6.291 1.00 0.00 C ATOM 2149 O LEU B 55 -8.708 -16.266 -5.214 1.00 0.00 O ATOM 2150 CB LEU B 55 -9.890 -15.576 -7.933 1.00 0.00 C ATOM 2151 CG LEU B 55 -10.558 -14.467 -8.770 1.00 0.00 C ATOM 2152 CD1 LEU B 55 -11.802 -15.044 -9.461 1.00 0.00 C ATOM 2153 CD2 LEU B 55 -10.975 -13.279 -7.896 1.00 0.00 C ATOM 0 H LEU B 55 -7.848 -15.516 -9.335 1.00 0.00 H new ATOM 0 HA LEU B 55 -8.498 -14.287 -6.873 1.00 0.00 H new ATOM 0 HB2 LEU B 55 -9.812 -16.470 -8.552 1.00 0.00 H new ATOM 0 HB3 LEU B 55 -10.551 -15.821 -7.102 1.00 0.00 H new ATOM 0 HG LEU B 55 -9.837 -14.112 -9.507 1.00 0.00 H new ATOM 0 HD11 LEU B 55 -12.281 -14.266 -10.056 1.00 0.00 H new ATOM 0 HD12 LEU B 55 -11.508 -15.868 -10.111 1.00 0.00 H new ATOM 0 HD13 LEU B 55 -12.501 -15.407 -8.708 1.00 0.00 H new ATOM 0 HD21 LEU B 55 -11.442 -12.516 -8.518 1.00 0.00 H new ATOM 0 HD22 LEU B 55 -11.684 -13.615 -7.140 1.00 0.00 H new ATOM 0 HD23 LEU B 55 -10.095 -12.860 -7.408 1.00 0.00 H new ATOM 2165 N SER B 56 -7.239 -17.260 -6.561 1.00 0.00 N ATOM 2166 CA SER B 56 -6.842 -18.309 -5.610 1.00 0.00 C ATOM 2167 C SER B 56 -6.223 -17.729 -4.331 1.00 0.00 C ATOM 2168 O SER B 56 -6.751 -17.960 -3.244 1.00 0.00 O ATOM 2169 CB SER B 56 -5.911 -19.323 -6.297 1.00 0.00 C ATOM 2170 OG SER B 56 -6.091 -20.604 -5.719 1.00 0.00 O ATOM 0 H SER B 56 -6.764 -17.332 -7.461 1.00 0.00 H new ATOM 0 HA SER B 56 -7.742 -18.836 -5.293 1.00 0.00 H new ATOM 0 HB2 SER B 56 -6.125 -19.362 -7.365 1.00 0.00 H new ATOM 0 HB3 SER B 56 -4.873 -19.008 -6.191 1.00 0.00 H new ATOM 0 HG SER B 56 -5.498 -21.248 -6.160 1.00 0.00 H new ATOM 2176 N CYS B 57 -5.193 -16.880 -4.451 1.00 0.00 N ATOM 2177 CA CYS B 57 -4.637 -16.185 -3.291 1.00 0.00 C ATOM 2178 C CYS B 57 -5.671 -15.199 -2.711 1.00 0.00 C ATOM 2179 O CYS B 57 -5.882 -15.135 -1.504 1.00 0.00 O ATOM 2180 CB CYS B 57 -3.339 -15.489 -3.723 1.00 0.00 C ATOM 2181 SG CYS B 57 -2.329 -14.874 -2.329 1.00 0.00 S ATOM 0 H CYS B 57 -4.733 -16.662 -5.335 1.00 0.00 H new ATOM 0 HA CYS B 57 -4.403 -16.890 -2.493 1.00 0.00 H new ATOM 0 HB2 CYS B 57 -2.743 -16.187 -4.311 1.00 0.00 H new ATOM 0 HB3 CYS B 57 -3.587 -14.652 -4.376 1.00 0.00 H new ATOM 0 HG CYS B 57 -1.071 -15.094 -2.574 1.00 0.00 H new ATOM 2186 N LEU B 58 -6.332 -14.447 -3.594 1.00 0.00 N ATOM 2187 CA LEU B 58 -7.244 -13.348 -3.278 1.00 0.00 C ATOM 2188 C LEU B 58 -8.392 -13.746 -2.338 1.00 0.00 C ATOM 2189 O LEU B 58 -8.739 -12.976 -1.441 1.00 0.00 O ATOM 2190 CB LEU B 58 -7.758 -12.807 -4.629 1.00 0.00 C ATOM 2191 CG LEU B 58 -7.688 -11.281 -4.802 1.00 0.00 C ATOM 2192 CD1 LEU B 58 -6.239 -10.814 -4.679 1.00 0.00 C ATOM 2193 CD2 LEU B 58 -8.260 -10.934 -6.182 1.00 0.00 C ATOM 0 H LEU B 58 -6.240 -14.597 -4.599 1.00 0.00 H new ATOM 0 HA LEU B 58 -6.711 -12.579 -2.719 1.00 0.00 H new ATOM 0 HB2 LEU B 58 -7.183 -13.272 -5.429 1.00 0.00 H new ATOM 0 HB3 LEU B 58 -8.794 -13.122 -4.756 1.00 0.00 H new ATOM 0 HG LEU B 58 -8.268 -10.777 -4.029 1.00 0.00 H new ATOM 0 HD11 LEU B 58 -6.194 -9.732 -4.802 1.00 0.00 H new ATOM 0 HD12 LEU B 58 -5.852 -11.084 -3.696 1.00 0.00 H new ATOM 0 HD13 LEU B 58 -5.636 -11.293 -5.450 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -8.222 -9.855 -6.331 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -7.671 -11.428 -6.955 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -9.294 -11.272 -6.243 1.00 0.00 H new ATOM 2205 N ARG B 59 -8.966 -14.938 -2.546 1.00 0.00 N ATOM 2206 CA ARG B 59 -10.023 -15.523 -1.710 1.00 0.00 C ATOM 2207 C ARG B 59 -9.484 -16.248 -0.462 1.00 0.00 C ATOM 2208 O ARG B 59 -10.269 -16.573 0.425 1.00 0.00 O ATOM 2209 CB ARG B 59 -10.863 -16.488 -2.559 1.00 0.00 C ATOM 2210 CG ARG B 59 -11.563 -15.817 -3.760 1.00 0.00 C ATOM 2211 CD ARG B 59 -12.244 -16.881 -4.631 1.00 0.00 C ATOM 2212 NE ARG B 59 -11.223 -17.655 -5.359 1.00 0.00 N ATOM 2213 CZ ARG B 59 -11.235 -18.930 -5.724 1.00 0.00 C ATOM 2214 NH1 ARG B 59 -12.234 -19.730 -5.421 1.00 0.00 N ATOM 2215 NH2 ARG B 59 -10.222 -19.425 -6.402 1.00 0.00 N ATOM 0 H ARG B 59 -8.700 -15.541 -3.325 1.00 0.00 H new ATOM 0 HA ARG B 59 -10.636 -14.700 -1.344 1.00 0.00 H new ATOM 0 HB2 ARG B 59 -10.220 -17.288 -2.926 1.00 0.00 H new ATOM 0 HB3 ARG B 59 -11.618 -16.952 -1.924 1.00 0.00 H new ATOM 0 HG2 ARG B 59 -12.302 -15.098 -3.406 1.00 0.00 H new ATOM 0 HG3 ARG B 59 -10.835 -15.262 -4.352 1.00 0.00 H new ATOM 0 HD2 ARG B 59 -12.843 -17.546 -4.008 1.00 0.00 H new ATOM 0 HD3 ARG B 59 -12.925 -16.406 -5.337 1.00 0.00 H new ATOM 0 HE ARG B 59 -10.385 -17.135 -5.620 1.00 0.00 H new ATOM 0 HH11 ARG B 59 -13.029 -19.374 -4.891 1.00 0.00 H new ATOM 0 HH12 ARG B 59 -12.213 -20.706 -5.716 1.00 0.00 H new ATOM 0 HH21 ARG B 59 -9.431 -18.829 -6.645 1.00 0.00 H new ATOM 0 HH22 ARG B 59 -10.228 -20.405 -6.684 1.00 0.00 H new ATOM 2229 N GLY B 60 -8.170 -16.496 -0.368 1.00 0.00 N ATOM 2230 CA GLY B 60 -7.503 -17.001 0.841 1.00 0.00 C ATOM 2231 C GLY B 60 -7.133 -15.850 1.773 1.00 0.00 C ATOM 2232 O GLY B 60 -7.588 -15.810 2.908 1.00 0.00 O ATOM 0 H GLY B 60 -7.528 -16.348 -1.146 1.00 0.00 H new ATOM 0 HA2 GLY B 60 -8.160 -17.699 1.360 1.00 0.00 H new ATOM 0 HA3 GLY B 60 -6.606 -17.554 0.563 1.00 0.00 H new ATOM 2236 N CYS B 61 -6.401 -14.856 1.260 1.00 0.00 N ATOM 2237 CA CYS B 61 -6.026 -13.612 1.933 1.00 0.00 C ATOM 2238 C CYS B 61 -7.232 -12.753 2.425 1.00 0.00 C ATOM 2239 O CYS B 61 -7.045 -11.677 2.999 1.00 0.00 O ATOM 2240 CB CYS B 61 -5.145 -12.844 0.925 1.00 0.00 C ATOM 2241 SG CYS B 61 -3.417 -13.376 0.764 1.00 0.00 S ATOM 0 H CYS B 61 -6.034 -14.902 0.309 1.00 0.00 H new ATOM 0 HA CYS B 61 -5.495 -13.841 2.857 1.00 0.00 H new ATOM 0 HB2 CYS B 61 -5.614 -12.915 -0.057 1.00 0.00 H new ATOM 0 HB3 CYS B 61 -5.150 -11.791 1.205 1.00 0.00 H new ATOM 0 HG CYS B 61 -3.229 -13.888 -0.416 1.00 0.00 H new ATOM 2246 N GLY B 62 -8.462 -13.159 2.083 1.00 0.00 N ATOM 2247 CA GLY B 62 -9.695 -12.422 2.377 1.00 0.00 C ATOM 2248 C GLY B 62 -9.902 -11.179 1.507 1.00 0.00 C ATOM 2249 O GLY B 62 -10.933 -10.534 1.623 1.00 0.00 O ATOM 0 H GLY B 62 -8.630 -14.031 1.582 1.00 0.00 H new ATOM 0 HA2 GLY B 62 -10.546 -13.091 2.245 1.00 0.00 H new ATOM 0 HA3 GLY B 62 -9.685 -12.122 3.425 1.00 0.00 H new ATOM 2253 N LEU B 63 -8.958 -10.848 0.613 1.00 0.00 N ATOM 2254 CA LEU B 63 -8.961 -9.664 -0.263 1.00 0.00 C ATOM 2255 C LEU B 63 -10.204 -9.574 -1.163 1.00 0.00 C ATOM 2256 O LEU B 63 -10.613 -8.478 -1.540 1.00 0.00 O ATOM 2257 CB LEU B 63 -7.666 -9.618 -1.065 1.00 0.00 C ATOM 2258 CG LEU B 63 -6.418 -9.628 -0.163 1.00 0.00 C ATOM 2259 CD1 LEU B 63 -5.214 -9.640 -1.078 1.00 0.00 C ATOM 2260 CD2 LEU B 63 -6.287 -8.476 0.840 1.00 0.00 C ATOM 0 H LEU B 63 -8.130 -11.427 0.474 1.00 0.00 H new ATOM 0 HA LEU B 63 -9.014 -8.782 0.375 1.00 0.00 H new ATOM 0 HB2 LEU B 63 -7.630 -10.472 -1.741 1.00 0.00 H new ATOM 0 HB3 LEU B 63 -7.657 -8.721 -1.684 1.00 0.00 H new ATOM 0 HG LEU B 63 -6.502 -10.512 0.469 1.00 0.00 H new ATOM 0 HD11 LEU B 63 -4.303 -9.647 -0.480 1.00 0.00 H new ATOM 0 HD12 LEU B 63 -5.243 -10.530 -1.706 1.00 0.00 H new ATOM 0 HD13 LEU B 63 -5.227 -8.751 -1.708 1.00 0.00 H new ATOM 0 HD21 LEU B 63 -5.369 -8.597 1.415 1.00 0.00 H new ATOM 0 HD22 LEU B 63 -6.257 -7.528 0.303 1.00 0.00 H new ATOM 0 HD23 LEU B 63 -7.142 -8.483 1.516 1.00 0.00 H new ATOM 2272 N VAL B 64 -10.803 -10.725 -1.464 1.00 0.00 N ATOM 2273 CA VAL B 64 -12.119 -10.906 -2.098 1.00 0.00 C ATOM 2274 C VAL B 64 -12.935 -11.940 -1.330 1.00 0.00 C ATOM 2275 O VAL B 64 -12.391 -12.925 -0.833 1.00 0.00 O ATOM 2276 CB VAL B 64 -12.046 -11.360 -3.570 1.00 0.00 C ATOM 2277 CG1 VAL B 64 -11.848 -10.161 -4.497 1.00 0.00 C ATOM 2278 CG2 VAL B 64 -10.965 -12.387 -3.810 1.00 0.00 C ATOM 0 H VAL B 64 -10.356 -11.619 -1.260 1.00 0.00 H new ATOM 0 HA VAL B 64 -12.589 -9.923 -2.075 1.00 0.00 H new ATOM 0 HB VAL B 64 -13.000 -11.837 -3.796 1.00 0.00 H new ATOM 0 HG11 VAL B 64 -11.799 -10.504 -5.530 1.00 0.00 H new ATOM 0 HG12 VAL B 64 -12.684 -9.471 -4.383 1.00 0.00 H new ATOM 0 HG13 VAL B 64 -10.919 -9.652 -4.240 1.00 0.00 H new ATOM 0 HG21 VAL B 64 -10.959 -12.670 -4.863 1.00 0.00 H new ATOM 0 HG22 VAL B 64 -9.996 -11.965 -3.543 1.00 0.00 H new ATOM 0 HG23 VAL B 64 -11.158 -13.268 -3.198 1.00 0.00 H new ATOM 2288 N VAL B 65 -14.247 -11.706 -1.251 1.00 0.00 N ATOM 2289 CA VAL B 65 -15.212 -12.472 -0.437 1.00 0.00 C ATOM 2290 C VAL B 65 -16.542 -12.592 -1.192 1.00 0.00 C ATOM 2291 O VAL B 65 -16.981 -11.642 -1.835 1.00 0.00 O ATOM 2292 CB VAL B 65 -15.457 -11.806 0.947 1.00 0.00 C ATOM 2293 CG1 VAL B 65 -16.315 -12.702 1.856 1.00 0.00 C ATOM 2294 CG2 VAL B 65 -14.148 -11.507 1.699 1.00 0.00 C ATOM 0 H VAL B 65 -14.691 -10.949 -1.771 1.00 0.00 H new ATOM 0 HA VAL B 65 -14.789 -13.461 -0.262 1.00 0.00 H new ATOM 0 HB VAL B 65 -15.973 -10.871 0.730 1.00 0.00 H new ATOM 0 HG11 VAL B 65 -16.467 -12.207 2.815 1.00 0.00 H new ATOM 0 HG12 VAL B 65 -17.280 -12.882 1.383 1.00 0.00 H new ATOM 0 HG13 VAL B 65 -15.806 -13.653 2.015 1.00 0.00 H new ATOM 0 HG21 VAL B 65 -14.377 -11.043 2.658 1.00 0.00 H new ATOM 0 HG22 VAL B 65 -13.604 -12.437 1.867 1.00 0.00 H new ATOM 0 HG23 VAL B 65 -13.534 -10.829 1.106 1.00 0.00 H new ATOM 2304 N ALA B 66 -17.179 -13.764 -1.146 1.00 0.00 N ATOM 2305 CA ALA B 66 -18.478 -14.001 -1.790 1.00 0.00 C ATOM 2306 C ALA B 66 -19.663 -13.344 -1.067 1.00 0.00 C ATOM 2307 O ALA B 66 -19.637 -13.104 0.138 1.00 0.00 O ATOM 2308 CB ALA B 66 -18.683 -15.514 -1.933 1.00 0.00 C ATOM 0 H ALA B 66 -16.809 -14.581 -0.660 1.00 0.00 H new ATOM 0 HA ALA B 66 -18.453 -13.524 -2.770 1.00 0.00 H new ATOM 0 HB1 ALA B 66 -19.644 -15.708 -2.410 1.00 0.00 H new ATOM 0 HB2 ALA B 66 -17.884 -15.933 -2.544 1.00 0.00 H new ATOM 0 HB3 ALA B 66 -18.667 -15.978 -0.947 1.00 0.00 H new ATOM 2314 N THR B 67 -20.724 -13.045 -1.823 1.00 0.00 N ATOM 2315 CA THR B 67 -21.954 -12.392 -1.345 1.00 0.00 C ATOM 2316 C THR B 67 -23.061 -12.631 -2.366 1.00 0.00 C ATOM 2317 O THR B 67 -22.811 -12.506 -3.554 1.00 0.00 O ATOM 2318 CB THR B 67 -21.717 -10.881 -1.175 1.00 0.00 C ATOM 2319 OG1 THR B 67 -20.726 -10.619 -0.216 1.00 0.00 O ATOM 2320 CG2 THR B 67 -22.965 -10.107 -0.757 1.00 0.00 C ATOM 0 H THR B 67 -20.754 -13.257 -2.820 1.00 0.00 H new ATOM 0 HA THR B 67 -22.242 -12.809 -0.380 1.00 0.00 H new ATOM 0 HB THR B 67 -21.407 -10.544 -2.164 1.00 0.00 H new ATOM 0 HG1 THR B 67 -20.352 -11.465 0.108 1.00 0.00 H new ATOM 0 HG21 THR B 67 -22.721 -9.049 -0.657 1.00 0.00 H new ATOM 0 HG22 THR B 67 -23.740 -10.230 -1.513 1.00 0.00 H new ATOM 0 HG23 THR B 67 -23.326 -10.488 0.198 1.00 0.00 H new ATOM 2328 N TYR B 68 -24.295 -12.903 -1.955 1.00 0.00 N ATOM 2329 CA TYR B 68 -25.434 -12.904 -2.893 1.00 0.00 C ATOM 2330 C TYR B 68 -25.750 -11.460 -3.318 1.00 0.00 C ATOM 2331 O TYR B 68 -26.014 -10.632 -2.437 1.00 0.00 O ATOM 2332 CB TYR B 68 -26.665 -13.548 -2.242 1.00 0.00 C ATOM 2333 CG TYR B 68 -26.688 -15.063 -2.248 1.00 0.00 C ATOM 2334 CD1 TYR B 68 -26.071 -15.787 -1.208 1.00 0.00 C ATOM 2335 CD2 TYR B 68 -27.363 -15.748 -3.276 1.00 0.00 C ATOM 2336 CE1 TYR B 68 -26.122 -17.192 -1.195 1.00 0.00 C ATOM 2337 CE2 TYR B 68 -27.425 -17.156 -3.263 1.00 0.00 C ATOM 2338 CZ TYR B 68 -26.803 -17.882 -2.225 1.00 0.00 C ATOM 2339 OH TYR B 68 -26.854 -19.241 -2.223 1.00 0.00 O ATOM 0 H TYR B 68 -24.540 -13.125 -0.990 1.00 0.00 H new ATOM 0 HA TYR B 68 -25.169 -13.488 -3.774 1.00 0.00 H new ATOM 0 HB2 TYR B 68 -26.730 -13.205 -1.209 1.00 0.00 H new ATOM 0 HB3 TYR B 68 -27.556 -13.186 -2.754 1.00 0.00 H new ATOM 0 HD1 TYR B 68 -25.557 -15.260 -0.418 1.00 0.00 H new ATOM 0 HD2 TYR B 68 -27.834 -15.194 -4.075 1.00 0.00 H new ATOM 0 HE1 TYR B 68 -25.642 -17.743 -0.400 1.00 0.00 H new ATOM 0 HE2 TYR B 68 -27.949 -17.680 -4.048 1.00 0.00 H new ATOM 0 HH TYR B 68 -27.362 -19.550 -3.002 1.00 0.00 H new ATOM 2349 N GLU B 69 -25.749 -11.135 -4.618 1.00 0.00 N ATOM 2350 CA GLU B 69 -26.060 -9.773 -5.083 1.00 0.00 C ATOM 2351 C GLU B 69 -27.553 -9.461 -4.867 1.00 0.00 C ATOM 2352 O GLU B 69 -27.907 -8.824 -3.871 1.00 0.00 O ATOM 2353 CB GLU B 69 -25.467 -9.429 -6.479 1.00 0.00 C ATOM 2354 CG GLU B 69 -25.255 -10.484 -7.579 1.00 0.00 C ATOM 2355 CD GLU B 69 -26.442 -10.678 -8.514 1.00 0.00 C ATOM 2356 OE1 GLU B 69 -27.513 -11.068 -8.016 1.00 0.00 O ATOM 2357 OE2 GLU B 69 -26.289 -10.598 -9.745 1.00 0.00 O ATOM 0 H GLU B 69 -25.537 -11.794 -5.367 1.00 0.00 H new ATOM 0 HA GLU B 69 -25.525 -9.061 -4.455 1.00 0.00 H new ATOM 0 HB2 GLU B 69 -26.109 -8.659 -6.907 1.00 0.00 H new ATOM 0 HB3 GLU B 69 -24.495 -8.970 -6.298 1.00 0.00 H new ATOM 0 HG2 GLU B 69 -24.386 -10.201 -8.172 1.00 0.00 H new ATOM 0 HG3 GLU B 69 -25.022 -11.439 -7.107 1.00 0.00 H new ATOM 2364 N GLY B 70 -28.432 -9.995 -5.710 1.00 0.00 N ATOM 2365 CA GLY B 70 -29.893 -10.011 -5.582 1.00 0.00 C ATOM 2366 C GLY B 70 -30.530 -11.320 -6.067 1.00 0.00 C ATOM 2367 O GLY B 70 -31.562 -11.714 -5.533 1.00 0.00 O ATOM 0 H GLY B 70 -28.124 -10.462 -6.563 1.00 0.00 H new ATOM 0 HA2 GLY B 70 -30.161 -9.849 -4.538 1.00 0.00 H new ATOM 0 HA3 GLY B 70 -30.310 -9.180 -6.150 1.00 0.00 H new ATOM 2371 N ARG B 71 -29.919 -12.000 -7.046 1.00 0.00 N ATOM 2372 CA ARG B 71 -30.375 -13.278 -7.619 1.00 0.00 C ATOM 2373 C ARG B 71 -29.223 -14.219 -8.051 1.00 0.00 C ATOM 2374 O ARG B 71 -29.464 -15.387 -8.360 1.00 0.00 O ATOM 2375 CB ARG B 71 -31.300 -12.972 -8.812 1.00 0.00 C ATOM 2376 CG ARG B 71 -32.373 -14.055 -9.028 1.00 0.00 C ATOM 2377 CD ARG B 71 -32.584 -14.367 -10.514 1.00 0.00 C ATOM 2378 NE ARG B 71 -31.442 -15.122 -11.058 1.00 0.00 N ATOM 2379 CZ ARG B 71 -31.224 -16.426 -10.961 1.00 0.00 C ATOM 2380 NH1 ARG B 71 -32.099 -17.257 -10.432 1.00 0.00 N ATOM 2381 NH2 ARG B 71 -30.081 -16.897 -11.399 1.00 0.00 N ATOM 0 H ARG B 71 -29.059 -11.663 -7.479 1.00 0.00 H new ATOM 0 HA ARG B 71 -30.908 -13.818 -6.837 1.00 0.00 H new ATOM 0 HB2 ARG B 71 -31.788 -12.011 -8.650 1.00 0.00 H new ATOM 0 HB3 ARG B 71 -30.699 -12.877 -9.717 1.00 0.00 H new ATOM 0 HG2 ARG B 71 -32.080 -14.965 -8.505 1.00 0.00 H new ATOM 0 HG3 ARG B 71 -33.315 -13.725 -8.590 1.00 0.00 H new ATOM 0 HD2 ARG B 71 -33.501 -14.943 -10.643 1.00 0.00 H new ATOM 0 HD3 ARG B 71 -32.710 -13.438 -11.071 1.00 0.00 H new ATOM 0 HE ARG B 71 -30.741 -14.582 -11.565 1.00 0.00 H new ATOM 0 HH11 ARG B 71 -32.987 -16.904 -10.076 1.00 0.00 H new ATOM 0 HH12 ARG B 71 -31.888 -18.254 -10.378 1.00 0.00 H new ATOM 0 HH21 ARG B 71 -29.389 -16.264 -11.801 1.00 0.00 H new ATOM 0 HH22 ARG B 71 -29.884 -17.896 -11.338 1.00 0.00 H new ATOM 2395 N GLN B 72 -27.980 -13.737 -8.070 1.00 0.00 N ATOM 2396 CA GLN B 72 -26.745 -14.497 -8.246 1.00 0.00 C ATOM 2397 C GLN B 72 -25.878 -14.358 -6.990 1.00 0.00 C ATOM 2398 O GLN B 72 -26.153 -13.548 -6.106 1.00 0.00 O ATOM 2399 CB GLN B 72 -25.902 -14.037 -9.460 1.00 0.00 C ATOM 2400 CG GLN B 72 -26.463 -14.429 -10.833 1.00 0.00 C ATOM 2401 CD GLN B 72 -27.807 -13.786 -11.124 1.00 0.00 C ATOM 2402 OE1 GLN B 72 -28.737 -14.425 -11.600 1.00 0.00 O ATOM 2403 NE2 GLN B 72 -27.990 -12.543 -10.766 1.00 0.00 N ATOM 0 H GLN B 72 -27.799 -12.740 -7.955 1.00 0.00 H new ATOM 0 HA GLN B 72 -27.046 -15.529 -8.423 1.00 0.00 H new ATOM 0 HB2 GLN B 72 -25.803 -12.952 -9.423 1.00 0.00 H new ATOM 0 HB3 GLN B 72 -24.899 -14.452 -9.363 1.00 0.00 H new ATOM 0 HG2 GLN B 72 -25.752 -14.140 -11.607 1.00 0.00 H new ATOM 0 HG3 GLN B 72 -26.565 -15.513 -10.883 1.00 0.00 H new ATOM 0 HE21 GLN B 72 -27.218 -12.008 -10.369 1.00 0.00 H new ATOM 0 HE22 GLN B 72 -28.905 -12.108 -10.883 1.00 0.00 H new ATOM 2412 N VAL B 73 -24.796 -15.133 -6.947 1.00 0.00 N ATOM 2413 CA VAL B 73 -23.688 -14.919 -6.016 1.00 0.00 C ATOM 2414 C VAL B 73 -22.588 -14.156 -6.763 1.00 0.00 C ATOM 2415 O VAL B 73 -22.398 -14.352 -7.965 1.00 0.00 O ATOM 2416 CB VAL B 73 -23.157 -16.220 -5.384 1.00 0.00 C ATOM 2417 CG1 VAL B 73 -24.230 -16.898 -4.526 1.00 0.00 C ATOM 2418 CG2 VAL B 73 -22.595 -17.217 -6.414 1.00 0.00 C ATOM 0 H VAL B 73 -24.662 -15.935 -7.563 1.00 0.00 H new ATOM 0 HA VAL B 73 -24.049 -14.334 -5.170 1.00 0.00 H new ATOM 0 HB VAL B 73 -22.324 -15.919 -4.748 1.00 0.00 H new ATOM 0 HG11 VAL B 73 -23.825 -17.813 -4.094 1.00 0.00 H new ATOM 0 HG12 VAL B 73 -24.536 -16.223 -3.726 1.00 0.00 H new ATOM 0 HG13 VAL B 73 -25.093 -17.140 -5.147 1.00 0.00 H new ATOM 0 HG21 VAL B 73 -22.239 -18.110 -5.900 1.00 0.00 H new ATOM 0 HG22 VAL B 73 -23.379 -17.493 -7.119 1.00 0.00 H new ATOM 0 HG23 VAL B 73 -21.768 -16.755 -6.954 1.00 0.00 H new ATOM 2428 N ARG B 74 -21.885 -13.291 -6.037 1.00 0.00 N ATOM 2429 CA ARG B 74 -20.846 -12.387 -6.517 1.00 0.00 C ATOM 2430 C ARG B 74 -19.584 -12.581 -5.703 1.00 0.00 C ATOM 2431 O ARG B 74 -19.594 -13.280 -4.694 1.00 0.00 O ATOM 2432 CB ARG B 74 -21.316 -10.926 -6.383 1.00 0.00 C ATOM 2433 CG ARG B 74 -21.014 -10.202 -5.052 1.00 0.00 C ATOM 2434 CD ARG B 74 -21.825 -8.911 -4.974 1.00 0.00 C ATOM 2435 NE ARG B 74 -21.350 -7.983 -3.932 1.00 0.00 N ATOM 2436 CZ ARG B 74 -21.373 -6.653 -4.020 1.00 0.00 C ATOM 2437 NH1 ARG B 74 -21.850 -6.031 -5.084 1.00 0.00 N ATOM 2438 NH2 ARG B 74 -20.913 -5.921 -3.023 1.00 0.00 N ATOM 0 H ARG B 74 -22.036 -13.198 -5.033 1.00 0.00 H new ATOM 0 HA ARG B 74 -20.644 -12.607 -7.565 1.00 0.00 H new ATOM 0 HB2 ARG B 74 -20.862 -10.351 -7.190 1.00 0.00 H new ATOM 0 HB3 ARG B 74 -22.394 -10.903 -6.542 1.00 0.00 H new ATOM 0 HG2 ARG B 74 -21.261 -10.849 -4.210 1.00 0.00 H new ATOM 0 HG3 ARG B 74 -19.949 -9.979 -4.981 1.00 0.00 H new ATOM 0 HD2 ARG B 74 -21.789 -8.409 -5.941 1.00 0.00 H new ATOM 0 HD3 ARG B 74 -22.869 -9.158 -4.782 1.00 0.00 H new ATOM 0 HE ARG B 74 -20.974 -8.391 -3.076 1.00 0.00 H new ATOM 0 HH11 ARG B 74 -22.215 -6.570 -5.869 1.00 0.00 H new ATOM 0 HH12 ARG B 74 -21.853 -5.012 -5.120 1.00 0.00 H new ATOM 0 HH21 ARG B 74 -20.541 -6.373 -2.188 1.00 0.00 H new ATOM 0 HH22 ARG B 74 -20.929 -4.903 -3.088 1.00 0.00 H new ATOM 2452 N TYR B 75 -18.529 -11.882 -6.099 1.00 0.00 N ATOM 2453 CA TYR B 75 -17.344 -11.676 -5.274 1.00 0.00 C ATOM 2454 C TYR B 75 -17.183 -10.166 -5.090 1.00 0.00 C ATOM 2455 O TYR B 75 -17.073 -9.430 -6.069 1.00 0.00 O ATOM 2456 CB TYR B 75 -16.117 -12.366 -5.879 1.00 0.00 C ATOM 2457 CG TYR B 75 -15.996 -13.787 -5.358 1.00 0.00 C ATOM 2458 CD1 TYR B 75 -16.800 -14.811 -5.889 1.00 0.00 C ATOM 2459 CD2 TYR B 75 -15.177 -14.060 -4.245 1.00 0.00 C ATOM 2460 CE1 TYR B 75 -16.760 -16.109 -5.340 1.00 0.00 C ATOM 2461 CE2 TYR B 75 -15.112 -15.357 -3.703 1.00 0.00 C ATOM 2462 CZ TYR B 75 -15.890 -16.392 -4.263 1.00 0.00 C ATOM 2463 OH TYR B 75 -15.826 -17.646 -3.737 1.00 0.00 O ATOM 0 H TYR B 75 -18.470 -11.436 -7.014 1.00 0.00 H new ATOM 0 HA TYR B 75 -17.453 -12.138 -4.293 1.00 0.00 H new ATOM 0 HB2 TYR B 75 -16.197 -12.376 -6.966 1.00 0.00 H new ATOM 0 HB3 TYR B 75 -15.217 -11.803 -5.631 1.00 0.00 H new ATOM 0 HD1 TYR B 75 -17.453 -14.602 -6.723 1.00 0.00 H new ATOM 0 HD2 TYR B 75 -14.593 -13.266 -3.803 1.00 0.00 H new ATOM 0 HE1 TYR B 75 -17.393 -16.886 -5.742 1.00 0.00 H new ATOM 0 HE2 TYR B 75 -14.468 -15.560 -2.860 1.00 0.00 H new ATOM 0 HH TYR B 75 -15.175 -17.661 -3.004 1.00 0.00 H new ATOM 2473 N ALA B 76 -17.281 -9.718 -3.839 1.00 0.00 N ATOM 2474 CA ALA B 76 -16.953 -8.372 -3.396 1.00 0.00 C ATOM 2475 C ALA B 76 -15.495 -8.342 -2.915 1.00 0.00 C ATOM 2476 O ALA B 76 -14.888 -9.394 -2.713 1.00 0.00 O ATOM 2477 CB ALA B 76 -17.915 -7.999 -2.257 1.00 0.00 C ATOM 0 H ALA B 76 -17.606 -10.313 -3.077 1.00 0.00 H new ATOM 0 HA ALA B 76 -17.059 -7.653 -4.209 1.00 0.00 H new ATOM 0 HB1 ALA B 76 -17.690 -6.992 -1.906 1.00 0.00 H new ATOM 0 HB2 ALA B 76 -18.942 -8.035 -2.621 1.00 0.00 H new ATOM 0 HB3 ALA B 76 -17.797 -8.705 -1.435 1.00 0.00 H new ATOM 2483 N LEU B 77 -14.939 -7.145 -2.744 1.00 0.00 N ATOM 2484 CA LEU B 77 -13.675 -6.928 -2.050 1.00 0.00 C ATOM 2485 C LEU B 77 -13.844 -7.270 -0.561 1.00 0.00 C ATOM 2486 O LEU B 77 -14.974 -7.366 -0.084 1.00 0.00 O ATOM 2487 CB LEU B 77 -13.287 -5.450 -2.260 1.00 0.00 C ATOM 2488 CG LEU B 77 -11.833 -5.212 -2.683 1.00 0.00 C ATOM 2489 CD1 LEU B 77 -11.467 -5.907 -3.985 1.00 0.00 C ATOM 2490 CD2 LEU B 77 -11.669 -3.712 -2.917 1.00 0.00 C ATOM 0 H LEU B 77 -15.363 -6.284 -3.090 1.00 0.00 H new ATOM 0 HA LEU B 77 -12.884 -7.569 -2.439 1.00 0.00 H new ATOM 0 HB2 LEU B 77 -13.944 -5.022 -3.018 1.00 0.00 H new ATOM 0 HB3 LEU B 77 -13.473 -4.907 -1.333 1.00 0.00 H new ATOM 0 HG LEU B 77 -11.190 -5.608 -1.897 1.00 0.00 H new ATOM 0 HD11 LEU B 77 -10.425 -5.699 -4.228 1.00 0.00 H new ATOM 0 HD12 LEU B 77 -11.606 -6.982 -3.875 1.00 0.00 H new ATOM 0 HD13 LEU B 77 -12.107 -5.539 -4.787 1.00 0.00 H new ATOM 0 HD21 LEU B 77 -10.644 -3.501 -3.221 1.00 0.00 H new ATOM 0 HD22 LEU B 77 -12.354 -3.389 -3.701 1.00 0.00 H new ATOM 0 HD23 LEU B 77 -11.893 -3.173 -1.996 1.00 0.00 H new ATOM 2502 N ALA B 78 -12.732 -7.392 0.168 1.00 0.00 N ATOM 2503 CA ALA B 78 -12.708 -7.606 1.625 1.00 0.00 C ATOM 2504 C ALA B 78 -13.634 -6.653 2.405 1.00 0.00 C ATOM 2505 O ALA B 78 -14.408 -7.083 3.251 1.00 0.00 O ATOM 2506 CB ALA B 78 -11.259 -7.428 2.095 1.00 0.00 C ATOM 0 H ALA B 78 -11.800 -7.344 -0.244 1.00 0.00 H new ATOM 0 HA ALA B 78 -13.082 -8.610 1.826 1.00 0.00 H new ATOM 0 HB1 ALA B 78 -11.205 -7.580 3.173 1.00 0.00 H new ATOM 0 HB2 ALA B 78 -10.622 -8.156 1.593 1.00 0.00 H new ATOM 0 HB3 ALA B 78 -10.919 -6.421 1.853 1.00 0.00 H new ATOM 2512 N ASP B 79 -13.557 -5.358 2.086 1.00 0.00 N ATOM 2513 CA ASP B 79 -14.320 -4.263 2.688 1.00 0.00 C ATOM 2514 C ASP B 79 -13.981 -2.947 1.968 1.00 0.00 C ATOM 2515 O ASP B 79 -13.018 -2.838 1.196 1.00 0.00 O ATOM 2516 CB ASP B 79 -14.046 -4.159 4.223 1.00 0.00 C ATOM 2517 CG ASP B 79 -14.600 -2.877 4.882 1.00 0.00 C ATOM 2518 OD1 ASP B 79 -15.824 -2.631 4.758 1.00 0.00 O ATOM 2519 OD2 ASP B 79 -13.786 -2.005 5.273 1.00 0.00 O ATOM 0 H ASP B 79 -12.923 -5.028 1.358 1.00 0.00 H new ATOM 0 HA ASP B 79 -15.384 -4.465 2.569 1.00 0.00 H new ATOM 0 HB2 ASP B 79 -14.484 -5.026 4.718 1.00 0.00 H new ATOM 0 HB3 ASP B 79 -12.970 -4.205 4.392 1.00 0.00 H new ATOM 2524 N SER B 80 -14.771 -1.934 2.307 1.00 0.00 N ATOM 2525 CA SER B 80 -14.570 -0.497 2.119 1.00 0.00 C ATOM 2526 C SER B 80 -13.086 -0.112 2.259 1.00 0.00 C ATOM 2527 O SER B 80 -12.585 0.715 1.504 1.00 0.00 O ATOM 2528 CB SER B 80 -15.354 0.254 3.217 1.00 0.00 C ATOM 2529 OG SER B 80 -16.600 -0.350 3.534 1.00 0.00 O ATOM 0 H SER B 80 -15.662 -2.116 2.769 1.00 0.00 H new ATOM 0 HA SER B 80 -14.913 -0.233 1.119 1.00 0.00 H new ATOM 0 HB2 SER B 80 -14.744 0.305 4.119 1.00 0.00 H new ATOM 0 HB3 SER B 80 -15.528 1.280 2.892 1.00 0.00 H new ATOM 0 HG SER B 80 -16.451 -1.117 4.125 1.00 0.00 H new ATOM 2535 N HIS B 81 -12.373 -0.769 3.185 1.00 0.00 N ATOM 2536 CA HIS B 81 -10.930 -0.765 3.397 1.00 0.00 C ATOM 2537 C HIS B 81 -10.129 -0.866 2.101 1.00 0.00 C ATOM 2538 O HIS B 81 -9.495 0.117 1.716 1.00 0.00 O ATOM 2539 CB HIS B 81 -10.582 -1.900 4.395 1.00 0.00 C ATOM 2540 CG HIS B 81 -10.811 -1.530 5.840 1.00 0.00 C ATOM 2541 ND1 HIS B 81 -11.531 -0.442 6.290 1.00 0.00 N ATOM 2542 CD2 HIS B 81 -10.090 -2.004 6.897 1.00 0.00 C ATOM 2543 CE1 HIS B 81 -11.157 -0.180 7.551 1.00 0.00 C ATOM 2544 NE2 HIS B 81 -10.359 -1.179 7.975 1.00 0.00 N ATOM 0 H HIS B 81 -12.841 -1.370 3.864 1.00 0.00 H new ATOM 0 HA HIS B 81 -10.641 0.198 3.819 1.00 0.00 H new ATOM 0 HB2 HIS B 81 -11.181 -2.779 4.155 1.00 0.00 H new ATOM 0 HB3 HIS B 81 -9.537 -2.180 4.262 1.00 0.00 H new ATOM 0 HD2 HIS B 81 -9.433 -2.861 6.893 1.00 0.00 H new ATOM 0 HE1 HIS B 81 -11.447 0.685 8.129 1.00 0.00 H new ATOM 0 HE2 HIS B 81 -10.013 -1.305 8.926 1.00 0.00 H new ATOM 2553 N LEU B 82 -10.145 -2.012 1.411 1.00 0.00 N ATOM 2554 CA LEU B 82 -9.432 -2.134 0.132 1.00 0.00 C ATOM 2555 C LEU B 82 -10.119 -1.322 -0.964 1.00 0.00 C ATOM 2556 O LEU B 82 -9.444 -0.856 -1.872 1.00 0.00 O ATOM 2557 CB LEU B 82 -9.306 -3.590 -0.332 1.00 0.00 C ATOM 2558 CG LEU B 82 -8.834 -4.613 0.703 1.00 0.00 C ATOM 2559 CD1 LEU B 82 -8.625 -5.961 0.019 1.00 0.00 C ATOM 2560 CD2 LEU B 82 -7.555 -4.205 1.451 1.00 0.00 C ATOM 0 H LEU B 82 -10.635 -2.856 1.709 1.00 0.00 H new ATOM 0 HA LEU B 82 -8.431 -1.741 0.308 1.00 0.00 H new ATOM 0 HB2 LEU B 82 -10.278 -3.911 -0.706 1.00 0.00 H new ATOM 0 HB3 LEU B 82 -8.615 -3.618 -1.175 1.00 0.00 H new ATOM 0 HG LEU B 82 -9.617 -4.673 1.459 1.00 0.00 H new ATOM 0 HD11 LEU B 82 -8.289 -6.693 0.753 1.00 0.00 H new ATOM 0 HD12 LEU B 82 -9.564 -6.295 -0.422 1.00 0.00 H new ATOM 0 HD13 LEU B 82 -7.873 -5.859 -0.763 1.00 0.00 H new ATOM 0 HD21 LEU B 82 -7.288 -4.983 2.166 1.00 0.00 H new ATOM 0 HD22 LEU B 82 -6.742 -4.073 0.737 1.00 0.00 H new ATOM 0 HD23 LEU B 82 -7.727 -3.269 1.982 1.00 0.00 H new ATOM 2572 N ALA B 83 -11.437 -1.121 -0.891 1.00 0.00 N ATOM 2573 CA ALA B 83 -12.174 -0.412 -1.939 1.00 0.00 C ATOM 2574 C ALA B 83 -11.764 1.065 -2.010 1.00 0.00 C ATOM 2575 O ALA B 83 -11.669 1.622 -3.100 1.00 0.00 O ATOM 2576 CB ALA B 83 -13.673 -0.602 -1.685 1.00 0.00 C ATOM 0 H ALA B 83 -12.017 -1.440 -0.115 1.00 0.00 H new ATOM 0 HA ALA B 83 -11.931 -0.827 -2.917 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -14.241 -0.081 -2.455 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -13.915 -1.665 -1.712 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -13.931 -0.196 -0.707 1.00 0.00 H new ATOM 2582 N ARG B 84 -11.452 1.665 -0.857 1.00 0.00 N ATOM 2583 CA ARG B 84 -10.877 3.000 -0.751 1.00 0.00 C ATOM 2584 C ARG B 84 -9.367 2.950 -1.036 1.00 0.00 C ATOM 2585 O ARG B 84 -8.963 3.543 -2.030 1.00 0.00 O ATOM 2586 CB ARG B 84 -11.285 3.579 0.620 1.00 0.00 C ATOM 2587 CG ARG B 84 -10.836 5.008 0.962 1.00 0.00 C ATOM 2588 CD ARG B 84 -10.983 6.035 -0.176 1.00 0.00 C ATOM 2589 NE ARG B 84 -10.233 7.263 0.120 1.00 0.00 N ATOM 2590 CZ ARG B 84 -10.368 8.473 -0.404 1.00 0.00 C ATOM 2591 NH1 ARG B 84 -11.431 8.846 -1.096 1.00 0.00 N ATOM 2592 NH2 ARG B 84 -9.376 9.320 -0.244 1.00 0.00 N ATOM 0 H ARG B 84 -11.598 1.220 0.049 1.00 0.00 H new ATOM 0 HA ARG B 84 -11.264 3.686 -1.505 1.00 0.00 H new ATOM 0 HB2 ARG B 84 -12.372 3.546 0.686 1.00 0.00 H new ATOM 0 HB3 ARG B 84 -10.898 2.914 1.392 1.00 0.00 H new ATOM 0 HG2 ARG B 84 -11.411 5.356 1.820 1.00 0.00 H new ATOM 0 HG3 ARG B 84 -9.791 4.979 1.270 1.00 0.00 H new ATOM 0 HD2 ARG B 84 -10.624 5.602 -1.110 1.00 0.00 H new ATOM 0 HD3 ARG B 84 -12.037 6.274 -0.320 1.00 0.00 H new ATOM 0 HE ARG B 84 -9.505 7.172 0.829 1.00 0.00 H new ATOM 0 HH11 ARG B 84 -12.197 8.190 -1.248 1.00 0.00 H new ATOM 0 HH12 ARG B 84 -11.485 9.790 -1.478 1.00 0.00 H new ATOM 0 HH21 ARG B 84 -8.541 9.036 0.268 1.00 0.00 H new ATOM 0 HH22 ARG B 84 -9.441 10.261 -0.632 1.00 0.00 H new ATOM 2606 N ALA B 85 -8.581 2.127 -0.320 1.00 0.00 N ATOM 2607 CA ALA B 85 -7.111 2.063 -0.454 1.00 0.00 C ATOM 2608 C ALA B 85 -6.597 1.728 -1.871 1.00 0.00 C ATOM 2609 O ALA B 85 -5.532 2.197 -2.281 1.00 0.00 O ATOM 2610 CB ALA B 85 -6.563 1.072 0.591 1.00 0.00 C ATOM 0 H ALA B 85 -8.951 1.480 0.376 1.00 0.00 H new ATOM 0 HA ALA B 85 -6.734 3.069 -0.271 1.00 0.00 H new ATOM 0 HB1 ALA B 85 -5.478 1.014 0.504 1.00 0.00 H new ATOM 0 HB2 ALA B 85 -6.829 1.414 1.591 1.00 0.00 H new ATOM 0 HB3 ALA B 85 -6.994 0.086 0.418 1.00 0.00 H new ATOM 2616 N LEU B 86 -7.345 0.925 -2.636 1.00 0.00 N ATOM 2617 CA LEU B 86 -7.081 0.709 -4.058 1.00 0.00 C ATOM 2618 C LEU B 86 -7.706 1.827 -4.909 1.00 0.00 C ATOM 2619 O LEU B 86 -7.049 2.344 -5.807 1.00 0.00 O ATOM 2620 CB LEU B 86 -7.616 -0.678 -4.462 1.00 0.00 C ATOM 2621 CG LEU B 86 -6.785 -1.386 -5.551 1.00 0.00 C ATOM 2622 CD1 LEU B 86 -7.536 -2.657 -5.947 1.00 0.00 C ATOM 2623 CD2 LEU B 86 -6.502 -0.558 -6.811 1.00 0.00 C ATOM 0 H LEU B 86 -8.150 0.407 -2.284 1.00 0.00 H new ATOM 0 HA LEU B 86 -6.006 0.738 -4.238 1.00 0.00 H new ATOM 0 HB2 LEU B 86 -7.650 -1.313 -3.577 1.00 0.00 H new ATOM 0 HB3 LEU B 86 -8.641 -0.570 -4.816 1.00 0.00 H new ATOM 0 HG LEU B 86 -5.804 -1.580 -5.117 1.00 0.00 H new ATOM 0 HD11 LEU B 86 -6.976 -3.185 -6.718 1.00 0.00 H new ATOM 0 HD12 LEU B 86 -7.648 -3.301 -5.074 1.00 0.00 H new ATOM 0 HD13 LEU B 86 -8.521 -2.393 -6.331 1.00 0.00 H new ATOM 0 HD21 LEU B 86 -5.912 -1.150 -7.510 1.00 0.00 H new ATOM 0 HD22 LEU B 86 -7.445 -0.276 -7.280 1.00 0.00 H new ATOM 0 HD23 LEU B 86 -5.948 0.341 -6.539 1.00 0.00 H new ATOM 2635 N GLY B 87 -8.950 2.224 -4.616 1.00 0.00 N ATOM 2636 CA GLY B 87 -9.767 3.122 -5.443 1.00 0.00 C ATOM 2637 C GLY B 87 -9.280 4.579 -5.486 1.00 0.00 C ATOM 2638 O GLY B 87 -9.473 5.252 -6.495 1.00 0.00 O ATOM 0 H GLY B 87 -9.432 1.920 -3.770 1.00 0.00 H new ATOM 0 HA2 GLY B 87 -9.794 2.732 -6.461 1.00 0.00 H new ATOM 0 HA3 GLY B 87 -10.791 3.107 -5.069 1.00 0.00 H new ATOM 2642 N GLU B 88 -8.633 5.054 -4.418 1.00 0.00 N ATOM 2643 CA GLU B 88 -7.895 6.331 -4.379 1.00 0.00 C ATOM 2644 C GLU B 88 -6.470 6.204 -4.947 1.00 0.00 C ATOM 2645 O GLU B 88 -5.885 7.184 -5.416 1.00 0.00 O ATOM 2646 CB GLU B 88 -7.848 6.838 -2.928 1.00 0.00 C ATOM 2647 CG GLU B 88 -6.910 6.050 -1.991 1.00 0.00 C ATOM 2648 CD GLU B 88 -7.376 6.190 -0.548 1.00 0.00 C ATOM 2649 OE1 GLU B 88 -7.512 7.342 -0.096 1.00 0.00 O ATOM 2650 OE2 GLU B 88 -7.772 5.182 0.070 1.00 0.00 O ATOM 0 H GLU B 88 -8.604 4.552 -3.531 1.00 0.00 H new ATOM 0 HA GLU B 88 -8.422 7.045 -5.012 1.00 0.00 H new ATOM 0 HB2 GLU B 88 -7.537 7.883 -2.934 1.00 0.00 H new ATOM 0 HB3 GLU B 88 -8.857 6.808 -2.516 1.00 0.00 H new ATOM 0 HG2 GLU B 88 -6.897 4.998 -2.277 1.00 0.00 H new ATOM 0 HG3 GLU B 88 -5.889 6.420 -2.090 1.00 0.00 H new ATOM 2657 N LEU B 89 -5.945 4.973 -4.887 1.00 0.00 N ATOM 2658 CA LEU B 89 -4.626 4.498 -5.283 1.00 0.00 C ATOM 2659 C LEU B 89 -3.523 4.990 -4.336 1.00 0.00 C ATOM 2660 O LEU B 89 -3.458 6.153 -3.959 1.00 0.00 O ATOM 2661 CB LEU B 89 -4.353 4.859 -6.763 1.00 0.00 C ATOM 2662 CG LEU B 89 -3.151 4.153 -7.416 1.00 0.00 C ATOM 2663 CD1 LEU B 89 -3.348 2.631 -7.519 1.00 0.00 C ATOM 2664 CD2 LEU B 89 -2.912 4.729 -8.817 1.00 0.00 C ATOM 0 H LEU B 89 -6.504 4.204 -4.517 1.00 0.00 H new ATOM 0 HA LEU B 89 -4.613 3.411 -5.200 1.00 0.00 H new ATOM 0 HB2 LEU B 89 -5.246 4.627 -7.344 1.00 0.00 H new ATOM 0 HB3 LEU B 89 -4.199 5.936 -6.832 1.00 0.00 H new ATOM 0 HG LEU B 89 -2.286 4.331 -6.777 1.00 0.00 H new ATOM 0 HD11 LEU B 89 -2.472 2.182 -7.987 1.00 0.00 H new ATOM 0 HD12 LEU B 89 -3.481 2.213 -6.521 1.00 0.00 H new ATOM 0 HD13 LEU B 89 -4.231 2.418 -8.122 1.00 0.00 H new ATOM 0 HD21 LEU B 89 -2.060 4.227 -9.276 1.00 0.00 H new ATOM 0 HD22 LEU B 89 -3.799 4.573 -9.431 1.00 0.00 H new ATOM 0 HD23 LEU B 89 -2.706 5.797 -8.741 1.00 0.00 H new ATOM 2676 N VAL B 90 -2.548 4.111 -4.096 1.00 0.00 N ATOM 2677 CA VAL B 90 -1.233 4.315 -3.431 1.00 0.00 C ATOM 2678 C VAL B 90 -0.444 5.593 -3.802 1.00 0.00 C ATOM 2679 O VAL B 90 0.646 5.825 -3.279 1.00 0.00 O ATOM 2680 CB VAL B 90 -0.296 3.120 -3.741 1.00 0.00 C ATOM 2681 CG1 VAL B 90 -0.737 1.852 -2.994 1.00 0.00 C ATOM 2682 CG2 VAL B 90 -0.217 2.823 -5.253 1.00 0.00 C ATOM 0 H VAL B 90 -2.657 3.139 -4.386 1.00 0.00 H new ATOM 0 HA VAL B 90 -1.506 4.412 -2.380 1.00 0.00 H new ATOM 0 HB VAL B 90 0.696 3.411 -3.394 1.00 0.00 H new ATOM 0 HG11 VAL B 90 -0.058 1.034 -3.234 1.00 0.00 H new ATOM 0 HG12 VAL B 90 -0.717 2.037 -1.920 1.00 0.00 H new ATOM 0 HG13 VAL B 90 -1.749 1.585 -3.297 1.00 0.00 H new ATOM 0 HG21 VAL B 90 0.451 1.978 -5.423 1.00 0.00 H new ATOM 0 HG22 VAL B 90 -1.211 2.581 -5.629 1.00 0.00 H new ATOM 0 HG23 VAL B 90 0.166 3.699 -5.776 1.00 0.00 H new ATOM 2692 N GLN B 91 -0.935 6.389 -4.754 1.00 0.00 N ATOM 2693 CA GLN B 91 -0.462 7.699 -5.189 1.00 0.00 C ATOM 2694 C GLN B 91 0.846 7.673 -5.969 1.00 0.00 C ATOM 2695 O GLN B 91 1.004 8.535 -6.817 1.00 0.00 O ATOM 2696 CB GLN B 91 -0.380 8.681 -4.007 1.00 0.00 C ATOM 2697 CG GLN B 91 -1.568 9.652 -3.979 1.00 0.00 C ATOM 2698 CD GLN B 91 -1.576 10.753 -5.028 1.00 0.00 C ATOM 2699 OE1 GLN B 91 -1.052 11.833 -4.826 1.00 0.00 O ATOM 2700 NE2 GLN B 91 -2.165 10.547 -6.187 1.00 0.00 N ATOM 0 H GLN B 91 -1.754 6.101 -5.290 1.00 0.00 H new ATOM 0 HA GLN B 91 -1.212 8.052 -5.896 1.00 0.00 H new ATOM 0 HB2 GLN B 91 -0.348 8.121 -3.073 1.00 0.00 H new ATOM 0 HB3 GLN B 91 0.549 9.247 -4.071 1.00 0.00 H new ATOM 0 HG2 GLN B 91 -2.484 9.072 -4.088 1.00 0.00 H new ATOM 0 HG3 GLN B 91 -1.602 10.120 -2.995 1.00 0.00 H new ATOM 0 HE21 GLN B 91 -2.611 9.650 -6.380 1.00 0.00 H new ATOM 0 HE22 GLN B 91 -2.175 11.284 -6.892 1.00 0.00 H new ATOM 2709 N VAL B 92 1.734 6.708 -5.714 1.00 0.00 N ATOM 2710 CA VAL B 92 3.101 6.466 -6.233 1.00 0.00 C ATOM 2711 C VAL B 92 3.237 6.295 -7.761 1.00 0.00 C ATOM 2712 O VAL B 92 3.930 5.421 -8.273 1.00 0.00 O ATOM 2713 CB VAL B 92 3.671 5.272 -5.422 1.00 0.00 C ATOM 2714 CG1 VAL B 92 3.099 3.924 -5.897 1.00 0.00 C ATOM 2715 CG2 VAL B 92 5.194 5.223 -5.324 1.00 0.00 C ATOM 0 H VAL B 92 1.485 5.975 -5.050 1.00 0.00 H new ATOM 0 HA VAL B 92 3.690 7.371 -6.085 1.00 0.00 H new ATOM 0 HB VAL B 92 3.328 5.456 -4.404 1.00 0.00 H new ATOM 0 HG11 VAL B 92 3.526 3.117 -5.301 1.00 0.00 H new ATOM 0 HG12 VAL B 92 2.015 3.927 -5.780 1.00 0.00 H new ATOM 0 HG13 VAL B 92 3.350 3.772 -6.947 1.00 0.00 H new ATOM 0 HG21 VAL B 92 5.493 4.354 -4.738 1.00 0.00 H new ATOM 0 HG22 VAL B 92 5.621 5.151 -6.324 1.00 0.00 H new ATOM 0 HG23 VAL B 92 5.557 6.129 -4.839 1.00 0.00 H new ATOM 2725 N VAL B 93 2.479 7.102 -8.497 1.00 0.00 N ATOM 2726 CA VAL B 93 2.335 7.150 -9.959 1.00 0.00 C ATOM 2727 C VAL B 93 1.796 5.835 -10.562 1.00 0.00 C ATOM 2728 O VAL B 93 1.815 5.657 -11.775 1.00 0.00 O ATOM 2729 CB VAL B 93 3.629 7.632 -10.683 1.00 0.00 C ATOM 2730 CG1 VAL B 93 3.219 8.557 -11.836 1.00 0.00 C ATOM 2731 CG2 VAL B 93 4.600 8.453 -9.813 1.00 0.00 C ATOM 0 H VAL B 93 1.893 7.807 -8.049 1.00 0.00 H new ATOM 0 HA VAL B 93 1.573 7.907 -10.143 1.00 0.00 H new ATOM 0 HB VAL B 93 4.144 6.721 -10.989 1.00 0.00 H new ATOM 0 HG11 VAL B 93 4.111 8.906 -12.357 1.00 0.00 H new ATOM 0 HG12 VAL B 93 2.583 8.011 -12.532 1.00 0.00 H new ATOM 0 HG13 VAL B 93 2.672 9.412 -11.439 1.00 0.00 H new ATOM 0 HG21 VAL B 93 5.467 8.740 -10.408 1.00 0.00 H new ATOM 0 HG22 VAL B 93 4.095 9.349 -9.451 1.00 0.00 H new ATOM 0 HG23 VAL B 93 4.925 7.852 -8.964 1.00 0.00 H new ATOM 2741 N LEU B 94 1.311 4.940 -9.683 1.00 0.00 N ATOM 2742 CA LEU B 94 0.978 3.527 -9.900 1.00 0.00 C ATOM 2743 C LEU B 94 2.307 2.761 -9.873 1.00 0.00 C ATOM 2744 O LEU B 94 3.158 2.936 -10.741 1.00 0.00 O ATOM 2745 CB LEU B 94 0.160 3.292 -11.194 1.00 0.00 C ATOM 2746 CG LEU B 94 -0.617 1.958 -11.251 1.00 0.00 C ATOM 2747 CD1 LEU B 94 -1.571 1.983 -12.454 1.00 0.00 C ATOM 2748 CD2 LEU B 94 0.285 0.717 -11.361 1.00 0.00 C ATOM 0 H LEU B 94 1.127 5.215 -8.718 1.00 0.00 H new ATOM 0 HA LEU B 94 0.316 3.162 -9.115 1.00 0.00 H new ATOM 0 HB2 LEU B 94 -0.549 4.112 -11.310 1.00 0.00 H new ATOM 0 HB3 LEU B 94 0.839 3.335 -12.046 1.00 0.00 H new ATOM 0 HG LEU B 94 -1.157 1.874 -10.308 1.00 0.00 H new ATOM 0 HD11 LEU B 94 -2.123 1.044 -12.500 1.00 0.00 H new ATOM 0 HD12 LEU B 94 -2.272 2.811 -12.346 1.00 0.00 H new ATOM 0 HD13 LEU B 94 -0.997 2.112 -13.371 1.00 0.00 H new ATOM 0 HD21 LEU B 94 -0.333 -0.180 -11.396 1.00 0.00 H new ATOM 0 HD22 LEU B 94 0.883 0.781 -12.270 1.00 0.00 H new ATOM 0 HD23 LEU B 94 0.945 0.669 -10.495 1.00 0.00 H new ATOM 2760 N ALA B 95 2.512 1.905 -8.872 1.00 0.00 N ATOM 2761 CA ALA B 95 3.704 1.050 -8.791 1.00 0.00 C ATOM 2762 C ALA B 95 3.752 0.017 -9.943 1.00 0.00 C ATOM 2763 O ALA B 95 3.343 -1.123 -9.770 1.00 0.00 O ATOM 2764 CB ALA B 95 3.756 0.399 -7.400 1.00 0.00 C ATOM 0 H ALA B 95 1.862 1.782 -8.096 1.00 0.00 H new ATOM 0 HA ALA B 95 4.598 1.660 -8.918 1.00 0.00 H new ATOM 0 HB1 ALA B 95 4.638 -0.238 -7.329 1.00 0.00 H new ATOM 0 HB2 ALA B 95 3.807 1.175 -6.637 1.00 0.00 H new ATOM 0 HB3 ALA B 95 2.860 -0.203 -7.246 1.00 0.00 H new