USER MOD reduce.3.24.130724 H: found=0, std=0, add=1402, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1400 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Single : A 1 MET CE :methyl 142:sc= -0.341 (180deg=-1.64!) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 THR OG1 : rot 180:sc= 0 USER MOD Single : A 3 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 SER OG : rot 180:sc= 0 USER MOD Single : A 5 GLN : amide:sc= 0 K(o=0,f=-0.91) USER MOD Single : A 6 LYS NZ :NH3+ -159:sc= -0.0594 (180deg=-0.523) USER MOD Single : A 7 HIS : no HD1:sc= -2.44! C(o=-2.4!,f=-3.5!) USER MOD Single : A 15 MET CE :methyl -121:sc= -2.37 (180deg=-7.86!) USER MOD Single : A 18 LYS NZ :NH3+ -124:sc= 0.0179 (180deg=-0.134) USER MOD Single : A 22 SER OG : rot 150:sc= 0 USER MOD Single : A 32 LYS NZ :NH3+ -126:sc= -2.06 (180deg=-4.89!) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ -167:sc= 0 (180deg=-0.221) USER MOD Single : A 43 TYR OH : rot 180:sc= 0 USER MOD Single : A 48 GLN : amide:sc= -0.383 X(o=-0.38,f=-0.42) USER MOD Single : A 53 LYS NZ :NH3+ 158:sc= -0.0801 (180deg=-0.695) USER MOD Single : A 54 LYS NZ :NH3+ -177:sc= -0.571 (180deg=-0.666) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 THR OG1 : rot 98:sc= 0.898 USER MOD Single : A 67 CYS SG : rot -40:sc= 0.91 USER MOD Single : A 70 ASN : amide:sc= -0.465 X(o=-0.46,f=-0.00067) USER MOD Single : A 72 LYS NZ :NH3+ -131:sc= -2.37! (180deg=-4.97!) USER MOD Single : A 73 GLN : amide:sc= -1.11! K(o=-1.1!,f=-1.7) USER MOD Single : A 74 SER OG : rot -49:sc= 0.23 USER MOD Single : A 77 CYS SG : rot -0:sc= -0.934 USER MOD Single : A 80 CYS SG : rot -140:sc= -0.17 USER MOD Single : A 85 CYS SG : rot 180:sc= 0 USER MOD Single : B 1 MET CE :methyl 153:sc= -0.32 (180deg=-1.57!) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 THR OG1 : rot 180:sc= 0 USER MOD Single : B 3 THR OG1 : rot 180:sc= 0 USER MOD Single : B 4 SER OG : rot 180:sc= 0 USER MOD Single : B 5 GLN : amide:sc= 0 K(o=0,f=-0.93) USER MOD Single : B 6 LYS NZ :NH3+ -160:sc= -0.0495 (180deg=-0.579) USER MOD Single : B 7 HIS : no HD1:sc= -2.25! C(o=-2.2!,f=-3.4!) USER MOD Single : B 15 MET CE :methyl -125:sc= -2.36 (180deg=-7.91!) USER MOD Single : B 18 LYS NZ :NH3+ -124:sc= 0.0168 (180deg=-0.143) USER MOD Single : B 22 SER OG : rot 150:sc= 0 USER MOD Single : B 32 LYS NZ :NH3+ -131:sc= -2.11 (180deg=-4.9!) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 41 LYS NZ :NH3+ -167:sc= -0.0023 (180deg=-0.205) USER MOD Single : B 43 TYR OH : rot 180:sc= 0 USER MOD Single : B 48 GLN : amide:sc= -0.335 X(o=-0.34,f=-0.38) USER MOD Single : B 53 LYS NZ :NH3+ 157:sc= -0.0749 (180deg=-0.655) USER MOD Single : B 54 LYS NZ :NH3+ -175:sc= -0.61 (180deg=-0.659) USER MOD Single : B 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 66 THR OG1 : rot 99:sc= 0.739 USER MOD Single : B 67 CYS SG : rot -34:sc= 0.828 USER MOD Single : B 70 ASN : amide:sc= -0.455 X(o=-0.45,f=0) USER MOD Single : B 72 LYS NZ :NH3+ -131:sc= -2.41 (180deg=-4.96!) USER MOD Single : B 73 GLN : amide:sc= -1.13! K(o=-1.1!,f=-1.7) USER MOD Single : B 74 SER OG : rot -48:sc= 0.228 USER MOD Single : B 77 CYS SG : rot -18:sc= -0.945 USER MOD Single : B 80 CYS SG : rot -140:sc= -0.163 USER MOD Single : B 85 CYS SG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 115.104 -12.244 9.345 1.00 0.00 N ATOM 2 CA MET A 1 115.751 -12.170 10.685 1.00 0.00 C ATOM 3 C MET A 1 116.728 -10.991 10.704 1.00 0.00 C ATOM 4 O MET A 1 117.926 -11.162 10.589 1.00 0.00 O ATOM 5 CB MET A 1 116.508 -13.476 10.954 1.00 0.00 C ATOM 6 CG MET A 1 117.098 -13.463 12.370 1.00 0.00 C ATOM 7 SD MET A 1 115.767 -13.392 13.603 1.00 0.00 S ATOM 8 CE MET A 1 114.958 -14.957 13.190 1.00 0.00 C ATOM 0 H1 MET A 1 114.439 -13.043 9.324 1.00 0.00 H new ATOM 0 H2 MET A 1 114.589 -11.360 9.159 1.00 0.00 H new ATOM 0 H3 MET A 1 115.832 -12.381 8.615 1.00 0.00 H new ATOM 0 HA MET A 1 114.995 -12.027 11.457 1.00 0.00 H new ATOM 0 HB2 MET A 1 115.835 -14.325 10.840 1.00 0.00 H new ATOM 0 HB3 MET A 1 117.305 -13.601 10.221 1.00 0.00 H new ATOM 0 HG2 MET A 1 117.703 -14.356 12.528 1.00 0.00 H new ATOM 0 HG3 MET A 1 117.760 -12.605 12.488 1.00 0.00 H new ATOM 0 HE1 MET A 1 114.616 -15.442 14.104 1.00 0.00 H new ATOM 0 HE2 MET A 1 114.104 -14.765 12.540 1.00 0.00 H new ATOM 0 HE3 MET A 1 115.666 -15.608 12.676 1.00 0.00 H new ATOM 20 N THR A 2 116.223 -9.795 10.841 1.00 0.00 N ATOM 21 CA THR A 2 117.117 -8.605 10.858 1.00 0.00 C ATOM 22 C THR A 2 118.034 -8.646 9.630 1.00 0.00 C ATOM 23 O THR A 2 117.592 -8.466 8.514 1.00 0.00 O ATOM 24 CB THR A 2 117.950 -8.610 12.145 1.00 0.00 C ATOM 25 OG1 THR A 2 117.086 -8.790 13.259 1.00 0.00 O ATOM 26 CG2 THR A 2 118.691 -7.278 12.287 1.00 0.00 C ATOM 0 H THR A 2 115.229 -9.592 10.942 1.00 0.00 H new ATOM 0 HA THR A 2 116.522 -7.692 10.828 1.00 0.00 H new ATOM 0 HB THR A 2 118.676 -9.422 12.105 1.00 0.00 H new ATOM 0 HG1 THR A 2 117.614 -8.796 14.085 1.00 0.00 H new ATOM 0 HG21 THR A 2 119.282 -7.286 13.203 1.00 0.00 H new ATOM 0 HG22 THR A 2 119.351 -7.136 11.431 1.00 0.00 H new ATOM 0 HG23 THR A 2 117.969 -6.463 12.328 1.00 0.00 H new ATOM 34 N THR A 3 119.306 -8.881 9.820 1.00 0.00 N ATOM 35 CA THR A 3 120.233 -8.930 8.653 1.00 0.00 C ATOM 36 C THR A 3 120.000 -10.218 7.858 1.00 0.00 C ATOM 37 O THR A 3 119.616 -11.235 8.398 1.00 0.00 O ATOM 38 CB THR A 3 121.680 -8.892 9.151 1.00 0.00 C ATOM 39 OG1 THR A 3 121.893 -9.961 10.063 1.00 0.00 O ATOM 40 CG2 THR A 3 121.946 -7.559 9.850 1.00 0.00 C ATOM 0 H THR A 3 119.741 -9.040 10.729 1.00 0.00 H new ATOM 0 HA THR A 3 120.045 -8.072 8.008 1.00 0.00 H new ATOM 0 HB THR A 3 122.359 -8.996 8.305 1.00 0.00 H new ATOM 0 HG1 THR A 3 122.819 -9.939 10.382 1.00 0.00 H new ATOM 0 HG21 THR A 3 122.977 -7.533 10.204 1.00 0.00 H new ATOM 0 HG22 THR A 3 121.783 -6.741 9.148 1.00 0.00 H new ATOM 0 HG23 THR A 3 121.268 -7.451 10.697 1.00 0.00 H new ATOM 48 N SER A 4 120.239 -10.177 6.576 1.00 0.00 N ATOM 49 CA SER A 4 120.044 -11.390 5.730 1.00 0.00 C ATOM 50 C SER A 4 121.255 -12.313 5.874 1.00 0.00 C ATOM 51 O SER A 4 122.247 -11.974 6.488 1.00 0.00 O ATOM 52 CB SER A 4 119.903 -10.968 4.267 1.00 0.00 C ATOM 53 OG SER A 4 121.084 -10.287 3.863 1.00 0.00 O ATOM 0 H SER A 4 120.563 -9.350 6.074 1.00 0.00 H new ATOM 0 HA SER A 4 119.145 -11.916 6.050 1.00 0.00 H new ATOM 0 HB2 SER A 4 119.739 -11.843 3.638 1.00 0.00 H new ATOM 0 HB3 SER A 4 119.035 -10.320 4.145 1.00 0.00 H new ATOM 0 HG SER A 4 121.000 -10.015 2.925 1.00 0.00 H new ATOM 59 N GLN A 5 121.164 -13.489 5.314 1.00 0.00 N ATOM 60 CA GLN A 5 122.284 -14.469 5.405 1.00 0.00 C ATOM 61 C GLN A 5 123.517 -13.922 4.684 1.00 0.00 C ATOM 62 O GLN A 5 124.634 -14.286 4.989 1.00 0.00 O ATOM 63 CB GLN A 5 121.859 -15.787 4.754 1.00 0.00 C ATOM 64 CG GLN A 5 120.798 -16.468 5.623 1.00 0.00 C ATOM 65 CD GLN A 5 120.360 -17.777 4.963 1.00 0.00 C ATOM 66 OE1 GLN A 5 120.332 -17.882 3.752 1.00 0.00 O ATOM 67 NE2 GLN A 5 120.013 -18.787 5.713 1.00 0.00 N ATOM 0 H GLN A 5 120.351 -13.816 4.791 1.00 0.00 H new ATOM 0 HA GLN A 5 122.528 -14.637 6.454 1.00 0.00 H new ATOM 0 HB2 GLN A 5 121.462 -15.600 3.756 1.00 0.00 H new ATOM 0 HB3 GLN A 5 122.723 -16.442 4.636 1.00 0.00 H new ATOM 0 HG2 GLN A 5 121.199 -16.666 6.617 1.00 0.00 H new ATOM 0 HG3 GLN A 5 119.940 -15.808 5.751 1.00 0.00 H new ATOM 0 HE21 GLN A 5 120.036 -18.700 6.729 1.00 0.00 H new ATOM 0 HE22 GLN A 5 119.719 -19.664 5.283 1.00 0.00 H new ATOM 76 N LYS A 6 123.328 -13.049 3.728 1.00 0.00 N ATOM 77 CA LYS A 6 124.492 -12.484 2.992 1.00 0.00 C ATOM 78 C LYS A 6 125.393 -11.724 3.968 1.00 0.00 C ATOM 79 O LYS A 6 126.600 -11.720 3.835 1.00 0.00 O ATOM 80 CB LYS A 6 123.993 -11.525 1.907 1.00 0.00 C ATOM 81 CG LYS A 6 123.302 -12.325 0.799 1.00 0.00 C ATOM 82 CD LYS A 6 122.800 -11.371 -0.288 1.00 0.00 C ATOM 83 CE LYS A 6 122.110 -12.177 -1.391 1.00 0.00 C ATOM 84 NZ LYS A 6 123.105 -13.074 -2.046 1.00 0.00 N ATOM 0 H LYS A 6 122.416 -12.705 3.427 1.00 0.00 H new ATOM 0 HA LYS A 6 125.057 -13.294 2.530 1.00 0.00 H new ATOM 0 HB2 LYS A 6 123.299 -10.803 2.336 1.00 0.00 H new ATOM 0 HB3 LYS A 6 124.828 -10.959 1.495 1.00 0.00 H new ATOM 0 HG2 LYS A 6 123.997 -13.047 0.370 1.00 0.00 H new ATOM 0 HG3 LYS A 6 122.468 -12.892 1.212 1.00 0.00 H new ATOM 0 HD2 LYS A 6 122.105 -10.649 0.139 1.00 0.00 H new ATOM 0 HD3 LYS A 6 123.633 -10.804 -0.703 1.00 0.00 H new ATOM 0 HE2 LYS A 6 121.295 -12.766 -0.970 1.00 0.00 H new ATOM 0 HE3 LYS A 6 121.670 -11.504 -2.127 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 122.759 -13.347 -2.988 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 124.012 -12.575 -2.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 123.238 -13.927 -1.466 1.00 0.00 H new ATOM 98 N HIS A 7 124.820 -11.072 4.938 1.00 0.00 N ATOM 99 CA HIS A 7 125.649 -10.301 5.908 1.00 0.00 C ATOM 100 C HIS A 7 126.635 -11.230 6.628 1.00 0.00 C ATOM 101 O HIS A 7 127.812 -10.946 6.714 1.00 0.00 O ATOM 102 CB HIS A 7 124.724 -9.620 6.926 1.00 0.00 C ATOM 103 CG HIS A 7 125.532 -9.017 8.045 1.00 0.00 C ATOM 104 ND1 HIS A 7 126.131 -7.768 7.946 1.00 0.00 N ATOM 105 CD2 HIS A 7 125.838 -9.481 9.302 1.00 0.00 C ATOM 106 CE1 HIS A 7 126.759 -7.525 9.114 1.00 0.00 C ATOM 107 NE2 HIS A 7 126.609 -8.537 9.969 1.00 0.00 N ATOM 0 H HIS A 7 123.814 -11.038 5.103 1.00 0.00 H new ATOM 0 HA HIS A 7 126.223 -9.545 5.372 1.00 0.00 H new ATOM 0 HB2 HIS A 7 124.138 -8.845 6.433 1.00 0.00 H new ATOM 0 HB3 HIS A 7 124.018 -10.346 7.329 1.00 0.00 H new ATOM 0 HD2 HIS A 7 125.527 -10.432 9.708 1.00 0.00 H new ATOM 0 HE1 HIS A 7 127.314 -6.624 9.330 1.00 0.00 H new ATOM 0 HE2 HIS A 7 126.983 -8.604 10.916 1.00 0.00 H new ATOM 115 N ARG A 8 126.170 -12.336 7.149 1.00 0.00 N ATOM 116 CA ARG A 8 127.086 -13.272 7.863 1.00 0.00 C ATOM 117 C ARG A 8 128.027 -13.945 6.857 1.00 0.00 C ATOM 118 O ARG A 8 129.157 -14.269 7.166 1.00 0.00 O ATOM 119 CB ARG A 8 126.257 -14.351 8.580 1.00 0.00 C ATOM 120 CG ARG A 8 125.437 -13.733 9.727 1.00 0.00 C ATOM 121 CD ARG A 8 126.307 -13.511 10.974 1.00 0.00 C ATOM 122 NE ARG A 8 127.046 -14.769 11.330 1.00 0.00 N ATOM 123 CZ ARG A 8 126.420 -15.887 11.591 1.00 0.00 C ATOM 124 NH1 ARG A 8 125.120 -15.909 11.710 1.00 0.00 N ATOM 125 NH2 ARG A 8 127.104 -16.980 11.789 1.00 0.00 N ATOM 0 H ARG A 8 125.194 -12.631 7.110 1.00 0.00 H new ATOM 0 HA ARG A 8 127.674 -12.713 8.591 1.00 0.00 H new ATOM 0 HB2 ARG A 8 125.589 -14.836 7.869 1.00 0.00 H new ATOM 0 HB3 ARG A 8 126.918 -15.123 8.974 1.00 0.00 H new ATOM 0 HG2 ARG A 8 125.012 -12.783 9.403 1.00 0.00 H new ATOM 0 HG3 ARG A 8 124.602 -14.388 9.975 1.00 0.00 H new ATOM 0 HD2 ARG A 8 127.017 -12.705 10.791 1.00 0.00 H new ATOM 0 HD3 ARG A 8 125.681 -13.201 11.811 1.00 0.00 H new ATOM 0 HE ARG A 8 128.065 -14.751 11.369 1.00 0.00 H new ATOM 0 HH11 ARG A 8 124.583 -15.049 11.599 1.00 0.00 H new ATOM 0 HH12 ARG A 8 124.641 -16.786 11.914 1.00 0.00 H new ATOM 0 HH21 ARG A 8 128.123 -16.960 11.740 1.00 0.00 H new ATOM 0 HH22 ARG A 8 126.620 -17.855 11.993 1.00 0.00 H new ATOM 139 N ASP A 9 127.567 -14.157 5.658 1.00 0.00 N ATOM 140 CA ASP A 9 128.424 -14.808 4.627 1.00 0.00 C ATOM 141 C ASP A 9 129.523 -13.850 4.158 1.00 0.00 C ATOM 142 O ASP A 9 130.642 -14.249 3.906 1.00 0.00 O ATOM 143 CB ASP A 9 127.573 -15.204 3.421 1.00 0.00 C ATOM 144 CG ASP A 9 126.648 -16.363 3.799 1.00 0.00 C ATOM 145 OD1 ASP A 9 126.922 -17.014 4.793 1.00 0.00 O ATOM 146 OD2 ASP A 9 125.685 -16.581 3.085 1.00 0.00 O ATOM 0 H ASP A 9 126.629 -13.907 5.344 1.00 0.00 H new ATOM 0 HA ASP A 9 128.880 -15.693 5.071 1.00 0.00 H new ATOM 0 HB2 ASP A 9 126.984 -14.351 3.084 1.00 0.00 H new ATOM 0 HB3 ASP A 9 128.216 -15.495 2.590 1.00 0.00 H new ATOM 151 N PHE A 10 129.199 -12.594 4.015 1.00 0.00 N ATOM 152 CA PHE A 10 130.205 -11.604 3.527 1.00 0.00 C ATOM 153 C PHE A 10 131.312 -11.417 4.569 1.00 0.00 C ATOM 154 O PHE A 10 132.474 -11.294 4.236 1.00 0.00 O ATOM 155 CB PHE A 10 129.493 -10.269 3.292 1.00 0.00 C ATOM 156 CG PHE A 10 130.406 -9.304 2.570 1.00 0.00 C ATOM 157 CD1 PHE A 10 131.268 -8.471 3.295 1.00 0.00 C ATOM 158 CD2 PHE A 10 130.381 -9.236 1.170 1.00 0.00 C ATOM 159 CE1 PHE A 10 132.106 -7.573 2.619 1.00 0.00 C ATOM 160 CE2 PHE A 10 131.218 -8.338 0.496 1.00 0.00 C ATOM 161 CZ PHE A 10 132.081 -7.506 1.220 1.00 0.00 C ATOM 0 H PHE A 10 128.277 -12.208 4.216 1.00 0.00 H new ATOM 0 HA PHE A 10 130.656 -11.963 2.602 1.00 0.00 H new ATOM 0 HB2 PHE A 10 128.588 -10.431 2.706 1.00 0.00 H new ATOM 0 HB3 PHE A 10 129.183 -9.842 4.246 1.00 0.00 H new ATOM 0 HD1 PHE A 10 131.287 -8.521 4.374 1.00 0.00 H new ATOM 0 HD2 PHE A 10 129.716 -9.877 0.611 1.00 0.00 H new ATOM 0 HE1 PHE A 10 132.772 -6.932 3.178 1.00 0.00 H new ATOM 0 HE2 PHE A 10 131.198 -8.287 -0.583 1.00 0.00 H new ATOM 0 HZ PHE A 10 132.727 -6.813 0.700 1.00 0.00 H new ATOM 171 N VAL A 11 130.961 -11.380 5.824 1.00 0.00 N ATOM 172 CA VAL A 11 131.991 -11.185 6.886 1.00 0.00 C ATOM 173 C VAL A 11 132.661 -12.518 7.228 1.00 0.00 C ATOM 174 O VAL A 11 133.284 -12.655 8.264 1.00 0.00 O ATOM 175 CB VAL A 11 131.312 -10.622 8.135 1.00 0.00 C ATOM 176 CG1 VAL A 11 130.637 -9.289 7.790 1.00 0.00 C ATOM 177 CG2 VAL A 11 130.259 -11.621 8.634 1.00 0.00 C ATOM 0 H VAL A 11 130.004 -11.476 6.162 1.00 0.00 H new ATOM 0 HA VAL A 11 132.752 -10.493 6.527 1.00 0.00 H new ATOM 0 HB VAL A 11 132.055 -10.459 8.916 1.00 0.00 H new ATOM 0 HG11 VAL A 11 130.152 -8.886 8.679 1.00 0.00 H new ATOM 0 HG12 VAL A 11 131.387 -8.583 7.434 1.00 0.00 H new ATOM 0 HG13 VAL A 11 129.891 -9.450 7.011 1.00 0.00 H new ATOM 0 HG21 VAL A 11 129.773 -11.223 9.525 1.00 0.00 H new ATOM 0 HG22 VAL A 11 129.514 -11.783 7.855 1.00 0.00 H new ATOM 0 HG23 VAL A 11 130.742 -12.568 8.877 1.00 0.00 H new ATOM 187 N ALA A 12 132.523 -13.510 6.377 1.00 0.00 N ATOM 188 CA ALA A 12 133.134 -14.855 6.655 1.00 0.00 C ATOM 189 C ALA A 12 134.120 -15.241 5.546 1.00 0.00 C ATOM 190 O ALA A 12 134.793 -16.250 5.637 1.00 0.00 O ATOM 191 CB ALA A 12 132.019 -15.900 6.720 1.00 0.00 C ATOM 0 H ALA A 12 132.011 -13.447 5.497 1.00 0.00 H new ATOM 0 HA ALA A 12 133.672 -14.811 7.602 1.00 0.00 H new ATOM 0 HB1 ALA A 12 132.451 -16.880 6.921 1.00 0.00 H new ATOM 0 HB2 ALA A 12 131.322 -15.640 7.517 1.00 0.00 H new ATOM 0 HB3 ALA A 12 131.488 -15.926 5.768 1.00 0.00 H new ATOM 197 N GLU A 13 134.233 -14.453 4.509 1.00 0.00 N ATOM 198 CA GLU A 13 135.199 -14.792 3.417 1.00 0.00 C ATOM 199 C GLU A 13 135.641 -13.501 2.712 1.00 0.00 C ATOM 200 O GLU A 13 134.886 -12.551 2.644 1.00 0.00 O ATOM 201 CB GLU A 13 134.526 -15.726 2.406 1.00 0.00 C ATOM 202 CG GLU A 13 133.207 -15.111 1.933 1.00 0.00 C ATOM 203 CD GLU A 13 132.622 -15.967 0.808 1.00 0.00 C ATOM 204 OE1 GLU A 13 133.396 -16.537 0.060 1.00 0.00 O ATOM 205 OE2 GLU A 13 131.406 -16.036 0.715 1.00 0.00 O ATOM 0 H GLU A 13 133.702 -13.593 4.369 1.00 0.00 H new ATOM 0 HA GLU A 13 136.069 -15.292 3.842 1.00 0.00 H new ATOM 0 HB2 GLU A 13 135.186 -15.893 1.555 1.00 0.00 H new ATOM 0 HB3 GLU A 13 134.342 -16.699 2.862 1.00 0.00 H new ATOM 0 HG2 GLU A 13 132.503 -15.051 2.763 1.00 0.00 H new ATOM 0 HG3 GLU A 13 133.373 -14.093 1.581 1.00 0.00 H new ATOM 212 N PRO A 14 136.841 -13.452 2.172 1.00 0.00 N ATOM 213 CA PRO A 14 137.330 -12.238 1.458 1.00 0.00 C ATOM 214 C PRO A 14 136.240 -11.636 0.563 1.00 0.00 C ATOM 215 O PRO A 14 135.292 -12.302 0.196 1.00 0.00 O ATOM 216 CB PRO A 14 138.499 -12.764 0.616 1.00 0.00 C ATOM 217 CG PRO A 14 139.034 -13.942 1.376 1.00 0.00 C ATOM 218 CD PRO A 14 137.858 -14.525 2.179 1.00 0.00 C ATOM 0 HA PRO A 14 137.619 -11.439 2.141 1.00 0.00 H new ATOM 0 HB2 PRO A 14 138.166 -13.056 -0.380 1.00 0.00 H new ATOM 0 HB3 PRO A 14 139.265 -12.000 0.485 1.00 0.00 H new ATOM 0 HG2 PRO A 14 139.444 -14.688 0.695 1.00 0.00 H new ATOM 0 HG3 PRO A 14 139.843 -13.638 2.041 1.00 0.00 H new ATOM 0 HD2 PRO A 14 137.477 -15.437 1.720 1.00 0.00 H new ATOM 0 HD3 PRO A 14 138.159 -14.781 3.195 1.00 0.00 H new ATOM 226 N MET A 15 136.364 -10.387 0.198 1.00 0.00 N ATOM 227 CA MET A 15 135.328 -9.761 -0.680 1.00 0.00 C ATOM 228 C MET A 15 135.728 -9.959 -2.144 1.00 0.00 C ATOM 229 O MET A 15 134.907 -9.915 -3.037 1.00 0.00 O ATOM 230 CB MET A 15 135.221 -8.266 -0.365 1.00 0.00 C ATOM 231 CG MET A 15 136.620 -7.685 -0.169 1.00 0.00 C ATOM 232 SD MET A 15 136.534 -5.873 -0.184 1.00 0.00 S ATOM 233 CE MET A 15 135.626 -5.630 1.368 1.00 0.00 C ATOM 0 H MET A 15 137.134 -9.774 0.468 1.00 0.00 H new ATOM 0 HA MET A 15 134.360 -10.230 -0.501 1.00 0.00 H new ATOM 0 HB2 MET A 15 134.711 -7.748 -1.177 1.00 0.00 H new ATOM 0 HB3 MET A 15 134.624 -8.115 0.534 1.00 0.00 H new ATOM 0 HG2 MET A 15 137.040 -8.031 0.775 1.00 0.00 H new ATOM 0 HG3 MET A 15 137.284 -8.034 -0.960 1.00 0.00 H new ATOM 0 HE1 MET A 15 134.697 -5.097 1.166 1.00 0.00 H new ATOM 0 HE2 MET A 15 135.400 -6.599 1.813 1.00 0.00 H new ATOM 0 HE3 MET A 15 136.236 -5.047 2.059 1.00 0.00 H new ATOM 243 N GLY A 16 136.992 -10.187 -2.389 1.00 0.00 N ATOM 244 CA GLY A 16 137.464 -10.405 -3.787 1.00 0.00 C ATOM 245 C GLY A 16 136.964 -9.285 -4.702 1.00 0.00 C ATOM 246 O GLY A 16 137.014 -8.120 -4.361 1.00 0.00 O ATOM 0 H GLY A 16 137.721 -10.232 -1.677 1.00 0.00 H new ATOM 0 HA2 GLY A 16 138.553 -10.441 -3.808 1.00 0.00 H new ATOM 0 HA3 GLY A 16 137.106 -11.368 -4.152 1.00 0.00 H new ATOM 250 N GLU A 17 136.512 -9.638 -5.881 1.00 0.00 N ATOM 251 CA GLU A 17 136.034 -8.615 -6.867 1.00 0.00 C ATOM 252 C GLU A 17 134.512 -8.695 -7.019 1.00 0.00 C ATOM 253 O GLU A 17 133.975 -8.470 -8.085 1.00 0.00 O ATOM 254 CB GLU A 17 136.690 -8.894 -8.221 1.00 0.00 C ATOM 255 CG GLU A 17 138.210 -8.804 -8.078 1.00 0.00 C ATOM 256 CD GLU A 17 138.871 -9.083 -9.429 1.00 0.00 C ATOM 257 OE1 GLU A 17 138.150 -9.360 -10.373 1.00 0.00 O ATOM 258 OE2 GLU A 17 140.088 -9.023 -9.495 1.00 0.00 O ATOM 0 H GLU A 17 136.453 -10.603 -6.207 1.00 0.00 H new ATOM 0 HA GLU A 17 136.301 -7.619 -6.513 1.00 0.00 H new ATOM 0 HB2 GLU A 17 136.405 -9.884 -8.578 1.00 0.00 H new ATOM 0 HB3 GLU A 17 136.340 -8.175 -8.962 1.00 0.00 H new ATOM 0 HG2 GLU A 17 138.494 -7.814 -7.721 1.00 0.00 H new ATOM 0 HG3 GLU A 17 138.559 -9.522 -7.336 1.00 0.00 H new ATOM 265 N LYS A 18 133.812 -9.022 -5.967 1.00 0.00 N ATOM 266 CA LYS A 18 132.328 -9.123 -6.063 1.00 0.00 C ATOM 267 C LYS A 18 131.759 -7.760 -6.488 1.00 0.00 C ATOM 268 O LYS A 18 132.332 -6.730 -6.190 1.00 0.00 O ATOM 269 CB LYS A 18 131.765 -9.502 -4.692 1.00 0.00 C ATOM 270 CG LYS A 18 132.128 -10.952 -4.378 1.00 0.00 C ATOM 271 CD LYS A 18 131.636 -11.309 -2.974 1.00 0.00 C ATOM 272 CE LYS A 18 131.986 -12.765 -2.669 1.00 0.00 C ATOM 273 NZ LYS A 18 133.450 -12.881 -2.423 1.00 0.00 N ATOM 0 H LYS A 18 134.203 -9.223 -5.047 1.00 0.00 H new ATOM 0 HA LYS A 18 132.052 -9.881 -6.796 1.00 0.00 H new ATOM 0 HB2 LYS A 18 132.168 -8.840 -3.925 1.00 0.00 H new ATOM 0 HB3 LYS A 18 130.682 -9.377 -4.684 1.00 0.00 H new ATOM 0 HG2 LYS A 18 131.677 -11.618 -5.113 1.00 0.00 H new ATOM 0 HG3 LYS A 18 133.207 -11.090 -4.443 1.00 0.00 H new ATOM 0 HD2 LYS A 18 132.096 -10.651 -2.237 1.00 0.00 H new ATOM 0 HD3 LYS A 18 130.558 -11.160 -2.905 1.00 0.00 H new ATOM 0 HE2 LYS A 18 131.431 -13.109 -1.796 1.00 0.00 H new ATOM 0 HE3 LYS A 18 131.695 -13.403 -3.503 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 133.857 -13.583 -3.073 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 133.903 -11.958 -2.582 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 133.614 -13.183 -1.441 1.00 0.00 H new ATOM 287 N PRO A 19 130.646 -7.744 -7.189 1.00 0.00 N ATOM 288 CA PRO A 19 130.022 -6.473 -7.663 1.00 0.00 C ATOM 289 C PRO A 19 129.557 -5.591 -6.500 1.00 0.00 C ATOM 290 O PRO A 19 129.253 -6.065 -5.424 1.00 0.00 O ATOM 291 CB PRO A 19 128.831 -6.933 -8.528 1.00 0.00 C ATOM 292 CG PRO A 19 128.535 -8.330 -8.079 1.00 0.00 C ATOM 293 CD PRO A 19 129.865 -8.922 -7.610 1.00 0.00 C ATOM 0 HA PRO A 19 130.729 -5.856 -8.217 1.00 0.00 H new ATOM 0 HB2 PRO A 19 127.968 -6.283 -8.387 1.00 0.00 H new ATOM 0 HB3 PRO A 19 129.081 -6.905 -9.589 1.00 0.00 H new ATOM 0 HG2 PRO A 19 127.803 -8.332 -7.272 1.00 0.00 H new ATOM 0 HG3 PRO A 19 128.113 -8.919 -8.893 1.00 0.00 H new ATOM 0 HD2 PRO A 19 129.723 -9.623 -6.787 1.00 0.00 H new ATOM 0 HD3 PRO A 19 130.364 -9.468 -8.411 1.00 0.00 H new ATOM 301 N VAL A 20 129.522 -4.306 -6.713 1.00 0.00 N ATOM 302 CA VAL A 20 129.104 -3.374 -5.632 1.00 0.00 C ATOM 303 C VAL A 20 127.736 -3.784 -5.071 1.00 0.00 C ATOM 304 O VAL A 20 127.495 -3.717 -3.883 1.00 0.00 O ATOM 305 CB VAL A 20 129.032 -1.951 -6.197 1.00 0.00 C ATOM 306 CG1 VAL A 20 128.179 -1.938 -7.469 1.00 0.00 C ATOM 307 CG2 VAL A 20 128.408 -1.012 -5.159 1.00 0.00 C ATOM 0 H VAL A 20 129.767 -3.859 -7.596 1.00 0.00 H new ATOM 0 HA VAL A 20 129.833 -3.412 -4.823 1.00 0.00 H new ATOM 0 HB VAL A 20 130.041 -1.613 -6.434 1.00 0.00 H new ATOM 0 HG11 VAL A 20 128.132 -0.924 -7.865 1.00 0.00 H new ATOM 0 HG12 VAL A 20 128.625 -2.598 -8.213 1.00 0.00 H new ATOM 0 HG13 VAL A 20 127.172 -2.283 -7.235 1.00 0.00 H new ATOM 0 HG21 VAL A 20 128.359 -0.002 -5.565 1.00 0.00 H new ATOM 0 HG22 VAL A 20 127.402 -1.355 -4.916 1.00 0.00 H new ATOM 0 HG23 VAL A 20 129.018 -1.011 -4.256 1.00 0.00 H new ATOM 317 N GLY A 21 126.829 -4.188 -5.927 1.00 0.00 N ATOM 318 CA GLY A 21 125.467 -4.577 -5.464 1.00 0.00 C ATOM 319 C GLY A 21 125.537 -5.812 -4.564 1.00 0.00 C ATOM 320 O GLY A 21 124.539 -6.242 -4.019 1.00 0.00 O ATOM 0 H GLY A 21 126.978 -4.264 -6.933 1.00 0.00 H new ATOM 0 HA2 GLY A 21 125.012 -3.749 -4.920 1.00 0.00 H new ATOM 0 HA3 GLY A 21 124.830 -4.783 -6.324 1.00 0.00 H new ATOM 324 N SER A 22 126.695 -6.393 -4.394 1.00 0.00 N ATOM 325 CA SER A 22 126.794 -7.596 -3.517 1.00 0.00 C ATOM 326 C SER A 22 126.900 -7.148 -2.059 1.00 0.00 C ATOM 327 O SER A 22 126.586 -7.889 -1.149 1.00 0.00 O ATOM 328 CB SER A 22 128.036 -8.406 -3.893 1.00 0.00 C ATOM 329 OG SER A 22 128.173 -9.497 -2.990 1.00 0.00 O ATOM 0 H SER A 22 127.570 -6.090 -4.821 1.00 0.00 H new ATOM 0 HA SER A 22 125.907 -8.216 -3.648 1.00 0.00 H new ATOM 0 HB2 SER A 22 127.950 -8.773 -4.916 1.00 0.00 H new ATOM 0 HB3 SER A 22 128.923 -7.773 -3.855 1.00 0.00 H new ATOM 0 HG SER A 22 128.608 -10.247 -3.447 1.00 0.00 H new ATOM 335 N LEU A 23 127.337 -5.939 -1.826 1.00 0.00 N ATOM 336 CA LEU A 23 127.457 -5.454 -0.424 1.00 0.00 C ATOM 337 C LEU A 23 126.071 -5.415 0.220 1.00 0.00 C ATOM 338 O LEU A 23 125.092 -5.034 -0.391 1.00 0.00 O ATOM 339 CB LEU A 23 128.075 -4.049 -0.414 1.00 0.00 C ATOM 340 CG LEU A 23 129.557 -4.118 -0.820 1.00 0.00 C ATOM 341 CD1 LEU A 23 130.071 -2.697 -1.080 1.00 0.00 C ATOM 342 CD2 LEU A 23 130.395 -4.765 0.302 1.00 0.00 C ATOM 0 H LEU A 23 127.615 -5.270 -2.544 1.00 0.00 H new ATOM 0 HA LEU A 23 128.099 -6.130 0.141 1.00 0.00 H new ATOM 0 HB2 LEU A 23 127.532 -3.400 -1.101 1.00 0.00 H new ATOM 0 HB3 LEU A 23 127.983 -3.610 0.579 1.00 0.00 H new ATOM 0 HG LEU A 23 129.650 -4.724 -1.721 1.00 0.00 H new ATOM 0 HD11 LEU A 23 131.121 -2.737 -1.368 1.00 0.00 H new ATOM 0 HD12 LEU A 23 129.491 -2.242 -1.883 1.00 0.00 H new ATOM 0 HD13 LEU A 23 129.966 -2.101 -0.174 1.00 0.00 H new ATOM 0 HD21 LEU A 23 131.441 -4.806 -0.002 1.00 0.00 H new ATOM 0 HD22 LEU A 23 130.305 -4.172 1.212 1.00 0.00 H new ATOM 0 HD23 LEU A 23 130.032 -5.776 0.490 1.00 0.00 H new ATOM 354 N ALA A 24 125.992 -5.819 1.452 1.00 0.00 N ATOM 355 CA ALA A 24 124.680 -5.826 2.154 1.00 0.00 C ATOM 356 C ALA A 24 124.126 -4.402 2.254 1.00 0.00 C ATOM 357 O ALA A 24 124.840 -3.456 2.520 1.00 0.00 O ATOM 358 CB ALA A 24 124.865 -6.395 3.561 1.00 0.00 C ATOM 0 H ALA A 24 126.782 -6.147 2.008 1.00 0.00 H new ATOM 0 HA ALA A 24 123.978 -6.442 1.591 1.00 0.00 H new ATOM 0 HB1 ALA A 24 123.906 -6.402 4.080 1.00 0.00 H new ATOM 0 HB2 ALA A 24 125.249 -7.413 3.494 1.00 0.00 H new ATOM 0 HB3 ALA A 24 125.572 -5.776 4.114 1.00 0.00 H new ATOM 364 N GLY A 25 122.844 -4.257 2.044 1.00 0.00 N ATOM 365 CA GLY A 25 122.203 -2.909 2.126 1.00 0.00 C ATOM 366 C GLY A 25 122.138 -2.268 0.737 1.00 0.00 C ATOM 367 O GLY A 25 121.423 -1.310 0.526 1.00 0.00 O ATOM 0 H GLY A 25 122.207 -5.021 1.817 1.00 0.00 H new ATOM 0 HA2 GLY A 25 121.199 -3.001 2.539 1.00 0.00 H new ATOM 0 HA3 GLY A 25 122.769 -2.270 2.803 1.00 0.00 H new ATOM 371 N ILE A 26 122.865 -2.790 -0.216 1.00 0.00 N ATOM 372 CA ILE A 26 122.828 -2.213 -1.599 1.00 0.00 C ATOM 373 C ILE A 26 121.943 -3.106 -2.467 1.00 0.00 C ATOM 374 O ILE A 26 122.249 -4.263 -2.682 1.00 0.00 O ATOM 375 CB ILE A 26 124.244 -2.180 -2.180 1.00 0.00 C ATOM 376 CG1 ILE A 26 125.189 -1.446 -1.216 1.00 0.00 C ATOM 377 CG2 ILE A 26 124.224 -1.457 -3.528 1.00 0.00 C ATOM 378 CD1 ILE A 26 124.620 -0.070 -0.848 1.00 0.00 C ATOM 0 H ILE A 26 123.484 -3.592 -0.099 1.00 0.00 H new ATOM 0 HA ILE A 26 122.431 -1.198 -1.572 1.00 0.00 H new ATOM 0 HB ILE A 26 124.599 -3.201 -2.318 1.00 0.00 H new ATOM 0 HG12 ILE A 26 125.331 -2.041 -0.313 1.00 0.00 H new ATOM 0 HG13 ILE A 26 126.169 -1.329 -1.678 1.00 0.00 H new ATOM 0 HG21 ILE A 26 125.232 -1.433 -3.943 1.00 0.00 H new ATOM 0 HG22 ILE A 26 123.562 -1.985 -4.214 1.00 0.00 H new ATOM 0 HG23 ILE A 26 123.864 -0.438 -3.389 1.00 0.00 H new ATOM 0 HD11 ILE A 26 125.303 0.435 -0.165 1.00 0.00 H new ATOM 0 HD12 ILE A 26 124.502 0.528 -1.751 1.00 0.00 H new ATOM 0 HD13 ILE A 26 123.650 -0.194 -0.366 1.00 0.00 H new ATOM 390 N GLY A 27 120.848 -2.598 -2.976 1.00 0.00 N ATOM 391 CA GLY A 27 119.961 -3.439 -3.832 1.00 0.00 C ATOM 392 C GLY A 27 120.318 -3.225 -5.305 1.00 0.00 C ATOM 393 O GLY A 27 121.205 -2.464 -5.637 1.00 0.00 O ATOM 0 H GLY A 27 120.532 -1.639 -2.835 1.00 0.00 H new ATOM 0 HA2 GLY A 27 120.075 -4.491 -3.569 1.00 0.00 H new ATOM 0 HA3 GLY A 27 118.917 -3.178 -3.659 1.00 0.00 H new ATOM 397 N GLU A 28 119.646 -3.912 -6.185 1.00 0.00 N ATOM 398 CA GLU A 28 119.955 -3.771 -7.636 1.00 0.00 C ATOM 399 C GLU A 28 119.792 -2.311 -8.079 1.00 0.00 C ATOM 400 O GLU A 28 120.573 -1.805 -8.859 1.00 0.00 O ATOM 401 CB GLU A 28 119.003 -4.664 -8.437 1.00 0.00 C ATOM 402 CG GLU A 28 119.359 -6.132 -8.194 1.00 0.00 C ATOM 403 CD GLU A 28 118.398 -7.032 -8.972 1.00 0.00 C ATOM 404 OE1 GLU A 28 117.422 -6.513 -9.490 1.00 0.00 O ATOM 405 OE2 GLU A 28 118.650 -8.224 -9.032 1.00 0.00 O ATOM 0 H GLU A 28 118.895 -4.566 -5.963 1.00 0.00 H new ATOM 0 HA GLU A 28 120.987 -4.073 -7.815 1.00 0.00 H new ATOM 0 HB2 GLU A 28 117.972 -4.474 -8.139 1.00 0.00 H new ATOM 0 HB3 GLU A 28 119.076 -4.432 -9.499 1.00 0.00 H new ATOM 0 HG2 GLU A 28 120.385 -6.324 -8.507 1.00 0.00 H new ATOM 0 HG3 GLU A 28 119.303 -6.358 -7.129 1.00 0.00 H new ATOM 412 N VAL A 29 118.788 -1.627 -7.598 1.00 0.00 N ATOM 413 CA VAL A 29 118.597 -0.205 -8.014 1.00 0.00 C ATOM 414 C VAL A 29 119.744 0.654 -7.475 1.00 0.00 C ATOM 415 O VAL A 29 120.319 1.454 -8.186 1.00 0.00 O ATOM 416 CB VAL A 29 117.263 0.318 -7.460 1.00 0.00 C ATOM 417 CG1 VAL A 29 117.168 1.835 -7.665 1.00 0.00 C ATOM 418 CG2 VAL A 29 116.104 -0.364 -8.189 1.00 0.00 C ATOM 0 H VAL A 29 118.096 -1.987 -6.940 1.00 0.00 H new ATOM 0 HA VAL A 29 118.587 -0.150 -9.103 1.00 0.00 H new ATOM 0 HB VAL A 29 117.210 0.095 -6.394 1.00 0.00 H new ATOM 0 HG11 VAL A 29 116.219 2.197 -7.269 1.00 0.00 H new ATOM 0 HG12 VAL A 29 117.990 2.325 -7.142 1.00 0.00 H new ATOM 0 HG13 VAL A 29 117.228 2.063 -8.729 1.00 0.00 H new ATOM 0 HG21 VAL A 29 115.158 0.007 -7.796 1.00 0.00 H new ATOM 0 HG22 VAL A 29 116.165 -0.144 -9.255 1.00 0.00 H new ATOM 0 HG23 VAL A 29 116.162 -1.442 -8.037 1.00 0.00 H new ATOM 428 N LEU A 30 120.070 0.508 -6.223 1.00 0.00 N ATOM 429 CA LEU A 30 121.164 1.327 -5.632 1.00 0.00 C ATOM 430 C LEU A 30 122.497 0.953 -6.278 1.00 0.00 C ATOM 431 O LEU A 30 123.344 1.792 -6.509 1.00 0.00 O ATOM 432 CB LEU A 30 121.238 1.072 -4.124 1.00 0.00 C ATOM 433 CG LEU A 30 119.931 1.521 -3.453 1.00 0.00 C ATOM 434 CD1 LEU A 30 119.953 1.098 -1.981 1.00 0.00 C ATOM 435 CD2 LEU A 30 119.774 3.051 -3.551 1.00 0.00 C ATOM 0 H LEU A 30 119.624 -0.146 -5.580 1.00 0.00 H new ATOM 0 HA LEU A 30 120.960 2.382 -5.813 1.00 0.00 H new ATOM 0 HB2 LEU A 30 121.409 0.013 -3.934 1.00 0.00 H new ATOM 0 HB3 LEU A 30 122.082 1.613 -3.696 1.00 0.00 H new ATOM 0 HG LEU A 30 119.088 1.053 -3.962 1.00 0.00 H new ATOM 0 HD11 LEU A 30 119.028 1.413 -1.498 1.00 0.00 H new ATOM 0 HD12 LEU A 30 120.045 0.014 -1.915 1.00 0.00 H new ATOM 0 HD13 LEU A 30 120.801 1.565 -1.481 1.00 0.00 H new ATOM 0 HD21 LEU A 30 118.843 3.353 -3.071 1.00 0.00 H new ATOM 0 HD22 LEU A 30 120.613 3.536 -3.052 1.00 0.00 H new ATOM 0 HD23 LEU A 30 119.754 3.348 -4.599 1.00 0.00 H new ATOM 447 N GLY A 31 122.690 -0.300 -6.571 1.00 0.00 N ATOM 448 CA GLY A 31 123.968 -0.725 -7.202 1.00 0.00 C ATOM 449 C GLY A 31 124.144 0.000 -8.539 1.00 0.00 C ATOM 450 O GLY A 31 125.230 0.412 -8.893 1.00 0.00 O ATOM 0 H GLY A 31 122.018 -1.049 -6.401 1.00 0.00 H new ATOM 0 HA2 GLY A 31 124.805 -0.499 -6.541 1.00 0.00 H new ATOM 0 HA3 GLY A 31 123.967 -1.804 -7.359 1.00 0.00 H new ATOM 454 N LYS A 32 123.084 0.149 -9.289 1.00 0.00 N ATOM 455 CA LYS A 32 123.195 0.835 -10.609 1.00 0.00 C ATOM 456 C LYS A 32 123.618 2.297 -10.423 1.00 0.00 C ATOM 457 O LYS A 32 124.401 2.818 -11.192 1.00 0.00 O ATOM 458 CB LYS A 32 121.844 0.783 -11.331 1.00 0.00 C ATOM 459 CG LYS A 32 121.968 1.482 -12.688 1.00 0.00 C ATOM 460 CD LYS A 32 120.735 1.181 -13.547 1.00 0.00 C ATOM 461 CE LYS A 32 119.481 1.782 -12.903 1.00 0.00 C ATOM 462 NZ LYS A 32 119.000 0.884 -11.816 1.00 0.00 N ATOM 0 H LYS A 32 122.148 -0.174 -9.045 1.00 0.00 H new ATOM 0 HA LYS A 32 123.951 0.324 -11.204 1.00 0.00 H new ATOM 0 HB2 LYS A 32 121.532 -0.252 -11.469 1.00 0.00 H new ATOM 0 HB3 LYS A 32 121.077 1.269 -10.728 1.00 0.00 H new ATOM 0 HG2 LYS A 32 122.068 2.558 -12.544 1.00 0.00 H new ATOM 0 HG3 LYS A 32 122.869 1.144 -13.200 1.00 0.00 H new ATOM 0 HD2 LYS A 32 120.871 1.591 -14.548 1.00 0.00 H new ATOM 0 HD3 LYS A 32 120.615 0.103 -13.658 1.00 0.00 H new ATOM 0 HE2 LYS A 32 119.704 2.770 -12.501 1.00 0.00 H new ATOM 0 HE3 LYS A 32 118.701 1.912 -13.653 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 118.000 0.649 -11.977 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 119.564 0.010 -11.812 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 119.100 1.364 -10.899 1.00 0.00 H new ATOM 476 N LYS A 33 123.106 2.974 -9.431 1.00 0.00 N ATOM 477 CA LYS A 33 123.491 4.407 -9.248 1.00 0.00 C ATOM 478 C LYS A 33 124.969 4.506 -8.854 1.00 0.00 C ATOM 479 O LYS A 33 125.702 5.319 -9.379 1.00 0.00 O ATOM 480 CB LYS A 33 122.624 5.030 -8.150 1.00 0.00 C ATOM 481 CG LYS A 33 121.185 5.172 -8.655 1.00 0.00 C ATOM 482 CD LYS A 33 120.314 5.794 -7.562 1.00 0.00 C ATOM 483 CE LYS A 33 118.878 5.933 -8.070 1.00 0.00 C ATOM 484 NZ LYS A 33 117.992 6.365 -6.952 1.00 0.00 N ATOM 0 H LYS A 33 122.446 2.605 -8.746 1.00 0.00 H new ATOM 0 HA LYS A 33 123.336 4.943 -10.185 1.00 0.00 H new ATOM 0 HB2 LYS A 33 122.647 4.407 -7.256 1.00 0.00 H new ATOM 0 HB3 LYS A 33 123.020 6.006 -7.869 1.00 0.00 H new ATOM 0 HG2 LYS A 33 121.163 5.795 -9.549 1.00 0.00 H new ATOM 0 HG3 LYS A 33 120.790 4.196 -8.937 1.00 0.00 H new ATOM 0 HD2 LYS A 33 120.336 5.172 -6.667 1.00 0.00 H new ATOM 0 HD3 LYS A 33 120.707 6.771 -7.281 1.00 0.00 H new ATOM 0 HE2 LYS A 33 118.837 6.660 -8.881 1.00 0.00 H new ATOM 0 HE3 LYS A 33 118.531 4.983 -8.476 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 117.016 6.459 -7.299 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 118.022 5.656 -6.191 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 118.319 7.281 -6.585 1.00 0.00 H new ATOM 498 N LEU A 34 125.421 3.680 -7.953 1.00 0.00 N ATOM 499 CA LEU A 34 126.860 3.727 -7.558 1.00 0.00 C ATOM 500 C LEU A 34 127.718 3.363 -8.777 1.00 0.00 C ATOM 501 O LEU A 34 128.764 3.934 -9.015 1.00 0.00 O ATOM 502 CB LEU A 34 127.114 2.735 -6.416 1.00 0.00 C ATOM 503 CG LEU A 34 126.426 3.212 -5.126 1.00 0.00 C ATOM 504 CD1 LEU A 34 126.479 2.087 -4.087 1.00 0.00 C ATOM 505 CD2 LEU A 34 127.142 4.458 -4.561 1.00 0.00 C ATOM 0 H LEU A 34 124.860 2.976 -7.473 1.00 0.00 H new ATOM 0 HA LEU A 34 127.121 4.728 -7.214 1.00 0.00 H new ATOM 0 HB2 LEU A 34 126.739 1.749 -6.692 1.00 0.00 H new ATOM 0 HB3 LEU A 34 128.186 2.632 -6.247 1.00 0.00 H new ATOM 0 HG LEU A 34 125.391 3.472 -5.350 1.00 0.00 H new ATOM 0 HD11 LEU A 34 125.993 2.417 -3.169 1.00 0.00 H new ATOM 0 HD12 LEU A 34 125.963 1.209 -4.475 1.00 0.00 H new ATOM 0 HD13 LEU A 34 127.518 1.834 -3.877 1.00 0.00 H new ATOM 0 HD21 LEU A 34 126.642 4.782 -3.648 1.00 0.00 H new ATOM 0 HD22 LEU A 34 128.180 4.211 -4.338 1.00 0.00 H new ATOM 0 HD23 LEU A 34 127.110 5.261 -5.297 1.00 0.00 H new ATOM 517 N GLU A 35 127.273 2.403 -9.536 1.00 0.00 N ATOM 518 CA GLU A 35 128.055 1.979 -10.738 1.00 0.00 C ATOM 519 C GLU A 35 128.215 3.160 -11.702 1.00 0.00 C ATOM 520 O GLU A 35 129.284 3.408 -12.222 1.00 0.00 O ATOM 521 CB GLU A 35 127.327 0.825 -11.436 1.00 0.00 C ATOM 522 CG GLU A 35 128.116 0.378 -12.669 1.00 0.00 C ATOM 523 CD GLU A 35 127.430 -0.836 -13.299 1.00 0.00 C ATOM 524 OE1 GLU A 35 126.494 -1.338 -12.700 1.00 0.00 O ATOM 525 OE2 GLU A 35 127.855 -1.245 -14.367 1.00 0.00 O ATOM 0 H GLU A 35 126.404 1.892 -9.380 1.00 0.00 H new ATOM 0 HA GLU A 35 129.045 1.645 -10.427 1.00 0.00 H new ATOM 0 HB2 GLU A 35 127.209 -0.011 -10.747 1.00 0.00 H new ATOM 0 HB3 GLU A 35 126.326 1.140 -11.729 1.00 0.00 H new ATOM 0 HG2 GLU A 35 128.175 1.192 -13.392 1.00 0.00 H new ATOM 0 HG3 GLU A 35 129.139 0.127 -12.388 1.00 0.00 H new ATOM 532 N GLU A 36 127.163 3.895 -11.935 1.00 0.00 N ATOM 533 CA GLU A 36 127.254 5.066 -12.855 1.00 0.00 C ATOM 534 C GLU A 36 128.176 6.115 -12.229 1.00 0.00 C ATOM 535 O GLU A 36 128.678 7.000 -12.892 1.00 0.00 O ATOM 536 CB GLU A 36 125.854 5.658 -13.069 1.00 0.00 C ATOM 537 CG GLU A 36 125.928 6.863 -14.014 1.00 0.00 C ATOM 538 CD GLU A 36 124.524 7.428 -14.233 1.00 0.00 C ATOM 539 OE1 GLU A 36 123.577 6.791 -13.803 1.00 0.00 O ATOM 540 OE2 GLU A 36 124.420 8.490 -14.825 1.00 0.00 O ATOM 0 H GLU A 36 126.242 3.736 -11.527 1.00 0.00 H new ATOM 0 HA GLU A 36 127.657 4.755 -13.819 1.00 0.00 H new ATOM 0 HB2 GLU A 36 125.190 4.900 -13.485 1.00 0.00 H new ATOM 0 HB3 GLU A 36 125.430 5.962 -12.112 1.00 0.00 H new ATOM 0 HG2 GLU A 36 126.578 7.630 -13.592 1.00 0.00 H new ATOM 0 HG3 GLU A 36 126.364 6.564 -14.967 1.00 0.00 H new ATOM 547 N ARG A 37 128.384 6.029 -10.945 1.00 0.00 N ATOM 548 CA ARG A 37 129.248 7.038 -10.261 1.00 0.00 C ATOM 549 C ARG A 37 130.715 6.586 -10.283 1.00 0.00 C ATOM 550 O ARG A 37 131.585 7.289 -9.810 1.00 0.00 O ATOM 551 CB ARG A 37 128.780 7.201 -8.810 1.00 0.00 C ATOM 552 CG ARG A 37 127.406 7.894 -8.759 1.00 0.00 C ATOM 553 CD ARG A 37 127.540 9.412 -8.968 1.00 0.00 C ATOM 554 NE ARG A 37 128.589 9.960 -8.062 1.00 0.00 N ATOM 555 CZ ARG A 37 129.073 11.154 -8.273 1.00 0.00 C ATOM 556 NH1 ARG A 37 128.617 11.878 -9.258 1.00 0.00 N ATOM 557 NH2 ARG A 37 130.008 11.626 -7.494 1.00 0.00 N ATOM 0 H ARG A 37 127.995 5.307 -10.339 1.00 0.00 H new ATOM 0 HA ARG A 37 129.168 7.991 -10.784 1.00 0.00 H new ATOM 0 HB2 ARG A 37 128.719 6.224 -8.330 1.00 0.00 H new ATOM 0 HB3 ARG A 37 129.510 7.786 -8.250 1.00 0.00 H new ATOM 0 HG2 ARG A 37 126.756 7.475 -9.527 1.00 0.00 H new ATOM 0 HG3 ARG A 37 126.932 7.697 -7.797 1.00 0.00 H new ATOM 0 HD2 ARG A 37 127.797 9.623 -10.006 1.00 0.00 H new ATOM 0 HD3 ARG A 37 126.586 9.900 -8.771 1.00 0.00 H new ATOM 0 HE ARG A 37 128.928 9.403 -7.278 1.00 0.00 H new ATOM 0 HH11 ARG A 37 127.882 11.511 -9.863 1.00 0.00 H new ATOM 0 HH12 ARG A 37 128.995 12.811 -9.423 1.00 0.00 H new ATOM 0 HH21 ARG A 37 130.360 11.062 -6.721 1.00 0.00 H new ATOM 0 HH22 ARG A 37 130.386 12.559 -7.659 1.00 0.00 H new ATOM 571 N GLY A 38 131.005 5.443 -10.863 1.00 0.00 N ATOM 572 CA GLY A 38 132.433 4.980 -10.955 1.00 0.00 C ATOM 573 C GLY A 38 132.718 3.820 -9.996 1.00 0.00 C ATOM 574 O GLY A 38 133.842 3.372 -9.890 1.00 0.00 O ATOM 0 H GLY A 38 130.319 4.811 -11.276 1.00 0.00 H new ATOM 0 HA2 GLY A 38 132.649 4.668 -11.977 1.00 0.00 H new ATOM 0 HA3 GLY A 38 133.100 5.812 -10.728 1.00 0.00 H new ATOM 578 N PHE A 39 131.729 3.326 -9.298 1.00 0.00 N ATOM 579 CA PHE A 39 131.966 2.188 -8.351 1.00 0.00 C ATOM 580 C PHE A 39 131.406 0.898 -8.953 1.00 0.00 C ATOM 581 O PHE A 39 130.365 0.413 -8.555 1.00 0.00 O ATOM 582 CB PHE A 39 131.254 2.481 -7.036 1.00 0.00 C ATOM 583 CG PHE A 39 131.839 3.727 -6.423 1.00 0.00 C ATOM 584 CD1 PHE A 39 132.944 3.637 -5.572 1.00 0.00 C ATOM 585 CD2 PHE A 39 131.284 4.973 -6.721 1.00 0.00 C ATOM 586 CE1 PHE A 39 133.495 4.797 -5.016 1.00 0.00 C ATOM 587 CE2 PHE A 39 131.834 6.135 -6.169 1.00 0.00 C ATOM 588 CZ PHE A 39 132.940 6.048 -5.316 1.00 0.00 C ATOM 0 H PHE A 39 130.766 3.659 -9.340 1.00 0.00 H new ATOM 0 HA PHE A 39 133.036 2.071 -8.176 1.00 0.00 H new ATOM 0 HB2 PHE A 39 130.186 2.613 -7.209 1.00 0.00 H new ATOM 0 HB3 PHE A 39 131.365 1.639 -6.353 1.00 0.00 H new ATOM 0 HD1 PHE A 39 133.373 2.672 -5.344 1.00 0.00 H new ATOM 0 HD2 PHE A 39 130.430 5.040 -7.378 1.00 0.00 H new ATOM 0 HE1 PHE A 39 134.347 4.728 -4.356 1.00 0.00 H new ATOM 0 HE2 PHE A 39 131.405 7.099 -6.401 1.00 0.00 H new ATOM 0 HZ PHE A 39 133.365 6.944 -4.889 1.00 0.00 H new ATOM 598 N ASP A 40 132.093 0.343 -9.914 1.00 0.00 N ATOM 599 CA ASP A 40 131.602 -0.914 -10.551 1.00 0.00 C ATOM 600 C ASP A 40 131.995 -2.117 -9.690 1.00 0.00 C ATOM 601 O ASP A 40 131.508 -3.212 -9.890 1.00 0.00 O ATOM 602 CB ASP A 40 132.232 -1.057 -11.938 1.00 0.00 C ATOM 603 CG ASP A 40 133.755 -1.112 -11.802 1.00 0.00 C ATOM 604 OD1 ASP A 40 134.248 -0.763 -10.742 1.00 0.00 O ATOM 605 OD2 ASP A 40 134.402 -1.498 -12.761 1.00 0.00 O ATOM 0 H ASP A 40 132.972 0.704 -10.286 1.00 0.00 H new ATOM 0 HA ASP A 40 130.516 -0.874 -10.641 1.00 0.00 H new ATOM 0 HB2 ASP A 40 131.866 -1.962 -12.424 1.00 0.00 H new ATOM 0 HB3 ASP A 40 131.942 -0.217 -12.569 1.00 0.00 H new ATOM 610 N LYS A 41 132.879 -1.925 -8.738 1.00 0.00 N ATOM 611 CA LYS A 41 133.317 -3.059 -7.861 1.00 0.00 C ATOM 612 C LYS A 41 133.218 -2.637 -6.395 1.00 0.00 C ATOM 613 O LYS A 41 133.324 -1.474 -6.057 1.00 0.00 O ATOM 614 CB LYS A 41 134.769 -3.427 -8.184 1.00 0.00 C ATOM 615 CG LYS A 41 134.888 -3.886 -9.644 1.00 0.00 C ATOM 616 CD LYS A 41 134.387 -5.328 -9.796 1.00 0.00 C ATOM 617 CE LYS A 41 134.732 -5.838 -11.197 1.00 0.00 C ATOM 618 NZ LYS A 41 133.975 -5.050 -12.209 1.00 0.00 N ATOM 0 H LYS A 41 133.318 -1.028 -8.530 1.00 0.00 H new ATOM 0 HA LYS A 41 132.674 -3.921 -8.038 1.00 0.00 H new ATOM 0 HB2 LYS A 41 135.417 -2.567 -8.012 1.00 0.00 H new ATOM 0 HB3 LYS A 41 135.108 -4.220 -7.517 1.00 0.00 H new ATOM 0 HG2 LYS A 41 134.309 -3.224 -10.288 1.00 0.00 H new ATOM 0 HG3 LYS A 41 135.926 -3.819 -9.969 1.00 0.00 H new ATOM 0 HD2 LYS A 41 134.846 -5.966 -9.041 1.00 0.00 H new ATOM 0 HD3 LYS A 41 133.310 -5.370 -9.636 1.00 0.00 H new ATOM 0 HE2 LYS A 41 135.803 -5.747 -11.376 1.00 0.00 H new ATOM 0 HE3 LYS A 41 134.483 -6.896 -11.283 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 134.031 -5.526 -13.132 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 132.979 -4.976 -11.917 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 134.385 -4.097 -12.285 1.00 0.00 H new ATOM 632 N ALA A 42 132.996 -3.582 -5.528 1.00 0.00 N ATOM 633 CA ALA A 42 132.867 -3.269 -4.076 1.00 0.00 C ATOM 634 C ALA A 42 134.179 -2.710 -3.508 1.00 0.00 C ATOM 635 O ALA A 42 134.168 -1.823 -2.679 1.00 0.00 O ATOM 636 CB ALA A 42 132.495 -4.545 -3.321 1.00 0.00 C ATOM 0 H ALA A 42 132.897 -4.569 -5.764 1.00 0.00 H new ATOM 0 HA ALA A 42 132.092 -2.513 -3.954 1.00 0.00 H new ATOM 0 HB1 ALA A 42 132.399 -4.324 -2.258 1.00 0.00 H new ATOM 0 HB2 ALA A 42 131.547 -4.928 -3.699 1.00 0.00 H new ATOM 0 HB3 ALA A 42 133.273 -5.294 -3.467 1.00 0.00 H new ATOM 642 N TYR A 43 135.309 -3.237 -3.906 1.00 0.00 N ATOM 643 CA TYR A 43 136.595 -2.743 -3.328 1.00 0.00 C ATOM 644 C TYR A 43 136.793 -1.247 -3.605 1.00 0.00 C ATOM 645 O TYR A 43 137.534 -0.586 -2.906 1.00 0.00 O ATOM 646 CB TYR A 43 137.783 -3.553 -3.869 1.00 0.00 C ATOM 647 CG TYR A 43 137.963 -3.337 -5.353 1.00 0.00 C ATOM 648 CD1 TYR A 43 138.582 -2.174 -5.818 1.00 0.00 C ATOM 649 CD2 TYR A 43 137.539 -4.315 -6.261 1.00 0.00 C ATOM 650 CE1 TYR A 43 138.777 -1.985 -7.189 1.00 0.00 C ATOM 651 CE2 TYR A 43 137.731 -4.125 -7.634 1.00 0.00 C ATOM 652 CZ TYR A 43 138.351 -2.960 -8.099 1.00 0.00 C ATOM 653 OH TYR A 43 138.545 -2.775 -9.453 1.00 0.00 O ATOM 0 H TYR A 43 135.397 -3.980 -4.599 1.00 0.00 H new ATOM 0 HA TYR A 43 136.546 -2.881 -2.248 1.00 0.00 H new ATOM 0 HB2 TYR A 43 138.693 -3.263 -3.344 1.00 0.00 H new ATOM 0 HB3 TYR A 43 137.624 -4.613 -3.670 1.00 0.00 H new ATOM 0 HD1 TYR A 43 138.910 -1.420 -5.117 1.00 0.00 H new ATOM 0 HD2 TYR A 43 137.064 -5.216 -5.902 1.00 0.00 H new ATOM 0 HE1 TYR A 43 139.257 -1.086 -7.547 1.00 0.00 H new ATOM 0 HE2 TYR A 43 137.401 -4.878 -8.335 1.00 0.00 H new ATOM 0 HH TYR A 43 138.192 -3.547 -9.943 1.00 0.00 H new ATOM 663 N VAL A 44 136.121 -0.685 -4.577 1.00 0.00 N ATOM 664 CA VAL A 44 136.280 0.785 -4.810 1.00 0.00 C ATOM 665 C VAL A 44 135.424 1.507 -3.766 1.00 0.00 C ATOM 666 O VAL A 44 135.750 2.577 -3.286 1.00 0.00 O ATOM 667 CB VAL A 44 135.810 1.165 -6.220 1.00 0.00 C ATOM 668 CG1 VAL A 44 136.056 2.658 -6.462 1.00 0.00 C ATOM 669 CG2 VAL A 44 136.593 0.361 -7.257 1.00 0.00 C ATOM 0 H VAL A 44 135.481 -1.167 -5.209 1.00 0.00 H new ATOM 0 HA VAL A 44 137.329 1.069 -4.722 1.00 0.00 H new ATOM 0 HB VAL A 44 134.746 0.947 -6.310 1.00 0.00 H new ATOM 0 HG11 VAL A 44 135.721 2.924 -7.464 1.00 0.00 H new ATOM 0 HG12 VAL A 44 135.502 3.242 -5.727 1.00 0.00 H new ATOM 0 HG13 VAL A 44 137.121 2.871 -6.367 1.00 0.00 H new ATOM 0 HG21 VAL A 44 136.257 0.633 -8.258 1.00 0.00 H new ATOM 0 HG22 VAL A 44 137.656 0.579 -7.159 1.00 0.00 H new ATOM 0 HG23 VAL A 44 136.425 -0.704 -7.095 1.00 0.00 H new ATOM 679 N VAL A 45 134.329 0.888 -3.404 1.00 0.00 N ATOM 680 CA VAL A 45 133.420 1.475 -2.382 1.00 0.00 C ATOM 681 C VAL A 45 134.075 1.279 -1.019 1.00 0.00 C ATOM 682 O VAL A 45 134.006 2.126 -0.150 1.00 0.00 O ATOM 683 CB VAL A 45 132.075 0.746 -2.411 1.00 0.00 C ATOM 684 CG1 VAL A 45 131.143 1.348 -1.358 1.00 0.00 C ATOM 685 CG2 VAL A 45 131.446 0.895 -3.796 1.00 0.00 C ATOM 0 H VAL A 45 134.025 -0.010 -3.780 1.00 0.00 H new ATOM 0 HA VAL A 45 133.249 2.533 -2.581 1.00 0.00 H new ATOM 0 HB VAL A 45 132.230 -0.311 -2.194 1.00 0.00 H new ATOM 0 HG11 VAL A 45 130.185 0.828 -1.380 1.00 0.00 H new ATOM 0 HG12 VAL A 45 131.592 1.241 -0.371 1.00 0.00 H new ATOM 0 HG13 VAL A 45 130.987 2.405 -1.572 1.00 0.00 H new ATOM 0 HG21 VAL A 45 130.488 0.376 -3.818 1.00 0.00 H new ATOM 0 HG22 VAL A 45 131.292 1.952 -4.014 1.00 0.00 H new ATOM 0 HG23 VAL A 45 132.110 0.463 -4.545 1.00 0.00 H new ATOM 695 N LEU A 46 134.745 0.176 -0.844 1.00 0.00 N ATOM 696 CA LEU A 46 135.450 -0.078 0.436 1.00 0.00 C ATOM 697 C LEU A 46 136.470 1.045 0.622 1.00 0.00 C ATOM 698 O LEU A 46 136.689 1.540 1.709 1.00 0.00 O ATOM 699 CB LEU A 46 136.177 -1.427 0.352 1.00 0.00 C ATOM 700 CG LEU A 46 136.909 -1.741 1.672 1.00 0.00 C ATOM 701 CD1 LEU A 46 135.894 -2.108 2.765 1.00 0.00 C ATOM 702 CD2 LEU A 46 137.901 -2.903 1.450 1.00 0.00 C ATOM 0 H LEU A 46 134.834 -0.565 -1.540 1.00 0.00 H new ATOM 0 HA LEU A 46 134.751 -0.106 1.272 1.00 0.00 H new ATOM 0 HB2 LEU A 46 135.460 -2.218 0.132 1.00 0.00 H new ATOM 0 HB3 LEU A 46 136.893 -1.408 -0.470 1.00 0.00 H new ATOM 0 HG LEU A 46 137.461 -0.859 1.995 1.00 0.00 H new ATOM 0 HD11 LEU A 46 136.422 -2.328 3.693 1.00 0.00 H new ATOM 0 HD12 LEU A 46 135.213 -1.272 2.924 1.00 0.00 H new ATOM 0 HD13 LEU A 46 135.326 -2.985 2.454 1.00 0.00 H new ATOM 0 HD21 LEU A 46 138.418 -3.124 2.384 1.00 0.00 H new ATOM 0 HD22 LEU A 46 137.357 -3.787 1.118 1.00 0.00 H new ATOM 0 HD23 LEU A 46 138.630 -2.619 0.691 1.00 0.00 H new ATOM 714 N GLY A 47 137.100 1.437 -0.453 1.00 0.00 N ATOM 715 CA GLY A 47 138.120 2.518 -0.387 1.00 0.00 C ATOM 716 C GLY A 47 137.506 3.785 0.210 1.00 0.00 C ATOM 717 O GLY A 47 138.100 4.427 1.052 1.00 0.00 O ATOM 0 H GLY A 47 136.948 1.048 -1.384 1.00 0.00 H new ATOM 0 HA2 GLY A 47 138.966 2.194 0.219 1.00 0.00 H new ATOM 0 HA3 GLY A 47 138.505 2.727 -1.385 1.00 0.00 H new ATOM 721 N GLN A 48 136.324 4.156 -0.207 1.00 0.00 N ATOM 722 CA GLN A 48 135.695 5.383 0.361 1.00 0.00 C ATOM 723 C GLN A 48 135.515 5.207 1.873 1.00 0.00 C ATOM 724 O GLN A 48 135.793 6.098 2.652 1.00 0.00 O ATOM 725 CB GLN A 48 134.327 5.611 -0.294 1.00 0.00 C ATOM 726 CG GLN A 48 133.740 6.949 0.169 1.00 0.00 C ATOM 727 CD GLN A 48 134.619 8.099 -0.326 1.00 0.00 C ATOM 728 OE1 GLN A 48 134.956 8.163 -1.492 1.00 0.00 O ATOM 729 NE2 GLN A 48 135.008 9.019 0.514 1.00 0.00 N ATOM 0 H GLN A 48 135.771 3.667 -0.911 1.00 0.00 H new ATOM 0 HA GLN A 48 136.336 6.243 0.166 1.00 0.00 H new ATOM 0 HB2 GLN A 48 134.429 5.605 -1.379 1.00 0.00 H new ATOM 0 HB3 GLN A 48 133.650 4.798 -0.033 1.00 0.00 H new ATOM 0 HG2 GLN A 48 132.726 7.064 -0.214 1.00 0.00 H new ATOM 0 HG3 GLN A 48 133.675 6.971 1.257 1.00 0.00 H new ATOM 0 HE21 GLN A 48 134.727 8.968 1.493 1.00 0.00 H new ATOM 0 HE22 GLN A 48 135.593 9.789 0.191 1.00 0.00 H new ATOM 738 N PHE A 49 135.056 4.057 2.291 1.00 0.00 N ATOM 739 CA PHE A 49 134.860 3.805 3.749 1.00 0.00 C ATOM 740 C PHE A 49 136.211 3.954 4.455 1.00 0.00 C ATOM 741 O PHE A 49 136.310 4.495 5.537 1.00 0.00 O ATOM 742 CB PHE A 49 134.315 2.383 3.933 1.00 0.00 C ATOM 743 CG PHE A 49 134.089 2.091 5.400 1.00 0.00 C ATOM 744 CD1 PHE A 49 133.092 2.780 6.101 1.00 0.00 C ATOM 745 CD2 PHE A 49 134.863 1.122 6.055 1.00 0.00 C ATOM 746 CE1 PHE A 49 132.867 2.503 7.454 1.00 0.00 C ATOM 747 CE2 PHE A 49 134.638 0.846 7.409 1.00 0.00 C ATOM 748 CZ PHE A 49 133.640 1.537 8.109 1.00 0.00 C ATOM 0 H PHE A 49 134.807 3.277 1.682 1.00 0.00 H new ATOM 0 HA PHE A 49 134.152 4.516 4.175 1.00 0.00 H new ATOM 0 HB2 PHE A 49 133.379 2.272 3.385 1.00 0.00 H new ATOM 0 HB3 PHE A 49 135.017 1.661 3.516 1.00 0.00 H new ATOM 0 HD1 PHE A 49 132.496 3.526 5.597 1.00 0.00 H new ATOM 0 HD2 PHE A 49 135.632 0.589 5.515 1.00 0.00 H new ATOM 0 HE1 PHE A 49 132.097 3.035 7.993 1.00 0.00 H new ATOM 0 HE2 PHE A 49 135.234 0.100 7.914 1.00 0.00 H new ATOM 0 HZ PHE A 49 133.467 1.324 9.154 1.00 0.00 H new ATOM 758 N LEU A 50 137.244 3.471 3.836 1.00 0.00 N ATOM 759 CA LEU A 50 138.597 3.576 4.455 1.00 0.00 C ATOM 760 C LEU A 50 139.022 5.050 4.464 1.00 0.00 C ATOM 761 O LEU A 50 139.623 5.529 5.404 1.00 0.00 O ATOM 762 CB LEU A 50 139.600 2.748 3.642 1.00 0.00 C ATOM 763 CG LEU A 50 139.249 1.253 3.737 1.00 0.00 C ATOM 764 CD1 LEU A 50 140.100 0.466 2.732 1.00 0.00 C ATOM 765 CD2 LEU A 50 139.515 0.726 5.159 1.00 0.00 C ATOM 0 H LEU A 50 137.216 3.007 2.928 1.00 0.00 H new ATOM 0 HA LEU A 50 138.571 3.195 5.476 1.00 0.00 H new ATOM 0 HB2 LEU A 50 139.587 3.067 2.600 1.00 0.00 H new ATOM 0 HB3 LEU A 50 140.610 2.917 4.015 1.00 0.00 H new ATOM 0 HG LEU A 50 138.191 1.124 3.508 1.00 0.00 H new ATOM 0 HD11 LEU A 50 139.853 -0.594 2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 50 139.896 0.825 1.723 1.00 0.00 H new ATOM 0 HD13 LEU A 50 141.156 0.607 2.961 1.00 0.00 H new ATOM 0 HD21 LEU A 50 139.261 -0.333 5.208 1.00 0.00 H new ATOM 0 HD22 LEU A 50 140.569 0.858 5.405 1.00 0.00 H new ATOM 0 HD23 LEU A 50 138.904 1.279 5.872 1.00 0.00 H new ATOM 777 N VAL A 51 138.723 5.763 3.416 1.00 0.00 N ATOM 778 CA VAL A 51 139.112 7.203 3.339 1.00 0.00 C ATOM 779 C VAL A 51 138.338 8.030 4.381 1.00 0.00 C ATOM 780 O VAL A 51 138.782 9.081 4.798 1.00 0.00 O ATOM 781 CB VAL A 51 138.816 7.727 1.927 1.00 0.00 C ATOM 782 CG1 VAL A 51 138.964 9.253 1.884 1.00 0.00 C ATOM 783 CG2 VAL A 51 139.806 7.101 0.943 1.00 0.00 C ATOM 0 H VAL A 51 138.222 5.410 2.601 1.00 0.00 H new ATOM 0 HA VAL A 51 140.177 7.298 3.552 1.00 0.00 H new ATOM 0 HB VAL A 51 137.794 7.460 1.656 1.00 0.00 H new ATOM 0 HG11 VAL A 51 138.751 9.611 0.877 1.00 0.00 H new ATOM 0 HG12 VAL A 51 138.264 9.706 2.586 1.00 0.00 H new ATOM 0 HG13 VAL A 51 139.982 9.528 2.159 1.00 0.00 H new ATOM 0 HG21 VAL A 51 139.601 7.469 -0.062 1.00 0.00 H new ATOM 0 HG22 VAL A 51 140.823 7.371 1.228 1.00 0.00 H new ATOM 0 HG23 VAL A 51 139.700 6.016 0.961 1.00 0.00 H new ATOM 793 N LEU A 52 137.179 7.580 4.790 1.00 0.00 N ATOM 794 CA LEU A 52 136.379 8.367 5.785 1.00 0.00 C ATOM 795 C LEU A 52 136.743 7.962 7.221 1.00 0.00 C ATOM 796 O LEU A 52 136.039 8.289 8.155 1.00 0.00 O ATOM 797 CB LEU A 52 134.885 8.118 5.552 1.00 0.00 C ATOM 798 CG LEU A 52 134.439 8.766 4.232 1.00 0.00 C ATOM 799 CD1 LEU A 52 132.990 8.360 3.944 1.00 0.00 C ATOM 800 CD2 LEU A 52 134.544 10.307 4.321 1.00 0.00 C ATOM 0 H LEU A 52 136.751 6.707 4.482 1.00 0.00 H new ATOM 0 HA LEU A 52 136.606 9.425 5.652 1.00 0.00 H new ATOM 0 HB2 LEU A 52 134.687 7.046 5.525 1.00 0.00 H new ATOM 0 HB3 LEU A 52 134.307 8.528 6.380 1.00 0.00 H new ATOM 0 HG LEU A 52 135.089 8.424 3.426 1.00 0.00 H new ATOM 0 HD11 LEU A 52 132.664 8.815 3.009 1.00 0.00 H new ATOM 0 HD12 LEU A 52 132.926 7.275 3.862 1.00 0.00 H new ATOM 0 HD13 LEU A 52 132.348 8.701 4.757 1.00 0.00 H new ATOM 0 HD21 LEU A 52 134.224 10.749 3.377 1.00 0.00 H new ATOM 0 HD22 LEU A 52 133.905 10.669 5.126 1.00 0.00 H new ATOM 0 HD23 LEU A 52 135.577 10.590 4.522 1.00 0.00 H new ATOM 812 N LYS A 53 137.830 7.268 7.415 1.00 0.00 N ATOM 813 CA LYS A 53 138.221 6.869 8.799 1.00 0.00 C ATOM 814 C LYS A 53 137.040 6.208 9.526 1.00 0.00 C ATOM 815 O LYS A 53 136.866 6.383 10.714 1.00 0.00 O ATOM 816 CB LYS A 53 138.655 8.117 9.573 1.00 0.00 C ATOM 817 CG LYS A 53 139.860 8.751 8.873 1.00 0.00 C ATOM 818 CD LYS A 53 140.304 9.998 9.638 1.00 0.00 C ATOM 819 CE LYS A 53 141.508 10.624 8.932 1.00 0.00 C ATOM 820 NZ LYS A 53 141.118 11.028 7.551 1.00 0.00 N ATOM 0 H LYS A 53 138.464 6.960 6.678 1.00 0.00 H new ATOM 0 HA LYS A 53 139.041 6.153 8.743 1.00 0.00 H new ATOM 0 HB2 LYS A 53 137.833 8.831 9.626 1.00 0.00 H new ATOM 0 HB3 LYS A 53 138.913 7.852 10.598 1.00 0.00 H new ATOM 0 HG2 LYS A 53 140.680 8.035 8.819 1.00 0.00 H new ATOM 0 HG3 LYS A 53 139.600 9.015 7.848 1.00 0.00 H new ATOM 0 HD2 LYS A 53 139.486 10.716 9.691 1.00 0.00 H new ATOM 0 HD3 LYS A 53 140.565 9.736 10.663 1.00 0.00 H new ATOM 0 HE2 LYS A 53 141.860 11.491 9.490 1.00 0.00 H new ATOM 0 HE3 LYS A 53 142.332 9.912 8.895 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 141.771 11.761 7.206 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 141.162 10.201 6.922 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 140.149 11.405 7.560 1.00 0.00 H new ATOM 834 N LYS A 54 136.239 5.441 8.821 1.00 0.00 N ATOM 835 CA LYS A 54 135.073 4.733 9.443 1.00 0.00 C ATOM 836 C LYS A 54 134.094 5.740 10.062 1.00 0.00 C ATOM 837 O LYS A 54 133.290 5.379 10.899 1.00 0.00 O ATOM 838 CB LYS A 54 135.562 3.772 10.538 1.00 0.00 C ATOM 839 CG LYS A 54 136.519 2.739 9.936 1.00 0.00 C ATOM 840 CD LYS A 54 136.999 1.788 11.036 1.00 0.00 C ATOM 841 CE LYS A 54 137.989 0.778 10.450 1.00 0.00 C ATOM 842 NZ LYS A 54 137.303 -0.066 9.430 1.00 0.00 N ATOM 0 H LYS A 54 136.348 5.273 7.821 1.00 0.00 H new ATOM 0 HA LYS A 54 134.562 4.172 8.661 1.00 0.00 H new ATOM 0 HB2 LYS A 54 136.066 4.331 11.326 1.00 0.00 H new ATOM 0 HB3 LYS A 54 134.712 3.268 10.998 1.00 0.00 H new ATOM 0 HG2 LYS A 54 136.017 2.177 9.148 1.00 0.00 H new ATOM 0 HG3 LYS A 54 137.371 3.241 9.476 1.00 0.00 H new ATOM 0 HD2 LYS A 54 137.474 2.354 11.838 1.00 0.00 H new ATOM 0 HD3 LYS A 54 136.149 1.266 11.475 1.00 0.00 H new ATOM 0 HE2 LYS A 54 138.831 1.301 9.996 1.00 0.00 H new ATOM 0 HE3 LYS A 54 138.394 0.149 11.243 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 137.965 -0.784 9.071 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 136.483 -0.537 9.863 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 136.982 0.533 8.643 1.00 0.00 H new ATOM 856 N ASP A 55 134.119 6.983 9.663 1.00 0.00 N ATOM 857 CA ASP A 55 133.140 7.943 10.256 1.00 0.00 C ATOM 858 C ASP A 55 131.733 7.559 9.773 1.00 0.00 C ATOM 859 O ASP A 55 131.425 7.619 8.599 1.00 0.00 O ATOM 860 CB ASP A 55 133.481 9.371 9.819 1.00 0.00 C ATOM 861 CG ASP A 55 134.675 9.878 10.632 1.00 0.00 C ATOM 862 OD1 ASP A 55 134.731 9.582 11.814 1.00 0.00 O ATOM 863 OD2 ASP A 55 135.510 10.561 10.061 1.00 0.00 O ATOM 0 H ASP A 55 134.758 7.370 8.969 1.00 0.00 H new ATOM 0 HA ASP A 55 133.181 7.900 11.344 1.00 0.00 H new ATOM 0 HB2 ASP A 55 133.716 9.391 8.755 1.00 0.00 H new ATOM 0 HB3 ASP A 55 132.621 10.024 9.968 1.00 0.00 H new ATOM 868 N GLU A 56 130.896 7.126 10.678 1.00 0.00 N ATOM 869 CA GLU A 56 129.514 6.682 10.314 1.00 0.00 C ATOM 870 C GLU A 56 128.639 7.828 9.775 1.00 0.00 C ATOM 871 O GLU A 56 127.890 7.648 8.839 1.00 0.00 O ATOM 872 CB GLU A 56 128.860 6.092 11.563 1.00 0.00 C ATOM 873 CG GLU A 56 127.532 5.431 11.198 1.00 0.00 C ATOM 874 CD GLU A 56 126.942 4.769 12.444 1.00 0.00 C ATOM 875 OE1 GLU A 56 127.627 4.739 13.454 1.00 0.00 O ATOM 876 OE2 GLU A 56 125.818 4.301 12.368 1.00 0.00 O ATOM 0 H GLU A 56 131.114 7.059 11.672 1.00 0.00 H new ATOM 0 HA GLU A 56 129.596 5.945 9.515 1.00 0.00 H new ATOM 0 HB2 GLU A 56 129.526 5.360 12.020 1.00 0.00 H new ATOM 0 HB3 GLU A 56 128.694 6.877 12.301 1.00 0.00 H new ATOM 0 HG2 GLU A 56 126.839 6.174 10.803 1.00 0.00 H new ATOM 0 HG3 GLU A 56 127.684 4.689 10.415 1.00 0.00 H new ATOM 883 N ASP A 57 128.716 8.995 10.351 1.00 0.00 N ATOM 884 CA ASP A 57 127.869 10.125 9.855 1.00 0.00 C ATOM 885 C ASP A 57 128.362 10.581 8.484 1.00 0.00 C ATOM 886 O ASP A 57 127.584 10.890 7.604 1.00 0.00 O ATOM 887 CB ASP A 57 127.933 11.294 10.841 1.00 0.00 C ATOM 888 CG ASP A 57 127.191 10.917 12.126 1.00 0.00 C ATOM 889 OD1 ASP A 57 126.369 10.018 12.069 1.00 0.00 O ATOM 890 OD2 ASP A 57 127.457 11.534 13.143 1.00 0.00 O ATOM 0 H ASP A 57 129.324 9.218 11.139 1.00 0.00 H new ATOM 0 HA ASP A 57 126.837 9.784 9.769 1.00 0.00 H new ATOM 0 HB2 ASP A 57 128.971 11.538 11.066 1.00 0.00 H new ATOM 0 HB3 ASP A 57 127.485 12.183 10.397 1.00 0.00 H new ATOM 895 N LEU A 58 129.640 10.618 8.293 1.00 0.00 N ATOM 896 CA LEU A 58 130.161 11.046 6.969 1.00 0.00 C ATOM 897 C LEU A 58 129.842 9.964 5.932 1.00 0.00 C ATOM 898 O LEU A 58 129.478 10.258 4.811 1.00 0.00 O ATOM 899 CB LEU A 58 131.675 11.274 7.043 1.00 0.00 C ATOM 900 CG LEU A 58 131.991 12.404 8.038 1.00 0.00 C ATOM 901 CD1 LEU A 58 133.512 12.567 8.143 1.00 0.00 C ATOM 902 CD2 LEU A 58 131.361 13.728 7.560 1.00 0.00 C ATOM 0 H LEU A 58 130.346 10.374 8.987 1.00 0.00 H new ATOM 0 HA LEU A 58 129.686 11.983 6.678 1.00 0.00 H new ATOM 0 HB2 LEU A 58 132.174 10.356 7.353 1.00 0.00 H new ATOM 0 HB3 LEU A 58 132.061 11.529 6.056 1.00 0.00 H new ATOM 0 HG LEU A 58 131.576 12.151 9.014 1.00 0.00 H new ATOM 0 HD11 LEU A 58 133.745 13.366 8.847 1.00 0.00 H new ATOM 0 HD12 LEU A 58 133.954 11.635 8.494 1.00 0.00 H new ATOM 0 HD13 LEU A 58 133.920 12.816 7.163 1.00 0.00 H new ATOM 0 HD21 LEU A 58 131.592 14.519 8.273 1.00 0.00 H new ATOM 0 HD22 LEU A 58 131.765 13.991 6.582 1.00 0.00 H new ATOM 0 HD23 LEU A 58 130.280 13.611 7.486 1.00 0.00 H new ATOM 914 N PHE A 59 129.953 8.714 6.299 1.00 0.00 N ATOM 915 CA PHE A 59 129.628 7.626 5.330 1.00 0.00 C ATOM 916 C PHE A 59 128.147 7.701 4.944 1.00 0.00 C ATOM 917 O PHE A 59 127.790 7.606 3.787 1.00 0.00 O ATOM 918 CB PHE A 59 129.920 6.260 5.955 1.00 0.00 C ATOM 919 CG PHE A 59 129.583 5.173 4.956 1.00 0.00 C ATOM 920 CD1 PHE A 59 130.324 5.060 3.773 1.00 0.00 C ATOM 921 CD2 PHE A 59 128.533 4.277 5.211 1.00 0.00 C ATOM 922 CE1 PHE A 59 130.019 4.056 2.845 1.00 0.00 C ATOM 923 CE2 PHE A 59 128.229 3.273 4.282 1.00 0.00 C ATOM 924 CZ PHE A 59 128.971 3.162 3.100 1.00 0.00 C ATOM 0 H PHE A 59 130.253 8.401 7.222 1.00 0.00 H new ATOM 0 HA PHE A 59 130.244 7.753 4.440 1.00 0.00 H new ATOM 0 HB2 PHE A 59 130.970 6.195 6.241 1.00 0.00 H new ATOM 0 HB3 PHE A 59 129.333 6.130 6.864 1.00 0.00 H new ATOM 0 HD1 PHE A 59 131.132 5.748 3.576 1.00 0.00 H new ATOM 0 HD2 PHE A 59 127.960 4.361 6.122 1.00 0.00 H new ATOM 0 HE1 PHE A 59 130.592 3.971 1.933 1.00 0.00 H new ATOM 0 HE2 PHE A 59 127.421 2.584 4.478 1.00 0.00 H new ATOM 0 HZ PHE A 59 128.736 2.388 2.385 1.00 0.00 H new ATOM 934 N ARG A 60 127.280 7.843 5.917 1.00 0.00 N ATOM 935 CA ARG A 60 125.819 7.893 5.619 1.00 0.00 C ATOM 936 C ARG A 60 125.484 9.062 4.695 1.00 0.00 C ATOM 937 O ARG A 60 124.760 8.906 3.733 1.00 0.00 O ATOM 938 CB ARG A 60 125.034 8.055 6.924 1.00 0.00 C ATOM 939 CG ARG A 60 125.114 6.769 7.749 1.00 0.00 C ATOM 940 CD ARG A 60 124.493 7.009 9.126 1.00 0.00 C ATOM 941 NE ARG A 60 123.109 7.541 8.964 1.00 0.00 N ATOM 942 CZ ARG A 60 122.284 7.534 9.976 1.00 0.00 C ATOM 943 NH1 ARG A 60 122.655 7.023 11.119 1.00 0.00 N ATOM 944 NH2 ARG A 60 121.085 8.031 9.842 1.00 0.00 N ATOM 0 H ARG A 60 127.523 7.926 6.904 1.00 0.00 H new ATOM 0 HA ARG A 60 125.544 6.962 5.123 1.00 0.00 H new ATOM 0 HB2 ARG A 60 125.436 8.890 7.498 1.00 0.00 H new ATOM 0 HB3 ARG A 60 123.993 8.291 6.704 1.00 0.00 H new ATOM 0 HG2 ARG A 60 124.589 5.962 7.237 1.00 0.00 H new ATOM 0 HG3 ARG A 60 126.153 6.456 7.856 1.00 0.00 H new ATOM 0 HD2 ARG A 60 124.472 6.079 9.694 1.00 0.00 H new ATOM 0 HD3 ARG A 60 125.101 7.715 9.692 1.00 0.00 H new ATOM 0 HE ARG A 60 122.807 7.910 8.062 1.00 0.00 H new ATOM 0 HH11 ARG A 60 123.590 6.629 11.222 1.00 0.00 H new ATOM 0 HH12 ARG A 60 122.010 7.018 11.909 1.00 0.00 H new ATOM 0 HH21 ARG A 60 120.793 8.424 8.947 1.00 0.00 H new ATOM 0 HH22 ARG A 60 120.440 8.026 10.632 1.00 0.00 H new ATOM 958 N GLU A 61 125.998 10.230 4.960 1.00 0.00 N ATOM 959 CA GLU A 61 125.690 11.383 4.071 1.00 0.00 C ATOM 960 C GLU A 61 126.260 11.095 2.682 1.00 0.00 C ATOM 961 O GLU A 61 125.663 11.421 1.675 1.00 0.00 O ATOM 962 CB GLU A 61 126.328 12.653 4.638 1.00 0.00 C ATOM 963 CG GLU A 61 125.876 13.868 3.823 1.00 0.00 C ATOM 964 CD GLU A 61 124.381 14.107 4.045 1.00 0.00 C ATOM 965 OE1 GLU A 61 123.864 13.615 5.035 1.00 0.00 O ATOM 966 OE2 GLU A 61 123.778 14.774 3.218 1.00 0.00 O ATOM 0 H GLU A 61 126.613 10.435 5.747 1.00 0.00 H new ATOM 0 HA GLU A 61 124.611 11.527 4.007 1.00 0.00 H new ATOM 0 HB2 GLU A 61 126.044 12.778 5.683 1.00 0.00 H new ATOM 0 HB3 GLU A 61 127.414 12.569 4.611 1.00 0.00 H new ATOM 0 HG2 GLU A 61 126.444 14.750 4.120 1.00 0.00 H new ATOM 0 HG3 GLU A 61 126.075 13.703 2.764 1.00 0.00 H new ATOM 973 N TRP A 62 127.410 10.491 2.619 1.00 0.00 N ATOM 974 CA TRP A 62 128.017 10.186 1.294 1.00 0.00 C ATOM 975 C TRP A 62 127.118 9.248 0.485 1.00 0.00 C ATOM 976 O TRP A 62 126.841 9.487 -0.672 1.00 0.00 O ATOM 977 CB TRP A 62 129.387 9.516 1.496 1.00 0.00 C ATOM 978 CG TRP A 62 129.890 8.989 0.182 1.00 0.00 C ATOM 979 CD1 TRP A 62 130.534 9.720 -0.758 1.00 0.00 C ATOM 980 CD2 TRP A 62 129.776 7.638 -0.356 1.00 0.00 C ATOM 981 NE1 TRP A 62 130.829 8.902 -1.836 1.00 0.00 N ATOM 982 CE2 TRP A 62 130.382 7.610 -1.635 1.00 0.00 C ATOM 983 CE3 TRP A 62 129.213 6.444 0.136 1.00 0.00 C ATOM 984 CZ2 TRP A 62 130.428 6.439 -2.398 1.00 0.00 C ATOM 985 CZ3 TRP A 62 129.259 5.267 -0.629 1.00 0.00 C ATOM 986 CH2 TRP A 62 129.867 5.265 -1.893 1.00 0.00 C ATOM 0 H TRP A 62 127.958 10.194 3.427 1.00 0.00 H new ATOM 0 HA TRP A 62 128.133 11.122 0.747 1.00 0.00 H new ATOM 0 HB2 TRP A 62 130.097 10.234 1.907 1.00 0.00 H new ATOM 0 HB3 TRP A 62 129.302 8.703 2.217 1.00 0.00 H new ATOM 0 HD1 TRP A 62 130.778 10.769 -0.680 1.00 0.00 H new ATOM 0 HE1 TRP A 62 131.317 9.215 -2.676 1.00 0.00 H new ATOM 0 HE3 TRP A 62 128.743 6.434 1.108 1.00 0.00 H new ATOM 0 HZ2 TRP A 62 130.895 6.443 -3.372 1.00 0.00 H new ATOM 0 HZ3 TRP A 62 128.823 4.358 -0.242 1.00 0.00 H new ATOM 0 HH2 TRP A 62 129.901 4.356 -2.475 1.00 0.00 H new ATOM 997 N LEU A 63 126.675 8.175 1.072 1.00 0.00 N ATOM 998 CA LEU A 63 125.818 7.220 0.317 1.00 0.00 C ATOM 999 C LEU A 63 124.462 7.860 0.007 1.00 0.00 C ATOM 1000 O LEU A 63 123.990 7.825 -1.112 1.00 0.00 O ATOM 1001 CB LEU A 63 125.616 5.952 1.158 1.00 0.00 C ATOM 1002 CG LEU A 63 124.741 4.938 0.406 1.00 0.00 C ATOM 1003 CD1 LEU A 63 125.447 4.480 -0.881 1.00 0.00 C ATOM 1004 CD2 LEU A 63 124.487 3.728 1.312 1.00 0.00 C ATOM 0 H LEU A 63 126.868 7.917 2.040 1.00 0.00 H new ATOM 0 HA LEU A 63 126.305 6.963 -0.624 1.00 0.00 H new ATOM 0 HB2 LEU A 63 126.583 5.505 1.390 1.00 0.00 H new ATOM 0 HB3 LEU A 63 125.148 6.210 2.108 1.00 0.00 H new ATOM 0 HG LEU A 63 123.794 5.407 0.139 1.00 0.00 H new ATOM 0 HD11 LEU A 63 124.817 3.761 -1.405 1.00 0.00 H new ATOM 0 HD12 LEU A 63 125.627 5.342 -1.524 1.00 0.00 H new ATOM 0 HD13 LEU A 63 126.398 4.012 -0.627 1.00 0.00 H new ATOM 0 HD21 LEU A 63 123.866 3.003 0.785 1.00 0.00 H new ATOM 0 HD22 LEU A 63 125.438 3.266 1.578 1.00 0.00 H new ATOM 0 HD23 LEU A 63 123.976 4.053 2.218 1.00 0.00 H new ATOM 1016 N LYS A 64 123.831 8.443 0.987 1.00 0.00 N ATOM 1017 CA LYS A 64 122.507 9.083 0.747 1.00 0.00 C ATOM 1018 C LYS A 64 122.660 10.209 -0.274 1.00 0.00 C ATOM 1019 O LYS A 64 121.900 10.324 -1.214 1.00 0.00 O ATOM 1020 CB LYS A 64 121.956 9.649 2.057 1.00 0.00 C ATOM 1021 CG LYS A 64 120.542 10.188 1.823 1.00 0.00 C ATOM 1022 CD LYS A 64 119.988 10.753 3.131 1.00 0.00 C ATOM 1023 CE LYS A 64 118.563 11.262 2.904 1.00 0.00 C ATOM 1024 NZ LYS A 64 117.914 11.525 4.220 1.00 0.00 N ATOM 0 H LYS A 64 124.175 8.504 1.945 1.00 0.00 H new ATOM 0 HA LYS A 64 121.814 8.335 0.362 1.00 0.00 H new ATOM 0 HB2 LYS A 64 121.939 8.873 2.823 1.00 0.00 H new ATOM 0 HB3 LYS A 64 122.604 10.445 2.423 1.00 0.00 H new ATOM 0 HG2 LYS A 64 120.559 10.964 1.058 1.00 0.00 H new ATOM 0 HG3 LYS A 64 119.894 9.392 1.455 1.00 0.00 H new ATOM 0 HD2 LYS A 64 119.992 9.983 3.903 1.00 0.00 H new ATOM 0 HD3 LYS A 64 120.623 11.564 3.487 1.00 0.00 H new ATOM 0 HE2 LYS A 64 118.582 12.174 2.307 1.00 0.00 H new ATOM 0 HE3 LYS A 64 117.987 10.526 2.343 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 116.945 11.871 4.066 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 117.884 10.645 4.774 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 118.460 12.242 4.739 1.00 0.00 H new ATOM 1038 N ASP A 65 123.642 11.042 -0.082 1.00 0.00 N ATOM 1039 CA ASP A 65 123.868 12.173 -1.022 1.00 0.00 C ATOM 1040 C ASP A 65 124.331 11.636 -2.374 1.00 0.00 C ATOM 1041 O ASP A 65 124.095 12.234 -3.405 1.00 0.00 O ATOM 1042 CB ASP A 65 124.939 13.105 -0.447 1.00 0.00 C ATOM 1043 CG ASP A 65 125.070 14.343 -1.336 1.00 0.00 C ATOM 1044 OD1 ASP A 65 125.574 14.204 -2.439 1.00 0.00 O ATOM 1045 OD2 ASP A 65 124.664 15.407 -0.899 1.00 0.00 O ATOM 0 H ASP A 65 124.304 10.987 0.692 1.00 0.00 H new ATOM 0 HA ASP A 65 122.937 12.724 -1.155 1.00 0.00 H new ATOM 0 HB2 ASP A 65 124.673 13.400 0.568 1.00 0.00 H new ATOM 0 HB3 ASP A 65 125.895 12.585 -0.387 1.00 0.00 H new ATOM 1050 N THR A 66 125.017 10.525 -2.378 1.00 0.00 N ATOM 1051 CA THR A 66 125.528 9.968 -3.661 1.00 0.00 C ATOM 1052 C THR A 66 124.423 9.229 -4.422 1.00 0.00 C ATOM 1053 O THR A 66 124.434 9.214 -5.637 1.00 0.00 O ATOM 1054 CB THR A 66 126.683 9.002 -3.376 1.00 0.00 C ATOM 1055 OG1 THR A 66 127.768 9.722 -2.807 1.00 0.00 O ATOM 1056 CG2 THR A 66 127.141 8.345 -4.678 1.00 0.00 C ATOM 0 H THR A 66 125.245 9.979 -1.547 1.00 0.00 H new ATOM 0 HA THR A 66 125.876 10.796 -4.278 1.00 0.00 H new ATOM 0 HB THR A 66 126.346 8.232 -2.682 1.00 0.00 H new ATOM 0 HG1 THR A 66 127.747 9.629 -1.832 1.00 0.00 H new ATOM 0 HG21 THR A 66 127.962 7.659 -4.470 1.00 0.00 H new ATOM 0 HG22 THR A 66 126.311 7.794 -5.119 1.00 0.00 H new ATOM 0 HG23 THR A 66 127.477 9.113 -5.374 1.00 0.00 H new ATOM 1064 N CYS A 67 123.491 8.580 -3.752 1.00 0.00 N ATOM 1065 CA CYS A 67 122.430 7.814 -4.492 1.00 0.00 C ATOM 1066 C CYS A 67 121.024 8.097 -3.954 1.00 0.00 C ATOM 1067 O CYS A 67 120.053 8.020 -4.680 1.00 0.00 O ATOM 1068 CB CYS A 67 122.717 6.319 -4.348 1.00 0.00 C ATOM 1069 SG CYS A 67 122.484 5.826 -2.622 1.00 0.00 S ATOM 0 H CYS A 67 123.420 8.548 -2.735 1.00 0.00 H new ATOM 0 HA CYS A 67 122.457 8.129 -5.535 1.00 0.00 H new ATOM 0 HB2 CYS A 67 122.052 5.746 -4.994 1.00 0.00 H new ATOM 0 HB3 CYS A 67 123.737 6.101 -4.666 1.00 0.00 H new ATOM 0 HG CYS A 67 122.954 6.751 -1.839 1.00 0.00 H new ATOM 1075 N GLY A 68 120.900 8.407 -2.686 1.00 0.00 N ATOM 1076 CA GLY A 68 119.548 8.678 -2.093 1.00 0.00 C ATOM 1077 C GLY A 68 119.146 7.498 -1.203 1.00 0.00 C ATOM 1078 O GLY A 68 117.997 7.350 -0.835 1.00 0.00 O ATOM 0 H GLY A 68 121.679 8.485 -2.032 1.00 0.00 H new ATOM 0 HA2 GLY A 68 119.571 9.598 -1.510 1.00 0.00 H new ATOM 0 HA3 GLY A 68 118.812 8.820 -2.884 1.00 0.00 H new ATOM 1082 N ALA A 69 120.082 6.658 -0.849 1.00 0.00 N ATOM 1083 CA ALA A 69 119.750 5.491 0.020 1.00 0.00 C ATOM 1084 C ALA A 69 118.998 5.981 1.257 1.00 0.00 C ATOM 1085 O ALA A 69 119.138 7.117 1.666 1.00 0.00 O ATOM 1086 CB ALA A 69 121.041 4.792 0.454 1.00 0.00 C ATOM 0 H ALA A 69 121.062 6.729 -1.124 1.00 0.00 H new ATOM 0 HA ALA A 69 119.127 4.789 -0.535 1.00 0.00 H new ATOM 0 HB1 ALA A 69 120.798 3.940 1.089 1.00 0.00 H new ATOM 0 HB2 ALA A 69 121.581 4.446 -0.427 1.00 0.00 H new ATOM 0 HB3 ALA A 69 121.665 5.492 1.010 1.00 0.00 H new ATOM 1092 N ASN A 70 118.193 5.143 1.857 1.00 0.00 N ATOM 1093 CA ASN A 70 117.425 5.578 3.062 1.00 0.00 C ATOM 1094 C ASN A 70 118.226 5.278 4.330 1.00 0.00 C ATOM 1095 O ASN A 70 119.261 4.644 4.294 1.00 0.00 O ATOM 1096 CB ASN A 70 116.092 4.828 3.112 1.00 0.00 C ATOM 1097 CG ASN A 70 115.279 5.161 1.861 1.00 0.00 C ATOM 1098 OD1 ASN A 70 114.692 4.288 1.252 1.00 0.00 O ATOM 1099 ND2 ASN A 70 115.221 6.397 1.447 1.00 0.00 N ATOM 0 H ASN A 70 118.034 4.178 1.566 1.00 0.00 H new ATOM 0 HA ASN A 70 117.242 6.651 3.002 1.00 0.00 H new ATOM 0 HB2 ASN A 70 116.268 3.754 3.170 1.00 0.00 H new ATOM 0 HB3 ASN A 70 115.536 5.109 4.007 1.00 0.00 H new ATOM 0 HD21 ASN A 70 114.683 6.631 0.612 1.00 0.00 H new ATOM 0 HD22 ASN A 70 115.714 7.130 1.958 1.00 0.00 H new ATOM 1106 N ALA A 71 117.754 5.752 5.448 1.00 0.00 N ATOM 1107 CA ALA A 71 118.475 5.532 6.733 1.00 0.00 C ATOM 1108 C ALA A 71 118.614 4.035 7.034 1.00 0.00 C ATOM 1109 O ALA A 71 119.585 3.606 7.619 1.00 0.00 O ATOM 1110 CB ALA A 71 117.695 6.205 7.865 1.00 0.00 C ATOM 0 H ALA A 71 116.890 6.288 5.528 1.00 0.00 H new ATOM 0 HA ALA A 71 119.473 5.962 6.652 1.00 0.00 H new ATOM 0 HB1 ALA A 71 118.216 6.048 8.809 1.00 0.00 H new ATOM 0 HB2 ALA A 71 117.616 7.274 7.667 1.00 0.00 H new ATOM 0 HB3 ALA A 71 116.696 5.773 7.926 1.00 0.00 H new ATOM 1116 N LYS A 72 117.654 3.236 6.660 1.00 0.00 N ATOM 1117 CA LYS A 72 117.758 1.778 6.959 1.00 0.00 C ATOM 1118 C LYS A 72 118.816 1.124 6.068 1.00 0.00 C ATOM 1119 O LYS A 72 119.564 0.266 6.497 1.00 0.00 O ATOM 1120 CB LYS A 72 116.405 1.111 6.718 1.00 0.00 C ATOM 1121 CG LYS A 72 115.418 1.566 7.794 1.00 0.00 C ATOM 1122 CD LYS A 72 113.999 1.124 7.419 1.00 0.00 C ATOM 1123 CE LYS A 72 113.944 -0.400 7.265 1.00 0.00 C ATOM 1124 NZ LYS A 72 114.446 -0.782 5.913 1.00 0.00 N ATOM 0 H LYS A 72 116.810 3.524 6.165 1.00 0.00 H new ATOM 0 HA LYS A 72 118.051 1.653 8.001 1.00 0.00 H new ATOM 0 HB2 LYS A 72 116.029 1.373 5.729 1.00 0.00 H new ATOM 0 HB3 LYS A 72 116.512 0.027 6.742 1.00 0.00 H new ATOM 0 HG2 LYS A 72 115.697 1.143 8.759 1.00 0.00 H new ATOM 0 HG3 LYS A 72 115.455 2.650 7.899 1.00 0.00 H new ATOM 0 HD2 LYS A 72 113.295 1.445 8.187 1.00 0.00 H new ATOM 0 HD3 LYS A 72 113.695 1.602 6.488 1.00 0.00 H new ATOM 0 HE2 LYS A 72 114.548 -0.876 8.037 1.00 0.00 H new ATOM 0 HE3 LYS A 72 112.921 -0.753 7.398 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 113.775 -1.439 5.466 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 114.540 0.070 5.324 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 115.373 -1.244 6.005 1.00 0.00 H new ATOM 1138 N GLN A 73 118.870 1.506 4.825 1.00 0.00 N ATOM 1139 CA GLN A 73 119.852 0.893 3.892 1.00 0.00 C ATOM 1140 C GLN A 73 121.274 1.300 4.265 1.00 0.00 C ATOM 1141 O GLN A 73 122.202 0.526 4.142 1.00 0.00 O ATOM 1142 CB GLN A 73 119.543 1.345 2.466 1.00 0.00 C ATOM 1143 CG GLN A 73 118.158 0.840 2.059 1.00 0.00 C ATOM 1144 CD GLN A 73 118.180 -0.684 1.937 1.00 0.00 C ATOM 1145 OE1 GLN A 73 117.331 -1.363 2.479 1.00 0.00 O ATOM 1146 NE2 GLN A 73 119.130 -1.256 1.250 1.00 0.00 N ATOM 0 H GLN A 73 118.272 2.222 4.412 1.00 0.00 H new ATOM 0 HA GLN A 73 119.775 -0.192 3.960 1.00 0.00 H new ATOM 0 HB2 GLN A 73 119.578 2.433 2.402 1.00 0.00 H new ATOM 0 HB3 GLN A 73 120.298 0.961 1.780 1.00 0.00 H new ATOM 0 HG2 GLN A 73 117.418 1.145 2.799 1.00 0.00 H new ATOM 0 HG3 GLN A 73 117.862 1.286 1.109 1.00 0.00 H new ATOM 0 HE21 GLN A 73 119.843 -0.687 0.794 1.00 0.00 H new ATOM 0 HE22 GLN A 73 119.159 -2.272 1.168 1.00 0.00 H new ATOM 1155 N SER A 74 121.463 2.512 4.706 1.00 0.00 N ATOM 1156 CA SER A 74 122.832 2.962 5.069 1.00 0.00 C ATOM 1157 C SER A 74 123.315 2.218 6.316 1.00 0.00 C ATOM 1158 O SER A 74 124.474 1.868 6.424 1.00 0.00 O ATOM 1159 CB SER A 74 122.814 4.465 5.341 1.00 0.00 C ATOM 1160 OG SER A 74 122.196 4.708 6.597 1.00 0.00 O ATOM 0 H SER A 74 120.728 3.209 4.830 1.00 0.00 H new ATOM 0 HA SER A 74 123.512 2.747 4.245 1.00 0.00 H new ATOM 0 HB2 SER A 74 123.831 4.858 5.341 1.00 0.00 H new ATOM 0 HB3 SER A 74 122.272 4.983 4.550 1.00 0.00 H new ATOM 0 HG SER A 74 121.351 4.214 6.647 1.00 0.00 H new ATOM 1166 N ARG A 75 122.448 1.973 7.266 1.00 0.00 N ATOM 1167 CA ARG A 75 122.881 1.257 8.499 1.00 0.00 C ATOM 1168 C ARG A 75 123.404 -0.133 8.141 1.00 0.00 C ATOM 1169 O ARG A 75 124.341 -0.614 8.745 1.00 0.00 O ATOM 1170 CB ARG A 75 121.713 1.142 9.480 1.00 0.00 C ATOM 1171 CG ARG A 75 121.416 2.521 10.071 1.00 0.00 C ATOM 1172 CD ARG A 75 120.248 2.419 11.055 1.00 0.00 C ATOM 1173 NE ARG A 75 119.965 3.766 11.627 1.00 0.00 N ATOM 1174 CZ ARG A 75 118.849 3.983 12.267 1.00 0.00 C ATOM 1175 NH1 ARG A 75 117.977 3.022 12.402 1.00 0.00 N ATOM 1176 NH2 ARG A 75 118.604 5.162 12.770 1.00 0.00 N ATOM 0 H ARG A 75 121.463 2.238 7.239 1.00 0.00 H new ATOM 0 HA ARG A 75 123.682 1.825 8.972 1.00 0.00 H new ATOM 0 HB2 ARG A 75 120.831 0.754 8.970 1.00 0.00 H new ATOM 0 HB3 ARG A 75 121.958 0.437 10.275 1.00 0.00 H new ATOM 0 HG2 ARG A 75 122.299 2.908 10.579 1.00 0.00 H new ATOM 0 HG3 ARG A 75 121.173 3.224 9.274 1.00 0.00 H new ATOM 0 HD2 ARG A 75 119.363 2.034 10.548 1.00 0.00 H new ATOM 0 HD3 ARG A 75 120.490 1.716 11.852 1.00 0.00 H new ATOM 0 HE ARG A 75 120.644 4.519 11.518 1.00 0.00 H new ATOM 0 HH11 ARG A 75 118.168 2.101 12.007 1.00 0.00 H new ATOM 0 HH12 ARG A 75 117.105 3.192 12.902 1.00 0.00 H new ATOM 0 HH21 ARG A 75 119.285 5.914 12.663 1.00 0.00 H new ATOM 0 HH22 ARG A 75 117.732 5.332 13.270 1.00 0.00 H new ATOM 1190 N ASP A 76 122.810 -0.805 7.191 1.00 0.00 N ATOM 1191 CA ASP A 76 123.279 -2.173 6.838 1.00 0.00 C ATOM 1192 C ASP A 76 124.667 -2.122 6.199 1.00 0.00 C ATOM 1193 O ASP A 76 125.506 -2.956 6.468 1.00 0.00 O ATOM 1194 CB ASP A 76 122.294 -2.813 5.857 1.00 0.00 C ATOM 1195 CG ASP A 76 120.981 -3.128 6.576 1.00 0.00 C ATOM 1196 OD1 ASP A 76 121.016 -3.290 7.785 1.00 0.00 O ATOM 1197 OD2 ASP A 76 119.964 -3.205 5.907 1.00 0.00 O ATOM 0 H ASP A 76 122.019 -0.464 6.645 1.00 0.00 H new ATOM 0 HA ASP A 76 123.335 -2.766 7.751 1.00 0.00 H new ATOM 0 HB2 ASP A 76 122.109 -2.139 5.021 1.00 0.00 H new ATOM 0 HB3 ASP A 76 122.721 -3.726 5.442 1.00 0.00 H new ATOM 1202 N CYS A 77 124.926 -1.158 5.359 1.00 0.00 N ATOM 1203 CA CYS A 77 126.270 -1.081 4.721 1.00 0.00 C ATOM 1204 C CYS A 77 127.334 -0.702 5.756 1.00 0.00 C ATOM 1205 O CYS A 77 128.436 -1.213 5.727 1.00 0.00 O ATOM 1206 CB CYS A 77 126.241 -0.025 3.614 1.00 0.00 C ATOM 1207 SG CYS A 77 125.276 -0.647 2.215 1.00 0.00 S ATOM 0 H CYS A 77 124.270 -0.425 5.088 1.00 0.00 H new ATOM 0 HA CYS A 77 126.519 -2.056 4.302 1.00 0.00 H new ATOM 0 HB2 CYS A 77 125.803 0.900 3.990 1.00 0.00 H new ATOM 0 HB3 CYS A 77 127.256 0.210 3.294 1.00 0.00 H new ATOM 0 HG CYS A 77 124.847 -1.845 2.482 1.00 0.00 H new ATOM 1213 N PHE A 78 127.040 0.198 6.655 1.00 0.00 N ATOM 1214 CA PHE A 78 128.080 0.593 7.648 1.00 0.00 C ATOM 1215 C PHE A 78 128.510 -0.622 8.472 1.00 0.00 C ATOM 1216 O PHE A 78 129.664 -1.002 8.479 1.00 0.00 O ATOM 1217 CB PHE A 78 127.516 1.679 8.569 1.00 0.00 C ATOM 1218 CG PHE A 78 128.559 2.076 9.587 1.00 0.00 C ATOM 1219 CD1 PHE A 78 129.496 3.071 9.283 1.00 0.00 C ATOM 1220 CD2 PHE A 78 128.579 1.456 10.842 1.00 0.00 C ATOM 1221 CE1 PHE A 78 130.454 3.443 10.232 1.00 0.00 C ATOM 1222 CE2 PHE A 78 129.538 1.828 11.792 1.00 0.00 C ATOM 1223 CZ PHE A 78 130.476 2.821 11.487 1.00 0.00 C ATOM 0 H PHE A 78 126.140 0.670 6.745 1.00 0.00 H new ATOM 0 HA PHE A 78 128.952 0.982 7.121 1.00 0.00 H new ATOM 0 HB2 PHE A 78 127.217 2.548 7.982 1.00 0.00 H new ATOM 0 HB3 PHE A 78 126.622 1.313 9.074 1.00 0.00 H new ATOM 0 HD1 PHE A 78 129.479 3.551 8.316 1.00 0.00 H new ATOM 0 HD2 PHE A 78 127.854 0.690 11.078 1.00 0.00 H new ATOM 0 HE1 PHE A 78 131.177 4.210 9.997 1.00 0.00 H new ATOM 0 HE2 PHE A 78 129.554 1.349 12.760 1.00 0.00 H new ATOM 0 HZ PHE A 78 131.217 3.108 12.219 1.00 0.00 H new ATOM 1233 N GLY A 79 127.593 -1.232 9.170 1.00 0.00 N ATOM 1234 CA GLY A 79 127.950 -2.418 10.001 1.00 0.00 C ATOM 1235 C GLY A 79 128.515 -3.535 9.118 1.00 0.00 C ATOM 1236 O GLY A 79 129.365 -4.296 9.531 1.00 0.00 O ATOM 0 H GLY A 79 126.610 -0.961 9.202 1.00 0.00 H new ATOM 0 HA2 GLY A 79 128.684 -2.135 10.755 1.00 0.00 H new ATOM 0 HA3 GLY A 79 127.069 -2.776 10.533 1.00 0.00 H new ATOM 1240 N CYS A 80 128.050 -3.637 7.907 1.00 0.00 N ATOM 1241 CA CYS A 80 128.567 -4.705 7.004 1.00 0.00 C ATOM 1242 C CYS A 80 130.023 -4.412 6.634 1.00 0.00 C ATOM 1243 O CYS A 80 130.883 -5.264 6.741 1.00 0.00 O ATOM 1244 CB CYS A 80 127.719 -4.751 5.732 1.00 0.00 C ATOM 1245 SG CYS A 80 128.353 -6.039 4.629 1.00 0.00 S ATOM 0 H CYS A 80 127.337 -3.031 7.502 1.00 0.00 H new ATOM 0 HA CYS A 80 128.512 -5.666 7.516 1.00 0.00 H new ATOM 0 HB2 CYS A 80 126.678 -4.953 5.984 1.00 0.00 H new ATOM 0 HB3 CYS A 80 127.744 -3.783 5.231 1.00 0.00 H new ATOM 0 HG CYS A 80 128.314 -5.616 3.400 1.00 0.00 H new ATOM 1251 N LEU A 81 130.312 -3.211 6.213 1.00 0.00 N ATOM 1252 CA LEU A 81 131.722 -2.883 5.857 1.00 0.00 C ATOM 1253 C LEU A 81 132.575 -2.837 7.130 1.00 0.00 C ATOM 1254 O LEU A 81 133.707 -3.280 7.143 1.00 0.00 O ATOM 1255 CB LEU A 81 131.768 -1.518 5.162 1.00 0.00 C ATOM 1256 CG LEU A 81 130.994 -1.580 3.838 1.00 0.00 C ATOM 1257 CD1 LEU A 81 130.914 -0.173 3.235 1.00 0.00 C ATOM 1258 CD2 LEU A 81 131.699 -2.528 2.847 1.00 0.00 C ATOM 0 H LEU A 81 129.642 -2.450 6.101 1.00 0.00 H new ATOM 0 HA LEU A 81 132.114 -3.647 5.186 1.00 0.00 H new ATOM 0 HB2 LEU A 81 131.336 -0.755 5.810 1.00 0.00 H new ATOM 0 HB3 LEU A 81 132.803 -1.230 4.975 1.00 0.00 H new ATOM 0 HG LEU A 81 129.990 -1.959 4.029 1.00 0.00 H new ATOM 0 HD11 LEU A 81 130.365 -0.211 2.294 1.00 0.00 H new ATOM 0 HD12 LEU A 81 130.399 0.491 3.929 1.00 0.00 H new ATOM 0 HD13 LEU A 81 131.921 0.203 3.053 1.00 0.00 H new ATOM 0 HD21 LEU A 81 131.138 -2.561 1.913 1.00 0.00 H new ATOM 0 HD22 LEU A 81 132.708 -2.165 2.651 1.00 0.00 H new ATOM 0 HD23 LEU A 81 131.750 -3.529 3.275 1.00 0.00 H new ATOM 1270 N ARG A 82 132.051 -2.292 8.196 1.00 0.00 N ATOM 1271 CA ARG A 82 132.845 -2.209 9.458 1.00 0.00 C ATOM 1272 C ARG A 82 133.223 -3.610 9.938 1.00 0.00 C ATOM 1273 O ARG A 82 134.320 -3.842 10.405 1.00 0.00 O ATOM 1274 CB ARG A 82 132.019 -1.511 10.541 1.00 0.00 C ATOM 1275 CG ARG A 82 132.883 -1.310 11.791 1.00 0.00 C ATOM 1276 CD ARG A 82 132.072 -0.576 12.860 1.00 0.00 C ATOM 1277 NE ARG A 82 131.024 -1.487 13.401 1.00 0.00 N ATOM 1278 CZ ARG A 82 130.372 -1.161 14.483 1.00 0.00 C ATOM 1279 NH1 ARG A 82 130.604 -0.015 15.062 1.00 0.00 N ATOM 1280 NH2 ARG A 82 129.484 -1.975 14.981 1.00 0.00 N ATOM 0 H ARG A 82 131.110 -1.902 8.248 1.00 0.00 H new ATOM 0 HA ARG A 82 133.754 -1.640 9.263 1.00 0.00 H new ATOM 0 HB2 ARG A 82 131.659 -0.549 10.176 1.00 0.00 H new ATOM 0 HB3 ARG A 82 131.140 -2.108 10.785 1.00 0.00 H new ATOM 0 HG2 ARG A 82 133.219 -2.274 12.173 1.00 0.00 H new ATOM 0 HG3 ARG A 82 133.776 -0.738 11.540 1.00 0.00 H new ATOM 0 HD2 ARG A 82 132.728 -0.241 13.663 1.00 0.00 H new ATOM 0 HD3 ARG A 82 131.610 0.315 12.434 1.00 0.00 H new ATOM 0 HE ARG A 82 130.817 -2.365 12.925 1.00 0.00 H new ATOM 0 HH11 ARG A 82 131.294 0.625 14.669 1.00 0.00 H new ATOM 0 HH12 ARG A 82 130.095 0.241 15.908 1.00 0.00 H new ATOM 0 HH21 ARG A 82 129.298 -2.868 14.525 1.00 0.00 H new ATOM 0 HH22 ARG A 82 128.975 -1.719 15.827 1.00 0.00 H new ATOM 1294 N GLU A 83 132.323 -4.546 9.832 1.00 0.00 N ATOM 1295 CA GLU A 83 132.630 -5.929 10.287 1.00 0.00 C ATOM 1296 C GLU A 83 133.647 -6.597 9.359 1.00 0.00 C ATOM 1297 O GLU A 83 134.517 -7.313 9.813 1.00 0.00 O ATOM 1298 CB GLU A 83 131.347 -6.765 10.344 1.00 0.00 C ATOM 1299 CG GLU A 83 130.506 -6.330 11.548 1.00 0.00 C ATOM 1300 CD GLU A 83 129.225 -7.163 11.606 1.00 0.00 C ATOM 1301 OE1 GLU A 83 128.960 -7.874 10.651 1.00 0.00 O ATOM 1302 OE2 GLU A 83 128.533 -7.081 12.608 1.00 0.00 O ATOM 0 H GLU A 83 131.387 -4.413 9.449 1.00 0.00 H new ATOM 0 HA GLU A 83 133.063 -5.869 11.286 1.00 0.00 H new ATOM 0 HB2 GLU A 83 130.777 -6.638 9.424 1.00 0.00 H new ATOM 0 HB3 GLU A 83 131.594 -7.824 10.423 1.00 0.00 H new ATOM 0 HG2 GLU A 83 131.077 -6.457 12.468 1.00 0.00 H new ATOM 0 HG3 GLU A 83 130.260 -5.271 11.469 1.00 0.00 H new ATOM 1309 N TRP A 84 133.580 -6.373 8.070 1.00 0.00 N ATOM 1310 CA TRP A 84 134.582 -7.009 7.169 1.00 0.00 C ATOM 1311 C TRP A 84 135.979 -6.498 7.533 1.00 0.00 C ATOM 1312 O TRP A 84 136.931 -7.249 7.594 1.00 0.00 O ATOM 1313 CB TRP A 84 134.273 -6.668 5.709 1.00 0.00 C ATOM 1314 CG TRP A 84 135.261 -7.367 4.832 1.00 0.00 C ATOM 1315 CD1 TRP A 84 135.098 -8.612 4.327 1.00 0.00 C ATOM 1316 CD2 TRP A 84 136.560 -6.900 4.358 1.00 0.00 C ATOM 1317 NE1 TRP A 84 136.211 -8.940 3.575 1.00 0.00 N ATOM 1318 CE2 TRP A 84 137.140 -7.919 3.564 1.00 0.00 C ATOM 1319 CE3 TRP A 84 137.284 -5.707 4.538 1.00 0.00 C ATOM 1320 CZ2 TRP A 84 138.393 -7.760 2.970 1.00 0.00 C ATOM 1321 CZ3 TRP A 84 138.546 -5.545 3.940 1.00 0.00 C ATOM 1322 CH2 TRP A 84 139.099 -6.571 3.159 1.00 0.00 C ATOM 0 H TRP A 84 132.884 -5.785 7.610 1.00 0.00 H new ATOM 0 HA TRP A 84 134.540 -8.091 7.292 1.00 0.00 H new ATOM 0 HB2 TRP A 84 133.259 -6.977 5.456 1.00 0.00 H new ATOM 0 HB3 TRP A 84 134.326 -5.590 5.554 1.00 0.00 H new ATOM 0 HD1 TRP A 84 134.238 -9.246 4.486 1.00 0.00 H new ATOM 0 HE1 TRP A 84 136.331 -9.828 3.088 1.00 0.00 H new ATOM 0 HE3 TRP A 84 136.868 -4.912 5.139 1.00 0.00 H new ATOM 0 HZ2 TRP A 84 138.814 -8.552 2.368 1.00 0.00 H new ATOM 0 HZ3 TRP A 84 139.093 -4.625 4.083 1.00 0.00 H new ATOM 0 HH2 TRP A 84 140.070 -6.441 2.705 1.00 0.00 H new ATOM 1333 N CYS A 85 136.113 -5.218 7.761 1.00 0.00 N ATOM 1334 CA CYS A 85 137.451 -4.657 8.106 1.00 0.00 C ATOM 1335 C CYS A 85 137.970 -5.305 9.388 1.00 0.00 C ATOM 1336 O CYS A 85 139.139 -5.612 9.515 1.00 0.00 O ATOM 1337 CB CYS A 85 137.328 -3.145 8.314 1.00 0.00 C ATOM 1338 SG CYS A 85 137.097 -2.331 6.715 1.00 0.00 S ATOM 0 H CYS A 85 135.354 -4.538 7.723 1.00 0.00 H new ATOM 0 HA CYS A 85 138.148 -4.861 7.293 1.00 0.00 H new ATOM 0 HB2 CYS A 85 136.486 -2.925 8.971 1.00 0.00 H new ATOM 0 HB3 CYS A 85 138.223 -2.761 8.803 1.00 0.00 H new ATOM 0 HG CYS A 85 136.990 -1.048 6.893 1.00 0.00 H new ATOM 1344 N ASP A 86 137.108 -5.513 10.341 1.00 0.00 N ATOM 1345 CA ASP A 86 137.541 -6.138 11.620 1.00 0.00 C ATOM 1346 C ASP A 86 138.145 -7.519 11.347 1.00 0.00 C ATOM 1347 O ASP A 86 139.009 -7.979 12.065 1.00 0.00 O ATOM 1348 CB ASP A 86 136.335 -6.281 12.552 1.00 0.00 C ATOM 1349 CG ASP A 86 135.903 -4.898 13.044 1.00 0.00 C ATOM 1350 OD1 ASP A 86 136.744 -4.015 13.080 1.00 0.00 O ATOM 1351 OD2 ASP A 86 134.738 -4.744 13.373 1.00 0.00 O ATOM 0 H ASP A 86 136.117 -5.276 10.289 1.00 0.00 H new ATOM 0 HA ASP A 86 138.293 -5.506 12.092 1.00 0.00 H new ATOM 0 HB2 ASP A 86 135.512 -6.765 12.027 1.00 0.00 H new ATOM 0 HB3 ASP A 86 136.590 -6.917 13.400 1.00 0.00 H new ATOM 1356 N ALA A 87 137.687 -8.192 10.321 1.00 0.00 N ATOM 1357 CA ALA A 87 138.228 -9.554 10.018 1.00 0.00 C ATOM 1358 C ALA A 87 139.381 -9.478 9.008 1.00 0.00 C ATOM 1359 O ALA A 87 140.286 -10.289 9.038 1.00 0.00 O ATOM 1360 CB ALA A 87 137.113 -10.421 9.430 1.00 0.00 C ATOM 0 H ALA A 87 136.965 -7.859 9.682 1.00 0.00 H new ATOM 0 HA ALA A 87 138.602 -9.988 10.945 1.00 0.00 H new ATOM 0 HB1 ALA A 87 137.503 -11.414 9.208 1.00 0.00 H new ATOM 0 HB2 ALA A 87 136.299 -10.504 10.150 1.00 0.00 H new ATOM 0 HB3 ALA A 87 136.742 -9.964 8.513 1.00 0.00 H new ATOM 1366 N PHE A 88 139.331 -8.546 8.085 1.00 0.00 N ATOM 1367 CA PHE A 88 140.400 -8.455 7.032 1.00 0.00 C ATOM 1368 C PHE A 88 141.287 -7.220 7.224 1.00 0.00 C ATOM 1369 O PHE A 88 142.200 -6.984 6.457 1.00 0.00 O ATOM 1370 CB PHE A 88 139.735 -8.391 5.657 1.00 0.00 C ATOM 1371 CG PHE A 88 139.028 -9.698 5.392 1.00 0.00 C ATOM 1372 CD1 PHE A 88 139.750 -10.795 4.904 1.00 0.00 C ATOM 1373 CD2 PHE A 88 137.655 -9.819 5.642 1.00 0.00 C ATOM 1374 CE1 PHE A 88 139.098 -12.010 4.663 1.00 0.00 C ATOM 1375 CE2 PHE A 88 137.005 -11.035 5.401 1.00 0.00 C ATOM 1376 CZ PHE A 88 137.726 -12.130 4.912 1.00 0.00 C ATOM 0 H PHE A 88 138.596 -7.842 8.013 1.00 0.00 H new ATOM 0 HA PHE A 88 141.036 -9.337 7.115 1.00 0.00 H new ATOM 0 HB2 PHE A 88 139.025 -7.565 5.620 1.00 0.00 H new ATOM 0 HB3 PHE A 88 140.482 -8.204 4.886 1.00 0.00 H new ATOM 0 HD1 PHE A 88 140.809 -10.703 4.714 1.00 0.00 H new ATOM 0 HD2 PHE A 88 137.098 -8.974 6.020 1.00 0.00 H new ATOM 0 HE1 PHE A 88 139.654 -12.855 4.285 1.00 0.00 H new ATOM 0 HE2 PHE A 88 135.946 -11.128 5.593 1.00 0.00 H new ATOM 0 HZ PHE A 88 137.224 -13.068 4.727 1.00 0.00 H new ATOM 1386 N LEU A 89 141.039 -6.425 8.232 1.00 0.00 N ATOM 1387 CA LEU A 89 141.882 -5.208 8.455 1.00 0.00 C ATOM 1388 C LEU A 89 142.031 -4.973 9.959 1.00 0.00 C ATOM 1389 O LEU A 89 141.062 -4.555 10.573 1.00 0.00 O ATOM 1390 CB LEU A 89 141.197 -3.987 7.825 1.00 0.00 C ATOM 1391 CG LEU A 89 142.152 -2.775 7.829 1.00 0.00 C ATOM 1392 CD1 LEU A 89 143.141 -2.859 6.658 1.00 0.00 C ATOM 1393 CD2 LEU A 89 141.344 -1.481 7.704 1.00 0.00 C ATOM 1394 OXT LEU A 89 143.111 -5.218 10.473 1.00 0.00 O ATOM 0 H LEU A 89 140.291 -6.564 8.911 1.00 0.00 H new ATOM 0 HA LEU A 89 142.861 -5.354 8.000 1.00 0.00 H new ATOM 0 HB2 LEU A 89 140.896 -4.218 6.803 1.00 0.00 H new ATOM 0 HB3 LEU A 89 140.289 -3.745 8.378 1.00 0.00 H new ATOM 0 HG LEU A 89 142.708 -2.781 8.766 1.00 0.00 H new ATOM 0 HD11 LEU A 89 143.805 -1.995 6.680 1.00 0.00 H new ATOM 0 HD12 LEU A 89 143.731 -3.772 6.744 1.00 0.00 H new ATOM 0 HD13 LEU A 89 142.591 -2.870 5.717 1.00 0.00 H new ATOM 0 HD21 LEU A 89 142.022 -0.627 7.707 1.00 0.00 H new ATOM 0 HD22 LEU A 89 140.780 -1.493 6.771 1.00 0.00 H new ATOM 0 HD23 LEU A 89 140.654 -1.400 8.544 1.00 0.00 H new TER 1406 LEU A 89 ATOM 1407 N MET B 1 169.802 -5.655 0.384 1.00 0.00 N ATOM 1408 CA MET B 1 169.326 -6.729 -0.531 1.00 0.00 C ATOM 1409 C MET B 1 168.036 -6.269 -1.211 1.00 0.00 C ATOM 1410 O MET B 1 166.949 -6.667 -0.839 1.00 0.00 O ATOM 1411 CB MET B 1 169.061 -8.003 0.279 1.00 0.00 C ATOM 1412 CG MET B 1 168.666 -9.151 -0.658 1.00 0.00 C ATOM 1413 SD MET B 1 170.036 -9.546 -1.779 1.00 0.00 S ATOM 1414 CE MET B 1 171.248 -10.042 -0.528 1.00 0.00 C ATOM 0 H1 MET B 1 170.680 -5.960 0.851 1.00 0.00 H new ATOM 0 H2 MET B 1 169.984 -4.789 -0.162 1.00 0.00 H new ATOM 0 H3 MET B 1 169.076 -5.465 1.103 1.00 0.00 H new ATOM 0 HA MET B 1 170.082 -6.936 -1.288 1.00 0.00 H new ATOM 0 HB2 MET B 1 169.952 -8.275 0.845 1.00 0.00 H new ATOM 0 HB3 MET B 1 168.266 -7.824 1.003 1.00 0.00 H new ATOM 0 HG2 MET B 1 168.400 -10.032 -0.073 1.00 0.00 H new ATOM 0 HG3 MET B 1 167.784 -8.872 -1.234 1.00 0.00 H new ATOM 0 HE1 MET B 1 171.954 -10.749 -0.965 1.00 0.00 H new ATOM 0 HE2 MET B 1 171.787 -9.163 -0.175 1.00 0.00 H new ATOM 0 HE3 MET B 1 170.734 -10.514 0.310 1.00 0.00 H new ATOM 1426 N THR B 2 168.147 -5.425 -2.202 1.00 0.00 N ATOM 1427 CA THR B 2 166.929 -4.930 -2.902 1.00 0.00 C ATOM 1428 C THR B 2 165.936 -4.391 -1.866 1.00 0.00 C ATOM 1429 O THR B 2 166.166 -3.367 -1.254 1.00 0.00 O ATOM 1430 CB THR B 2 166.296 -6.077 -3.698 1.00 0.00 C ATOM 1431 OG1 THR B 2 167.295 -6.699 -4.493 1.00 0.00 O ATOM 1432 CG2 THR B 2 165.191 -5.529 -4.606 1.00 0.00 C ATOM 0 H THR B 2 169.030 -5.057 -2.556 1.00 0.00 H new ATOM 0 HA THR B 2 167.196 -4.129 -3.591 1.00 0.00 H new ATOM 0 HB THR B 2 165.866 -6.804 -3.009 1.00 0.00 H new ATOM 0 HG1 THR B 2 166.896 -7.435 -5.003 1.00 0.00 H new ATOM 0 HG21 THR B 2 164.744 -6.348 -5.170 1.00 0.00 H new ATOM 0 HG22 THR B 2 164.426 -5.047 -3.998 1.00 0.00 H new ATOM 0 HG23 THR B 2 165.616 -4.802 -5.298 1.00 0.00 H new ATOM 1440 N THR B 3 164.837 -5.066 -1.658 1.00 0.00 N ATOM 1441 CA THR B 3 163.845 -4.576 -0.659 1.00 0.00 C ATOM 1442 C THR B 3 164.379 -4.803 0.759 1.00 0.00 C ATOM 1443 O THR B 3 165.127 -5.725 1.015 1.00 0.00 O ATOM 1444 CB THR B 3 162.529 -5.336 -0.833 1.00 0.00 C ATOM 1445 OG1 THR B 3 162.771 -6.732 -0.722 1.00 0.00 O ATOM 1446 CG2 THR B 3 161.937 -5.026 -2.207 1.00 0.00 C ATOM 0 H THR B 3 164.585 -5.932 -2.135 1.00 0.00 H new ATOM 0 HA THR B 3 163.677 -3.510 -0.814 1.00 0.00 H new ATOM 0 HB THR B 3 161.826 -5.027 -0.060 1.00 0.00 H new ATOM 0 HG1 THR B 3 161.928 -7.220 -0.832 1.00 0.00 H new ATOM 0 HG21 THR B 3 160.999 -5.568 -2.330 1.00 0.00 H new ATOM 0 HG22 THR B 3 161.751 -3.955 -2.290 1.00 0.00 H new ATOM 0 HG23 THR B 3 162.638 -5.333 -2.983 1.00 0.00 H new ATOM 1454 N SER B 4 163.993 -3.964 1.682 1.00 0.00 N ATOM 1455 CA SER B 4 164.463 -4.115 3.090 1.00 0.00 C ATOM 1456 C SER B 4 163.634 -5.192 3.791 1.00 0.00 C ATOM 1457 O SER B 4 162.667 -5.700 3.259 1.00 0.00 O ATOM 1458 CB SER B 4 164.291 -2.787 3.827 1.00 0.00 C ATOM 1459 OG SER B 4 162.916 -2.425 3.821 1.00 0.00 O ATOM 0 H SER B 4 163.368 -3.175 1.520 1.00 0.00 H new ATOM 0 HA SER B 4 165.514 -4.403 3.093 1.00 0.00 H new ATOM 0 HB2 SER B 4 164.652 -2.876 4.852 1.00 0.00 H new ATOM 0 HB3 SER B 4 164.886 -2.011 3.346 1.00 0.00 H new ATOM 0 HG SER B 4 162.800 -1.575 4.294 1.00 0.00 H new ATOM 1465 N GLN B 5 164.026 -5.546 4.986 1.00 0.00 N ATOM 1466 CA GLN B 5 163.294 -6.594 5.752 1.00 0.00 C ATOM 1467 C GLN B 5 161.875 -6.118 6.066 1.00 0.00 C ATOM 1468 O GLN B 5 160.975 -6.912 6.258 1.00 0.00 O ATOM 1469 CB GLN B 5 164.036 -6.880 7.059 1.00 0.00 C ATOM 1470 CG GLN B 5 165.351 -7.600 6.754 1.00 0.00 C ATOM 1471 CD GLN B 5 166.102 -7.868 8.061 1.00 0.00 C ATOM 1472 OE1 GLN B 5 166.013 -7.097 8.995 1.00 0.00 O ATOM 1473 NE2 GLN B 5 166.845 -8.936 8.166 1.00 0.00 N ATOM 0 H GLN B 5 164.832 -5.148 5.469 1.00 0.00 H new ATOM 0 HA GLN B 5 163.241 -7.503 5.153 1.00 0.00 H new ATOM 0 HB2 GLN B 5 164.234 -5.948 7.588 1.00 0.00 H new ATOM 0 HB3 GLN B 5 163.417 -7.493 7.714 1.00 0.00 H new ATOM 0 HG2 GLN B 5 165.152 -8.539 6.237 1.00 0.00 H new ATOM 0 HG3 GLN B 5 165.964 -6.993 6.088 1.00 0.00 H new ATOM 0 HE21 GLN B 5 166.920 -9.584 7.382 1.00 0.00 H new ATOM 0 HE22 GLN B 5 167.350 -9.123 9.032 1.00 0.00 H new ATOM 1482 N LYS B 6 161.663 -4.829 6.122 1.00 0.00 N ATOM 1483 CA LYS B 6 160.302 -4.307 6.427 1.00 0.00 C ATOM 1484 C LYS B 6 159.330 -4.762 5.337 1.00 0.00 C ATOM 1485 O LYS B 6 158.176 -5.039 5.601 1.00 0.00 O ATOM 1486 CB LYS B 6 160.342 -2.778 6.472 1.00 0.00 C ATOM 1487 CG LYS B 6 161.117 -2.325 7.712 1.00 0.00 C ATOM 1488 CD LYS B 6 161.159 -0.796 7.763 1.00 0.00 C ATOM 1489 CE LYS B 6 161.935 -0.349 9.004 1.00 0.00 C ATOM 1490 NZ LYS B 6 161.210 -0.792 10.229 1.00 0.00 N ATOM 0 H LYS B 6 162.376 -4.116 5.969 1.00 0.00 H new ATOM 0 HA LYS B 6 159.971 -4.689 7.393 1.00 0.00 H new ATOM 0 HB2 LYS B 6 160.817 -2.389 5.571 1.00 0.00 H new ATOM 0 HB3 LYS B 6 159.329 -2.377 6.497 1.00 0.00 H new ATOM 0 HG2 LYS B 6 160.643 -2.716 8.612 1.00 0.00 H new ATOM 0 HG3 LYS B 6 162.130 -2.726 7.686 1.00 0.00 H new ATOM 0 HD2 LYS B 6 161.634 -0.404 6.863 1.00 0.00 H new ATOM 0 HD3 LYS B 6 160.146 -0.394 7.790 1.00 0.00 H new ATOM 0 HE2 LYS B 6 162.940 -0.772 8.990 1.00 0.00 H new ATOM 0 HE3 LYS B 6 162.046 0.735 9.006 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 161.524 -0.225 11.042 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 160.187 -0.665 10.092 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 161.413 -1.796 10.408 1.00 0.00 H new ATOM 1504 N HIS B 7 159.774 -4.827 4.116 1.00 0.00 N ATOM 1505 CA HIS B 7 158.863 -5.247 3.014 1.00 0.00 C ATOM 1506 C HIS B 7 158.315 -6.655 3.277 1.00 0.00 C ATOM 1507 O HIS B 7 157.126 -6.890 3.188 1.00 0.00 O ATOM 1508 CB HIS B 7 159.636 -5.220 1.688 1.00 0.00 C ATOM 1509 CG HIS B 7 158.814 -5.845 0.591 1.00 0.00 C ATOM 1510 ND1 HIS B 7 157.842 -5.141 -0.109 1.00 0.00 N ATOM 1511 CD2 HIS B 7 158.820 -7.109 0.055 1.00 0.00 C ATOM 1512 CE1 HIS B 7 157.310 -5.979 -1.020 1.00 0.00 C ATOM 1513 NE2 HIS B 7 157.872 -7.188 -0.959 1.00 0.00 N ATOM 0 H HIS B 7 160.729 -4.608 3.831 1.00 0.00 H new ATOM 0 HA HIS B 7 158.020 -4.558 2.961 1.00 0.00 H new ATOM 0 HB2 HIS B 7 159.884 -4.192 1.425 1.00 0.00 H new ATOM 0 HB3 HIS B 7 160.578 -5.758 1.797 1.00 0.00 H new ATOM 0 HD2 HIS B 7 159.462 -7.917 0.372 1.00 0.00 H new ATOM 0 HE1 HIS B 7 156.527 -5.707 -1.712 1.00 0.00 H new ATOM 0 HE2 HIS B 7 157.652 -8.000 -1.536 1.00 0.00 H new ATOM 1521 N ARG B 8 159.166 -7.597 3.598 1.00 0.00 N ATOM 1522 CA ARG B 8 158.684 -8.984 3.860 1.00 0.00 C ATOM 1523 C ARG B 8 157.895 -9.020 5.173 1.00 0.00 C ATOM 1524 O ARG B 8 156.972 -9.793 5.334 1.00 0.00 O ATOM 1525 CB ARG B 8 159.892 -9.931 3.968 1.00 0.00 C ATOM 1526 CG ARG B 8 160.602 -10.065 2.610 1.00 0.00 C ATOM 1527 CD ARG B 8 159.858 -11.045 1.688 1.00 0.00 C ATOM 1528 NE ARG B 8 159.603 -12.344 2.400 1.00 0.00 N ATOM 1529 CZ ARG B 8 160.577 -13.065 2.890 1.00 0.00 C ATOM 1530 NH1 ARG B 8 161.820 -12.761 2.636 1.00 0.00 N ATOM 1531 NH2 ARG B 8 160.302 -14.128 3.596 1.00 0.00 N ATOM 0 H ARG B 8 160.173 -7.464 3.689 1.00 0.00 H new ATOM 0 HA ARG B 8 158.038 -9.301 3.041 1.00 0.00 H new ATOM 0 HB2 ARG B 8 160.591 -9.553 4.714 1.00 0.00 H new ATOM 0 HB3 ARG B 8 159.562 -10.912 4.310 1.00 0.00 H new ATOM 0 HG2 ARG B 8 160.665 -9.088 2.131 1.00 0.00 H new ATOM 0 HG3 ARG B 8 161.624 -10.411 2.764 1.00 0.00 H new ATOM 0 HD2 ARG B 8 158.913 -10.607 1.368 1.00 0.00 H new ATOM 0 HD3 ARG B 8 160.446 -11.226 0.788 1.00 0.00 H new ATOM 0 HE ARG B 8 158.643 -12.672 2.504 1.00 0.00 H new ATOM 0 HH11 ARG B 8 162.038 -11.955 2.051 1.00 0.00 H new ATOM 0 HH12 ARG B 8 162.573 -13.330 3.023 1.00 0.00 H new ATOM 0 HH21 ARG B 8 159.331 -14.392 3.763 1.00 0.00 H new ATOM 0 HH22 ARG B 8 161.058 -14.694 3.981 1.00 0.00 H new ATOM 1545 N ASP B 9 158.255 -8.190 6.110 1.00 0.00 N ATOM 1546 CA ASP B 9 157.533 -8.168 7.415 1.00 0.00 C ATOM 1547 C ASP B 9 156.140 -7.556 7.247 1.00 0.00 C ATOM 1548 O ASP B 9 155.182 -7.989 7.857 1.00 0.00 O ATOM 1549 CB ASP B 9 158.319 -7.334 8.426 1.00 0.00 C ATOM 1550 CG ASP B 9 159.601 -8.070 8.817 1.00 0.00 C ATOM 1551 OD1 ASP B 9 159.665 -9.267 8.595 1.00 0.00 O ATOM 1552 OD2 ASP B 9 160.494 -7.425 9.338 1.00 0.00 O ATOM 0 H ASP B 9 159.022 -7.522 6.029 1.00 0.00 H new ATOM 0 HA ASP B 9 157.436 -9.194 7.771 1.00 0.00 H new ATOM 0 HB2 ASP B 9 158.563 -6.362 7.998 1.00 0.00 H new ATOM 0 HB3 ASP B 9 157.710 -7.149 9.311 1.00 0.00 H new ATOM 1557 N PHE B 10 156.030 -6.531 6.446 1.00 0.00 N ATOM 1558 CA PHE B 10 154.712 -5.855 6.260 1.00 0.00 C ATOM 1559 C PHE B 10 153.732 -6.791 5.546 1.00 0.00 C ATOM 1560 O PHE B 10 152.560 -6.839 5.866 1.00 0.00 O ATOM 1561 CB PHE B 10 154.931 -4.598 5.411 1.00 0.00 C ATOM 1562 CG PHE B 10 153.681 -3.747 5.396 1.00 0.00 C ATOM 1563 CD1 PHE B 10 152.689 -3.968 4.432 1.00 0.00 C ATOM 1564 CD2 PHE B 10 153.519 -2.729 6.345 1.00 0.00 C ATOM 1565 CE1 PHE B 10 151.537 -3.171 4.418 1.00 0.00 C ATOM 1566 CE2 PHE B 10 152.369 -1.933 6.331 1.00 0.00 C ATOM 1567 CZ PHE B 10 151.376 -2.153 5.368 1.00 0.00 C ATOM 0 H PHE B 10 156.799 -6.130 5.910 1.00 0.00 H new ATOM 0 HA PHE B 10 154.293 -5.591 7.231 1.00 0.00 H new ATOM 0 HB2 PHE B 10 155.766 -4.022 5.811 1.00 0.00 H new ATOM 0 HB3 PHE B 10 155.198 -4.881 4.393 1.00 0.00 H new ATOM 0 HD1 PHE B 10 152.812 -4.752 3.700 1.00 0.00 H new ATOM 0 HD2 PHE B 10 154.283 -2.559 7.089 1.00 0.00 H new ATOM 0 HE1 PHE B 10 150.772 -3.341 3.675 1.00 0.00 H new ATOM 0 HE2 PHE B 10 152.247 -1.148 7.063 1.00 0.00 H new ATOM 0 HZ PHE B 10 150.487 -1.539 5.357 1.00 0.00 H new ATOM 1577 N VAL B 11 154.197 -7.525 4.573 1.00 0.00 N ATOM 1578 CA VAL B 11 153.292 -8.447 3.827 1.00 0.00 C ATOM 1579 C VAL B 11 153.128 -9.764 4.592 1.00 0.00 C ATOM 1580 O VAL B 11 152.711 -10.759 4.034 1.00 0.00 O ATOM 1581 CB VAL B 11 153.898 -8.732 2.452 1.00 0.00 C ATOM 1582 CG1 VAL B 11 154.070 -7.414 1.689 1.00 0.00 C ATOM 1583 CG2 VAL B 11 155.264 -9.407 2.629 1.00 0.00 C ATOM 0 H VAL B 11 155.168 -7.527 4.261 1.00 0.00 H new ATOM 0 HA VAL B 11 152.314 -7.979 3.717 1.00 0.00 H new ATOM 0 HB VAL B 11 153.238 -9.392 1.890 1.00 0.00 H new ATOM 0 HG11 VAL B 11 154.502 -7.615 0.709 1.00 0.00 H new ATOM 0 HG12 VAL B 11 153.099 -6.935 1.566 1.00 0.00 H new ATOM 0 HG13 VAL B 11 154.732 -6.753 2.249 1.00 0.00 H new ATOM 0 HG21 VAL B 11 155.698 -9.611 1.650 1.00 0.00 H new ATOM 0 HG22 VAL B 11 155.926 -8.747 3.189 1.00 0.00 H new ATOM 0 HG23 VAL B 11 155.139 -10.343 3.173 1.00 0.00 H new ATOM 1593 N ALA B 12 153.469 -9.782 5.861 1.00 0.00 N ATOM 1594 CA ALA B 12 153.353 -11.043 6.671 1.00 0.00 C ATOM 1595 C ALA B 12 152.416 -10.836 7.866 1.00 0.00 C ATOM 1596 O ALA B 12 152.111 -11.765 8.586 1.00 0.00 O ATOM 1597 CB ALA B 12 154.741 -11.434 7.182 1.00 0.00 C ATOM 0 H ALA B 12 153.824 -8.975 6.374 1.00 0.00 H new ATOM 0 HA ALA B 12 152.943 -11.832 6.040 1.00 0.00 H new ATOM 0 HB1 ALA B 12 154.668 -12.348 7.771 1.00 0.00 H new ATOM 0 HB2 ALA B 12 155.407 -11.600 6.335 1.00 0.00 H new ATOM 0 HB3 ALA B 12 155.139 -10.632 7.804 1.00 0.00 H new ATOM 1603 N GLU B 13 151.941 -9.637 8.084 1.00 0.00 N ATOM 1604 CA GLU B 13 151.012 -9.402 9.234 1.00 0.00 C ATOM 1605 C GLU B 13 150.103 -8.204 8.916 1.00 0.00 C ATOM 1606 O GLU B 13 150.503 -7.305 8.205 1.00 0.00 O ATOM 1607 CB GLU B 13 151.825 -9.109 10.500 1.00 0.00 C ATOM 1608 CG GLU B 13 152.814 -7.975 10.229 1.00 0.00 C ATOM 1609 CD GLU B 13 153.508 -7.581 11.535 1.00 0.00 C ATOM 1610 OE1 GLU B 13 152.874 -7.675 12.573 1.00 0.00 O ATOM 1611 OE2 GLU B 13 154.662 -7.190 11.474 1.00 0.00 O ATOM 0 H GLU B 13 152.153 -8.814 7.520 1.00 0.00 H new ATOM 0 HA GLU B 13 150.401 -10.290 9.397 1.00 0.00 H new ATOM 0 HB2 GLU B 13 151.157 -8.834 11.317 1.00 0.00 H new ATOM 0 HB3 GLU B 13 152.361 -10.004 10.814 1.00 0.00 H new ATOM 0 HG2 GLU B 13 153.553 -8.291 9.493 1.00 0.00 H new ATOM 0 HG3 GLU B 13 152.292 -7.116 9.808 1.00 0.00 H new ATOM 1618 N PRO B 14 148.896 -8.168 9.440 1.00 0.00 N ATOM 1619 CA PRO B 14 147.968 -7.030 9.189 1.00 0.00 C ATOM 1620 C PRO B 14 148.698 -5.682 9.261 1.00 0.00 C ATOM 1621 O PRO B 14 149.759 -5.575 9.843 1.00 0.00 O ATOM 1622 CB PRO B 14 146.937 -7.152 10.319 1.00 0.00 C ATOM 1623 CG PRO B 14 146.896 -8.613 10.657 1.00 0.00 C ATOM 1624 CD PRO B 14 148.282 -9.189 10.316 1.00 0.00 C ATOM 0 HA PRO B 14 147.522 -7.067 8.195 1.00 0.00 H new ATOM 0 HB2 PRO B 14 147.228 -6.556 11.184 1.00 0.00 H new ATOM 0 HB3 PRO B 14 145.958 -6.794 10.000 1.00 0.00 H new ATOM 0 HG2 PRO B 14 146.666 -8.759 11.712 1.00 0.00 H new ATOM 0 HG3 PRO B 14 146.116 -9.119 10.088 1.00 0.00 H new ATOM 0 HD2 PRO B 14 148.877 -9.352 11.215 1.00 0.00 H new ATOM 0 HD3 PRO B 14 148.200 -10.151 9.809 1.00 0.00 H new ATOM 1632 N MET B 15 148.143 -4.650 8.683 1.00 0.00 N ATOM 1633 CA MET B 15 148.815 -3.316 8.733 1.00 0.00 C ATOM 1634 C MET B 15 148.327 -2.555 9.968 1.00 0.00 C ATOM 1635 O MET B 15 148.980 -1.653 10.455 1.00 0.00 O ATOM 1636 CB MET B 15 148.478 -2.522 7.467 1.00 0.00 C ATOM 1637 CG MET B 15 146.999 -2.706 7.128 1.00 0.00 C ATOM 1638 SD MET B 15 146.504 -1.480 5.886 1.00 0.00 S ATOM 1639 CE MET B 15 147.462 -2.115 4.482 1.00 0.00 C ATOM 0 H MET B 15 147.256 -4.671 8.180 1.00 0.00 H new ATOM 0 HA MET B 15 149.895 -3.450 8.791 1.00 0.00 H new ATOM 0 HB2 MET B 15 148.699 -1.465 7.618 1.00 0.00 H new ATOM 0 HB3 MET B 15 149.097 -2.861 6.637 1.00 0.00 H new ATOM 0 HG2 MET B 15 146.825 -3.713 6.749 1.00 0.00 H new ATOM 0 HG3 MET B 15 146.393 -2.594 8.027 1.00 0.00 H new ATOM 0 HE1 MET B 15 148.094 -1.321 4.084 1.00 0.00 H new ATOM 0 HE2 MET B 15 148.087 -2.944 4.813 1.00 0.00 H new ATOM 0 HE3 MET B 15 146.782 -2.462 3.704 1.00 0.00 H new ATOM 1649 N GLY B 16 147.187 -2.928 10.483 1.00 0.00 N ATOM 1650 CA GLY B 16 146.645 -2.252 11.695 1.00 0.00 C ATOM 1651 C GLY B 16 146.655 -0.732 11.509 1.00 0.00 C ATOM 1652 O GLY B 16 146.284 -0.219 10.474 1.00 0.00 O ATOM 0 H GLY B 16 146.604 -3.678 10.112 1.00 0.00 H new ATOM 0 HA2 GLY B 16 145.628 -2.595 11.886 1.00 0.00 H new ATOM 0 HA3 GLY B 16 147.241 -2.522 12.567 1.00 0.00 H new ATOM 1656 N GLU B 17 147.051 -0.010 12.530 1.00 0.00 N ATOM 1657 CA GLU B 17 147.062 1.487 12.465 1.00 0.00 C ATOM 1658 C GLU B 17 148.501 2.005 12.410 1.00 0.00 C ATOM 1659 O GLU B 17 148.809 3.055 12.940 1.00 0.00 O ATOM 1660 CB GLU B 17 146.376 2.038 13.717 1.00 0.00 C ATOM 1661 CG GLU B 17 144.933 1.530 13.771 1.00 0.00 C ATOM 1662 CD GLU B 17 144.243 2.079 15.020 1.00 0.00 C ATOM 1663 OE1 GLU B 17 144.903 2.766 15.784 1.00 0.00 O ATOM 1664 OE2 GLU B 17 143.069 1.797 15.196 1.00 0.00 O ATOM 0 H GLU B 17 147.371 -0.399 13.417 1.00 0.00 H new ATOM 0 HA GLU B 17 146.536 1.813 11.568 1.00 0.00 H new ATOM 0 HB2 GLU B 17 146.917 1.724 14.610 1.00 0.00 H new ATOM 0 HB3 GLU B 17 146.389 3.128 13.703 1.00 0.00 H new ATOM 0 HG2 GLU B 17 144.393 1.843 12.877 1.00 0.00 H new ATOM 0 HG3 GLU B 17 144.921 0.440 13.786 1.00 0.00 H new ATOM 1671 N LYS B 18 149.388 1.282 11.784 1.00 0.00 N ATOM 1672 CA LYS B 18 150.805 1.739 11.711 1.00 0.00 C ATOM 1673 C LYS B 18 150.858 3.099 10.999 1.00 0.00 C ATOM 1674 O LYS B 18 150.026 3.392 10.163 1.00 0.00 O ATOM 1675 CB LYS B 18 151.619 0.717 10.912 1.00 0.00 C ATOM 1676 CG LYS B 18 151.773 -0.561 11.732 1.00 0.00 C ATOM 1677 CD LYS B 18 152.513 -1.611 10.904 1.00 0.00 C ATOM 1678 CE LYS B 18 152.683 -2.884 11.733 1.00 0.00 C ATOM 1679 NZ LYS B 18 151.372 -3.580 11.848 1.00 0.00 N ATOM 0 H LYS B 18 149.193 0.395 11.320 1.00 0.00 H new ATOM 0 HA LYS B 18 151.218 1.834 12.715 1.00 0.00 H new ATOM 0 HB2 LYS B 18 151.122 0.498 9.967 1.00 0.00 H new ATOM 0 HB3 LYS B 18 152.599 1.127 10.669 1.00 0.00 H new ATOM 0 HG2 LYS B 18 152.322 -0.353 12.650 1.00 0.00 H new ATOM 0 HG3 LYS B 18 150.793 -0.938 12.025 1.00 0.00 H new ATOM 0 HD2 LYS B 18 151.957 -1.829 9.992 1.00 0.00 H new ATOM 0 HD3 LYS B 18 153.488 -1.229 10.599 1.00 0.00 H new ATOM 0 HE2 LYS B 18 153.416 -3.541 11.264 1.00 0.00 H new ATOM 0 HE3 LYS B 18 153.064 -2.637 12.724 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 151.138 -3.717 12.852 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 150.633 -3.005 11.396 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 151.428 -4.505 11.376 1.00 0.00 H new ATOM 1693 N PRO B 19 151.817 3.936 11.330 1.00 0.00 N ATOM 1694 CA PRO B 19 151.946 5.287 10.707 1.00 0.00 C ATOM 1695 C PRO B 19 152.239 5.203 9.205 1.00 0.00 C ATOM 1696 O PRO B 19 152.802 4.244 8.720 1.00 0.00 O ATOM 1697 CB PRO B 19 153.111 5.948 11.470 1.00 0.00 C ATOM 1698 CG PRO B 19 153.887 4.814 12.065 1.00 0.00 C ATOM 1699 CD PRO B 19 152.878 3.694 12.328 1.00 0.00 C ATOM 0 HA PRO B 19 151.020 5.858 10.780 1.00 0.00 H new ATOM 0 HB2 PRO B 19 153.733 6.542 10.800 1.00 0.00 H new ATOM 0 HB3 PRO B 19 152.743 6.621 12.244 1.00 0.00 H new ATOM 0 HG2 PRO B 19 154.670 4.480 11.385 1.00 0.00 H new ATOM 0 HG3 PRO B 19 154.377 5.121 12.989 1.00 0.00 H new ATOM 0 HD2 PRO B 19 153.330 2.710 12.201 1.00 0.00 H new ATOM 0 HD3 PRO B 19 152.488 3.737 13.345 1.00 0.00 H new ATOM 1707 N VAL B 20 151.840 6.204 8.470 1.00 0.00 N ATOM 1708 CA VAL B 20 152.066 6.196 6.999 1.00 0.00 C ATOM 1709 C VAL B 20 153.548 5.960 6.687 1.00 0.00 C ATOM 1710 O VAL B 20 153.894 5.257 5.758 1.00 0.00 O ATOM 1711 CB VAL B 20 151.616 7.541 6.418 1.00 0.00 C ATOM 1712 CG1 VAL B 20 152.264 8.690 7.197 1.00 0.00 C ATOM 1713 CG2 VAL B 20 152.025 7.631 4.945 1.00 0.00 C ATOM 0 H VAL B 20 151.364 7.032 8.828 1.00 0.00 H new ATOM 0 HA VAL B 20 151.488 5.388 6.549 1.00 0.00 H new ATOM 0 HB VAL B 20 150.532 7.617 6.500 1.00 0.00 H new ATOM 0 HG11 VAL B 20 151.939 9.642 6.778 1.00 0.00 H new ATOM 0 HG12 VAL B 20 151.966 8.634 8.244 1.00 0.00 H new ATOM 0 HG13 VAL B 20 153.349 8.613 7.124 1.00 0.00 H new ATOM 0 HG21 VAL B 20 151.703 8.589 4.536 1.00 0.00 H new ATOM 0 HG22 VAL B 20 153.109 7.547 4.862 1.00 0.00 H new ATOM 0 HG23 VAL B 20 151.555 6.822 4.387 1.00 0.00 H new ATOM 1723 N GLY B 21 154.428 6.566 7.445 1.00 0.00 N ATOM 1724 CA GLY B 21 155.888 6.411 7.190 1.00 0.00 C ATOM 1725 C GLY B 21 156.320 4.960 7.408 1.00 0.00 C ATOM 1726 O GLY B 21 157.461 4.611 7.177 1.00 0.00 O ATOM 0 H GLY B 21 154.192 7.166 8.236 1.00 0.00 H new ATOM 0 HA2 GLY B 21 156.119 6.716 6.169 1.00 0.00 H new ATOM 0 HA3 GLY B 21 156.451 7.068 7.854 1.00 0.00 H new ATOM 1730 N SER B 22 155.434 4.104 7.843 1.00 0.00 N ATOM 1731 CA SER B 22 155.826 2.681 8.056 1.00 0.00 C ATOM 1732 C SER B 22 155.755 1.936 6.722 1.00 0.00 C ATOM 1733 O SER B 22 156.393 0.919 6.535 1.00 0.00 O ATOM 1734 CB SER B 22 154.873 2.028 9.056 1.00 0.00 C ATOM 1735 OG SER B 22 155.196 0.649 9.181 1.00 0.00 O ATOM 0 H SER B 22 154.462 4.327 8.059 1.00 0.00 H new ATOM 0 HA SER B 22 156.842 2.638 8.449 1.00 0.00 H new ATOM 0 HB2 SER B 22 154.951 2.521 10.025 1.00 0.00 H new ATOM 0 HB3 SER B 22 153.842 2.143 8.722 1.00 0.00 H new ATOM 0 HG SER B 22 154.972 0.341 10.084 1.00 0.00 H new ATOM 1741 N LEU B 23 154.985 2.433 5.791 1.00 0.00 N ATOM 1742 CA LEU B 23 154.880 1.746 4.472 1.00 0.00 C ATOM 1743 C LEU B 23 156.247 1.753 3.786 1.00 0.00 C ATOM 1744 O LEU B 23 156.974 2.725 3.822 1.00 0.00 O ATOM 1745 CB LEU B 23 153.854 2.471 3.593 1.00 0.00 C ATOM 1746 CG LEU B 23 152.435 2.252 4.141 1.00 0.00 C ATOM 1747 CD1 LEU B 23 151.470 3.203 3.427 1.00 0.00 C ATOM 1748 CD2 LEU B 23 151.981 0.796 3.904 1.00 0.00 C ATOM 0 H LEU B 23 154.427 3.281 5.886 1.00 0.00 H new ATOM 0 HA LEU B 23 154.556 0.716 4.622 1.00 0.00 H new ATOM 0 HB2 LEU B 23 154.079 3.537 3.563 1.00 0.00 H new ATOM 0 HB3 LEU B 23 153.917 2.103 2.569 1.00 0.00 H new ATOM 0 HG LEU B 23 152.436 2.449 5.213 1.00 0.00 H new ATOM 0 HD11 LEU B 23 150.461 3.053 3.811 1.00 0.00 H new ATOM 0 HD12 LEU B 23 151.777 4.234 3.605 1.00 0.00 H new ATOM 0 HD13 LEU B 23 151.485 3.000 2.356 1.00 0.00 H new ATOM 0 HD21 LEU B 23 150.974 0.660 4.299 1.00 0.00 H new ATOM 0 HD22 LEU B 23 151.983 0.584 2.835 1.00 0.00 H new ATOM 0 HD23 LEU B 23 152.664 0.115 4.411 1.00 0.00 H new ATOM 1760 N ALA B 24 156.594 0.661 3.173 1.00 0.00 N ATOM 1761 CA ALA B 24 157.914 0.576 2.491 1.00 0.00 C ATOM 1762 C ALA B 24 157.997 1.609 1.363 1.00 0.00 C ATOM 1763 O ALA B 24 157.059 1.824 0.622 1.00 0.00 O ATOM 1764 CB ALA B 24 158.085 -0.826 1.905 1.00 0.00 C ATOM 0 H ALA B 24 156.020 -0.180 3.113 1.00 0.00 H new ATOM 0 HA ALA B 24 158.703 0.779 3.215 1.00 0.00 H new ATOM 0 HB1 ALA B 24 159.050 -0.896 1.404 1.00 0.00 H new ATOM 0 HB2 ALA B 24 158.038 -1.563 2.706 1.00 0.00 H new ATOM 0 HB3 ALA B 24 157.288 -1.020 1.187 1.00 0.00 H new ATOM 1770 N GLY B 25 159.132 2.242 1.236 1.00 0.00 N ATOM 1771 CA GLY B 25 159.320 3.266 0.161 1.00 0.00 C ATOM 1772 C GLY B 25 159.014 4.664 0.704 1.00 0.00 C ATOM 1773 O GLY B 25 159.358 5.656 0.095 1.00 0.00 O ATOM 0 H GLY B 25 159.945 2.094 1.834 1.00 0.00 H new ATOM 0 HA2 GLY B 25 160.344 3.229 -0.212 1.00 0.00 H new ATOM 0 HA3 GLY B 25 158.665 3.044 -0.682 1.00 0.00 H new ATOM 1777 N ILE B 26 158.384 4.756 1.847 1.00 0.00 N ATOM 1778 CA ILE B 26 158.074 6.100 2.433 1.00 0.00 C ATOM 1779 C ILE B 26 159.088 6.384 3.539 1.00 0.00 C ATOM 1780 O ILE B 26 159.143 5.681 4.528 1.00 0.00 O ATOM 1781 CB ILE B 26 156.663 6.090 3.025 1.00 0.00 C ATOM 1782 CG1 ILE B 26 155.653 5.617 1.967 1.00 0.00 C ATOM 1783 CG2 ILE B 26 156.294 7.499 3.493 1.00 0.00 C ATOM 1784 CD1 ILE B 26 155.796 6.440 0.680 1.00 0.00 C ATOM 0 H ILE B 26 158.070 3.960 2.402 1.00 0.00 H new ATOM 0 HA ILE B 26 158.129 6.868 1.662 1.00 0.00 H new ATOM 0 HB ILE B 26 156.637 5.406 3.873 1.00 0.00 H new ATOM 0 HG12 ILE B 26 155.813 4.561 1.750 1.00 0.00 H new ATOM 0 HG13 ILE B 26 154.639 5.712 2.356 1.00 0.00 H new ATOM 0 HG21 ILE B 26 155.289 7.491 3.914 1.00 0.00 H new ATOM 0 HG22 ILE B 26 157.003 7.828 4.253 1.00 0.00 H new ATOM 0 HG23 ILE B 26 156.327 8.184 2.646 1.00 0.00 H new ATOM 0 HD11 ILE B 26 155.073 6.091 -0.057 1.00 0.00 H new ATOM 0 HD12 ILE B 26 155.612 7.492 0.899 1.00 0.00 H new ATOM 0 HD13 ILE B 26 156.804 6.323 0.283 1.00 0.00 H new ATOM 1796 N GLY B 27 159.896 7.406 3.398 1.00 0.00 N ATOM 1797 CA GLY B 27 160.899 7.718 4.459 1.00 0.00 C ATOM 1798 C GLY B 27 160.322 8.765 5.414 1.00 0.00 C ATOM 1799 O GLY B 27 159.208 9.222 5.253 1.00 0.00 O ATOM 0 H GLY B 27 159.903 8.035 2.595 1.00 0.00 H new ATOM 0 HA2 GLY B 27 161.157 6.812 5.008 1.00 0.00 H new ATOM 0 HA3 GLY B 27 161.819 8.090 4.007 1.00 0.00 H new ATOM 1803 N GLU B 28 161.067 9.127 6.419 1.00 0.00 N ATOM 1804 CA GLU B 28 160.562 10.126 7.403 1.00 0.00 C ATOM 1805 C GLU B 28 160.201 11.439 6.694 1.00 0.00 C ATOM 1806 O GLU B 28 159.214 12.068 7.015 1.00 0.00 O ATOM 1807 CB GLU B 28 161.648 10.385 8.450 1.00 0.00 C ATOM 1808 CG GLU B 28 161.806 9.145 9.335 1.00 0.00 C ATOM 1809 CD GLU B 28 162.908 9.389 10.368 1.00 0.00 C ATOM 1810 OE1 GLU B 28 163.603 10.383 10.243 1.00 0.00 O ATOM 1811 OE2 GLU B 28 163.040 8.572 11.265 1.00 0.00 O ATOM 0 H GLU B 28 162.006 8.774 6.603 1.00 0.00 H new ATOM 0 HA GLU B 28 159.666 9.736 7.886 1.00 0.00 H new ATOM 0 HB2 GLU B 28 162.593 10.619 7.960 1.00 0.00 H new ATOM 0 HB3 GLU B 28 161.383 11.249 9.059 1.00 0.00 H new ATOM 0 HG2 GLU B 28 160.865 8.922 9.838 1.00 0.00 H new ATOM 0 HG3 GLU B 28 162.053 8.278 8.723 1.00 0.00 H new ATOM 1818 N VAL B 29 160.987 11.864 5.741 1.00 0.00 N ATOM 1819 CA VAL B 29 160.666 13.143 5.036 1.00 0.00 C ATOM 1820 C VAL B 29 159.376 12.981 4.228 1.00 0.00 C ATOM 1821 O VAL B 29 158.496 13.818 4.272 1.00 0.00 O ATOM 1822 CB VAL B 29 161.818 13.511 4.091 1.00 0.00 C ATOM 1823 CG1 VAL B 29 161.404 14.675 3.184 1.00 0.00 C ATOM 1824 CG2 VAL B 29 163.041 13.923 4.912 1.00 0.00 C ATOM 0 H VAL B 29 161.830 11.387 5.421 1.00 0.00 H new ATOM 0 HA VAL B 29 160.532 13.934 5.773 1.00 0.00 H new ATOM 0 HB VAL B 29 162.061 12.645 3.475 1.00 0.00 H new ATOM 0 HG11 VAL B 29 162.229 14.928 2.518 1.00 0.00 H new ATOM 0 HG12 VAL B 29 160.536 14.384 2.593 1.00 0.00 H new ATOM 0 HG13 VAL B 29 161.153 15.541 3.796 1.00 0.00 H new ATOM 0 HG21 VAL B 29 163.859 14.184 4.240 1.00 0.00 H new ATOM 0 HG22 VAL B 29 162.790 14.785 5.531 1.00 0.00 H new ATOM 0 HG23 VAL B 29 163.347 13.094 5.551 1.00 0.00 H new ATOM 1834 N LEU B 30 159.265 11.923 3.479 1.00 0.00 N ATOM 1835 CA LEU B 30 158.044 11.715 2.650 1.00 0.00 C ATOM 1836 C LEU B 30 156.833 11.507 3.559 1.00 0.00 C ATOM 1837 O LEU B 30 155.743 11.958 3.268 1.00 0.00 O ATOM 1838 CB LEU B 30 158.231 10.485 1.758 1.00 0.00 C ATOM 1839 CG LEU B 30 159.396 10.716 0.785 1.00 0.00 C ATOM 1840 CD1 LEU B 30 159.682 9.415 0.027 1.00 0.00 C ATOM 1841 CD2 LEU B 30 159.046 11.834 -0.217 1.00 0.00 C ATOM 0 H LEU B 30 159.969 11.189 3.403 1.00 0.00 H new ATOM 0 HA LEU B 30 157.880 12.594 2.026 1.00 0.00 H new ATOM 0 HB2 LEU B 30 158.428 9.606 2.372 1.00 0.00 H new ATOM 0 HB3 LEU B 30 157.315 10.286 1.201 1.00 0.00 H new ATOM 0 HG LEU B 30 160.278 11.019 1.349 1.00 0.00 H new ATOM 0 HD11 LEU B 30 160.509 9.572 -0.666 1.00 0.00 H new ATOM 0 HD12 LEU B 30 159.947 8.631 0.737 1.00 0.00 H new ATOM 0 HD13 LEU B 30 158.794 9.115 -0.529 1.00 0.00 H new ATOM 0 HD21 LEU B 30 159.882 11.986 -0.900 1.00 0.00 H new ATOM 0 HD22 LEU B 30 158.161 11.549 -0.785 1.00 0.00 H new ATOM 0 HD23 LEU B 30 158.848 12.759 0.325 1.00 0.00 H new ATOM 1853 N GLY B 31 157.016 10.828 4.654 1.00 0.00 N ATOM 1854 CA GLY B 31 155.873 10.594 5.577 1.00 0.00 C ATOM 1855 C GLY B 31 155.321 11.937 6.060 1.00 0.00 C ATOM 1856 O GLY B 31 154.126 12.117 6.187 1.00 0.00 O ATOM 0 H GLY B 31 157.905 10.425 4.950 1.00 0.00 H new ATOM 0 HA2 GLY B 31 155.091 10.030 5.068 1.00 0.00 H new ATOM 0 HA3 GLY B 31 156.196 9.995 6.428 1.00 0.00 H new ATOM 1860 N LYS B 32 156.183 12.879 6.344 1.00 0.00 N ATOM 1861 CA LYS B 32 155.705 14.205 6.834 1.00 0.00 C ATOM 1862 C LYS B 32 154.862 14.903 5.759 1.00 0.00 C ATOM 1863 O LYS B 32 153.868 15.535 6.060 1.00 0.00 O ATOM 1864 CB LYS B 32 156.906 15.084 7.193 1.00 0.00 C ATOM 1865 CG LYS B 32 156.408 16.440 7.699 1.00 0.00 C ATOM 1866 CD LYS B 32 157.564 17.215 8.344 1.00 0.00 C ATOM 1867 CE LYS B 32 158.627 17.550 7.293 1.00 0.00 C ATOM 1868 NZ LYS B 32 159.494 16.360 7.064 1.00 0.00 N ATOM 0 H LYS B 32 157.195 12.787 6.258 1.00 0.00 H new ATOM 0 HA LYS B 32 155.087 14.049 7.718 1.00 0.00 H new ATOM 0 HB2 LYS B 32 157.511 14.598 7.958 1.00 0.00 H new ATOM 0 HB3 LYS B 32 157.545 15.221 6.320 1.00 0.00 H new ATOM 0 HG2 LYS B 32 155.990 17.015 6.873 1.00 0.00 H new ATOM 0 HG3 LYS B 32 155.607 16.295 8.424 1.00 0.00 H new ATOM 0 HD2 LYS B 32 157.188 18.132 8.797 1.00 0.00 H new ATOM 0 HD3 LYS B 32 158.007 16.622 9.144 1.00 0.00 H new ATOM 0 HE2 LYS B 32 158.149 17.850 6.360 1.00 0.00 H new ATOM 0 HE3 LYS B 32 159.231 18.394 7.627 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 160.493 16.644 7.113 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 159.302 15.645 7.794 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 159.293 15.960 6.125 1.00 0.00 H new ATOM 1882 N LYS B 33 155.248 14.823 4.512 1.00 0.00 N ATOM 1883 CA LYS B 33 154.453 15.515 3.455 1.00 0.00 C ATOM 1884 C LYS B 33 153.076 14.855 3.317 1.00 0.00 C ATOM 1885 O LYS B 33 152.066 15.526 3.240 1.00 0.00 O ATOM 1886 CB LYS B 33 155.199 15.431 2.121 1.00 0.00 C ATOM 1887 CG LYS B 33 156.450 16.313 2.179 1.00 0.00 C ATOM 1888 CD LYS B 33 157.199 16.233 0.847 1.00 0.00 C ATOM 1889 CE LYS B 33 158.446 17.117 0.910 1.00 0.00 C ATOM 1890 NZ LYS B 33 159.271 16.899 -0.311 1.00 0.00 N ATOM 0 H LYS B 33 156.069 14.315 4.183 1.00 0.00 H new ATOM 0 HA LYS B 33 154.319 16.560 3.734 1.00 0.00 H new ATOM 0 HB2 LYS B 33 155.479 14.398 1.913 1.00 0.00 H new ATOM 0 HB3 LYS B 33 154.550 15.755 1.308 1.00 0.00 H new ATOM 0 HG2 LYS B 33 156.170 17.345 2.388 1.00 0.00 H new ATOM 0 HG3 LYS B 33 157.099 15.988 2.992 1.00 0.00 H new ATOM 0 HD2 LYS B 33 157.482 15.201 0.638 1.00 0.00 H new ATOM 0 HD3 LYS B 33 156.551 16.557 0.033 1.00 0.00 H new ATOM 0 HE2 LYS B 33 158.158 18.166 0.985 1.00 0.00 H new ATOM 0 HE3 LYS B 33 159.027 16.881 1.802 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 160.119 17.500 -0.269 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 159.556 15.900 -0.363 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 158.714 17.145 -1.154 1.00 0.00 H new ATOM 1904 N LEU B 34 153.020 13.553 3.304 1.00 0.00 N ATOM 1905 CA LEU B 34 151.698 12.870 3.194 1.00 0.00 C ATOM 1906 C LEU B 34 150.860 13.208 4.437 1.00 0.00 C ATOM 1907 O LEU B 34 149.667 13.427 4.364 1.00 0.00 O ATOM 1908 CB LEU B 34 151.904 11.354 3.094 1.00 0.00 C ATOM 1909 CG LEU B 34 152.551 10.988 1.748 1.00 0.00 C ATOM 1910 CD1 LEU B 34 152.983 9.519 1.784 1.00 0.00 C ATOM 1911 CD2 LEU B 34 151.549 11.191 0.592 1.00 0.00 C ATOM 0 H LEU B 34 153.828 12.933 3.364 1.00 0.00 H new ATOM 0 HA LEU B 34 151.178 13.211 2.299 1.00 0.00 H new ATOM 0 HB2 LEU B 34 152.536 11.012 3.913 1.00 0.00 H new ATOM 0 HB3 LEU B 34 150.946 10.843 3.195 1.00 0.00 H new ATOM 0 HG LEU B 34 153.414 11.634 1.584 1.00 0.00 H new ATOM 0 HD11 LEU B 34 153.443 9.252 0.833 1.00 0.00 H new ATOM 0 HD12 LEU B 34 153.703 9.371 2.589 1.00 0.00 H new ATOM 0 HD13 LEU B 34 152.111 8.888 1.956 1.00 0.00 H new ATOM 0 HD21 LEU B 34 152.025 10.927 -0.352 1.00 0.00 H new ATOM 0 HD22 LEU B 34 150.678 10.555 0.750 1.00 0.00 H new ATOM 0 HD23 LEU B 34 151.236 12.235 0.561 1.00 0.00 H new ATOM 1923 N GLU B 35 151.495 13.240 5.574 1.00 0.00 N ATOM 1924 CA GLU B 35 150.752 13.551 6.834 1.00 0.00 C ATOM 1925 C GLU B 35 150.113 14.941 6.735 1.00 0.00 C ATOM 1926 O GLU B 35 148.967 15.133 7.088 1.00 0.00 O ATOM 1927 CB GLU B 35 151.723 13.501 8.019 1.00 0.00 C ATOM 1928 CG GLU B 35 150.978 13.816 9.320 1.00 0.00 C ATOM 1929 CD GLU B 35 151.937 13.671 10.503 1.00 0.00 C ATOM 1930 OE1 GLU B 35 153.046 13.210 10.287 1.00 0.00 O ATOM 1931 OE2 GLU B 35 151.546 14.019 11.604 1.00 0.00 O ATOM 0 H GLU B 35 152.493 13.065 5.689 1.00 0.00 H new ATOM 0 HA GLU B 35 149.963 12.814 6.982 1.00 0.00 H new ATOM 0 HB2 GLU B 35 152.182 12.514 8.083 1.00 0.00 H new ATOM 0 HB3 GLU B 35 152.530 14.218 7.869 1.00 0.00 H new ATOM 0 HG2 GLU B 35 150.576 14.829 9.286 1.00 0.00 H new ATOM 0 HG3 GLU B 35 150.131 13.141 9.440 1.00 0.00 H new ATOM 1938 N GLU B 36 150.842 15.908 6.249 1.00 0.00 N ATOM 1939 CA GLU B 36 150.275 17.283 6.117 1.00 0.00 C ATOM 1940 C GLU B 36 149.149 17.254 5.082 1.00 0.00 C ATOM 1941 O GLU B 36 148.317 18.139 5.021 1.00 0.00 O ATOM 1942 CB GLU B 36 151.381 18.247 5.664 1.00 0.00 C ATOM 1943 CG GLU B 36 150.819 19.667 5.526 1.00 0.00 C ATOM 1944 CD GLU B 36 151.936 20.620 5.095 1.00 0.00 C ATOM 1945 OE1 GLU B 36 153.079 20.196 5.089 1.00 0.00 O ATOM 1946 OE2 GLU B 36 151.628 21.757 4.777 1.00 0.00 O ATOM 0 H GLU B 36 151.808 15.806 5.937 1.00 0.00 H new ATOM 0 HA GLU B 36 149.880 17.621 7.075 1.00 0.00 H new ATOM 0 HB2 GLU B 36 152.198 18.240 6.385 1.00 0.00 H new ATOM 0 HB3 GLU B 36 151.794 17.917 4.711 1.00 0.00 H new ATOM 0 HG2 GLU B 36 150.012 19.680 4.793 1.00 0.00 H new ATOM 0 HG3 GLU B 36 150.393 19.994 6.474 1.00 0.00 H new ATOM 1953 N ARG B 37 149.133 16.249 4.254 1.00 0.00 N ATOM 1954 CA ARG B 37 148.081 16.171 3.196 1.00 0.00 C ATOM 1955 C ARG B 37 146.843 15.438 3.729 1.00 0.00 C ATOM 1956 O ARG B 37 145.857 15.302 3.031 1.00 0.00 O ATOM 1957 CB ARG B 37 148.639 15.422 1.980 1.00 0.00 C ATOM 1958 CG ARG B 37 149.716 16.264 1.274 1.00 0.00 C ATOM 1959 CD ARG B 37 149.082 17.362 0.404 1.00 0.00 C ATOM 1960 NE ARG B 37 148.027 16.774 -0.470 1.00 0.00 N ATOM 1961 CZ ARG B 37 147.168 17.553 -1.068 1.00 0.00 C ATOM 1962 NH1 ARG B 37 147.249 18.848 -0.923 1.00 0.00 N ATOM 1963 NH2 ARG B 37 146.229 17.040 -1.814 1.00 0.00 N ATOM 0 H ARG B 37 149.800 15.478 4.261 1.00 0.00 H new ATOM 0 HA ARG B 37 147.792 17.181 2.906 1.00 0.00 H new ATOM 0 HB2 ARG B 37 149.064 14.469 2.296 1.00 0.00 H new ATOM 0 HB3 ARG B 37 147.832 15.196 1.283 1.00 0.00 H new ATOM 0 HG2 ARG B 37 150.371 16.718 2.017 1.00 0.00 H new ATOM 0 HG3 ARG B 37 150.337 15.618 0.654 1.00 0.00 H new ATOM 0 HD2 ARG B 37 148.650 18.136 1.038 1.00 0.00 H new ATOM 0 HD3 ARG B 37 149.847 17.840 -0.207 1.00 0.00 H new ATOM 0 HE ARG B 37 147.977 15.764 -0.600 1.00 0.00 H new ATOM 0 HH11 ARG B 37 147.984 19.251 -0.342 1.00 0.00 H new ATOM 0 HH12 ARG B 37 146.577 19.457 -1.391 1.00 0.00 H new ATOM 0 HH21 ARG B 37 146.166 16.029 -1.930 1.00 0.00 H new ATOM 0 HH22 ARG B 37 145.558 17.650 -2.281 1.00 0.00 H new ATOM 1977 N GLY B 38 146.861 15.002 4.969 1.00 0.00 N ATOM 1978 CA GLY B 38 145.652 14.321 5.552 1.00 0.00 C ATOM 1979 C GLY B 38 145.865 12.814 5.701 1.00 0.00 C ATOM 1980 O GLY B 38 144.961 12.099 6.089 1.00 0.00 O ATOM 0 H GLY B 38 147.656 15.087 5.602 1.00 0.00 H new ATOM 0 HA2 GLY B 38 145.426 14.754 6.526 1.00 0.00 H new ATOM 0 HA3 GLY B 38 144.788 14.504 4.913 1.00 0.00 H new ATOM 1984 N PHE B 39 147.036 12.313 5.406 1.00 0.00 N ATOM 1985 CA PHE B 39 147.287 10.842 5.544 1.00 0.00 C ATOM 1986 C PHE B 39 148.154 10.585 6.778 1.00 0.00 C ATOM 1987 O PHE B 39 149.335 10.318 6.680 1.00 0.00 O ATOM 1988 CB PHE B 39 148.017 10.344 4.303 1.00 0.00 C ATOM 1989 CG PHE B 39 147.143 10.557 3.093 1.00 0.00 C ATOM 1990 CD1 PHE B 39 146.230 9.572 2.704 1.00 0.00 C ATOM 1991 CD2 PHE B 39 147.233 11.751 2.372 1.00 0.00 C ATOM 1992 CE1 PHE B 39 145.407 9.780 1.590 1.00 0.00 C ATOM 1993 CE2 PHE B 39 146.410 11.963 1.261 1.00 0.00 C ATOM 1994 CZ PHE B 39 145.497 10.977 0.869 1.00 0.00 C ATOM 0 H PHE B 39 147.832 12.857 5.075 1.00 0.00 H new ATOM 0 HA PHE B 39 146.338 10.316 5.652 1.00 0.00 H new ATOM 0 HB2 PHE B 39 148.960 10.877 4.183 1.00 0.00 H new ATOM 0 HB3 PHE B 39 148.260 9.287 4.409 1.00 0.00 H new ATOM 0 HD1 PHE B 39 146.159 8.650 3.263 1.00 0.00 H new ATOM 0 HD2 PHE B 39 147.939 12.511 2.673 1.00 0.00 H new ATOM 0 HE1 PHE B 39 144.704 9.018 1.287 1.00 0.00 H new ATOM 0 HE2 PHE B 39 146.479 12.887 0.706 1.00 0.00 H new ATOM 0 HZ PHE B 39 144.862 11.139 0.011 1.00 0.00 H new ATOM 2004 N ASP B 40 147.567 10.670 7.942 1.00 0.00 N ATOM 2005 CA ASP B 40 148.353 10.437 9.188 1.00 0.00 C ATOM 2006 C ASP B 40 148.465 8.936 9.456 1.00 0.00 C ATOM 2007 O ASP B 40 149.247 8.505 10.280 1.00 0.00 O ATOM 2008 CB ASP B 40 147.643 11.109 10.365 1.00 0.00 C ATOM 2009 CG ASP B 40 146.244 10.512 10.522 1.00 0.00 C ATOM 2010 OD1 ASP B 40 145.793 9.855 9.598 1.00 0.00 O ATOM 2011 OD2 ASP B 40 145.644 10.726 11.563 1.00 0.00 O ATOM 0 H ASP B 40 146.581 10.890 8.084 1.00 0.00 H new ATOM 0 HA ASP B 40 149.352 10.857 9.069 1.00 0.00 H new ATOM 0 HB2 ASP B 40 148.217 10.965 11.280 1.00 0.00 H new ATOM 0 HB3 ASP B 40 147.575 12.184 10.197 1.00 0.00 H new ATOM 2016 N LYS B 41 147.686 8.134 8.770 1.00 0.00 N ATOM 2017 CA LYS B 41 147.736 6.650 8.981 1.00 0.00 C ATOM 2018 C LYS B 41 147.869 5.947 7.630 1.00 0.00 C ATOM 2019 O LYS B 41 147.442 6.444 6.607 1.00 0.00 O ATOM 2020 CB LYS B 41 146.449 6.185 9.672 1.00 0.00 C ATOM 2021 CG LYS B 41 146.313 6.856 11.046 1.00 0.00 C ATOM 2022 CD LYS B 41 147.226 6.170 12.072 1.00 0.00 C ATOM 2023 CE LYS B 41 146.902 6.698 13.470 1.00 0.00 C ATOM 2024 NZ LYS B 41 147.249 8.145 13.546 1.00 0.00 N ATOM 0 H LYS B 41 147.014 8.444 8.069 1.00 0.00 H new ATOM 0 HA LYS B 41 148.594 6.403 9.607 1.00 0.00 H new ATOM 0 HB2 LYS B 41 145.586 6.430 9.053 1.00 0.00 H new ATOM 0 HB3 LYS B 41 146.461 5.101 9.788 1.00 0.00 H new ATOM 0 HG2 LYS B 41 146.572 7.912 10.969 1.00 0.00 H new ATOM 0 HG3 LYS B 41 145.277 6.805 11.381 1.00 0.00 H new ATOM 0 HD2 LYS B 41 147.084 5.090 12.037 1.00 0.00 H new ATOM 0 HD3 LYS B 41 148.272 6.362 11.831 1.00 0.00 H new ATOM 0 HE2 LYS B 41 145.844 6.555 13.688 1.00 0.00 H new ATOM 0 HE3 LYS B 41 147.461 6.139 14.220 1.00 0.00 H new ATOM 0 HZ1 LYS B 41 147.240 8.452 14.540 1.00 0.00 H new ATOM 0 HZ2 LYS B 41 148.197 8.296 13.145 1.00 0.00 H new ATOM 0 HZ3 LYS B 41 146.553 8.698 13.007 1.00 0.00 H new ATOM 2038 N ALA B 42 148.477 4.795 7.628 1.00 0.00 N ATOM 2039 CA ALA B 42 148.670 4.038 6.360 1.00 0.00 C ATOM 2040 C ALA B 42 147.326 3.607 5.758 1.00 0.00 C ATOM 2041 O ALA B 42 147.156 3.618 4.554 1.00 0.00 O ATOM 2042 CB ALA B 42 149.515 2.796 6.641 1.00 0.00 C ATOM 0 H ALA B 42 148.853 4.340 8.460 1.00 0.00 H new ATOM 0 HA ALA B 42 149.173 4.689 5.645 1.00 0.00 H new ATOM 0 HB1 ALA B 42 149.660 2.238 5.716 1.00 0.00 H new ATOM 0 HB2 ALA B 42 150.484 3.098 7.038 1.00 0.00 H new ATOM 0 HB3 ALA B 42 149.005 2.166 7.369 1.00 0.00 H new ATOM 2048 N TYR B 43 146.380 3.192 6.562 1.00 0.00 N ATOM 2049 CA TYR B 43 145.082 2.723 5.992 1.00 0.00 C ATOM 2050 C TYR B 43 144.392 3.833 5.189 1.00 0.00 C ATOM 2051 O TYR B 43 143.573 3.556 4.336 1.00 0.00 O ATOM 2052 CB TYR B 43 144.157 2.202 7.101 1.00 0.00 C ATOM 2053 CG TYR B 43 143.742 3.312 8.039 1.00 0.00 C ATOM 2054 CD1 TYR B 43 142.730 4.202 7.664 1.00 0.00 C ATOM 2055 CD2 TYR B 43 144.346 3.430 9.296 1.00 0.00 C ATOM 2056 CE1 TYR B 43 142.323 5.214 8.543 1.00 0.00 C ATOM 2057 CE2 TYR B 43 143.943 4.442 10.175 1.00 0.00 C ATOM 2058 CZ TYR B 43 142.932 5.334 9.799 1.00 0.00 C ATOM 2059 OH TYR B 43 142.532 6.328 10.670 1.00 0.00 O ATOM 0 H TYR B 43 146.449 3.158 7.579 1.00 0.00 H new ATOM 0 HA TYR B 43 145.297 1.901 5.309 1.00 0.00 H new ATOM 0 HB2 TYR B 43 143.271 1.750 6.655 1.00 0.00 H new ATOM 0 HB3 TYR B 43 144.666 1.419 7.664 1.00 0.00 H new ATOM 0 HD1 TYR B 43 142.262 4.109 6.695 1.00 0.00 H new ATOM 0 HD2 TYR B 43 145.124 2.740 9.588 1.00 0.00 H new ATOM 0 HE1 TYR B 43 141.541 5.900 8.253 1.00 0.00 H new ATOM 0 HE2 TYR B 43 144.412 4.535 11.143 1.00 0.00 H new ATOM 0 HH TYR B 43 143.056 6.269 11.496 1.00 0.00 H new ATOM 2069 N VAL B 44 144.725 5.078 5.408 1.00 0.00 N ATOM 2070 CA VAL B 44 144.083 6.154 4.591 1.00 0.00 C ATOM 2071 C VAL B 44 144.785 6.170 3.230 1.00 0.00 C ATOM 2072 O VAL B 44 144.196 6.441 2.199 1.00 0.00 O ATOM 2073 CB VAL B 44 144.239 7.520 5.272 1.00 0.00 C ATOM 2074 CG1 VAL B 44 143.508 8.591 4.457 1.00 0.00 C ATOM 2075 CG2 VAL B 44 143.636 7.469 6.677 1.00 0.00 C ATOM 0 H VAL B 44 145.401 5.394 6.103 1.00 0.00 H new ATOM 0 HA VAL B 44 143.016 5.958 4.482 1.00 0.00 H new ATOM 0 HB VAL B 44 145.299 7.764 5.335 1.00 0.00 H new ATOM 0 HG11 VAL B 44 143.621 9.559 4.944 1.00 0.00 H new ATOM 0 HG12 VAL B 44 143.932 8.638 3.454 1.00 0.00 H new ATOM 0 HG13 VAL B 44 142.449 8.339 4.392 1.00 0.00 H new ATOM 0 HG21 VAL B 44 143.749 8.441 7.157 1.00 0.00 H new ATOM 0 HG22 VAL B 44 142.577 7.218 6.610 1.00 0.00 H new ATOM 0 HG23 VAL B 44 144.151 6.711 7.267 1.00 0.00 H new ATOM 2085 N VAL B 45 146.053 5.849 3.241 1.00 0.00 N ATOM 2086 CA VAL B 45 146.841 5.807 1.980 1.00 0.00 C ATOM 2087 C VAL B 45 146.447 4.537 1.234 1.00 0.00 C ATOM 2088 O VAL B 45 146.346 4.514 0.024 1.00 0.00 O ATOM 2089 CB VAL B 45 148.335 5.762 2.306 1.00 0.00 C ATOM 2090 CG1 VAL B 45 149.146 5.717 1.009 1.00 0.00 C ATOM 2091 CG2 VAL B 45 148.719 7.009 3.101 1.00 0.00 C ATOM 0 H VAL B 45 146.579 5.612 4.082 1.00 0.00 H new ATOM 0 HA VAL B 45 146.641 6.691 1.374 1.00 0.00 H new ATOM 0 HB VAL B 45 148.548 4.871 2.896 1.00 0.00 H new ATOM 0 HG11 VAL B 45 150.209 5.685 1.246 1.00 0.00 H new ATOM 0 HG12 VAL B 45 148.874 4.828 0.440 1.00 0.00 H new ATOM 0 HG13 VAL B 45 148.933 6.606 0.416 1.00 0.00 H new ATOM 0 HG21 VAL B 45 149.783 6.978 3.334 1.00 0.00 H new ATOM 0 HG22 VAL B 45 148.502 7.899 2.510 1.00 0.00 H new ATOM 0 HG23 VAL B 45 148.145 7.041 4.027 1.00 0.00 H new ATOM 2101 N LEU B 46 146.187 3.489 1.961 1.00 0.00 N ATOM 2102 CA LEU B 46 145.754 2.222 1.319 1.00 0.00 C ATOM 2103 C LEU B 46 144.461 2.519 0.560 1.00 0.00 C ATOM 2104 O LEU B 46 144.231 2.032 -0.529 1.00 0.00 O ATOM 2105 CB LEU B 46 145.486 1.172 2.407 1.00 0.00 C ATOM 2106 CG LEU B 46 145.052 -0.169 1.784 1.00 0.00 C ATOM 2107 CD1 LEU B 46 146.253 -0.853 1.108 1.00 0.00 C ATOM 2108 CD2 LEU B 46 144.462 -1.082 2.879 1.00 0.00 C ATOM 0 H LEU B 46 146.257 3.457 2.978 1.00 0.00 H new ATOM 0 HA LEU B 46 146.519 1.840 0.643 1.00 0.00 H new ATOM 0 HB2 LEU B 46 146.385 1.025 3.005 1.00 0.00 H new ATOM 0 HB3 LEU B 46 144.709 1.532 3.082 1.00 0.00 H new ATOM 0 HG LEU B 46 144.290 0.017 1.028 1.00 0.00 H new ATOM 0 HD11 LEU B 46 145.934 -1.800 0.671 1.00 0.00 H new ATOM 0 HD12 LEU B 46 146.646 -0.206 0.324 1.00 0.00 H new ATOM 0 HD13 LEU B 46 147.030 -1.039 1.849 1.00 0.00 H new ATOM 0 HD21 LEU B 46 144.156 -2.030 2.436 1.00 0.00 H new ATOM 0 HD22 LEU B 46 145.216 -1.266 3.645 1.00 0.00 H new ATOM 0 HD23 LEU B 46 143.597 -0.596 3.331 1.00 0.00 H new ATOM 2120 N GLY B 47 143.614 3.319 1.151 1.00 0.00 N ATOM 2121 CA GLY B 47 142.320 3.670 0.505 1.00 0.00 C ATOM 2122 C GLY B 47 142.568 4.273 -0.879 1.00 0.00 C ATOM 2123 O GLY B 47 141.907 3.927 -1.838 1.00 0.00 O ATOM 0 H GLY B 47 143.767 3.748 2.064 1.00 0.00 H new ATOM 0 HA2 GLY B 47 141.696 2.780 0.416 1.00 0.00 H new ATOM 0 HA3 GLY B 47 141.775 4.380 1.127 1.00 0.00 H new ATOM 2127 N GLN B 48 143.509 5.172 -1.000 1.00 0.00 N ATOM 2128 CA GLN B 48 143.779 5.778 -2.338 1.00 0.00 C ATOM 2129 C GLN B 48 144.183 4.673 -3.321 1.00 0.00 C ATOM 2130 O GLN B 48 143.728 4.633 -4.447 1.00 0.00 O ATOM 2131 CB GLN B 48 144.918 6.798 -2.219 1.00 0.00 C ATOM 2132 CG GLN B 48 145.100 7.536 -3.550 1.00 0.00 C ATOM 2133 CD GLN B 48 143.849 8.362 -3.858 1.00 0.00 C ATOM 2134 OE1 GLN B 48 143.376 9.106 -3.021 1.00 0.00 O ATOM 2135 NE2 GLN B 48 143.288 8.264 -5.033 1.00 0.00 N ATOM 0 H GLN B 48 144.097 5.511 -0.239 1.00 0.00 H new ATOM 0 HA GLN B 48 142.881 6.280 -2.699 1.00 0.00 H new ATOM 0 HB2 GLN B 48 144.697 7.511 -1.425 1.00 0.00 H new ATOM 0 HB3 GLN B 48 145.844 6.292 -1.944 1.00 0.00 H new ATOM 0 HG2 GLN B 48 145.973 8.186 -3.500 1.00 0.00 H new ATOM 0 HG3 GLN B 48 145.281 6.820 -4.352 1.00 0.00 H new ATOM 0 HE21 GLN B 48 143.683 7.640 -5.737 1.00 0.00 H new ATOM 0 HE22 GLN B 48 142.454 8.811 -5.247 1.00 0.00 H new ATOM 2144 N PHE B 49 145.027 3.773 -2.896 1.00 0.00 N ATOM 2145 CA PHE B 49 145.464 2.661 -3.791 1.00 0.00 C ATOM 2146 C PHE B 49 144.229 1.855 -4.202 1.00 0.00 C ATOM 2147 O PHE B 49 144.090 1.435 -5.334 1.00 0.00 O ATOM 2148 CB PHE B 49 146.450 1.769 -3.027 1.00 0.00 C ATOM 2149 CG PHE B 49 146.924 0.635 -3.907 1.00 0.00 C ATOM 2150 CD1 PHE B 49 147.726 0.908 -5.022 1.00 0.00 C ATOM 2151 CD2 PHE B 49 146.580 -0.689 -3.601 1.00 0.00 C ATOM 2152 CE1 PHE B 49 148.182 -0.140 -5.832 1.00 0.00 C ATOM 2153 CE2 PHE B 49 147.036 -1.736 -4.411 1.00 0.00 C ATOM 2154 CZ PHE B 49 147.837 -1.461 -5.526 1.00 0.00 C ATOM 0 H PHE B 49 145.436 3.759 -1.962 1.00 0.00 H new ATOM 0 HA PHE B 49 145.955 3.052 -4.683 1.00 0.00 H new ATOM 0 HB2 PHE B 49 147.303 2.361 -2.694 1.00 0.00 H new ATOM 0 HB3 PHE B 49 145.971 1.369 -2.133 1.00 0.00 H new ATOM 0 HD1 PHE B 49 147.993 1.928 -5.258 1.00 0.00 H new ATOM 0 HD2 PHE B 49 145.963 -0.901 -2.740 1.00 0.00 H new ATOM 0 HE1 PHE B 49 148.800 0.072 -6.692 1.00 0.00 H new ATOM 0 HE2 PHE B 49 146.770 -2.756 -4.176 1.00 0.00 H new ATOM 0 HZ PHE B 49 148.189 -2.269 -6.150 1.00 0.00 H new ATOM 2164 N LEU B 50 143.335 1.647 -3.285 1.00 0.00 N ATOM 2165 CA LEU B 50 142.102 0.876 -3.610 1.00 0.00 C ATOM 2166 C LEU B 50 141.239 1.707 -4.568 1.00 0.00 C ATOM 2167 O LEU B 50 140.638 1.188 -5.488 1.00 0.00 O ATOM 2168 CB LEU B 50 141.324 0.588 -2.318 1.00 0.00 C ATOM 2169 CG LEU B 50 142.140 -0.350 -1.410 1.00 0.00 C ATOM 2170 CD1 LEU B 50 141.473 -0.435 -0.032 1.00 0.00 C ATOM 2171 CD2 LEU B 50 142.223 -1.759 -2.027 1.00 0.00 C ATOM 0 H LEU B 50 143.401 1.976 -2.322 1.00 0.00 H new ATOM 0 HA LEU B 50 142.365 -0.071 -4.082 1.00 0.00 H new ATOM 0 HB2 LEU B 50 141.113 1.521 -1.795 1.00 0.00 H new ATOM 0 HB3 LEU B 50 140.363 0.132 -2.556 1.00 0.00 H new ATOM 0 HG LEU B 50 143.149 0.050 -1.309 1.00 0.00 H new ATOM 0 HD11 LEU B 50 142.050 -1.099 0.611 1.00 0.00 H new ATOM 0 HD12 LEU B 50 141.433 0.558 0.415 1.00 0.00 H new ATOM 0 HD13 LEU B 50 140.461 -0.825 -0.141 1.00 0.00 H new ATOM 0 HD21 LEU B 50 142.803 -2.409 -1.372 1.00 0.00 H new ATOM 0 HD22 LEU B 50 141.218 -2.165 -2.144 1.00 0.00 H new ATOM 0 HD23 LEU B 50 142.706 -1.701 -3.002 1.00 0.00 H new ATOM 2183 N VAL B 51 141.164 2.986 -4.346 1.00 0.00 N ATOM 2184 CA VAL B 51 140.333 3.865 -5.223 1.00 0.00 C ATOM 2185 C VAL B 51 140.923 3.928 -6.644 1.00 0.00 C ATOM 2186 O VAL B 51 140.222 4.196 -7.600 1.00 0.00 O ATOM 2187 CB VAL B 51 140.280 5.274 -4.616 1.00 0.00 C ATOM 2188 CG1 VAL B 51 139.651 6.258 -5.607 1.00 0.00 C ATOM 2189 CG2 VAL B 51 139.433 5.238 -3.342 1.00 0.00 C ATOM 0 H VAL B 51 141.646 3.469 -3.588 1.00 0.00 H new ATOM 0 HA VAL B 51 139.326 3.453 -5.289 1.00 0.00 H new ATOM 0 HB VAL B 51 141.294 5.600 -4.387 1.00 0.00 H new ATOM 0 HG11 VAL B 51 139.620 7.253 -5.162 1.00 0.00 H new ATOM 0 HG12 VAL B 51 140.247 6.287 -6.519 1.00 0.00 H new ATOM 0 HG13 VAL B 51 138.637 5.936 -5.846 1.00 0.00 H new ATOM 0 HG21 VAL B 51 139.391 6.236 -2.905 1.00 0.00 H new ATOM 0 HG22 VAL B 51 138.424 4.905 -3.585 1.00 0.00 H new ATOM 0 HG23 VAL B 51 139.880 4.547 -2.627 1.00 0.00 H new ATOM 2199 N LEU B 52 142.202 3.704 -6.791 1.00 0.00 N ATOM 2200 CA LEU B 52 142.826 3.780 -8.155 1.00 0.00 C ATOM 2201 C LEU B 52 142.784 2.412 -8.848 1.00 0.00 C ATOM 2202 O LEU B 52 143.457 2.196 -9.837 1.00 0.00 O ATOM 2203 CB LEU B 52 144.282 4.236 -8.029 1.00 0.00 C ATOM 2204 CG LEU B 52 144.341 5.709 -7.592 1.00 0.00 C ATOM 2205 CD1 LEU B 52 145.800 6.083 -7.316 1.00 0.00 C ATOM 2206 CD2 LEU B 52 143.764 6.625 -8.696 1.00 0.00 C ATOM 0 H LEU B 52 142.843 3.472 -6.032 1.00 0.00 H new ATOM 0 HA LEU B 52 142.262 4.496 -8.753 1.00 0.00 H new ATOM 0 HB2 LEU B 52 144.804 3.613 -7.303 1.00 0.00 H new ATOM 0 HB3 LEU B 52 144.794 4.111 -8.983 1.00 0.00 H new ATOM 0 HG LEU B 52 143.744 5.843 -6.690 1.00 0.00 H new ATOM 0 HD11 LEU B 52 145.856 7.126 -7.005 1.00 0.00 H new ATOM 0 HD12 LEU B 52 146.195 5.447 -6.524 1.00 0.00 H new ATOM 0 HD13 LEU B 52 146.389 5.943 -8.222 1.00 0.00 H new ATOM 0 HD21 LEU B 52 143.814 7.664 -8.370 1.00 0.00 H new ATOM 0 HD22 LEU B 52 144.345 6.504 -9.610 1.00 0.00 H new ATOM 0 HD23 LEU B 52 142.726 6.354 -8.888 1.00 0.00 H new ATOM 2218 N LYS B 53 141.999 1.495 -8.363 1.00 0.00 N ATOM 2219 CA LYS B 53 141.919 0.158 -9.025 1.00 0.00 C ATOM 2220 C LYS B 53 143.324 -0.416 -9.259 1.00 0.00 C ATOM 2221 O LYS B 53 143.572 -1.068 -10.253 1.00 0.00 O ATOM 2222 CB LYS B 53 141.204 0.309 -10.370 1.00 0.00 C ATOM 2223 CG LYS B 53 139.785 0.834 -10.134 1.00 0.00 C ATOM 2224 CD LYS B 53 139.060 0.988 -11.472 1.00 0.00 C ATOM 2225 CE LYS B 53 137.645 1.514 -11.222 1.00 0.00 C ATOM 2226 NZ LYS B 53 137.721 2.850 -10.565 1.00 0.00 N ATOM 0 H LYS B 53 141.409 1.609 -7.539 1.00 0.00 H new ATOM 0 HA LYS B 53 141.367 -0.524 -8.378 1.00 0.00 H new ATOM 0 HB2 LYS B 53 141.755 0.995 -11.013 1.00 0.00 H new ATOM 0 HB3 LYS B 53 141.168 -0.651 -10.885 1.00 0.00 H new ATOM 0 HG2 LYS B 53 139.236 0.148 -9.489 1.00 0.00 H new ATOM 0 HG3 LYS B 53 139.824 1.794 -9.618 1.00 0.00 H new ATOM 0 HD2 LYS B 53 139.607 1.675 -12.118 1.00 0.00 H new ATOM 0 HD3 LYS B 53 139.018 0.029 -11.989 1.00 0.00 H new ATOM 0 HE2 LYS B 53 137.102 1.590 -12.164 1.00 0.00 H new ATOM 0 HE3 LYS B 53 137.093 0.817 -10.591 1.00 0.00 H new ATOM 0 HZ1 LYS B 53 136.840 3.373 -10.740 1.00 0.00 H new ATOM 0 HZ2 LYS B 53 137.853 2.726 -9.541 1.00 0.00 H new ATOM 0 HZ3 LYS B 53 138.524 3.384 -10.955 1.00 0.00 H new ATOM 2240 N LYS B 54 144.236 -0.189 -8.342 1.00 0.00 N ATOM 2241 CA LYS B 54 145.632 -0.726 -8.464 1.00 0.00 C ATOM 2242 C LYS B 54 146.309 -0.192 -9.733 1.00 0.00 C ATOM 2243 O LYS B 54 147.283 -0.757 -10.194 1.00 0.00 O ATOM 2244 CB LYS B 54 145.603 -2.262 -8.521 1.00 0.00 C ATOM 2245 CG LYS B 54 144.962 -2.818 -7.245 1.00 0.00 C ATOM 2246 CD LYS B 54 144.942 -4.348 -7.312 1.00 0.00 C ATOM 2247 CE LYS B 54 144.266 -4.913 -6.060 1.00 0.00 C ATOM 2248 NZ LYS B 54 145.061 -4.550 -4.851 1.00 0.00 N ATOM 0 H LYS B 54 144.068 0.357 -7.497 1.00 0.00 H new ATOM 0 HA LYS B 54 146.198 -0.399 -7.592 1.00 0.00 H new ATOM 0 HB2 LYS B 54 145.041 -2.592 -9.395 1.00 0.00 H new ATOM 0 HB3 LYS B 54 146.616 -2.650 -8.629 1.00 0.00 H new ATOM 0 HG2 LYS B 54 145.522 -2.488 -6.370 1.00 0.00 H new ATOM 0 HG3 LYS B 54 143.948 -2.434 -7.137 1.00 0.00 H new ATOM 0 HD2 LYS B 54 144.408 -4.675 -8.204 1.00 0.00 H new ATOM 0 HD3 LYS B 54 145.959 -4.731 -7.391 1.00 0.00 H new ATOM 0 HE2 LYS B 54 143.253 -4.519 -5.973 1.00 0.00 H new ATOM 0 HE3 LYS B 54 144.181 -5.997 -6.139 1.00 0.00 H new ATOM 0 HZ1 LYS B 54 144.646 -5.006 -4.013 1.00 0.00 H new ATOM 0 HZ2 LYS B 54 146.042 -4.873 -4.971 1.00 0.00 H new ATOM 0 HZ3 LYS B 54 145.049 -3.518 -4.725 1.00 0.00 H new ATOM 2262 N ASP B 55 145.841 0.886 -10.301 1.00 0.00 N ATOM 2263 CA ASP B 55 146.527 1.409 -11.523 1.00 0.00 C ATOM 2264 C ASP B 55 147.916 1.921 -11.113 1.00 0.00 C ATOM 2265 O ASP B 55 148.048 2.862 -10.355 1.00 0.00 O ATOM 2266 CB ASP B 55 145.699 2.542 -12.136 1.00 0.00 C ATOM 2267 CG ASP B 55 144.509 1.950 -12.898 1.00 0.00 C ATOM 2268 OD1 ASP B 55 144.678 0.903 -13.501 1.00 0.00 O ATOM 2269 OD2 ASP B 55 143.450 2.551 -12.862 1.00 0.00 O ATOM 0 H ASP B 55 145.032 1.419 -9.983 1.00 0.00 H new ATOM 0 HA ASP B 55 146.631 0.620 -12.268 1.00 0.00 H new ATOM 0 HB2 ASP B 55 145.346 3.213 -11.353 1.00 0.00 H new ATOM 0 HB3 ASP B 55 146.317 3.135 -12.810 1.00 0.00 H new ATOM 2274 N GLU B 56 148.948 1.272 -11.585 1.00 0.00 N ATOM 2275 CA GLU B 56 150.346 1.657 -11.215 1.00 0.00 C ATOM 2276 C GLU B 56 150.739 3.050 -11.736 1.00 0.00 C ATOM 2277 O GLU B 56 151.382 3.812 -11.048 1.00 0.00 O ATOM 2278 CB GLU B 56 151.295 0.610 -11.799 1.00 0.00 C ATOM 2279 CG GLU B 56 152.713 0.839 -11.277 1.00 0.00 C ATOM 2280 CD GLU B 56 153.623 -0.274 -11.797 1.00 0.00 C ATOM 2281 OE1 GLU B 56 153.106 -1.199 -12.402 1.00 0.00 O ATOM 2282 OE2 GLU B 56 154.820 -0.185 -11.581 1.00 0.00 O ATOM 0 H GLU B 56 148.882 0.478 -12.222 1.00 0.00 H new ATOM 0 HA GLU B 56 150.411 1.698 -10.128 1.00 0.00 H new ATOM 0 HB2 GLU B 56 150.957 -0.390 -11.529 1.00 0.00 H new ATOM 0 HB3 GLU B 56 151.286 0.666 -12.888 1.00 0.00 H new ATOM 0 HG2 GLU B 56 153.082 1.811 -11.605 1.00 0.00 H new ATOM 0 HG3 GLU B 56 152.716 0.848 -10.187 1.00 0.00 H new ATOM 2289 N ASP B 57 150.370 3.393 -12.940 1.00 0.00 N ATOM 2290 CA ASP B 57 150.749 4.738 -13.481 1.00 0.00 C ATOM 2291 C ASP B 57 149.977 5.831 -12.744 1.00 0.00 C ATOM 2292 O ASP B 57 150.507 6.881 -12.438 1.00 0.00 O ATOM 2293 CB ASP B 57 150.431 4.802 -14.978 1.00 0.00 C ATOM 2294 CG ASP B 57 151.400 3.897 -15.742 1.00 0.00 C ATOM 2295 OD1 ASP B 57 152.454 3.602 -15.203 1.00 0.00 O ATOM 2296 OD2 ASP B 57 151.072 3.516 -16.854 1.00 0.00 O ATOM 0 H ASP B 57 149.825 2.807 -13.573 1.00 0.00 H new ATOM 0 HA ASP B 57 151.818 4.893 -13.333 1.00 0.00 H new ATOM 0 HB2 ASP B 57 149.403 4.486 -15.157 1.00 0.00 H new ATOM 0 HB3 ASP B 57 150.516 5.828 -15.336 1.00 0.00 H new ATOM 2301 N LEU B 58 148.742 5.592 -12.451 1.00 0.00 N ATOM 2302 CA LEU B 58 147.959 6.625 -11.724 1.00 0.00 C ATOM 2303 C LEU B 58 148.479 6.731 -10.287 1.00 0.00 C ATOM 2304 O LEU B 58 148.594 7.809 -9.740 1.00 0.00 O ATOM 2305 CB LEU B 58 146.471 6.260 -11.718 1.00 0.00 C ATOM 2306 CG LEU B 58 145.931 6.218 -13.158 1.00 0.00 C ATOM 2307 CD1 LEU B 58 144.462 5.786 -13.128 1.00 0.00 C ATOM 2308 CD2 LEU B 58 146.048 7.610 -13.813 1.00 0.00 C ATOM 0 H LEU B 58 148.238 4.735 -12.678 1.00 0.00 H new ATOM 0 HA LEU B 58 148.076 7.585 -12.227 1.00 0.00 H new ATOM 0 HB2 LEU B 58 146.328 5.291 -11.239 1.00 0.00 H new ATOM 0 HB3 LEU B 58 145.912 6.990 -11.133 1.00 0.00 H new ATOM 0 HG LEU B 58 146.516 5.507 -13.741 1.00 0.00 H new ATOM 0 HD11 LEU B 58 144.071 5.754 -14.145 1.00 0.00 H new ATOM 0 HD12 LEU B 58 144.383 4.797 -12.677 1.00 0.00 H new ATOM 0 HD13 LEU B 58 143.885 6.500 -12.540 1.00 0.00 H new ATOM 0 HD21 LEU B 58 145.662 7.566 -14.832 1.00 0.00 H new ATOM 0 HD22 LEU B 58 145.470 8.333 -13.237 1.00 0.00 H new ATOM 0 HD23 LEU B 58 147.094 7.916 -13.834 1.00 0.00 H new ATOM 2320 N PHE B 59 148.820 5.625 -9.678 1.00 0.00 N ATOM 2321 CA PHE B 59 149.359 5.679 -8.287 1.00 0.00 C ATOM 2322 C PHE B 59 150.684 6.448 -8.273 1.00 0.00 C ATOM 2323 O PHE B 59 150.915 7.293 -7.431 1.00 0.00 O ATOM 2324 CB PHE B 59 149.590 4.262 -7.756 1.00 0.00 C ATOM 2325 CG PHE B 59 150.136 4.343 -6.346 1.00 0.00 C ATOM 2326 CD1 PHE B 59 149.337 4.861 -5.317 1.00 0.00 C ATOM 2327 CD2 PHE B 59 151.437 3.901 -6.063 1.00 0.00 C ATOM 2328 CE1 PHE B 59 149.837 4.936 -4.011 1.00 0.00 C ATOM 2329 CE2 PHE B 59 151.935 3.976 -4.757 1.00 0.00 C ATOM 2330 CZ PHE B 59 151.135 4.494 -3.730 1.00 0.00 C ATOM 0 H PHE B 59 148.749 4.691 -10.082 1.00 0.00 H new ATOM 0 HA PHE B 59 148.635 6.188 -7.650 1.00 0.00 H new ATOM 0 HB2 PHE B 59 148.656 3.700 -7.766 1.00 0.00 H new ATOM 0 HB3 PHE B 59 150.289 3.729 -8.400 1.00 0.00 H new ATOM 0 HD1 PHE B 59 148.335 5.202 -5.532 1.00 0.00 H new ATOM 0 HD2 PHE B 59 152.055 3.502 -6.854 1.00 0.00 H new ATOM 0 HE1 PHE B 59 149.220 5.335 -3.220 1.00 0.00 H new ATOM 0 HE2 PHE B 59 152.936 3.634 -4.541 1.00 0.00 H new ATOM 0 HZ PHE B 59 151.520 4.552 -2.722 1.00 0.00 H new ATOM 2340 N ARG B 60 151.566 6.137 -9.189 1.00 0.00 N ATOM 2341 CA ARG B 60 152.890 6.823 -9.219 1.00 0.00 C ATOM 2342 C ARG B 60 152.723 8.331 -9.404 1.00 0.00 C ATOM 2343 O ARG B 60 153.334 9.115 -8.707 1.00 0.00 O ATOM 2344 CB ARG B 60 153.730 6.271 -10.375 1.00 0.00 C ATOM 2345 CG ARG B 60 154.159 4.835 -10.072 1.00 0.00 C ATOM 2346 CD ARG B 60 154.829 4.232 -11.309 1.00 0.00 C ATOM 2347 NE ARG B 60 155.943 5.117 -11.753 1.00 0.00 N ATOM 2348 CZ ARG B 60 156.841 4.669 -12.589 1.00 0.00 C ATOM 2349 NH1 ARG B 60 156.789 3.432 -13.003 1.00 0.00 N ATOM 2350 NH2 ARG B 60 157.794 5.456 -13.006 1.00 0.00 N ATOM 0 H ARG B 60 151.425 5.437 -9.917 1.00 0.00 H new ATOM 0 HA ARG B 60 153.389 6.638 -8.268 1.00 0.00 H new ATOM 0 HB2 ARG B 60 153.154 6.299 -11.300 1.00 0.00 H new ATOM 0 HB3 ARG B 60 154.609 6.897 -10.528 1.00 0.00 H new ATOM 0 HG2 ARG B 60 154.849 4.820 -9.228 1.00 0.00 H new ATOM 0 HG3 ARG B 60 153.293 4.238 -9.787 1.00 0.00 H new ATOM 0 HD2 ARG B 60 155.210 3.237 -11.080 1.00 0.00 H new ATOM 0 HD3 ARG B 60 154.100 4.117 -12.111 1.00 0.00 H new ATOM 0 HE ARG B 60 156.004 6.073 -11.404 1.00 0.00 H new ATOM 0 HH11 ARG B 60 156.047 2.815 -12.674 1.00 0.00 H new ATOM 0 HH12 ARG B 60 157.491 3.083 -13.656 1.00 0.00 H new ATOM 0 HH21 ARG B 60 157.838 6.421 -12.679 1.00 0.00 H new ATOM 0 HH22 ARG B 60 158.495 5.106 -13.659 1.00 0.00 H new ATOM 2364 N GLU B 61 151.906 8.756 -10.327 1.00 0.00 N ATOM 2365 CA GLU B 61 151.723 10.220 -10.524 1.00 0.00 C ATOM 2366 C GLU B 61 151.114 10.815 -9.254 1.00 0.00 C ATOM 2367 O GLU B 61 151.452 11.908 -8.846 1.00 0.00 O ATOM 2368 CB GLU B 61 150.786 10.464 -11.710 1.00 0.00 C ATOM 2369 CG GLU B 61 150.728 11.962 -12.025 1.00 0.00 C ATOM 2370 CD GLU B 61 152.085 12.426 -12.558 1.00 0.00 C ATOM 2371 OE1 GLU B 61 152.845 11.581 -13.001 1.00 0.00 O ATOM 2372 OE2 GLU B 61 152.342 13.618 -12.510 1.00 0.00 O ATOM 0 H GLU B 61 151.361 8.158 -10.949 1.00 0.00 H new ATOM 0 HA GLU B 61 152.684 10.691 -10.728 1.00 0.00 H new ATOM 0 HB2 GLU B 61 151.137 9.913 -12.582 1.00 0.00 H new ATOM 0 HB3 GLU B 61 149.788 10.093 -11.479 1.00 0.00 H new ATOM 0 HG2 GLU B 61 149.949 12.159 -12.762 1.00 0.00 H new ATOM 0 HG3 GLU B 61 150.467 12.523 -11.128 1.00 0.00 H new ATOM 2379 N TRP B 62 150.219 10.107 -8.631 1.00 0.00 N ATOM 2380 CA TRP B 62 149.588 10.635 -7.389 1.00 0.00 C ATOM 2381 C TRP B 62 150.636 10.855 -6.294 1.00 0.00 C ATOM 2382 O TRP B 62 150.682 11.893 -5.669 1.00 0.00 O ATOM 2383 CB TRP B 62 148.536 9.637 -6.879 1.00 0.00 C ATOM 2384 CG TRP B 62 148.076 10.045 -5.509 1.00 0.00 C ATOM 2385 CD1 TRP B 62 147.127 10.975 -5.247 1.00 0.00 C ATOM 2386 CD2 TRP B 62 148.550 9.568 -4.214 1.00 0.00 C ATOM 2387 NE1 TRP B 62 146.982 11.091 -3.875 1.00 0.00 N ATOM 2388 CE2 TRP B 62 147.838 10.245 -3.195 1.00 0.00 C ATOM 2389 CE3 TRP B 62 149.517 8.619 -3.827 1.00 0.00 C ATOM 2390 CZ2 TRP B 62 148.076 9.991 -1.841 1.00 0.00 C ATOM 2391 CZ3 TRP B 62 149.758 8.362 -2.467 1.00 0.00 C ATOM 2392 CH2 TRP B 62 149.039 9.046 -1.477 1.00 0.00 C ATOM 0 H TRP B 62 149.895 9.186 -8.926 1.00 0.00 H new ATOM 0 HA TRP B 62 149.118 11.590 -7.625 1.00 0.00 H new ATOM 0 HB2 TRP B 62 147.688 9.605 -7.564 1.00 0.00 H new ATOM 0 HB3 TRP B 62 148.958 8.633 -6.848 1.00 0.00 H new ATOM 0 HD1 TRP B 62 146.574 11.534 -5.987 1.00 0.00 H new ATOM 0 HE1 TRP B 62 146.323 11.724 -3.421 1.00 0.00 H new ATOM 0 HE3 TRP B 62 150.077 8.086 -4.581 1.00 0.00 H new ATOM 0 HZ2 TRP B 62 147.520 10.521 -1.082 1.00 0.00 H new ATOM 0 HZ3 TRP B 62 150.502 7.633 -2.182 1.00 0.00 H new ATOM 0 HH2 TRP B 62 149.229 8.843 -0.433 1.00 0.00 H new ATOM 2403 N LEU B 63 151.465 9.884 -6.044 1.00 0.00 N ATOM 2404 CA LEU B 63 152.485 10.044 -4.972 1.00 0.00 C ATOM 2405 C LEU B 63 153.519 11.096 -5.383 1.00 0.00 C ATOM 2406 O LEU B 63 153.837 11.993 -4.628 1.00 0.00 O ATOM 2407 CB LEU B 63 153.177 8.694 -4.732 1.00 0.00 C ATOM 2408 CG LEU B 63 154.233 8.818 -3.623 1.00 0.00 C ATOM 2409 CD1 LEU B 63 153.563 9.188 -2.290 1.00 0.00 C ATOM 2410 CD2 LEU B 63 154.964 7.478 -3.477 1.00 0.00 C ATOM 0 H LEU B 63 151.482 8.989 -6.533 1.00 0.00 H new ATOM 0 HA LEU B 63 151.999 10.374 -4.054 1.00 0.00 H new ATOM 0 HB2 LEU B 63 152.437 7.944 -4.454 1.00 0.00 H new ATOM 0 HB3 LEU B 63 153.648 8.352 -5.653 1.00 0.00 H new ATOM 0 HG LEU B 63 154.943 9.602 -3.887 1.00 0.00 H new ATOM 0 HD11 LEU B 63 154.322 9.273 -1.512 1.00 0.00 H new ATOM 0 HD12 LEU B 63 153.044 10.141 -2.396 1.00 0.00 H new ATOM 0 HD13 LEU B 63 152.847 8.413 -2.015 1.00 0.00 H new ATOM 0 HD21 LEU B 63 155.716 7.557 -2.692 1.00 0.00 H new ATOM 0 HD22 LEU B 63 154.247 6.699 -3.216 1.00 0.00 H new ATOM 0 HD23 LEU B 63 155.449 7.224 -4.419 1.00 0.00 H new ATOM 2422 N LYS B 64 154.047 10.991 -6.569 1.00 0.00 N ATOM 2423 CA LYS B 64 155.062 11.984 -7.025 1.00 0.00 C ATOM 2424 C LYS B 64 154.440 13.379 -7.047 1.00 0.00 C ATOM 2425 O LYS B 64 155.006 14.337 -6.560 1.00 0.00 O ATOM 2426 CB LYS B 64 155.553 11.621 -8.427 1.00 0.00 C ATOM 2427 CG LYS B 64 156.686 12.569 -8.832 1.00 0.00 C ATOM 2428 CD LYS B 64 157.179 12.208 -10.233 1.00 0.00 C ATOM 2429 CE LYS B 64 158.329 13.137 -10.623 1.00 0.00 C ATOM 2430 NZ LYS B 64 159.011 12.601 -11.836 1.00 0.00 N ATOM 0 H LYS B 64 153.821 10.261 -7.244 1.00 0.00 H new ATOM 0 HA LYS B 64 155.907 11.973 -6.336 1.00 0.00 H new ATOM 0 HB2 LYS B 64 155.904 10.589 -8.445 1.00 0.00 H new ATOM 0 HB3 LYS B 64 154.732 11.692 -9.141 1.00 0.00 H new ATOM 0 HG2 LYS B 64 156.335 13.601 -8.813 1.00 0.00 H new ATOM 0 HG3 LYS B 64 157.506 12.498 -8.117 1.00 0.00 H new ATOM 0 HD2 LYS B 64 157.511 11.170 -10.257 1.00 0.00 H new ATOM 0 HD3 LYS B 64 156.364 12.299 -10.952 1.00 0.00 H new ATOM 0 HE2 LYS B 64 157.950 14.140 -10.819 1.00 0.00 H new ATOM 0 HE3 LYS B 64 159.039 13.220 -9.800 1.00 0.00 H new ATOM 0 HZ1 LYS B 64 159.793 13.232 -12.102 1.00 0.00 H new ATOM 0 HZ2 LYS B 64 159.385 11.652 -11.633 1.00 0.00 H new ATOM 0 HZ3 LYS B 64 158.330 12.544 -12.620 1.00 0.00 H new ATOM 2444 N ASP B 65 153.273 13.492 -7.616 1.00 0.00 N ATOM 2445 CA ASP B 65 152.591 14.811 -7.688 1.00 0.00 C ATOM 2446 C ASP B 65 152.169 15.249 -6.287 1.00 0.00 C ATOM 2447 O ASP B 65 152.080 16.424 -5.993 1.00 0.00 O ATOM 2448 CB ASP B 65 151.356 14.696 -8.583 1.00 0.00 C ATOM 2449 CG ASP B 65 150.734 16.080 -8.776 1.00 0.00 C ATOM 2450 OD1 ASP B 65 150.176 16.596 -7.821 1.00 0.00 O ATOM 2451 OD2 ASP B 65 150.826 16.601 -9.876 1.00 0.00 O ATOM 0 H ASP B 65 152.759 12.719 -8.038 1.00 0.00 H new ATOM 0 HA ASP B 65 153.275 15.550 -8.105 1.00 0.00 H new ATOM 0 HB2 ASP B 65 151.632 14.272 -9.548 1.00 0.00 H new ATOM 0 HB3 ASP B 65 150.630 14.019 -8.133 1.00 0.00 H new ATOM 2456 N THR B 66 151.874 14.313 -5.426 1.00 0.00 N ATOM 2457 CA THR B 66 151.419 14.675 -4.056 1.00 0.00 C ATOM 2458 C THR B 66 152.603 15.057 -3.161 1.00 0.00 C ATOM 2459 O THR B 66 152.453 15.884 -2.282 1.00 0.00 O ATOM 2460 CB THR B 66 150.674 13.491 -3.433 1.00 0.00 C ATOM 2461 OG1 THR B 66 149.490 13.237 -4.177 1.00 0.00 O ATOM 2462 CG2 THR B 66 150.299 13.819 -1.986 1.00 0.00 C ATOM 0 H THR B 66 151.929 13.312 -5.614 1.00 0.00 H new ATOM 0 HA THR B 66 150.755 15.536 -4.135 1.00 0.00 H new ATOM 0 HB THR B 66 151.317 12.611 -3.450 1.00 0.00 H new ATOM 0 HG1 THR B 66 149.648 12.497 -4.800 1.00 0.00 H new ATOM 0 HG21 THR B 66 149.769 12.974 -1.547 1.00 0.00 H new ATOM 0 HG22 THR B 66 151.204 14.018 -1.412 1.00 0.00 H new ATOM 0 HG23 THR B 66 149.656 14.699 -1.967 1.00 0.00 H new ATOM 2470 N CYS B 67 153.764 14.456 -3.328 1.00 0.00 N ATOM 2471 CA CYS B 67 154.918 14.791 -2.425 1.00 0.00 C ATOM 2472 C CYS B 67 156.212 15.040 -3.205 1.00 0.00 C ATOM 2473 O CYS B 67 157.063 15.792 -2.774 1.00 0.00 O ATOM 2474 CB CYS B 67 155.142 13.624 -1.463 1.00 0.00 C ATOM 2475 SG CYS B 67 155.724 12.182 -2.390 1.00 0.00 S ATOM 0 H CYS B 67 153.960 13.755 -4.043 1.00 0.00 H new ATOM 0 HA CYS B 67 154.669 15.707 -1.890 1.00 0.00 H new ATOM 0 HB2 CYS B 67 155.873 13.900 -0.703 1.00 0.00 H new ATOM 0 HB3 CYS B 67 154.215 13.385 -0.942 1.00 0.00 H new ATOM 0 HG CYS B 67 155.174 12.173 -3.568 1.00 0.00 H new ATOM 2481 N GLY B 68 156.384 14.402 -4.339 1.00 0.00 N ATOM 2482 CA GLY B 68 157.640 14.589 -5.139 1.00 0.00 C ATOM 2483 C GLY B 68 158.498 13.325 -5.021 1.00 0.00 C ATOM 2484 O GLY B 68 159.671 13.329 -5.339 1.00 0.00 O ATOM 0 H GLY B 68 155.707 13.757 -4.747 1.00 0.00 H new ATOM 0 HA2 GLY B 68 157.396 14.782 -6.184 1.00 0.00 H new ATOM 0 HA3 GLY B 68 158.193 15.455 -4.775 1.00 0.00 H new ATOM 2488 N ALA B 69 157.923 12.241 -4.572 1.00 0.00 N ATOM 2489 CA ALA B 69 158.708 10.978 -4.440 1.00 0.00 C ATOM 2490 C ALA B 69 159.406 10.677 -5.767 1.00 0.00 C ATOM 2491 O ALA B 69 158.965 11.098 -6.818 1.00 0.00 O ATOM 2492 CB ALA B 69 157.765 9.825 -4.088 1.00 0.00 C ATOM 0 H ALA B 69 156.945 12.175 -4.291 1.00 0.00 H new ATOM 0 HA ALA B 69 159.452 11.091 -3.652 1.00 0.00 H new ATOM 0 HB1 ALA B 69 158.338 8.903 -3.992 1.00 0.00 H new ATOM 0 HB2 ALA B 69 157.263 10.041 -3.145 1.00 0.00 H new ATOM 0 HB3 ALA B 69 157.021 9.709 -4.877 1.00 0.00 H new ATOM 2498 N ASN B 70 160.498 9.959 -5.735 1.00 0.00 N ATOM 2499 CA ASN B 70 161.224 9.647 -7.002 1.00 0.00 C ATOM 2500 C ASN B 70 160.713 8.330 -7.588 1.00 0.00 C ATOM 2501 O ASN B 70 159.937 7.620 -6.979 1.00 0.00 O ATOM 2502 CB ASN B 70 162.722 9.531 -6.714 1.00 0.00 C ATOM 2503 CG ASN B 70 163.235 10.863 -6.167 1.00 0.00 C ATOM 2504 OD1 ASN B 70 163.992 10.893 -5.217 1.00 0.00 O ATOM 2505 ND2 ASN B 70 162.850 11.976 -6.729 1.00 0.00 N ATOM 0 H ASN B 70 160.918 9.576 -4.888 1.00 0.00 H new ATOM 0 HA ASN B 70 161.049 10.448 -7.721 1.00 0.00 H new ATOM 0 HB2 ASN B 70 162.905 8.734 -5.993 1.00 0.00 H new ATOM 0 HB3 ASN B 70 163.260 9.267 -7.625 1.00 0.00 H new ATOM 0 HD21 ASN B 70 163.185 12.871 -6.371 1.00 0.00 H new ATOM 0 HD22 ASN B 70 162.215 11.951 -7.527 1.00 0.00 H new ATOM 2512 N ALA B 71 161.135 8.015 -8.779 1.00 0.00 N ATOM 2513 CA ALA B 71 160.677 6.762 -9.445 1.00 0.00 C ATOM 2514 C ALA B 71 161.062 5.530 -8.616 1.00 0.00 C ATOM 2515 O ALA B 71 160.356 4.545 -8.604 1.00 0.00 O ATOM 2516 CB ALA B 71 161.329 6.664 -10.827 1.00 0.00 C ATOM 0 H ALA B 71 161.785 8.578 -9.327 1.00 0.00 H new ATOM 0 HA ALA B 71 159.591 6.792 -9.538 1.00 0.00 H new ATOM 0 HB1 ALA B 71 160.999 5.750 -11.321 1.00 0.00 H new ATOM 0 HB2 ALA B 71 161.039 7.526 -11.428 1.00 0.00 H new ATOM 0 HB3 ALA B 71 162.413 6.646 -10.717 1.00 0.00 H new ATOM 2522 N LYS B 72 162.172 5.564 -7.936 1.00 0.00 N ATOM 2523 CA LYS B 72 162.572 4.367 -7.135 1.00 0.00 C ATOM 2524 C LYS B 72 161.681 4.225 -5.903 1.00 0.00 C ATOM 2525 O LYS B 72 161.303 3.136 -5.516 1.00 0.00 O ATOM 2526 CB LYS B 72 164.030 4.512 -6.701 1.00 0.00 C ATOM 2527 CG LYS B 72 164.941 4.371 -7.922 1.00 0.00 C ATOM 2528 CD LYS B 72 166.372 4.775 -7.553 1.00 0.00 C ATOM 2529 CE LYS B 72 166.891 3.897 -6.409 1.00 0.00 C ATOM 2530 NZ LYS B 72 166.383 4.424 -5.110 1.00 0.00 N ATOM 0 H LYS B 72 162.814 6.355 -7.897 1.00 0.00 H new ATOM 0 HA LYS B 72 162.458 3.475 -7.751 1.00 0.00 H new ATOM 0 HB2 LYS B 72 164.185 5.482 -6.228 1.00 0.00 H new ATOM 0 HB3 LYS B 72 164.277 3.752 -5.959 1.00 0.00 H new ATOM 0 HG2 LYS B 72 164.925 3.342 -8.282 1.00 0.00 H new ATOM 0 HG3 LYS B 72 164.575 4.998 -8.735 1.00 0.00 H new ATOM 0 HD2 LYS B 72 167.022 4.674 -8.422 1.00 0.00 H new ATOM 0 HD3 LYS B 72 166.397 5.824 -7.257 1.00 0.00 H new ATOM 0 HE2 LYS B 72 166.563 2.867 -6.549 1.00 0.00 H new ATOM 0 HE3 LYS B 72 167.981 3.888 -6.409 1.00 0.00 H new ATOM 0 HZ1 LYS B 72 167.171 4.507 -4.437 1.00 0.00 H new ATOM 0 HZ2 LYS B 72 165.955 5.360 -5.259 1.00 0.00 H new ATOM 0 HZ3 LYS B 72 165.668 3.773 -4.727 1.00 0.00 H new ATOM 2544 N GLN B 73 161.363 5.318 -5.267 1.00 0.00 N ATOM 2545 CA GLN B 73 160.525 5.257 -4.040 1.00 0.00 C ATOM 2546 C GLN B 73 159.099 4.832 -4.383 1.00 0.00 C ATOM 2547 O GLN B 73 158.456 4.126 -3.631 1.00 0.00 O ATOM 2548 CB GLN B 73 160.504 6.634 -3.377 1.00 0.00 C ATOM 2549 CG GLN B 73 161.923 7.009 -2.939 1.00 0.00 C ATOM 2550 CD GLN B 73 162.372 6.088 -1.803 1.00 0.00 C ATOM 2551 OE1 GLN B 73 163.448 5.526 -1.850 1.00 0.00 O ATOM 2552 NE2 GLN B 73 161.583 5.901 -0.783 1.00 0.00 N ATOM 0 H GLN B 73 161.650 6.256 -5.547 1.00 0.00 H new ATOM 0 HA GLN B 73 160.951 4.522 -3.357 1.00 0.00 H new ATOM 0 HB2 GLN B 73 160.117 7.379 -4.073 1.00 0.00 H new ATOM 0 HB3 GLN B 73 159.836 6.625 -2.516 1.00 0.00 H new ATOM 0 HG2 GLN B 73 162.609 6.924 -3.782 1.00 0.00 H new ATOM 0 HG3 GLN B 73 161.950 8.048 -2.610 1.00 0.00 H new ATOM 0 HE21 GLN B 73 160.680 6.373 -0.744 1.00 0.00 H new ATOM 0 HE22 GLN B 73 161.869 5.283 -0.024 1.00 0.00 H new ATOM 2561 N SER B 74 158.591 5.263 -5.503 1.00 0.00 N ATOM 2562 CA SER B 74 157.202 4.889 -5.876 1.00 0.00 C ATOM 2563 C SER B 74 157.129 3.393 -6.191 1.00 0.00 C ATOM 2564 O SER B 74 156.161 2.733 -5.867 1.00 0.00 O ATOM 2565 CB SER B 74 156.772 5.693 -7.102 1.00 0.00 C ATOM 2566 OG SER B 74 157.424 5.176 -8.254 1.00 0.00 O ATOM 0 H SER B 74 159.078 5.857 -6.174 1.00 0.00 H new ATOM 0 HA SER B 74 156.535 5.109 -5.042 1.00 0.00 H new ATOM 0 HB2 SER B 74 155.691 5.638 -7.226 1.00 0.00 H new ATOM 0 HB3 SER B 74 157.024 6.745 -6.968 1.00 0.00 H new ATOM 0 HG SER B 74 158.381 5.076 -8.071 1.00 0.00 H new ATOM 2572 N ARG B 75 158.137 2.843 -6.821 1.00 0.00 N ATOM 2573 CA ARG B 75 158.101 1.389 -7.149 1.00 0.00 C ATOM 2574 C ARG B 75 158.009 0.564 -5.867 1.00 0.00 C ATOM 2575 O ARG B 75 157.354 -0.459 -5.835 1.00 0.00 O ATOM 2576 CB ARG B 75 159.350 0.996 -7.938 1.00 0.00 C ATOM 2577 CG ARG B 75 159.260 1.584 -9.348 1.00 0.00 C ATOM 2578 CD ARG B 75 160.506 1.196 -10.146 1.00 0.00 C ATOM 2579 NE ARG B 75 160.411 1.771 -11.517 1.00 0.00 N ATOM 2580 CZ ARG B 75 161.469 1.816 -12.280 1.00 0.00 C ATOM 2581 NH1 ARG B 75 162.610 1.361 -11.841 1.00 0.00 N ATOM 2582 NH2 ARG B 75 161.385 2.316 -13.483 1.00 0.00 N ATOM 0 H ARG B 75 158.978 3.337 -7.120 1.00 0.00 H new ATOM 0 HA ARG B 75 157.221 1.189 -7.761 1.00 0.00 H new ATOM 0 HB2 ARG B 75 160.244 1.364 -7.434 1.00 0.00 H new ATOM 0 HB3 ARG B 75 159.436 -0.089 -7.988 1.00 0.00 H new ATOM 0 HG2 ARG B 75 158.365 1.216 -9.850 1.00 0.00 H new ATOM 0 HG3 ARG B 75 159.173 2.669 -9.296 1.00 0.00 H new ATOM 0 HD2 ARG B 75 161.402 1.565 -9.646 1.00 0.00 H new ATOM 0 HD3 ARG B 75 160.594 0.111 -10.200 1.00 0.00 H new ATOM 0 HE ARG B 75 159.519 2.129 -11.859 1.00 0.00 H new ATOM 0 HH11 ARG B 75 162.676 0.970 -10.901 1.00 0.00 H new ATOM 0 HH12 ARG B 75 163.437 1.396 -12.438 1.00 0.00 H new ATOM 0 HH21 ARG B 75 160.493 2.671 -13.826 1.00 0.00 H new ATOM 0 HH22 ARG B 75 162.212 2.351 -14.079 1.00 0.00 H new ATOM 2596 N ASP B 76 158.666 0.963 -4.810 1.00 0.00 N ATOM 2597 CA ASP B 76 158.621 0.165 -3.553 1.00 0.00 C ATOM 2598 C ASP B 76 157.223 0.213 -2.936 1.00 0.00 C ATOM 2599 O ASP B 76 156.728 -0.777 -2.435 1.00 0.00 O ATOM 2600 CB ASP B 76 159.634 0.728 -2.555 1.00 0.00 C ATOM 2601 CG ASP B 76 161.054 0.429 -3.042 1.00 0.00 C ATOM 2602 OD1 ASP B 76 161.215 -0.523 -3.790 1.00 0.00 O ATOM 2603 OD2 ASP B 76 161.957 1.154 -2.659 1.00 0.00 O ATOM 0 H ASP B 76 159.233 1.810 -4.765 1.00 0.00 H new ATOM 0 HA ASP B 76 158.867 -0.871 -3.788 1.00 0.00 H new ATOM 0 HB2 ASP B 76 159.494 1.804 -2.447 1.00 0.00 H new ATOM 0 HB3 ASP B 76 159.475 0.286 -1.571 1.00 0.00 H new ATOM 2608 N CYS B 77 156.574 1.345 -2.960 1.00 0.00 N ATOM 2609 CA CYS B 77 155.210 1.424 -2.366 1.00 0.00 C ATOM 2610 C CYS B 77 154.210 0.630 -3.212 1.00 0.00 C ATOM 2611 O CYS B 77 153.332 -0.024 -2.684 1.00 0.00 O ATOM 2612 CB CYS B 77 154.773 2.887 -2.302 1.00 0.00 C ATOM 2613 SG CYS B 77 155.712 3.742 -1.014 1.00 0.00 S ATOM 0 H CYS B 77 156.927 2.213 -3.363 1.00 0.00 H new ATOM 0 HA CYS B 77 155.236 0.998 -1.363 1.00 0.00 H new ATOM 0 HB2 CYS B 77 154.936 3.369 -3.266 1.00 0.00 H new ATOM 0 HB3 CYS B 77 153.705 2.950 -2.091 1.00 0.00 H new ATOM 0 HG CYS B 77 156.236 2.868 -0.207 1.00 0.00 H new ATOM 2619 N PHE B 78 154.304 0.690 -4.513 1.00 0.00 N ATOM 2620 CA PHE B 78 153.319 -0.055 -5.345 1.00 0.00 C ATOM 2621 C PHE B 78 153.396 -1.552 -5.040 1.00 0.00 C ATOM 2622 O PHE B 78 152.429 -2.160 -4.624 1.00 0.00 O ATOM 2623 CB PHE B 78 153.613 0.194 -6.826 1.00 0.00 C ATOM 2624 CG PHE B 78 152.624 -0.569 -7.677 1.00 0.00 C ATOM 2625 CD1 PHE B 78 151.391 0.006 -8.007 1.00 0.00 C ATOM 2626 CD2 PHE B 78 152.947 -1.847 -8.146 1.00 0.00 C ATOM 2627 CE1 PHE B 78 150.480 -0.699 -8.804 1.00 0.00 C ATOM 2628 CE2 PHE B 78 152.038 -2.552 -8.942 1.00 0.00 C ATOM 2629 CZ PHE B 78 150.804 -1.979 -9.271 1.00 0.00 C ATOM 0 H PHE B 78 155.010 1.215 -5.029 1.00 0.00 H new ATOM 0 HA PHE B 78 152.314 0.296 -5.112 1.00 0.00 H new ATOM 0 HB2 PHE B 78 153.550 1.260 -7.045 1.00 0.00 H new ATOM 0 HB3 PHE B 78 154.630 -0.120 -7.063 1.00 0.00 H new ATOM 0 HD1 PHE B 78 151.142 0.993 -7.647 1.00 0.00 H new ATOM 0 HD2 PHE B 78 153.899 -2.290 -7.893 1.00 0.00 H new ATOM 0 HE1 PHE B 78 149.528 -0.256 -9.058 1.00 0.00 H new ATOM 0 HE2 PHE B 78 152.288 -3.539 -9.303 1.00 0.00 H new ATOM 0 HZ PHE B 78 150.102 -2.524 -9.885 1.00 0.00 H new ATOM 2639 N GLY B 79 154.534 -2.153 -5.248 1.00 0.00 N ATOM 2640 CA GLY B 79 154.670 -3.614 -4.977 1.00 0.00 C ATOM 2641 C GLY B 79 154.391 -3.909 -3.501 1.00 0.00 C ATOM 2642 O GLY B 79 153.881 -4.954 -3.153 1.00 0.00 O ATOM 0 H GLY B 79 155.378 -1.696 -5.594 1.00 0.00 H new ATOM 0 HA2 GLY B 79 153.976 -4.173 -5.604 1.00 0.00 H new ATOM 0 HA3 GLY B 79 155.674 -3.947 -5.238 1.00 0.00 H new ATOM 2646 N CYS B 80 154.719 -2.997 -2.632 1.00 0.00 N ATOM 2647 CA CYS B 80 154.465 -3.233 -1.181 1.00 0.00 C ATOM 2648 C CYS B 80 152.957 -3.233 -0.911 1.00 0.00 C ATOM 2649 O CYS B 80 152.431 -4.129 -0.281 1.00 0.00 O ATOM 2650 CB CYS B 80 155.127 -2.123 -0.363 1.00 0.00 C ATOM 2651 SG CYS B 80 154.815 -2.405 1.398 1.00 0.00 S ATOM 0 H CYS B 80 155.150 -2.101 -2.860 1.00 0.00 H new ATOM 0 HA CYS B 80 154.882 -4.199 -0.895 1.00 0.00 H new ATOM 0 HB2 CYS B 80 156.200 -2.105 -0.555 1.00 0.00 H new ATOM 0 HB3 CYS B 80 154.733 -1.152 -0.662 1.00 0.00 H new ATOM 0 HG CYS B 80 154.571 -1.270 1.983 1.00 0.00 H new ATOM 2657 N LEU B 81 152.256 -2.244 -1.392 1.00 0.00 N ATOM 2658 CA LEU B 81 150.782 -2.214 -1.163 1.00 0.00 C ATOM 2659 C LEU B 81 150.111 -3.324 -1.982 1.00 0.00 C ATOM 2660 O LEU B 81 149.189 -3.972 -1.527 1.00 0.00 O ATOM 2661 CB LEU B 81 150.227 -0.853 -1.595 1.00 0.00 C ATOM 2662 CG LEU B 81 150.821 0.259 -0.719 1.00 0.00 C ATOM 2663 CD1 LEU B 81 150.374 1.620 -1.261 1.00 0.00 C ATOM 2664 CD2 LEU B 81 150.346 0.101 0.741 1.00 0.00 C ATOM 0 H LEU B 81 152.633 -1.463 -1.928 1.00 0.00 H new ATOM 0 HA LEU B 81 150.576 -2.372 -0.104 1.00 0.00 H new ATOM 0 HB2 LEU B 81 150.467 -0.669 -2.642 1.00 0.00 H new ATOM 0 HB3 LEU B 81 149.140 -0.851 -1.512 1.00 0.00 H new ATOM 0 HG LEU B 81 151.909 0.191 -0.743 1.00 0.00 H new ATOM 0 HD11 LEU B 81 150.793 2.414 -0.642 1.00 0.00 H new ATOM 0 HD12 LEU B 81 150.724 1.736 -2.287 1.00 0.00 H new ATOM 0 HD13 LEU B 81 149.286 1.680 -1.240 1.00 0.00 H new ATOM 0 HD21 LEU B 81 150.775 0.896 1.351 1.00 0.00 H new ATOM 0 HD22 LEU B 81 149.258 0.161 0.778 1.00 0.00 H new ATOM 0 HD23 LEU B 81 150.669 -0.866 1.126 1.00 0.00 H new ATOM 2676 N ARG B 82 150.559 -3.541 -3.190 1.00 0.00 N ATOM 2677 CA ARG B 82 149.934 -4.602 -4.037 1.00 0.00 C ATOM 2678 C ARG B 82 150.081 -5.967 -3.367 1.00 0.00 C ATOM 2679 O ARG B 82 149.178 -6.780 -3.388 1.00 0.00 O ATOM 2680 CB ARG B 82 150.617 -4.639 -5.406 1.00 0.00 C ATOM 2681 CG ARG B 82 149.884 -5.631 -6.314 1.00 0.00 C ATOM 2682 CD ARG B 82 150.537 -5.639 -7.696 1.00 0.00 C ATOM 2683 NE ARG B 82 151.875 -6.291 -7.608 1.00 0.00 N ATOM 2684 CZ ARG B 82 152.510 -6.624 -8.698 1.00 0.00 C ATOM 2685 NH1 ARG B 82 151.996 -6.343 -9.864 1.00 0.00 N ATOM 2686 NH2 ARG B 82 153.663 -7.231 -8.625 1.00 0.00 N ATOM 0 H ARG B 82 151.328 -3.032 -3.627 1.00 0.00 H new ATOM 0 HA ARG B 82 148.875 -4.373 -4.159 1.00 0.00 H new ATOM 0 HB2 ARG B 82 150.611 -3.646 -5.855 1.00 0.00 H new ATOM 0 HB3 ARG B 82 151.661 -4.933 -5.296 1.00 0.00 H new ATOM 0 HG2 ARG B 82 149.917 -6.630 -5.879 1.00 0.00 H new ATOM 0 HG3 ARG B 82 148.833 -5.354 -6.399 1.00 0.00 H new ATOM 0 HD2 ARG B 82 149.906 -6.174 -8.406 1.00 0.00 H new ATOM 0 HD3 ARG B 82 150.641 -4.619 -8.067 1.00 0.00 H new ATOM 0 HE ARG B 82 152.293 -6.477 -6.696 1.00 0.00 H new ATOM 0 HH11 ARG B 82 151.098 -5.863 -9.923 1.00 0.00 H new ATOM 0 HH12 ARG B 82 152.492 -6.603 -10.716 1.00 0.00 H new ATOM 0 HH21 ARG B 82 154.069 -7.446 -7.715 1.00 0.00 H new ATOM 0 HH22 ARG B 82 154.158 -7.490 -9.478 1.00 0.00 H new ATOM 2700 N GLU B 83 151.212 -6.229 -2.776 1.00 0.00 N ATOM 2701 CA GLU B 83 151.417 -7.546 -2.110 1.00 0.00 C ATOM 2702 C GLU B 83 150.563 -7.656 -0.844 1.00 0.00 C ATOM 2703 O GLU B 83 150.027 -8.707 -0.554 1.00 0.00 O ATOM 2704 CB GLU B 83 152.897 -7.738 -1.762 1.00 0.00 C ATOM 2705 CG GLU B 83 153.689 -8.028 -3.041 1.00 0.00 C ATOM 2706 CD GLU B 83 155.166 -8.221 -2.696 1.00 0.00 C ATOM 2707 OE1 GLU B 83 155.531 -7.946 -1.565 1.00 0.00 O ATOM 2708 OE2 GLU B 83 155.907 -8.647 -3.567 1.00 0.00 O ATOM 0 H GLU B 83 152.004 -5.588 -2.725 1.00 0.00 H new ATOM 0 HA GLU B 83 151.109 -8.329 -2.802 1.00 0.00 H new ATOM 0 HB2 GLU B 83 153.286 -6.844 -1.275 1.00 0.00 H new ATOM 0 HB3 GLU B 83 153.012 -8.560 -1.056 1.00 0.00 H new ATOM 0 HG2 GLU B 83 153.299 -8.922 -3.528 1.00 0.00 H new ATOM 0 HG3 GLU B 83 153.574 -7.205 -3.746 1.00 0.00 H new ATOM 2715 N TRP B 84 150.404 -6.599 -0.086 1.00 0.00 N ATOM 2716 CA TRP B 84 149.558 -6.701 1.136 1.00 0.00 C ATOM 2717 C TRP B 84 148.123 -7.046 0.725 1.00 0.00 C ATOM 2718 O TRP B 84 147.473 -7.873 1.332 1.00 0.00 O ATOM 2719 CB TRP B 84 149.570 -5.376 1.901 1.00 0.00 C ATOM 2720 CG TRP B 84 148.759 -5.533 3.147 1.00 0.00 C ATOM 2721 CD1 TRP B 84 149.249 -5.949 4.338 1.00 0.00 C ATOM 2722 CD2 TRP B 84 147.334 -5.298 3.352 1.00 0.00 C ATOM 2723 NE1 TRP B 84 148.218 -5.986 5.259 1.00 0.00 N ATOM 2724 CE2 TRP B 84 147.018 -5.594 4.700 1.00 0.00 C ATOM 2725 CE3 TRP B 84 146.294 -4.863 2.509 1.00 0.00 C ATOM 2726 CZ2 TRP B 84 145.719 -5.465 5.194 1.00 0.00 C ATOM 2727 CZ3 TRP B 84 144.984 -4.731 3.005 1.00 0.00 C ATOM 2728 CH2 TRP B 84 144.699 -5.032 4.347 1.00 0.00 C ATOM 0 H TRP B 84 150.818 -5.683 -0.259 1.00 0.00 H new ATOM 0 HA TRP B 84 149.955 -7.482 1.784 1.00 0.00 H new ATOM 0 HB2 TRP B 84 150.593 -5.093 2.149 1.00 0.00 H new ATOM 0 HB3 TRP B 84 149.160 -4.579 1.281 1.00 0.00 H new ATOM 0 HD1 TRP B 84 150.278 -6.210 4.537 1.00 0.00 H new ATOM 0 HE1 TRP B 84 148.330 -6.268 6.233 1.00 0.00 H new ATOM 0 HE3 TRP B 84 146.503 -4.629 1.475 1.00 0.00 H new ATOM 0 HZ2 TRP B 84 145.505 -5.699 6.226 1.00 0.00 H new ATOM 0 HZ3 TRP B 84 144.193 -4.396 2.350 1.00 0.00 H new ATOM 0 HH2 TRP B 84 143.692 -4.928 4.722 1.00 0.00 H new ATOM 2739 N CYS B 85 147.619 -6.405 -0.296 1.00 0.00 N ATOM 2740 CA CYS B 85 146.221 -6.686 -0.736 1.00 0.00 C ATOM 2741 C CYS B 85 146.089 -8.155 -1.136 1.00 0.00 C ATOM 2742 O CYS B 85 145.103 -8.803 -0.848 1.00 0.00 O ATOM 2743 CB CYS B 85 145.881 -5.802 -1.937 1.00 0.00 C ATOM 2744 SG CYS B 85 145.650 -4.094 -1.384 1.00 0.00 S ATOM 0 H CYS B 85 148.114 -5.701 -0.843 1.00 0.00 H new ATOM 0 HA CYS B 85 145.536 -6.473 0.085 1.00 0.00 H new ATOM 0 HB2 CYS B 85 146.681 -5.851 -2.676 1.00 0.00 H new ATOM 0 HB3 CYS B 85 144.975 -6.164 -2.423 1.00 0.00 H new ATOM 0 HG CYS B 85 145.363 -3.342 -2.405 1.00 0.00 H new ATOM 2750 N ASP B 86 147.078 -8.684 -1.795 1.00 0.00 N ATOM 2751 CA ASP B 86 147.019 -10.109 -2.217 1.00 0.00 C ATOM 2752 C ASP B 86 146.859 -11.012 -0.991 1.00 0.00 C ATOM 2753 O ASP B 86 146.281 -12.078 -1.067 1.00 0.00 O ATOM 2754 CB ASP B 86 148.307 -10.475 -2.958 1.00 0.00 C ATOM 2755 CG ASP B 86 148.332 -9.776 -4.319 1.00 0.00 C ATOM 2756 OD1 ASP B 86 147.263 -9.484 -4.831 1.00 0.00 O ATOM 2757 OD2 ASP B 86 149.417 -9.546 -4.826 1.00 0.00 O ATOM 0 H ASP B 86 147.929 -8.189 -2.061 1.00 0.00 H new ATOM 0 HA ASP B 86 146.164 -10.251 -2.878 1.00 0.00 H new ATOM 0 HB2 ASP B 86 149.175 -10.177 -2.369 1.00 0.00 H new ATOM 0 HB3 ASP B 86 148.368 -11.555 -3.091 1.00 0.00 H new ATOM 2762 N ALA B 87 147.378 -10.602 0.139 1.00 0.00 N ATOM 2763 CA ALA B 87 147.267 -11.454 1.366 1.00 0.00 C ATOM 2764 C ALA B 87 146.040 -11.062 2.197 1.00 0.00 C ATOM 2765 O ALA B 87 145.446 -11.894 2.856 1.00 0.00 O ATOM 2766 CB ALA B 87 148.524 -11.273 2.222 1.00 0.00 C ATOM 0 H ALA B 87 147.872 -9.719 0.267 1.00 0.00 H new ATOM 0 HA ALA B 87 147.163 -12.494 1.055 1.00 0.00 H new ATOM 0 HB1 ALA B 87 148.447 -11.891 3.116 1.00 0.00 H new ATOM 0 HB2 ALA B 87 149.401 -11.572 1.648 1.00 0.00 H new ATOM 0 HB3 ALA B 87 148.619 -10.227 2.512 1.00 0.00 H new ATOM 2772 N PHE B 88 145.684 -9.799 2.214 1.00 0.00 N ATOM 2773 CA PHE B 88 144.524 -9.341 3.055 1.00 0.00 C ATOM 2774 C PHE B 88 143.319 -8.939 2.195 1.00 0.00 C ATOM 2775 O PHE B 88 142.293 -8.543 2.711 1.00 0.00 O ATOM 2776 CB PHE B 88 144.969 -8.146 3.897 1.00 0.00 C ATOM 2777 CG PHE B 88 146.020 -8.603 4.881 1.00 0.00 C ATOM 2778 CD1 PHE B 88 145.632 -9.206 6.083 1.00 0.00 C ATOM 2779 CD2 PHE B 88 147.378 -8.433 4.590 1.00 0.00 C ATOM 2780 CE1 PHE B 88 146.602 -9.635 6.995 1.00 0.00 C ATOM 2781 CE2 PHE B 88 148.349 -8.863 5.503 1.00 0.00 C ATOM 2782 CZ PHE B 88 147.960 -9.463 6.706 1.00 0.00 C ATOM 0 H PHE B 88 146.146 -9.062 1.682 1.00 0.00 H new ATOM 0 HA PHE B 88 144.214 -10.169 3.692 1.00 0.00 H new ATOM 0 HB2 PHE B 88 145.370 -7.361 3.255 1.00 0.00 H new ATOM 0 HB3 PHE B 88 144.117 -7.720 4.427 1.00 0.00 H new ATOM 0 HD1 PHE B 88 144.584 -9.340 6.306 1.00 0.00 H new ATOM 0 HD2 PHE B 88 147.677 -7.970 3.661 1.00 0.00 H new ATOM 0 HE1 PHE B 88 146.302 -10.099 7.923 1.00 0.00 H new ATOM 0 HE2 PHE B 88 149.397 -8.732 5.279 1.00 0.00 H new ATOM 0 HZ PHE B 88 148.708 -9.793 7.411 1.00 0.00 H new ATOM 2792 N LEU B 89 143.424 -9.033 0.895 1.00 0.00 N ATOM 2793 CA LEU B 89 142.271 -8.650 0.020 1.00 0.00 C ATOM 2794 C LEU B 89 142.235 -9.580 -1.193 1.00 0.00 C ATOM 2795 O LEU B 89 143.084 -9.432 -2.055 1.00 0.00 O ATOM 2796 CB LEU B 89 142.451 -7.204 -0.461 1.00 0.00 C ATOM 2797 CG LEU B 89 141.168 -6.708 -1.161 1.00 0.00 C ATOM 2798 CD1 LEU B 89 140.129 -6.254 -0.125 1.00 0.00 C ATOM 2799 CD2 LEU B 89 141.505 -5.525 -2.074 1.00 0.00 C ATOM 2800 OXT LEU B 89 141.356 -10.426 -1.239 1.00 0.00 O ATOM 0 H LEU B 89 144.255 -9.357 0.400 1.00 0.00 H new ATOM 0 HA LEU B 89 141.341 -8.734 0.582 1.00 0.00 H new ATOM 0 HB2 LEU B 89 142.684 -6.558 0.386 1.00 0.00 H new ATOM 0 HB3 LEU B 89 143.295 -7.145 -1.149 1.00 0.00 H new ATOM 0 HG LEU B 89 140.756 -7.530 -1.747 1.00 0.00 H new ATOM 0 HD11 LEU B 89 139.231 -5.908 -0.637 1.00 0.00 H new ATOM 0 HD12 LEU B 89 139.875 -7.090 0.526 1.00 0.00 H new ATOM 0 HD13 LEU B 89 140.542 -5.441 0.472 1.00 0.00 H new ATOM 0 HD21 LEU B 89 140.598 -5.176 -2.567 1.00 0.00 H new ATOM 0 HD22 LEU B 89 141.929 -4.716 -1.479 1.00 0.00 H new ATOM 0 HD23 LEU B 89 142.229 -5.840 -2.826 1.00 0.00 H new TER 2812 LEU B 89