USER MOD reduce.3.24.130724 H: found=0, std=0, add=930, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 930 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 43 ASN : amide:sc= 0.179 X(o=0.35,f=0) USER MOD Set 1.2: A 46 GLN : amide:sc= 0.166 K(o=0.35,f=-0.88) USER MOD Set 2.1: A 8 SER OG : rot 180:sc= 0.804 USER MOD Set 2.2: A 19 THR OG1 : rot 180:sc= 0 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -162:sc= -0.0509 (180deg=-0.452) USER MOD Single : A 6 THR OG1 : rot 23:sc= 0.585 USER MOD Single : A 9 LYS NZ :NH3+ -115:sc= -1.49 (180deg=-2.53!) USER MOD Single : A 11 THR OG1 : rot 180:sc= 0 USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 ASN : amide:sc= -3.51! K(o=-3.5!,f=-1.5) USER MOD Single : A 33 HIS : no HD1:sc= -1.26 X(o=-1.3,f=-0.87) USER MOD Single : A 34 ASN : amide:sc= -0.205 X(o=-0.2,f=-0.27) USER MOD Single : A 40 TYR OH : rot 0:sc= -0.506 USER MOD Single : A 55 THR OG1 : rot 180:sc= 0 USER MOD Single : A 57 SER OG : rot 180:sc= -0.316 USER MOD Single : A 64 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 GLN : amide:sc= -3.28! C(o=-3.3!,f=-2!) USER MOD Single : A 72 LYS NZ :NH3+ -124:sc= -0.663 (180deg=-2.52!) USER MOD Single : A 74 THR OG1 : rot 17:sc= 0.969 USER MOD Single : A 76 LYS NZ :NH3+ -161:sc= -0.0813 (180deg=-0.536) USER MOD Single : A 83 ASN : amide:sc= -1.46 X(o=-1.5,f=-1.4) USER MOD Single : A 89 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 103 LYS NZ :NH3+ 137:sc= -0.645 (180deg=-2.12) USER MOD Single : A 105 ASN : amide:sc= -2 K(o=-2,f=-1.4) USER MOD Single : A 106 ASN : amide:sc= -2.55 X(o=-2.5,f=-2.1) USER MOD Single : A 109 SER OG : rot 76:sc= 1.23 USER MOD Single : A 113 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=-0.005) USER MOD Single : A 118 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 119 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 120 HIS : no HD1:sc= -0.014 X(o=-0.014,f=-0.014) USER MOD Single : A 121 HIS : no HD1:sc= -1.55 X(o=-1.5,f=-1.7) USER MOD Single : A 122 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 14.180 8.120 3.859 1.00 1.00 N ATOM 2 CA MET A 1 12.888 7.835 4.549 1.00 1.00 C ATOM 3 C MET A 1 11.743 8.252 3.627 1.00 1.00 C ATOM 4 O MET A 1 11.008 7.412 3.107 1.00 1.00 O ATOM 5 CB MET A 1 12.818 8.634 5.874 1.00 1.00 C ATOM 6 CG MET A 1 13.969 8.241 6.828 1.00 1.00 C ATOM 7 SD MET A 1 13.782 6.513 7.376 1.00 1.00 S ATOM 8 CE MET A 1 12.787 6.788 8.871 1.00 1.00 C ATOM 0 H1 MET A 1 14.943 7.581 4.315 1.00 1.00 H new ATOM 0 H2 MET A 1 14.109 7.842 2.860 1.00 1.00 H new ATOM 0 H3 MET A 1 14.390 9.137 3.921 1.00 1.00 H new ATOM 0 HA MET A 1 12.811 6.772 4.777 1.00 1.00 H new ATOM 0 HB2 MET A 1 12.868 9.702 5.660 1.00 1.00 H new ATOM 0 HB3 MET A 1 11.860 8.451 6.361 1.00 1.00 H new ATOM 0 HG2 MET A 1 14.927 8.367 6.323 1.00 1.00 H new ATOM 0 HG3 MET A 1 13.975 8.904 7.693 1.00 1.00 H new ATOM 0 HE1 MET A 1 12.572 5.831 9.346 1.00 1.00 H new ATOM 0 HE2 MET A 1 13.340 7.422 9.565 1.00 1.00 H new ATOM 0 HE3 MET A 1 11.851 7.277 8.600 1.00 1.00 H new ATOM 20 N ASP A 2 11.600 9.558 3.432 1.00 1.00 N ATOM 21 CA ASP A 2 10.537 10.108 2.573 1.00 1.00 C ATOM 22 C ASP A 2 9.159 9.593 3.014 1.00 1.00 C ATOM 23 O ASP A 2 9.061 8.842 3.984 1.00 1.00 O ATOM 24 CB ASP A 2 10.799 9.735 1.098 1.00 1.00 C ATOM 25 CG ASP A 2 12.156 10.275 0.648 1.00 1.00 C ATOM 26 OD1 ASP A 2 12.484 11.388 1.026 1.00 1.00 O ATOM 27 OD2 ASP A 2 12.848 9.569 -0.071 1.00 1.00 O ATOM 0 H ASP A 2 12.204 10.263 3.854 1.00 1.00 H new ATOM 0 HA ASP A 2 10.544 11.194 2.670 1.00 1.00 H new ATOM 0 HB2 ASP A 2 10.773 8.652 0.980 1.00 1.00 H new ATOM 0 HB3 ASP A 2 10.010 10.143 0.467 1.00 1.00 H new ATOM 32 N LEU A 3 8.114 9.982 2.290 1.00 1.00 N ATOM 33 CA LEU A 3 6.751 9.559 2.626 1.00 1.00 C ATOM 34 C LEU A 3 6.593 8.021 2.470 1.00 1.00 C ATOM 35 O LEU A 3 7.189 7.460 1.551 1.00 1.00 O ATOM 36 CB LEU A 3 5.737 10.303 1.720 1.00 1.00 C ATOM 37 CG LEU A 3 5.888 11.887 1.858 1.00 1.00 C ATOM 38 CD1 LEU A 3 6.543 12.498 0.592 1.00 1.00 C ATOM 39 CD2 LEU A 3 4.505 12.552 2.077 1.00 1.00 C ATOM 0 H LEU A 3 8.180 10.586 1.471 1.00 1.00 H new ATOM 0 HA LEU A 3 6.553 9.811 3.668 1.00 1.00 H new ATOM 0 HB2 LEU A 3 5.891 10.010 0.681 1.00 1.00 H new ATOM 0 HB3 LEU A 3 4.722 10.008 1.987 1.00 1.00 H new ATOM 0 HG LEU A 3 6.527 12.078 2.720 1.00 1.00 H new ATOM 0 HD11 LEU A 3 6.633 13.577 0.714 1.00 1.00 H new ATOM 0 HD12 LEU A 3 7.533 12.065 0.449 1.00 1.00 H new ATOM 0 HD13 LEU A 3 5.924 12.282 -0.278 1.00 1.00 H new ATOM 0 HD21 LEU A 3 4.630 13.631 2.169 1.00 1.00 H new ATOM 0 HD22 LEU A 3 3.857 12.333 1.228 1.00 1.00 H new ATOM 0 HD23 LEU A 3 4.053 12.161 2.989 1.00 1.00 H new ATOM 51 N PRO A 4 5.826 7.369 3.301 1.00 1.00 N ATOM 52 CA PRO A 4 5.650 5.871 3.183 1.00 1.00 C ATOM 53 C PRO A 4 4.802 5.479 1.981 1.00 1.00 C ATOM 54 O PRO A 4 5.064 4.490 1.297 1.00 1.00 O ATOM 55 CB PRO A 4 4.967 5.492 4.530 1.00 1.00 C ATOM 56 CG PRO A 4 4.148 6.709 4.861 1.00 1.00 C ATOM 57 CD PRO A 4 5.029 7.899 4.446 1.00 1.00 C ATOM 0 HA PRO A 4 6.592 5.347 3.019 1.00 1.00 H new ATOM 0 HB2 PRO A 4 4.343 4.604 4.428 1.00 1.00 H new ATOM 0 HB3 PRO A 4 5.701 5.279 5.307 1.00 1.00 H new ATOM 0 HG2 PRO A 4 3.202 6.709 4.319 1.00 1.00 H new ATOM 0 HG3 PRO A 4 3.907 6.747 5.923 1.00 1.00 H new ATOM 0 HD2 PRO A 4 4.427 8.759 4.151 1.00 1.00 H new ATOM 0 HD3 PRO A 4 5.672 8.225 5.264 1.00 1.00 H new ATOM 65 N ILE A 5 3.764 6.273 1.738 1.00 1.00 N ATOM 66 CA ILE A 5 2.850 6.008 0.608 1.00 1.00 C ATOM 67 C ILE A 5 3.200 6.926 -0.559 1.00 1.00 C ATOM 68 O ILE A 5 3.383 8.131 -0.390 1.00 1.00 O ATOM 69 CB ILE A 5 1.373 6.229 1.056 1.00 1.00 C ATOM 70 CG1 ILE A 5 1.013 5.305 2.287 1.00 1.00 C ATOM 71 CG2 ILE A 5 0.393 5.951 -0.127 1.00 1.00 C ATOM 72 CD1 ILE A 5 0.770 3.827 1.909 1.00 1.00 C ATOM 0 H ILE A 5 3.528 7.096 2.293 1.00 1.00 H new ATOM 0 HA ILE A 5 2.961 4.973 0.286 1.00 1.00 H new ATOM 0 HB ILE A 5 1.267 7.270 1.363 1.00 1.00 H new ATOM 0 HG12 ILE A 5 1.822 5.355 3.016 1.00 1.00 H new ATOM 0 HG13 ILE A 5 0.120 5.697 2.774 1.00 1.00 H new ATOM 0 HG21 ILE A 5 -0.633 6.110 0.205 1.00 1.00 H new ATOM 0 HG22 ILE A 5 0.617 6.628 -0.952 1.00 1.00 H new ATOM 0 HG23 ILE A 5 0.510 4.920 -0.462 1.00 1.00 H new ATOM 0 HD11 ILE A 5 0.528 3.257 2.806 1.00 1.00 H new ATOM 0 HD12 ILE A 5 -0.059 3.763 1.204 1.00 1.00 H new ATOM 0 HD13 ILE A 5 1.669 3.416 1.449 1.00 1.00 H new ATOM 84 N THR A 6 3.268 6.343 -1.751 1.00 1.00 N ATOM 85 CA THR A 6 3.577 7.116 -2.981 1.00 1.00 C ATOM 86 C THR A 6 2.666 6.677 -4.130 1.00 1.00 C ATOM 87 O THR A 6 2.631 5.504 -4.498 1.00 1.00 O ATOM 88 CB THR A 6 5.048 6.909 -3.389 1.00 1.00 C ATOM 89 OG1 THR A 6 5.246 5.556 -3.781 1.00 1.00 O ATOM 90 CG2 THR A 6 5.978 7.236 -2.208 1.00 1.00 C ATOM 0 H THR A 6 3.117 5.346 -1.907 1.00 1.00 H new ATOM 0 HA THR A 6 3.407 8.172 -2.771 1.00 1.00 H new ATOM 0 HB THR A 6 5.280 7.573 -4.221 1.00 1.00 H new ATOM 0 HG1 THR A 6 4.389 5.165 -4.050 1.00 1.00 H new ATOM 0 HG21 THR A 6 7.015 7.086 -2.509 1.00 1.00 H new ATOM 0 HG22 THR A 6 5.834 8.274 -1.908 1.00 1.00 H new ATOM 0 HG23 THR A 6 5.745 6.580 -1.369 1.00 1.00 H new ATOM 98 N LEU A 7 1.938 7.635 -4.693 1.00 1.00 N ATOM 99 CA LEU A 7 1.006 7.378 -5.813 1.00 1.00 C ATOM 100 C LEU A 7 1.513 8.046 -7.097 1.00 1.00 C ATOM 101 O LEU A 7 2.192 9.073 -7.055 1.00 1.00 O ATOM 102 CB LEU A 7 -0.397 7.936 -5.454 1.00 1.00 C ATOM 103 CG LEU A 7 -0.893 7.391 -4.076 1.00 1.00 C ATOM 104 CD1 LEU A 7 -2.300 7.960 -3.777 1.00 1.00 C ATOM 105 CD2 LEU A 7 -0.945 5.837 -4.062 1.00 1.00 C ATOM 0 H LEU A 7 1.968 8.610 -4.396 1.00 1.00 H new ATOM 0 HA LEU A 7 0.943 6.303 -5.981 1.00 1.00 H new ATOM 0 HB2 LEU A 7 -0.360 9.025 -5.424 1.00 1.00 H new ATOM 0 HB3 LEU A 7 -1.109 7.662 -6.233 1.00 1.00 H new ATOM 0 HG LEU A 7 -0.187 7.710 -3.309 1.00 1.00 H new ATOM 0 HD11 LEU A 7 -2.649 7.582 -2.816 1.00 1.00 H new ATOM 0 HD12 LEU A 7 -2.253 9.048 -3.743 1.00 1.00 H new ATOM 0 HD13 LEU A 7 -2.991 7.651 -4.561 1.00 1.00 H new ATOM 0 HD21 LEU A 7 -1.294 5.493 -3.088 1.00 1.00 H new ATOM 0 HD22 LEU A 7 -1.629 5.489 -4.836 1.00 1.00 H new ATOM 0 HD23 LEU A 7 0.051 5.438 -4.252 1.00 1.00 H new ATOM 117 N SER A 8 1.171 7.449 -8.234 1.00 1.00 N ATOM 118 CA SER A 8 1.587 7.983 -9.545 1.00 1.00 C ATOM 119 C SER A 8 0.666 9.121 -9.971 1.00 1.00 C ATOM 120 O SER A 8 0.474 9.359 -11.164 1.00 1.00 O ATOM 121 CB SER A 8 1.548 6.868 -10.604 1.00 1.00 C ATOM 122 OG SER A 8 0.220 6.376 -10.724 1.00 1.00 O ATOM 0 H SER A 8 0.610 6.599 -8.284 1.00 1.00 H new ATOM 0 HA SER A 8 2.605 8.363 -9.456 1.00 1.00 H new ATOM 0 HB2 SER A 8 1.894 7.251 -11.564 1.00 1.00 H new ATOM 0 HB3 SER A 8 2.223 6.060 -10.322 1.00 1.00 H new ATOM 0 HG SER A 8 0.194 5.667 -11.400 1.00 1.00 H new ATOM 128 N LYS A 9 0.098 9.819 -8.993 1.00 1.00 N ATOM 129 CA LYS A 9 -0.808 10.941 -9.274 1.00 1.00 C ATOM 130 C LYS A 9 -0.001 12.160 -9.764 1.00 1.00 C ATOM 131 O LYS A 9 -0.190 13.275 -9.278 1.00 1.00 O ATOM 132 CB LYS A 9 -1.641 11.283 -8.001 1.00 1.00 C ATOM 133 CG LYS A 9 -2.857 12.186 -8.350 1.00 1.00 C ATOM 134 CD LYS A 9 -3.699 12.470 -7.088 1.00 1.00 C ATOM 135 CE LYS A 9 -4.882 13.394 -7.444 1.00 1.00 C ATOM 136 NZ LYS A 9 -5.708 12.760 -8.513 1.00 1.00 N ATOM 0 H LYS A 9 0.244 9.633 -8.001 1.00 1.00 H new ATOM 0 HA LYS A 9 -1.503 10.659 -10.065 1.00 1.00 H new ATOM 0 HB2 LYS A 9 -1.991 10.362 -7.534 1.00 1.00 H new ATOM 0 HB3 LYS A 9 -1.006 11.789 -7.273 1.00 1.00 H new ATOM 0 HG2 LYS A 9 -2.509 13.125 -8.781 1.00 1.00 H new ATOM 0 HG3 LYS A 9 -3.475 11.699 -9.104 1.00 1.00 H new ATOM 0 HD2 LYS A 9 -4.070 11.534 -6.669 1.00 1.00 H new ATOM 0 HD3 LYS A 9 -3.078 12.937 -6.323 1.00 1.00 H new ATOM 0 HE2 LYS A 9 -5.492 13.578 -6.560 1.00 1.00 H new ATOM 0 HE3 LYS A 9 -4.512 14.362 -7.782 1.00 1.00 H new ATOM 0 HZ1 LYS A 9 -5.659 13.336 -9.377 1.00 1.00 H new ATOM 0 HZ2 LYS A 9 -5.346 11.806 -8.712 1.00 1.00 H new ATOM 0 HZ3 LYS A 9 -6.696 12.696 -8.196 1.00 1.00 H new ATOM 150 N GLU A 10 0.884 11.933 -10.731 1.00 1.00 N ATOM 151 CA GLU A 10 1.717 13.010 -11.290 1.00 1.00 C ATOM 152 C GLU A 10 0.831 14.167 -11.797 1.00 1.00 C ATOM 153 O GLU A 10 1.258 15.321 -11.851 1.00 1.00 O ATOM 154 CB GLU A 10 2.589 12.440 -12.458 1.00 1.00 C ATOM 155 CG GLU A 10 1.715 11.564 -13.422 1.00 1.00 C ATOM 156 CD GLU A 10 2.363 11.432 -14.810 1.00 1.00 C ATOM 157 OE1 GLU A 10 3.179 10.545 -14.984 1.00 1.00 O ATOM 158 OE2 GLU A 10 2.014 12.219 -15.678 1.00 1.00 O ATOM 0 H GLU A 10 1.048 11.016 -11.148 1.00 1.00 H new ATOM 0 HA GLU A 10 2.371 13.398 -10.510 1.00 1.00 H new ATOM 0 HB2 GLU A 10 3.043 13.260 -13.014 1.00 1.00 H new ATOM 0 HB3 GLU A 10 3.404 11.841 -12.052 1.00 1.00 H new ATOM 0 HG2 GLU A 10 1.576 10.573 -12.989 1.00 1.00 H new ATOM 0 HG3 GLU A 10 0.725 12.010 -13.523 1.00 1.00 H new ATOM 165 N THR A 11 -0.403 13.835 -12.160 1.00 1.00 N ATOM 166 CA THR A 11 -1.369 14.853 -12.667 1.00 1.00 C ATOM 167 C THR A 11 -2.763 14.703 -11.986 1.00 1.00 C ATOM 168 O THR A 11 -3.227 13.571 -11.852 1.00 1.00 O ATOM 169 CB THR A 11 -1.515 14.689 -14.202 1.00 1.00 C ATOM 170 OG1 THR A 11 -2.356 15.720 -14.705 1.00 1.00 O ATOM 171 CG2 THR A 11 -2.124 13.313 -14.565 1.00 1.00 C ATOM 0 H THR A 11 -0.773 12.885 -12.121 1.00 1.00 H new ATOM 0 HA THR A 11 -0.986 15.845 -12.428 1.00 1.00 H new ATOM 0 HB THR A 11 -0.523 14.754 -14.649 1.00 1.00 H new ATOM 0 HG1 THR A 11 -2.450 15.621 -15.675 1.00 1.00 H new ATOM 0 HG21 THR A 11 -2.213 13.229 -15.648 1.00 1.00 H new ATOM 0 HG22 THR A 11 -1.477 12.519 -14.192 1.00 1.00 H new ATOM 0 HG23 THR A 11 -3.111 13.221 -14.111 1.00 1.00 H new ATOM 179 N PRO A 12 -3.418 15.770 -11.616 1.00 1.00 N ATOM 180 CA PRO A 12 -4.785 15.640 -10.988 1.00 1.00 C ATOM 181 C PRO A 12 -5.878 15.382 -12.050 1.00 1.00 C ATOM 182 O PRO A 12 -6.171 16.251 -12.874 1.00 1.00 O ATOM 183 CB PRO A 12 -4.968 17.005 -10.283 1.00 1.00 C ATOM 184 CG PRO A 12 -4.281 17.969 -11.209 1.00 1.00 C ATOM 185 CD PRO A 12 -3.017 17.214 -11.693 1.00 1.00 C ATOM 0 HA PRO A 12 -4.869 14.795 -10.305 1.00 1.00 H new ATOM 0 HB2 PRO A 12 -6.022 17.253 -10.154 1.00 1.00 H new ATOM 0 HB3 PRO A 12 -4.516 17.009 -9.291 1.00 1.00 H new ATOM 0 HG2 PRO A 12 -4.924 18.242 -12.046 1.00 1.00 H new ATOM 0 HG3 PRO A 12 -4.018 18.893 -10.695 1.00 1.00 H new ATOM 0 HD2 PRO A 12 -2.743 17.500 -12.708 1.00 1.00 H new ATOM 0 HD3 PRO A 12 -2.156 17.426 -11.059 1.00 1.00 H new ATOM 193 N PHE A 13 -6.475 14.195 -12.008 1.00 1.00 N ATOM 194 CA PHE A 13 -7.543 13.840 -12.963 1.00 1.00 C ATOM 195 C PHE A 13 -8.280 12.566 -12.506 1.00 1.00 C ATOM 196 O PHE A 13 -7.803 11.452 -12.721 1.00 1.00 O ATOM 197 CB PHE A 13 -6.948 13.632 -14.385 1.00 1.00 C ATOM 198 CG PHE A 13 -8.078 13.631 -15.436 1.00 1.00 C ATOM 199 CD1 PHE A 13 -8.842 12.469 -15.654 1.00 1.00 C ATOM 200 CD2 PHE A 13 -8.371 14.798 -16.175 1.00 1.00 C ATOM 201 CE1 PHE A 13 -9.875 12.471 -16.599 1.00 1.00 C ATOM 202 CE2 PHE A 13 -9.408 14.793 -17.117 1.00 1.00 C ATOM 203 CZ PHE A 13 -10.159 13.631 -17.330 1.00 1.00 C ATOM 0 H PHE A 13 -6.248 13.463 -11.335 1.00 1.00 H new ATOM 0 HA PHE A 13 -8.259 14.661 -12.996 1.00 1.00 H new ATOM 0 HB2 PHE A 13 -6.233 14.424 -14.608 1.00 1.00 H new ATOM 0 HB3 PHE A 13 -6.402 12.689 -14.425 1.00 1.00 H new ATOM 0 HD1 PHE A 13 -8.631 11.572 -15.090 1.00 1.00 H new ATOM 0 HD2 PHE A 13 -7.794 15.697 -16.014 1.00 1.00 H new ATOM 0 HE1 PHE A 13 -10.455 11.575 -16.765 1.00 1.00 H new ATOM 0 HE2 PHE A 13 -9.629 15.688 -17.680 1.00 1.00 H new ATOM 0 HZ PHE A 13 -10.957 13.629 -18.058 1.00 1.00 H new ATOM 213 N GLU A 14 -9.438 12.750 -11.881 1.00 1.00 N ATOM 214 CA GLU A 14 -10.235 11.609 -11.394 1.00 1.00 C ATOM 215 C GLU A 14 -10.520 10.614 -12.538 1.00 1.00 C ATOM 216 O GLU A 14 -10.661 11.010 -13.695 1.00 1.00 O ATOM 217 CB GLU A 14 -11.555 12.119 -10.766 1.00 1.00 C ATOM 218 CG GLU A 14 -12.322 10.967 -10.072 1.00 1.00 C ATOM 219 CD GLU A 14 -13.602 11.496 -9.420 1.00 1.00 C ATOM 220 OE1 GLU A 14 -14.381 12.125 -10.119 1.00 1.00 O ATOM 221 OE2 GLU A 14 -13.789 11.255 -8.239 1.00 1.00 O ATOM 0 H GLU A 14 -9.850 13.665 -11.697 1.00 1.00 H new ATOM 0 HA GLU A 14 -9.664 11.083 -10.629 1.00 1.00 H new ATOM 0 HB2 GLU A 14 -11.338 12.904 -10.042 1.00 1.00 H new ATOM 0 HB3 GLU A 14 -12.182 12.564 -11.539 1.00 1.00 H new ATOM 0 HG2 GLU A 14 -12.570 10.195 -10.801 1.00 1.00 H new ATOM 0 HG3 GLU A 14 -11.688 10.501 -9.318 1.00 1.00 H new ATOM 228 N GLY A 15 -10.587 9.331 -12.199 1.00 1.00 N ATOM 229 CA GLY A 15 -10.843 8.270 -13.197 1.00 1.00 C ATOM 230 C GLY A 15 -9.533 7.735 -13.765 1.00 1.00 C ATOM 231 O GLY A 15 -9.479 6.608 -14.259 1.00 1.00 O ATOM 0 H GLY A 15 -10.469 8.989 -11.245 1.00 1.00 H new ATOM 0 HA2 GLY A 15 -11.403 7.457 -12.735 1.00 1.00 H new ATOM 0 HA3 GLY A 15 -11.461 8.665 -14.004 1.00 1.00 H new ATOM 235 N GLU A 16 -8.481 8.543 -13.686 1.00 1.00 N ATOM 236 CA GLU A 16 -7.162 8.138 -14.201 1.00 1.00 C ATOM 237 C GLU A 16 -6.590 7.020 -13.332 1.00 1.00 C ATOM 238 O GLU A 16 -6.679 7.065 -12.104 1.00 1.00 O ATOM 239 CB GLU A 16 -6.200 9.357 -14.218 1.00 1.00 C ATOM 240 CG GLU A 16 -4.842 9.013 -14.901 1.00 1.00 C ATOM 241 CD GLU A 16 -5.030 8.711 -16.394 1.00 1.00 C ATOM 242 OE1 GLU A 16 -5.978 9.219 -16.973 1.00 1.00 O ATOM 243 OE2 GLU A 16 -4.224 7.970 -16.933 1.00 1.00 O ATOM 0 H GLU A 16 -8.507 9.476 -13.275 1.00 1.00 H new ATOM 0 HA GLU A 16 -7.273 7.770 -15.221 1.00 1.00 H new ATOM 0 HB2 GLU A 16 -6.673 10.186 -14.745 1.00 1.00 H new ATOM 0 HB3 GLU A 16 -6.019 9.691 -13.196 1.00 1.00 H new ATOM 0 HG2 GLU A 16 -4.150 9.847 -14.781 1.00 1.00 H new ATOM 0 HG3 GLU A 16 -4.392 8.152 -14.407 1.00 1.00 H new ATOM 250 N GLU A 17 -5.993 6.023 -13.978 1.00 1.00 N ATOM 251 CA GLU A 17 -5.405 4.898 -13.255 1.00 1.00 C ATOM 252 C GLU A 17 -4.189 5.381 -12.450 1.00 1.00 C ATOM 253 O GLU A 17 -3.357 6.141 -12.943 1.00 1.00 O ATOM 254 CB GLU A 17 -4.997 3.786 -14.251 1.00 1.00 C ATOM 255 CG GLU A 17 -4.587 2.497 -13.495 1.00 1.00 C ATOM 256 CD GLU A 17 -4.166 1.408 -14.485 1.00 1.00 C ATOM 257 OE1 GLU A 17 -3.317 1.691 -15.317 1.00 1.00 O ATOM 258 OE2 GLU A 17 -4.699 0.313 -14.404 1.00 1.00 O ATOM 0 H GLU A 17 -5.903 5.970 -14.993 1.00 1.00 H new ATOM 0 HA GLU A 17 -6.140 4.486 -12.563 1.00 1.00 H new ATOM 0 HB2 GLU A 17 -5.827 3.571 -14.923 1.00 1.00 H new ATOM 0 HB3 GLU A 17 -4.168 4.131 -14.869 1.00 1.00 H new ATOM 0 HG2 GLU A 17 -3.765 2.714 -12.812 1.00 1.00 H new ATOM 0 HG3 GLU A 17 -5.420 2.143 -12.888 1.00 1.00 H new ATOM 265 N ILE A 18 -4.097 4.916 -11.207 1.00 1.00 N ATOM 266 CA ILE A 18 -2.975 5.288 -10.305 1.00 1.00 C ATOM 267 C ILE A 18 -2.294 4.033 -9.764 1.00 1.00 C ATOM 268 O ILE A 18 -2.933 3.002 -9.554 1.00 1.00 O ATOM 269 CB ILE A 18 -3.499 6.183 -9.140 1.00 1.00 C ATOM 270 CG1 ILE A 18 -4.642 5.459 -8.357 1.00 1.00 C ATOM 271 CG2 ILE A 18 -4.019 7.528 -9.711 1.00 1.00 C ATOM 272 CD1 ILE A 18 -5.052 6.277 -7.114 1.00 1.00 C ATOM 0 H ILE A 18 -4.777 4.281 -10.788 1.00 1.00 H new ATOM 0 HA ILE A 18 -2.238 5.858 -10.871 1.00 1.00 H new ATOM 0 HB ILE A 18 -2.678 6.374 -8.449 1.00 1.00 H new ATOM 0 HG12 ILE A 18 -5.505 5.320 -9.008 1.00 1.00 H new ATOM 0 HG13 ILE A 18 -4.309 4.467 -8.052 1.00 1.00 H new ATOM 0 HG21 ILE A 18 -4.385 8.152 -8.896 1.00 1.00 H new ATOM 0 HG22 ILE A 18 -3.208 8.042 -10.226 1.00 1.00 H new ATOM 0 HG23 ILE A 18 -4.830 7.336 -10.413 1.00 1.00 H new ATOM 0 HD11 ILE A 18 -5.849 5.757 -6.582 1.00 1.00 H new ATOM 0 HD12 ILE A 18 -4.192 6.393 -6.455 1.00 1.00 H new ATOM 0 HD13 ILE A 18 -5.406 7.260 -7.426 1.00 1.00 H new ATOM 284 N THR A 19 -0.990 4.138 -9.528 1.00 1.00 N ATOM 285 CA THR A 19 -0.197 3.012 -9.003 1.00 1.00 C ATOM 286 C THR A 19 -0.070 3.144 -7.488 1.00 1.00 C ATOM 287 O THR A 19 0.568 4.068 -6.983 1.00 1.00 O ATOM 288 CB THR A 19 1.207 3.016 -9.656 1.00 1.00 C ATOM 289 OG1 THR A 19 1.055 3.051 -11.067 1.00 1.00 O ATOM 290 CG2 THR A 19 2.002 1.748 -9.272 1.00 1.00 C ATOM 0 H THR A 19 -0.452 4.989 -9.690 1.00 1.00 H new ATOM 0 HA THR A 19 -0.695 2.072 -9.240 1.00 1.00 H new ATOM 0 HB THR A 19 1.753 3.890 -9.302 1.00 1.00 H new ATOM 0 HG1 THR A 19 1.938 3.056 -11.491 1.00 1.00 H new ATOM 0 HG21 THR A 19 2.984 1.777 -9.744 1.00 1.00 H new ATOM 0 HG22 THR A 19 2.121 1.707 -8.189 1.00 1.00 H new ATOM 0 HG23 THR A 19 1.462 0.864 -9.611 1.00 1.00 H new ATOM 298 N VAL A 20 -0.670 2.201 -6.770 1.00 1.00 N ATOM 299 CA VAL A 20 -0.619 2.211 -5.296 1.00 1.00 C ATOM 300 C VAL A 20 0.524 1.315 -4.820 1.00 1.00 C ATOM 301 O VAL A 20 0.561 0.126 -5.135 1.00 1.00 O ATOM 302 CB VAL A 20 -1.976 1.724 -4.709 1.00 1.00 C ATOM 303 CG1 VAL A 20 -1.996 1.916 -3.164 1.00 1.00 C ATOM 304 CG2 VAL A 20 -3.134 2.537 -5.338 1.00 1.00 C ATOM 0 H VAL A 20 -1.195 1.424 -7.171 1.00 1.00 H new ATOM 0 HA VAL A 20 -0.441 3.228 -4.947 1.00 1.00 H new ATOM 0 HB VAL A 20 -2.098 0.666 -4.939 1.00 1.00 H new ATOM 0 HG11 VAL A 20 -2.951 1.571 -2.767 1.00 1.00 H new ATOM 0 HG12 VAL A 20 -1.187 1.340 -2.715 1.00 1.00 H new ATOM 0 HG13 VAL A 20 -1.864 2.972 -2.927 1.00 1.00 H new ATOM 0 HG21 VAL A 20 -4.084 2.195 -4.927 1.00 1.00 H new ATOM 0 HG22 VAL A 20 -3.000 3.595 -5.112 1.00 1.00 H new ATOM 0 HG23 VAL A 20 -3.134 2.394 -6.419 1.00 1.00 H new ATOM 314 N SER A 21 1.445 1.888 -4.050 1.00 1.00 N ATOM 315 CA SER A 21 2.604 1.155 -3.510 1.00 1.00 C ATOM 316 C SER A 21 2.703 1.373 -2.006 1.00 1.00 C ATOM 317 O SER A 21 2.638 2.501 -1.517 1.00 1.00 O ATOM 318 CB SER A 21 3.903 1.642 -4.189 1.00 1.00 C ATOM 319 OG SER A 21 3.781 1.480 -5.595 1.00 1.00 O ATOM 0 H SER A 21 1.416 2.871 -3.779 1.00 1.00 H new ATOM 0 HA SER A 21 2.471 0.092 -3.712 1.00 1.00 H new ATOM 0 HB2 SER A 21 4.085 2.689 -3.945 1.00 1.00 H new ATOM 0 HB3 SER A 21 4.757 1.075 -3.818 1.00 1.00 H new ATOM 0 HG SER A 21 4.602 1.789 -6.032 1.00 1.00 H new ATOM 325 N ALA A 22 2.891 0.277 -1.277 1.00 1.00 N ATOM 326 CA ALA A 22 3.009 0.319 0.194 1.00 1.00 C ATOM 327 C ALA A 22 4.324 -0.330 0.625 1.00 1.00 C ATOM 328 O ALA A 22 4.593 -1.489 0.310 1.00 1.00 O ATOM 329 CB ALA A 22 1.820 -0.437 0.813 1.00 1.00 C ATOM 0 H ALA A 22 2.966 -0.659 -1.674 1.00 1.00 H new ATOM 0 HA ALA A 22 3.000 1.354 0.536 1.00 1.00 H new ATOM 0 HB1 ALA A 22 1.899 -0.411 1.900 1.00 1.00 H new ATOM 0 HB2 ALA A 22 0.888 0.037 0.505 1.00 1.00 H new ATOM 0 HB3 ALA A 22 1.830 -1.473 0.473 1.00 1.00 H new ATOM 335 N ARG A 23 5.133 0.429 1.357 1.00 1.00 N ATOM 336 CA ARG A 23 6.426 -0.068 1.839 1.00 1.00 C ATOM 337 C ARG A 23 6.225 -0.958 3.074 1.00 1.00 C ATOM 338 O ARG A 23 5.353 -0.690 3.899 1.00 1.00 O ATOM 339 CB ARG A 23 7.375 1.115 2.173 1.00 1.00 C ATOM 340 CG ARG A 23 6.735 2.086 3.213 1.00 1.00 C ATOM 341 CD ARG A 23 7.809 3.030 3.795 1.00 1.00 C ATOM 342 NE ARG A 23 8.839 2.256 4.489 1.00 1.00 N ATOM 343 CZ ARG A 23 9.873 2.844 5.105 1.00 1.00 C ATOM 344 NH1 ARG A 23 9.987 4.149 5.117 1.00 1.00 N ATOM 345 NH2 ARG A 23 10.766 2.111 5.704 1.00 1.00 N ATOM 0 H ARG A 23 4.921 1.388 1.631 1.00 1.00 H new ATOM 0 HA ARG A 23 6.885 -0.663 1.050 1.00 1.00 H new ATOM 0 HB2 ARG A 23 8.316 0.729 2.565 1.00 1.00 H new ATOM 0 HB3 ARG A 23 7.611 1.662 1.260 1.00 1.00 H new ATOM 0 HG2 ARG A 23 5.946 2.670 2.738 1.00 1.00 H new ATOM 0 HG3 ARG A 23 6.269 1.515 4.016 1.00 1.00 H new ATOM 0 HD2 ARG A 23 8.261 3.616 2.995 1.00 1.00 H new ATOM 0 HD3 ARG A 23 7.348 3.736 4.485 1.00 1.00 H new ATOM 0 HE ARG A 23 8.767 1.239 4.504 1.00 1.00 H new ATOM 0 HH11 ARG A 23 9.285 4.727 4.655 1.00 1.00 H new ATOM 0 HH12 ARG A 23 10.778 4.588 5.589 1.00 1.00 H new ATOM 0 HH21 ARG A 23 10.676 1.095 5.703 1.00 1.00 H new ATOM 0 HH22 ARG A 23 11.556 2.553 6.175 1.00 1.00 H new ATOM 359 N VAL A 24 7.045 -1.998 3.198 1.00 1.00 N ATOM 360 CA VAL A 24 6.974 -2.928 4.348 1.00 1.00 C ATOM 361 C VAL A 24 8.357 -3.098 4.972 1.00 1.00 C ATOM 362 O VAL A 24 9.343 -3.292 4.262 1.00 1.00 O ATOM 363 CB VAL A 24 6.412 -4.302 3.876 1.00 1.00 C ATOM 364 CG1 VAL A 24 7.306 -4.955 2.799 1.00 1.00 C ATOM 365 CG2 VAL A 24 6.257 -5.274 5.076 1.00 1.00 C ATOM 0 H VAL A 24 7.772 -2.228 2.520 1.00 1.00 H new ATOM 0 HA VAL A 24 6.306 -2.516 5.104 1.00 1.00 H new ATOM 0 HB VAL A 24 5.434 -4.108 3.435 1.00 1.00 H new ATOM 0 HG11 VAL A 24 6.876 -5.911 2.500 1.00 1.00 H new ATOM 0 HG12 VAL A 24 7.370 -4.298 1.932 1.00 1.00 H new ATOM 0 HG13 VAL A 24 8.304 -5.118 3.205 1.00 1.00 H new ATOM 0 HG21 VAL A 24 5.863 -6.227 4.724 1.00 1.00 H new ATOM 0 HG22 VAL A 24 7.229 -5.433 5.543 1.00 1.00 H new ATOM 0 HG23 VAL A 24 5.570 -4.845 5.805 1.00 1.00 H new ATOM 375 N THR A 25 8.420 -3.058 6.301 1.00 1.00 N ATOM 376 CA THR A 25 9.700 -3.221 7.031 1.00 1.00 C ATOM 377 C THR A 25 9.801 -4.644 7.583 1.00 1.00 C ATOM 378 O THR A 25 8.926 -5.097 8.322 1.00 1.00 O ATOM 379 CB THR A 25 9.775 -2.194 8.185 1.00 1.00 C ATOM 380 OG1 THR A 25 9.653 -0.887 7.638 1.00 1.00 O ATOM 381 CG2 THR A 25 11.123 -2.292 8.941 1.00 1.00 C ATOM 0 H THR A 25 7.609 -2.915 6.903 1.00 1.00 H new ATOM 0 HA THR A 25 10.532 -3.047 6.348 1.00 1.00 H new ATOM 0 HB THR A 25 8.969 -2.404 8.888 1.00 1.00 H new ATOM 0 HG1 THR A 25 9.697 -0.225 8.359 1.00 1.00 H new ATOM 0 HG21 THR A 25 11.143 -1.557 9.746 1.00 1.00 H new ATOM 0 HG22 THR A 25 11.233 -3.292 9.360 1.00 1.00 H new ATOM 0 HG23 THR A 25 11.943 -2.096 8.250 1.00 1.00 H new ATOM 389 N ASN A 26 10.875 -5.338 7.221 1.00 1.00 N ATOM 390 CA ASN A 26 11.096 -6.708 7.685 1.00 1.00 C ATOM 391 C ASN A 26 11.709 -6.696 9.088 1.00 1.00 C ATOM 392 O ASN A 26 12.795 -6.162 9.309 1.00 1.00 O ATOM 393 CB ASN A 26 12.022 -7.445 6.707 1.00 1.00 C ATOM 394 CG ASN A 26 12.231 -8.893 7.152 1.00 1.00 C ATOM 395 OD1 ASN A 26 13.335 -9.427 7.042 1.00 1.00 O ATOM 396 ND2 ASN A 26 11.225 -9.556 7.655 1.00 1.00 N ATOM 0 H ASN A 26 11.607 -4.977 6.609 1.00 1.00 H new ATOM 0 HA ASN A 26 10.139 -7.229 7.727 1.00 1.00 H new ATOM 0 HB2 ASN A 26 11.592 -7.425 5.706 1.00 1.00 H new ATOM 0 HB3 ASN A 26 12.983 -6.933 6.652 1.00 1.00 H new ATOM 0 HD21 ASN A 26 11.351 -10.521 7.959 1.00 1.00 H new ATOM 0 HD22 ASN A 26 10.313 -9.109 7.744 1.00 1.00 H new ATOM 403 N ARG A 27 10.993 -7.300 10.031 1.00 1.00 N ATOM 404 CA ARG A 27 11.441 -7.379 11.432 1.00 1.00 C ATOM 405 C ARG A 27 11.847 -8.815 11.771 1.00 1.00 C ATOM 406 O ARG A 27 11.012 -9.647 12.129 1.00 1.00 O ATOM 407 CB ARG A 27 10.286 -6.919 12.344 1.00 1.00 C ATOM 408 CG ARG A 27 9.928 -5.445 12.032 1.00 1.00 C ATOM 409 CD ARG A 27 8.781 -4.974 12.941 1.00 1.00 C ATOM 410 NE ARG A 27 9.219 -5.030 14.337 1.00 1.00 N ATOM 411 CZ ARG A 27 8.400 -4.763 15.360 1.00 1.00 C ATOM 412 NH1 ARG A 27 7.149 -4.442 15.153 1.00 1.00 N ATOM 413 NH2 ARG A 27 8.859 -4.828 16.580 1.00 1.00 N ATOM 0 H ARG A 27 10.093 -7.747 9.856 1.00 1.00 H new ATOM 0 HA ARG A 27 12.307 -6.735 11.584 1.00 1.00 H new ATOM 0 HB2 ARG A 27 9.414 -7.555 12.191 1.00 1.00 H new ATOM 0 HB3 ARG A 27 10.574 -7.019 13.390 1.00 1.00 H new ATOM 0 HG2 ARG A 27 10.803 -4.811 12.180 1.00 1.00 H new ATOM 0 HG3 ARG A 27 9.637 -5.347 10.986 1.00 1.00 H new ATOM 0 HD2 ARG A 27 8.488 -3.957 12.680 1.00 1.00 H new ATOM 0 HD3 ARG A 27 7.904 -5.605 12.797 1.00 1.00 H new ATOM 0 HE ARG A 27 10.187 -5.283 14.537 1.00 1.00 H new ATOM 0 HH11 ARG A 27 6.786 -4.393 14.201 1.00 1.00 H new ATOM 0 HH12 ARG A 27 6.537 -4.241 15.944 1.00 1.00 H new ATOM 0 HH21 ARG A 27 9.833 -5.080 16.746 1.00 1.00 H new ATOM 0 HH22 ARG A 27 8.243 -4.626 17.368 1.00 1.00 H new ATOM 427 N GLY A 28 13.144 -9.088 11.670 1.00 1.00 N ATOM 428 CA GLY A 28 13.669 -10.422 11.966 1.00 1.00 C ATOM 429 C GLY A 28 15.197 -10.420 11.968 1.00 1.00 C ATOM 430 O GLY A 28 15.832 -9.821 11.101 1.00 1.00 O ATOM 0 H GLY A 28 13.850 -8.409 11.387 1.00 1.00 H new ATOM 0 HA2 GLY A 28 13.301 -10.755 12.936 1.00 1.00 H new ATOM 0 HA3 GLY A 28 13.303 -11.133 11.225 1.00 1.00 H new ATOM 434 N ALA A 29 15.780 -11.099 12.952 1.00 1.00 N ATOM 435 CA ALA A 29 17.241 -11.184 13.072 1.00 1.00 C ATOM 436 C ALA A 29 17.810 -12.146 12.021 1.00 1.00 C ATOM 437 O ALA A 29 18.982 -12.518 12.078 1.00 1.00 O ATOM 438 CB ALA A 29 17.603 -11.671 14.487 1.00 1.00 C ATOM 0 H ALA A 29 15.268 -11.599 13.679 1.00 1.00 H new ATOM 0 HA ALA A 29 17.674 -10.198 12.902 1.00 1.00 H new ATOM 0 HB1 ALA A 29 18.687 -11.736 14.583 1.00 1.00 H new ATOM 0 HB2 ALA A 29 17.215 -10.968 15.224 1.00 1.00 H new ATOM 0 HB3 ALA A 29 17.164 -12.654 14.657 1.00 1.00 H new ATOM 444 N ALA A 30 16.971 -12.538 11.069 1.00 1.00 N ATOM 445 CA ALA A 30 17.381 -13.467 9.995 1.00 1.00 C ATOM 446 C ALA A 30 16.628 -13.162 8.696 1.00 1.00 C ATOM 447 O ALA A 30 15.629 -12.441 8.692 1.00 1.00 O ATOM 448 CB ALA A 30 17.098 -14.915 10.439 1.00 1.00 C ATOM 0 H ALA A 30 16.000 -12.233 11.009 1.00 1.00 H new ATOM 0 HA ALA A 30 18.447 -13.341 9.808 1.00 1.00 H new ATOM 0 HB1 ALA A 30 17.399 -15.603 9.649 1.00 1.00 H new ATOM 0 HB2 ALA A 30 17.662 -15.134 11.346 1.00 1.00 H new ATOM 0 HB3 ALA A 30 16.033 -15.033 10.637 1.00 1.00 H new ATOM 454 N GLU A 31 17.121 -13.723 7.598 1.00 1.00 N ATOM 455 CA GLU A 31 16.498 -13.503 6.280 1.00 1.00 C ATOM 456 C GLU A 31 15.029 -13.951 6.297 1.00 1.00 C ATOM 457 O GLU A 31 14.729 -15.087 6.665 1.00 1.00 O ATOM 458 CB GLU A 31 17.270 -14.293 5.200 1.00 1.00 C ATOM 459 CG GLU A 31 18.725 -13.780 5.100 1.00 1.00 C ATOM 460 CD GLU A 31 19.512 -14.559 4.041 1.00 1.00 C ATOM 461 OE1 GLU A 31 19.141 -15.686 3.752 1.00 1.00 O ATOM 462 OE2 GLU A 31 20.476 -14.009 3.535 1.00 1.00 O ATOM 0 H GLU A 31 17.941 -14.329 7.584 1.00 1.00 H new ATOM 0 HA GLU A 31 16.536 -12.438 6.050 1.00 1.00 H new ATOM 0 HB2 GLU A 31 17.267 -15.355 5.445 1.00 1.00 H new ATOM 0 HB3 GLU A 31 16.772 -14.187 4.236 1.00 1.00 H new ATOM 0 HG2 GLU A 31 18.724 -12.719 4.849 1.00 1.00 H new ATOM 0 HG3 GLU A 31 19.216 -13.878 6.068 1.00 1.00 H new ATOM 469 N ALA A 32 14.128 -13.053 5.910 1.00 1.00 N ATOM 470 CA ALA A 32 12.682 -13.348 5.888 1.00 1.00 C ATOM 471 C ALA A 32 12.214 -13.557 4.460 1.00 1.00 C ATOM 472 O ALA A 32 12.782 -13.008 3.516 1.00 1.00 O ATOM 473 CB ALA A 32 11.912 -12.175 6.508 1.00 1.00 C ATOM 0 H ALA A 32 14.366 -12.109 5.605 1.00 1.00 H new ATOM 0 HA ALA A 32 12.496 -14.256 6.461 1.00 1.00 H new ATOM 0 HB1 ALA A 32 10.844 -12.392 6.492 1.00 1.00 H new ATOM 0 HB2 ALA A 32 12.238 -12.030 7.538 1.00 1.00 H new ATOM 0 HB3 ALA A 32 12.107 -11.268 5.935 1.00 1.00 H new ATOM 479 N HIS A 33 11.151 -14.343 4.307 1.00 1.00 N ATOM 480 CA HIS A 33 10.580 -14.635 2.996 1.00 1.00 C ATOM 481 C HIS A 33 9.073 -14.810 3.119 1.00 1.00 C ATOM 482 O HIS A 33 8.485 -14.677 4.191 1.00 1.00 O ATOM 483 CB HIS A 33 11.228 -15.908 2.415 1.00 1.00 C ATOM 484 CG HIS A 33 12.726 -15.730 2.350 1.00 1.00 C ATOM 485 ND1 HIS A 33 13.585 -16.386 3.221 1.00 1.00 N ATOM 486 CD2 HIS A 33 13.533 -14.967 1.534 1.00 1.00 C ATOM 487 CE1 HIS A 33 14.841 -16.011 2.914 1.00 1.00 C ATOM 488 NE2 HIS A 33 14.866 -15.148 1.894 1.00 1.00 N ATOM 0 H HIS A 33 10.665 -14.792 5.083 1.00 1.00 H new ATOM 0 HA HIS A 33 10.781 -13.804 2.320 1.00 1.00 H new ATOM 0 HB2 HIS A 33 10.981 -16.770 3.035 1.00 1.00 H new ATOM 0 HB3 HIS A 33 10.832 -16.108 1.419 1.00 1.00 H new ATOM 0 HD2 HIS A 33 13.185 -14.327 0.737 1.00 1.00 H new ATOM 0 HE1 HIS A 33 15.722 -16.365 3.430 1.00 1.00 H new ATOM 0 HE2 HIS A 33 15.686 -14.715 1.470 1.00 1.00 H new ATOM 497 N ASN A 34 8.450 -15.104 1.981 1.00 1.00 N ATOM 498 CA ASN A 34 6.985 -15.286 1.955 1.00 1.00 C ATOM 499 C ASN A 34 6.264 -14.134 2.696 1.00 1.00 C ATOM 500 O ASN A 34 5.533 -14.356 3.662 1.00 1.00 O ATOM 501 CB ASN A 34 6.617 -16.651 2.571 1.00 1.00 C ATOM 502 CG ASN A 34 5.117 -16.922 2.434 1.00 1.00 C ATOM 503 OD1 ASN A 34 4.396 -16.952 3.430 1.00 1.00 O ATOM 504 ND2 ASN A 34 4.610 -17.116 1.248 1.00 1.00 N ATOM 0 H ASN A 34 8.915 -15.221 1.080 1.00 1.00 H new ATOM 0 HA ASN A 34 6.652 -15.266 0.917 1.00 1.00 H new ATOM 0 HB2 ASN A 34 7.181 -17.442 2.077 1.00 1.00 H new ATOM 0 HB3 ASN A 34 6.900 -16.668 3.624 1.00 1.00 H new ATOM 0 HD21 ASN A 34 3.611 -17.294 1.143 1.00 1.00 H new ATOM 0 HD22 ASN A 34 5.212 -17.090 0.425 1.00 1.00 H new ATOM 511 N VAL A 35 6.485 -12.914 2.220 1.00 1.00 N ATOM 512 CA VAL A 35 5.867 -11.710 2.836 1.00 1.00 C ATOM 513 C VAL A 35 4.759 -11.158 1.909 1.00 1.00 C ATOM 514 O VAL A 35 5.045 -10.245 1.134 1.00 1.00 O ATOM 515 CB VAL A 35 6.967 -10.627 3.065 1.00 1.00 C ATOM 516 CG1 VAL A 35 6.383 -9.408 3.830 1.00 1.00 C ATOM 517 CG2 VAL A 35 8.126 -11.238 3.889 1.00 1.00 C ATOM 0 H VAL A 35 7.081 -12.716 1.416 1.00 1.00 H new ATOM 0 HA VAL A 35 5.421 -11.977 3.794 1.00 1.00 H new ATOM 0 HB VAL A 35 7.334 -10.291 2.095 1.00 1.00 H new ATOM 0 HG11 VAL A 35 7.165 -8.664 3.980 1.00 1.00 H new ATOM 0 HG12 VAL A 35 5.571 -8.969 3.250 1.00 1.00 H new ATOM 0 HG13 VAL A 35 6.002 -9.734 4.798 1.00 1.00 H new ATOM 0 HG21 VAL A 35 8.895 -10.483 4.050 1.00 1.00 H new ATOM 0 HG22 VAL A 35 7.747 -11.581 4.852 1.00 1.00 H new ATOM 0 HG23 VAL A 35 8.553 -12.081 3.346 1.00 1.00 H new ATOM 527 N PRO A 36 3.556 -11.663 1.974 1.00 1.00 N ATOM 528 CA PRO A 36 2.456 -11.139 1.092 1.00 1.00 C ATOM 529 C PRO A 36 1.897 -9.820 1.611 1.00 1.00 C ATOM 530 O PRO A 36 2.055 -9.464 2.778 1.00 1.00 O ATOM 531 CB PRO A 36 1.411 -12.277 1.135 1.00 1.00 C ATOM 532 CG PRO A 36 1.517 -12.773 2.544 1.00 1.00 C ATOM 533 CD PRO A 36 3.037 -12.782 2.833 1.00 1.00 C ATOM 0 HA PRO A 36 2.786 -10.907 0.080 1.00 1.00 H new ATOM 0 HB2 PRO A 36 0.408 -11.914 0.908 1.00 1.00 H new ATOM 0 HB3 PRO A 36 1.637 -13.061 0.412 1.00 1.00 H new ATOM 0 HG2 PRO A 36 0.984 -12.121 3.236 1.00 1.00 H new ATOM 0 HG3 PRO A 36 1.086 -13.769 2.649 1.00 1.00 H new ATOM 0 HD2 PRO A 36 3.247 -12.610 3.889 1.00 1.00 H new ATOM 0 HD3 PRO A 36 3.492 -13.737 2.569 1.00 1.00 H new ATOM 541 N VAL A 37 1.230 -9.097 0.718 1.00 1.00 N ATOM 542 CA VAL A 37 0.621 -7.799 1.062 1.00 1.00 C ATOM 543 C VAL A 37 -0.741 -7.669 0.395 1.00 1.00 C ATOM 544 O VAL A 37 -0.935 -8.066 -0.755 1.00 1.00 O ATOM 545 CB VAL A 37 1.562 -6.636 0.622 1.00 1.00 C ATOM 546 CG1 VAL A 37 1.759 -6.619 -0.916 1.00 1.00 C ATOM 547 CG2 VAL A 37 1.002 -5.265 1.088 1.00 1.00 C ATOM 0 H VAL A 37 1.092 -9.380 -0.252 1.00 1.00 H new ATOM 0 HA VAL A 37 0.483 -7.743 2.142 1.00 1.00 H new ATOM 0 HB VAL A 37 2.529 -6.807 1.095 1.00 1.00 H new ATOM 0 HG11 VAL A 37 2.420 -5.796 -1.189 1.00 1.00 H new ATOM 0 HG12 VAL A 37 2.202 -7.562 -1.237 1.00 1.00 H new ATOM 0 HG13 VAL A 37 0.794 -6.487 -1.405 1.00 1.00 H new ATOM 0 HG21 VAL A 37 1.676 -4.470 0.769 1.00 1.00 H new ATOM 0 HG22 VAL A 37 0.018 -5.105 0.648 1.00 1.00 H new ATOM 0 HG23 VAL A 37 0.919 -5.256 2.175 1.00 1.00 H new ATOM 557 N ALA A 38 -1.683 -7.083 1.127 1.00 1.00 N ATOM 558 CA ALA A 38 -3.050 -6.875 0.627 1.00 1.00 C ATOM 559 C ALA A 38 -3.461 -5.434 0.859 1.00 1.00 C ATOM 560 O ALA A 38 -3.363 -4.924 1.976 1.00 1.00 O ATOM 561 CB ALA A 38 -4.013 -7.808 1.384 1.00 1.00 C ATOM 0 H ALA A 38 -1.529 -6.740 2.075 1.00 1.00 H new ATOM 0 HA ALA A 38 -3.086 -7.095 -0.440 1.00 1.00 H new ATOM 0 HB1 ALA A 38 -5.028 -7.658 1.017 1.00 1.00 H new ATOM 0 HB2 ALA A 38 -3.718 -8.845 1.222 1.00 1.00 H new ATOM 0 HB3 ALA A 38 -3.975 -7.583 2.450 1.00 1.00 H new ATOM 567 N VAL A 39 -3.951 -4.785 -0.192 1.00 1.00 N ATOM 568 CA VAL A 39 -4.394 -3.387 -0.124 1.00 1.00 C ATOM 569 C VAL A 39 -5.881 -3.314 -0.461 1.00 1.00 C ATOM 570 O VAL A 39 -6.397 -4.074 -1.280 1.00 1.00 O ATOM 571 CB VAL A 39 -3.563 -2.533 -1.126 1.00 1.00 C ATOM 572 CG1 VAL A 39 -3.867 -1.027 -0.935 1.00 1.00 C ATOM 573 CG2 VAL A 39 -2.051 -2.787 -0.896 1.00 1.00 C ATOM 0 H VAL A 39 -4.054 -5.207 -1.115 1.00 1.00 H new ATOM 0 HA VAL A 39 -4.241 -2.994 0.881 1.00 1.00 H new ATOM 0 HB VAL A 39 -3.835 -2.822 -2.141 1.00 1.00 H new ATOM 0 HG11 VAL A 39 -3.278 -0.444 -1.643 1.00 1.00 H new ATOM 0 HG12 VAL A 39 -4.928 -0.845 -1.109 1.00 1.00 H new ATOM 0 HG13 VAL A 39 -3.610 -0.730 0.082 1.00 1.00 H new ATOM 0 HG21 VAL A 39 -1.471 -2.189 -1.598 1.00 1.00 H new ATOM 0 HG22 VAL A 39 -1.786 -2.508 0.124 1.00 1.00 H new ATOM 0 HG23 VAL A 39 -1.832 -3.843 -1.052 1.00 1.00 H new ATOM 583 N TYR A 40 -6.564 -2.373 0.185 1.00 1.00 N ATOM 584 CA TYR A 40 -8.000 -2.183 -0.039 1.00 1.00 C ATOM 585 C TYR A 40 -8.383 -0.726 0.229 1.00 1.00 C ATOM 586 O TYR A 40 -7.775 -0.048 1.058 1.00 1.00 O ATOM 587 CB TYR A 40 -8.786 -3.149 0.878 1.00 1.00 C ATOM 588 CG TYR A 40 -8.328 -2.963 2.330 1.00 1.00 C ATOM 589 CD1 TYR A 40 -8.939 -1.995 3.150 1.00 1.00 C ATOM 590 CD2 TYR A 40 -7.276 -3.747 2.855 1.00 1.00 C ATOM 591 CE1 TYR A 40 -8.509 -1.815 4.469 1.00 1.00 C ATOM 592 CE2 TYR A 40 -6.855 -3.563 4.178 1.00 1.00 C ATOM 593 CZ TYR A 40 -7.472 -2.595 4.982 1.00 1.00 C ATOM 594 OH TYR A 40 -7.055 -2.399 6.282 1.00 1.00 O ATOM 0 H TYR A 40 -6.153 -1.732 0.864 1.00 1.00 H new ATOM 0 HA TYR A 40 -8.249 -2.406 -1.076 1.00 1.00 H new ATOM 0 HB2 TYR A 40 -9.856 -2.956 0.795 1.00 1.00 H new ATOM 0 HB3 TYR A 40 -8.623 -4.180 0.563 1.00 1.00 H new ATOM 0 HD1 TYR A 40 -9.743 -1.389 2.759 1.00 1.00 H new ATOM 0 HD2 TYR A 40 -6.796 -4.489 2.235 1.00 1.00 H new ATOM 0 HE1 TYR A 40 -8.981 -1.070 5.092 1.00 1.00 H new ATOM 0 HE2 TYR A 40 -6.055 -4.167 4.579 1.00 1.00 H new ATOM 0 HH TYR A 40 -7.586 -1.685 6.692 1.00 1.00 H new ATOM 604 N LEU A 41 -9.407 -0.258 -0.477 1.00 1.00 N ATOM 605 CA LEU A 41 -9.878 1.138 -0.326 1.00 1.00 C ATOM 606 C LEU A 41 -11.074 1.190 0.630 1.00 1.00 C ATOM 607 O LEU A 41 -12.023 0.422 0.481 1.00 1.00 O ATOM 608 CB LEU A 41 -10.289 1.726 -1.714 1.00 1.00 C ATOM 609 CG LEU A 41 -10.404 3.312 -1.651 1.00 1.00 C ATOM 610 CD1 LEU A 41 -9.048 3.968 -2.024 1.00 1.00 C ATOM 611 CD2 LEU A 41 -11.506 3.828 -2.607 1.00 1.00 C ATOM 0 H LEU A 41 -9.931 -0.809 -1.157 1.00 1.00 H new ATOM 0 HA LEU A 41 -9.064 1.735 0.085 1.00 1.00 H new ATOM 0 HB2 LEU A 41 -9.553 1.441 -2.466 1.00 1.00 H new ATOM 0 HB3 LEU A 41 -11.243 1.301 -2.025 1.00 1.00 H new ATOM 0 HG LEU A 41 -10.670 3.585 -0.630 1.00 1.00 H new ATOM 0 HD11 LEU A 41 -9.143 5.053 -1.976 1.00 1.00 H new ATOM 0 HD12 LEU A 41 -8.280 3.640 -1.323 1.00 1.00 H new ATOM 0 HD13 LEU A 41 -8.767 3.673 -3.035 1.00 1.00 H new ATOM 0 HD21 LEU A 41 -11.563 4.915 -2.544 1.00 1.00 H new ATOM 0 HD22 LEU A 41 -11.267 3.536 -3.630 1.00 1.00 H new ATOM 0 HD23 LEU A 41 -12.466 3.397 -2.322 1.00 1.00 H new ATOM 623 N GLY A 42 -11.019 2.095 1.602 1.00 1.00 N ATOM 624 CA GLY A 42 -12.106 2.257 2.588 1.00 1.00 C ATOM 625 C GLY A 42 -11.609 1.912 3.988 1.00 1.00 C ATOM 626 O GLY A 42 -10.422 2.009 4.298 1.00 1.00 O ATOM 0 H GLY A 42 -10.235 2.734 1.736 1.00 1.00 H new ATOM 0 HA2 GLY A 42 -12.474 3.283 2.568 1.00 1.00 H new ATOM 0 HA3 GLY A 42 -12.944 1.613 2.324 1.00 1.00 H new ATOM 630 N ASN A 43 -12.547 1.490 4.831 1.00 1.00 N ATOM 631 CA ASN A 43 -12.223 1.119 6.235 1.00 1.00 C ATOM 632 C ASN A 43 -12.560 -0.379 6.518 1.00 1.00 C ATOM 633 O ASN A 43 -13.573 -0.857 6.008 1.00 1.00 O ATOM 634 CB ASN A 43 -13.034 2.033 7.172 1.00 1.00 C ATOM 635 CG ASN A 43 -12.650 3.502 6.935 1.00 1.00 C ATOM 636 OD1 ASN A 43 -11.572 3.933 7.343 1.00 1.00 O ATOM 637 ND2 ASN A 43 -13.465 4.291 6.290 1.00 1.00 N ATOM 0 H ASN A 43 -13.532 1.392 4.585 1.00 1.00 H new ATOM 0 HA ASN A 43 -11.154 1.249 6.406 1.00 1.00 H new ATOM 0 HB2 ASN A 43 -14.101 1.894 6.995 1.00 1.00 H new ATOM 0 HB3 ASN A 43 -12.845 1.762 8.211 1.00 1.00 H new ATOM 0 HD21 ASN A 43 -13.208 5.264 6.124 1.00 1.00 H new ATOM 0 HD22 ASN A 43 -14.359 3.935 5.951 1.00 1.00 H new ATOM 644 N PRO A 44 -11.787 -1.075 7.306 1.00 1.00 N ATOM 645 CA PRO A 44 -12.115 -2.529 7.611 1.00 1.00 C ATOM 646 C PRO A 44 -13.582 -2.746 8.044 1.00 1.00 C ATOM 647 O PRO A 44 -14.199 -3.756 7.704 1.00 1.00 O ATOM 648 CB PRO A 44 -11.143 -2.901 8.768 1.00 1.00 C ATOM 649 CG PRO A 44 -9.955 -2.006 8.564 1.00 1.00 C ATOM 650 CD PRO A 44 -10.522 -0.674 8.007 1.00 1.00 C ATOM 0 HA PRO A 44 -11.997 -3.150 6.723 1.00 1.00 H new ATOM 0 HB2 PRO A 44 -11.603 -2.734 9.742 1.00 1.00 H new ATOM 0 HB3 PRO A 44 -10.860 -3.953 8.726 1.00 1.00 H new ATOM 0 HG2 PRO A 44 -9.422 -1.843 9.501 1.00 1.00 H new ATOM 0 HG3 PRO A 44 -9.245 -2.451 7.867 1.00 1.00 H new ATOM 0 HD2 PRO A 44 -10.719 0.040 8.807 1.00 1.00 H new ATOM 0 HD3 PRO A 44 -9.821 -0.199 7.321 1.00 1.00 H new ATOM 658 N ALA A 45 -14.115 -1.793 8.803 1.00 1.00 N ATOM 659 CA ALA A 45 -15.500 -1.886 9.290 1.00 1.00 C ATOM 660 C ALA A 45 -16.490 -1.881 8.119 1.00 1.00 C ATOM 661 O ALA A 45 -17.456 -2.645 8.101 1.00 1.00 O ATOM 662 CB ALA A 45 -15.793 -0.703 10.229 1.00 1.00 C ATOM 0 H ALA A 45 -13.619 -0.951 9.096 1.00 1.00 H new ATOM 0 HA ALA A 45 -15.618 -2.823 9.834 1.00 1.00 H new ATOM 0 HB1 ALA A 45 -16.819 -0.771 10.590 1.00 1.00 H new ATOM 0 HB2 ALA A 45 -15.107 -0.732 11.076 1.00 1.00 H new ATOM 0 HB3 ALA A 45 -15.661 0.233 9.687 1.00 1.00 H new ATOM 668 N GLN A 46 -16.237 -1.013 7.146 1.00 1.00 N ATOM 669 CA GLN A 46 -17.107 -0.907 5.964 1.00 1.00 C ATOM 670 C GLN A 46 -16.907 -2.118 5.049 1.00 1.00 C ATOM 671 O GLN A 46 -17.419 -2.147 3.929 1.00 1.00 O ATOM 672 CB GLN A 46 -16.783 0.396 5.196 1.00 1.00 C ATOM 673 CG GLN A 46 -17.108 1.626 6.075 1.00 1.00 C ATOM 674 CD GLN A 46 -16.763 2.919 5.335 1.00 1.00 C ATOM 675 OE1 GLN A 46 -15.768 2.974 4.612 1.00 1.00 O ATOM 676 NE2 GLN A 46 -17.533 3.962 5.471 1.00 1.00 N ATOM 0 H GLN A 46 -15.443 -0.373 7.145 1.00 1.00 H new ATOM 0 HA GLN A 46 -18.147 -0.884 6.289 1.00 1.00 H new ATOM 0 HB2 GLN A 46 -15.730 0.409 4.914 1.00 1.00 H new ATOM 0 HB3 GLN A 46 -17.361 0.436 4.273 1.00 1.00 H new ATOM 0 HG2 GLN A 46 -18.165 1.622 6.339 1.00 1.00 H new ATOM 0 HG3 GLN A 46 -16.546 1.573 7.008 1.00 1.00 H new ATOM 0 HE21 GLN A 46 -18.357 3.913 6.071 1.00 1.00 H new ATOM 0 HE22 GLN A 46 -17.312 4.827 4.978 1.00 1.00 H new ATOM 685 N GLY A 47 -16.162 -3.108 5.530 1.00 1.00 N ATOM 686 CA GLY A 47 -15.898 -4.320 4.750 1.00 1.00 C ATOM 687 C GLY A 47 -15.050 -4.004 3.529 1.00 1.00 C ATOM 688 O GLY A 47 -15.548 -3.979 2.403 1.00 1.00 O ATOM 0 H GLY A 47 -15.730 -3.099 6.454 1.00 1.00 H new ATOM 0 HA2 GLY A 47 -15.387 -5.054 5.373 1.00 1.00 H new ATOM 0 HA3 GLY A 47 -16.841 -4.769 4.437 1.00 1.00 H new ATOM 692 N GLY A 48 -13.765 -3.756 3.756 1.00 1.00 N ATOM 693 CA GLY A 48 -12.839 -3.439 2.666 1.00 1.00 C ATOM 694 C GLY A 48 -12.770 -4.581 1.652 1.00 1.00 C ATOM 695 O GLY A 48 -13.190 -5.702 1.941 1.00 1.00 O ATOM 0 H GLY A 48 -13.338 -3.767 4.682 1.00 1.00 H new ATOM 0 HA2 GLY A 48 -13.159 -2.524 2.167 1.00 1.00 H new ATOM 0 HA3 GLY A 48 -11.846 -3.249 3.072 1.00 1.00 H new ATOM 699 N VAL A 49 -12.234 -4.292 0.470 1.00 1.00 N ATOM 700 CA VAL A 49 -12.101 -5.302 -0.613 1.00 1.00 C ATOM 701 C VAL A 49 -10.662 -5.328 -1.144 1.00 1.00 C ATOM 702 O VAL A 49 -10.071 -4.289 -1.435 1.00 1.00 O ATOM 703 CB VAL A 49 -13.109 -4.964 -1.756 1.00 1.00 C ATOM 704 CG1 VAL A 49 -12.794 -3.587 -2.401 1.00 1.00 C ATOM 705 CG2 VAL A 49 -13.090 -6.065 -2.849 1.00 1.00 C ATOM 0 H VAL A 49 -11.879 -3.368 0.223 1.00 1.00 H new ATOM 0 HA VAL A 49 -12.330 -6.292 -0.219 1.00 1.00 H new ATOM 0 HB VAL A 49 -14.102 -4.919 -1.309 1.00 1.00 H new ATOM 0 HG11 VAL A 49 -13.515 -3.383 -3.193 1.00 1.00 H new ATOM 0 HG12 VAL A 49 -12.858 -2.807 -1.642 1.00 1.00 H new ATOM 0 HG13 VAL A 49 -11.788 -3.604 -2.821 1.00 1.00 H new ATOM 0 HG21 VAL A 49 -13.800 -5.809 -3.636 1.00 1.00 H new ATOM 0 HG22 VAL A 49 -12.089 -6.139 -3.274 1.00 1.00 H new ATOM 0 HG23 VAL A 49 -13.368 -7.022 -2.407 1.00 1.00 H new ATOM 715 N GLU A 50 -10.116 -6.533 -1.280 1.00 1.00 N ATOM 716 CA GLU A 50 -8.751 -6.692 -1.781 1.00 1.00 C ATOM 717 C GLU A 50 -8.702 -6.330 -3.273 1.00 1.00 C ATOM 718 O GLU A 50 -9.550 -6.752 -4.058 1.00 1.00 O ATOM 719 CB GLU A 50 -8.271 -8.147 -1.550 1.00 1.00 C ATOM 720 CG GLU A 50 -6.776 -8.308 -1.927 1.00 1.00 C ATOM 721 CD GLU A 50 -6.289 -9.734 -1.647 1.00 1.00 C ATOM 722 OE1 GLU A 50 -7.120 -10.618 -1.497 1.00 1.00 O ATOM 723 OE2 GLU A 50 -5.089 -9.913 -1.583 1.00 1.00 O ATOM 0 H GLU A 50 -10.591 -7.407 -1.053 1.00 1.00 H new ATOM 0 HA GLU A 50 -8.084 -6.021 -1.240 1.00 1.00 H new ATOM 0 HB2 GLU A 50 -8.417 -8.420 -0.505 1.00 1.00 H new ATOM 0 HB3 GLU A 50 -8.875 -8.831 -2.146 1.00 1.00 H new ATOM 0 HG2 GLU A 50 -6.636 -8.073 -2.982 1.00 1.00 H new ATOM 0 HG3 GLU A 50 -6.176 -7.597 -1.360 1.00 1.00 H new ATOM 730 N ILE A 51 -7.688 -5.554 -3.650 1.00 1.00 N ATOM 731 CA ILE A 51 -7.519 -5.124 -5.061 1.00 1.00 C ATOM 732 C ILE A 51 -6.499 -6.016 -5.746 1.00 1.00 C ATOM 733 O ILE A 51 -6.615 -6.323 -6.933 1.00 1.00 O ATOM 734 CB ILE A 51 -7.064 -3.630 -5.113 1.00 1.00 C ATOM 735 CG1 ILE A 51 -8.108 -2.746 -4.358 1.00 1.00 C ATOM 736 CG2 ILE A 51 -6.958 -3.154 -6.592 1.00 1.00 C ATOM 737 CD1 ILE A 51 -7.595 -1.300 -4.197 1.00 1.00 C ATOM 0 H ILE A 51 -6.970 -5.206 -3.014 1.00 1.00 H new ATOM 0 HA ILE A 51 -8.471 -5.213 -5.584 1.00 1.00 H new ATOM 0 HB ILE A 51 -6.087 -3.537 -4.638 1.00 1.00 H new ATOM 0 HG12 ILE A 51 -9.050 -2.742 -4.906 1.00 1.00 H new ATOM 0 HG13 ILE A 51 -8.311 -3.175 -3.377 1.00 1.00 H new ATOM 0 HG21 ILE A 51 -6.640 -2.112 -6.617 1.00 1.00 H new ATOM 0 HG22 ILE A 51 -6.229 -3.768 -7.121 1.00 1.00 H new ATOM 0 HG23 ILE A 51 -7.930 -3.248 -7.075 1.00 1.00 H new ATOM 0 HD11 ILE A 51 -8.341 -0.706 -3.668 1.00 1.00 H new ATOM 0 HD12 ILE A 51 -6.665 -1.305 -3.628 1.00 1.00 H new ATOM 0 HD13 ILE A 51 -7.416 -0.866 -5.181 1.00 1.00 H new ATOM 749 N GLY A 52 -5.480 -6.415 -4.992 1.00 1.00 N ATOM 750 CA GLY A 52 -4.425 -7.272 -5.532 1.00 1.00 C ATOM 751 C GLY A 52 -3.338 -7.494 -4.500 1.00 1.00 C ATOM 752 O GLY A 52 -3.340 -6.879 -3.433 1.00 1.00 O ATOM 0 H GLY A 52 -5.360 -6.162 -4.011 1.00 1.00 H new ATOM 0 HA2 GLY A 52 -4.847 -8.230 -5.835 1.00 1.00 H new ATOM 0 HA3 GLY A 52 -3.999 -6.814 -6.425 1.00 1.00 H new ATOM 756 N ARG A 53 -2.398 -8.376 -4.823 1.00 1.00 N ATOM 757 CA ARG A 53 -1.284 -8.688 -3.924 1.00 1.00 C ATOM 758 C ARG A 53 -0.077 -9.184 -4.726 1.00 1.00 C ATOM 759 O ARG A 53 -0.176 -9.515 -5.908 1.00 1.00 O ATOM 760 CB ARG A 53 -1.724 -9.752 -2.884 1.00 1.00 C ATOM 761 CG ARG A 53 -2.253 -11.018 -3.595 1.00 1.00 C ATOM 762 CD ARG A 53 -2.657 -12.087 -2.563 1.00 1.00 C ATOM 763 NE ARG A 53 -3.147 -13.281 -3.267 1.00 1.00 N ATOM 764 CZ ARG A 53 -2.316 -14.133 -3.886 1.00 1.00 C ATOM 765 NH1 ARG A 53 -1.024 -13.930 -3.866 1.00 1.00 N ATOM 766 NH2 ARG A 53 -2.800 -15.165 -4.516 1.00 1.00 N ATOM 0 H ARG A 53 -2.383 -8.891 -5.703 1.00 1.00 H new ATOM 0 HA ARG A 53 -0.993 -7.782 -3.393 1.00 1.00 H new ATOM 0 HB2 ARG A 53 -0.882 -10.013 -2.243 1.00 1.00 H new ATOM 0 HB3 ARG A 53 -2.500 -9.339 -2.239 1.00 1.00 H new ATOM 0 HG2 ARG A 53 -3.111 -10.762 -4.217 1.00 1.00 H new ATOM 0 HG3 ARG A 53 -1.486 -11.417 -4.259 1.00 1.00 H new ATOM 0 HD2 ARG A 53 -1.803 -12.345 -1.936 1.00 1.00 H new ATOM 0 HD3 ARG A 53 -3.431 -11.697 -1.902 1.00 1.00 H new ATOM 0 HE ARG A 53 -4.150 -13.467 -3.285 1.00 1.00 H new ATOM 0 HH11 ARG A 53 -0.643 -13.120 -3.378 1.00 1.00 H new ATOM 0 HH12 ARG A 53 -0.398 -14.582 -4.339 1.00 1.00 H new ATOM 0 HH21 ARG A 53 -3.807 -15.323 -4.537 1.00 1.00 H new ATOM 0 HH22 ARG A 53 -2.172 -15.815 -4.988 1.00 1.00 H new ATOM 780 N ASP A 54 1.067 -9.234 -4.053 1.00 1.00 N ATOM 781 CA ASP A 54 2.319 -9.696 -4.688 1.00 1.00 C ATOM 782 C ASP A 54 3.338 -10.095 -3.609 1.00 1.00 C ATOM 783 O ASP A 54 3.783 -9.252 -2.829 1.00 1.00 O ATOM 784 CB ASP A 54 2.932 -8.568 -5.571 1.00 1.00 C ATOM 785 CG ASP A 54 2.084 -8.304 -6.822 1.00 1.00 C ATOM 786 OD1 ASP A 54 1.851 -9.245 -7.562 1.00 1.00 O ATOM 787 OD2 ASP A 54 1.689 -7.165 -7.027 1.00 1.00 O ATOM 0 H ASP A 54 1.165 -8.965 -3.074 1.00 1.00 H new ATOM 0 HA ASP A 54 2.087 -10.557 -5.314 1.00 1.00 H new ATOM 0 HB2 ASP A 54 3.013 -7.652 -4.986 1.00 1.00 H new ATOM 0 HB3 ASP A 54 3.943 -8.847 -5.869 1.00 1.00 H new ATOM 792 N THR A 55 3.718 -11.369 -3.592 1.00 1.00 N ATOM 793 CA THR A 55 4.702 -11.860 -2.614 1.00 1.00 C ATOM 794 C THR A 55 6.104 -11.427 -3.039 1.00 1.00 C ATOM 795 O THR A 55 6.469 -11.519 -4.211 1.00 1.00 O ATOM 796 CB THR A 55 4.621 -13.404 -2.497 1.00 1.00 C ATOM 797 OG1 THR A 55 3.275 -13.771 -2.230 1.00 1.00 O ATOM 798 CG2 THR A 55 5.515 -13.919 -1.344 1.00 1.00 C ATOM 0 H THR A 55 3.368 -12.079 -4.235 1.00 1.00 H new ATOM 0 HA THR A 55 4.480 -11.433 -1.636 1.00 1.00 H new ATOM 0 HB THR A 55 4.967 -13.845 -3.432 1.00 1.00 H new ATOM 0 HG1 THR A 55 3.210 -14.746 -2.155 1.00 1.00 H new ATOM 0 HG21 THR A 55 5.440 -15.005 -1.283 1.00 1.00 H new ATOM 0 HG22 THR A 55 6.551 -13.636 -1.533 1.00 1.00 H new ATOM 0 HG23 THR A 55 5.184 -13.479 -0.403 1.00 1.00 H new ATOM 806 N ILE A 56 6.887 -10.962 -2.071 1.00 1.00 N ATOM 807 CA ILE A 56 8.269 -10.495 -2.340 1.00 1.00 C ATOM 808 C ILE A 56 9.276 -11.510 -1.784 1.00 1.00 C ATOM 809 O ILE A 56 9.070 -12.098 -0.724 1.00 1.00 O ATOM 810 CB ILE A 56 8.514 -9.099 -1.682 1.00 1.00 C ATOM 811 CG1 ILE A 56 7.341 -8.124 -2.030 1.00 1.00 C ATOM 812 CG2 ILE A 56 9.867 -8.505 -2.202 1.00 1.00 C ATOM 813 CD1 ILE A 56 7.488 -6.792 -1.265 1.00 1.00 C ATOM 0 H ILE A 56 6.603 -10.893 -1.094 1.00 1.00 H new ATOM 0 HA ILE A 56 8.401 -10.402 -3.418 1.00 1.00 H new ATOM 0 HB ILE A 56 8.562 -9.220 -0.600 1.00 1.00 H new ATOM 0 HG12 ILE A 56 7.328 -7.932 -3.103 1.00 1.00 H new ATOM 0 HG13 ILE A 56 6.388 -8.590 -1.778 1.00 1.00 H new ATOM 0 HG21 ILE A 56 10.037 -7.531 -1.743 1.00 1.00 H new ATOM 0 HG22 ILE A 56 10.684 -9.177 -1.940 1.00 1.00 H new ATOM 0 HG23 ILE A 56 9.822 -8.392 -3.285 1.00 1.00 H new ATOM 0 HD11 ILE A 56 6.661 -6.131 -1.523 1.00 1.00 H new ATOM 0 HD12 ILE A 56 7.477 -6.985 -0.192 1.00 1.00 H new ATOM 0 HD13 ILE A 56 8.431 -6.318 -1.538 1.00 1.00 H new ATOM 825 N SER A 57 10.364 -11.706 -2.522 1.00 1.00 N ATOM 826 CA SER A 57 11.419 -12.653 -2.099 1.00 1.00 C ATOM 827 C SER A 57 12.636 -11.900 -1.575 1.00 1.00 C ATOM 828 O SER A 57 13.092 -12.139 -0.456 1.00 1.00 O ATOM 829 CB SER A 57 11.836 -13.510 -3.306 1.00 1.00 C ATOM 830 OG SER A 57 12.413 -12.678 -4.303 1.00 1.00 O ATOM 0 H SER A 57 10.548 -11.234 -3.407 1.00 1.00 H new ATOM 0 HA SER A 57 11.028 -13.286 -1.302 1.00 1.00 H new ATOM 0 HB2 SER A 57 12.551 -14.272 -2.995 1.00 1.00 H new ATOM 0 HB3 SER A 57 10.969 -14.033 -3.711 1.00 1.00 H new ATOM 0 HG SER A 57 12.680 -13.225 -5.071 1.00 1.00 H new ATOM 836 N ARG A 58 13.165 -10.997 -2.395 1.00 1.00 N ATOM 837 CA ARG A 58 14.346 -10.211 -2.000 1.00 1.00 C ATOM 838 C ARG A 58 14.031 -9.314 -0.785 1.00 1.00 C ATOM 839 O ARG A 58 13.866 -8.100 -0.893 1.00 1.00 O ATOM 840 CB ARG A 58 14.828 -9.368 -3.194 1.00 1.00 C ATOM 841 CG ARG A 58 16.180 -8.672 -2.880 1.00 1.00 C ATOM 842 CD ARG A 58 16.610 -7.788 -4.065 1.00 1.00 C ATOM 843 NE ARG A 58 16.797 -8.606 -5.271 1.00 1.00 N ATOM 844 CZ ARG A 58 17.830 -9.448 -5.421 1.00 1.00 C ATOM 845 NH1 ARG A 58 18.749 -9.551 -4.496 1.00 1.00 N ATOM 846 NH2 ARG A 58 17.924 -10.160 -6.508 1.00 1.00 N ATOM 0 H ARG A 58 12.806 -10.788 -3.326 1.00 1.00 H new ATOM 0 HA ARG A 58 15.142 -10.895 -1.705 1.00 1.00 H new ATOM 0 HB2 ARG A 58 14.939 -10.005 -4.071 1.00 1.00 H new ATOM 0 HB3 ARG A 58 14.077 -8.617 -3.439 1.00 1.00 H new ATOM 0 HG2 ARG A 58 16.085 -8.065 -1.980 1.00 1.00 H new ATOM 0 HG3 ARG A 58 16.945 -9.422 -2.679 1.00 1.00 H new ATOM 0 HD2 ARG A 58 15.855 -7.023 -4.250 1.00 1.00 H new ATOM 0 HD3 ARG A 58 17.537 -7.269 -3.822 1.00 1.00 H new ATOM 0 HE ARG A 58 16.114 -8.530 -6.024 1.00 1.00 H new ATOM 0 HH11 ARG A 58 18.685 -8.987 -3.648 1.00 1.00 H new ATOM 0 HH12 ARG A 58 19.530 -10.195 -4.622 1.00 1.00 H new ATOM 0 HH21 ARG A 58 17.215 -10.074 -7.237 1.00 1.00 H new ATOM 0 HH22 ARG A 58 18.706 -10.803 -6.630 1.00 1.00 H new ATOM 860 N ILE A 59 13.961 -9.955 0.376 1.00 1.00 N ATOM 861 CA ILE A 59 13.686 -9.237 1.653 1.00 1.00 C ATOM 862 C ILE A 59 14.845 -9.486 2.646 1.00 1.00 C ATOM 863 O ILE A 59 14.703 -10.343 3.519 1.00 1.00 O ATOM 864 CB ILE A 59 12.330 -9.699 2.268 1.00 1.00 C ATOM 865 CG1 ILE A 59 11.163 -9.431 1.253 1.00 1.00 C ATOM 866 CG2 ILE A 59 12.037 -8.941 3.594 1.00 1.00 C ATOM 867 CD1 ILE A 59 11.007 -7.919 0.902 1.00 1.00 C ATOM 0 H ILE A 59 14.087 -10.962 0.478 1.00 1.00 H new ATOM 0 HA ILE A 59 13.613 -8.169 1.448 1.00 1.00 H new ATOM 0 HB ILE A 59 12.399 -10.766 2.479 1.00 1.00 H new ATOM 0 HG12 ILE A 59 11.345 -9.995 0.338 1.00 1.00 H new ATOM 0 HG13 ILE A 59 10.228 -9.800 1.674 1.00 1.00 H new ATOM 0 HG21 ILE A 59 11.086 -9.280 4.004 1.00 1.00 H new ATOM 0 HG22 ILE A 59 12.833 -9.141 4.311 1.00 1.00 H new ATOM 0 HG23 ILE A 59 11.986 -7.870 3.397 1.00 1.00 H new ATOM 0 HD11 ILE A 59 10.186 -7.792 0.197 1.00 1.00 H new ATOM 0 HD12 ILE A 59 10.796 -7.355 1.810 1.00 1.00 H new ATOM 0 HD13 ILE A 59 11.930 -7.552 0.453 1.00 1.00 H new ATOM 879 N PRO A 60 15.929 -8.765 2.553 1.00 1.00 N ATOM 880 CA PRO A 60 17.074 -8.951 3.513 1.00 1.00 C ATOM 881 C PRO A 60 16.788 -8.301 4.878 1.00 1.00 C ATOM 882 O PRO A 60 15.843 -7.527 5.031 1.00 1.00 O ATOM 883 CB PRO A 60 18.267 -8.303 2.770 1.00 1.00 C ATOM 884 CG PRO A 60 17.644 -7.169 2.001 1.00 1.00 C ATOM 885 CD PRO A 60 16.255 -7.692 1.550 1.00 1.00 C ATOM 0 HA PRO A 60 17.264 -9.995 3.762 1.00 1.00 H new ATOM 0 HB2 PRO A 60 19.024 -7.944 3.467 1.00 1.00 H new ATOM 0 HB3 PRO A 60 18.757 -9.014 2.105 1.00 1.00 H new ATOM 0 HG2 PRO A 60 17.546 -6.279 2.623 1.00 1.00 H new ATOM 0 HG3 PRO A 60 18.257 -6.892 1.143 1.00 1.00 H new ATOM 0 HD2 PRO A 60 15.508 -6.898 1.557 1.00 1.00 H new ATOM 0 HD3 PRO A 60 16.288 -8.090 0.536 1.00 1.00 H new ATOM 893 N VAL A 61 17.621 -8.628 5.860 1.00 1.00 N ATOM 894 CA VAL A 61 17.471 -8.095 7.213 1.00 1.00 C ATOM 895 C VAL A 61 17.763 -6.596 7.228 1.00 1.00 C ATOM 896 O VAL A 61 18.713 -6.141 6.593 1.00 1.00 O ATOM 897 CB VAL A 61 18.424 -8.857 8.171 1.00 1.00 C ATOM 898 CG1 VAL A 61 17.996 -10.340 8.259 1.00 1.00 C ATOM 899 CG2 VAL A 61 19.890 -8.775 7.671 1.00 1.00 C ATOM 0 H VAL A 61 18.411 -9.263 5.745 1.00 1.00 H new ATOM 0 HA VAL A 61 16.444 -8.237 7.550 1.00 1.00 H new ATOM 0 HB VAL A 61 18.364 -8.394 9.156 1.00 1.00 H new ATOM 0 HG11 VAL A 61 18.667 -10.873 8.933 1.00 1.00 H new ATOM 0 HG12 VAL A 61 16.976 -10.402 8.638 1.00 1.00 H new ATOM 0 HG13 VAL A 61 18.043 -10.792 7.268 1.00 1.00 H new ATOM 0 HG21 VAL A 61 20.540 -9.316 8.359 1.00 1.00 H new ATOM 0 HG22 VAL A 61 19.961 -9.220 6.678 1.00 1.00 H new ATOM 0 HG23 VAL A 61 20.201 -7.731 7.624 1.00 1.00 H new ATOM 909 N GLY A 62 16.946 -5.839 7.954 1.00 1.00 N ATOM 910 CA GLY A 62 17.111 -4.397 8.048 1.00 1.00 C ATOM 911 C GLY A 62 16.733 -3.739 6.735 1.00 1.00 C ATOM 912 O GLY A 62 17.026 -2.563 6.522 1.00 1.00 O ATOM 0 H GLY A 62 16.158 -6.206 8.488 1.00 1.00 H new ATOM 0 HA2 GLY A 62 16.489 -4.004 8.852 1.00 1.00 H new ATOM 0 HA3 GLY A 62 18.144 -4.158 8.299 1.00 1.00 H new ATOM 916 N GLY A 63 16.071 -4.491 5.863 1.00 1.00 N ATOM 917 CA GLY A 63 15.629 -4.003 4.546 1.00 1.00 C ATOM 918 C GLY A 63 14.126 -3.793 4.535 1.00 1.00 C ATOM 919 O GLY A 63 13.474 -3.796 5.579 1.00 1.00 O ATOM 0 H GLY A 63 15.821 -5.463 6.044 1.00 1.00 H new ATOM 0 HA2 GLY A 63 16.135 -3.067 4.310 1.00 1.00 H new ATOM 0 HA3 GLY A 63 15.908 -4.720 3.774 1.00 1.00 H new ATOM 923 N THR A 64 13.576 -3.609 3.339 1.00 1.00 N ATOM 924 CA THR A 64 12.132 -3.377 3.159 1.00 1.00 C ATOM 925 C THR A 64 11.634 -4.060 1.898 1.00 1.00 C ATOM 926 O THR A 64 12.370 -4.789 1.232 1.00 1.00 O ATOM 927 CB THR A 64 11.834 -1.858 3.065 1.00 1.00 C ATOM 928 OG1 THR A 64 12.379 -1.359 1.853 1.00 1.00 O ATOM 929 CG2 THR A 64 12.468 -1.109 4.253 1.00 1.00 C ATOM 0 H THR A 64 14.107 -3.615 2.468 1.00 1.00 H new ATOM 0 HA THR A 64 11.616 -3.795 4.023 1.00 1.00 H new ATOM 0 HB THR A 64 10.755 -1.703 3.089 1.00 1.00 H new ATOM 0 HG1 THR A 64 12.195 -0.399 1.782 1.00 1.00 H new ATOM 0 HG21 THR A 64 12.249 -0.044 4.171 1.00 1.00 H new ATOM 0 HG22 THR A 64 12.057 -1.493 5.187 1.00 1.00 H new ATOM 0 HG23 THR A 64 13.548 -1.259 4.243 1.00 1.00 H new ATOM 937 N GLY A 65 10.368 -3.819 1.574 1.00 1.00 N ATOM 938 CA GLY A 65 9.753 -4.411 0.369 1.00 1.00 C ATOM 939 C GLY A 65 8.799 -3.427 -0.294 1.00 1.00 C ATOM 940 O GLY A 65 8.183 -2.592 0.369 1.00 1.00 O ATOM 0 H GLY A 65 9.743 -3.224 2.118 1.00 1.00 H new ATOM 0 HA2 GLY A 65 10.532 -4.700 -0.337 1.00 1.00 H new ATOM 0 HA3 GLY A 65 9.215 -5.319 0.640 1.00 1.00 H new ATOM 944 N LEU A 66 8.679 -3.535 -1.613 1.00 1.00 N ATOM 945 CA LEU A 66 7.772 -2.657 -2.390 1.00 1.00 C ATOM 946 C LEU A 66 7.042 -3.473 -3.460 1.00 1.00 C ATOM 947 O LEU A 66 7.644 -4.133 -4.309 1.00 1.00 O ATOM 948 CB LEU A 66 8.567 -1.465 -3.039 1.00 1.00 C ATOM 949 CG LEU A 66 8.739 -0.247 -2.045 1.00 1.00 C ATOM 950 CD1 LEU A 66 9.865 0.690 -2.544 1.00 1.00 C ATOM 951 CD2 LEU A 66 7.418 0.586 -1.945 1.00 1.00 C ATOM 0 H LEU A 66 9.190 -4.214 -2.176 1.00 1.00 H new ATOM 0 HA LEU A 66 7.032 -2.232 -1.711 1.00 1.00 H new ATOM 0 HB2 LEU A 66 9.550 -1.816 -3.354 1.00 1.00 H new ATOM 0 HB3 LEU A 66 8.046 -1.129 -3.935 1.00 1.00 H new ATOM 0 HG LEU A 66 8.988 -0.653 -1.065 1.00 1.00 H new ATOM 0 HD11 LEU A 66 9.976 1.526 -1.853 1.00 1.00 H new ATOM 0 HD12 LEU A 66 10.802 0.136 -2.597 1.00 1.00 H new ATOM 0 HD13 LEU A 66 9.611 1.069 -3.534 1.00 1.00 H new ATOM 0 HD21 LEU A 66 7.563 1.417 -1.255 1.00 1.00 H new ATOM 0 HD22 LEU A 66 7.157 0.973 -2.930 1.00 1.00 H new ATOM 0 HD23 LEU A 66 6.613 -0.051 -1.580 1.00 1.00 H new ATOM 963 N ALA A 67 5.716 -3.391 -3.412 1.00 1.00 N ATOM 964 CA ALA A 67 4.826 -4.086 -4.345 1.00 1.00 C ATOM 965 C ALA A 67 4.205 -3.077 -5.298 1.00 1.00 C ATOM 966 O ALA A 67 4.167 -1.877 -5.031 1.00 1.00 O ATOM 967 CB ALA A 67 3.727 -4.811 -3.547 1.00 1.00 C ATOM 0 H ALA A 67 5.220 -2.834 -2.716 1.00 1.00 H new ATOM 0 HA ALA A 67 5.390 -4.817 -4.924 1.00 1.00 H new ATOM 0 HB1 ALA A 67 3.060 -5.331 -4.235 1.00 1.00 H new ATOM 0 HB2 ALA A 67 4.185 -5.533 -2.870 1.00 1.00 H new ATOM 0 HB3 ALA A 67 3.157 -4.083 -2.970 1.00 1.00 H new ATOM 973 N ARG A 68 3.710 -3.585 -6.423 1.00 1.00 N ATOM 974 CA ARG A 68 3.074 -2.723 -7.448 1.00 1.00 C ATOM 975 C ARG A 68 1.674 -3.248 -7.772 1.00 1.00 C ATOM 976 O ARG A 68 1.501 -4.392 -8.193 1.00 1.00 O ATOM 977 CB ARG A 68 3.956 -2.692 -8.730 1.00 1.00 C ATOM 978 CG ARG A 68 3.482 -1.571 -9.697 1.00 1.00 C ATOM 979 CD ARG A 68 4.322 -1.578 -10.989 1.00 1.00 C ATOM 980 NE ARG A 68 5.738 -1.323 -10.683 1.00 1.00 N ATOM 981 CZ ARG A 68 6.189 -0.118 -10.304 1.00 1.00 C ATOM 982 NH1 ARG A 68 5.381 0.908 -10.245 1.00 1.00 N ATOM 983 NH2 ARG A 68 7.452 0.034 -10.011 1.00 1.00 N ATOM 0 H ARG A 68 3.730 -4.577 -6.659 1.00 1.00 H new ATOM 0 HA ARG A 68 2.984 -1.708 -7.062 1.00 1.00 H new ATOM 0 HB2 ARG A 68 4.998 -2.526 -8.456 1.00 1.00 H new ATOM 0 HB3 ARG A 68 3.908 -3.658 -9.234 1.00 1.00 H new ATOM 0 HG2 ARG A 68 2.429 -1.714 -9.941 1.00 1.00 H new ATOM 0 HG3 ARG A 68 3.567 -0.601 -9.207 1.00 1.00 H new ATOM 0 HD2 ARG A 68 4.220 -2.540 -11.491 1.00 1.00 H new ATOM 0 HD3 ARG A 68 3.950 -0.818 -11.676 1.00 1.00 H new ATOM 0 HE ARG A 68 6.403 -2.093 -10.762 1.00 1.00 H new ATOM 0 HH11 ARG A 68 4.397 0.797 -10.489 1.00 1.00 H new ATOM 0 HH12 ARG A 68 5.735 1.820 -9.955 1.00 1.00 H new ATOM 0 HH21 ARG A 68 8.089 -0.761 -10.071 1.00 1.00 H new ATOM 0 HH22 ARG A 68 7.802 0.947 -9.722 1.00 1.00 H new ATOM 997 N VAL A 69 0.680 -2.387 -7.585 1.00 1.00 N ATOM 998 CA VAL A 69 -0.723 -2.738 -7.858 1.00 1.00 C ATOM 999 C VAL A 69 -1.401 -1.566 -8.578 1.00 1.00 C ATOM 1000 O VAL A 69 -1.268 -0.403 -8.199 1.00 1.00 O ATOM 1001 CB VAL A 69 -1.463 -3.073 -6.528 1.00 1.00 C ATOM 1002 CG1 VAL A 69 -2.913 -3.552 -6.814 1.00 1.00 C ATOM 1003 CG2 VAL A 69 -0.693 -4.182 -5.769 1.00 1.00 C ATOM 0 H VAL A 69 0.813 -1.435 -7.244 1.00 1.00 H new ATOM 0 HA VAL A 69 -0.764 -3.621 -8.496 1.00 1.00 H new ATOM 0 HB VAL A 69 -1.506 -2.171 -5.918 1.00 1.00 H new ATOM 0 HG11 VAL A 69 -3.413 -3.781 -5.873 1.00 1.00 H new ATOM 0 HG12 VAL A 69 -3.460 -2.765 -7.334 1.00 1.00 H new ATOM 0 HG13 VAL A 69 -2.885 -4.446 -7.437 1.00 1.00 H new ATOM 0 HG21 VAL A 69 -1.212 -4.414 -4.839 1.00 1.00 H new ATOM 0 HG22 VAL A 69 -0.640 -5.077 -6.389 1.00 1.00 H new ATOM 0 HG23 VAL A 69 0.316 -3.836 -5.544 1.00 1.00 H new ATOM 1013 N GLN A 70 -2.156 -1.907 -9.617 1.00 1.00 N ATOM 1014 CA GLN A 70 -2.873 -0.889 -10.414 1.00 1.00 C ATOM 1015 C GLN A 70 -4.331 -0.829 -9.983 1.00 1.00 C ATOM 1016 O GLN A 70 -4.948 -1.868 -9.749 1.00 1.00 O ATOM 1017 CB GLN A 70 -2.790 -1.241 -11.924 1.00 1.00 C ATOM 1018 CG GLN A 70 -1.308 -1.334 -12.391 1.00 1.00 C ATOM 1019 CD GLN A 70 -0.639 -2.609 -11.863 1.00 1.00 C ATOM 1020 OE1 GLN A 70 -0.938 -3.706 -12.334 1.00 1.00 O ATOM 1021 NE2 GLN A 70 0.240 -2.527 -10.906 1.00 1.00 N ATOM 0 H GLN A 70 -2.294 -2.867 -9.933 1.00 1.00 H new ATOM 0 HA GLN A 70 -2.407 0.082 -10.247 1.00 1.00 H new ATOM 0 HB2 GLN A 70 -3.294 -2.190 -12.109 1.00 1.00 H new ATOM 0 HB3 GLN A 70 -3.313 -0.483 -12.508 1.00 1.00 H new ATOM 0 HG2 GLN A 70 -1.266 -1.322 -13.480 1.00 1.00 H new ATOM 0 HG3 GLN A 70 -0.758 -0.460 -12.041 1.00 1.00 H new ATOM 0 HE21 GLN A 70 0.487 -1.617 -10.517 1.00 1.00 H new ATOM 0 HE22 GLN A 70 0.682 -3.373 -10.546 1.00 1.00 H new ATOM 1030 N TRP A 71 -4.881 0.378 -9.889 1.00 1.00 N ATOM 1031 CA TRP A 71 -6.280 0.576 -9.494 1.00 1.00 C ATOM 1032 C TRP A 71 -6.888 1.743 -10.287 1.00 1.00 C ATOM 1033 O TRP A 71 -6.239 2.750 -10.572 1.00 1.00 O ATOM 1034 CB TRP A 71 -6.382 0.848 -7.970 1.00 1.00 C ATOM 1035 CG TRP A 71 -7.832 0.938 -7.564 1.00 1.00 C ATOM 1036 CD1 TRP A 71 -8.721 -0.079 -7.636 1.00 1.00 C ATOM 1037 CD2 TRP A 71 -8.569 2.088 -7.062 1.00 1.00 C ATOM 1038 NE1 TRP A 71 -9.958 0.376 -7.220 1.00 1.00 N ATOM 1039 CE2 TRP A 71 -9.916 1.707 -6.858 1.00 1.00 C ATOM 1040 CE3 TRP A 71 -8.203 3.412 -6.773 1.00 1.00 C ATOM 1041 CZ2 TRP A 71 -10.866 2.613 -6.388 1.00 1.00 C ATOM 1042 CZ3 TRP A 71 -9.154 4.327 -6.299 1.00 1.00 C ATOM 1043 CH2 TRP A 71 -10.483 3.931 -6.111 1.00 1.00 C ATOM 0 H TRP A 71 -4.377 1.244 -10.082 1.00 1.00 H new ATOM 0 HA TRP A 71 -6.839 -0.333 -9.718 1.00 1.00 H new ATOM 0 HB2 TRP A 71 -5.888 0.050 -7.415 1.00 1.00 H new ATOM 0 HB3 TRP A 71 -5.867 1.776 -7.721 1.00 1.00 H new ATOM 0 HD1 TRP A 71 -8.500 -1.084 -7.965 1.00 1.00 H new ATOM 0 HE1 TRP A 71 -10.798 -0.201 -7.185 1.00 1.00 H new ATOM 0 HE3 TRP A 71 -7.181 3.729 -6.917 1.00 1.00 H new ATOM 0 HZ2 TRP A 71 -11.889 2.301 -6.239 1.00 1.00 H new ATOM 0 HZ3 TRP A 71 -8.859 5.342 -6.078 1.00 1.00 H new ATOM 0 HH2 TRP A 71 -11.213 4.642 -5.752 1.00 1.00 H new ATOM 1054 N LYS A 72 -8.161 1.581 -10.630 1.00 1.00 N ATOM 1055 CA LYS A 72 -8.912 2.605 -11.396 1.00 1.00 C ATOM 1056 C LYS A 72 -10.021 3.206 -10.528 1.00 1.00 C ATOM 1057 O LYS A 72 -10.846 2.487 -9.963 1.00 1.00 O ATOM 1058 CB LYS A 72 -9.515 1.968 -12.672 1.00 1.00 C ATOM 1059 CG LYS A 72 -10.187 3.048 -13.571 1.00 1.00 C ATOM 1060 CD LYS A 72 -10.648 2.433 -14.922 1.00 1.00 C ATOM 1061 CE LYS A 72 -11.735 1.334 -14.717 1.00 1.00 C ATOM 1062 NZ LYS A 72 -11.073 0.025 -14.446 1.00 1.00 N ATOM 0 H LYS A 72 -8.708 0.753 -10.395 1.00 1.00 H new ATOM 0 HA LYS A 72 -8.229 3.403 -11.688 1.00 1.00 H new ATOM 0 HB2 LYS A 72 -8.732 1.458 -13.233 1.00 1.00 H new ATOM 0 HB3 LYS A 72 -10.250 1.213 -12.393 1.00 1.00 H new ATOM 0 HG2 LYS A 72 -11.043 3.479 -13.051 1.00 1.00 H new ATOM 0 HG3 LYS A 72 -9.485 3.861 -13.757 1.00 1.00 H new ATOM 0 HD2 LYS A 72 -11.044 3.220 -15.564 1.00 1.00 H new ATOM 0 HD3 LYS A 72 -9.789 2.003 -15.438 1.00 1.00 H new ATOM 0 HE2 LYS A 72 -12.387 1.603 -13.886 1.00 1.00 H new ATOM 0 HE3 LYS A 72 -12.364 1.259 -15.604 1.00 1.00 H new ATOM 0 HZ1 LYS A 72 -11.399 -0.679 -15.139 1.00 1.00 H new ATOM 0 HZ2 LYS A 72 -10.042 0.135 -14.523 1.00 1.00 H new ATOM 0 HZ3 LYS A 72 -11.316 -0.295 -13.487 1.00 1.00 H new ATOM 1076 N ALA A 73 -10.037 4.532 -10.443 1.00 1.00 N ATOM 1077 CA ALA A 73 -11.055 5.215 -9.641 1.00 1.00 C ATOM 1078 C ALA A 73 -12.418 5.105 -10.335 1.00 1.00 C ATOM 1079 O ALA A 73 -12.597 5.607 -11.444 1.00 1.00 O ATOM 1080 CB ALA A 73 -10.665 6.692 -9.454 1.00 1.00 C ATOM 0 H ALA A 73 -9.372 5.149 -10.909 1.00 1.00 H new ATOM 0 HA ALA A 73 -11.121 4.744 -8.660 1.00 1.00 H new ATOM 0 HB1 ALA A 73 -11.425 7.196 -8.857 1.00 1.00 H new ATOM 0 HB2 ALA A 73 -9.704 6.753 -8.944 1.00 1.00 H new ATOM 0 HB3 ALA A 73 -10.590 7.175 -10.428 1.00 1.00 H new ATOM 1086 N THR A 74 -13.371 4.463 -9.668 1.00 1.00 N ATOM 1087 CA THR A 74 -14.734 4.279 -10.225 1.00 1.00 C ATOM 1088 C THR A 74 -15.713 5.223 -9.528 1.00 1.00 C ATOM 1089 O THR A 74 -15.905 5.160 -8.313 1.00 1.00 O ATOM 1090 CB THR A 74 -15.201 2.821 -9.997 1.00 1.00 C ATOM 1091 OG1 THR A 74 -15.431 2.615 -8.610 1.00 1.00 O ATOM 1092 CG2 THR A 74 -14.127 1.826 -10.484 1.00 1.00 C ATOM 0 H THR A 74 -13.239 4.057 -8.742 1.00 1.00 H new ATOM 0 HA THR A 74 -14.708 4.497 -11.293 1.00 1.00 H new ATOM 0 HB THR A 74 -16.119 2.654 -10.561 1.00 1.00 H new ATOM 0 HG1 THR A 74 -15.508 3.482 -8.159 1.00 1.00 H new ATOM 0 HG21 THR A 74 -14.473 0.806 -10.316 1.00 1.00 H new ATOM 0 HG22 THR A 74 -13.947 1.977 -11.548 1.00 1.00 H new ATOM 0 HG23 THR A 74 -13.201 1.991 -9.932 1.00 1.00 H new ATOM 1100 N ARG A 75 -16.325 6.107 -10.312 1.00 1.00 N ATOM 1101 CA ARG A 75 -17.290 7.074 -9.773 1.00 1.00 C ATOM 1102 C ARG A 75 -18.006 7.803 -10.923 1.00 1.00 C ATOM 1103 O ARG A 75 -17.381 8.538 -11.687 1.00 1.00 O ATOM 1104 CB ARG A 75 -16.567 8.096 -8.853 1.00 1.00 C ATOM 1105 CG ARG A 75 -17.581 9.083 -8.210 1.00 1.00 C ATOM 1106 CD ARG A 75 -16.881 9.978 -7.168 1.00 1.00 C ATOM 1107 NE ARG A 75 -16.364 9.154 -6.069 1.00 1.00 N ATOM 1108 CZ ARG A 75 -15.688 9.679 -5.038 1.00 1.00 C ATOM 1109 NH1 ARG A 75 -15.417 10.957 -4.994 1.00 1.00 N ATOM 1110 NH2 ARG A 75 -15.283 8.901 -4.074 1.00 1.00 N ATOM 0 H ARG A 75 -16.174 6.177 -11.318 1.00 1.00 H new ATOM 0 HA ARG A 75 -18.033 6.539 -9.182 1.00 1.00 H new ATOM 0 HB2 ARG A 75 -16.024 7.566 -8.070 1.00 1.00 H new ATOM 0 HB3 ARG A 75 -15.829 8.653 -9.431 1.00 1.00 H new ATOM 0 HG2 ARG A 75 -18.034 9.703 -8.984 1.00 1.00 H new ATOM 0 HG3 ARG A 75 -18.388 8.525 -7.735 1.00 1.00 H new ATOM 0 HD2 ARG A 75 -16.065 10.527 -7.637 1.00 1.00 H new ATOM 0 HD3 ARG A 75 -17.582 10.717 -6.781 1.00 1.00 H new ATOM 0 HE ARG A 75 -16.525 8.147 -6.091 1.00 1.00 H new ATOM 0 HH11 ARG A 75 -15.721 11.569 -5.751 1.00 1.00 H new ATOM 0 HH12 ARG A 75 -14.902 11.342 -4.203 1.00 1.00 H new ATOM 0 HH21 ARG A 75 -15.481 7.901 -4.108 1.00 1.00 H new ATOM 0 HH22 ARG A 75 -14.768 9.292 -3.285 1.00 1.00 H new ATOM 1124 N LYS A 76 -19.317 7.607 -11.017 1.00 1.00 N ATOM 1125 CA LYS A 76 -20.138 8.254 -12.071 1.00 1.00 C ATOM 1126 C LYS A 76 -21.397 8.840 -11.463 1.00 1.00 C ATOM 1127 O LYS A 76 -22.416 8.161 -11.324 1.00 1.00 O ATOM 1128 CB LYS A 76 -20.516 7.218 -13.157 1.00 1.00 C ATOM 1129 CG LYS A 76 -19.233 6.678 -13.815 1.00 1.00 C ATOM 1130 CD LYS A 76 -19.569 5.667 -14.931 1.00 1.00 C ATOM 1131 CE LYS A 76 -18.267 5.102 -15.533 1.00 1.00 C ATOM 1132 NZ LYS A 76 -17.432 6.220 -16.061 1.00 1.00 N ATOM 0 H LYS A 76 -19.847 7.008 -10.383 1.00 1.00 H new ATOM 0 HA LYS A 76 -19.557 9.055 -12.527 1.00 1.00 H new ATOM 0 HB2 LYS A 76 -21.083 6.400 -12.713 1.00 1.00 H new ATOM 0 HB3 LYS A 76 -21.157 7.679 -13.908 1.00 1.00 H new ATOM 0 HG2 LYS A 76 -18.657 7.505 -14.230 1.00 1.00 H new ATOM 0 HG3 LYS A 76 -18.607 6.199 -13.062 1.00 1.00 H new ATOM 0 HD2 LYS A 76 -20.176 4.856 -14.529 1.00 1.00 H new ATOM 0 HD3 LYS A 76 -20.159 6.152 -15.708 1.00 1.00 H new ATOM 0 HE2 LYS A 76 -17.714 4.549 -14.774 1.00 1.00 H new ATOM 0 HE3 LYS A 76 -18.500 4.399 -16.333 1.00 1.00 H new ATOM 0 HZ1 LYS A 76 -16.735 5.844 -16.735 1.00 1.00 H new ATOM 0 HZ2 LYS A 76 -18.042 6.911 -16.543 1.00 1.00 H new ATOM 0 HZ3 LYS A 76 -16.936 6.685 -15.274 1.00 1.00 H new ATOM 1146 N LEU A 77 -21.329 10.122 -11.115 1.00 1.00 N ATOM 1147 CA LEU A 77 -22.465 10.841 -10.516 1.00 1.00 C ATOM 1148 C LEU A 77 -23.096 11.777 -11.551 1.00 1.00 C ATOM 1149 O LEU A 77 -22.901 11.615 -12.756 1.00 1.00 O ATOM 1150 CB LEU A 77 -21.979 11.658 -9.282 1.00 1.00 C ATOM 1151 CG LEU A 77 -21.189 10.762 -8.281 1.00 1.00 C ATOM 1152 CD1 LEU A 77 -20.714 11.616 -7.080 1.00 1.00 C ATOM 1153 CD2 LEU A 77 -22.058 9.573 -7.774 1.00 1.00 C ATOM 0 H LEU A 77 -20.494 10.695 -11.236 1.00 1.00 H new ATOM 0 HA LEU A 77 -23.214 10.119 -10.192 1.00 1.00 H new ATOM 0 HB2 LEU A 77 -21.345 12.480 -9.615 1.00 1.00 H new ATOM 0 HB3 LEU A 77 -22.837 12.101 -8.777 1.00 1.00 H new ATOM 0 HG LEU A 77 -20.326 10.349 -8.803 1.00 1.00 H new ATOM 0 HD11 LEU A 77 -20.162 10.987 -6.382 1.00 1.00 H new ATOM 0 HD12 LEU A 77 -20.066 12.417 -7.437 1.00 1.00 H new ATOM 0 HD13 LEU A 77 -21.579 12.046 -6.575 1.00 1.00 H new ATOM 0 HD21 LEU A 77 -21.477 8.968 -7.078 1.00 1.00 H new ATOM 0 HD22 LEU A 77 -22.943 9.959 -7.268 1.00 1.00 H new ATOM 0 HD23 LEU A 77 -22.363 8.958 -8.621 1.00 1.00 H new ATOM 1165 N ALA A 78 -23.861 12.751 -11.066 1.00 1.00 N ATOM 1166 CA ALA A 78 -24.526 13.715 -11.955 1.00 1.00 C ATOM 1167 C ALA A 78 -24.981 14.948 -11.170 1.00 1.00 C ATOM 1168 O ALA A 78 -26.177 15.209 -11.037 1.00 1.00 O ATOM 1169 CB ALA A 78 -25.727 13.037 -12.642 1.00 1.00 C ATOM 0 H ALA A 78 -24.038 12.898 -10.072 1.00 1.00 H new ATOM 0 HA ALA A 78 -23.818 14.044 -12.716 1.00 1.00 H new ATOM 0 HB1 ALA A 78 -26.220 13.752 -13.301 1.00 1.00 H new ATOM 0 HB2 ALA A 78 -25.379 12.185 -13.226 1.00 1.00 H new ATOM 0 HB3 ALA A 78 -26.433 12.694 -11.886 1.00 1.00 H new ATOM 1175 N GLY A 79 -24.014 15.703 -10.658 1.00 1.00 N ATOM 1176 CA GLY A 79 -24.306 16.915 -9.893 1.00 1.00 C ATOM 1177 C GLY A 79 -23.021 17.562 -9.384 1.00 1.00 C ATOM 1178 O GLY A 79 -21.932 17.318 -9.907 1.00 1.00 O ATOM 0 H GLY A 79 -23.020 15.498 -10.758 1.00 1.00 H new ATOM 0 HA2 GLY A 79 -24.851 17.622 -10.519 1.00 1.00 H new ATOM 0 HA3 GLY A 79 -24.953 16.671 -9.051 1.00 1.00 H new ATOM 1182 N ARG A 80 -23.160 18.399 -8.360 1.00 1.00 N ATOM 1183 CA ARG A 80 -22.008 19.094 -7.771 1.00 1.00 C ATOM 1184 C ARG A 80 -21.030 18.088 -7.155 1.00 1.00 C ATOM 1185 O ARG A 80 -21.325 16.897 -7.065 1.00 1.00 O ATOM 1186 CB ARG A 80 -22.497 20.098 -6.699 1.00 1.00 C ATOM 1187 CG ARG A 80 -23.346 19.372 -5.625 1.00 1.00 C ATOM 1188 CD ARG A 80 -23.824 20.377 -4.557 1.00 1.00 C ATOM 1189 NE ARG A 80 -22.666 20.956 -3.860 1.00 1.00 N ATOM 1190 CZ ARG A 80 -21.927 20.258 -2.984 1.00 1.00 C ATOM 1191 NH1 ARG A 80 -22.234 19.021 -2.686 1.00 1.00 N ATOM 1192 NH2 ARG A 80 -20.896 20.822 -2.417 1.00 1.00 N ATOM 0 H ARG A 80 -24.054 18.615 -7.918 1.00 1.00 H new ATOM 0 HA ARG A 80 -21.485 19.639 -8.557 1.00 1.00 H new ATOM 0 HB2 ARG A 80 -21.641 20.583 -6.229 1.00 1.00 H new ATOM 0 HB3 ARG A 80 -23.089 20.883 -7.170 1.00 1.00 H new ATOM 0 HG2 ARG A 80 -24.205 18.891 -6.093 1.00 1.00 H new ATOM 0 HG3 ARG A 80 -22.757 18.584 -5.156 1.00 1.00 H new ATOM 0 HD2 ARG A 80 -24.410 21.168 -5.026 1.00 1.00 H new ATOM 0 HD3 ARG A 80 -24.477 19.877 -3.842 1.00 1.00 H new ATOM 0 HE ARG A 80 -22.415 21.926 -4.050 1.00 1.00 H new ATOM 0 HH11 ARG A 80 -23.043 18.577 -3.121 1.00 1.00 H new ATOM 0 HH12 ARG A 80 -21.664 18.501 -2.019 1.00 1.00 H new ATOM 0 HH21 ARG A 80 -20.656 21.788 -2.641 1.00 1.00 H new ATOM 0 HH22 ARG A 80 -20.330 20.297 -1.750 1.00 1.00 H new ATOM 1206 N ALA A 81 -19.873 18.582 -6.729 1.00 1.00 N ATOM 1207 CA ALA A 81 -18.845 17.729 -6.113 1.00 1.00 C ATOM 1208 C ALA A 81 -17.763 18.587 -5.436 1.00 1.00 C ATOM 1209 O ALA A 81 -17.174 19.472 -6.057 1.00 1.00 O ATOM 1210 CB ALA A 81 -18.200 16.831 -7.185 1.00 1.00 C ATOM 0 H ALA A 81 -19.617 19.567 -6.796 1.00 1.00 H new ATOM 0 HA ALA A 81 -19.321 17.106 -5.355 1.00 1.00 H new ATOM 0 HB1 ALA A 81 -17.439 16.202 -6.723 1.00 1.00 H new ATOM 0 HB2 ALA A 81 -18.964 16.201 -7.640 1.00 1.00 H new ATOM 0 HB3 ALA A 81 -17.739 17.454 -7.952 1.00 1.00 H new ATOM 1216 N ALA A 82 -17.505 18.304 -4.162 1.00 1.00 N ATOM 1217 CA ALA A 82 -16.489 19.049 -3.399 1.00 1.00 C ATOM 1218 C ALA A 82 -16.202 18.358 -2.066 1.00 1.00 C ATOM 1219 O ALA A 82 -15.679 18.975 -1.139 1.00 1.00 O ATOM 1220 CB ALA A 82 -16.986 20.484 -3.143 1.00 1.00 C ATOM 0 H ALA A 82 -17.978 17.571 -3.633 1.00 1.00 H new ATOM 0 HA ALA A 82 -15.567 19.078 -3.980 1.00 1.00 H new ATOM 0 HB1 ALA A 82 -16.233 21.034 -2.578 1.00 1.00 H new ATOM 0 HB2 ALA A 82 -17.162 20.983 -4.096 1.00 1.00 H new ATOM 0 HB3 ALA A 82 -17.915 20.451 -2.574 1.00 1.00 H new ATOM 1226 N ASN A 83 -16.541 17.077 -1.984 1.00 1.00 N ATOM 1227 CA ASN A 83 -16.327 16.289 -0.758 1.00 1.00 C ATOM 1228 C ASN A 83 -16.152 14.797 -1.123 1.00 1.00 C ATOM 1229 O ASN A 83 -16.875 13.952 -0.595 1.00 1.00 O ATOM 1230 CB ASN A 83 -17.530 16.474 0.184 1.00 1.00 C ATOM 1231 CG ASN A 83 -17.699 17.945 0.565 1.00 1.00 C ATOM 1232 OD1 ASN A 83 -18.635 18.600 0.105 1.00 1.00 O ATOM 1233 ND2 ASN A 83 -16.849 18.505 1.383 1.00 1.00 N ATOM 0 H ASN A 83 -16.967 16.553 -2.749 1.00 1.00 H new ATOM 0 HA ASN A 83 -15.425 16.633 -0.252 1.00 1.00 H new ATOM 0 HB2 ASN A 83 -18.437 16.113 -0.301 1.00 1.00 H new ATOM 0 HB3 ASN A 83 -17.389 15.874 1.083 1.00 1.00 H new ATOM 0 HD21 ASN A 83 -16.960 19.485 1.641 1.00 1.00 H new ATOM 0 HD22 ASN A 83 -16.074 17.962 1.764 1.00 1.00 H new ATOM 1240 N PRO A 84 -15.217 14.476 -1.976 1.00 1.00 N ATOM 1241 CA PRO A 84 -14.981 13.048 -2.376 1.00 1.00 C ATOM 1242 C PRO A 84 -14.505 12.197 -1.190 1.00 1.00 C ATOM 1243 O PRO A 84 -15.206 11.293 -0.736 1.00 1.00 O ATOM 1244 CB PRO A 84 -13.909 13.161 -3.509 1.00 1.00 C ATOM 1245 CG PRO A 84 -13.192 14.457 -3.225 1.00 1.00 C ATOM 1246 CD PRO A 84 -14.281 15.400 -2.681 1.00 1.00 C ATOM 0 HA PRO A 84 -15.885 12.542 -2.715 1.00 1.00 H new ATOM 0 HB2 PRO A 84 -13.222 12.315 -3.490 1.00 1.00 H new ATOM 0 HB3 PRO A 84 -14.374 13.173 -4.495 1.00 1.00 H new ATOM 0 HG2 PRO A 84 -12.393 14.315 -2.498 1.00 1.00 H new ATOM 0 HG3 PRO A 84 -12.734 14.861 -4.128 1.00 1.00 H new ATOM 0 HD2 PRO A 84 -13.865 16.145 -2.003 1.00 1.00 H new ATOM 0 HD3 PRO A 84 -14.780 15.943 -3.484 1.00 1.00 H new ATOM 1254 N GLY A 85 -13.301 12.489 -0.710 1.00 1.00 N ATOM 1255 CA GLY A 85 -12.738 11.742 0.417 1.00 1.00 C ATOM 1256 C GLY A 85 -12.515 10.282 0.036 1.00 1.00 C ATOM 1257 O GLY A 85 -13.309 9.406 0.377 1.00 1.00 O ATOM 0 H GLY A 85 -12.700 13.227 -1.076 1.00 1.00 H new ATOM 0 HA2 GLY A 85 -11.793 12.192 0.723 1.00 1.00 H new ATOM 0 HA3 GLY A 85 -13.411 11.801 1.272 1.00 1.00 H new ATOM 1261 N VAL A 86 -11.420 10.031 -0.673 1.00 1.00 N ATOM 1262 CA VAL A 86 -11.059 8.667 -1.125 1.00 1.00 C ATOM 1263 C VAL A 86 -9.671 8.298 -0.565 1.00 1.00 C ATOM 1264 O VAL A 86 -8.744 8.065 -1.343 1.00 1.00 O ATOM 1265 CB VAL A 86 -11.061 8.624 -2.689 1.00 1.00 C ATOM 1266 CG1 VAL A 86 -12.516 8.686 -3.222 1.00 1.00 C ATOM 1267 CG2 VAL A 86 -10.259 9.821 -3.268 1.00 1.00 C ATOM 0 H VAL A 86 -10.755 10.751 -0.955 1.00 1.00 H new ATOM 0 HA VAL A 86 -11.786 7.942 -0.758 1.00 1.00 H new ATOM 0 HB VAL A 86 -10.593 7.691 -3.004 1.00 1.00 H new ATOM 0 HG11 VAL A 86 -12.506 8.655 -4.312 1.00 1.00 H new ATOM 0 HG12 VAL A 86 -13.080 7.835 -2.840 1.00 1.00 H new ATOM 0 HG13 VAL A 86 -12.986 9.611 -2.889 1.00 1.00 H new ATOM 0 HG21 VAL A 86 -10.271 9.775 -4.357 1.00 1.00 H new ATOM 0 HG22 VAL A 86 -10.713 10.756 -2.940 1.00 1.00 H new ATOM 0 HG23 VAL A 86 -9.229 9.774 -2.914 1.00 1.00 H new ATOM 1277 N PRO A 87 -9.525 8.218 0.729 1.00 1.00 N ATOM 1278 CA PRO A 87 -8.216 7.840 1.357 1.00 1.00 C ATOM 1279 C PRO A 87 -7.834 6.399 1.017 1.00 1.00 C ATOM 1280 O PRO A 87 -8.641 5.607 0.531 1.00 1.00 O ATOM 1281 CB PRO A 87 -8.475 8.035 2.880 1.00 1.00 C ATOM 1282 CG PRO A 87 -9.949 7.784 3.005 1.00 1.00 C ATOM 1283 CD PRO A 87 -10.550 8.493 1.787 1.00 1.00 C ATOM 0 HA PRO A 87 -7.379 8.440 0.999 1.00 1.00 H new ATOM 0 HB2 PRO A 87 -7.894 7.336 3.481 1.00 1.00 H new ATOM 0 HB3 PRO A 87 -8.207 9.039 3.210 1.00 1.00 H new ATOM 0 HG2 PRO A 87 -10.174 6.718 2.998 1.00 1.00 H new ATOM 0 HG3 PRO A 87 -10.345 8.187 3.937 1.00 1.00 H new ATOM 0 HD2 PRO A 87 -11.528 8.091 1.522 1.00 1.00 H new ATOM 0 HD3 PRO A 87 -10.681 9.561 1.960 1.00 1.00 H new ATOM 1291 N VAL A 88 -6.574 6.074 1.292 1.00 1.00 N ATOM 1292 CA VAL A 88 -6.030 4.722 1.026 1.00 1.00 C ATOM 1293 C VAL A 88 -5.553 4.082 2.327 1.00 1.00 C ATOM 1294 O VAL A 88 -5.270 4.765 3.310 1.00 1.00 O ATOM 1295 CB VAL A 88 -4.856 4.833 0.010 1.00 1.00 C ATOM 1296 CG1 VAL A 88 -5.387 5.356 -1.347 1.00 1.00 C ATOM 1297 CG2 VAL A 88 -3.772 5.801 0.542 1.00 1.00 C ATOM 0 H VAL A 88 -5.900 6.722 1.700 1.00 1.00 H new ATOM 0 HA VAL A 88 -6.811 4.091 0.602 1.00 1.00 H new ATOM 0 HB VAL A 88 -4.416 3.845 -0.123 1.00 1.00 H new ATOM 0 HG11 VAL A 88 -4.562 5.432 -2.055 1.00 1.00 H new ATOM 0 HG12 VAL A 88 -6.136 4.666 -1.735 1.00 1.00 H new ATOM 0 HG13 VAL A 88 -5.837 6.339 -1.207 1.00 1.00 H new ATOM 0 HG21 VAL A 88 -2.958 5.868 -0.180 1.00 1.00 H new ATOM 0 HG22 VAL A 88 -4.208 6.789 0.690 1.00 1.00 H new ATOM 0 HG23 VAL A 88 -3.386 5.429 1.491 1.00 1.00 H new ATOM 1307 N TYR A 89 -5.458 2.756 2.316 1.00 1.00 N ATOM 1308 CA TYR A 89 -5.007 2.001 3.494 1.00 1.00 C ATOM 1309 C TYR A 89 -4.367 0.688 3.051 1.00 1.00 C ATOM 1310 O TYR A 89 -4.769 0.069 2.067 1.00 1.00 O ATOM 1311 CB TYR A 89 -6.200 1.716 4.444 1.00 1.00 C ATOM 1312 CG TYR A 89 -6.695 3.030 5.076 1.00 1.00 C ATOM 1313 CD1 TYR A 89 -6.005 3.581 6.177 1.00 1.00 C ATOM 1314 CD2 TYR A 89 -7.818 3.706 4.560 1.00 1.00 C ATOM 1315 CE1 TYR A 89 -6.434 4.786 6.749 1.00 1.00 C ATOM 1316 CE2 TYR A 89 -8.243 4.907 5.142 1.00 1.00 C ATOM 1317 CZ TYR A 89 -7.553 5.448 6.230 1.00 1.00 C ATOM 1318 OH TYR A 89 -7.972 6.639 6.788 1.00 1.00 O ATOM 0 H TYR A 89 -5.686 2.177 1.508 1.00 1.00 H new ATOM 0 HA TYR A 89 -4.270 2.597 4.032 1.00 1.00 H new ATOM 0 HB2 TYR A 89 -7.010 1.241 3.891 1.00 1.00 H new ATOM 0 HB3 TYR A 89 -5.895 1.019 5.225 1.00 1.00 H new ATOM 0 HD1 TYR A 89 -5.142 3.072 6.580 1.00 1.00 H new ATOM 0 HD2 TYR A 89 -8.352 3.298 3.715 1.00 1.00 H new ATOM 0 HE1 TYR A 89 -5.901 5.204 7.590 1.00 1.00 H new ATOM 0 HE2 TYR A 89 -9.109 5.418 4.748 1.00 1.00 H new ATOM 0 HH TYR A 89 -8.761 6.965 6.308 1.00 1.00 H new ATOM 1328 N ALA A 90 -3.363 0.265 3.813 1.00 1.00 N ATOM 1329 CA ALA A 90 -2.639 -0.984 3.526 1.00 1.00 C ATOM 1330 C ALA A 90 -2.307 -1.702 4.829 1.00 1.00 C ATOM 1331 O ALA A 90 -2.002 -1.079 5.845 1.00 1.00 O ATOM 1332 CB ALA A 90 -1.344 -0.652 2.764 1.00 1.00 C ATOM 0 H ALA A 90 -3.027 0.764 4.636 1.00 1.00 H new ATOM 0 HA ALA A 90 -3.263 -1.637 2.916 1.00 1.00 H new ATOM 0 HB1 ALA A 90 -0.803 -1.573 2.548 1.00 1.00 H new ATOM 0 HB2 ALA A 90 -1.591 -0.149 1.829 1.00 1.00 H new ATOM 0 HB3 ALA A 90 -0.720 0.001 3.374 1.00 1.00 H new ATOM 1338 N VAL A 91 -2.357 -3.029 4.781 1.00 1.00 N ATOM 1339 CA VAL A 91 -2.064 -3.868 5.964 1.00 1.00 C ATOM 1340 C VAL A 91 -1.091 -4.972 5.580 1.00 1.00 C ATOM 1341 O VAL A 91 -1.199 -5.589 4.520 1.00 1.00 O ATOM 1342 CB VAL A 91 -3.377 -4.476 6.529 1.00 1.00 C ATOM 1343 CG1 VAL A 91 -3.090 -5.312 7.810 1.00 1.00 C ATOM 1344 CG2 VAL A 91 -4.358 -3.332 6.874 1.00 1.00 C ATOM 0 H VAL A 91 -2.596 -3.557 3.942 1.00 1.00 H new ATOM 0 HA VAL A 91 -1.610 -3.249 6.738 1.00 1.00 H new ATOM 0 HB VAL A 91 -3.813 -5.132 5.776 1.00 1.00 H new ATOM 0 HG11 VAL A 91 -4.023 -5.729 8.189 1.00 1.00 H new ATOM 0 HG12 VAL A 91 -2.402 -6.122 7.569 1.00 1.00 H new ATOM 0 HG13 VAL A 91 -2.643 -4.671 8.570 1.00 1.00 H new ATOM 0 HG21 VAL A 91 -5.282 -3.752 7.271 1.00 1.00 H new ATOM 0 HG22 VAL A 91 -3.907 -2.678 7.620 1.00 1.00 H new ATOM 0 HG23 VAL A 91 -4.578 -2.758 5.974 1.00 1.00 H new ATOM 1354 N VAL A 92 -0.135 -5.219 6.468 1.00 1.00 N ATOM 1355 CA VAL A 92 0.881 -6.249 6.252 1.00 1.00 C ATOM 1356 C VAL A 92 0.431 -7.560 6.896 1.00 1.00 C ATOM 1357 O VAL A 92 -0.037 -7.574 8.034 1.00 1.00 O ATOM 1358 CB VAL A 92 2.237 -5.799 6.875 1.00 1.00 C ATOM 1359 CG1 VAL A 92 3.370 -6.748 6.408 1.00 1.00 C ATOM 1360 CG2 VAL A 92 2.558 -4.346 6.443 1.00 1.00 C ATOM 0 H VAL A 92 -0.040 -4.718 7.351 1.00 1.00 H new ATOM 0 HA VAL A 92 1.013 -6.398 5.180 1.00 1.00 H new ATOM 0 HB VAL A 92 2.161 -5.840 7.962 1.00 1.00 H new ATOM 0 HG11 VAL A 92 4.316 -6.429 6.846 1.00 1.00 H new ATOM 0 HG12 VAL A 92 3.147 -7.766 6.728 1.00 1.00 H new ATOM 0 HG13 VAL A 92 3.445 -6.717 5.321 1.00 1.00 H new ATOM 0 HG21 VAL A 92 3.507 -4.037 6.882 1.00 1.00 H new ATOM 0 HG22 VAL A 92 2.627 -4.296 5.356 1.00 1.00 H new ATOM 0 HG23 VAL A 92 1.766 -3.681 6.787 1.00 1.00 H new ATOM 1370 N ASP A 93 0.593 -8.660 6.166 1.00 1.00 N ATOM 1371 CA ASP A 93 0.214 -10.000 6.676 1.00 1.00 C ATOM 1372 C ASP A 93 1.418 -10.965 6.585 1.00 1.00 C ATOM 1373 O ASP A 93 1.474 -11.756 5.643 1.00 1.00 O ATOM 1374 CB ASP A 93 -0.958 -10.523 5.824 1.00 1.00 C ATOM 1375 CG ASP A 93 -2.145 -9.562 5.915 1.00 1.00 C ATOM 1376 OD1 ASP A 93 -2.926 -9.701 6.842 1.00 1.00 O ATOM 1377 OD2 ASP A 93 -2.255 -8.704 5.054 1.00 1.00 O ATOM 0 H ASP A 93 0.981 -8.664 5.223 1.00 1.00 H new ATOM 0 HA ASP A 93 -0.085 -9.934 7.722 1.00 1.00 H new ATOM 0 HB2 ASP A 93 -0.644 -10.628 4.785 1.00 1.00 H new ATOM 0 HB3 ASP A 93 -1.255 -11.513 6.169 1.00 1.00 H new ATOM 1382 N PRO A 94 2.339 -10.920 7.509 1.00 1.00 N ATOM 1383 CA PRO A 94 3.532 -11.831 7.482 1.00 1.00 C ATOM 1384 C PRO A 94 3.124 -13.307 7.544 1.00 1.00 C ATOM 1385 O PRO A 94 1.944 -13.644 7.652 1.00 1.00 O ATOM 1386 CB PRO A 94 4.365 -11.406 8.740 1.00 1.00 C ATOM 1387 CG PRO A 94 3.902 -10.006 9.031 1.00 1.00 C ATOM 1388 CD PRO A 94 2.402 -10.029 8.705 1.00 1.00 C ATOM 0 HA PRO A 94 4.101 -11.740 6.557 1.00 1.00 H new ATOM 0 HB2 PRO A 94 4.180 -12.071 9.584 1.00 1.00 H new ATOM 0 HB3 PRO A 94 5.436 -11.438 8.538 1.00 1.00 H new ATOM 0 HG2 PRO A 94 4.079 -9.737 10.072 1.00 1.00 H new ATOM 0 HG3 PRO A 94 4.431 -9.276 8.418 1.00 1.00 H new ATOM 0 HD2 PRO A 94 1.814 -10.422 9.534 1.00 1.00 H new ATOM 0 HD3 PRO A 94 2.020 -9.032 8.487 1.00 1.00 H new ATOM 1396 N ASP A 95 4.124 -14.179 7.489 1.00 1.00 N ATOM 1397 CA ASP A 95 3.887 -15.623 7.546 1.00 1.00 C ATOM 1398 C ASP A 95 3.299 -16.006 8.906 1.00 1.00 C ATOM 1399 O ASP A 95 2.405 -16.847 8.994 1.00 1.00 O ATOM 1400 CB ASP A 95 5.215 -16.371 7.296 1.00 1.00 C ATOM 1401 CG ASP A 95 4.993 -17.888 7.264 1.00 1.00 C ATOM 1402 OD1 ASP A 95 4.312 -18.345 6.363 1.00 1.00 O ATOM 1403 OD2 ASP A 95 5.504 -18.565 8.144 1.00 1.00 O ATOM 0 H ASP A 95 5.106 -13.916 7.405 1.00 1.00 H new ATOM 0 HA ASP A 95 3.171 -15.905 6.774 1.00 1.00 H new ATOM 0 HB2 ASP A 95 5.649 -16.043 6.351 1.00 1.00 H new ATOM 0 HB3 ASP A 95 5.931 -16.121 8.079 1.00 1.00 H new ATOM 1408 N ASN A 96 3.812 -15.382 9.962 1.00 1.00 N ATOM 1409 CA ASN A 96 3.358 -15.635 11.348 1.00 1.00 C ATOM 1410 C ASN A 96 2.594 -14.425 11.896 1.00 1.00 C ATOM 1411 O ASN A 96 3.038 -13.770 12.839 1.00 1.00 O ATOM 1412 CB ASN A 96 4.593 -15.926 12.228 1.00 1.00 C ATOM 1413 CG ASN A 96 5.348 -17.134 11.682 1.00 1.00 C ATOM 1414 OD1 ASN A 96 6.382 -16.979 11.033 1.00 1.00 O ATOM 1415 ND2 ASN A 96 4.890 -18.335 11.909 1.00 1.00 N ATOM 0 H ASN A 96 4.554 -14.685 9.894 1.00 1.00 H new ATOM 0 HA ASN A 96 2.684 -16.491 11.358 1.00 1.00 H new ATOM 0 HB2 ASN A 96 5.249 -15.056 12.249 1.00 1.00 H new ATOM 0 HB3 ASN A 96 4.282 -16.115 13.255 1.00 1.00 H new ATOM 0 HD21 ASN A 96 5.389 -19.148 11.548 1.00 1.00 H new ATOM 0 HD22 ASN A 96 4.033 -18.461 12.447 1.00 1.00 H new ATOM 1422 N ARG A 97 1.437 -14.150 11.305 1.00 1.00 N ATOM 1423 CA ARG A 97 0.587 -13.032 11.739 1.00 1.00 C ATOM 1424 C ARG A 97 0.083 -13.279 13.178 1.00 1.00 C ATOM 1425 O ARG A 97 -0.898 -13.992 13.387 1.00 1.00 O ATOM 1426 CB ARG A 97 -0.617 -12.851 10.753 1.00 1.00 C ATOM 1427 CG ARG A 97 -1.227 -14.224 10.358 1.00 1.00 C ATOM 1428 CD ARG A 97 -2.484 -14.029 9.494 1.00 1.00 C ATOM 1429 NE ARG A 97 -3.038 -15.342 9.123 1.00 1.00 N ATOM 1430 CZ ARG A 97 -2.443 -16.141 8.222 1.00 1.00 C ATOM 1431 NH1 ARG A 97 -1.361 -15.750 7.600 1.00 1.00 N ATOM 1432 NH2 ARG A 97 -2.948 -17.317 7.960 1.00 1.00 N ATOM 0 H ARG A 97 1.060 -14.683 10.522 1.00 1.00 H new ATOM 0 HA ARG A 97 1.176 -12.115 11.731 1.00 1.00 H new ATOM 0 HB2 ARG A 97 -1.382 -12.230 11.219 1.00 1.00 H new ATOM 0 HB3 ARG A 97 -0.282 -12.327 9.858 1.00 1.00 H new ATOM 0 HG2 ARG A 97 -0.490 -14.811 9.810 1.00 1.00 H new ATOM 0 HG3 ARG A 97 -1.480 -14.788 11.256 1.00 1.00 H new ATOM 0 HD2 ARG A 97 -3.228 -13.451 10.042 1.00 1.00 H new ATOM 0 HD3 ARG A 97 -2.236 -13.461 8.597 1.00 1.00 H new ATOM 0 HE ARG A 97 -3.902 -15.655 9.565 1.00 1.00 H new ATOM 0 HH11 ARG A 97 -0.963 -14.832 7.798 1.00 1.00 H new ATOM 0 HH12 ARG A 97 -0.915 -16.363 6.917 1.00 1.00 H new ATOM 0 HH21 ARG A 97 -3.793 -17.627 8.439 1.00 1.00 H new ATOM 0 HH22 ARG A 97 -2.497 -17.925 7.276 1.00 1.00 H new ATOM 1446 N VAL A 98 0.761 -12.678 14.151 1.00 1.00 N ATOM 1447 CA VAL A 98 0.391 -12.827 15.580 1.00 1.00 C ATOM 1448 C VAL A 98 0.353 -11.457 16.258 1.00 1.00 C ATOM 1449 O VAL A 98 0.930 -10.481 15.780 1.00 1.00 O ATOM 1450 CB VAL A 98 1.406 -13.771 16.290 1.00 1.00 C ATOM 1451 CG1 VAL A 98 1.029 -13.978 17.791 1.00 1.00 C ATOM 1452 CG2 VAL A 98 1.413 -15.143 15.568 1.00 1.00 C ATOM 0 H VAL A 98 1.572 -12.080 13.990 1.00 1.00 H new ATOM 0 HA VAL A 98 -0.603 -13.269 15.652 1.00 1.00 H new ATOM 0 HB VAL A 98 2.394 -13.313 16.246 1.00 1.00 H new ATOM 0 HG11 VAL A 98 1.755 -14.641 18.260 1.00 1.00 H new ATOM 0 HG12 VAL A 98 1.032 -13.016 18.303 1.00 1.00 H new ATOM 0 HG13 VAL A 98 0.036 -14.422 17.859 1.00 1.00 H new ATOM 0 HG21 VAL A 98 2.122 -15.809 16.060 1.00 1.00 H new ATOM 0 HG22 VAL A 98 0.415 -15.580 15.608 1.00 1.00 H new ATOM 0 HG23 VAL A 98 1.707 -15.005 14.527 1.00 1.00 H new ATOM 1462 N ALA A 99 -0.345 -11.402 17.388 1.00 1.00 N ATOM 1463 CA ALA A 99 -0.496 -10.162 18.154 1.00 1.00 C ATOM 1464 C ALA A 99 -1.137 -9.067 17.273 1.00 1.00 C ATOM 1465 O ALA A 99 -0.500 -8.518 16.374 1.00 1.00 O ATOM 1466 CB ALA A 99 0.864 -9.698 18.711 1.00 1.00 C ATOM 0 H ALA A 99 -0.819 -12.206 17.799 1.00 1.00 H new ATOM 0 HA ALA A 99 -1.156 -10.351 19.000 1.00 1.00 H new ATOM 0 HB1 ALA A 99 0.730 -8.776 19.276 1.00 1.00 H new ATOM 0 HB2 ALA A 99 1.271 -10.469 19.365 1.00 1.00 H new ATOM 0 HB3 ALA A 99 1.554 -9.521 17.886 1.00 1.00 H new ATOM 1472 N GLU A 100 -2.402 -8.763 17.552 1.00 1.00 N ATOM 1473 CA GLU A 100 -3.125 -7.746 16.769 1.00 1.00 C ATOM 1474 C GLU A 100 -2.586 -6.362 17.088 1.00 1.00 C ATOM 1475 O GLU A 100 -2.020 -5.679 16.234 1.00 1.00 O ATOM 1476 CB GLU A 100 -4.640 -7.826 17.082 1.00 1.00 C ATOM 1477 CG GLU A 100 -5.453 -6.861 16.178 1.00 1.00 C ATOM 1478 CD GLU A 100 -6.958 -6.975 16.462 1.00 1.00 C ATOM 1479 OE1 GLU A 100 -7.365 -7.953 17.070 1.00 1.00 O ATOM 1480 OE2 GLU A 100 -7.680 -6.078 16.058 1.00 1.00 O ATOM 0 H GLU A 100 -2.946 -9.194 18.300 1.00 1.00 H new ATOM 0 HA GLU A 100 -2.976 -7.936 15.706 1.00 1.00 H new ATOM 0 HB2 GLU A 100 -4.991 -8.848 16.935 1.00 1.00 H new ATOM 0 HB3 GLU A 100 -4.811 -7.578 18.129 1.00 1.00 H new ATOM 0 HG2 GLU A 100 -5.124 -5.836 16.347 1.00 1.00 H new ATOM 0 HG3 GLU A 100 -5.259 -7.089 15.130 1.00 1.00 H new ATOM 1487 N SER A 101 -2.767 -5.949 18.338 1.00 1.00 N ATOM 1488 CA SER A 101 -2.299 -4.617 18.792 1.00 1.00 C ATOM 1489 C SER A 101 -0.900 -4.290 18.222 1.00 1.00 C ATOM 1490 O SER A 101 -0.600 -3.135 17.919 1.00 1.00 O ATOM 1491 CB SER A 101 -2.232 -4.608 20.324 1.00 1.00 C ATOM 1492 OG SER A 101 -1.199 -5.493 20.747 1.00 1.00 O ATOM 0 H SER A 101 -3.229 -6.502 19.060 1.00 1.00 H new ATOM 0 HA SER A 101 -3.000 -3.863 18.433 1.00 1.00 H new ATOM 0 HB2 SER A 101 -2.036 -3.599 20.687 1.00 1.00 H new ATOM 0 HB3 SER A 101 -3.189 -4.917 20.745 1.00 1.00 H new ATOM 0 HG SER A 101 -1.148 -5.492 21.726 1.00 1.00 H new ATOM 1498 N ASP A 102 -0.084 -5.322 18.037 1.00 1.00 N ATOM 1499 CA ASP A 102 1.256 -5.154 17.457 1.00 1.00 C ATOM 1500 C ASP A 102 1.137 -4.728 15.987 1.00 1.00 C ATOM 1501 O ASP A 102 1.570 -3.637 15.617 1.00 1.00 O ATOM 1502 CB ASP A 102 2.034 -6.486 17.557 1.00 1.00 C ATOM 1503 CG ASP A 102 3.481 -6.317 17.069 1.00 1.00 C ATOM 1504 OD1 ASP A 102 4.105 -5.339 17.448 1.00 1.00 O ATOM 1505 OD2 ASP A 102 3.943 -7.171 16.326 1.00 1.00 O ATOM 0 H ASP A 102 -0.321 -6.285 18.278 1.00 1.00 H new ATOM 0 HA ASP A 102 1.793 -4.382 18.008 1.00 1.00 H new ATOM 0 HB2 ASP A 102 2.033 -6.835 18.590 1.00 1.00 H new ATOM 0 HB3 ASP A 102 1.533 -7.250 16.962 1.00 1.00 H new ATOM 1510 N LYS A 103 0.554 -5.593 15.165 1.00 1.00 N ATOM 1511 CA LYS A 103 0.381 -5.294 13.713 1.00 1.00 C ATOM 1512 C LYS A 103 -0.098 -3.837 13.499 1.00 1.00 C ATOM 1513 O LYS A 103 0.382 -3.133 12.609 1.00 1.00 O ATOM 1514 CB LYS A 103 -0.643 -6.282 13.094 1.00 1.00 C ATOM 1515 CG LYS A 103 -0.741 -6.093 11.554 1.00 1.00 C ATOM 1516 CD LYS A 103 -1.691 -7.147 10.909 1.00 1.00 C ATOM 1517 CE LYS A 103 -3.179 -6.921 11.304 1.00 1.00 C ATOM 1518 NZ LYS A 103 -3.555 -5.485 11.131 1.00 1.00 N ATOM 0 H LYS A 103 0.191 -6.501 15.456 1.00 1.00 H new ATOM 0 HA LYS A 103 1.346 -5.411 13.220 1.00 1.00 H new ATOM 0 HB2 LYS A 103 -0.347 -7.306 13.320 1.00 1.00 H new ATOM 0 HB3 LYS A 103 -1.623 -6.126 13.546 1.00 1.00 H new ATOM 0 HG2 LYS A 103 -1.104 -5.090 11.332 1.00 1.00 H new ATOM 0 HG3 LYS A 103 0.252 -6.178 11.112 1.00 1.00 H new ATOM 0 HD2 LYS A 103 -1.595 -7.104 9.824 1.00 1.00 H new ATOM 0 HD3 LYS A 103 -1.384 -8.146 11.217 1.00 1.00 H new ATOM 0 HE2 LYS A 103 -3.824 -7.548 10.689 1.00 1.00 H new ATOM 0 HE3 LYS A 103 -3.336 -7.222 12.340 1.00 1.00 H new ATOM 0 HZ1 LYS A 103 -4.493 -5.423 10.686 1.00 1.00 H new ATOM 0 HZ2 LYS A 103 -3.581 -5.019 12.060 1.00 1.00 H new ATOM 0 HZ3 LYS A 103 -2.853 -5.013 10.526 1.00 1.00 H new ATOM 1532 N ALA A 104 -1.029 -3.403 14.341 1.00 1.00 N ATOM 1533 CA ALA A 104 -1.546 -2.013 14.271 1.00 1.00 C ATOM 1534 C ALA A 104 -0.391 -0.965 14.369 1.00 1.00 C ATOM 1535 O ALA A 104 -0.617 0.244 14.316 1.00 1.00 O ATOM 1536 CB ALA A 104 -2.561 -1.772 15.404 1.00 1.00 C ATOM 0 H ALA A 104 -1.446 -3.974 15.076 1.00 1.00 H new ATOM 0 HA ALA A 104 -2.035 -1.888 13.305 1.00 1.00 H new ATOM 0 HB1 ALA A 104 -2.936 -0.750 15.346 1.00 1.00 H new ATOM 0 HB2 ALA A 104 -3.392 -2.470 15.302 1.00 1.00 H new ATOM 0 HB3 ALA A 104 -2.074 -1.926 16.367 1.00 1.00 H new ATOM 1542 N ASN A 105 0.833 -1.467 14.492 1.00 1.00 N ATOM 1543 CA ASN A 105 2.032 -0.602 14.577 1.00 1.00 C ATOM 1544 C ASN A 105 2.654 -0.448 13.191 1.00 1.00 C ATOM 1545 O ASN A 105 3.869 -0.296 13.064 1.00 1.00 O ATOM 1546 CB ASN A 105 3.081 -1.186 15.557 1.00 1.00 C ATOM 1547 CG ASN A 105 2.481 -1.375 16.953 1.00 1.00 C ATOM 1548 OD1 ASN A 105 2.987 -2.176 17.738 1.00 1.00 O ATOM 1549 ND2 ASN A 105 1.432 -0.686 17.311 1.00 1.00 N ATOM 0 H ASN A 105 1.034 -2.466 14.536 1.00 1.00 H new ATOM 0 HA ASN A 105 1.721 0.372 14.954 1.00 1.00 H new ATOM 0 HB2 ASN A 105 3.443 -2.143 15.180 1.00 1.00 H new ATOM 0 HB3 ASN A 105 3.942 -0.519 15.614 1.00 1.00 H new ATOM 0 HD21 ASN A 105 1.032 -0.812 18.241 1.00 1.00 H new ATOM 0 HD22 ASN A 105 1.012 -0.022 16.661 1.00 1.00 H new ATOM 1556 N ASN A 106 1.815 -0.458 12.160 1.00 1.00 N ATOM 1557 CA ASN A 106 2.273 -0.324 10.771 1.00 1.00 C ATOM 1558 C ASN A 106 1.113 0.133 9.875 1.00 1.00 C ATOM 1559 O ASN A 106 0.913 -0.408 8.788 1.00 1.00 O ATOM 1560 CB ASN A 106 2.820 -1.683 10.265 1.00 1.00 C ATOM 1561 CG ASN A 106 4.074 -2.106 11.030 1.00 1.00 C ATOM 1562 OD1 ASN A 106 4.091 -3.164 11.660 1.00 1.00 O ATOM 1563 ND2 ASN A 106 5.131 -1.341 11.010 1.00 1.00 N ATOM 0 H ASN A 106 0.805 -0.558 12.257 1.00 1.00 H new ATOM 0 HA ASN A 106 3.067 0.421 10.731 1.00 1.00 H new ATOM 0 HB2 ASN A 106 2.051 -2.448 10.374 1.00 1.00 H new ATOM 0 HB3 ASN A 106 3.049 -1.610 9.202 1.00 1.00 H new ATOM 0 HD21 ASN A 106 5.972 -1.619 11.516 1.00 1.00 H new ATOM 0 HD22 ASN A 106 5.117 -0.465 10.488 1.00 1.00 H new ATOM 1570 N VAL A 107 0.377 1.143 10.327 1.00 1.00 N ATOM 1571 CA VAL A 107 -0.761 1.685 9.550 1.00 1.00 C ATOM 1572 C VAL A 107 -0.303 2.926 8.785 1.00 1.00 C ATOM 1573 O VAL A 107 -0.141 4.002 9.360 1.00 1.00 O ATOM 1574 CB VAL A 107 -1.941 2.044 10.500 1.00 1.00 C ATOM 1575 CG1 VAL A 107 -3.196 2.453 9.681 1.00 1.00 C ATOM 1576 CG2 VAL A 107 -2.283 0.815 11.376 1.00 1.00 C ATOM 0 H VAL A 107 0.537 1.609 11.220 1.00 1.00 H new ATOM 0 HA VAL A 107 -1.107 0.931 8.843 1.00 1.00 H new ATOM 0 HB VAL A 107 -1.643 2.883 11.129 1.00 1.00 H new ATOM 0 HG11 VAL A 107 -4.010 2.700 10.362 1.00 1.00 H new ATOM 0 HG12 VAL A 107 -2.962 3.321 9.065 1.00 1.00 H new ATOM 0 HG13 VAL A 107 -3.498 1.625 9.040 1.00 1.00 H new ATOM 0 HG21 VAL A 107 -3.109 1.062 12.043 1.00 1.00 H new ATOM 0 HG22 VAL A 107 -2.570 -0.019 10.736 1.00 1.00 H new ATOM 0 HG23 VAL A 107 -1.411 0.535 11.967 1.00 1.00 H new ATOM 1586 N PHE A 108 -0.105 2.764 7.482 1.00 1.00 N ATOM 1587 CA PHE A 108 0.340 3.866 6.609 1.00 1.00 C ATOM 1588 C PHE A 108 -0.795 4.282 5.670 1.00 1.00 C ATOM 1589 O PHE A 108 -1.425 3.441 5.027 1.00 1.00 O ATOM 1590 CB PHE A 108 1.555 3.391 5.793 1.00 1.00 C ATOM 1591 CG PHE A 108 2.671 2.941 6.752 1.00 1.00 C ATOM 1592 CD1 PHE A 108 3.376 3.903 7.501 1.00 1.00 C ATOM 1593 CD2 PHE A 108 3.004 1.575 6.896 1.00 1.00 C ATOM 1594 CE1 PHE A 108 4.397 3.508 8.378 1.00 1.00 C ATOM 1595 CE2 PHE A 108 4.025 1.188 7.775 1.00 1.00 C ATOM 1596 CZ PHE A 108 4.721 2.153 8.513 1.00 1.00 C ATOM 0 H PHE A 108 -0.244 1.878 6.996 1.00 1.00 H new ATOM 0 HA PHE A 108 0.619 4.728 7.215 1.00 1.00 H new ATOM 0 HB2 PHE A 108 1.268 2.567 5.139 1.00 1.00 H new ATOM 0 HB3 PHE A 108 1.914 4.196 5.152 1.00 1.00 H new ATOM 0 HD1 PHE A 108 3.129 4.950 7.400 1.00 1.00 H new ATOM 0 HD2 PHE A 108 2.471 0.828 6.327 1.00 1.00 H new ATOM 0 HE1 PHE A 108 4.934 4.250 8.950 1.00 1.00 H new ATOM 0 HE2 PHE A 108 4.275 0.143 7.883 1.00 1.00 H new ATOM 0 HZ PHE A 108 5.509 1.851 9.187 1.00 1.00 H new ATOM 1606 N SER A 109 -1.035 5.586 5.588 1.00 1.00 N ATOM 1607 CA SER A 109 -2.098 6.129 4.737 1.00 1.00 C ATOM 1608 C SER A 109 -1.898 7.627 4.539 1.00 1.00 C ATOM 1609 O SER A 109 -1.465 8.340 5.444 1.00 1.00 O ATOM 1610 CB SER A 109 -3.457 5.882 5.403 1.00 1.00 C ATOM 1611 OG SER A 109 -4.463 6.632 4.732 1.00 1.00 O ATOM 0 H SER A 109 -0.508 6.293 6.101 1.00 1.00 H new ATOM 0 HA SER A 109 -2.065 5.634 3.766 1.00 1.00 H new ATOM 0 HB2 SER A 109 -3.700 4.820 5.372 1.00 1.00 H new ATOM 0 HB3 SER A 109 -3.416 6.169 6.454 1.00 1.00 H new ATOM 0 HG SER A 109 -4.681 6.198 3.881 1.00 1.00 H new ATOM 1617 N ARG A 110 -2.227 8.101 3.341 1.00 1.00 N ATOM 1618 CA ARG A 110 -2.093 9.537 3.008 1.00 1.00 C ATOM 1619 C ARG A 110 -3.361 10.037 2.312 1.00 1.00 C ATOM 1620 O ARG A 110 -3.863 9.423 1.371 1.00 1.00 O ATOM 1621 CB ARG A 110 -0.864 9.742 2.091 1.00 1.00 C ATOM 1622 CG ARG A 110 -0.616 11.251 1.827 1.00 1.00 C ATOM 1623 CD ARG A 110 0.606 11.446 0.915 1.00 1.00 C ATOM 1624 NE ARG A 110 0.888 12.880 0.774 1.00 1.00 N ATOM 1625 CZ ARG A 110 1.773 13.357 -0.114 1.00 1.00 C ATOM 1626 NH1 ARG A 110 2.448 12.545 -0.888 1.00 1.00 N ATOM 1627 NH2 ARG A 110 1.980 14.643 -0.190 1.00 1.00 N ATOM 0 H ARG A 110 -2.587 7.525 2.581 1.00 1.00 H new ATOM 0 HA ARG A 110 -1.954 10.107 3.926 1.00 1.00 H new ATOM 0 HB2 ARG A 110 0.018 9.300 2.554 1.00 1.00 H new ATOM 0 HB3 ARG A 110 -1.021 9.224 1.145 1.00 1.00 H new ATOM 0 HG2 ARG A 110 -1.497 11.694 1.363 1.00 1.00 H new ATOM 0 HG3 ARG A 110 -0.458 11.770 2.772 1.00 1.00 H new ATOM 0 HD2 ARG A 110 1.472 10.934 1.335 1.00 1.00 H new ATOM 0 HD3 ARG A 110 0.417 11.004 -0.063 1.00 1.00 H new ATOM 0 HE ARG A 110 0.392 13.539 1.374 1.00 1.00 H new ATOM 0 HH11 ARG A 110 2.304 11.538 -0.820 1.00 1.00 H new ATOM 0 HH12 ARG A 110 3.118 12.920 -1.559 1.00 1.00 H new ATOM 0 HH21 ARG A 110 1.470 15.279 0.424 1.00 1.00 H new ATOM 0 HH22 ARG A 110 2.652 15.013 -0.863 1.00 1.00 H new ATOM 1641 N ILE A 111 -3.860 11.176 2.782 1.00 1.00 N ATOM 1642 CA ILE A 111 -5.063 11.780 2.202 1.00 1.00 C ATOM 1643 C ILE A 111 -4.661 12.542 0.931 1.00 1.00 C ATOM 1644 O ILE A 111 -3.662 13.259 0.895 1.00 1.00 O ATOM 1645 CB ILE A 111 -5.750 12.736 3.251 1.00 1.00 C ATOM 1646 CG1 ILE A 111 -6.468 11.891 4.362 1.00 1.00 C ATOM 1647 CG2 ILE A 111 -6.808 13.677 2.577 1.00 1.00 C ATOM 1648 CD1 ILE A 111 -5.495 10.937 5.080 1.00 1.00 C ATOM 0 H ILE A 111 -3.456 11.700 3.558 1.00 1.00 H new ATOM 0 HA ILE A 111 -5.787 11.008 1.941 1.00 1.00 H new ATOM 0 HB ILE A 111 -4.964 13.351 3.688 1.00 1.00 H new ATOM 0 HG12 ILE A 111 -6.922 12.562 5.091 1.00 1.00 H new ATOM 0 HG13 ILE A 111 -7.276 11.314 3.913 1.00 1.00 H new ATOM 0 HG21 ILE A 111 -7.258 14.319 3.334 1.00 1.00 H new ATOM 0 HG22 ILE A 111 -6.319 14.293 1.822 1.00 1.00 H new ATOM 0 HG23 ILE A 111 -7.584 13.074 2.105 1.00 1.00 H new ATOM 0 HD11 ILE A 111 -6.034 10.372 5.841 1.00 1.00 H new ATOM 0 HD12 ILE A 111 -5.061 10.248 4.356 1.00 1.00 H new ATOM 0 HD13 ILE A 111 -4.701 11.515 5.552 1.00 1.00 H new ATOM 1660 N VAL A 112 -5.484 12.394 -0.102 1.00 1.00 N ATOM 1661 CA VAL A 112 -5.241 13.068 -1.394 1.00 1.00 C ATOM 1662 C VAL A 112 -6.562 13.583 -1.965 1.00 1.00 C ATOM 1663 O VAL A 112 -7.610 12.948 -1.842 1.00 1.00 O ATOM 1664 CB VAL A 112 -4.544 12.092 -2.399 1.00 1.00 C ATOM 1665 CG1 VAL A 112 -3.099 11.776 -1.929 1.00 1.00 C ATOM 1666 CG2 VAL A 112 -5.346 10.774 -2.509 1.00 1.00 C ATOM 0 H VAL A 112 -6.325 11.818 -0.080 1.00 1.00 H new ATOM 0 HA VAL A 112 -4.575 13.916 -1.233 1.00 1.00 H new ATOM 0 HB VAL A 112 -4.507 12.575 -3.376 1.00 1.00 H new ATOM 0 HG11 VAL A 112 -2.626 11.096 -2.638 1.00 1.00 H new ATOM 0 HG12 VAL A 112 -2.524 12.700 -1.874 1.00 1.00 H new ATOM 0 HG13 VAL A 112 -3.130 11.309 -0.944 1.00 1.00 H new ATOM 0 HG21 VAL A 112 -4.850 10.104 -3.211 1.00 1.00 H new ATOM 0 HG22 VAL A 112 -5.400 10.298 -1.530 1.00 1.00 H new ATOM 0 HG23 VAL A 112 -6.354 10.990 -2.863 1.00 1.00 H new ATOM 1676 N LYS A 113 -6.494 14.753 -2.594 1.00 1.00 N ATOM 1677 CA LYS A 113 -7.678 15.393 -3.200 1.00 1.00 C ATOM 1678 C LYS A 113 -7.449 15.610 -4.694 1.00 1.00 C ATOM 1679 O LYS A 113 -6.345 15.908 -5.151 1.00 1.00 O ATOM 1680 CB LYS A 113 -7.976 16.732 -2.479 1.00 1.00 C ATOM 1681 CG LYS A 113 -9.271 17.394 -3.047 1.00 1.00 C ATOM 1682 CD LYS A 113 -9.720 18.602 -2.174 1.00 1.00 C ATOM 1683 CE LYS A 113 -8.633 19.701 -2.113 1.00 1.00 C ATOM 1684 NZ LYS A 113 -9.255 20.971 -1.632 1.00 1.00 N ATOM 0 H LYS A 113 -5.631 15.286 -2.702 1.00 1.00 H new ATOM 0 HA LYS A 113 -8.543 14.741 -3.083 1.00 1.00 H new ATOM 0 HB2 LYS A 113 -8.092 16.556 -1.410 1.00 1.00 H new ATOM 0 HB3 LYS A 113 -7.132 17.411 -2.601 1.00 1.00 H new ATOM 0 HG2 LYS A 113 -9.093 17.728 -4.069 1.00 1.00 H new ATOM 0 HG3 LYS A 113 -10.071 16.655 -3.088 1.00 1.00 H new ATOM 0 HD2 LYS A 113 -10.640 19.022 -2.581 1.00 1.00 H new ATOM 0 HD3 LYS A 113 -9.946 18.257 -1.165 1.00 1.00 H new ATOM 0 HE2 LYS A 113 -7.828 19.398 -1.443 1.00 1.00 H new ATOM 0 HE3 LYS A 113 -8.190 19.848 -3.098 1.00 1.00 H new ATOM 0 HZ1 LYS A 113 -8.532 21.717 -1.588 1.00 1.00 H new ATOM 0 HZ2 LYS A 113 -10.009 21.259 -2.288 1.00 1.00 H new ATOM 0 HZ3 LYS A 113 -9.658 20.823 -0.685 1.00 1.00 H new ATOM 1698 N VAL A 114 -8.527 15.444 -5.456 1.00 1.00 N ATOM 1699 CA VAL A 114 -8.491 15.593 -6.926 1.00 1.00 C ATOM 1700 C VAL A 114 -9.491 16.661 -7.376 1.00 1.00 C ATOM 1701 O VAL A 114 -10.620 16.725 -6.891 1.00 1.00 O ATOM 1702 CB VAL A 114 -8.807 14.214 -7.575 1.00 1.00 C ATOM 1703 CG1 VAL A 114 -10.237 13.735 -7.219 1.00 1.00 C ATOM 1704 CG2 VAL A 114 -8.649 14.274 -9.114 1.00 1.00 C ATOM 0 H VAL A 114 -9.447 15.204 -5.086 1.00 1.00 H new ATOM 0 HA VAL A 114 -7.501 15.918 -7.245 1.00 1.00 H new ATOM 0 HB VAL A 114 -8.090 13.499 -7.172 1.00 1.00 H new ATOM 0 HG11 VAL A 114 -10.425 12.769 -7.688 1.00 1.00 H new ATOM 0 HG12 VAL A 114 -10.329 13.637 -6.137 1.00 1.00 H new ATOM 0 HG13 VAL A 114 -10.965 14.462 -7.581 1.00 1.00 H new ATOM 0 HG21 VAL A 114 -8.876 13.297 -9.541 1.00 1.00 H new ATOM 0 HG22 VAL A 114 -9.335 15.017 -9.522 1.00 1.00 H new ATOM 0 HG23 VAL A 114 -7.625 14.551 -9.364 1.00 1.00 H new ATOM 1714 N LEU A 115 -9.060 17.492 -8.319 1.00 1.00 N ATOM 1715 CA LEU A 115 -9.915 18.565 -8.845 1.00 1.00 C ATOM 1716 C LEU A 115 -9.554 18.845 -10.304 1.00 1.00 C ATOM 1717 O LEU A 115 -8.382 18.925 -10.673 1.00 1.00 O ATOM 1718 CB LEU A 115 -9.755 19.857 -7.975 1.00 1.00 C ATOM 1719 CG LEU A 115 -10.930 20.898 -8.233 1.00 1.00 C ATOM 1720 CD1 LEU A 115 -12.156 20.583 -7.331 1.00 1.00 C ATOM 1721 CD2 LEU A 115 -10.458 22.350 -7.945 1.00 1.00 C ATOM 0 H LEU A 115 -8.130 17.449 -8.737 1.00 1.00 H new ATOM 0 HA LEU A 115 -10.957 18.250 -8.799 1.00 1.00 H new ATOM 0 HB2 LEU A 115 -9.738 19.584 -6.920 1.00 1.00 H new ATOM 0 HB3 LEU A 115 -8.798 20.328 -8.198 1.00 1.00 H new ATOM 0 HG LEU A 115 -11.216 20.810 -9.281 1.00 1.00 H new ATOM 0 HD11 LEU A 115 -12.946 21.308 -7.525 1.00 1.00 H new ATOM 0 HD12 LEU A 115 -12.522 19.580 -7.551 1.00 1.00 H new ATOM 0 HD13 LEU A 115 -11.861 20.640 -6.283 1.00 1.00 H new ATOM 0 HD21 LEU A 115 -11.279 23.043 -8.129 1.00 1.00 H new ATOM 0 HD22 LEU A 115 -10.141 22.430 -6.905 1.00 1.00 H new ATOM 0 HD23 LEU A 115 -9.622 22.597 -8.599 1.00 1.00 H new ATOM 1733 N GLU A 116 -10.584 19.002 -11.129 1.00 1.00 N ATOM 1734 CA GLU A 116 -10.381 19.270 -12.551 1.00 1.00 C ATOM 1735 C GLU A 116 -11.689 19.730 -13.185 1.00 1.00 C ATOM 1736 O GLU A 116 -12.760 19.210 -12.867 1.00 1.00 O ATOM 1737 CB GLU A 116 -9.846 17.983 -13.244 1.00 1.00 C ATOM 1738 CG GLU A 116 -10.883 16.807 -13.171 1.00 1.00 C ATOM 1739 CD GLU A 116 -11.940 16.918 -14.280 1.00 1.00 C ATOM 1740 OE1 GLU A 116 -11.551 16.920 -15.436 1.00 1.00 O ATOM 1741 OE2 GLU A 116 -13.114 16.991 -13.955 1.00 1.00 O ATOM 0 H GLU A 116 -11.561 18.949 -10.842 1.00 1.00 H new ATOM 0 HA GLU A 116 -9.647 20.066 -12.677 1.00 1.00 H new ATOM 0 HB2 GLU A 116 -9.616 18.201 -14.287 1.00 1.00 H new ATOM 0 HB3 GLU A 116 -8.914 17.676 -12.770 1.00 1.00 H new ATOM 0 HG2 GLU A 116 -10.361 15.854 -13.259 1.00 1.00 H new ATOM 0 HG3 GLU A 116 -11.374 16.813 -12.198 1.00 1.00 H new ATOM 1748 N HIS A 117 -11.595 20.694 -14.097 1.00 1.00 N ATOM 1749 CA HIS A 117 -12.790 21.213 -14.771 1.00 1.00 C ATOM 1750 C HIS A 117 -13.264 20.212 -15.827 1.00 1.00 C ATOM 1751 O HIS A 117 -12.463 19.736 -16.632 1.00 1.00 O ATOM 1752 CB HIS A 117 -12.472 22.580 -15.423 1.00 1.00 C ATOM 1753 CG HIS A 117 -13.734 23.193 -15.990 1.00 1.00 C ATOM 1754 ND1 HIS A 117 -14.743 23.683 -15.174 1.00 1.00 N ATOM 1755 CD2 HIS A 117 -14.176 23.364 -17.278 1.00 1.00 C ATOM 1756 CE1 HIS A 117 -15.734 24.118 -15.972 1.00 1.00 C ATOM 1757 NE2 HIS A 117 -15.441 23.947 -17.264 1.00 1.00 N ATOM 0 H HIS A 117 -10.719 21.129 -14.386 1.00 1.00 H new ATOM 0 HA HIS A 117 -13.586 21.353 -14.040 1.00 1.00 H new ATOM 0 HB2 HIS A 117 -12.033 23.251 -14.684 1.00 1.00 H new ATOM 0 HB3 HIS A 117 -11.734 22.451 -16.215 1.00 1.00 H new ATOM 0 HD2 HIS A 117 -13.627 23.089 -18.166 1.00 1.00 H new ATOM 0 HE1 HIS A 117 -16.655 24.553 -15.612 1.00 1.00 H new ATOM 0 HE2 HIS A 117 -16.019 24.191 -18.068 1.00 1.00 H new ATOM 1766 N HIS A 118 -14.558 19.912 -15.829 1.00 1.00 N ATOM 1767 CA HIS A 118 -15.125 18.969 -16.794 1.00 1.00 C ATOM 1768 C HIS A 118 -15.041 19.556 -18.203 1.00 1.00 C ATOM 1769 O HIS A 118 -15.494 20.676 -18.447 1.00 1.00 O ATOM 1770 CB HIS A 118 -16.596 18.678 -16.430 1.00 1.00 C ATOM 1771 CG HIS A 118 -16.673 18.103 -15.037 1.00 1.00 C ATOM 1772 ND1 HIS A 118 -16.308 16.797 -14.753 1.00 1.00 N ATOM 1773 CD2 HIS A 118 -17.060 18.653 -13.838 1.00 1.00 C ATOM 1774 CE1 HIS A 118 -16.480 16.604 -13.432 1.00 1.00 C ATOM 1775 NE2 HIS A 118 -16.938 17.704 -12.827 1.00 1.00 N ATOM 0 H HIS A 118 -15.235 20.306 -15.176 1.00 1.00 H new ATOM 0 HA HIS A 118 -14.559 18.038 -16.765 1.00 1.00 H new ATOM 0 HB2 HIS A 118 -17.183 19.595 -16.488 1.00 1.00 H new ATOM 0 HB3 HIS A 118 -17.026 17.978 -17.147 1.00 1.00 H new ATOM 0 HD2 HIS A 118 -17.406 19.667 -13.701 1.00 1.00 H new ATOM 0 HE1 HIS A 118 -16.273 15.674 -12.923 1.00 1.00 H new ATOM 0 HE2 HIS A 118 -17.152 17.823 -11.837 1.00 1.00 H new ATOM 1784 N HIS A 119 -14.462 18.794 -19.125 1.00 1.00 N ATOM 1785 CA HIS A 119 -14.312 19.249 -20.512 1.00 1.00 C ATOM 1786 C HIS A 119 -13.645 20.636 -20.559 1.00 1.00 C ATOM 1787 O HIS A 119 -14.326 21.661 -20.523 1.00 1.00 O ATOM 1788 CB HIS A 119 -15.691 19.302 -21.201 1.00 1.00 C ATOM 1789 CG HIS A 119 -16.343 17.944 -21.144 1.00 1.00 C ATOM 1790 ND1 HIS A 119 -15.935 16.894 -21.954 1.00 1.00 N ATOM 1791 CD2 HIS A 119 -17.368 17.450 -20.377 1.00 1.00 C ATOM 1792 CE1 HIS A 119 -16.706 15.831 -21.657 1.00 1.00 C ATOM 1793 NE2 HIS A 119 -17.595 16.116 -20.703 1.00 1.00 N ATOM 0 H HIS A 119 -14.089 17.862 -18.943 1.00 1.00 H new ATOM 0 HA HIS A 119 -13.674 18.541 -21.042 1.00 1.00 H new ATOM 0 HB2 HIS A 119 -16.325 20.041 -20.710 1.00 1.00 H new ATOM 0 HB3 HIS A 119 -15.578 19.618 -22.238 1.00 1.00 H new ATOM 0 HD2 HIS A 119 -17.915 18.011 -19.634 1.00 1.00 H new ATOM 0 HE1 HIS A 119 -16.616 14.866 -22.133 1.00 1.00 H new ATOM 0 HE2 HIS A 119 -18.292 15.490 -20.299 1.00 1.00 H new ATOM 1802 N HIS A 120 -12.318 20.650 -20.639 1.00 1.00 N ATOM 1803 CA HIS A 120 -11.565 21.910 -20.683 1.00 1.00 C ATOM 1804 C HIS A 120 -11.965 22.724 -21.914 1.00 1.00 C ATOM 1805 O HIS A 120 -12.137 23.941 -21.844 1.00 1.00 O ATOM 1806 CB HIS A 120 -10.052 21.607 -20.719 1.00 1.00 C ATOM 1807 CG HIS A 120 -9.648 20.851 -19.475 1.00 1.00 C ATOM 1808 ND1 HIS A 120 -9.500 21.475 -18.247 1.00 1.00 N ATOM 1809 CD2 HIS A 120 -9.371 19.524 -19.257 1.00 1.00 C ATOM 1810 CE1 HIS A 120 -9.149 20.533 -17.351 1.00 1.00 C ATOM 1811 NE2 HIS A 120 -9.057 19.326 -17.916 1.00 1.00 N ATOM 0 H HIS A 120 -11.740 19.811 -20.675 1.00 1.00 H new ATOM 0 HA HIS A 120 -11.795 22.493 -19.791 1.00 1.00 H new ATOM 0 HB2 HIS A 120 -9.811 21.020 -21.606 1.00 1.00 H new ATOM 0 HB3 HIS A 120 -9.488 22.537 -20.789 1.00 1.00 H new ATOM 0 HD2 HIS A 120 -9.393 18.752 -20.011 1.00 1.00 H new ATOM 0 HE1 HIS A 120 -8.965 20.729 -16.305 1.00 1.00 H new ATOM 0 HE2 HIS A 120 -8.809 18.447 -17.461 1.00 1.00 H new ATOM 1820 N HIS A 121 -12.110 22.036 -23.042 1.00 1.00 N ATOM 1821 CA HIS A 121 -12.491 22.687 -24.306 1.00 1.00 C ATOM 1822 C HIS A 121 -11.498 23.808 -24.660 1.00 1.00 C ATOM 1823 O HIS A 121 -10.644 24.162 -23.848 1.00 1.00 O ATOM 1824 CB HIS A 121 -13.934 23.240 -24.205 1.00 1.00 C ATOM 1825 CG HIS A 121 -14.398 23.758 -25.546 1.00 1.00 C ATOM 1826 ND1 HIS A 121 -14.552 22.924 -26.640 1.00 1.00 N ATOM 1827 CD2 HIS A 121 -14.735 25.015 -25.980 1.00 1.00 C ATOM 1828 CE1 HIS A 121 -14.967 23.681 -27.672 1.00 1.00 C ATOM 1829 NE2 HIS A 121 -15.094 24.964 -27.323 1.00 1.00 N ATOM 0 H HIS A 121 -11.971 21.028 -23.114 1.00 1.00 H new ATOM 0 HA HIS A 121 -12.459 21.946 -25.105 1.00 1.00 H new ATOM 0 HB2 HIS A 121 -14.607 22.455 -23.859 1.00 1.00 H new ATOM 0 HB3 HIS A 121 -13.972 24.041 -23.466 1.00 1.00 H new ATOM 0 HD2 HIS A 121 -14.723 25.908 -25.372 1.00 1.00 H new ATOM 0 HE1 HIS A 121 -15.172 23.298 -28.661 1.00 1.00 H new ATOM 0 HE2 HIS A 121 -15.391 25.740 -27.915 1.00 1.00 H new ATOM 1838 N HIS A 122 -11.617 24.347 -25.870 1.00 1.00 N ATOM 1839 CA HIS A 122 -10.729 25.422 -26.325 1.00 1.00 C ATOM 1840 C HIS A 122 -11.288 26.037 -27.613 1.00 1.00 C ATOM 1841 O HIS A 122 -11.913 27.082 -27.529 1.00 1.00 O ATOM 1842 CB HIS A 122 -9.313 24.853 -26.568 1.00 1.00 C ATOM 1843 CG HIS A 122 -8.351 25.960 -26.938 1.00 1.00 C ATOM 1844 ND1 HIS A 122 -7.888 26.133 -28.232 1.00 1.00 N ATOM 1845 CD2 HIS A 122 -7.785 26.966 -26.198 1.00 1.00 C ATOM 1846 CE1 HIS A 122 -7.080 27.210 -28.230 1.00 1.00 C ATOM 1847 NE2 HIS A 122 -6.984 27.756 -27.015 1.00 1.00 N ATOM 1848 OXT HIS A 122 -11.081 25.449 -28.662 1.00 1.00 O ATOM 0 H HIS A 122 -12.317 24.061 -26.555 1.00 1.00 H new ATOM 0 HA HIS A 122 -10.669 26.199 -25.562 1.00 1.00 H new ATOM 0 HB2 HIS A 122 -8.961 24.343 -25.671 1.00 1.00 H new ATOM 0 HB3 HIS A 122 -9.345 24.110 -27.365 1.00 1.00 H new ATOM 0 HD2 HIS A 122 -7.938 27.121 -25.140 1.00 1.00 H new ATOM 0 HE1 HIS A 122 -6.571 27.587 -29.105 1.00 1.00 H new ATOM 0 HE2 HIS A 122 -6.440 28.576 -26.745 1.00 1.00 H new TER 1857 HIS A 122