USER MOD reduce.3.24.130724 H: found=0, std=0, add=1033, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 1031 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 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 122 TYR OH : rot 0:sc= 0 USER MOD Set 2.1: A 36 HIS : no HD1:sc= -2.53 K(o=-5.6,f=-11!) USER MOD Set 2.2: A 55 GLN : amide:sc= -3.1 K(o=-5.6,f=-4) USER MOD Single : A 1 GLY N :NH3+ -126:sc= 0.0838 (180deg=0) USER MOD Single : A 2 SER OG : rot 38:sc= 0.135 USER MOD Single : A 3 SER OG : rot 180:sc= 0 USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 10 LYS NZ :NH3+ 162:sc= -0.0299 (180deg=-0.231) USER MOD Single : A 14 HIS : no HD1:sc= -0.815 K(o=-0.81,f=-2.6) USER MOD Single : A 19 GLN : amide:sc= 0.188 K(o=0.19,f=-1.2) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 23 TYR OH : rot 180:sc= -0.571 USER MOD Single : A 24 THR OG1 : rot 99:sc= 1.26 USER MOD Single : A 28 ASN : amide:sc= -6.88! C(o=-6.9!,f=-6.5!) USER MOD Single : A 29 HIS : no HD1:sc= 0 X(o=0,f=-0.012) USER MOD Single : A 30 TYR OH : rot 180:sc= -0.913 USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot -50:sc= 0.0634 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 GLN : amide:sc= -5.52! C(o=-5.5!,f=-6.2!) USER MOD Single : A 45 GLN : amide:sc= -0.183 K(o=-0.18,f=-2.3!) USER MOD Single : A 48 THR OG1 : rot 75:sc= 0.961 USER MOD Single : A 58 GLN : amide:sc= -1.1 K(o=-1.1,f=-4.3!) USER MOD Single : A 62 ASN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 69 ASN : amide:sc= -2.43! K(o=-2.4!,f=-1.1) USER MOD Single : A 71 CYS SG : rot 180:sc= 0 USER MOD Single : A 73 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 74 ASN : amide:sc= -0.581 K(o=-0.58,f=-7.2!) USER MOD Single : A 76 SER OG : rot 180:sc= -0.336 USER MOD Single : A 77 GLN : amide:sc= -0.0791 X(o=-0.079,f=-0.41) USER MOD Single : A 78 MET CE :methyl 165:sc= -1.06 (180deg=-1.34) USER MOD Single : A 81 ASN : amide:sc= -2.84 K(o=-2.8,f=-11!) USER MOD Single : A 85 CYS SG : rot 72:sc= 0.00654 USER MOD Single : A 87 ASN : amide:sc= 0.149 X(o=0.15,f=0) USER MOD Single : A 95 ASN : amide:sc= 0 X(o=0,f=-0.067) USER MOD Single : A 97 GLN : amide:sc= -0.0584 K(o=-0.058,f=-1.7!) USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 106 ASN : amide:sc= 0.975 K(o=0.98,f=-0.34) USER MOD Single : A 108 ASN : amide:sc= -0.112 K(o=-0.11,f=-0.94) USER MOD Single : A 110 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 118 SER OG : rot -166:sc= -2.5! USER MOD Single : A 120 SER OG : rot 180:sc= 0 USER MOD Single : A 123 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 124 GLN : amide:sc= -0.209 K(o=-0.21,f=-2.9!) USER MOD Single : A 125 GLN : amide:sc= -0.635 X(o=-0.64,f=-0.89) USER MOD Single : A 126 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 127 GLN : amide:sc= -1.25 K(o=-1.2,f=-2) USER MOD Single : A 128 GLN : amide:sc= -0.36 K(o=-0.36,f=-2.3!) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -15.676 8.639 -18.274 1.00 0.00 N ATOM 2 CA GLY A 1 -14.551 9.508 -18.566 1.00 0.00 C ATOM 3 C GLY A 1 -13.580 8.888 -19.551 1.00 0.00 C ATOM 4 O GLY A 1 -13.870 7.854 -20.151 1.00 0.00 O ATOM 0 H1 GLY A 1 -16.564 9.151 -18.448 1.00 0.00 H new ATOM 0 H2 GLY A 1 -15.634 7.799 -18.886 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.637 8.343 -17.278 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.920 10.451 -18.969 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -14.025 9.740 -17.640 1.00 0.00 H new ATOM 8 N SER A 2 -12.423 9.522 -19.718 1.00 0.00 N ATOM 9 CA SER A 2 -11.408 9.029 -20.641 1.00 0.00 C ATOM 10 C SER A 2 -10.016 9.138 -20.025 1.00 0.00 C ATOM 11 O SER A 2 -9.589 10.216 -19.613 1.00 0.00 O ATOM 12 CB SER A 2 -11.459 9.812 -21.954 1.00 0.00 C ATOM 13 OG SER A 2 -11.361 11.206 -21.721 1.00 0.00 O ATOM 0 H SER A 2 -12.166 10.378 -19.226 1.00 0.00 H new ATOM 0 HA SER A 2 -11.616 7.979 -20.844 1.00 0.00 H new ATOM 0 HB2 SER A 2 -10.645 9.491 -22.604 1.00 0.00 H new ATOM 0 HB3 SER A 2 -12.390 9.592 -22.476 1.00 0.00 H new ATOM 0 HG SER A 2 -10.724 11.372 -20.995 1.00 0.00 H new ATOM 19 N SER A 3 -9.313 8.011 -19.966 1.00 0.00 N ATOM 20 CA SER A 3 -7.970 7.977 -19.398 1.00 0.00 C ATOM 21 C SER A 3 -6.915 7.923 -20.498 1.00 0.00 C ATOM 22 O SER A 3 -7.042 7.163 -21.458 1.00 0.00 O ATOM 23 CB SER A 3 -7.817 6.771 -18.469 1.00 0.00 C ATOM 24 OG SER A 3 -8.858 6.732 -17.508 1.00 0.00 O ATOM 0 H SER A 3 -9.651 7.110 -20.304 1.00 0.00 H new ATOM 0 HA SER A 3 -7.823 8.891 -18.823 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.825 5.853 -19.056 1.00 0.00 H new ATOM 0 HB3 SER A 3 -6.853 6.818 -17.963 1.00 0.00 H new ATOM 0 HG SER A 3 -8.738 5.951 -16.928 1.00 0.00 H new ATOM 30 N GLY A 4 -5.873 8.735 -20.351 1.00 0.00 N ATOM 31 CA GLY A 4 -4.811 8.765 -21.340 1.00 0.00 C ATOM 32 C GLY A 4 -3.689 9.709 -20.956 1.00 0.00 C ATOM 33 O GLY A 4 -3.654 10.221 -19.837 1.00 0.00 O ATOM 0 H GLY A 4 -5.745 9.372 -19.565 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -4.409 7.760 -21.467 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -5.223 9.068 -22.303 1.00 0.00 H new ATOM 37 N SER A 5 -2.767 9.939 -21.886 1.00 0.00 N ATOM 38 CA SER A 5 -1.635 10.824 -21.638 1.00 0.00 C ATOM 39 C SER A 5 -1.057 11.347 -22.949 1.00 0.00 C ATOM 40 O SER A 5 -0.598 10.574 -23.790 1.00 0.00 O ATOM 41 CB SER A 5 -0.551 10.090 -20.846 1.00 0.00 C ATOM 42 OG SER A 5 0.206 10.993 -20.060 1.00 0.00 O ATOM 0 H SER A 5 -2.782 9.525 -22.818 1.00 0.00 H new ATOM 0 HA SER A 5 -1.990 11.673 -21.054 1.00 0.00 H new ATOM 0 HB2 SER A 5 -1.011 9.340 -20.202 1.00 0.00 H new ATOM 0 HB3 SER A 5 0.109 9.559 -21.532 1.00 0.00 H new ATOM 0 HG SER A 5 0.891 10.499 -19.562 1.00 0.00 H new ATOM 48 N SER A 6 -1.083 12.666 -23.116 1.00 0.00 N ATOM 49 CA SER A 6 -0.565 13.294 -24.326 1.00 0.00 C ATOM 50 C SER A 6 0.913 13.638 -24.169 1.00 0.00 C ATOM 51 O SER A 6 1.738 13.278 -25.008 1.00 0.00 O ATOM 52 CB SER A 6 -1.362 14.558 -24.651 1.00 0.00 C ATOM 53 OG SER A 6 -1.174 14.947 -26.000 1.00 0.00 O ATOM 0 H SER A 6 -1.457 13.320 -22.429 1.00 0.00 H new ATOM 0 HA SER A 6 -0.670 12.585 -25.147 1.00 0.00 H new ATOM 0 HB2 SER A 6 -2.421 14.382 -24.464 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.052 15.367 -23.989 1.00 0.00 H new ATOM 0 HG SER A 6 -1.695 15.756 -26.183 1.00 0.00 H new ATOM 59 N GLY A 7 1.241 14.338 -23.087 1.00 0.00 N ATOM 60 CA GLY A 7 2.619 14.719 -22.839 1.00 0.00 C ATOM 61 C GLY A 7 2.766 16.198 -22.541 1.00 0.00 C ATOM 62 O GLY A 7 2.829 17.021 -23.455 1.00 0.00 O ATOM 0 H GLY A 7 0.577 14.648 -22.378 1.00 0.00 H new ATOM 0 HA2 GLY A 7 3.007 14.142 -22.000 1.00 0.00 H new ATOM 0 HA3 GLY A 7 3.225 14.464 -23.708 1.00 0.00 H new ATOM 66 N LYS A 8 2.820 16.539 -21.258 1.00 0.00 N ATOM 67 CA LYS A 8 2.960 17.929 -20.840 1.00 0.00 C ATOM 68 C LYS A 8 4.420 18.265 -20.552 1.00 0.00 C ATOM 69 O LYS A 8 5.152 17.457 -19.982 1.00 0.00 O ATOM 70 CB LYS A 8 2.109 18.198 -19.597 1.00 0.00 C ATOM 71 CG LYS A 8 0.614 18.178 -19.868 1.00 0.00 C ATOM 72 CD LYS A 8 0.048 16.772 -19.770 1.00 0.00 C ATOM 73 CE LYS A 8 -1.419 16.733 -20.168 1.00 0.00 C ATOM 74 NZ LYS A 8 -1.819 15.393 -20.680 1.00 0.00 N ATOM 0 H LYS A 8 2.769 15.871 -20.489 1.00 0.00 H new ATOM 0 HA LYS A 8 2.612 18.564 -21.655 1.00 0.00 H new ATOM 0 HB2 LYS A 8 2.342 17.451 -18.838 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.382 19.169 -19.183 1.00 0.00 H new ATOM 0 HG2 LYS A 8 0.105 18.826 -19.155 1.00 0.00 H new ATOM 0 HG3 LYS A 8 0.418 18.582 -20.861 1.00 0.00 H new ATOM 0 HD2 LYS A 8 0.619 16.103 -20.414 1.00 0.00 H new ATOM 0 HD3 LYS A 8 0.159 16.404 -18.750 1.00 0.00 H new ATOM 0 HE2 LYS A 8 -2.036 16.992 -19.307 1.00 0.00 H new ATOM 0 HE3 LYS A 8 -1.608 17.486 -20.934 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 -2.826 15.407 -20.941 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 -1.248 15.156 -21.516 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 -1.663 14.678 -19.941 1.00 0.00 H new ATOM 88 N ARG A 9 4.835 19.464 -20.948 1.00 0.00 N ATOM 89 CA ARG A 9 6.207 19.907 -20.732 1.00 0.00 C ATOM 90 C ARG A 9 6.364 20.535 -19.350 1.00 0.00 C ATOM 91 O ARG A 9 7.332 21.249 -19.086 1.00 0.00 O ATOM 92 CB ARG A 9 6.617 20.913 -21.810 1.00 0.00 C ATOM 93 CG ARG A 9 5.834 22.215 -21.757 1.00 0.00 C ATOM 94 CD ARG A 9 5.952 22.989 -23.061 1.00 0.00 C ATOM 95 NE ARG A 9 7.176 23.784 -23.116 1.00 0.00 N ATOM 96 CZ ARG A 9 7.419 24.696 -24.051 1.00 0.00 C ATOM 97 NH1 ARG A 9 6.527 24.926 -25.004 1.00 0.00 N ATOM 98 NH2 ARG A 9 8.556 25.379 -24.034 1.00 0.00 N ATOM 0 H ARG A 9 4.241 20.146 -21.420 1.00 0.00 H new ATOM 0 HA ARG A 9 6.858 19.034 -20.792 1.00 0.00 H new ATOM 0 HB2 ARG A 9 7.679 21.133 -21.704 1.00 0.00 H new ATOM 0 HB3 ARG A 9 6.482 20.457 -22.791 1.00 0.00 H new ATOM 0 HG2 ARG A 9 4.785 22.002 -21.553 1.00 0.00 H new ATOM 0 HG3 ARG A 9 6.201 22.828 -20.934 1.00 0.00 H new ATOM 0 HD2 ARG A 9 5.934 22.292 -23.899 1.00 0.00 H new ATOM 0 HD3 ARG A 9 5.088 23.645 -23.173 1.00 0.00 H new ATOM 0 HE ARG A 9 7.883 23.631 -22.397 1.00 0.00 H new ATOM 0 HH11 ARG A 9 5.652 24.402 -25.021 1.00 0.00 H new ATOM 0 HH12 ARG A 9 6.716 25.627 -25.721 1.00 0.00 H new ATOM 0 HH21 ARG A 9 9.245 25.204 -23.302 1.00 0.00 H new ATOM 0 HH22 ARG A 9 8.741 26.079 -24.752 1.00 0.00 H new ATOM 112 N LYS A 10 5.406 20.264 -18.470 1.00 0.00 N ATOM 113 CA LYS A 10 5.437 20.800 -17.115 1.00 0.00 C ATOM 114 C LYS A 10 6.221 19.881 -16.184 1.00 0.00 C ATOM 115 O LYS A 10 6.327 18.675 -16.407 1.00 0.00 O ATOM 116 CB LYS A 10 4.013 20.986 -16.585 1.00 0.00 C ATOM 117 CG LYS A 10 3.419 22.348 -16.900 1.00 0.00 C ATOM 118 CD LYS A 10 1.935 22.397 -16.577 1.00 0.00 C ATOM 119 CE LYS A 10 1.245 23.540 -17.306 1.00 0.00 C ATOM 120 NZ LYS A 10 1.155 23.289 -18.772 1.00 0.00 N ATOM 0 H LYS A 10 4.598 19.676 -18.672 1.00 0.00 H new ATOM 0 HA LYS A 10 5.936 21.769 -17.146 1.00 0.00 H new ATOM 0 HB2 LYS A 10 3.373 20.213 -17.010 1.00 0.00 H new ATOM 0 HB3 LYS A 10 4.015 20.841 -15.505 1.00 0.00 H new ATOM 0 HG2 LYS A 10 3.942 23.115 -16.329 1.00 0.00 H new ATOM 0 HG3 LYS A 10 3.571 22.577 -17.955 1.00 0.00 H new ATOM 0 HD2 LYS A 10 1.469 21.452 -16.856 1.00 0.00 H new ATOM 0 HD3 LYS A 10 1.799 22.514 -15.502 1.00 0.00 H new ATOM 0 HE2 LYS A 10 0.243 23.678 -16.899 1.00 0.00 H new ATOM 0 HE3 LYS A 10 1.792 24.466 -17.129 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 0.433 23.912 -19.187 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 2.076 23.483 -19.215 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 0.893 22.297 -18.939 1.00 0.00 H new ATOM 134 N PRO A 11 6.784 20.462 -15.114 1.00 0.00 N ATOM 135 CA PRO A 11 7.566 19.713 -14.126 1.00 0.00 C ATOM 136 C PRO A 11 6.700 18.780 -13.287 1.00 0.00 C ATOM 137 O PRO A 11 5.730 19.210 -12.663 1.00 0.00 O ATOM 138 CB PRO A 11 8.175 20.810 -13.250 1.00 0.00 C ATOM 139 CG PRO A 11 7.243 21.964 -13.385 1.00 0.00 C ATOM 140 CD PRO A 11 6.698 21.895 -14.785 1.00 0.00 C ATOM 0 HA PRO A 11 8.305 19.066 -14.598 1.00 0.00 H new ATOM 0 HB2 PRO A 11 8.258 20.487 -12.212 1.00 0.00 H new ATOM 0 HB3 PRO A 11 9.179 21.071 -13.584 1.00 0.00 H new ATOM 0 HG2 PRO A 11 6.440 21.905 -12.650 1.00 0.00 H new ATOM 0 HG3 PRO A 11 7.762 22.907 -13.214 1.00 0.00 H new ATOM 0 HD2 PRO A 11 5.671 22.258 -14.835 1.00 0.00 H new ATOM 0 HD3 PRO A 11 7.284 22.502 -15.475 1.00 0.00 H new ATOM 148 N VAL A 12 7.057 17.499 -13.275 1.00 0.00 N ATOM 149 CA VAL A 12 6.313 16.505 -12.511 1.00 0.00 C ATOM 150 C VAL A 12 6.309 16.845 -11.025 1.00 0.00 C ATOM 151 O VAL A 12 7.361 17.068 -10.426 1.00 0.00 O ATOM 152 CB VAL A 12 6.902 15.095 -12.702 1.00 0.00 C ATOM 153 CG1 VAL A 12 6.100 14.070 -11.914 1.00 0.00 C ATOM 154 CG2 VAL A 12 6.944 14.730 -14.178 1.00 0.00 C ATOM 0 H VAL A 12 7.857 17.126 -13.786 1.00 0.00 H new ATOM 0 HA VAL A 12 5.290 16.517 -12.887 1.00 0.00 H new ATOM 0 HB VAL A 12 7.923 15.093 -12.322 1.00 0.00 H new ATOM 0 HG11 VAL A 12 6.531 13.080 -12.061 1.00 0.00 H new ATOM 0 HG12 VAL A 12 6.127 14.324 -10.854 1.00 0.00 H new ATOM 0 HG13 VAL A 12 5.067 14.071 -12.261 1.00 0.00 H new ATOM 0 HG21 VAL A 12 7.363 13.730 -14.294 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.934 14.749 -14.587 1.00 0.00 H new ATOM 0 HG23 VAL A 12 7.565 15.448 -14.713 1.00 0.00 H new ATOM 164 N ILE A 13 5.118 16.883 -10.436 1.00 0.00 N ATOM 165 CA ILE A 13 4.977 17.194 -9.019 1.00 0.00 C ATOM 166 C ILE A 13 4.526 15.970 -8.229 1.00 0.00 C ATOM 167 O ILE A 13 3.827 15.102 -8.754 1.00 0.00 O ATOM 168 CB ILE A 13 3.970 18.337 -8.791 1.00 0.00 C ATOM 169 CG1 ILE A 13 4.461 19.620 -9.465 1.00 0.00 C ATOM 170 CG2 ILE A 13 3.753 18.563 -7.303 1.00 0.00 C ATOM 171 CD1 ILE A 13 5.960 19.809 -9.385 1.00 0.00 C ATOM 0 H ILE A 13 4.237 16.702 -10.918 1.00 0.00 H new ATOM 0 HA ILE A 13 5.959 17.509 -8.666 1.00 0.00 H new ATOM 0 HB ILE A 13 3.016 18.056 -9.238 1.00 0.00 H new ATOM 0 HG12 ILE A 13 4.160 19.609 -10.512 1.00 0.00 H new ATOM 0 HG13 ILE A 13 3.970 20.475 -9.001 1.00 0.00 H new ATOM 0 HG21 ILE A 13 3.039 19.374 -7.158 1.00 0.00 H new ATOM 0 HG22 ILE A 13 3.364 17.651 -6.849 1.00 0.00 H new ATOM 0 HG23 ILE A 13 4.701 18.826 -6.833 1.00 0.00 H new ATOM 0 HD11 ILE A 13 6.237 20.738 -9.883 1.00 0.00 H new ATOM 0 HD12 ILE A 13 6.266 19.853 -8.340 1.00 0.00 H new ATOM 0 HD13 ILE A 13 6.459 18.973 -9.874 1.00 0.00 H new ATOM 183 N HIS A 14 4.930 15.907 -6.964 1.00 0.00 N ATOM 184 CA HIS A 14 4.565 14.790 -6.101 1.00 0.00 C ATOM 185 C HIS A 14 3.767 15.274 -4.894 1.00 0.00 C ATOM 186 O HIS A 14 4.118 14.989 -3.750 1.00 0.00 O ATOM 187 CB HIS A 14 5.818 14.048 -5.634 1.00 0.00 C ATOM 188 CG HIS A 14 6.611 13.448 -6.754 1.00 0.00 C ATOM 189 ND1 HIS A 14 6.998 14.161 -7.869 1.00 0.00 N ATOM 190 CD2 HIS A 14 7.092 12.195 -6.925 1.00 0.00 C ATOM 191 CE1 HIS A 14 7.680 13.372 -8.679 1.00 0.00 C ATOM 192 NE2 HIS A 14 7.752 12.173 -8.129 1.00 0.00 N ATOM 0 H HIS A 14 5.510 16.616 -6.515 1.00 0.00 H new ATOM 0 HA HIS A 14 3.941 14.107 -6.677 1.00 0.00 H new ATOM 0 HB2 HIS A 14 6.453 14.738 -5.079 1.00 0.00 H new ATOM 0 HB3 HIS A 14 5.526 13.258 -4.943 1.00 0.00 H new ATOM 0 HD2 HIS A 14 6.978 11.366 -6.242 1.00 0.00 H new ATOM 0 HE1 HIS A 14 8.106 13.658 -9.629 1.00 0.00 H new ATOM 0 HE2 HIS A 14 8.222 11.363 -8.533 1.00 0.00 H new ATOM 201 N GLY A 15 2.691 16.009 -5.158 1.00 0.00 N ATOM 202 CA GLY A 15 1.861 16.522 -4.084 1.00 0.00 C ATOM 203 C GLY A 15 1.097 15.425 -3.367 1.00 0.00 C ATOM 204 O GLY A 15 0.774 14.395 -3.959 1.00 0.00 O ATOM 0 H GLY A 15 2.379 16.258 -6.097 1.00 0.00 H new ATOM 0 HA2 GLY A 15 2.487 17.053 -3.367 1.00 0.00 H new ATOM 0 HA3 GLY A 15 1.155 17.247 -4.489 1.00 0.00 H new ATOM 208 N LEU A 16 0.810 15.646 -2.089 1.00 0.00 N ATOM 209 CA LEU A 16 0.081 14.667 -1.290 1.00 0.00 C ATOM 210 C LEU A 16 -1.027 14.012 -2.108 1.00 0.00 C ATOM 211 O LEU A 16 -1.340 12.837 -1.917 1.00 0.00 O ATOM 212 CB LEU A 16 -0.513 15.335 -0.048 1.00 0.00 C ATOM 213 CG LEU A 16 0.486 15.995 0.902 1.00 0.00 C ATOM 214 CD1 LEU A 16 -0.241 16.693 2.041 1.00 0.00 C ATOM 215 CD2 LEU A 16 1.466 14.965 1.445 1.00 0.00 C ATOM 0 H LEU A 16 1.070 16.493 -1.584 1.00 0.00 H new ATOM 0 HA LEU A 16 0.783 13.893 -0.979 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -1.228 16.091 -0.373 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -1.074 14.585 0.510 1.00 0.00 H new ATOM 0 HG LEU A 16 1.048 16.744 0.344 1.00 0.00 H new ATOM 0 HD11 LEU A 16 0.487 17.157 2.707 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -0.902 17.459 1.636 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -0.829 15.964 2.598 1.00 0.00 H new ATOM 0 HD21 LEU A 16 2.170 15.453 2.120 1.00 0.00 H new ATOM 0 HD22 LEU A 16 0.920 14.193 1.987 1.00 0.00 H new ATOM 0 HD23 LEU A 16 2.012 14.511 0.618 1.00 0.00 H new ATOM 227 N GLU A 17 -1.615 14.780 -3.020 1.00 0.00 N ATOM 228 CA GLU A 17 -2.687 14.272 -3.869 1.00 0.00 C ATOM 229 C GLU A 17 -2.122 13.489 -5.050 1.00 0.00 C ATOM 230 O GLU A 17 -2.686 12.476 -5.464 1.00 0.00 O ATOM 231 CB GLU A 17 -3.556 15.426 -4.376 1.00 0.00 C ATOM 232 CG GLU A 17 -4.181 16.252 -3.264 1.00 0.00 C ATOM 233 CD GLU A 17 -5.423 16.994 -3.717 1.00 0.00 C ATOM 234 OE1 GLU A 17 -5.279 18.051 -4.366 1.00 0.00 O ATOM 235 OE2 GLU A 17 -6.539 16.518 -3.422 1.00 0.00 O ATOM 0 H GLU A 17 -1.368 15.755 -3.190 1.00 0.00 H new ATOM 0 HA GLU A 17 -3.301 13.599 -3.271 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -2.949 16.078 -5.004 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -4.348 15.023 -5.007 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -4.437 15.598 -2.430 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -3.449 16.969 -2.893 1.00 0.00 H new ATOM 242 N ASP A 18 -1.005 13.966 -5.588 1.00 0.00 N ATOM 243 CA ASP A 18 -0.362 13.311 -6.721 1.00 0.00 C ATOM 244 C ASP A 18 0.206 11.955 -6.314 1.00 0.00 C ATOM 245 O ASP A 18 0.042 10.965 -7.026 1.00 0.00 O ATOM 246 CB ASP A 18 0.751 14.196 -7.285 1.00 0.00 C ATOM 247 CG ASP A 18 0.307 15.633 -7.477 1.00 0.00 C ATOM 248 OD1 ASP A 18 -0.917 15.869 -7.559 1.00 0.00 O ATOM 249 OD2 ASP A 18 1.182 16.521 -7.546 1.00 0.00 O ATOM 0 H ASP A 18 -0.526 14.804 -5.258 1.00 0.00 H new ATOM 0 HA ASP A 18 -1.115 13.152 -7.493 1.00 0.00 H new ATOM 0 HB2 ASP A 18 1.608 14.170 -6.612 1.00 0.00 H new ATOM 0 HB3 ASP A 18 1.084 13.791 -8.241 1.00 0.00 H new ATOM 254 N GLN A 19 0.876 11.920 -5.167 1.00 0.00 N ATOM 255 CA GLN A 19 1.470 10.685 -4.667 1.00 0.00 C ATOM 256 C GLN A 19 0.415 9.593 -4.523 1.00 0.00 C ATOM 257 O GLN A 19 0.675 8.423 -4.802 1.00 0.00 O ATOM 258 CB GLN A 19 2.153 10.932 -3.321 1.00 0.00 C ATOM 259 CG GLN A 19 3.048 12.161 -3.309 1.00 0.00 C ATOM 260 CD GLN A 19 4.194 12.039 -2.325 1.00 0.00 C ATOM 261 OE1 GLN A 19 4.200 11.155 -1.468 1.00 0.00 O ATOM 262 NE2 GLN A 19 5.173 12.928 -2.442 1.00 0.00 N ATOM 0 H GLN A 19 1.021 12.732 -4.567 1.00 0.00 H new ATOM 0 HA GLN A 19 2.215 10.351 -5.389 1.00 0.00 H new ATOM 0 HB2 GLN A 19 1.390 11.041 -2.550 1.00 0.00 H new ATOM 0 HB3 GLN A 19 2.748 10.057 -3.059 1.00 0.00 H new ATOM 0 HG2 GLN A 19 3.449 12.323 -4.309 1.00 0.00 H new ATOM 0 HG3 GLN A 19 2.451 13.038 -3.059 1.00 0.00 H new ATOM 0 HE21 GLN A 19 5.128 13.644 -3.167 1.00 0.00 H new ATOM 0 HE22 GLN A 19 5.971 12.895 -1.807 1.00 0.00 H new ATOM 271 N LYS A 20 -0.777 9.983 -4.084 1.00 0.00 N ATOM 272 CA LYS A 20 -1.873 9.038 -3.902 1.00 0.00 C ATOM 273 C LYS A 20 -2.094 8.213 -5.166 1.00 0.00 C ATOM 274 O LYS A 20 -2.572 7.080 -5.102 1.00 0.00 O ATOM 275 CB LYS A 20 -3.159 9.782 -3.534 1.00 0.00 C ATOM 276 CG LYS A 20 -4.422 8.986 -3.812 1.00 0.00 C ATOM 277 CD LYS A 20 -5.670 9.780 -3.461 1.00 0.00 C ATOM 278 CE LYS A 20 -6.923 8.926 -3.573 1.00 0.00 C ATOM 279 NZ LYS A 20 -8.118 9.739 -3.934 1.00 0.00 N ATOM 0 H LYS A 20 -1.009 10.948 -3.847 1.00 0.00 H new ATOM 0 HA LYS A 20 -1.607 8.362 -3.089 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -3.129 10.042 -2.476 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -3.199 10.718 -4.091 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -4.452 8.706 -4.865 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -4.404 8.061 -3.236 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -5.582 10.168 -2.446 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -5.754 10.640 -4.125 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -6.769 8.152 -4.325 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -7.102 8.418 -2.625 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -8.951 9.121 -4.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.280 10.461 -3.203 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -7.958 10.204 -4.850 1.00 0.00 H new ATOM 293 N ARG A 21 -1.743 8.787 -6.312 1.00 0.00 N ATOM 294 CA ARG A 21 -1.903 8.104 -7.589 1.00 0.00 C ATOM 295 C ARG A 21 -0.662 7.284 -7.927 1.00 0.00 C ATOM 296 O ARG A 21 -0.762 6.124 -8.328 1.00 0.00 O ATOM 297 CB ARG A 21 -2.177 9.117 -8.703 1.00 0.00 C ATOM 298 CG ARG A 21 -2.820 8.506 -9.937 1.00 0.00 C ATOM 299 CD ARG A 21 -4.338 8.544 -9.851 1.00 0.00 C ATOM 300 NE ARG A 21 -4.832 9.862 -9.462 1.00 0.00 N ATOM 301 CZ ARG A 21 -4.912 10.892 -10.297 1.00 0.00 C ATOM 302 NH1 ARG A 21 -4.534 10.757 -11.560 1.00 0.00 N ATOM 303 NH2 ARG A 21 -5.373 12.060 -9.868 1.00 0.00 N ATOM 0 H ARG A 21 -1.346 9.724 -6.382 1.00 0.00 H new ATOM 0 HA ARG A 21 -2.753 7.427 -7.506 1.00 0.00 H new ATOM 0 HB2 ARG A 21 -2.826 9.903 -8.317 1.00 0.00 H new ATOM 0 HB3 ARG A 21 -1.239 9.592 -8.990 1.00 0.00 H new ATOM 0 HG2 ARG A 21 -2.491 9.046 -10.825 1.00 0.00 H new ATOM 0 HG3 ARG A 21 -2.487 7.474 -10.049 1.00 0.00 H new ATOM 0 HD2 ARG A 21 -4.763 8.268 -10.816 1.00 0.00 H new ATOM 0 HD3 ARG A 21 -4.679 7.802 -9.129 1.00 0.00 H new ATOM 0 HE ARG A 21 -5.132 9.999 -8.497 1.00 0.00 H new ATOM 0 HH11 ARG A 21 -4.180 9.860 -11.893 1.00 0.00 H new ATOM 0 HH12 ARG A 21 -4.597 11.550 -12.199 1.00 0.00 H new ATOM 0 HH21 ARG A 21 -5.666 12.167 -8.897 1.00 0.00 H new ATOM 0 HH22 ARG A 21 -5.434 12.851 -10.509 1.00 0.00 H new ATOM 317 N ILE A 22 0.507 7.896 -7.764 1.00 0.00 N ATOM 318 CA ILE A 22 1.767 7.222 -8.051 1.00 0.00 C ATOM 319 C ILE A 22 1.822 5.851 -7.387 1.00 0.00 C ATOM 320 O ILE A 22 2.129 4.849 -8.033 1.00 0.00 O ATOM 321 CB ILE A 22 2.972 8.057 -7.578 1.00 0.00 C ATOM 322 CG1 ILE A 22 3.044 9.374 -8.353 1.00 0.00 C ATOM 323 CG2 ILE A 22 4.262 7.268 -7.744 1.00 0.00 C ATOM 324 CD1 ILE A 22 4.112 10.317 -7.846 1.00 0.00 C ATOM 0 H ILE A 22 0.607 8.856 -7.435 1.00 0.00 H new ATOM 0 HA ILE A 22 1.820 7.101 -9.133 1.00 0.00 H new ATOM 0 HB ILE A 22 2.843 8.286 -6.520 1.00 0.00 H new ATOM 0 HG12 ILE A 22 3.232 9.157 -9.405 1.00 0.00 H new ATOM 0 HG13 ILE A 22 2.076 9.872 -8.298 1.00 0.00 H new ATOM 0 HG21 ILE A 22 5.104 7.872 -7.405 1.00 0.00 H new ATOM 0 HG22 ILE A 22 4.209 6.355 -7.151 1.00 0.00 H new ATOM 0 HG23 ILE A 22 4.399 7.011 -8.794 1.00 0.00 H new ATOM 0 HD11 ILE A 22 4.105 11.229 -8.442 1.00 0.00 H new ATOM 0 HD12 ILE A 22 3.914 10.564 -6.803 1.00 0.00 H new ATOM 0 HD13 ILE A 22 5.088 9.838 -7.927 1.00 0.00 H new ATOM 336 N TYR A 23 1.519 5.813 -6.094 1.00 0.00 N ATOM 337 CA TYR A 23 1.534 4.564 -5.341 1.00 0.00 C ATOM 338 C TYR A 23 0.486 3.593 -5.877 1.00 0.00 C ATOM 339 O TYR A 23 0.724 2.388 -5.961 1.00 0.00 O ATOM 340 CB TYR A 23 1.283 4.836 -3.857 1.00 0.00 C ATOM 341 CG TYR A 23 2.397 5.607 -3.186 1.00 0.00 C ATOM 342 CD1 TYR A 23 3.727 5.258 -3.384 1.00 0.00 C ATOM 343 CD2 TYR A 23 2.120 6.684 -2.353 1.00 0.00 C ATOM 344 CE1 TYR A 23 4.749 5.959 -2.772 1.00 0.00 C ATOM 345 CE2 TYR A 23 3.135 7.391 -1.738 1.00 0.00 C ATOM 346 CZ TYR A 23 4.447 7.025 -1.951 1.00 0.00 C ATOM 347 OH TYR A 23 5.461 7.726 -1.339 1.00 0.00 O ATOM 0 H TYR A 23 1.260 6.633 -5.545 1.00 0.00 H new ATOM 0 HA TYR A 23 2.518 4.110 -5.458 1.00 0.00 H new ATOM 0 HB2 TYR A 23 0.352 5.393 -3.751 1.00 0.00 H new ATOM 0 HB3 TYR A 23 1.147 3.886 -3.340 1.00 0.00 H new ATOM 0 HD1 TYR A 23 3.967 4.424 -4.027 1.00 0.00 H new ATOM 0 HD2 TYR A 23 1.093 6.973 -2.183 1.00 0.00 H new ATOM 0 HE1 TYR A 23 5.778 5.674 -2.936 1.00 0.00 H new ATOM 0 HE2 TYR A 23 2.902 8.226 -1.094 1.00 0.00 H new ATOM 0 HH TYR A 23 5.079 8.446 -0.796 1.00 0.00 H new ATOM 357 N THR A 24 -0.676 4.128 -6.239 1.00 0.00 N ATOM 358 CA THR A 24 -1.762 3.311 -6.765 1.00 0.00 C ATOM 359 C THR A 24 -1.296 2.477 -7.953 1.00 0.00 C ATOM 360 O THR A 24 -1.600 1.288 -8.046 1.00 0.00 O ATOM 361 CB THR A 24 -2.959 4.179 -7.199 1.00 0.00 C ATOM 362 OG1 THR A 24 -3.489 4.881 -6.070 1.00 0.00 O ATOM 363 CG2 THR A 24 -4.048 3.323 -7.829 1.00 0.00 C ATOM 0 H THR A 24 -0.889 5.124 -6.177 1.00 0.00 H new ATOM 0 HA THR A 24 -2.077 2.647 -5.960 1.00 0.00 H new ATOM 0 HB THR A 24 -2.610 4.897 -7.941 1.00 0.00 H new ATOM 0 HG1 THR A 24 -3.148 5.800 -6.067 1.00 0.00 H new ATOM 0 HG21 THR A 24 -4.883 3.958 -8.127 1.00 0.00 H new ATOM 0 HG22 THR A 24 -3.648 2.813 -8.706 1.00 0.00 H new ATOM 0 HG23 THR A 24 -4.394 2.584 -7.106 1.00 0.00 H new ATOM 371 N ASP A 25 -0.557 3.108 -8.859 1.00 0.00 N ATOM 372 CA ASP A 25 -0.047 2.423 -10.041 1.00 0.00 C ATOM 373 C ASP A 25 1.024 1.406 -9.660 1.00 0.00 C ATOM 374 O ASP A 25 1.072 0.305 -10.209 1.00 0.00 O ATOM 375 CB ASP A 25 0.523 3.434 -11.037 1.00 0.00 C ATOM 376 CG ASP A 25 0.966 2.784 -12.333 1.00 0.00 C ATOM 377 OD1 ASP A 25 0.091 2.454 -13.160 1.00 0.00 O ATOM 378 OD2 ASP A 25 2.188 2.606 -12.520 1.00 0.00 O ATOM 0 H ASP A 25 -0.298 4.093 -8.797 1.00 0.00 H new ATOM 0 HA ASP A 25 -0.876 1.892 -10.509 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -0.231 4.191 -11.253 1.00 0.00 H new ATOM 0 HB3 ASP A 25 1.371 3.948 -10.584 1.00 0.00 H new ATOM 383 N TRP A 26 1.882 1.783 -8.719 1.00 0.00 N ATOM 384 CA TRP A 26 2.954 0.903 -8.266 1.00 0.00 C ATOM 385 C TRP A 26 2.402 -0.452 -7.838 1.00 0.00 C ATOM 386 O TRP A 26 2.883 -1.495 -8.279 1.00 0.00 O ATOM 387 CB TRP A 26 3.713 1.548 -7.105 1.00 0.00 C ATOM 388 CG TRP A 26 4.807 0.682 -6.557 1.00 0.00 C ATOM 389 CD1 TRP A 26 5.997 0.385 -7.158 1.00 0.00 C ATOM 390 CD2 TRP A 26 4.810 -0.001 -5.299 1.00 0.00 C ATOM 391 NE1 TRP A 26 6.739 -0.441 -6.350 1.00 0.00 N ATOM 392 CE2 TRP A 26 6.034 -0.692 -5.202 1.00 0.00 C ATOM 393 CE3 TRP A 26 3.899 -0.095 -4.243 1.00 0.00 C ATOM 394 CZ2 TRP A 26 6.367 -1.465 -4.093 1.00 0.00 C ATOM 395 CZ3 TRP A 26 4.231 -0.863 -3.143 1.00 0.00 C ATOM 396 CH2 TRP A 26 5.456 -1.539 -3.075 1.00 0.00 C ATOM 0 H TRP A 26 1.857 2.691 -8.255 1.00 0.00 H new ATOM 0 HA TRP A 26 3.640 0.748 -9.099 1.00 0.00 H new ATOM 0 HB2 TRP A 26 4.141 2.493 -7.440 1.00 0.00 H new ATOM 0 HB3 TRP A 26 3.010 1.782 -6.306 1.00 0.00 H new ATOM 0 HD1 TRP A 26 6.309 0.747 -8.127 1.00 0.00 H new ATOM 0 HE1 TRP A 26 7.665 -0.808 -6.569 1.00 0.00 H new ATOM 0 HE3 TRP A 26 2.952 0.423 -4.286 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 7.311 -1.987 -4.038 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 3.534 -0.943 -2.322 1.00 0.00 H new ATOM 0 HH2 TRP A 26 5.686 -2.131 -2.201 1.00 0.00 H new ATOM 407 N ALA A 27 1.390 -0.429 -6.977 1.00 0.00 N ATOM 408 CA ALA A 27 0.772 -1.657 -6.492 1.00 0.00 C ATOM 409 C ALA A 27 0.019 -2.371 -7.609 1.00 0.00 C ATOM 410 O ALA A 27 0.082 -3.594 -7.731 1.00 0.00 O ATOM 411 CB ALA A 27 -0.165 -1.354 -5.332 1.00 0.00 C ATOM 0 H ALA A 27 0.981 0.426 -6.601 1.00 0.00 H new ATOM 0 HA ALA A 27 1.564 -2.319 -6.142 1.00 0.00 H new ATOM 0 HB1 ALA A 27 -0.619 -2.280 -4.980 1.00 0.00 H new ATOM 0 HB2 ALA A 27 0.398 -0.894 -4.520 1.00 0.00 H new ATOM 0 HB3 ALA A 27 -0.946 -0.670 -5.664 1.00 0.00 H new ATOM 417 N ASN A 28 -0.694 -1.599 -8.423 1.00 0.00 N ATOM 418 CA ASN A 28 -1.461 -2.159 -9.531 1.00 0.00 C ATOM 419 C ASN A 28 -0.632 -3.179 -10.306 1.00 0.00 C ATOM 420 O ASN A 28 -1.166 -4.148 -10.846 1.00 0.00 O ATOM 421 CB ASN A 28 -1.927 -1.045 -10.470 1.00 0.00 C ATOM 422 CG ASN A 28 -3.273 -0.474 -10.065 1.00 0.00 C ATOM 423 OD1 ASN A 28 -4.162 -0.300 -10.899 1.00 0.00 O ATOM 424 ND2 ASN A 28 -3.427 -0.178 -8.780 1.00 0.00 N ATOM 0 H ASN A 28 -0.757 -0.585 -8.337 1.00 0.00 H new ATOM 0 HA ASN A 28 -2.333 -2.665 -9.117 1.00 0.00 H new ATOM 0 HB2 ASN A 28 -1.185 -0.247 -10.479 1.00 0.00 H new ATOM 0 HB3 ASN A 28 -1.991 -1.433 -11.487 1.00 0.00 H new ATOM 0 HD21 ASN A 28 -4.310 0.210 -8.448 1.00 0.00 H new ATOM 0 HD22 ASN A 28 -2.662 -0.339 -8.124 1.00 0.00 H new ATOM 431 N HIS A 29 0.678 -2.954 -10.355 1.00 0.00 N ATOM 432 CA HIS A 29 1.581 -3.854 -11.063 1.00 0.00 C ATOM 433 C HIS A 29 1.702 -5.188 -10.332 1.00 0.00 C ATOM 434 O HIS A 29 1.738 -6.248 -10.958 1.00 0.00 O ATOM 435 CB HIS A 29 2.962 -3.213 -11.209 1.00 0.00 C ATOM 436 CG HIS A 29 4.033 -4.181 -11.608 1.00 0.00 C ATOM 437 ND1 HIS A 29 3.953 -4.967 -12.739 1.00 0.00 N ATOM 438 CD2 HIS A 29 5.213 -4.487 -11.021 1.00 0.00 C ATOM 439 CE1 HIS A 29 5.038 -5.715 -12.829 1.00 0.00 C ATOM 440 NE2 HIS A 29 5.819 -5.443 -11.799 1.00 0.00 N ATOM 0 H HIS A 29 1.137 -2.157 -9.913 1.00 0.00 H new ATOM 0 HA HIS A 29 1.167 -4.039 -12.054 1.00 0.00 H new ATOM 0 HB2 HIS A 29 2.907 -2.418 -11.952 1.00 0.00 H new ATOM 0 HB3 HIS A 29 3.239 -2.747 -10.263 1.00 0.00 H new ATOM 0 HD2 HIS A 29 5.605 -4.059 -10.110 1.00 0.00 H new ATOM 0 HE1 HIS A 29 5.250 -6.428 -13.612 1.00 0.00 H new ATOM 0 HE2 HIS A 29 6.725 -5.873 -11.612 1.00 0.00 H new ATOM 449 N TYR A 30 1.764 -5.128 -9.007 1.00 0.00 N ATOM 450 CA TYR A 30 1.884 -6.331 -8.192 1.00 0.00 C ATOM 451 C TYR A 30 0.563 -7.094 -8.149 1.00 0.00 C ATOM 452 O TYR A 30 0.540 -8.308 -7.946 1.00 0.00 O ATOM 453 CB TYR A 30 2.322 -5.968 -6.772 1.00 0.00 C ATOM 454 CG TYR A 30 3.776 -5.564 -6.672 1.00 0.00 C ATOM 455 CD1 TYR A 30 4.788 -6.513 -6.746 1.00 0.00 C ATOM 456 CD2 TYR A 30 4.137 -4.233 -6.502 1.00 0.00 C ATOM 457 CE1 TYR A 30 6.117 -6.148 -6.654 1.00 0.00 C ATOM 458 CE2 TYR A 30 5.463 -3.859 -6.411 1.00 0.00 C ATOM 459 CZ TYR A 30 6.450 -4.820 -6.487 1.00 0.00 C ATOM 460 OH TYR A 30 7.772 -4.451 -6.395 1.00 0.00 O ATOM 0 H TYR A 30 1.733 -4.259 -8.474 1.00 0.00 H new ATOM 0 HA TYR A 30 2.639 -6.973 -8.646 1.00 0.00 H new ATOM 0 HB2 TYR A 30 1.700 -5.151 -6.407 1.00 0.00 H new ATOM 0 HB3 TYR A 30 2.145 -6.821 -6.117 1.00 0.00 H new ATOM 0 HD1 TYR A 30 4.531 -7.554 -6.878 1.00 0.00 H new ATOM 0 HD2 TYR A 30 3.367 -3.478 -6.440 1.00 0.00 H new ATOM 0 HE1 TYR A 30 6.891 -6.899 -6.713 1.00 0.00 H new ATOM 0 HE2 TYR A 30 5.726 -2.820 -6.281 1.00 0.00 H new ATOM 0 HH TYR A 30 7.833 -3.480 -6.281 1.00 0.00 H new ATOM 470 N LEU A 31 -0.535 -6.372 -8.343 1.00 0.00 N ATOM 471 CA LEU A 31 -1.862 -6.979 -8.329 1.00 0.00 C ATOM 472 C LEU A 31 -2.210 -7.561 -9.695 1.00 0.00 C ATOM 473 O LEU A 31 -2.757 -8.659 -9.792 1.00 0.00 O ATOM 474 CB LEU A 31 -2.913 -5.946 -7.918 1.00 0.00 C ATOM 475 CG LEU A 31 -3.085 -5.725 -6.415 1.00 0.00 C ATOM 476 CD1 LEU A 31 -3.911 -4.476 -6.151 1.00 0.00 C ATOM 477 CD2 LEU A 31 -3.731 -6.941 -5.768 1.00 0.00 C ATOM 0 H LEU A 31 -0.533 -5.366 -8.512 1.00 0.00 H new ATOM 0 HA LEU A 31 -1.855 -7.790 -7.601 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -2.655 -4.992 -8.378 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -3.874 -6.250 -8.333 1.00 0.00 H new ATOM 0 HG LEU A 31 -2.099 -5.584 -5.972 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -4.023 -4.334 -5.076 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -3.408 -3.610 -6.581 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.895 -4.587 -6.607 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -3.846 -6.766 -4.698 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -4.710 -7.114 -6.215 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -3.100 -7.816 -5.927 1.00 0.00 H new ATOM 489 N ALA A 32 -1.887 -6.817 -10.748 1.00 0.00 N ATOM 490 CA ALA A 32 -2.162 -7.261 -12.109 1.00 0.00 C ATOM 491 C ALA A 32 -1.258 -8.425 -12.500 1.00 0.00 C ATOM 492 O ALA A 32 -1.667 -9.321 -13.240 1.00 0.00 O ATOM 493 CB ALA A 32 -1.990 -6.106 -13.085 1.00 0.00 C ATOM 0 H ALA A 32 -1.435 -5.905 -10.685 1.00 0.00 H new ATOM 0 HA ALA A 32 -3.195 -7.607 -12.150 1.00 0.00 H new ATOM 0 HB1 ALA A 32 -2.198 -6.451 -14.098 1.00 0.00 H new ATOM 0 HB2 ALA A 32 -2.681 -5.304 -12.826 1.00 0.00 H new ATOM 0 HB3 ALA A 32 -0.967 -5.734 -13.032 1.00 0.00 H new ATOM 499 N LYS A 33 -0.028 -8.407 -12.000 1.00 0.00 N ATOM 500 CA LYS A 33 0.935 -9.461 -12.296 1.00 0.00 C ATOM 501 C LYS A 33 0.520 -10.775 -11.643 1.00 0.00 C ATOM 502 O LYS A 33 0.706 -11.850 -12.215 1.00 0.00 O ATOM 503 CB LYS A 33 2.330 -9.057 -11.813 1.00 0.00 C ATOM 504 CG LYS A 33 2.500 -9.144 -10.306 1.00 0.00 C ATOM 505 CD LYS A 33 3.912 -8.774 -9.883 1.00 0.00 C ATOM 506 CE LYS A 33 4.884 -9.919 -10.123 1.00 0.00 C ATOM 507 NZ LYS A 33 4.846 -10.919 -9.020 1.00 0.00 N ATOM 0 H LYS A 33 0.326 -7.673 -11.387 1.00 0.00 H new ATOM 0 HA LYS A 33 0.959 -9.604 -13.376 1.00 0.00 H new ATOM 0 HB2 LYS A 33 3.071 -9.698 -12.291 1.00 0.00 H new ATOM 0 HB3 LYS A 33 2.536 -8.036 -12.135 1.00 0.00 H new ATOM 0 HG2 LYS A 33 1.787 -8.479 -9.819 1.00 0.00 H new ATOM 0 HG3 LYS A 33 2.272 -10.156 -9.971 1.00 0.00 H new ATOM 0 HD2 LYS A 33 4.240 -7.895 -10.437 1.00 0.00 H new ATOM 0 HD3 LYS A 33 3.918 -8.506 -8.827 1.00 0.00 H new ATOM 0 HE2 LYS A 33 4.642 -10.409 -11.066 1.00 0.00 H new ATOM 0 HE3 LYS A 33 5.895 -9.523 -10.220 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 5.522 -11.683 -9.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 5.101 -10.457 -8.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 3.888 -11.316 -8.944 1.00 0.00 H new ATOM 521 N SER A 34 -0.044 -10.683 -10.443 1.00 0.00 N ATOM 522 CA SER A 34 -0.483 -11.865 -9.711 1.00 0.00 C ATOM 523 C SER A 34 -1.870 -12.305 -10.172 1.00 0.00 C ATOM 524 O SER A 34 -2.572 -13.025 -9.463 1.00 0.00 O ATOM 525 CB SER A 34 -0.498 -11.584 -8.208 1.00 0.00 C ATOM 526 OG SER A 34 -0.421 -12.787 -7.463 1.00 0.00 O ATOM 0 H SER A 34 -0.208 -9.801 -9.957 1.00 0.00 H new ATOM 0 HA SER A 34 0.222 -12.671 -9.915 1.00 0.00 H new ATOM 0 HB2 SER A 34 0.340 -10.937 -7.948 1.00 0.00 H new ATOM 0 HB3 SER A 34 -1.409 -11.047 -7.944 1.00 0.00 H new ATOM 0 HG SER A 34 -1.090 -13.421 -7.796 1.00 0.00 H new ATOM 532 N GLY A 35 -2.258 -11.865 -11.365 1.00 0.00 N ATOM 533 CA GLY A 35 -3.558 -12.222 -11.901 1.00 0.00 C ATOM 534 C GLY A 35 -4.689 -11.894 -10.945 1.00 0.00 C ATOM 535 O GLY A 35 -5.415 -12.784 -10.503 1.00 0.00 O ATOM 0 H GLY A 35 -1.695 -11.267 -11.970 1.00 0.00 H new ATOM 0 HA2 GLY A 35 -3.717 -11.695 -12.842 1.00 0.00 H new ATOM 0 HA3 GLY A 35 -3.574 -13.288 -12.126 1.00 0.00 H new ATOM 539 N HIS A 36 -4.837 -10.613 -10.625 1.00 0.00 N ATOM 540 CA HIS A 36 -5.887 -10.169 -9.714 1.00 0.00 C ATOM 541 C HIS A 36 -6.984 -9.427 -10.471 1.00 0.00 C ATOM 542 O HIS A 36 -6.717 -8.461 -11.185 1.00 0.00 O ATOM 543 CB HIS A 36 -5.301 -9.267 -8.628 1.00 0.00 C ATOM 544 CG HIS A 36 -6.050 -9.327 -7.332 1.00 0.00 C ATOM 545 ND1 HIS A 36 -7.188 -8.589 -7.085 1.00 0.00 N ATOM 546 CD2 HIS A 36 -5.818 -10.045 -6.208 1.00 0.00 C ATOM 547 CE1 HIS A 36 -7.623 -8.849 -5.865 1.00 0.00 C ATOM 548 NE2 HIS A 36 -6.809 -9.730 -5.312 1.00 0.00 N ATOM 0 H HIS A 36 -4.244 -9.864 -10.982 1.00 0.00 H new ATOM 0 HA HIS A 36 -6.325 -11.051 -9.246 1.00 0.00 H new ATOM 0 HB2 HIS A 36 -4.263 -9.551 -8.452 1.00 0.00 H new ATOM 0 HB3 HIS A 36 -5.294 -8.238 -8.987 1.00 0.00 H new ATOM 0 HD2 HIS A 36 -5.005 -10.737 -6.046 1.00 0.00 H new ATOM 0 HE1 HIS A 36 -8.495 -8.415 -5.399 1.00 0.00 H new ATOM 0 HE2 HIS A 36 -6.902 -10.114 -4.372 1.00 0.00 H new ATOM 557 N LYS A 37 -8.221 -9.886 -10.310 1.00 0.00 N ATOM 558 CA LYS A 37 -9.360 -9.266 -10.977 1.00 0.00 C ATOM 559 C LYS A 37 -9.839 -8.039 -10.208 1.00 0.00 C ATOM 560 O LYS A 37 -11.034 -7.877 -9.961 1.00 0.00 O ATOM 561 CB LYS A 37 -10.505 -10.272 -11.117 1.00 0.00 C ATOM 562 CG LYS A 37 -10.415 -11.124 -12.371 1.00 0.00 C ATOM 563 CD LYS A 37 -9.611 -12.391 -12.129 1.00 0.00 C ATOM 564 CE LYS A 37 -8.961 -12.892 -13.410 1.00 0.00 C ATOM 565 NZ LYS A 37 -9.905 -13.698 -14.232 1.00 0.00 N ATOM 0 H LYS A 37 -8.460 -10.685 -9.723 1.00 0.00 H new ATOM 0 HA LYS A 37 -9.039 -8.949 -11.969 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -10.513 -10.925 -10.244 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -11.453 -9.733 -11.121 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -11.418 -11.387 -12.706 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -9.953 -10.546 -13.172 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -8.842 -12.198 -11.381 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -10.263 -13.165 -11.724 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -8.606 -12.043 -13.993 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -8.088 -13.496 -13.162 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -9.424 -14.021 -15.096 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -10.225 -14.523 -13.685 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -10.726 -13.114 -14.490 1.00 0.00 H new ATOM 579 N ARG A 38 -8.900 -7.177 -9.834 1.00 0.00 N ATOM 580 CA ARG A 38 -9.227 -5.964 -9.093 1.00 0.00 C ATOM 581 C ARG A 38 -8.038 -5.009 -9.062 1.00 0.00 C ATOM 582 O ARG A 38 -6.883 -5.437 -9.074 1.00 0.00 O ATOM 583 CB ARG A 38 -9.652 -6.312 -7.666 1.00 0.00 C ATOM 584 CG ARG A 38 -10.391 -5.187 -6.959 1.00 0.00 C ATOM 585 CD ARG A 38 -10.539 -5.466 -5.471 1.00 0.00 C ATOM 586 NE ARG A 38 -11.734 -4.840 -4.913 1.00 0.00 N ATOM 587 CZ ARG A 38 -12.181 -5.074 -3.685 1.00 0.00 C ATOM 588 NH1 ARG A 38 -11.535 -5.917 -2.890 1.00 0.00 N ATOM 589 NH2 ARG A 38 -13.276 -4.466 -3.248 1.00 0.00 N ATOM 0 H ARG A 38 -7.906 -7.296 -10.032 1.00 0.00 H new ATOM 0 HA ARG A 38 -10.055 -5.470 -9.601 1.00 0.00 H new ATOM 0 HB2 ARG A 38 -10.290 -7.195 -7.691 1.00 0.00 H new ATOM 0 HB3 ARG A 38 -8.767 -6.575 -7.086 1.00 0.00 H new ATOM 0 HG2 ARG A 38 -9.853 -4.250 -7.103 1.00 0.00 H new ATOM 0 HG3 ARG A 38 -11.377 -5.060 -7.406 1.00 0.00 H new ATOM 0 HD2 ARG A 38 -10.584 -6.543 -5.307 1.00 0.00 H new ATOM 0 HD3 ARG A 38 -9.658 -5.099 -4.944 1.00 0.00 H new ATOM 0 HE ARG A 38 -12.254 -4.187 -5.499 1.00 0.00 H new ATOM 0 HH11 ARG A 38 -10.693 -6.387 -3.222 1.00 0.00 H new ATOM 0 HH12 ARG A 38 -11.881 -6.095 -1.947 1.00 0.00 H new ATOM 0 HH21 ARG A 38 -13.776 -3.817 -3.856 1.00 0.00 H new ATOM 0 HH22 ARG A 38 -13.618 -4.647 -2.304 1.00 0.00 H new ATOM 603 N LEU A 39 -8.328 -3.713 -9.024 1.00 0.00 N ATOM 604 CA LEU A 39 -7.283 -2.695 -8.992 1.00 0.00 C ATOM 605 C LEU A 39 -7.503 -1.724 -7.836 1.00 0.00 C ATOM 606 O LEU A 39 -8.439 -1.881 -7.051 1.00 0.00 O ATOM 607 CB LEU A 39 -7.247 -1.931 -10.316 1.00 0.00 C ATOM 608 CG LEU A 39 -6.599 -2.658 -11.494 1.00 0.00 C ATOM 609 CD1 LEU A 39 -6.593 -1.772 -12.730 1.00 0.00 C ATOM 610 CD2 LEU A 39 -5.184 -3.092 -11.140 1.00 0.00 C ATOM 0 H LEU A 39 -9.278 -3.342 -9.015 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.327 -3.196 -8.843 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -8.270 -1.674 -10.592 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -6.715 -0.993 -10.157 1.00 0.00 H new ATOM 0 HG LEU A 39 -7.187 -3.549 -11.714 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -6.128 -2.306 -13.558 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -7.617 -1.511 -12.996 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -6.029 -0.862 -12.523 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -4.738 -3.608 -11.990 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -4.585 -2.215 -10.893 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -5.213 -3.764 -10.283 1.00 0.00 H new ATOM 622 N ILE A 40 -6.637 -0.721 -7.740 1.00 0.00 N ATOM 623 CA ILE A 40 -6.740 0.277 -6.682 1.00 0.00 C ATOM 624 C ILE A 40 -7.258 1.603 -7.227 1.00 0.00 C ATOM 625 O ILE A 40 -6.597 2.255 -8.035 1.00 0.00 O ATOM 626 CB ILE A 40 -5.381 0.512 -5.997 1.00 0.00 C ATOM 627 CG1 ILE A 40 -4.855 -0.793 -5.397 1.00 0.00 C ATOM 628 CG2 ILE A 40 -5.508 1.582 -4.923 1.00 0.00 C ATOM 629 CD1 ILE A 40 -3.504 -0.651 -4.732 1.00 0.00 C ATOM 0 H ILE A 40 -5.857 -0.578 -8.381 1.00 0.00 H new ATOM 0 HA ILE A 40 -7.446 -0.112 -5.948 1.00 0.00 H new ATOM 0 HB ILE A 40 -4.668 0.858 -6.745 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -5.574 -1.163 -4.666 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -4.786 -1.544 -6.184 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -4.539 1.737 -4.448 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -5.843 2.515 -5.377 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -6.232 1.262 -4.174 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -3.194 -1.615 -4.329 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -2.772 -0.311 -5.464 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -3.572 0.076 -3.922 1.00 0.00 H new ATOM 641 N ARG A 41 -8.445 1.998 -6.778 1.00 0.00 N ATOM 642 CA ARG A 41 -9.053 3.247 -7.219 1.00 0.00 C ATOM 643 C ARG A 41 -8.761 4.373 -6.231 1.00 0.00 C ATOM 644 O ARG A 41 -8.174 5.393 -6.592 1.00 0.00 O ATOM 645 CB ARG A 41 -10.564 3.075 -7.381 1.00 0.00 C ATOM 646 CG ARG A 41 -10.951 1.937 -8.311 1.00 0.00 C ATOM 647 CD ARG A 41 -12.461 1.798 -8.424 1.00 0.00 C ATOM 648 NE ARG A 41 -12.863 0.432 -8.748 1.00 0.00 N ATOM 649 CZ ARG A 41 -14.129 0.039 -8.834 1.00 0.00 C ATOM 650 NH1 ARG A 41 -15.111 0.904 -8.622 1.00 0.00 N ATOM 651 NH2 ARG A 41 -14.415 -1.222 -9.133 1.00 0.00 N ATOM 0 H ARG A 41 -9.005 1.470 -6.108 1.00 0.00 H new ATOM 0 HA ARG A 41 -8.619 3.512 -8.183 1.00 0.00 H new ATOM 0 HB2 ARG A 41 -11.008 2.899 -6.401 1.00 0.00 H new ATOM 0 HB3 ARG A 41 -10.988 4.004 -7.761 1.00 0.00 H new ATOM 0 HG2 ARG A 41 -10.526 2.113 -9.299 1.00 0.00 H new ATOM 0 HG3 ARG A 41 -10.525 1.004 -7.942 1.00 0.00 H new ATOM 0 HD2 ARG A 41 -12.924 2.099 -7.484 1.00 0.00 H new ATOM 0 HD3 ARG A 41 -12.831 2.477 -9.193 1.00 0.00 H new ATOM 0 HE ARG A 41 -12.131 -0.258 -8.918 1.00 0.00 H new ATOM 0 HH11 ARG A 41 -14.895 1.874 -8.392 1.00 0.00 H new ATOM 0 HH12 ARG A 41 -16.082 0.599 -8.689 1.00 0.00 H new ATOM 0 HH21 ARG A 41 -13.662 -1.891 -9.297 1.00 0.00 H new ATOM 0 HH22 ARG A 41 -15.387 -1.523 -9.199 1.00 0.00 H new ATOM 665 N ASP A 42 -9.176 4.180 -4.984 1.00 0.00 N ATOM 666 CA ASP A 42 -8.959 5.178 -3.943 1.00 0.00 C ATOM 667 C ASP A 42 -7.992 4.658 -2.884 1.00 0.00 C ATOM 668 O ASP A 42 -8.371 3.873 -2.013 1.00 0.00 O ATOM 669 CB ASP A 42 -10.288 5.563 -3.292 1.00 0.00 C ATOM 670 CG ASP A 42 -11.285 4.421 -3.290 1.00 0.00 C ATOM 671 OD1 ASP A 42 -10.931 3.325 -2.806 1.00 0.00 O ATOM 672 OD2 ASP A 42 -12.419 4.623 -3.770 1.00 0.00 O ATOM 0 H ASP A 42 -9.665 3.342 -4.669 1.00 0.00 H new ATOM 0 HA ASP A 42 -8.520 6.061 -4.407 1.00 0.00 H new ATOM 0 HB2 ASP A 42 -10.107 5.885 -2.266 1.00 0.00 H new ATOM 0 HB3 ASP A 42 -10.716 6.414 -3.822 1.00 0.00 H new ATOM 677 N LEU A 43 -6.741 5.098 -2.966 1.00 0.00 N ATOM 678 CA LEU A 43 -5.718 4.676 -2.015 1.00 0.00 C ATOM 679 C LEU A 43 -6.199 4.863 -0.579 1.00 0.00 C ATOM 680 O LEU A 43 -5.928 4.032 0.288 1.00 0.00 O ATOM 681 CB LEU A 43 -4.428 5.467 -2.240 1.00 0.00 C ATOM 682 CG LEU A 43 -3.139 4.797 -1.765 1.00 0.00 C ATOM 683 CD1 LEU A 43 -2.888 3.512 -2.539 1.00 0.00 C ATOM 684 CD2 LEU A 43 -1.959 5.747 -1.909 1.00 0.00 C ATOM 0 H LEU A 43 -6.411 5.746 -3.681 1.00 0.00 H new ATOM 0 HA LEU A 43 -5.521 3.616 -2.177 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -4.334 5.675 -3.306 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.522 6.428 -1.735 1.00 0.00 H new ATOM 0 HG LEU A 43 -3.251 4.546 -0.710 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -1.966 3.049 -2.187 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -3.721 2.826 -2.384 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -2.797 3.739 -3.601 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -1.050 5.253 -1.566 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -1.845 6.030 -2.955 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -2.135 6.640 -1.309 1.00 0.00 H new ATOM 696 N GLN A 44 -6.914 5.956 -0.338 1.00 0.00 N ATOM 697 CA GLN A 44 -7.433 6.250 0.993 1.00 0.00 C ATOM 698 C GLN A 44 -8.527 5.261 1.381 1.00 0.00 C ATOM 699 O GLN A 44 -8.608 4.832 2.532 1.00 0.00 O ATOM 700 CB GLN A 44 -7.979 7.678 1.046 1.00 0.00 C ATOM 701 CG GLN A 44 -6.895 8.743 1.067 1.00 0.00 C ATOM 702 CD GLN A 44 -7.350 10.052 0.451 1.00 0.00 C ATOM 703 OE1 GLN A 44 -7.722 10.104 -0.721 1.00 0.00 O ATOM 704 NE2 GLN A 44 -7.324 11.119 1.242 1.00 0.00 N ATOM 0 H GLN A 44 -7.147 6.652 -1.046 1.00 0.00 H new ATOM 0 HA GLN A 44 -6.613 6.155 1.705 1.00 0.00 H new ATOM 0 HB2 GLN A 44 -8.623 7.844 0.183 1.00 0.00 H new ATOM 0 HB3 GLN A 44 -8.602 7.787 1.934 1.00 0.00 H new ATOM 0 HG2 GLN A 44 -6.584 8.919 2.097 1.00 0.00 H new ATOM 0 HG3 GLN A 44 -6.021 8.377 0.528 1.00 0.00 H new ATOM 0 HE21 GLN A 44 -7.008 11.030 2.208 1.00 0.00 H new ATOM 0 HE22 GLN A 44 -7.620 12.027 0.884 1.00 0.00 H new ATOM 713 N GLN A 45 -9.365 4.903 0.413 1.00 0.00 N ATOM 714 CA GLN A 45 -10.454 3.964 0.655 1.00 0.00 C ATOM 715 C GLN A 45 -10.077 2.561 0.192 1.00 0.00 C ATOM 716 O GLN A 45 -10.924 1.671 0.123 1.00 0.00 O ATOM 717 CB GLN A 45 -11.723 4.427 -0.062 1.00 0.00 C ATOM 718 CG GLN A 45 -12.580 5.371 0.766 1.00 0.00 C ATOM 719 CD GLN A 45 -14.054 5.268 0.429 1.00 0.00 C ATOM 720 OE1 GLN A 45 -14.506 4.272 -0.136 1.00 0.00 O ATOM 721 NE2 GLN A 45 -14.815 6.301 0.775 1.00 0.00 N ATOM 0 H GLN A 45 -9.311 5.249 -0.545 1.00 0.00 H new ATOM 0 HA GLN A 45 -10.642 3.934 1.728 1.00 0.00 H new ATOM 0 HB2 GLN A 45 -11.444 4.924 -0.992 1.00 0.00 H new ATOM 0 HB3 GLN A 45 -12.317 3.554 -0.333 1.00 0.00 H new ATOM 0 HG2 GLN A 45 -12.437 5.152 1.824 1.00 0.00 H new ATOM 0 HG3 GLN A 45 -12.245 6.396 0.605 1.00 0.00 H new ATOM 0 HE21 GLN A 45 -14.399 7.107 1.242 1.00 0.00 H new ATOM 0 HE22 GLN A 45 -15.815 6.288 0.574 1.00 0.00 H new ATOM 730 N ASP A 46 -8.801 2.371 -0.126 1.00 0.00 N ATOM 731 CA ASP A 46 -8.311 1.076 -0.582 1.00 0.00 C ATOM 732 C ASP A 46 -7.595 0.338 0.544 1.00 0.00 C ATOM 733 O ASP A 46 -7.564 -0.893 0.573 1.00 0.00 O ATOM 734 CB ASP A 46 -7.367 1.255 -1.772 1.00 0.00 C ATOM 735 CG ASP A 46 -8.097 1.219 -3.101 1.00 0.00 C ATOM 736 OD1 ASP A 46 -8.627 0.147 -3.458 1.00 0.00 O ATOM 737 OD2 ASP A 46 -8.137 2.265 -3.784 1.00 0.00 O ATOM 0 H ASP A 46 -8.087 3.098 -0.076 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.169 0.480 -0.894 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -6.841 2.205 -1.675 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -6.612 0.469 -1.754 1.00 0.00 H new ATOM 742 N VAL A 47 -7.020 1.097 1.471 1.00 0.00 N ATOM 743 CA VAL A 47 -6.304 0.515 2.600 1.00 0.00 C ATOM 744 C VAL A 47 -7.057 0.744 3.906 1.00 0.00 C ATOM 745 O VAL A 47 -6.451 0.932 4.961 1.00 0.00 O ATOM 746 CB VAL A 47 -4.886 1.103 2.729 1.00 0.00 C ATOM 747 CG1 VAL A 47 -4.098 0.882 1.446 1.00 0.00 C ATOM 748 CG2 VAL A 47 -4.952 2.582 3.076 1.00 0.00 C ATOM 0 H VAL A 47 -7.036 2.117 1.462 1.00 0.00 H new ATOM 0 HA VAL A 47 -6.230 -0.556 2.409 1.00 0.00 H new ATOM 0 HB VAL A 47 -4.369 0.587 3.538 1.00 0.00 H new ATOM 0 HG11 VAL A 47 -3.099 1.304 1.555 1.00 0.00 H new ATOM 0 HG12 VAL A 47 -4.021 -0.187 1.246 1.00 0.00 H new ATOM 0 HG13 VAL A 47 -4.609 1.370 0.616 1.00 0.00 H new ATOM 0 HG21 VAL A 47 -3.941 2.981 3.163 1.00 0.00 H new ATOM 0 HG22 VAL A 47 -5.486 3.116 2.291 1.00 0.00 H new ATOM 0 HG23 VAL A 47 -5.476 2.710 4.023 1.00 0.00 H new ATOM 758 N THR A 48 -8.384 0.727 3.827 1.00 0.00 N ATOM 759 CA THR A 48 -9.222 0.934 5.002 1.00 0.00 C ATOM 760 C THR A 48 -9.522 -0.387 5.702 1.00 0.00 C ATOM 761 O THR A 48 -9.619 -0.442 6.929 1.00 0.00 O ATOM 762 CB THR A 48 -10.551 1.618 4.631 1.00 0.00 C ATOM 763 OG1 THR A 48 -11.161 0.938 3.528 1.00 0.00 O ATOM 764 CG2 THR A 48 -10.326 3.079 4.270 1.00 0.00 C ATOM 0 H THR A 48 -8.901 0.572 2.962 1.00 0.00 H new ATOM 0 HA THR A 48 -8.664 1.583 5.678 1.00 0.00 H new ATOM 0 HB THR A 48 -11.212 1.571 5.497 1.00 0.00 H new ATOM 0 HG1 THR A 48 -11.549 0.093 3.838 1.00 0.00 H new ATOM 0 HG21 THR A 48 -11.279 3.541 4.012 1.00 0.00 H new ATOM 0 HG22 THR A 48 -9.889 3.601 5.121 1.00 0.00 H new ATOM 0 HG23 THR A 48 -9.649 3.143 3.418 1.00 0.00 H new ATOM 772 N ASP A 49 -9.666 -1.448 4.917 1.00 0.00 N ATOM 773 CA ASP A 49 -9.953 -2.770 5.463 1.00 0.00 C ATOM 774 C ASP A 49 -8.672 -3.584 5.615 1.00 0.00 C ATOM 775 O ASP A 49 -8.644 -4.588 6.326 1.00 0.00 O ATOM 776 CB ASP A 49 -10.941 -3.513 4.563 1.00 0.00 C ATOM 777 CG ASP A 49 -12.251 -2.768 4.401 1.00 0.00 C ATOM 778 OD1 ASP A 49 -12.235 -1.521 4.460 1.00 0.00 O ATOM 779 OD2 ASP A 49 -13.293 -3.432 4.217 1.00 0.00 O ATOM 0 H ASP A 49 -9.589 -1.419 3.900 1.00 0.00 H new ATOM 0 HA ASP A 49 -10.399 -2.641 6.449 1.00 0.00 H new ATOM 0 HB2 ASP A 49 -10.490 -3.666 3.583 1.00 0.00 H new ATOM 0 HB3 ASP A 49 -11.137 -4.500 4.981 1.00 0.00 H new ATOM 784 N GLY A 50 -7.614 -3.145 4.941 1.00 0.00 N ATOM 785 CA GLY A 50 -6.345 -3.846 5.014 1.00 0.00 C ATOM 786 C GLY A 50 -6.305 -5.067 4.117 1.00 0.00 C ATOM 787 O GLY A 50 -5.236 -5.619 3.856 1.00 0.00 O ATOM 0 H GLY A 50 -7.613 -2.317 4.346 1.00 0.00 H new ATOM 0 HA2 GLY A 50 -5.541 -3.166 4.733 1.00 0.00 H new ATOM 0 HA3 GLY A 50 -6.160 -4.150 6.044 1.00 0.00 H new ATOM 791 N VAL A 51 -7.473 -5.492 3.646 1.00 0.00 N ATOM 792 CA VAL A 51 -7.567 -6.657 2.774 1.00 0.00 C ATOM 793 C VAL A 51 -6.785 -6.442 1.483 1.00 0.00 C ATOM 794 O VAL A 51 -5.741 -7.059 1.266 1.00 0.00 O ATOM 795 CB VAL A 51 -9.032 -6.980 2.425 1.00 0.00 C ATOM 796 CG1 VAL A 51 -9.105 -8.145 1.451 1.00 0.00 C ATOM 797 CG2 VAL A 51 -9.826 -7.279 3.688 1.00 0.00 C ATOM 0 H VAL A 51 -8.367 -5.047 3.854 1.00 0.00 H new ATOM 0 HA VAL A 51 -7.137 -7.497 3.321 1.00 0.00 H new ATOM 0 HB VAL A 51 -9.474 -6.108 1.943 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -10.148 -8.358 1.216 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -8.572 -7.888 0.535 1.00 0.00 H new ATOM 0 HG13 VAL A 51 -8.647 -9.025 1.902 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -10.859 -7.505 3.423 1.00 0.00 H new ATOM 0 HG22 VAL A 51 -9.387 -8.135 4.200 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -9.802 -6.411 4.347 1.00 0.00 H new ATOM 807 N LEU A 52 -7.295 -5.562 0.628 1.00 0.00 N ATOM 808 CA LEU A 52 -6.644 -5.263 -0.642 1.00 0.00 C ATOM 809 C LEU A 52 -5.191 -4.851 -0.427 1.00 0.00 C ATOM 810 O LEU A 52 -4.320 -5.155 -1.243 1.00 0.00 O ATOM 811 CB LEU A 52 -7.397 -4.153 -1.376 1.00 0.00 C ATOM 812 CG LEU A 52 -7.337 -4.196 -2.903 1.00 0.00 C ATOM 813 CD1 LEU A 52 -8.143 -3.054 -3.502 1.00 0.00 C ATOM 814 CD2 LEU A 52 -5.893 -4.140 -3.382 1.00 0.00 C ATOM 0 H LEU A 52 -8.158 -5.043 0.792 1.00 0.00 H new ATOM 0 HA LEU A 52 -6.659 -6.167 -1.250 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -8.443 -4.189 -1.073 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -7.002 -3.193 -1.044 1.00 0.00 H new ATOM 0 HG LEU A 52 -7.774 -5.137 -3.238 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -8.088 -3.101 -4.590 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -9.183 -3.138 -3.187 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -7.736 -2.103 -3.159 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -5.870 -4.172 -4.471 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -5.430 -3.216 -3.036 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -5.344 -4.992 -2.982 1.00 0.00 H new ATOM 826 N LEU A 53 -4.936 -4.160 0.679 1.00 0.00 N ATOM 827 CA LEU A 53 -3.588 -3.708 1.004 1.00 0.00 C ATOM 828 C LEU A 53 -2.627 -4.888 1.105 1.00 0.00 C ATOM 829 O LEU A 53 -1.542 -4.869 0.524 1.00 0.00 O ATOM 830 CB LEU A 53 -3.594 -2.926 2.319 1.00 0.00 C ATOM 831 CG LEU A 53 -2.300 -2.970 3.132 1.00 0.00 C ATOM 832 CD1 LEU A 53 -1.125 -2.496 2.290 1.00 0.00 C ATOM 833 CD2 LEU A 53 -2.431 -2.124 4.390 1.00 0.00 C ATOM 0 H LEU A 53 -5.645 -3.901 1.365 1.00 0.00 H new ATOM 0 HA LEU A 53 -3.247 -3.054 0.201 1.00 0.00 H new ATOM 0 HB2 LEU A 53 -3.825 -1.884 2.098 1.00 0.00 H new ATOM 0 HB3 LEU A 53 -4.404 -3.307 2.941 1.00 0.00 H new ATOM 0 HG LEU A 53 -2.116 -4.002 3.430 1.00 0.00 H new ATOM 0 HD11 LEU A 53 -0.212 -2.534 2.885 1.00 0.00 H new ATOM 0 HD12 LEU A 53 -1.018 -3.142 1.419 1.00 0.00 H new ATOM 0 HD13 LEU A 53 -1.302 -1.472 1.962 1.00 0.00 H new ATOM 0 HD21 LEU A 53 -1.501 -2.167 4.956 1.00 0.00 H new ATOM 0 HD22 LEU A 53 -2.640 -1.091 4.113 1.00 0.00 H new ATOM 0 HD23 LEU A 53 -3.247 -2.507 5.003 1.00 0.00 H new ATOM 845 N ALA A 54 -3.034 -5.914 1.845 1.00 0.00 N ATOM 846 CA ALA A 54 -2.211 -7.105 2.019 1.00 0.00 C ATOM 847 C ALA A 54 -2.013 -7.833 0.694 1.00 0.00 C ATOM 848 O ALA A 54 -0.926 -8.332 0.407 1.00 0.00 O ATOM 849 CB ALA A 54 -2.840 -8.035 3.046 1.00 0.00 C ATOM 0 H ALA A 54 -3.929 -5.945 2.334 1.00 0.00 H new ATOM 0 HA ALA A 54 -1.232 -6.791 2.381 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -2.215 -8.920 3.166 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -2.924 -7.518 4.002 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -3.832 -8.334 2.707 1.00 0.00 H new ATOM 855 N GLN A 55 -3.071 -7.890 -0.109 1.00 0.00 N ATOM 856 CA GLN A 55 -3.012 -8.559 -1.403 1.00 0.00 C ATOM 857 C GLN A 55 -1.761 -8.148 -2.172 1.00 0.00 C ATOM 858 O GLN A 55 -1.289 -8.878 -3.044 1.00 0.00 O ATOM 859 CB GLN A 55 -4.260 -8.234 -2.226 1.00 0.00 C ATOM 860 CG GLN A 55 -5.557 -8.659 -1.557 1.00 0.00 C ATOM 861 CD GLN A 55 -6.731 -8.674 -2.516 1.00 0.00 C ATOM 862 OE1 GLN A 55 -7.489 -9.643 -2.573 1.00 0.00 O ATOM 863 NE2 GLN A 55 -6.888 -7.598 -3.278 1.00 0.00 N ATOM 0 H GLN A 55 -3.979 -7.481 0.114 1.00 0.00 H new ATOM 0 HA GLN A 55 -2.971 -9.634 -1.226 1.00 0.00 H new ATOM 0 HB2 GLN A 55 -4.292 -7.161 -2.413 1.00 0.00 H new ATOM 0 HB3 GLN A 55 -4.183 -8.725 -3.196 1.00 0.00 H new ATOM 0 HG2 GLN A 55 -5.431 -9.653 -1.127 1.00 0.00 H new ATOM 0 HG3 GLN A 55 -5.775 -7.981 -0.732 1.00 0.00 H new ATOM 0 HE21 GLN A 55 -6.237 -6.817 -3.198 1.00 0.00 H new ATOM 0 HE22 GLN A 55 -7.660 -7.552 -3.943 1.00 0.00 H new ATOM 872 N ILE A 56 -1.229 -6.975 -1.843 1.00 0.00 N ATOM 873 CA ILE A 56 -0.032 -6.468 -2.503 1.00 0.00 C ATOM 874 C ILE A 56 1.222 -6.812 -1.706 1.00 0.00 C ATOM 875 O ILE A 56 2.168 -7.394 -2.238 1.00 0.00 O ATOM 876 CB ILE A 56 -0.100 -4.942 -2.698 1.00 0.00 C ATOM 877 CG1 ILE A 56 -1.407 -4.554 -3.394 1.00 0.00 C ATOM 878 CG2 ILE A 56 1.098 -4.457 -3.500 1.00 0.00 C ATOM 879 CD1 ILE A 56 -1.913 -3.182 -3.006 1.00 0.00 C ATOM 0 H ILE A 56 -1.608 -6.359 -1.124 1.00 0.00 H new ATOM 0 HA ILE A 56 0.017 -6.949 -3.480 1.00 0.00 H new ATOM 0 HB ILE A 56 -0.075 -4.463 -1.719 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -1.258 -4.586 -4.473 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -2.170 -5.295 -3.156 1.00 0.00 H new ATOM 0 HG21 ILE A 56 1.036 -3.377 -3.630 1.00 0.00 H new ATOM 0 HG22 ILE A 56 2.017 -4.707 -2.969 1.00 0.00 H new ATOM 0 HG23 ILE A 56 1.101 -4.940 -4.477 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -2.842 -2.973 -3.537 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -2.094 -3.151 -1.932 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -1.168 -2.431 -3.270 1.00 0.00 H new ATOM 891 N ILE A 57 1.222 -6.449 -0.428 1.00 0.00 N ATOM 892 CA ILE A 57 2.358 -6.721 0.443 1.00 0.00 C ATOM 893 C ILE A 57 2.809 -8.173 0.322 1.00 0.00 C ATOM 894 O ILE A 57 3.987 -8.450 0.096 1.00 0.00 O ATOM 895 CB ILE A 57 2.023 -6.422 1.917 1.00 0.00 C ATOM 896 CG1 ILE A 57 1.564 -4.970 2.073 1.00 0.00 C ATOM 897 CG2 ILE A 57 3.229 -6.699 2.801 1.00 0.00 C ATOM 898 CD1 ILE A 57 1.126 -4.623 3.478 1.00 0.00 C ATOM 0 H ILE A 57 0.448 -5.966 0.027 1.00 0.00 H new ATOM 0 HA ILE A 57 3.165 -6.063 0.121 1.00 0.00 H new ATOM 0 HB ILE A 57 1.210 -7.077 2.230 1.00 0.00 H new ATOM 0 HG12 ILE A 57 2.378 -4.307 1.781 1.00 0.00 H new ATOM 0 HG13 ILE A 57 0.738 -4.783 1.387 1.00 0.00 H new ATOM 0 HG21 ILE A 57 2.976 -6.483 3.839 1.00 0.00 H new ATOM 0 HG22 ILE A 57 3.516 -7.746 2.708 1.00 0.00 H new ATOM 0 HG23 ILE A 57 4.061 -6.066 2.491 1.00 0.00 H new ATOM 0 HD11 ILE A 57 0.814 -3.579 3.515 1.00 0.00 H new ATOM 0 HD12 ILE A 57 0.291 -5.261 3.767 1.00 0.00 H new ATOM 0 HD13 ILE A 57 1.957 -4.778 4.167 1.00 0.00 H new ATOM 910 N GLN A 58 1.863 -9.095 0.470 1.00 0.00 N ATOM 911 CA GLN A 58 2.164 -10.519 0.376 1.00 0.00 C ATOM 912 C GLN A 58 2.818 -10.849 -0.962 1.00 0.00 C ATOM 913 O GLN A 58 3.507 -11.860 -1.095 1.00 0.00 O ATOM 914 CB GLN A 58 0.887 -11.343 0.550 1.00 0.00 C ATOM 915 CG GLN A 58 0.335 -11.317 1.966 1.00 0.00 C ATOM 916 CD GLN A 58 -1.098 -11.806 2.043 1.00 0.00 C ATOM 917 OE1 GLN A 58 -2.017 -11.030 2.306 1.00 0.00 O ATOM 918 NE2 GLN A 58 -1.296 -13.099 1.814 1.00 0.00 N ATOM 0 H GLN A 58 0.883 -8.882 0.655 1.00 0.00 H new ATOM 0 HA GLN A 58 2.863 -10.772 1.173 1.00 0.00 H new ATOM 0 HB2 GLN A 58 0.126 -10.968 -0.135 1.00 0.00 H new ATOM 0 HB3 GLN A 58 1.089 -12.376 0.267 1.00 0.00 H new ATOM 0 HG2 GLN A 58 0.961 -11.937 2.607 1.00 0.00 H new ATOM 0 HG3 GLN A 58 0.389 -10.300 2.354 1.00 0.00 H new ATOM 0 HE21 GLN A 58 -0.505 -13.706 1.600 1.00 0.00 H new ATOM 0 HE22 GLN A 58 -2.239 -13.485 1.853 1.00 0.00 H new ATOM 927 N VAL A 59 2.596 -9.990 -1.952 1.00 0.00 N ATOM 928 CA VAL A 59 3.164 -10.190 -3.280 1.00 0.00 C ATOM 929 C VAL A 59 4.552 -9.567 -3.383 1.00 0.00 C ATOM 930 O VAL A 59 5.535 -10.257 -3.654 1.00 0.00 O ATOM 931 CB VAL A 59 2.261 -9.590 -4.373 1.00 0.00 C ATOM 932 CG1 VAL A 59 2.901 -9.752 -5.743 1.00 0.00 C ATOM 933 CG2 VAL A 59 0.883 -10.235 -4.339 1.00 0.00 C ATOM 0 H VAL A 59 2.027 -9.149 -1.859 1.00 0.00 H new ATOM 0 HA VAL A 59 3.240 -11.266 -3.433 1.00 0.00 H new ATOM 0 HB VAL A 59 2.143 -8.524 -4.178 1.00 0.00 H new ATOM 0 HG11 VAL A 59 2.248 -9.322 -6.503 1.00 0.00 H new ATOM 0 HG12 VAL A 59 3.863 -9.239 -5.758 1.00 0.00 H new ATOM 0 HG13 VAL A 59 3.052 -10.811 -5.951 1.00 0.00 H new ATOM 0 HG21 VAL A 59 0.258 -9.799 -5.118 1.00 0.00 H new ATOM 0 HG22 VAL A 59 0.979 -11.307 -4.509 1.00 0.00 H new ATOM 0 HG23 VAL A 59 0.424 -10.061 -3.366 1.00 0.00 H new ATOM 943 N VAL A 60 4.624 -8.258 -3.165 1.00 0.00 N ATOM 944 CA VAL A 60 5.892 -7.541 -3.232 1.00 0.00 C ATOM 945 C VAL A 60 6.893 -8.099 -2.226 1.00 0.00 C ATOM 946 O VAL A 60 8.104 -8.011 -2.426 1.00 0.00 O ATOM 947 CB VAL A 60 5.700 -6.036 -2.968 1.00 0.00 C ATOM 948 CG1 VAL A 60 5.000 -5.812 -1.636 1.00 0.00 C ATOM 949 CG2 VAL A 60 7.039 -5.314 -3.005 1.00 0.00 C ATOM 0 H VAL A 60 3.820 -7.672 -2.941 1.00 0.00 H new ATOM 0 HA VAL A 60 6.281 -7.679 -4.241 1.00 0.00 H new ATOM 0 HB VAL A 60 5.069 -5.624 -3.756 1.00 0.00 H new ATOM 0 HG11 VAL A 60 4.873 -4.743 -1.467 1.00 0.00 H new ATOM 0 HG12 VAL A 60 4.023 -6.295 -1.653 1.00 0.00 H new ATOM 0 HG13 VAL A 60 5.602 -6.238 -0.833 1.00 0.00 H new ATOM 0 HG21 VAL A 60 6.885 -4.252 -2.817 1.00 0.00 H new ATOM 0 HG22 VAL A 60 7.696 -5.727 -2.240 1.00 0.00 H new ATOM 0 HG23 VAL A 60 7.496 -5.446 -3.986 1.00 0.00 H new ATOM 959 N ALA A 61 6.377 -8.672 -1.143 1.00 0.00 N ATOM 960 CA ALA A 61 7.226 -9.247 -0.107 1.00 0.00 C ATOM 961 C ALA A 61 7.336 -10.760 -0.263 1.00 0.00 C ATOM 962 O ALA A 61 8.200 -11.394 0.340 1.00 0.00 O ATOM 963 CB ALA A 61 6.686 -8.895 1.272 1.00 0.00 C ATOM 0 H ALA A 61 5.376 -8.750 -0.961 1.00 0.00 H new ATOM 0 HA ALA A 61 8.225 -8.824 -0.214 1.00 0.00 H new ATOM 0 HB1 ALA A 61 7.329 -9.331 2.037 1.00 0.00 H new ATOM 0 HB2 ALA A 61 6.666 -7.811 1.389 1.00 0.00 H new ATOM 0 HB3 ALA A 61 5.676 -9.291 1.379 1.00 0.00 H new ATOM 969 N ASN A 62 6.455 -11.331 -1.078 1.00 0.00 N ATOM 970 CA ASN A 62 6.453 -12.771 -1.312 1.00 0.00 C ATOM 971 C ASN A 62 6.263 -13.535 -0.006 1.00 0.00 C ATOM 972 O ASN A 62 6.997 -14.479 0.285 1.00 0.00 O ATOM 973 CB ASN A 62 7.759 -13.201 -1.982 1.00 0.00 C ATOM 974 CG ASN A 62 7.926 -12.599 -3.364 1.00 0.00 C ATOM 975 OD1 ASN A 62 8.131 -11.394 -3.508 1.00 0.00 O ATOM 976 ND2 ASN A 62 7.838 -13.439 -4.390 1.00 0.00 N ATOM 0 H ASN A 62 5.734 -10.820 -1.587 1.00 0.00 H new ATOM 0 HA ASN A 62 5.619 -13.005 -1.973 1.00 0.00 H new ATOM 0 HB2 ASN A 62 8.600 -12.904 -1.356 1.00 0.00 H new ATOM 0 HB3 ASN A 62 7.785 -14.288 -2.057 1.00 0.00 H new ATOM 0 HD21 ASN A 62 7.942 -13.092 -5.344 1.00 0.00 H new ATOM 0 HD22 ASN A 62 7.667 -14.431 -4.224 1.00 0.00 H new ATOM 983 N GLU A 63 5.272 -13.120 0.778 1.00 0.00 N ATOM 984 CA GLU A 63 4.986 -13.766 2.054 1.00 0.00 C ATOM 985 C GLU A 63 3.492 -13.731 2.358 1.00 0.00 C ATOM 986 O GLU A 63 2.749 -12.929 1.792 1.00 0.00 O ATOM 987 CB GLU A 63 5.764 -13.083 3.181 1.00 0.00 C ATOM 988 CG GLU A 63 6.125 -14.018 4.324 1.00 0.00 C ATOM 989 CD GLU A 63 7.258 -14.961 3.970 1.00 0.00 C ATOM 990 OE1 GLU A 63 7.000 -15.964 3.272 1.00 0.00 O ATOM 991 OE2 GLU A 63 8.403 -14.696 4.391 1.00 0.00 O ATOM 0 H GLU A 63 4.655 -12.340 0.552 1.00 0.00 H new ATOM 0 HA GLU A 63 5.300 -14.807 1.984 1.00 0.00 H new ATOM 0 HB2 GLU A 63 6.678 -12.653 2.772 1.00 0.00 H new ATOM 0 HB3 GLU A 63 5.171 -12.257 3.572 1.00 0.00 H new ATOM 0 HG2 GLU A 63 6.407 -13.428 5.196 1.00 0.00 H new ATOM 0 HG3 GLU A 63 5.247 -14.600 4.604 1.00 0.00 H new ATOM 998 N LYS A 64 3.056 -14.608 3.256 1.00 0.00 N ATOM 999 CA LYS A 64 1.651 -14.679 3.638 1.00 0.00 C ATOM 1000 C LYS A 64 1.450 -14.188 5.068 1.00 0.00 C ATOM 1001 O LYS A 64 2.148 -14.619 5.986 1.00 0.00 O ATOM 1002 CB LYS A 64 1.137 -16.115 3.504 1.00 0.00 C ATOM 1003 CG LYS A 64 -0.342 -16.202 3.168 1.00 0.00 C ATOM 1004 CD LYS A 64 -0.751 -17.623 2.820 1.00 0.00 C ATOM 1005 CE LYS A 64 -1.121 -18.417 4.064 1.00 0.00 C ATOM 1006 NZ LYS A 64 -1.667 -19.760 3.723 1.00 0.00 N ATOM 0 H LYS A 64 3.657 -15.280 3.733 1.00 0.00 H new ATOM 0 HA LYS A 64 1.085 -14.032 2.968 1.00 0.00 H new ATOM 0 HB2 LYS A 64 1.708 -16.626 2.729 1.00 0.00 H new ATOM 0 HB3 LYS A 64 1.321 -16.647 4.438 1.00 0.00 H new ATOM 0 HG2 LYS A 64 -0.930 -15.850 4.016 1.00 0.00 H new ATOM 0 HG3 LYS A 64 -0.565 -15.542 2.329 1.00 0.00 H new ATOM 0 HD2 LYS A 64 -1.599 -17.601 2.135 1.00 0.00 H new ATOM 0 HD3 LYS A 64 0.067 -18.121 2.299 1.00 0.00 H new ATOM 0 HE2 LYS A 64 -0.241 -18.533 4.696 1.00 0.00 H new ATOM 0 HE3 LYS A 64 -1.859 -17.862 4.643 1.00 0.00 H new ATOM 0 HZ1 LYS A 64 -1.907 -20.269 4.597 1.00 0.00 H new ATOM 0 HZ2 LYS A 64 -2.522 -19.650 3.141 1.00 0.00 H new ATOM 0 HZ3 LYS A 64 -0.954 -20.300 3.192 1.00 0.00 H new ATOM 1020 N ILE A 65 0.492 -13.285 5.249 1.00 0.00 N ATOM 1021 CA ILE A 65 0.198 -12.738 6.568 1.00 0.00 C ATOM 1022 C ILE A 65 -0.934 -13.506 7.242 1.00 0.00 C ATOM 1023 O ILE A 65 -2.104 -13.322 6.911 1.00 0.00 O ATOM 1024 CB ILE A 65 -0.184 -11.248 6.487 1.00 0.00 C ATOM 1025 CG1 ILE A 65 0.833 -10.484 5.637 1.00 0.00 C ATOM 1026 CG2 ILE A 65 -0.275 -10.648 7.882 1.00 0.00 C ATOM 1027 CD1 ILE A 65 0.432 -9.053 5.356 1.00 0.00 C ATOM 0 H ILE A 65 -0.094 -12.917 4.499 1.00 0.00 H new ATOM 0 HA ILE A 65 1.106 -12.840 7.162 1.00 0.00 H new ATOM 0 HB ILE A 65 -1.162 -11.164 6.012 1.00 0.00 H new ATOM 0 HG12 ILE A 65 1.797 -10.489 6.146 1.00 0.00 H new ATOM 0 HG13 ILE A 65 0.969 -11.007 4.691 1.00 0.00 H new ATOM 0 HG21 ILE A 65 -0.546 -9.595 7.808 1.00 0.00 H new ATOM 0 HG22 ILE A 65 -1.034 -11.178 8.457 1.00 0.00 H new ATOM 0 HG23 ILE A 65 0.689 -10.741 8.381 1.00 0.00 H new ATOM 0 HD11 ILE A 65 1.199 -8.573 4.749 1.00 0.00 H new ATOM 0 HD12 ILE A 65 -0.517 -9.040 4.819 1.00 0.00 H new ATOM 0 HD13 ILE A 65 0.324 -8.514 6.297 1.00 0.00 H new ATOM 1039 N GLU A 66 -0.576 -14.365 8.192 1.00 0.00 N ATOM 1040 CA GLU A 66 -1.562 -15.159 8.913 1.00 0.00 C ATOM 1041 C GLU A 66 -2.348 -14.292 9.893 1.00 0.00 C ATOM 1042 O GLU A 66 -3.381 -14.710 10.418 1.00 0.00 O ATOM 1043 CB GLU A 66 -0.878 -16.304 9.664 1.00 0.00 C ATOM 1044 CG GLU A 66 0.005 -17.169 8.781 1.00 0.00 C ATOM 1045 CD GLU A 66 0.280 -18.531 9.388 1.00 0.00 C ATOM 1046 OE1 GLU A 66 -0.646 -19.111 9.992 1.00 0.00 O ATOM 1047 OE2 GLU A 66 1.424 -19.017 9.258 1.00 0.00 O ATOM 0 H GLU A 66 0.389 -14.528 8.479 1.00 0.00 H new ATOM 0 HA GLU A 66 -2.257 -15.576 8.184 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -0.275 -15.889 10.471 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -1.641 -16.931 10.126 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -0.473 -17.298 7.810 1.00 0.00 H new ATOM 0 HG3 GLU A 66 0.951 -16.656 8.605 1.00 0.00 H new ATOM 1054 N ASP A 67 -1.852 -13.084 10.133 1.00 0.00 N ATOM 1055 CA ASP A 67 -2.507 -12.157 11.049 1.00 0.00 C ATOM 1056 C ASP A 67 -3.477 -11.248 10.300 1.00 0.00 C ATOM 1057 O ASP A 67 -3.622 -10.071 10.632 1.00 0.00 O ATOM 1058 CB ASP A 67 -1.466 -11.315 11.788 1.00 0.00 C ATOM 1059 CG ASP A 67 -0.784 -12.084 12.902 1.00 0.00 C ATOM 1060 OD1 ASP A 67 -1.498 -12.639 13.763 1.00 0.00 O ATOM 1061 OD2 ASP A 67 0.464 -12.132 12.911 1.00 0.00 O ATOM 0 H ASP A 67 -0.999 -12.723 9.706 1.00 0.00 H new ATOM 0 HA ASP A 67 -3.072 -12.741 11.776 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -0.715 -10.966 11.079 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -1.948 -10.430 12.204 1.00 0.00 H new ATOM 1066 N ILE A 68 -4.137 -11.801 9.288 1.00 0.00 N ATOM 1067 CA ILE A 68 -5.092 -11.039 8.492 1.00 0.00 C ATOM 1068 C ILE A 68 -6.509 -11.569 8.680 1.00 0.00 C ATOM 1069 O ILE A 68 -6.747 -12.774 8.613 1.00 0.00 O ATOM 1070 CB ILE A 68 -4.735 -11.079 6.995 1.00 0.00 C ATOM 1071 CG1 ILE A 68 -3.365 -10.441 6.757 1.00 0.00 C ATOM 1072 CG2 ILE A 68 -5.805 -10.371 6.177 1.00 0.00 C ATOM 1073 CD1 ILE A 68 -3.334 -8.955 7.037 1.00 0.00 C ATOM 0 H ILE A 68 -4.028 -12.773 9.000 1.00 0.00 H new ATOM 0 HA ILE A 68 -5.043 -10.008 8.841 1.00 0.00 H new ATOM 0 HB ILE A 68 -4.690 -12.120 6.675 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -2.628 -10.937 7.388 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -3.067 -10.614 5.723 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -5.539 -10.407 5.121 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -6.764 -10.866 6.327 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -5.879 -9.332 6.497 1.00 0.00 H new ATOM 0 HD11 ILE A 68 -2.332 -8.570 6.847 1.00 0.00 H new ATOM 0 HD12 ILE A 68 -4.047 -8.447 6.387 1.00 0.00 H new ATOM 0 HD13 ILE A 68 -3.600 -8.775 8.079 1.00 0.00 H new ATOM 1085 N ASN A 69 -7.449 -10.658 8.915 1.00 0.00 N ATOM 1086 CA ASN A 69 -8.845 -11.034 9.111 1.00 0.00 C ATOM 1087 C ASN A 69 -9.423 -11.661 7.846 1.00 0.00 C ATOM 1088 O ASN A 69 -9.985 -12.754 7.884 1.00 0.00 O ATOM 1089 CB ASN A 69 -9.672 -9.810 9.511 1.00 0.00 C ATOM 1090 CG ASN A 69 -10.987 -10.190 10.164 1.00 0.00 C ATOM 1091 OD1 ASN A 69 -11.032 -11.054 11.040 1.00 0.00 O ATOM 1092 ND2 ASN A 69 -12.066 -9.543 9.739 1.00 0.00 N ATOM 0 H ASN A 69 -7.270 -9.656 8.974 1.00 0.00 H new ATOM 0 HA ASN A 69 -8.888 -11.772 9.912 1.00 0.00 H new ATOM 0 HB2 ASN A 69 -9.093 -9.192 10.198 1.00 0.00 H new ATOM 0 HB3 ASN A 69 -9.870 -9.204 8.627 1.00 0.00 H new ATOM 0 HD21 ASN A 69 -12.979 -9.755 10.141 1.00 0.00 H new ATOM 0 HD22 ASN A 69 -11.982 -8.834 9.010 1.00 0.00 H new ATOM 1099 N GLY A 70 -9.278 -10.960 6.726 1.00 0.00 N ATOM 1100 CA GLY A 70 -9.790 -11.464 5.465 1.00 0.00 C ATOM 1101 C GLY A 70 -11.186 -10.955 5.161 1.00 0.00 C ATOM 1102 O GLY A 70 -11.449 -10.465 4.062 1.00 0.00 O ATOM 0 H GLY A 70 -8.815 -10.053 6.669 1.00 0.00 H new ATOM 0 HA2 GLY A 70 -9.116 -11.171 4.660 1.00 0.00 H new ATOM 0 HA3 GLY A 70 -9.801 -12.554 5.490 1.00 0.00 H new ATOM 1106 N CYS A 71 -12.081 -11.072 6.135 1.00 0.00 N ATOM 1107 CA CYS A 71 -13.458 -10.623 5.965 1.00 0.00 C ATOM 1108 C CYS A 71 -13.921 -9.819 7.176 1.00 0.00 C ATOM 1109 O CYS A 71 -14.571 -10.337 8.084 1.00 0.00 O ATOM 1110 CB CYS A 71 -14.385 -11.820 5.748 1.00 0.00 C ATOM 1111 SG CYS A 71 -14.323 -12.508 4.077 1.00 0.00 S ATOM 0 H CYS A 71 -11.878 -11.474 7.050 1.00 0.00 H new ATOM 0 HA CYS A 71 -13.498 -9.979 5.087 1.00 0.00 H new ATOM 0 HB2 CYS A 71 -14.124 -12.602 6.461 1.00 0.00 H new ATOM 0 HB3 CYS A 71 -15.409 -11.517 5.967 1.00 0.00 H new ATOM 0 HG CYS A 71 -15.139 -13.517 3.992 1.00 0.00 H new ATOM 1117 N PRO A 72 -13.577 -8.523 7.193 1.00 0.00 N ATOM 1118 CA PRO A 72 -13.946 -7.620 8.287 1.00 0.00 C ATOM 1119 C PRO A 72 -15.441 -7.324 8.316 1.00 0.00 C ATOM 1120 O PRO A 72 -16.065 -7.118 7.275 1.00 0.00 O ATOM 1121 CB PRO A 72 -13.155 -6.346 7.978 1.00 0.00 C ATOM 1122 CG PRO A 72 -12.936 -6.385 6.505 1.00 0.00 C ATOM 1123 CD PRO A 72 -12.802 -7.838 6.144 1.00 0.00 C ATOM 0 HA PRO A 72 -13.723 -8.051 9.263 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -13.709 -5.455 8.273 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -12.209 -6.326 8.519 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -13.770 -5.927 5.974 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -12.039 -5.830 6.229 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -13.201 -8.044 5.151 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -11.760 -8.157 6.141 1.00 0.00 H new ATOM 1131 N LYS A 73 -16.013 -7.305 9.516 1.00 0.00 N ATOM 1132 CA LYS A 73 -17.435 -7.033 9.682 1.00 0.00 C ATOM 1133 C LYS A 73 -17.655 -5.736 10.453 1.00 0.00 C ATOM 1134 O LYS A 73 -18.458 -4.894 10.054 1.00 0.00 O ATOM 1135 CB LYS A 73 -18.116 -8.194 10.411 1.00 0.00 C ATOM 1136 CG LYS A 73 -18.139 -9.485 9.611 1.00 0.00 C ATOM 1137 CD LYS A 73 -19.263 -10.402 10.063 1.00 0.00 C ATOM 1138 CE LYS A 73 -19.067 -11.819 9.548 1.00 0.00 C ATOM 1139 NZ LYS A 73 -20.219 -12.698 9.892 1.00 0.00 N ATOM 0 H LYS A 73 -15.512 -7.475 10.388 1.00 0.00 H new ATOM 0 HA LYS A 73 -17.876 -6.925 8.691 1.00 0.00 H new ATOM 0 HB2 LYS A 73 -17.601 -8.371 11.355 1.00 0.00 H new ATOM 0 HB3 LYS A 73 -19.140 -7.909 10.654 1.00 0.00 H new ATOM 0 HG2 LYS A 73 -18.259 -9.256 8.552 1.00 0.00 H new ATOM 0 HG3 LYS A 73 -17.184 -9.998 9.720 1.00 0.00 H new ATOM 0 HD2 LYS A 73 -19.310 -10.413 11.152 1.00 0.00 H new ATOM 0 HD3 LYS A 73 -20.217 -10.013 9.707 1.00 0.00 H new ATOM 0 HE2 LYS A 73 -18.937 -11.798 8.466 1.00 0.00 H new ATOM 0 HE3 LYS A 73 -18.153 -12.236 9.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 -20.047 -13.655 9.524 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 -20.328 -12.739 10.925 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 -21.087 -12.314 9.467 1.00 0.00 H new ATOM 1153 N ASN A 74 -16.935 -5.581 11.559 1.00 0.00 N ATOM 1154 CA ASN A 74 -17.051 -4.386 12.386 1.00 0.00 C ATOM 1155 C ASN A 74 -15.894 -3.427 12.121 1.00 0.00 C ATOM 1156 O ASN A 74 -14.750 -3.849 11.956 1.00 0.00 O ATOM 1157 CB ASN A 74 -17.084 -4.766 13.868 1.00 0.00 C ATOM 1158 CG ASN A 74 -17.670 -3.668 14.734 1.00 0.00 C ATOM 1159 OD1 ASN A 74 -17.595 -2.487 14.393 1.00 0.00 O ATOM 1160 ND2 ASN A 74 -18.257 -4.053 15.861 1.00 0.00 N ATOM 0 H ASN A 74 -16.265 -6.268 11.903 1.00 0.00 H new ATOM 0 HA ASN A 74 -17.983 -3.884 12.126 1.00 0.00 H new ATOM 0 HB2 ASN A 74 -17.671 -5.676 13.994 1.00 0.00 H new ATOM 0 HB3 ASN A 74 -16.072 -4.990 14.205 1.00 0.00 H new ATOM 0 HD21 ASN A 74 -18.669 -3.359 16.484 1.00 0.00 H new ATOM 0 HD22 ASN A 74 -18.296 -5.043 16.103 1.00 0.00 H new ATOM 1167 N ARG A 75 -16.201 -2.134 12.083 1.00 0.00 N ATOM 1168 CA ARG A 75 -15.188 -1.115 11.837 1.00 0.00 C ATOM 1169 C ARG A 75 -13.860 -1.502 12.483 1.00 0.00 C ATOM 1170 O ARG A 75 -12.804 -1.412 11.857 1.00 0.00 O ATOM 1171 CB ARG A 75 -15.654 0.238 12.376 1.00 0.00 C ATOM 1172 CG ARG A 75 -16.374 1.090 11.344 1.00 0.00 C ATOM 1173 CD ARG A 75 -15.396 1.747 10.383 1.00 0.00 C ATOM 1174 NE ARG A 75 -15.912 3.005 9.851 1.00 0.00 N ATOM 1175 CZ ARG A 75 -16.901 3.079 8.968 1.00 0.00 C ATOM 1176 NH1 ARG A 75 -17.478 1.972 8.520 1.00 0.00 N ATOM 1177 NH2 ARG A 75 -17.316 4.261 8.531 1.00 0.00 N ATOM 0 H ARG A 75 -17.143 -1.768 12.219 1.00 0.00 H new ATOM 0 HA ARG A 75 -15.040 -1.038 10.760 1.00 0.00 H new ATOM 0 HB2 ARG A 75 -16.318 0.072 13.225 1.00 0.00 H new ATOM 0 HB3 ARG A 75 -14.790 0.788 12.750 1.00 0.00 H new ATOM 0 HG2 ARG A 75 -17.075 0.471 10.784 1.00 0.00 H new ATOM 0 HG3 ARG A 75 -16.960 1.858 11.849 1.00 0.00 H new ATOM 0 HD2 ARG A 75 -14.452 1.931 10.896 1.00 0.00 H new ATOM 0 HD3 ARG A 75 -15.184 1.065 9.559 1.00 0.00 H new ATOM 0 HE ARG A 75 -15.490 3.875 10.175 1.00 0.00 H new ATOM 0 HH11 ARG A 75 -17.162 1.061 8.854 1.00 0.00 H new ATOM 0 HH12 ARG A 75 -18.238 2.031 7.842 1.00 0.00 H new ATOM 0 HH21 ARG A 75 -16.875 5.115 8.873 1.00 0.00 H new ATOM 0 HH22 ARG A 75 -18.076 4.316 7.853 1.00 0.00 H new ATOM 1191 N SER A 76 -13.922 -1.933 13.739 1.00 0.00 N ATOM 1192 CA SER A 76 -12.725 -2.329 14.471 1.00 0.00 C ATOM 1193 C SER A 76 -12.024 -3.493 13.777 1.00 0.00 C ATOM 1194 O SER A 76 -10.812 -3.464 13.565 1.00 0.00 O ATOM 1195 CB SER A 76 -13.085 -2.719 15.906 1.00 0.00 C ATOM 1196 OG SER A 76 -13.512 -4.068 15.976 1.00 0.00 O ATOM 0 H SER A 76 -14.788 -2.017 14.271 1.00 0.00 H new ATOM 0 HA SER A 76 -12.044 -1.478 14.493 1.00 0.00 H new ATOM 0 HB2 SER A 76 -12.220 -2.574 16.553 1.00 0.00 H new ATOM 0 HB3 SER A 76 -13.874 -2.065 16.277 1.00 0.00 H new ATOM 0 HG SER A 76 -13.734 -4.293 16.904 1.00 0.00 H new ATOM 1202 N GLN A 77 -12.797 -4.516 13.425 1.00 0.00 N ATOM 1203 CA GLN A 77 -12.250 -5.690 12.755 1.00 0.00 C ATOM 1204 C GLN A 77 -11.265 -5.285 11.664 1.00 0.00 C ATOM 1205 O GLN A 77 -10.401 -6.069 11.272 1.00 0.00 O ATOM 1206 CB GLN A 77 -13.378 -6.532 12.154 1.00 0.00 C ATOM 1207 CG GLN A 77 -14.226 -7.245 13.195 1.00 0.00 C ATOM 1208 CD GLN A 77 -13.485 -8.381 13.872 1.00 0.00 C ATOM 1209 OE1 GLN A 77 -12.728 -8.166 14.819 1.00 0.00 O ATOM 1210 NE2 GLN A 77 -13.701 -9.599 13.390 1.00 0.00 N ATOM 0 H GLN A 77 -13.802 -4.555 13.592 1.00 0.00 H new ATOM 0 HA GLN A 77 -11.717 -6.285 13.497 1.00 0.00 H new ATOM 0 HB2 GLN A 77 -14.020 -5.888 11.553 1.00 0.00 H new ATOM 0 HB3 GLN A 77 -12.948 -7.272 11.479 1.00 0.00 H new ATOM 0 HG2 GLN A 77 -14.549 -6.527 13.949 1.00 0.00 H new ATOM 0 HG3 GLN A 77 -15.126 -7.635 12.720 1.00 0.00 H new ATOM 0 HE21 GLN A 77 -14.337 -9.731 12.603 1.00 0.00 H new ATOM 0 HE22 GLN A 77 -13.231 -10.403 13.806 1.00 0.00 H new ATOM 1219 N MET A 78 -11.401 -4.056 11.176 1.00 0.00 N ATOM 1220 CA MET A 78 -10.522 -3.547 10.130 1.00 0.00 C ATOM 1221 C MET A 78 -9.189 -3.091 10.715 1.00 0.00 C ATOM 1222 O MET A 78 -8.136 -3.286 10.108 1.00 0.00 O ATOM 1223 CB MET A 78 -11.192 -2.388 9.391 1.00 0.00 C ATOM 1224 CG MET A 78 -12.473 -2.783 8.674 1.00 0.00 C ATOM 1225 SD MET A 78 -13.649 -1.421 8.552 1.00 0.00 S ATOM 1226 CE MET A 78 -15.203 -2.310 8.603 1.00 0.00 C ATOM 0 H MET A 78 -12.112 -3.394 11.488 1.00 0.00 H new ATOM 0 HA MET A 78 -10.331 -4.356 9.424 1.00 0.00 H new ATOM 0 HB2 MET A 78 -11.414 -1.594 10.104 1.00 0.00 H new ATOM 0 HB3 MET A 78 -10.491 -1.977 8.665 1.00 0.00 H new ATOM 0 HG2 MET A 78 -12.230 -3.139 7.673 1.00 0.00 H new ATOM 0 HG3 MET A 78 -12.939 -3.614 9.203 1.00 0.00 H new ATOM 0 HE1 MET A 78 -16.015 -1.612 8.805 1.00 0.00 H new ATOM 0 HE2 MET A 78 -15.374 -2.799 7.644 1.00 0.00 H new ATOM 0 HE3 MET A 78 -15.167 -3.062 9.392 1.00 0.00 H new ATOM 1236 N ILE A 79 -9.243 -2.483 11.895 1.00 0.00 N ATOM 1237 CA ILE A 79 -8.040 -1.999 12.560 1.00 0.00 C ATOM 1238 C ILE A 79 -6.966 -3.080 12.607 1.00 0.00 C ATOM 1239 O ILE A 79 -5.818 -2.844 12.232 1.00 0.00 O ATOM 1240 CB ILE A 79 -8.341 -1.529 13.996 1.00 0.00 C ATOM 1241 CG1 ILE A 79 -9.354 -0.382 13.978 1.00 0.00 C ATOM 1242 CG2 ILE A 79 -7.058 -1.099 14.692 1.00 0.00 C ATOM 1243 CD1 ILE A 79 -8.718 0.984 13.847 1.00 0.00 C ATOM 0 H ILE A 79 -10.107 -2.314 12.410 1.00 0.00 H new ATOM 0 HA ILE A 79 -7.676 -1.153 11.978 1.00 0.00 H new ATOM 0 HB ILE A 79 -8.772 -2.361 14.553 1.00 0.00 H new ATOM 0 HG12 ILE A 79 -10.046 -0.532 13.150 1.00 0.00 H new ATOM 0 HG13 ILE A 79 -9.943 -0.413 14.895 1.00 0.00 H new ATOM 0 HG21 ILE A 79 -7.287 -0.770 15.706 1.00 0.00 H new ATOM 0 HG22 ILE A 79 -6.366 -1.940 14.731 1.00 0.00 H new ATOM 0 HG23 ILE A 79 -6.601 -0.279 14.138 1.00 0.00 H new ATOM 0 HD11 ILE A 79 -9.495 1.748 13.841 1.00 0.00 H new ATOM 0 HD12 ILE A 79 -8.047 1.155 14.689 1.00 0.00 H new ATOM 0 HD13 ILE A 79 -8.153 1.034 12.916 1.00 0.00 H new ATOM 1255 N GLU A 80 -7.347 -4.268 13.067 1.00 0.00 N ATOM 1256 CA GLU A 80 -6.416 -5.386 13.161 1.00 0.00 C ATOM 1257 C GLU A 80 -5.745 -5.649 11.816 1.00 0.00 C ATOM 1258 O GLU A 80 -4.519 -5.697 11.720 1.00 0.00 O ATOM 1259 CB GLU A 80 -7.143 -6.646 13.635 1.00 0.00 C ATOM 1260 CG GLU A 80 -7.328 -6.710 15.142 1.00 0.00 C ATOM 1261 CD GLU A 80 -7.639 -8.111 15.632 1.00 0.00 C ATOM 1262 OE1 GLU A 80 -6.822 -9.022 15.385 1.00 0.00 O ATOM 1263 OE2 GLU A 80 -8.701 -8.296 16.264 1.00 0.00 O ATOM 0 H GLU A 80 -8.294 -4.481 13.380 1.00 0.00 H new ATOM 0 HA GLU A 80 -5.646 -5.124 13.887 1.00 0.00 H new ATOM 0 HB2 GLU A 80 -8.120 -6.694 13.155 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -6.584 -7.523 13.308 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -6.423 -6.351 15.631 1.00 0.00 H new ATOM 0 HG3 GLU A 80 -8.136 -6.039 15.434 1.00 0.00 H new ATOM 1270 N ASN A 81 -6.558 -5.819 10.778 1.00 0.00 N ATOM 1271 CA ASN A 81 -6.044 -6.079 9.438 1.00 0.00 C ATOM 1272 C ASN A 81 -4.816 -5.221 9.151 1.00 0.00 C ATOM 1273 O ASN A 81 -3.701 -5.732 9.044 1.00 0.00 O ATOM 1274 CB ASN A 81 -7.127 -5.806 8.393 1.00 0.00 C ATOM 1275 CG ASN A 81 -8.320 -6.730 8.540 1.00 0.00 C ATOM 1276 OD1 ASN A 81 -8.703 -7.095 9.652 1.00 0.00 O ATOM 1277 ND2 ASN A 81 -8.914 -7.114 7.416 1.00 0.00 N ATOM 0 H ASN A 81 -7.575 -5.781 10.839 1.00 0.00 H new ATOM 0 HA ASN A 81 -5.753 -7.128 9.384 1.00 0.00 H new ATOM 0 HB2 ASN A 81 -7.459 -4.772 8.480 1.00 0.00 H new ATOM 0 HB3 ASN A 81 -6.703 -5.921 7.396 1.00 0.00 H new ATOM 0 HD21 ASN A 81 -9.722 -7.736 7.453 1.00 0.00 H new ATOM 0 HD22 ASN A 81 -8.563 -6.787 6.516 1.00 0.00 H new ATOM 1284 N ILE A 82 -5.029 -3.915 9.029 1.00 0.00 N ATOM 1285 CA ILE A 82 -3.939 -2.986 8.757 1.00 0.00 C ATOM 1286 C ILE A 82 -2.814 -3.145 9.773 1.00 0.00 C ATOM 1287 O ILE A 82 -1.635 -3.091 9.423 1.00 0.00 O ATOM 1288 CB ILE A 82 -4.428 -1.525 8.772 1.00 0.00 C ATOM 1289 CG1 ILE A 82 -5.532 -1.323 7.733 1.00 0.00 C ATOM 1290 CG2 ILE A 82 -3.267 -0.576 8.512 1.00 0.00 C ATOM 1291 CD1 ILE A 82 -6.486 -0.200 8.076 1.00 0.00 C ATOM 0 H ILE A 82 -5.946 -3.476 9.114 1.00 0.00 H new ATOM 0 HA ILE A 82 -3.562 -3.224 7.762 1.00 0.00 H new ATOM 0 HB ILE A 82 -4.839 -1.304 9.757 1.00 0.00 H new ATOM 0 HG12 ILE A 82 -5.075 -1.118 6.765 1.00 0.00 H new ATOM 0 HG13 ILE A 82 -6.096 -2.250 7.630 1.00 0.00 H new ATOM 0 HG21 ILE A 82 -3.628 0.452 8.526 1.00 0.00 H new ATOM 0 HG22 ILE A 82 -2.511 -0.706 9.286 1.00 0.00 H new ATOM 0 HG23 ILE A 82 -2.830 -0.794 7.538 1.00 0.00 H new ATOM 0 HD11 ILE A 82 -7.242 -0.114 7.296 1.00 0.00 H new ATOM 0 HD12 ILE A 82 -6.970 -0.412 9.029 1.00 0.00 H new ATOM 0 HD13 ILE A 82 -5.934 0.737 8.151 1.00 0.00 H new ATOM 1303 N ASP A 83 -3.186 -3.343 11.033 1.00 0.00 N ATOM 1304 CA ASP A 83 -2.208 -3.513 12.102 1.00 0.00 C ATOM 1305 C ASP A 83 -1.234 -4.640 11.772 1.00 0.00 C ATOM 1306 O ASP A 83 -0.019 -4.459 11.827 1.00 0.00 O ATOM 1307 CB ASP A 83 -2.914 -3.803 13.427 1.00 0.00 C ATOM 1308 CG ASP A 83 -2.131 -3.298 14.623 1.00 0.00 C ATOM 1309 OD1 ASP A 83 -1.667 -2.140 14.582 1.00 0.00 O ATOM 1310 OD2 ASP A 83 -1.981 -4.062 15.600 1.00 0.00 O ATOM 0 H ASP A 83 -4.158 -3.390 11.339 1.00 0.00 H new ATOM 0 HA ASP A 83 -1.644 -2.585 12.196 1.00 0.00 H new ATOM 0 HB2 ASP A 83 -3.900 -3.338 13.419 1.00 0.00 H new ATOM 0 HB3 ASP A 83 -3.069 -4.877 13.525 1.00 0.00 H new ATOM 1315 N ALA A 84 -1.778 -5.804 11.432 1.00 0.00 N ATOM 1316 CA ALA A 84 -0.958 -6.960 11.094 1.00 0.00 C ATOM 1317 C ALA A 84 0.039 -6.622 9.990 1.00 0.00 C ATOM 1318 O ALA A 84 1.214 -6.983 10.070 1.00 0.00 O ATOM 1319 CB ALA A 84 -1.838 -8.127 10.672 1.00 0.00 C ATOM 0 H ALA A 84 -2.783 -5.971 11.383 1.00 0.00 H new ATOM 0 HA ALA A 84 -0.395 -7.246 11.982 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -1.212 -8.983 10.422 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.507 -8.393 11.491 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.427 -7.842 9.800 1.00 0.00 H new ATOM 1325 N CYS A 85 -0.436 -5.929 8.962 1.00 0.00 N ATOM 1326 CA CYS A 85 0.414 -5.543 7.841 1.00 0.00 C ATOM 1327 C CYS A 85 1.582 -4.684 8.315 1.00 0.00 C ATOM 1328 O CYS A 85 2.706 -4.825 7.831 1.00 0.00 O ATOM 1329 CB CYS A 85 -0.402 -4.783 6.794 1.00 0.00 C ATOM 1330 SG CYS A 85 -1.739 -5.750 6.055 1.00 0.00 S ATOM 0 H CYS A 85 -1.405 -5.622 8.881 1.00 0.00 H new ATOM 0 HA CYS A 85 0.814 -6.451 7.390 1.00 0.00 H new ATOM 0 HB2 CYS A 85 -0.826 -3.891 7.256 1.00 0.00 H new ATOM 0 HB3 CYS A 85 0.267 -4.445 6.003 1.00 0.00 H new ATOM 0 HG CYS A 85 -2.686 -5.919 6.929 1.00 0.00 H new ATOM 1336 N LEU A 86 1.309 -3.794 9.262 1.00 0.00 N ATOM 1337 CA LEU A 86 2.337 -2.910 9.801 1.00 0.00 C ATOM 1338 C LEU A 86 3.412 -3.708 10.532 1.00 0.00 C ATOM 1339 O LEU A 86 4.597 -3.603 10.219 1.00 0.00 O ATOM 1340 CB LEU A 86 1.711 -1.886 10.750 1.00 0.00 C ATOM 1341 CG LEU A 86 0.675 -0.945 10.134 1.00 0.00 C ATOM 1342 CD1 LEU A 86 0.008 -0.106 11.213 1.00 0.00 C ATOM 1343 CD2 LEU A 86 1.323 -0.052 9.086 1.00 0.00 C ATOM 0 H LEU A 86 0.384 -3.665 9.673 1.00 0.00 H new ATOM 0 HA LEU A 86 2.804 -2.385 8.968 1.00 0.00 H new ATOM 0 HB2 LEU A 86 1.240 -2.424 11.573 1.00 0.00 H new ATOM 0 HB3 LEU A 86 2.511 -1.282 11.180 1.00 0.00 H new ATOM 0 HG LEU A 86 -0.091 -1.548 9.646 1.00 0.00 H new ATOM 0 HD11 LEU A 86 -0.726 0.558 10.756 1.00 0.00 H new ATOM 0 HD12 LEU A 86 -0.490 -0.761 11.927 1.00 0.00 H new ATOM 0 HD13 LEU A 86 0.762 0.488 11.730 1.00 0.00 H new ATOM 0 HD21 LEU A 86 0.571 0.611 8.658 1.00 0.00 H new ATOM 0 HD22 LEU A 86 2.109 0.543 9.551 1.00 0.00 H new ATOM 0 HD23 LEU A 86 1.753 -0.670 8.298 1.00 0.00 H new ATOM 1355 N ASN A 87 2.989 -4.507 11.506 1.00 0.00 N ATOM 1356 CA ASN A 87 3.915 -5.324 12.281 1.00 0.00 C ATOM 1357 C ASN A 87 4.678 -6.288 11.377 1.00 0.00 C ATOM 1358 O ASN A 87 5.827 -6.635 11.650 1.00 0.00 O ATOM 1359 CB ASN A 87 3.160 -6.106 13.358 1.00 0.00 C ATOM 1360 CG ASN A 87 2.581 -5.203 14.429 1.00 0.00 C ATOM 1361 OD1 ASN A 87 3.302 -4.703 15.292 1.00 0.00 O ATOM 1362 ND2 ASN A 87 1.271 -4.990 14.378 1.00 0.00 N ATOM 0 H ASN A 87 2.011 -4.606 11.777 1.00 0.00 H new ATOM 0 HA ASN A 87 4.633 -4.659 12.761 1.00 0.00 H new ATOM 0 HB2 ASN A 87 2.355 -6.675 12.893 1.00 0.00 H new ATOM 0 HB3 ASN A 87 3.835 -6.827 13.820 1.00 0.00 H new ATOM 0 HD21 ASN A 87 0.824 -4.391 15.072 1.00 0.00 H new ATOM 0 HD22 ASN A 87 0.712 -5.425 13.644 1.00 0.00 H new ATOM 1369 N PHE A 88 4.030 -6.715 10.298 1.00 0.00 N ATOM 1370 CA PHE A 88 4.646 -7.639 9.353 1.00 0.00 C ATOM 1371 C PHE A 88 5.732 -6.942 8.540 1.00 0.00 C ATOM 1372 O PHE A 88 6.795 -7.510 8.284 1.00 0.00 O ATOM 1373 CB PHE A 88 3.588 -8.224 8.416 1.00 0.00 C ATOM 1374 CG PHE A 88 4.161 -8.822 7.163 1.00 0.00 C ATOM 1375 CD1 PHE A 88 4.755 -8.017 6.204 1.00 0.00 C ATOM 1376 CD2 PHE A 88 4.107 -10.189 6.944 1.00 0.00 C ATOM 1377 CE1 PHE A 88 5.284 -8.564 5.050 1.00 0.00 C ATOM 1378 CE2 PHE A 88 4.634 -10.742 5.792 1.00 0.00 C ATOM 1379 CZ PHE A 88 5.223 -9.929 4.844 1.00 0.00 C ATOM 0 H PHE A 88 3.079 -6.436 10.057 1.00 0.00 H new ATOM 0 HA PHE A 88 5.105 -8.448 9.921 1.00 0.00 H new ATOM 0 HB2 PHE A 88 3.025 -8.990 8.950 1.00 0.00 H new ATOM 0 HB3 PHE A 88 2.881 -7.440 8.144 1.00 0.00 H new ATOM 0 HD1 PHE A 88 4.805 -6.950 6.360 1.00 0.00 H new ATOM 0 HD2 PHE A 88 3.648 -10.830 7.682 1.00 0.00 H new ATOM 0 HE1 PHE A 88 5.744 -7.925 4.311 1.00 0.00 H new ATOM 0 HE2 PHE A 88 4.585 -11.809 5.634 1.00 0.00 H new ATOM 0 HZ PHE A 88 5.635 -10.359 3.943 1.00 0.00 H new ATOM 1389 N LEU A 89 5.458 -5.706 8.135 1.00 0.00 N ATOM 1390 CA LEU A 89 6.411 -4.929 7.350 1.00 0.00 C ATOM 1391 C LEU A 89 7.631 -4.557 8.187 1.00 0.00 C ATOM 1392 O LEU A 89 8.762 -4.594 7.703 1.00 0.00 O ATOM 1393 CB LEU A 89 5.744 -3.663 6.809 1.00 0.00 C ATOM 1394 CG LEU A 89 4.760 -3.863 5.657 1.00 0.00 C ATOM 1395 CD1 LEU A 89 4.129 -2.538 5.257 1.00 0.00 C ATOM 1396 CD2 LEU A 89 5.456 -4.505 4.466 1.00 0.00 C ATOM 0 H LEU A 89 4.584 -5.221 8.337 1.00 0.00 H new ATOM 0 HA LEU A 89 6.742 -5.544 6.513 1.00 0.00 H new ATOM 0 HB2 LEU A 89 5.218 -3.175 7.629 1.00 0.00 H new ATOM 0 HB3 LEU A 89 6.525 -2.978 6.479 1.00 0.00 H new ATOM 0 HG LEU A 89 3.968 -4.532 5.994 1.00 0.00 H new ATOM 0 HD11 LEU A 89 3.431 -2.701 4.435 1.00 0.00 H new ATOM 0 HD12 LEU A 89 3.595 -2.118 6.109 1.00 0.00 H new ATOM 0 HD13 LEU A 89 4.908 -1.845 4.940 1.00 0.00 H new ATOM 0 HD21 LEU A 89 4.740 -4.640 3.655 1.00 0.00 H new ATOM 0 HD22 LEU A 89 6.269 -3.861 4.129 1.00 0.00 H new ATOM 0 HD23 LEU A 89 5.859 -5.474 4.759 1.00 0.00 H new ATOM 1408 N ALA A 90 7.393 -4.201 9.445 1.00 0.00 N ATOM 1409 CA ALA A 90 8.472 -3.826 10.350 1.00 0.00 C ATOM 1410 C ALA A 90 9.531 -4.921 10.424 1.00 0.00 C ATOM 1411 O ALA A 90 10.726 -4.638 10.505 1.00 0.00 O ATOM 1412 CB ALA A 90 7.920 -3.529 11.736 1.00 0.00 C ATOM 0 H ALA A 90 6.462 -4.164 9.860 1.00 0.00 H new ATOM 0 HA ALA A 90 8.944 -2.925 9.959 1.00 0.00 H new ATOM 0 HB1 ALA A 90 8.737 -3.250 12.401 1.00 0.00 H new ATOM 0 HB2 ALA A 90 7.206 -2.708 11.675 1.00 0.00 H new ATOM 0 HB3 ALA A 90 7.421 -4.416 12.126 1.00 0.00 H new ATOM 1418 N ALA A 91 9.085 -6.172 10.397 1.00 0.00 N ATOM 1419 CA ALA A 91 9.994 -7.310 10.460 1.00 0.00 C ATOM 1420 C ALA A 91 10.885 -7.369 9.224 1.00 0.00 C ATOM 1421 O ALA A 91 11.940 -8.004 9.236 1.00 0.00 O ATOM 1422 CB ALA A 91 9.210 -8.605 10.611 1.00 0.00 C ATOM 0 H ALA A 91 8.099 -6.424 10.332 1.00 0.00 H new ATOM 0 HA ALA A 91 10.635 -7.184 11.332 1.00 0.00 H new ATOM 0 HB1 ALA A 91 9.902 -9.446 10.657 1.00 0.00 H new ATOM 0 HB2 ALA A 91 8.621 -8.569 11.528 1.00 0.00 H new ATOM 0 HB3 ALA A 91 8.544 -8.729 9.757 1.00 0.00 H new ATOM 1428 N LYS A 92 10.454 -6.704 8.157 1.00 0.00 N ATOM 1429 CA LYS A 92 11.212 -6.681 6.912 1.00 0.00 C ATOM 1430 C LYS A 92 12.186 -5.507 6.890 1.00 0.00 C ATOM 1431 O LYS A 92 13.127 -5.482 6.098 1.00 0.00 O ATOM 1432 CB LYS A 92 10.263 -6.592 5.715 1.00 0.00 C ATOM 1433 CG LYS A 92 9.293 -7.757 5.621 1.00 0.00 C ATOM 1434 CD LYS A 92 9.954 -8.987 5.024 1.00 0.00 C ATOM 1435 CE LYS A 92 8.947 -10.102 4.786 1.00 0.00 C ATOM 1436 NZ LYS A 92 9.358 -10.992 3.666 1.00 0.00 N ATOM 0 H LYS A 92 9.583 -6.174 8.130 1.00 0.00 H new ATOM 0 HA LYS A 92 11.784 -7.607 6.847 1.00 0.00 H new ATOM 0 HB2 LYS A 92 9.697 -5.663 5.779 1.00 0.00 H new ATOM 0 HB3 LYS A 92 10.851 -6.545 4.798 1.00 0.00 H new ATOM 0 HG2 LYS A 92 8.911 -7.994 6.614 1.00 0.00 H new ATOM 0 HG3 LYS A 92 8.437 -7.470 5.010 1.00 0.00 H new ATOM 0 HD2 LYS A 92 10.434 -8.722 4.082 1.00 0.00 H new ATOM 0 HD3 LYS A 92 10.738 -9.341 5.693 1.00 0.00 H new ATOM 0 HE2 LYS A 92 8.836 -10.691 5.696 1.00 0.00 H new ATOM 0 HE3 LYS A 92 7.971 -9.669 4.566 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 8.645 -11.738 3.536 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 9.439 -10.435 2.792 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 10.277 -11.426 3.887 1.00 0.00 H new ATOM 1450 N GLY A 93 11.954 -4.534 7.767 1.00 0.00 N ATOM 1451 CA GLY A 93 12.820 -3.372 7.832 1.00 0.00 C ATOM 1452 C GLY A 93 12.128 -2.106 7.365 1.00 0.00 C ATOM 1453 O GLY A 93 12.743 -1.257 6.719 1.00 0.00 O ATOM 0 H GLY A 93 11.182 -4.531 8.433 1.00 0.00 H new ATOM 0 HA2 GLY A 93 13.165 -3.237 8.857 1.00 0.00 H new ATOM 0 HA3 GLY A 93 13.704 -3.547 7.219 1.00 0.00 H new ATOM 1457 N ILE A 94 10.845 -1.981 7.690 1.00 0.00 N ATOM 1458 CA ILE A 94 10.070 -0.811 7.298 1.00 0.00 C ATOM 1459 C ILE A 94 9.524 -0.079 8.520 1.00 0.00 C ATOM 1460 O ILE A 94 9.004 -0.699 9.446 1.00 0.00 O ATOM 1461 CB ILE A 94 8.897 -1.195 6.377 1.00 0.00 C ATOM 1462 CG1 ILE A 94 9.420 -1.808 5.077 1.00 0.00 C ATOM 1463 CG2 ILE A 94 8.032 0.022 6.085 1.00 0.00 C ATOM 1464 CD1 ILE A 94 8.373 -2.584 4.310 1.00 0.00 C ATOM 0 H ILE A 94 10.321 -2.675 8.223 1.00 0.00 H new ATOM 0 HA ILE A 94 10.747 -0.152 6.754 1.00 0.00 H new ATOM 0 HB ILE A 94 8.284 -1.939 6.886 1.00 0.00 H new ATOM 0 HG12 ILE A 94 9.809 -1.013 4.441 1.00 0.00 H new ATOM 0 HG13 ILE A 94 10.255 -2.470 5.307 1.00 0.00 H new ATOM 0 HG21 ILE A 94 7.207 -0.266 5.433 1.00 0.00 H new ATOM 0 HG22 ILE A 94 7.634 0.418 7.019 1.00 0.00 H new ATOM 0 HG23 ILE A 94 8.634 0.786 5.593 1.00 0.00 H new ATOM 0 HD11 ILE A 94 8.815 -2.990 3.400 1.00 0.00 H new ATOM 0 HD12 ILE A 94 8.000 -3.401 4.928 1.00 0.00 H new ATOM 0 HD13 ILE A 94 7.548 -1.921 4.048 1.00 0.00 H new ATOM 1476 N ASN A 95 9.644 1.245 8.513 1.00 0.00 N ATOM 1477 CA ASN A 95 9.161 2.062 9.620 1.00 0.00 C ATOM 1478 C ASN A 95 7.636 2.102 9.641 1.00 0.00 C ATOM 1479 O ASN A 95 6.998 2.382 8.626 1.00 0.00 O ATOM 1480 CB ASN A 95 9.719 3.482 9.514 1.00 0.00 C ATOM 1481 CG ASN A 95 9.287 4.361 10.672 1.00 0.00 C ATOM 1482 OD1 ASN A 95 8.248 5.020 10.612 1.00 0.00 O ATOM 1483 ND2 ASN A 95 10.084 4.375 11.733 1.00 0.00 N ATOM 0 H ASN A 95 10.071 1.774 7.753 1.00 0.00 H new ATOM 0 HA ASN A 95 9.507 1.612 10.550 1.00 0.00 H new ATOM 0 HB2 ASN A 95 10.808 3.440 9.480 1.00 0.00 H new ATOM 0 HB3 ASN A 95 9.388 3.931 8.578 1.00 0.00 H new ATOM 0 HD21 ASN A 95 9.845 4.948 12.543 1.00 0.00 H new ATOM 0 HD22 ASN A 95 10.935 3.813 11.739 1.00 0.00 H new ATOM 1490 N ILE A 96 7.058 1.822 10.805 1.00 0.00 N ATOM 1491 CA ILE A 96 5.609 1.829 10.959 1.00 0.00 C ATOM 1492 C ILE A 96 5.186 2.691 12.143 1.00 0.00 C ATOM 1493 O ILE A 96 4.091 3.253 12.154 1.00 0.00 O ATOM 1494 CB ILE A 96 5.057 0.404 11.152 1.00 0.00 C ATOM 1495 CG1 ILE A 96 5.732 -0.270 12.348 1.00 0.00 C ATOM 1496 CG2 ILE A 96 5.261 -0.419 9.888 1.00 0.00 C ATOM 1497 CD1 ILE A 96 5.063 -1.559 12.772 1.00 0.00 C ATOM 0 H ILE A 96 7.571 1.588 11.655 1.00 0.00 H new ATOM 0 HA ILE A 96 5.196 2.249 10.042 1.00 0.00 H new ATOM 0 HB ILE A 96 3.987 0.468 11.351 1.00 0.00 H new ATOM 0 HG12 ILE A 96 6.773 -0.475 12.099 1.00 0.00 H new ATOM 0 HG13 ILE A 96 5.736 0.422 13.190 1.00 0.00 H new ATOM 0 HG21 ILE A 96 4.866 -1.423 10.040 1.00 0.00 H new ATOM 0 HG22 ILE A 96 4.738 0.055 9.057 1.00 0.00 H new ATOM 0 HG23 ILE A 96 6.325 -0.478 9.660 1.00 0.00 H new ATOM 0 HD11 ILE A 96 5.595 -1.981 13.625 1.00 0.00 H new ATOM 0 HD12 ILE A 96 4.029 -1.357 13.053 1.00 0.00 H new ATOM 0 HD13 ILE A 96 5.083 -2.268 11.945 1.00 0.00 H new ATOM 1509 N GLN A 97 6.062 2.790 13.138 1.00 0.00 N ATOM 1510 CA GLN A 97 5.778 3.585 14.328 1.00 0.00 C ATOM 1511 C GLN A 97 4.953 4.818 13.975 1.00 0.00 C ATOM 1512 O GLN A 97 3.918 5.080 14.587 1.00 0.00 O ATOM 1513 CB GLN A 97 7.082 4.008 15.007 1.00 0.00 C ATOM 1514 CG GLN A 97 7.714 2.910 15.848 1.00 0.00 C ATOM 1515 CD GLN A 97 9.183 3.160 16.126 1.00 0.00 C ATOM 1516 OE1 GLN A 97 9.765 4.124 15.629 1.00 0.00 O ATOM 1517 NE2 GLN A 97 9.791 2.289 16.923 1.00 0.00 N ATOM 0 H GLN A 97 6.973 2.331 13.144 1.00 0.00 H new ATOM 0 HA GLN A 97 5.200 2.968 15.017 1.00 0.00 H new ATOM 0 HB2 GLN A 97 7.793 4.325 14.244 1.00 0.00 H new ATOM 0 HB3 GLN A 97 6.888 4.873 15.641 1.00 0.00 H new ATOM 0 HG2 GLN A 97 7.178 2.828 16.794 1.00 0.00 H new ATOM 0 HG3 GLN A 97 7.603 1.955 15.335 1.00 0.00 H new ATOM 0 HE21 GLN A 97 9.269 1.504 17.313 1.00 0.00 H new ATOM 0 HE22 GLN A 97 10.780 2.405 17.145 1.00 0.00 H new ATOM 1526 N GLY A 98 5.418 5.572 12.983 1.00 0.00 N ATOM 1527 CA GLY A 98 4.710 6.768 12.567 1.00 0.00 C ATOM 1528 C GLY A 98 3.317 6.468 12.050 1.00 0.00 C ATOM 1529 O GLY A 98 2.363 7.181 12.364 1.00 0.00 O ATOM 0 H GLY A 98 6.272 5.376 12.461 1.00 0.00 H new ATOM 0 HA2 GLY A 98 4.641 7.457 13.409 1.00 0.00 H new ATOM 0 HA3 GLY A 98 5.282 7.273 11.788 1.00 0.00 H new ATOM 1533 N LEU A 99 3.198 5.410 11.255 1.00 0.00 N ATOM 1534 CA LEU A 99 1.911 5.017 10.692 1.00 0.00 C ATOM 1535 C LEU A 99 0.973 4.506 11.781 1.00 0.00 C ATOM 1536 O LEU A 99 1.384 3.754 12.665 1.00 0.00 O ATOM 1537 CB LEU A 99 2.107 3.939 9.624 1.00 0.00 C ATOM 1538 CG LEU A 99 3.093 4.274 8.505 1.00 0.00 C ATOM 1539 CD1 LEU A 99 3.319 3.064 7.613 1.00 0.00 C ATOM 1540 CD2 LEU A 99 2.591 5.455 7.688 1.00 0.00 C ATOM 0 H LEU A 99 3.977 4.809 10.986 1.00 0.00 H new ATOM 0 HA LEU A 99 1.459 5.896 10.233 1.00 0.00 H new ATOM 0 HB2 LEU A 99 2.443 3.026 10.115 1.00 0.00 H new ATOM 0 HB3 LEU A 99 1.138 3.721 9.174 1.00 0.00 H new ATOM 0 HG LEU A 99 4.046 4.549 8.957 1.00 0.00 H new ATOM 0 HD11 LEU A 99 4.024 3.321 6.822 1.00 0.00 H new ATOM 0 HD12 LEU A 99 3.724 2.245 8.207 1.00 0.00 H new ATOM 0 HD13 LEU A 99 2.372 2.757 7.169 1.00 0.00 H new ATOM 0 HD21 LEU A 99 3.305 5.679 6.896 1.00 0.00 H new ATOM 0 HD22 LEU A 99 1.626 5.208 7.246 1.00 0.00 H new ATOM 0 HD23 LEU A 99 2.482 6.325 8.335 1.00 0.00 H new ATOM 1552 N SER A 100 -0.289 4.917 11.710 1.00 0.00 N ATOM 1553 CA SER A 100 -1.285 4.502 12.690 1.00 0.00 C ATOM 1554 C SER A 100 -2.450 3.788 12.012 1.00 0.00 C ATOM 1555 O SER A 100 -3.098 4.339 11.123 1.00 0.00 O ATOM 1556 CB SER A 100 -1.799 5.714 13.470 1.00 0.00 C ATOM 1557 OG SER A 100 -1.062 5.901 14.666 1.00 0.00 O ATOM 0 H SER A 100 -0.646 5.537 10.983 1.00 0.00 H new ATOM 0 HA SER A 100 -0.810 3.807 13.383 1.00 0.00 H new ATOM 0 HB2 SER A 100 -1.725 6.607 12.850 1.00 0.00 H new ATOM 0 HB3 SER A 100 -2.854 5.577 13.707 1.00 0.00 H new ATOM 0 HG SER A 100 -1.409 6.682 15.145 1.00 0.00 H new ATOM 1563 N ALA A 101 -2.710 2.556 12.440 1.00 0.00 N ATOM 1564 CA ALA A 101 -3.797 1.766 11.876 1.00 0.00 C ATOM 1565 C ALA A 101 -5.108 2.545 11.893 1.00 0.00 C ATOM 1566 O ALA A 101 -5.831 2.581 10.898 1.00 0.00 O ATOM 1567 CB ALA A 101 -3.949 0.458 12.638 1.00 0.00 C ATOM 0 H ALA A 101 -2.183 2.085 13.175 1.00 0.00 H new ATOM 0 HA ALA A 101 -3.550 1.543 10.838 1.00 0.00 H new ATOM 0 HB1 ALA A 101 -4.765 -0.122 12.206 1.00 0.00 H new ATOM 0 HB2 ALA A 101 -3.023 -0.112 12.570 1.00 0.00 H new ATOM 0 HB3 ALA A 101 -4.169 0.670 13.684 1.00 0.00 H new ATOM 1573 N GLU A 102 -5.407 3.167 13.029 1.00 0.00 N ATOM 1574 CA GLU A 102 -6.632 3.945 13.174 1.00 0.00 C ATOM 1575 C GLU A 102 -6.714 5.035 12.109 1.00 0.00 C ATOM 1576 O GLU A 102 -7.772 5.267 11.525 1.00 0.00 O ATOM 1577 CB GLU A 102 -6.703 4.572 14.568 1.00 0.00 C ATOM 1578 CG GLU A 102 -8.115 4.917 15.009 1.00 0.00 C ATOM 1579 CD GLU A 102 -8.167 5.465 16.422 1.00 0.00 C ATOM 1580 OE1 GLU A 102 -7.970 6.686 16.592 1.00 0.00 O ATOM 1581 OE2 GLU A 102 -8.405 4.673 17.358 1.00 0.00 O ATOM 0 H GLU A 102 -4.818 3.147 13.862 1.00 0.00 H new ATOM 0 HA GLU A 102 -7.478 3.270 13.044 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -6.264 3.883 15.290 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -6.096 5.477 14.581 1.00 0.00 H new ATOM 0 HG2 GLU A 102 -8.537 5.651 14.323 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -8.739 4.026 14.946 1.00 0.00 H new ATOM 1588 N GLU A 103 -5.589 5.700 11.863 1.00 0.00 N ATOM 1589 CA GLU A 103 -5.535 6.766 10.870 1.00 0.00 C ATOM 1590 C GLU A 103 -5.640 6.199 9.457 1.00 0.00 C ATOM 1591 O GLU A 103 -6.357 6.737 8.613 1.00 0.00 O ATOM 1592 CB GLU A 103 -4.237 7.563 11.016 1.00 0.00 C ATOM 1593 CG GLU A 103 -4.021 8.124 12.412 1.00 0.00 C ATOM 1594 CD GLU A 103 -3.242 9.425 12.404 1.00 0.00 C ATOM 1595 OE1 GLU A 103 -2.424 9.621 11.482 1.00 0.00 O ATOM 1596 OE2 GLU A 103 -3.452 10.247 13.320 1.00 0.00 O ATOM 0 H GLU A 103 -4.704 5.519 12.337 1.00 0.00 H new ATOM 0 HA GLU A 103 -6.382 7.430 11.040 1.00 0.00 H new ATOM 0 HB2 GLU A 103 -3.395 6.921 10.757 1.00 0.00 H new ATOM 0 HB3 GLU A 103 -4.243 8.385 10.300 1.00 0.00 H new ATOM 0 HG2 GLU A 103 -4.988 8.287 12.888 1.00 0.00 H new ATOM 0 HG3 GLU A 103 -3.488 7.390 13.016 1.00 0.00 H new ATOM 1603 N ILE A 104 -4.920 5.111 9.207 1.00 0.00 N ATOM 1604 CA ILE A 104 -4.932 4.471 7.898 1.00 0.00 C ATOM 1605 C ILE A 104 -6.319 3.933 7.562 1.00 0.00 C ATOM 1606 O ILE A 104 -6.760 3.999 6.414 1.00 0.00 O ATOM 1607 CB ILE A 104 -3.915 3.317 7.825 1.00 0.00 C ATOM 1608 CG1 ILE A 104 -2.494 3.847 8.027 1.00 0.00 C ATOM 1609 CG2 ILE A 104 -4.031 2.591 6.493 1.00 0.00 C ATOM 1610 CD1 ILE A 104 -1.436 2.766 8.006 1.00 0.00 C ATOM 0 H ILE A 104 -4.321 4.654 9.894 1.00 0.00 H new ATOM 0 HA ILE A 104 -4.655 5.235 7.171 1.00 0.00 H new ATOM 0 HB ILE A 104 -4.135 2.608 8.623 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -2.273 4.576 7.247 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -2.444 4.374 8.980 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -3.306 1.778 6.457 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -5.037 2.185 6.387 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -3.834 3.289 5.680 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -0.454 3.215 8.155 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -1.632 2.049 8.803 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -1.458 2.254 7.044 1.00 0.00 H new ATOM 1622 N ARG A 105 -7.002 3.402 8.571 1.00 0.00 N ATOM 1623 CA ARG A 105 -8.339 2.854 8.383 1.00 0.00 C ATOM 1624 C ARG A 105 -9.339 3.958 8.051 1.00 0.00 C ATOM 1625 O ARG A 105 -10.237 3.770 7.232 1.00 0.00 O ATOM 1626 CB ARG A 105 -8.788 2.106 9.639 1.00 0.00 C ATOM 1627 CG ARG A 105 -10.292 2.129 9.857 1.00 0.00 C ATOM 1628 CD ARG A 105 -10.694 1.290 11.060 1.00 0.00 C ATOM 1629 NE ARG A 105 -11.969 1.720 11.627 1.00 0.00 N ATOM 1630 CZ ARG A 105 -12.091 2.735 12.476 1.00 0.00 C ATOM 1631 NH1 ARG A 105 -11.021 3.420 12.854 1.00 0.00 N ATOM 1632 NH2 ARG A 105 -13.286 3.066 12.948 1.00 0.00 N ATOM 0 H ARG A 105 -6.651 3.340 9.527 1.00 0.00 H new ATOM 0 HA ARG A 105 -8.303 2.157 7.546 1.00 0.00 H new ATOM 0 HB2 ARG A 105 -8.455 1.070 9.573 1.00 0.00 H new ATOM 0 HB3 ARG A 105 -8.297 2.544 10.508 1.00 0.00 H new ATOM 0 HG2 ARG A 105 -10.624 3.157 10.002 1.00 0.00 H new ATOM 0 HG3 ARG A 105 -10.796 1.754 8.966 1.00 0.00 H new ATOM 0 HD2 ARG A 105 -10.764 0.243 10.765 1.00 0.00 H new ATOM 0 HD3 ARG A 105 -9.918 1.355 11.823 1.00 0.00 H new ATOM 0 HE ARG A 105 -12.812 1.214 11.357 1.00 0.00 H new ATOM 0 HH11 ARG A 105 -10.101 3.169 12.493 1.00 0.00 H new ATOM 0 HH12 ARG A 105 -11.118 4.199 13.506 1.00 0.00 H new ATOM 0 HH21 ARG A 105 -14.112 2.541 12.659 1.00 0.00 H new ATOM 0 HH22 ARG A 105 -13.379 3.845 13.600 1.00 0.00 H new ATOM 1646 N ASN A 106 -9.174 5.110 8.693 1.00 0.00 N ATOM 1647 CA ASN A 106 -10.062 6.245 8.467 1.00 0.00 C ATOM 1648 C ASN A 106 -9.905 6.785 7.049 1.00 0.00 C ATOM 1649 O ASN A 106 -10.839 7.350 6.481 1.00 0.00 O ATOM 1650 CB ASN A 106 -9.776 7.353 9.482 1.00 0.00 C ATOM 1651 CG ASN A 106 -10.562 7.178 10.767 1.00 0.00 C ATOM 1652 OD1 ASN A 106 -11.774 7.388 10.800 1.00 0.00 O ATOM 1653 ND2 ASN A 106 -9.872 6.793 11.834 1.00 0.00 N ATOM 0 H ASN A 106 -8.434 5.282 9.374 1.00 0.00 H new ATOM 0 HA ASN A 106 -11.089 5.902 8.594 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -8.710 7.366 9.710 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -10.019 8.319 9.039 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -10.346 6.660 12.727 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -8.868 6.630 11.760 1.00 0.00 H new ATOM 1660 N GLY A 107 -8.716 6.606 6.482 1.00 0.00 N ATOM 1661 CA GLY A 107 -8.457 7.080 5.135 1.00 0.00 C ATOM 1662 C GLY A 107 -7.700 8.393 5.118 1.00 0.00 C ATOM 1663 O GLY A 107 -7.859 9.197 4.200 1.00 0.00 O ATOM 0 H GLY A 107 -7.927 6.141 6.932 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -7.885 6.327 4.592 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -9.403 7.203 4.608 1.00 0.00 H new ATOM 1667 N ASN A 108 -6.875 8.612 6.137 1.00 0.00 N ATOM 1668 CA ASN A 108 -6.092 9.838 6.236 1.00 0.00 C ATOM 1669 C ASN A 108 -4.935 9.827 5.242 1.00 0.00 C ATOM 1670 O ASN A 108 -3.919 9.166 5.462 1.00 0.00 O ATOM 1671 CB ASN A 108 -5.555 10.011 7.659 1.00 0.00 C ATOM 1672 CG ASN A 108 -5.378 11.469 8.037 1.00 0.00 C ATOM 1673 OD1 ASN A 108 -6.194 12.318 7.677 1.00 0.00 O ATOM 1674 ND2 ASN A 108 -4.309 11.766 8.765 1.00 0.00 N ATOM 0 H ASN A 108 -6.732 7.957 6.905 1.00 0.00 H new ATOM 0 HA ASN A 108 -6.745 10.677 5.996 1.00 0.00 H new ATOM 0 HB2 ASN A 108 -6.239 9.537 8.363 1.00 0.00 H new ATOM 0 HB3 ASN A 108 -4.598 9.497 7.748 1.00 0.00 H new ATOM 0 HD21 ASN A 108 -4.137 12.731 9.049 1.00 0.00 H new ATOM 0 HD22 ASN A 108 -3.659 11.030 9.041 1.00 0.00 H new ATOM 1681 N LEU A 109 -5.095 10.562 4.148 1.00 0.00 N ATOM 1682 CA LEU A 109 -4.064 10.638 3.119 1.00 0.00 C ATOM 1683 C LEU A 109 -2.671 10.608 3.740 1.00 0.00 C ATOM 1684 O LEU A 109 -1.826 9.799 3.357 1.00 0.00 O ATOM 1685 CB LEU A 109 -4.237 11.911 2.288 1.00 0.00 C ATOM 1686 CG LEU A 109 -3.689 11.862 0.862 1.00 0.00 C ATOM 1687 CD1 LEU A 109 -4.584 11.011 -0.025 1.00 0.00 C ATOM 1688 CD2 LEU A 109 -3.553 13.267 0.293 1.00 0.00 C ATOM 0 H LEU A 109 -5.929 11.114 3.950 1.00 0.00 H new ATOM 0 HA LEU A 109 -4.171 9.770 2.469 1.00 0.00 H new ATOM 0 HB2 LEU A 109 -5.300 12.147 2.239 1.00 0.00 H new ATOM 0 HB3 LEU A 109 -3.752 12.733 2.814 1.00 0.00 H new ATOM 0 HG LEU A 109 -2.699 11.406 0.890 1.00 0.00 H new ATOM 0 HD11 LEU A 109 -4.178 10.988 -1.036 1.00 0.00 H new ATOM 0 HD12 LEU A 109 -4.630 9.996 0.371 1.00 0.00 H new ATOM 0 HD13 LEU A 109 -5.587 11.438 -0.046 1.00 0.00 H new ATOM 0 HD21 LEU A 109 -3.161 13.212 -0.723 1.00 0.00 H new ATOM 0 HD22 LEU A 109 -4.530 13.750 0.280 1.00 0.00 H new ATOM 0 HD23 LEU A 109 -2.870 13.847 0.914 1.00 0.00 H new ATOM 1700 N LYS A 110 -2.440 11.494 4.703 1.00 0.00 N ATOM 1701 CA LYS A 110 -1.151 11.568 5.381 1.00 0.00 C ATOM 1702 C LYS A 110 -0.723 10.194 5.887 1.00 0.00 C ATOM 1703 O LYS A 110 0.443 9.817 5.774 1.00 0.00 O ATOM 1704 CB LYS A 110 -1.222 12.554 6.549 1.00 0.00 C ATOM 1705 CG LYS A 110 -0.916 13.988 6.154 1.00 0.00 C ATOM 1706 CD LYS A 110 0.581 14.233 6.060 1.00 0.00 C ATOM 1707 CE LYS A 110 0.903 15.719 6.039 1.00 0.00 C ATOM 1708 NZ LYS A 110 0.929 16.300 7.411 1.00 0.00 N ATOM 0 H LYS A 110 -3.129 12.171 5.032 1.00 0.00 H new ATOM 0 HA LYS A 110 -0.410 11.918 4.662 1.00 0.00 H new ATOM 0 HB2 LYS A 110 -2.218 12.512 6.989 1.00 0.00 H new ATOM 0 HB3 LYS A 110 -0.519 12.241 7.321 1.00 0.00 H new ATOM 0 HG2 LYS A 110 -1.383 14.210 5.194 1.00 0.00 H new ATOM 0 HG3 LYS A 110 -1.352 14.669 6.885 1.00 0.00 H new ATOM 0 HD2 LYS A 110 1.081 13.763 6.907 1.00 0.00 H new ATOM 0 HD3 LYS A 110 0.972 13.762 5.158 1.00 0.00 H new ATOM 0 HE2 LYS A 110 1.870 15.874 5.560 1.00 0.00 H new ATOM 0 HE3 LYS A 110 0.161 16.243 5.437 1.00 0.00 H new ATOM 0 HZ1 LYS A 110 1.152 17.314 7.354 1.00 0.00 H new ATOM 0 HZ2 LYS A 110 -0.001 16.174 7.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 110 1.655 15.817 7.979 1.00 0.00 H new ATOM 1722 N ALA A 111 -1.674 9.451 6.444 1.00 0.00 N ATOM 1723 CA ALA A 111 -1.395 8.118 6.963 1.00 0.00 C ATOM 1724 C ALA A 111 -1.087 7.142 5.833 1.00 0.00 C ATOM 1725 O ALA A 111 -0.033 6.505 5.821 1.00 0.00 O ATOM 1726 CB ALA A 111 -2.570 7.618 7.790 1.00 0.00 C ATOM 0 H ALA A 111 -2.644 9.750 6.547 1.00 0.00 H new ATOM 0 HA ALA A 111 -0.515 8.181 7.603 1.00 0.00 H new ATOM 0 HB1 ALA A 111 -2.348 6.621 8.172 1.00 0.00 H new ATOM 0 HB2 ALA A 111 -2.742 8.297 8.626 1.00 0.00 H new ATOM 0 HB3 ALA A 111 -3.463 7.577 7.166 1.00 0.00 H new ATOM 1732 N ILE A 112 -2.013 7.028 4.887 1.00 0.00 N ATOM 1733 CA ILE A 112 -1.839 6.129 3.753 1.00 0.00 C ATOM 1734 C ILE A 112 -0.520 6.398 3.035 1.00 0.00 C ATOM 1735 O ILE A 112 0.380 5.557 3.032 1.00 0.00 O ATOM 1736 CB ILE A 112 -2.995 6.264 2.745 1.00 0.00 C ATOM 1737 CG1 ILE A 112 -4.325 5.898 3.409 1.00 0.00 C ATOM 1738 CG2 ILE A 112 -2.744 5.385 1.529 1.00 0.00 C ATOM 1739 CD1 ILE A 112 -5.009 7.070 4.076 1.00 0.00 C ATOM 0 H ILE A 112 -2.891 7.547 4.883 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.833 5.115 4.153 1.00 0.00 H new ATOM 0 HB ILE A 112 -3.049 7.301 2.414 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -4.993 5.477 2.658 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -4.149 5.120 4.151 1.00 0.00 H new ATOM 0 HG21 ILE A 112 -3.570 5.492 0.826 1.00 0.00 H new ATOM 0 HG22 ILE A 112 -1.815 5.689 1.046 1.00 0.00 H new ATOM 0 HG23 ILE A 112 -2.667 4.344 1.842 1.00 0.00 H new ATOM 0 HD11 ILE A 112 -5.945 6.738 4.525 1.00 0.00 H new ATOM 0 HD12 ILE A 112 -4.359 7.478 4.850 1.00 0.00 H new ATOM 0 HD13 ILE A 112 -5.217 7.841 3.334 1.00 0.00 H new ATOM 1751 N LEU A 113 -0.412 7.576 2.430 1.00 0.00 N ATOM 1752 CA LEU A 113 0.798 7.958 1.710 1.00 0.00 C ATOM 1753 C LEU A 113 2.045 7.485 2.451 1.00 0.00 C ATOM 1754 O LEU A 113 2.996 7.000 1.841 1.00 0.00 O ATOM 1755 CB LEU A 113 0.846 9.475 1.523 1.00 0.00 C ATOM 1756 CG LEU A 113 -0.104 10.053 0.473 1.00 0.00 C ATOM 1757 CD1 LEU A 113 -0.024 11.571 0.459 1.00 0.00 C ATOM 1758 CD2 LEU A 113 0.214 9.487 -0.903 1.00 0.00 C ATOM 0 H LEU A 113 -1.147 8.283 2.424 1.00 0.00 H new ATOM 0 HA LEU A 113 0.776 7.478 0.732 1.00 0.00 H new ATOM 0 HB2 LEU A 113 0.626 9.946 2.481 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.865 9.756 1.256 1.00 0.00 H new ATOM 0 HG LEU A 113 -1.122 9.766 0.735 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.707 11.964 -0.294 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.302 11.959 1.439 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.994 11.880 0.222 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -0.472 9.909 -1.637 1.00 0.00 H new ATOM 0 HD22 LEU A 113 1.238 9.743 -1.174 1.00 0.00 H new ATOM 0 HD23 LEU A 113 0.104 8.403 -0.885 1.00 0.00 H new ATOM 1770 N GLY A 114 2.031 7.629 3.773 1.00 0.00 N ATOM 1771 CA GLY A 114 3.165 7.210 4.577 1.00 0.00 C ATOM 1772 C GLY A 114 3.466 5.732 4.428 1.00 0.00 C ATOM 1773 O GLY A 114 4.629 5.331 4.367 1.00 0.00 O ATOM 0 H GLY A 114 1.255 8.028 4.301 1.00 0.00 H new ATOM 0 HA2 GLY A 114 4.044 7.787 4.289 1.00 0.00 H new ATOM 0 HA3 GLY A 114 2.966 7.433 5.625 1.00 0.00 H new ATOM 1777 N LEU A 115 2.417 4.919 4.373 1.00 0.00 N ATOM 1778 CA LEU A 115 2.575 3.475 4.233 1.00 0.00 C ATOM 1779 C LEU A 115 3.215 3.125 2.894 1.00 0.00 C ATOM 1780 O LEU A 115 4.296 2.538 2.845 1.00 0.00 O ATOM 1781 CB LEU A 115 1.218 2.780 4.360 1.00 0.00 C ATOM 1782 CG LEU A 115 1.066 1.461 3.601 1.00 0.00 C ATOM 1783 CD1 LEU A 115 0.099 0.537 4.324 1.00 0.00 C ATOM 1784 CD2 LEU A 115 0.598 1.717 2.176 1.00 0.00 C ATOM 0 H LEU A 115 1.448 5.234 4.423 1.00 0.00 H new ATOM 0 HA LEU A 115 3.231 3.126 5.030 1.00 0.00 H new ATOM 0 HB2 LEU A 115 1.026 2.592 5.416 1.00 0.00 H new ATOM 0 HB3 LEU A 115 0.446 3.467 4.013 1.00 0.00 H new ATOM 0 HG LEU A 115 2.040 0.973 3.560 1.00 0.00 H new ATOM 0 HD11 LEU A 115 0.004 -0.396 3.769 1.00 0.00 H new ATOM 0 HD12 LEU A 115 0.476 0.327 5.325 1.00 0.00 H new ATOM 0 HD13 LEU A 115 -0.877 1.017 4.397 1.00 0.00 H new ATOM 0 HD21 LEU A 115 0.495 0.767 1.651 1.00 0.00 H new ATOM 0 HD22 LEU A 115 -0.365 2.227 2.195 1.00 0.00 H new ATOM 0 HD23 LEU A 115 1.328 2.340 1.660 1.00 0.00 H new ATOM 1796 N PHE A 116 2.542 3.491 1.808 1.00 0.00 N ATOM 1797 CA PHE A 116 3.046 3.216 0.467 1.00 0.00 C ATOM 1798 C PHE A 116 4.359 3.953 0.218 1.00 0.00 C ATOM 1799 O PHE A 116 5.062 3.680 -0.755 1.00 0.00 O ATOM 1800 CB PHE A 116 2.011 3.626 -0.583 1.00 0.00 C ATOM 1801 CG PHE A 116 1.043 2.531 -0.929 1.00 0.00 C ATOM 1802 CD1 PHE A 116 1.434 1.470 -1.730 1.00 0.00 C ATOM 1803 CD2 PHE A 116 -0.258 2.563 -0.454 1.00 0.00 C ATOM 1804 CE1 PHE A 116 0.545 0.460 -2.050 1.00 0.00 C ATOM 1805 CE2 PHE A 116 -1.151 1.557 -0.771 1.00 0.00 C ATOM 1806 CZ PHE A 116 -0.749 0.505 -1.571 1.00 0.00 C ATOM 0 H PHE A 116 1.646 3.979 1.830 1.00 0.00 H new ATOM 0 HA PHE A 116 3.230 2.145 0.387 1.00 0.00 H new ATOM 0 HB2 PHE A 116 1.455 4.489 -0.216 1.00 0.00 H new ATOM 0 HB3 PHE A 116 2.529 3.942 -1.489 1.00 0.00 H new ATOM 0 HD1 PHE A 116 2.445 1.431 -2.109 1.00 0.00 H new ATOM 0 HD2 PHE A 116 -0.578 3.383 0.171 1.00 0.00 H new ATOM 0 HE1 PHE A 116 0.863 -0.363 -2.674 1.00 0.00 H new ATOM 0 HE2 PHE A 116 -2.162 1.593 -0.394 1.00 0.00 H new ATOM 0 HZ PHE A 116 -1.446 -0.281 -1.821 1.00 0.00 H new ATOM 1816 N PHE A 117 4.683 4.888 1.105 1.00 0.00 N ATOM 1817 CA PHE A 117 5.910 5.666 0.982 1.00 0.00 C ATOM 1818 C PHE A 117 7.111 4.869 1.484 1.00 0.00 C ATOM 1819 O PHE A 117 8.205 4.958 0.926 1.00 0.00 O ATOM 1820 CB PHE A 117 5.790 6.975 1.763 1.00 0.00 C ATOM 1821 CG PHE A 117 7.073 7.754 1.830 1.00 0.00 C ATOM 1822 CD1 PHE A 117 8.139 7.293 2.586 1.00 0.00 C ATOM 1823 CD2 PHE A 117 7.212 8.946 1.138 1.00 0.00 C ATOM 1824 CE1 PHE A 117 9.321 8.007 2.649 1.00 0.00 C ATOM 1825 CE2 PHE A 117 8.392 9.663 1.198 1.00 0.00 C ATOM 1826 CZ PHE A 117 9.447 9.194 1.955 1.00 0.00 C ATOM 0 H PHE A 117 4.113 5.125 1.917 1.00 0.00 H new ATOM 0 HA PHE A 117 6.062 5.894 -0.073 1.00 0.00 H new ATOM 0 HB2 PHE A 117 5.022 7.595 1.301 1.00 0.00 H new ATOM 0 HB3 PHE A 117 5.455 6.755 2.777 1.00 0.00 H new ATOM 0 HD1 PHE A 117 8.045 6.366 3.132 1.00 0.00 H new ATOM 0 HD2 PHE A 117 6.390 9.319 0.545 1.00 0.00 H new ATOM 0 HE1 PHE A 117 10.145 7.637 3.241 1.00 0.00 H new ATOM 0 HE2 PHE A 117 8.489 10.590 0.653 1.00 0.00 H new ATOM 0 HZ PHE A 117 10.369 9.754 2.004 1.00 0.00 H new ATOM 1836 N SER A 118 6.899 4.092 2.541 1.00 0.00 N ATOM 1837 CA SER A 118 7.964 3.283 3.122 1.00 0.00 C ATOM 1838 C SER A 118 7.964 1.878 2.527 1.00 0.00 C ATOM 1839 O SER A 118 9.021 1.288 2.298 1.00 0.00 O ATOM 1840 CB SER A 118 7.804 3.207 4.641 1.00 0.00 C ATOM 1841 OG SER A 118 6.912 2.169 5.009 1.00 0.00 O ATOM 0 H SER A 118 5.999 4.005 3.013 1.00 0.00 H new ATOM 0 HA SER A 118 8.917 3.757 2.888 1.00 0.00 H new ATOM 0 HB2 SER A 118 8.776 3.037 5.104 1.00 0.00 H new ATOM 0 HB3 SER A 118 7.434 4.160 5.019 1.00 0.00 H new ATOM 0 HG SER A 118 6.654 2.277 5.948 1.00 0.00 H new ATOM 1847 N LEU A 119 6.772 1.347 2.281 1.00 0.00 N ATOM 1848 CA LEU A 119 6.633 0.010 1.713 1.00 0.00 C ATOM 1849 C LEU A 119 7.415 -0.112 0.409 1.00 0.00 C ATOM 1850 O LEU A 119 8.161 -1.071 0.209 1.00 0.00 O ATOM 1851 CB LEU A 119 5.157 -0.310 1.467 1.00 0.00 C ATOM 1852 CG LEU A 119 4.872 -1.489 0.536 1.00 0.00 C ATOM 1853 CD1 LEU A 119 5.648 -2.719 0.980 1.00 0.00 C ATOM 1854 CD2 LEU A 119 3.380 -1.784 0.491 1.00 0.00 C ATOM 0 H LEU A 119 5.888 1.821 2.466 1.00 0.00 H new ATOM 0 HA LEU A 119 7.040 -0.705 2.428 1.00 0.00 H new ATOM 0 HB2 LEU A 119 4.684 -0.510 2.429 1.00 0.00 H new ATOM 0 HB3 LEU A 119 4.677 0.577 1.054 1.00 0.00 H new ATOM 0 HG LEU A 119 5.199 -1.222 -0.469 1.00 0.00 H new ATOM 0 HD11 LEU A 119 5.433 -3.548 0.306 1.00 0.00 H new ATOM 0 HD12 LEU A 119 6.716 -2.502 0.959 1.00 0.00 H new ATOM 0 HD13 LEU A 119 5.352 -2.990 1.994 1.00 0.00 H new ATOM 0 HD21 LEU A 119 3.196 -2.626 -0.176 1.00 0.00 H new ATOM 0 HD22 LEU A 119 3.028 -2.031 1.492 1.00 0.00 H new ATOM 0 HD23 LEU A 119 2.847 -0.907 0.125 1.00 0.00 H new ATOM 1866 N SER A 120 7.241 0.866 -0.473 1.00 0.00 N ATOM 1867 CA SER A 120 7.930 0.868 -1.759 1.00 0.00 C ATOM 1868 C SER A 120 9.441 0.791 -1.565 1.00 0.00 C ATOM 1869 O SER A 120 10.144 0.136 -2.336 1.00 0.00 O ATOM 1870 CB SER A 120 7.570 2.125 -2.553 1.00 0.00 C ATOM 1871 OG SER A 120 8.090 3.287 -1.932 1.00 0.00 O ATOM 0 H SER A 120 6.629 1.668 -0.321 1.00 0.00 H new ATOM 0 HA SER A 120 7.607 -0.010 -2.318 1.00 0.00 H new ATOM 0 HB2 SER A 120 7.963 2.044 -3.566 1.00 0.00 H new ATOM 0 HB3 SER A 120 6.486 2.208 -2.637 1.00 0.00 H new ATOM 0 HG SER A 120 7.847 4.076 -2.460 1.00 0.00 H new ATOM 1877 N ARG A 121 9.935 1.464 -0.531 1.00 0.00 N ATOM 1878 CA ARG A 121 11.362 1.474 -0.236 1.00 0.00 C ATOM 1879 C ARG A 121 11.877 0.058 0.005 1.00 0.00 C ATOM 1880 O ARG A 121 12.913 -0.337 -0.530 1.00 0.00 O ATOM 1881 CB ARG A 121 11.646 2.347 0.988 1.00 0.00 C ATOM 1882 CG ARG A 121 11.160 3.779 0.840 1.00 0.00 C ATOM 1883 CD ARG A 121 11.721 4.673 1.935 1.00 0.00 C ATOM 1884 NE ARG A 121 13.142 4.948 1.742 1.00 0.00 N ATOM 1885 CZ ARG A 121 13.617 5.719 0.771 1.00 0.00 C ATOM 1886 NH1 ARG A 121 12.788 6.290 -0.092 1.00 0.00 N ATOM 1887 NH2 ARG A 121 14.924 5.921 0.661 1.00 0.00 N ATOM 0 H ARG A 121 9.367 2.010 0.117 1.00 0.00 H new ATOM 0 HA ARG A 121 11.883 1.890 -1.099 1.00 0.00 H new ATOM 0 HB2 ARG A 121 11.171 1.899 1.861 1.00 0.00 H new ATOM 0 HB3 ARG A 121 12.719 2.354 1.178 1.00 0.00 H new ATOM 0 HG2 ARG A 121 11.456 4.166 -0.135 1.00 0.00 H new ATOM 0 HG3 ARG A 121 10.071 3.800 0.874 1.00 0.00 H new ATOM 0 HD2 ARG A 121 11.169 5.613 1.954 1.00 0.00 H new ATOM 0 HD3 ARG A 121 11.572 4.196 2.904 1.00 0.00 H new ATOM 0 HE ARG A 121 13.807 4.524 2.389 1.00 0.00 H new ATOM 0 HH11 ARG A 121 11.783 6.137 -0.011 1.00 0.00 H new ATOM 0 HH12 ARG A 121 13.156 6.882 -0.837 1.00 0.00 H new ATOM 0 HH21 ARG A 121 15.565 5.484 1.323 1.00 0.00 H new ATOM 0 HH22 ARG A 121 15.287 6.514 -0.085 1.00 0.00 H new ATOM 1901 N TYR A 122 11.147 -0.702 0.814 1.00 0.00 N ATOM 1902 CA TYR A 122 11.530 -2.073 1.129 1.00 0.00 C ATOM 1903 C TYR A 122 12.008 -2.805 -0.121 1.00 0.00 C ATOM 1904 O TYR A 122 13.122 -3.329 -0.161 1.00 0.00 O ATOM 1905 CB TYR A 122 10.354 -2.823 1.755 1.00 0.00 C ATOM 1906 CG TYR A 122 10.458 -4.326 1.628 1.00 0.00 C ATOM 1907 CD1 TYR A 122 11.194 -5.071 2.540 1.00 0.00 C ATOM 1908 CD2 TYR A 122 9.818 -5.001 0.595 1.00 0.00 C ATOM 1909 CE1 TYR A 122 11.292 -6.445 2.427 1.00 0.00 C ATOM 1910 CE2 TYR A 122 9.909 -6.374 0.475 1.00 0.00 C ATOM 1911 CZ TYR A 122 10.648 -7.092 1.393 1.00 0.00 C ATOM 1912 OH TYR A 122 10.742 -8.460 1.278 1.00 0.00 O ATOM 0 H TYR A 122 10.286 -0.391 1.264 1.00 0.00 H new ATOM 0 HA TYR A 122 12.351 -2.039 1.845 1.00 0.00 H new ATOM 0 HB2 TYR A 122 10.287 -2.560 2.811 1.00 0.00 H new ATOM 0 HB3 TYR A 122 9.429 -2.490 1.284 1.00 0.00 H new ATOM 0 HD1 TYR A 122 11.699 -4.568 3.352 1.00 0.00 H new ATOM 0 HD2 TYR A 122 9.240 -4.442 -0.126 1.00 0.00 H new ATOM 0 HE1 TYR A 122 11.870 -7.009 3.144 1.00 0.00 H new ATOM 0 HE2 TYR A 122 9.404 -6.883 -0.333 1.00 0.00 H new ATOM 0 HH TYR A 122 11.298 -8.812 2.005 1.00 0.00 H new ATOM 1922 N LYS A 123 11.158 -2.837 -1.142 1.00 0.00 N ATOM 1923 CA LYS A 123 11.491 -3.503 -2.395 1.00 0.00 C ATOM 1924 C LYS A 123 12.495 -2.681 -3.198 1.00 0.00 C ATOM 1925 O LYS A 123 13.546 -3.185 -3.593 1.00 0.00 O ATOM 1926 CB LYS A 123 10.226 -3.734 -3.225 1.00 0.00 C ATOM 1927 CG LYS A 123 10.454 -4.600 -4.452 1.00 0.00 C ATOM 1928 CD LYS A 123 10.484 -6.077 -4.095 1.00 0.00 C ATOM 1929 CE LYS A 123 10.053 -6.943 -5.268 1.00 0.00 C ATOM 1930 NZ LYS A 123 11.205 -7.319 -6.133 1.00 0.00 N ATOM 0 H LYS A 123 10.232 -2.409 -1.126 1.00 0.00 H new ATOM 0 HA LYS A 123 11.943 -4.466 -2.157 1.00 0.00 H new ATOM 0 HB2 LYS A 123 9.469 -4.202 -2.596 1.00 0.00 H new ATOM 0 HB3 LYS A 123 9.827 -2.770 -3.540 1.00 0.00 H new ATOM 0 HG2 LYS A 123 9.663 -4.417 -5.180 1.00 0.00 H new ATOM 0 HG3 LYS A 123 11.395 -4.320 -4.926 1.00 0.00 H new ATOM 0 HD2 LYS A 123 11.491 -6.357 -3.785 1.00 0.00 H new ATOM 0 HD3 LYS A 123 9.827 -6.260 -3.245 1.00 0.00 H new ATOM 0 HE2 LYS A 123 9.570 -7.846 -4.895 1.00 0.00 H new ATOM 0 HE3 LYS A 123 9.313 -6.407 -5.862 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 10.869 -7.909 -6.921 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 11.651 -6.459 -6.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 11.900 -7.852 -5.573 1.00 0.00 H new ATOM 1944 N GLN A 124 12.164 -1.416 -3.433 1.00 0.00 N ATOM 1945 CA GLN A 124 13.038 -0.526 -4.187 1.00 0.00 C ATOM 1946 C GLN A 124 14.505 -0.843 -3.914 1.00 0.00 C ATOM 1947 O GLN A 124 15.328 -0.852 -4.830 1.00 0.00 O ATOM 1948 CB GLN A 124 12.746 0.933 -3.832 1.00 0.00 C ATOM 1949 CG GLN A 124 11.556 1.514 -4.579 1.00 0.00 C ATOM 1950 CD GLN A 124 11.160 2.885 -4.068 1.00 0.00 C ATOM 1951 OE1 GLN A 124 11.639 3.335 -3.027 1.00 0.00 O ATOM 1952 NE2 GLN A 124 10.279 3.558 -4.800 1.00 0.00 N ATOM 0 H GLN A 124 11.297 -0.984 -3.112 1.00 0.00 H new ATOM 0 HA GLN A 124 12.842 -0.681 -5.248 1.00 0.00 H new ATOM 0 HB2 GLN A 124 12.563 1.008 -2.760 1.00 0.00 H new ATOM 0 HB3 GLN A 124 13.629 1.535 -4.048 1.00 0.00 H new ATOM 0 HG2 GLN A 124 11.795 1.581 -5.640 1.00 0.00 H new ATOM 0 HG3 GLN A 124 10.707 0.836 -4.486 1.00 0.00 H new ATOM 0 HE21 GLN A 124 9.907 3.147 -5.656 1.00 0.00 H new ATOM 0 HE22 GLN A 124 9.974 4.486 -4.506 1.00 0.00 H new ATOM 1961 N GLN A 125 14.824 -1.103 -2.651 1.00 0.00 N ATOM 1962 CA GLN A 125 16.192 -1.420 -2.258 1.00 0.00 C ATOM 1963 C GLN A 125 16.562 -2.841 -2.672 1.00 0.00 C ATOM 1964 O GLN A 125 17.564 -3.057 -3.352 1.00 0.00 O ATOM 1965 CB GLN A 125 16.363 -1.255 -0.747 1.00 0.00 C ATOM 1966 CG GLN A 125 17.797 -1.426 -0.275 1.00 0.00 C ATOM 1967 CD GLN A 125 18.136 -2.866 0.055 1.00 0.00 C ATOM 1968 OE1 GLN A 125 18.806 -3.551 -0.718 1.00 0.00 O ATOM 1969 NE2 GLN A 125 17.674 -3.334 1.209 1.00 0.00 N ATOM 0 H GLN A 125 14.154 -1.101 -1.882 1.00 0.00 H new ATOM 0 HA GLN A 125 16.860 -0.727 -2.769 1.00 0.00 H new ATOM 0 HB2 GLN A 125 16.009 -0.266 -0.456 1.00 0.00 H new ATOM 0 HB3 GLN A 125 15.732 -1.983 -0.237 1.00 0.00 H new ATOM 0 HG2 GLN A 125 18.475 -1.065 -1.048 1.00 0.00 H new ATOM 0 HG3 GLN A 125 17.961 -0.807 0.607 1.00 0.00 H new ATOM 0 HE21 GLN A 125 17.122 -2.731 1.820 1.00 0.00 H new ATOM 0 HE22 GLN A 125 17.871 -4.296 1.485 1.00 0.00 H new ATOM 1978 N GLN A 126 15.746 -3.804 -2.256 1.00 0.00 N ATOM 1979 CA GLN A 126 15.989 -5.204 -2.583 1.00 0.00 C ATOM 1980 C GLN A 126 15.578 -5.507 -4.020 1.00 0.00 C ATOM 1981 O GLN A 126 14.461 -5.955 -4.274 1.00 0.00 O ATOM 1982 CB GLN A 126 15.225 -6.115 -1.619 1.00 0.00 C ATOM 1983 CG GLN A 126 15.572 -5.881 -0.158 1.00 0.00 C ATOM 1984 CD GLN A 126 16.755 -6.712 0.301 1.00 0.00 C ATOM 1985 OE1 GLN A 126 17.639 -7.044 -0.489 1.00 0.00 O ATOM 1986 NE2 GLN A 126 16.777 -7.052 1.585 1.00 0.00 N ATOM 0 H GLN A 126 14.912 -3.641 -1.692 1.00 0.00 H new ATOM 0 HA GLN A 126 17.058 -5.394 -2.482 1.00 0.00 H new ATOM 0 HB2 GLN A 126 14.155 -5.962 -1.759 1.00 0.00 H new ATOM 0 HB3 GLN A 126 15.434 -7.154 -1.872 1.00 0.00 H new ATOM 0 HG2 GLN A 126 15.794 -4.825 -0.006 1.00 0.00 H new ATOM 0 HG3 GLN A 126 14.705 -6.117 0.460 1.00 0.00 H new ATOM 0 HE21 GLN A 126 16.023 -6.755 2.204 1.00 0.00 H new ATOM 0 HE22 GLN A 126 17.548 -7.610 1.952 1.00 0.00 H new ATOM 1995 N GLN A 127 16.490 -5.258 -4.955 1.00 0.00 N ATOM 1996 CA GLN A 127 16.221 -5.503 -6.367 1.00 0.00 C ATOM 1997 C GLN A 127 17.519 -5.711 -7.140 1.00 0.00 C ATOM 1998 O GLN A 127 18.561 -5.164 -6.780 1.00 0.00 O ATOM 1999 CB GLN A 127 15.436 -4.336 -6.969 1.00 0.00 C ATOM 2000 CG GLN A 127 16.131 -2.993 -6.816 1.00 0.00 C ATOM 2001 CD GLN A 127 15.327 -1.850 -7.404 1.00 0.00 C ATOM 2002 OE1 GLN A 127 14.100 -1.913 -7.480 1.00 0.00 O ATOM 2003 NE2 GLN A 127 16.017 -0.796 -7.824 1.00 0.00 N ATOM 0 H GLN A 127 17.420 -4.887 -4.760 1.00 0.00 H new ATOM 0 HA GLN A 127 15.624 -6.411 -6.445 1.00 0.00 H new ATOM 0 HB2 GLN A 127 15.268 -4.530 -8.028 1.00 0.00 H new ATOM 0 HB3 GLN A 127 14.456 -4.285 -6.495 1.00 0.00 H new ATOM 0 HG2 GLN A 127 16.311 -2.800 -5.758 1.00 0.00 H new ATOM 0 HG3 GLN A 127 17.105 -3.035 -7.303 1.00 0.00 H new ATOM 0 HE21 GLN A 127 17.034 -0.786 -7.742 1.00 0.00 H new ATOM 0 HE22 GLN A 127 15.530 0.004 -8.229 1.00 0.00 H new ATOM 2012 N GLN A 128 17.448 -6.506 -8.203 1.00 0.00 N ATOM 2013 CA GLN A 128 18.619 -6.786 -9.026 1.00 0.00 C ATOM 2014 C GLN A 128 19.122 -5.517 -9.707 1.00 0.00 C ATOM 2015 O GLN A 128 18.348 -4.644 -10.097 1.00 0.00 O ATOM 2016 CB GLN A 128 18.287 -7.846 -10.078 1.00 0.00 C ATOM 2017 CG GLN A 128 18.275 -9.264 -9.530 1.00 0.00 C ATOM 2018 CD GLN A 128 17.326 -9.429 -8.359 1.00 0.00 C ATOM 2019 OE1 GLN A 128 16.170 -9.008 -8.418 1.00 0.00 O ATOM 2020 NE2 GLN A 128 17.810 -10.044 -7.287 1.00 0.00 N ATOM 0 H GLN A 128 16.593 -6.967 -8.514 1.00 0.00 H new ATOM 0 HA GLN A 128 19.407 -7.164 -8.375 1.00 0.00 H new ATOM 0 HB2 GLN A 128 17.311 -7.624 -10.510 1.00 0.00 H new ATOM 0 HB3 GLN A 128 19.015 -7.784 -10.887 1.00 0.00 H new ATOM 0 HG2 GLN A 128 17.990 -9.954 -10.324 1.00 0.00 H new ATOM 0 HG3 GLN A 128 19.283 -9.537 -9.217 1.00 0.00 H new ATOM 0 HE21 GLN A 128 18.774 -10.377 -7.282 1.00 0.00 H new ATOM 0 HE22 GLN A 128 17.218 -10.184 -6.468 1.00 0.00 H new ATOM 2029 N PRO A 129 20.451 -5.411 -9.853 1.00 0.00 N ATOM 2030 CA PRO A 129 21.088 -4.253 -10.487 1.00 0.00 C ATOM 2031 C PRO A 129 20.820 -4.192 -11.986 1.00 0.00 C ATOM 2032 O PRO A 129 19.720 -4.504 -12.443 1.00 0.00 O ATOM 2033 CB PRO A 129 22.579 -4.477 -10.219 1.00 0.00 C ATOM 2034 CG PRO A 129 22.716 -5.950 -10.048 1.00 0.00 C ATOM 2035 CD PRO A 129 21.435 -6.414 -9.411 1.00 0.00 C ATOM 0 HA PRO A 129 20.706 -3.311 -10.092 1.00 0.00 H new ATOM 0 HB2 PRO A 129 23.189 -4.116 -11.047 1.00 0.00 H new ATOM 0 HB3 PRO A 129 22.905 -3.943 -9.327 1.00 0.00 H new ATOM 0 HG2 PRO A 129 22.875 -6.441 -11.008 1.00 0.00 H new ATOM 0 HG3 PRO A 129 23.574 -6.192 -9.421 1.00 0.00 H new ATOM 0 HD2 PRO A 129 21.163 -7.417 -9.741 1.00 0.00 H new ATOM 0 HD3 PRO A 129 21.515 -6.446 -8.324 1.00 0.00 H new TER 2043 PRO A 129