USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 739 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 ASN : amide:sc= 1.14 K(o=1.5,f=-0.73) USER MOD Set 1.2: A 93 ASN : amide:sc= 0.349 K(o=1.5,f=-1.3) USER MOD Single : A 1 GLY N :NH3+ -117:sc= 0.115 (180deg=0) USER MOD Single : A 3 MET CE :methyl -143:sc= -3.18! (180deg=-4.98!) USER MOD Single : A 6 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0169) USER MOD Single : A 7 SER OG : rot 180:sc= 0 USER MOD Single : A 8 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 15 LYS NZ :NH3+ 174:sc=-0.00887 (180deg=-0.0893) USER MOD Single : A 17 SER OG : rot 122:sc= 1.36 USER MOD Single : A 20 GLN : amide:sc= -0.596 K(o=-0.6,f=-6.6!) USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 68:sc= 0.366 USER MOD Single : A 23 HIS : no HD1:sc= -1.58 X(o=-1.6,f=-1.8) USER MOD Single : A 28 LYS NZ :NH3+ -136:sc= 0.965 (180deg=-0.379) USER MOD Single : A 33 ASN : amide:sc= -0.0123 K(o=-0.012,f=-6.7!) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 TYR OH : rot 180:sc= -0.571 USER MOD Single : A 46 SER OG : rot 180:sc= 0 USER MOD Single : A 47 LYS NZ :NH3+ -157:sc= 1.29 (180deg=0.825) USER MOD Single : A 49 LYS NZ :NH3+ -137:sc= 0.271 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 103:sc= 1.22 USER MOD Single : A 54 HIS : no HD1:sc= 0.428 K(o=0.43,f=-4!) USER MOD Single : A 56 LYS NZ :NH3+ -176:sc= 2.35 (180deg=2.23) USER MOD Single : A 57 SER OG : rot 180:sc= 0 USER MOD Single : A 61 LYS NZ :NH3+ -118:sc= -0.346 (180deg=-1.71!) USER MOD Single : A 63 ASN : amide:sc= 0.973 K(o=0.97,f=-0.68) USER MOD Single : A 65 ASN : amide:sc= -0.018 K(o=-0.018,f=-1) USER MOD Single : A 69 GLN : amide:sc= 0.625 K(o=0.62,f=-0.48) USER MOD Single : A 70 GLN : amide:sc= 1.18 K(o=1.2,f=-0.23) USER MOD Single : A 71 LYS NZ :NH3+ -146:sc= 0.672 (180deg=0.153) USER MOD Single : A 72 THR OG1 : rot 89:sc= 1.22 USER MOD Single : A 73 THR OG1 : rot 72:sc= 0.164 USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 GLN : amide:sc= -1.37! K(o=-1.4!,f=0) USER MOD Single : A 77 THR OG1 : rot 180:sc= 0 USER MOD Single : A 79 GLN : amide:sc= -1.8 K(o=-1.8,f=-2.8!) USER MOD Single : A 83 SER OG : rot -105:sc= 0.49 USER MOD Single : A 91 SER OG : rot 180:sc= 0.0531 USER MOD Single : A 96 THR OG1 : rot -178:sc= -0.733 USER MOD Single : A 97 THR OG1 : rot 180:sc= 0 USER MOD Single : A 100 ASN : amide:sc= -0.0278 X(o=-0.028,f=0) USER MOD Single : A 102 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 1.626 1.371 -8.103 1.00 0.00 N ATOM 2 CA GLY A 1 1.368 0.014 -7.573 1.00 0.00 C ATOM 3 C GLY A 1 2.494 -0.935 -7.909 1.00 0.00 C ATOM 4 O GLY A 1 3.355 -0.602 -8.726 1.00 0.00 O ATOM 0 H1 GLY A 1 1.702 2.043 -7.313 1.00 0.00 H new ATOM 0 H2 GLY A 1 2.515 1.369 -8.644 1.00 0.00 H new ATOM 0 H3 GLY A 1 0.843 1.655 -8.725 1.00 0.00 H new ATOM 0 HA2 GLY A 1 1.242 0.063 -6.491 1.00 0.00 H new ATOM 0 HA3 GLY A 1 0.434 -0.367 -7.986 1.00 0.00 H new ATOM 7 N ALA A 2 2.481 -2.112 -7.283 1.00 0.00 N ATOM 8 CA ALA A 2 3.514 -3.126 -7.487 1.00 0.00 C ATOM 9 C ALA A 2 4.916 -2.533 -7.374 1.00 0.00 C ATOM 10 O ALA A 2 5.616 -2.357 -8.373 1.00 0.00 O ATOM 11 CB ALA A 2 3.332 -3.823 -8.828 1.00 0.00 C ATOM 0 H ALA A 2 1.755 -2.388 -6.622 1.00 0.00 H new ATOM 0 HA ALA A 2 3.405 -3.867 -6.695 1.00 0.00 H new ATOM 0 HB1 ALA A 2 4.112 -4.573 -8.957 1.00 0.00 H new ATOM 0 HB2 ALA A 2 2.356 -4.307 -8.857 1.00 0.00 H new ATOM 0 HB3 ALA A 2 3.398 -3.089 -9.631 1.00 0.00 H new ATOM 17 N MET A 3 5.310 -2.197 -6.156 1.00 0.00 N ATOM 18 CA MET A 3 6.616 -1.593 -5.925 1.00 0.00 C ATOM 19 C MET A 3 7.674 -2.672 -5.707 1.00 0.00 C ATOM 20 O MET A 3 8.867 -2.386 -5.636 1.00 0.00 O ATOM 21 CB MET A 3 6.560 -0.645 -4.720 1.00 0.00 C ATOM 22 CG MET A 3 7.854 0.126 -4.448 1.00 0.00 C ATOM 23 SD MET A 3 8.209 1.426 -5.661 1.00 0.00 S ATOM 24 CE MET A 3 8.790 0.485 -7.072 1.00 0.00 C ATOM 0 H MET A 3 4.749 -2.331 -5.315 1.00 0.00 H new ATOM 0 HA MET A 3 6.891 -1.016 -6.808 1.00 0.00 H new ATOM 0 HB2 MET A 3 5.753 0.071 -4.876 1.00 0.00 H new ATOM 0 HB3 MET A 3 6.305 -1.224 -3.832 1.00 0.00 H new ATOM 0 HG2 MET A 3 7.795 0.575 -3.457 1.00 0.00 H new ATOM 0 HG3 MET A 3 8.687 -0.577 -4.431 1.00 0.00 H new ATOM 0 HE1 MET A 3 9.594 1.030 -7.567 1.00 0.00 H new ATOM 0 HE2 MET A 3 9.161 -0.483 -6.736 1.00 0.00 H new ATOM 0 HE3 MET A 3 7.968 0.335 -7.772 1.00 0.00 H new ATOM 34 N GLY A 4 7.236 -3.915 -5.616 1.00 0.00 N ATOM 35 CA GLY A 4 8.163 -5.001 -5.405 1.00 0.00 C ATOM 36 C GLY A 4 8.266 -5.902 -6.615 1.00 0.00 C ATOM 37 O GLY A 4 7.850 -5.522 -7.715 1.00 0.00 O ATOM 0 H GLY A 4 6.256 -4.191 -5.684 1.00 0.00 H new ATOM 0 HA2 GLY A 4 9.147 -4.597 -5.169 1.00 0.00 H new ATOM 0 HA3 GLY A 4 7.845 -5.587 -4.543 1.00 0.00 H new ATOM 41 N PRO A 5 8.822 -7.107 -6.441 1.00 0.00 N ATOM 42 CA PRO A 5 8.918 -8.092 -7.512 1.00 0.00 C ATOM 43 C PRO A 5 7.590 -8.809 -7.717 1.00 0.00 C ATOM 44 O PRO A 5 6.577 -8.416 -7.131 1.00 0.00 O ATOM 45 CB PRO A 5 9.977 -9.062 -6.989 1.00 0.00 C ATOM 46 CG PRO A 5 9.841 -9.007 -5.508 1.00 0.00 C ATOM 47 CD PRO A 5 9.390 -7.608 -5.174 1.00 0.00 C ATOM 0 HA PRO A 5 9.169 -7.652 -8.477 1.00 0.00 H new ATOM 0 HB2 PRO A 5 9.810 -10.071 -7.365 1.00 0.00 H new ATOM 0 HB3 PRO A 5 10.977 -8.765 -7.306 1.00 0.00 H new ATOM 0 HG2 PRO A 5 9.117 -9.743 -5.157 1.00 0.00 H new ATOM 0 HG3 PRO A 5 10.789 -9.236 -5.022 1.00 0.00 H new ATOM 0 HD2 PRO A 5 8.648 -7.607 -4.375 1.00 0.00 H new ATOM 0 HD3 PRO A 5 10.222 -6.990 -4.837 1.00 0.00 H new ATOM 55 N LYS A 6 7.585 -9.849 -8.545 1.00 0.00 N ATOM 56 CA LYS A 6 6.397 -10.670 -8.697 1.00 0.00 C ATOM 57 C LYS A 6 6.034 -11.250 -7.344 1.00 0.00 C ATOM 58 O LYS A 6 6.791 -12.031 -6.766 1.00 0.00 O ATOM 59 CB LYS A 6 6.609 -11.793 -9.705 1.00 0.00 C ATOM 60 CG LYS A 6 7.083 -11.325 -11.069 1.00 0.00 C ATOM 61 CD LYS A 6 6.721 -12.326 -12.158 1.00 0.00 C ATOM 62 CE LYS A 6 7.064 -13.753 -11.759 1.00 0.00 C ATOM 63 NZ LYS A 6 8.514 -13.931 -11.481 1.00 0.00 N ATOM 0 H LYS A 6 8.381 -10.138 -9.113 1.00 0.00 H new ATOM 0 HA LYS A 6 5.588 -10.045 -9.075 1.00 0.00 H new ATOM 0 HB2 LYS A 6 7.338 -12.496 -9.301 1.00 0.00 H new ATOM 0 HB3 LYS A 6 5.673 -12.339 -9.826 1.00 0.00 H new ATOM 0 HG2 LYS A 6 6.636 -10.358 -11.299 1.00 0.00 H new ATOM 0 HG3 LYS A 6 8.163 -11.180 -11.050 1.00 0.00 H new ATOM 0 HD2 LYS A 6 5.655 -12.257 -12.374 1.00 0.00 H new ATOM 0 HD3 LYS A 6 7.250 -12.070 -13.076 1.00 0.00 H new ATOM 0 HE2 LYS A 6 6.491 -14.028 -10.874 1.00 0.00 H new ATOM 0 HE3 LYS A 6 6.764 -14.433 -12.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 6 8.708 -14.933 -11.280 1.00 0.00 H new ATOM 0 HZ2 LYS A 6 9.066 -13.631 -12.310 1.00 0.00 H new ATOM 0 HZ3 LYS A 6 8.783 -13.354 -10.659 1.00 0.00 H new ATOM 77 N SER A 7 4.885 -10.857 -6.841 1.00 0.00 N ATOM 78 CA SER A 7 4.519 -11.162 -5.473 1.00 0.00 C ATOM 79 C SER A 7 3.924 -12.561 -5.375 1.00 0.00 C ATOM 80 O SER A 7 3.651 -13.197 -6.391 1.00 0.00 O ATOM 81 CB SER A 7 3.532 -10.111 -4.978 1.00 0.00 C ATOM 82 OG SER A 7 3.995 -8.808 -5.304 1.00 0.00 O ATOM 0 H SER A 7 4.186 -10.324 -7.359 1.00 0.00 H new ATOM 0 HA SER A 7 5.409 -11.141 -4.844 1.00 0.00 H new ATOM 0 HB2 SER A 7 2.554 -10.280 -5.428 1.00 0.00 H new ATOM 0 HB3 SER A 7 3.406 -10.200 -3.899 1.00 0.00 H new ATOM 0 HG SER A 7 3.352 -8.142 -4.982 1.00 0.00 H new ATOM 88 N LYS A 8 3.713 -13.039 -4.157 1.00 0.00 N ATOM 89 CA LYS A 8 3.122 -14.354 -3.956 1.00 0.00 C ATOM 90 C LYS A 8 1.696 -14.364 -4.492 1.00 0.00 C ATOM 91 O LYS A 8 1.210 -15.381 -4.979 1.00 0.00 O ATOM 92 CB LYS A 8 3.136 -14.720 -2.473 1.00 0.00 C ATOM 93 CG LYS A 8 4.528 -14.772 -1.864 1.00 0.00 C ATOM 94 CD LYS A 8 4.460 -14.918 -0.354 1.00 0.00 C ATOM 95 CE LYS A 8 5.838 -14.861 0.287 1.00 0.00 C ATOM 96 NZ LYS A 8 6.664 -16.051 -0.042 1.00 0.00 N ATOM 0 H LYS A 8 3.941 -12.539 -3.298 1.00 0.00 H new ATOM 0 HA LYS A 8 3.709 -15.095 -4.498 1.00 0.00 H new ATOM 0 HB2 LYS A 8 2.537 -13.994 -1.924 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.657 -15.691 -2.344 1.00 0.00 H new ATOM 0 HG2 LYS A 8 5.083 -15.609 -2.289 1.00 0.00 H new ATOM 0 HG3 LYS A 8 5.074 -13.864 -2.120 1.00 0.00 H new ATOM 0 HD2 LYS A 8 3.835 -14.126 0.059 1.00 0.00 H new ATOM 0 HD3 LYS A 8 3.982 -15.865 -0.103 1.00 0.00 H new ATOM 0 HE2 LYS A 8 6.354 -13.960 -0.046 1.00 0.00 H new ATOM 0 HE3 LYS A 8 5.730 -14.785 1.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 7.593 -15.966 0.417 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 6.187 -16.910 0.298 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 6.791 -16.111 -1.072 1.00 0.00 H new ATOM 110 N GLU A 9 1.046 -13.203 -4.420 1.00 0.00 N ATOM 111 CA GLU A 9 -0.290 -13.021 -4.981 1.00 0.00 C ATOM 112 C GLU A 9 -0.248 -13.203 -6.495 1.00 0.00 C ATOM 113 O GLU A 9 -1.238 -13.566 -7.123 1.00 0.00 O ATOM 114 CB GLU A 9 -0.815 -11.618 -4.646 1.00 0.00 C ATOM 115 CG GLU A 9 -0.061 -10.503 -5.361 1.00 0.00 C ATOM 116 CD GLU A 9 -0.436 -9.119 -4.877 1.00 0.00 C ATOM 117 OE1 GLU A 9 0.355 -8.523 -4.123 1.00 0.00 O ATOM 118 OE2 GLU A 9 -1.519 -8.614 -5.252 1.00 0.00 O ATOM 0 H GLU A 9 1.428 -12.369 -3.975 1.00 0.00 H new ATOM 0 HA GLU A 9 -0.957 -13.766 -4.547 1.00 0.00 H new ATOM 0 HB2 GLU A 9 -1.871 -11.560 -4.911 1.00 0.00 H new ATOM 0 HB3 GLU A 9 -0.747 -11.460 -3.570 1.00 0.00 H new ATOM 0 HG2 GLU A 9 1.010 -10.651 -5.222 1.00 0.00 H new ATOM 0 HG3 GLU A 9 -0.256 -10.571 -6.431 1.00 0.00 H new ATOM 125 N GLU A 10 0.924 -12.961 -7.061 1.00 0.00 N ATOM 126 CA GLU A 10 1.119 -12.997 -8.493 1.00 0.00 C ATOM 127 C GLU A 10 1.436 -14.416 -8.939 1.00 0.00 C ATOM 128 O GLU A 10 0.907 -14.898 -9.934 1.00 0.00 O ATOM 129 CB GLU A 10 2.249 -12.043 -8.868 1.00 0.00 C ATOM 130 CG GLU A 10 2.199 -11.557 -10.299 1.00 0.00 C ATOM 131 CD GLU A 10 3.149 -10.408 -10.541 1.00 0.00 C ATOM 132 OE1 GLU A 10 3.554 -9.750 -9.559 1.00 0.00 O ATOM 133 OE2 GLU A 10 3.482 -10.148 -11.713 1.00 0.00 O ATOM 0 H GLU A 10 1.767 -12.734 -6.534 1.00 0.00 H new ATOM 0 HA GLU A 10 0.207 -12.680 -8.999 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.218 -11.181 -8.202 1.00 0.00 H new ATOM 0 HB3 GLU A 10 3.203 -12.543 -8.699 1.00 0.00 H new ATOM 0 HG2 GLU A 10 2.447 -12.380 -10.970 1.00 0.00 H new ATOM 0 HG3 GLU A 10 1.183 -11.244 -10.540 1.00 0.00 H new ATOM 140 N LEU A 11 2.282 -15.089 -8.175 1.00 0.00 N ATOM 141 CA LEU A 11 2.641 -16.471 -8.467 1.00 0.00 C ATOM 142 C LEU A 11 1.441 -17.385 -8.244 1.00 0.00 C ATOM 143 O LEU A 11 1.228 -18.350 -8.977 1.00 0.00 O ATOM 144 CB LEU A 11 3.805 -16.914 -7.576 1.00 0.00 C ATOM 145 CG LEU A 11 5.037 -16.007 -7.609 1.00 0.00 C ATOM 146 CD1 LEU A 11 6.102 -16.513 -6.647 1.00 0.00 C ATOM 147 CD2 LEU A 11 5.593 -15.917 -9.020 1.00 0.00 C ATOM 0 H LEU A 11 2.734 -14.702 -7.347 1.00 0.00 H new ATOM 0 HA LEU A 11 2.948 -16.538 -9.511 1.00 0.00 H new ATOM 0 HB2 LEU A 11 3.449 -16.979 -6.548 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.106 -17.919 -7.873 1.00 0.00 H new ATOM 0 HG LEU A 11 4.736 -15.008 -7.292 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.970 -15.854 -6.686 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.701 -16.525 -5.634 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.400 -17.522 -6.932 1.00 0.00 H new ATOM 0 HD21 LEU A 11 6.469 -15.268 -9.025 1.00 0.00 H new ATOM 0 HD22 LEU A 11 5.876 -16.912 -9.364 1.00 0.00 H new ATOM 0 HD23 LEU A 11 4.833 -15.506 -9.685 1.00 0.00 H new ATOM 159 N LEU A 12 0.654 -17.067 -7.227 1.00 0.00 N ATOM 160 CA LEU A 12 -0.528 -17.849 -6.895 1.00 0.00 C ATOM 161 C LEU A 12 -1.663 -17.568 -7.872 1.00 0.00 C ATOM 162 O LEU A 12 -2.482 -18.439 -8.139 1.00 0.00 O ATOM 163 CB LEU A 12 -0.975 -17.529 -5.468 1.00 0.00 C ATOM 164 CG LEU A 12 -2.218 -18.271 -4.981 1.00 0.00 C ATOM 165 CD1 LEU A 12 -1.956 -19.765 -4.882 1.00 0.00 C ATOM 166 CD2 LEU A 12 -2.666 -17.711 -3.643 1.00 0.00 C ATOM 0 H LEU A 12 0.814 -16.268 -6.614 1.00 0.00 H new ATOM 0 HA LEU A 12 -0.272 -18.906 -6.968 1.00 0.00 H new ATOM 0 HB2 LEU A 12 -0.152 -17.753 -4.790 1.00 0.00 H new ATOM 0 HB3 LEU A 12 -1.163 -16.458 -5.397 1.00 0.00 H new ATOM 0 HG LEU A 12 -3.017 -18.123 -5.707 1.00 0.00 H new ATOM 0 HD11 LEU A 12 -2.857 -20.270 -4.533 1.00 0.00 H new ATOM 0 HD12 LEU A 12 -1.680 -20.152 -5.863 1.00 0.00 H new ATOM 0 HD13 LEU A 12 -1.143 -19.946 -4.179 1.00 0.00 H new ATOM 0 HD21 LEU A 12 -3.553 -18.246 -3.303 1.00 0.00 H new ATOM 0 HD22 LEU A 12 -1.867 -17.832 -2.912 1.00 0.00 H new ATOM 0 HD23 LEU A 12 -2.900 -16.652 -3.752 1.00 0.00 H new ATOM 178 N ARG A 13 -1.712 -16.361 -8.419 1.00 0.00 N ATOM 179 CA ARG A 13 -2.766 -16.025 -9.368 1.00 0.00 C ATOM 180 C ARG A 13 -2.521 -16.737 -10.698 1.00 0.00 C ATOM 181 O ARG A 13 -3.415 -16.832 -11.531 1.00 0.00 O ATOM 182 CB ARG A 13 -2.891 -14.510 -9.562 1.00 0.00 C ATOM 183 CG ARG A 13 -1.836 -13.896 -10.465 1.00 0.00 C ATOM 184 CD ARG A 13 -1.816 -12.381 -10.350 1.00 0.00 C ATOM 185 NE ARG A 13 -3.120 -11.781 -10.644 1.00 0.00 N ATOM 186 CZ ARG A 13 -3.725 -10.881 -9.862 1.00 0.00 C ATOM 187 NH1 ARG A 13 -3.175 -10.514 -8.711 1.00 0.00 N ATOM 188 NH2 ARG A 13 -4.883 -10.355 -10.227 1.00 0.00 N ATOM 0 H ARG A 13 -1.048 -15.611 -8.227 1.00 0.00 H new ATOM 0 HA ARG A 13 -3.715 -16.371 -8.959 1.00 0.00 H new ATOM 0 HB2 ARG A 13 -3.876 -14.290 -9.975 1.00 0.00 H new ATOM 0 HB3 ARG A 13 -2.840 -14.027 -8.586 1.00 0.00 H new ATOM 0 HG2 ARG A 13 -0.856 -14.294 -10.204 1.00 0.00 H new ATOM 0 HG3 ARG A 13 -2.031 -14.181 -11.499 1.00 0.00 H new ATOM 0 HD2 ARG A 13 -1.509 -12.100 -9.343 1.00 0.00 H new ATOM 0 HD3 ARG A 13 -1.071 -11.977 -11.035 1.00 0.00 H new ATOM 0 HE ARG A 13 -3.596 -12.068 -11.499 1.00 0.00 H new ATOM 0 HH11 ARG A 13 -2.286 -10.919 -8.419 1.00 0.00 H new ATOM 0 HH12 ARG A 13 -3.642 -9.827 -8.119 1.00 0.00 H new ATOM 0 HH21 ARG A 13 -5.316 -10.636 -11.107 1.00 0.00 H new ATOM 0 HH22 ARG A 13 -5.343 -9.669 -9.629 1.00 0.00 H new ATOM 202 N GLU A 14 -1.304 -17.246 -10.882 1.00 0.00 N ATOM 203 CA GLU A 14 -1.006 -18.118 -12.012 1.00 0.00 C ATOM 204 C GLU A 14 -1.688 -19.467 -11.796 1.00 0.00 C ATOM 205 O GLU A 14 -2.013 -20.183 -12.744 1.00 0.00 O ATOM 206 CB GLU A 14 0.505 -18.333 -12.162 1.00 0.00 C ATOM 207 CG GLU A 14 1.316 -17.054 -12.298 1.00 0.00 C ATOM 208 CD GLU A 14 2.787 -17.333 -12.540 1.00 0.00 C ATOM 209 OE1 GLU A 14 3.551 -17.433 -11.559 1.00 0.00 O ATOM 210 OE2 GLU A 14 3.184 -17.472 -13.718 1.00 0.00 O ATOM 0 H GLU A 14 -0.512 -17.069 -10.264 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.377 -17.645 -12.921 1.00 0.00 H new ATOM 0 HB2 GLU A 14 0.868 -18.887 -11.296 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.685 -18.957 -13.038 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.920 -16.460 -13.122 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.205 -16.457 -11.393 1.00 0.00 H new ATOM 217 N LYS A 15 -1.907 -19.789 -10.527 1.00 0.00 N ATOM 218 CA LYS A 15 -2.501 -21.057 -10.125 1.00 0.00 C ATOM 219 C LYS A 15 -4.018 -20.946 -10.110 1.00 0.00 C ATOM 220 O LYS A 15 -4.737 -21.939 -10.210 1.00 0.00 O ATOM 221 CB LYS A 15 -2.023 -21.428 -8.725 1.00 0.00 C ATOM 222 CG LYS A 15 -0.558 -21.129 -8.493 1.00 0.00 C ATOM 223 CD LYS A 15 0.342 -21.981 -9.365 1.00 0.00 C ATOM 224 CE LYS A 15 1.793 -21.536 -9.275 1.00 0.00 C ATOM 225 NZ LYS A 15 2.309 -21.593 -7.882 1.00 0.00 N ATOM 0 H LYS A 15 -1.677 -19.176 -9.745 1.00 0.00 H new ATOM 0 HA LYS A 15 -2.199 -21.823 -10.839 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -2.618 -20.886 -7.990 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -2.201 -22.490 -8.558 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -0.367 -20.075 -8.696 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -0.315 -21.301 -7.444 1.00 0.00 H new ATOM 0 HD2 LYS A 15 0.261 -23.025 -9.061 1.00 0.00 H new ATOM 0 HD3 LYS A 15 0.007 -21.923 -10.401 1.00 0.00 H new ATOM 0 HE2 LYS A 15 2.407 -22.170 -9.915 1.00 0.00 H new ATOM 0 HE3 LYS A 15 1.884 -20.518 -9.654 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 3.327 -21.380 -7.880 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 1.808 -20.894 -7.297 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 2.154 -22.545 -7.493 1.00 0.00 H new ATOM 239 N LEU A 16 -4.487 -19.717 -9.976 1.00 0.00 N ATOM 240 CA LEU A 16 -5.896 -19.445 -9.769 1.00 0.00 C ATOM 241 C LEU A 16 -6.598 -19.152 -11.085 1.00 0.00 C ATOM 242 O LEU A 16 -5.978 -18.696 -12.046 1.00 0.00 O ATOM 243 CB LEU A 16 -6.055 -18.249 -8.825 1.00 0.00 C ATOM 244 CG LEU A 16 -5.442 -18.421 -7.434 1.00 0.00 C ATOM 245 CD1 LEU A 16 -5.564 -17.130 -6.638 1.00 0.00 C ATOM 246 CD2 LEU A 16 -6.110 -19.569 -6.695 1.00 0.00 C ATOM 0 H LEU A 16 -3.902 -18.882 -10.008 1.00 0.00 H new ATOM 0 HA LEU A 16 -6.354 -20.330 -9.327 1.00 0.00 H new ATOM 0 HB2 LEU A 16 -5.605 -17.375 -9.296 1.00 0.00 H new ATOM 0 HB3 LEU A 16 -7.118 -18.038 -8.711 1.00 0.00 H new ATOM 0 HG LEU A 16 -4.384 -18.657 -7.549 1.00 0.00 H new ATOM 0 HD11 LEU A 16 -5.123 -17.268 -5.651 1.00 0.00 H new ATOM 0 HD12 LEU A 16 -5.040 -16.330 -7.160 1.00 0.00 H new ATOM 0 HD13 LEU A 16 -6.616 -16.866 -6.532 1.00 0.00 H new ATOM 0 HD21 LEU A 16 -5.661 -19.676 -5.708 1.00 0.00 H new ATOM 0 HD22 LEU A 16 -7.175 -19.363 -6.589 1.00 0.00 H new ATOM 0 HD23 LEU A 16 -5.974 -20.492 -7.258 1.00 0.00 H new ATOM 258 N SER A 17 -7.890 -19.421 -11.119 1.00 0.00 N ATOM 259 CA SER A 17 -8.716 -19.079 -12.260 1.00 0.00 C ATOM 260 C SER A 17 -9.171 -17.619 -12.155 1.00 0.00 C ATOM 261 O SER A 17 -8.850 -16.938 -11.180 1.00 0.00 O ATOM 262 CB SER A 17 -9.902 -20.044 -12.331 1.00 0.00 C ATOM 263 OG SER A 17 -10.370 -20.360 -11.032 1.00 0.00 O ATOM 0 H SER A 17 -8.394 -19.880 -10.360 1.00 0.00 H new ATOM 0 HA SER A 17 -8.144 -19.177 -13.183 1.00 0.00 H new ATOM 0 HB2 SER A 17 -10.707 -19.596 -12.914 1.00 0.00 H new ATOM 0 HB3 SER A 17 -9.604 -20.957 -12.847 1.00 0.00 H new ATOM 0 HG SER A 17 -11.313 -20.106 -10.953 1.00 0.00 H new ATOM 269 N GLU A 18 -9.929 -17.144 -13.137 1.00 0.00 N ATOM 270 CA GLU A 18 -10.250 -15.723 -13.233 1.00 0.00 C ATOM 271 C GLU A 18 -11.160 -15.290 -12.095 1.00 0.00 C ATOM 272 O GLU A 18 -11.076 -14.164 -11.598 1.00 0.00 O ATOM 273 CB GLU A 18 -10.909 -15.429 -14.576 1.00 0.00 C ATOM 274 CG GLU A 18 -10.038 -15.799 -15.762 1.00 0.00 C ATOM 275 CD GLU A 18 -10.728 -15.568 -17.086 1.00 0.00 C ATOM 276 OE1 GLU A 18 -11.449 -16.474 -17.548 1.00 0.00 O ATOM 277 OE2 GLU A 18 -10.550 -14.481 -17.671 1.00 0.00 O ATOM 0 H GLU A 18 -10.332 -17.719 -13.876 1.00 0.00 H new ATOM 0 HA GLU A 18 -9.322 -15.156 -13.157 1.00 0.00 H new ATOM 0 HB2 GLU A 18 -11.850 -15.976 -14.639 1.00 0.00 H new ATOM 0 HB3 GLU A 18 -11.153 -14.368 -14.629 1.00 0.00 H new ATOM 0 HG2 GLU A 18 -9.119 -15.214 -15.729 1.00 0.00 H new ATOM 0 HG3 GLU A 18 -9.752 -16.848 -15.684 1.00 0.00 H new ATOM 284 N ASP A 19 -12.012 -16.204 -11.677 1.00 0.00 N ATOM 285 CA ASP A 19 -12.936 -15.960 -10.587 1.00 0.00 C ATOM 286 C ASP A 19 -12.187 -15.893 -9.262 1.00 0.00 C ATOM 287 O ASP A 19 -12.423 -15.000 -8.450 1.00 0.00 O ATOM 288 CB ASP A 19 -14.011 -17.051 -10.563 1.00 0.00 C ATOM 289 CG ASP A 19 -13.455 -18.449 -10.355 1.00 0.00 C ATOM 290 OD1 ASP A 19 -12.383 -18.758 -10.914 1.00 0.00 O ATOM 291 OD2 ASP A 19 -14.109 -19.257 -9.666 1.00 0.00 O ATOM 0 H ASP A 19 -12.084 -17.137 -12.083 1.00 0.00 H new ATOM 0 HA ASP A 19 -13.427 -14.999 -10.740 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -14.723 -16.830 -9.768 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -14.564 -17.025 -11.502 1.00 0.00 H new ATOM 296 N GLN A 20 -11.248 -16.814 -9.081 1.00 0.00 N ATOM 297 CA GLN A 20 -10.434 -16.864 -7.874 1.00 0.00 C ATOM 298 C GLN A 20 -9.591 -15.597 -7.719 1.00 0.00 C ATOM 299 O GLN A 20 -9.468 -15.054 -6.621 1.00 0.00 O ATOM 300 CB GLN A 20 -9.512 -18.080 -7.913 1.00 0.00 C ATOM 301 CG GLN A 20 -10.232 -19.419 -7.951 1.00 0.00 C ATOM 302 CD GLN A 20 -10.973 -19.743 -6.670 1.00 0.00 C ATOM 303 OE1 GLN A 20 -11.472 -18.861 -5.976 1.00 0.00 O ATOM 304 NE2 GLN A 20 -11.037 -21.021 -6.341 1.00 0.00 N ATOM 0 H GLN A 20 -11.031 -17.542 -9.762 1.00 0.00 H new ATOM 0 HA GLN A 20 -11.109 -16.939 -7.022 1.00 0.00 H new ATOM 0 HB2 GLN A 20 -8.868 -18.003 -8.789 1.00 0.00 H new ATOM 0 HB3 GLN A 20 -8.863 -18.056 -7.038 1.00 0.00 H new ATOM 0 HG2 GLN A 20 -10.939 -19.419 -8.780 1.00 0.00 H new ATOM 0 HG3 GLN A 20 -9.506 -20.207 -8.151 1.00 0.00 H new ATOM 0 HE21 GLN A 20 -10.610 -21.725 -6.943 1.00 0.00 H new ATOM 0 HE22 GLN A 20 -11.513 -21.304 -5.485 1.00 0.00 H new ATOM 313 N LYS A 21 -9.012 -15.128 -8.830 1.00 0.00 N ATOM 314 CA LYS A 21 -8.154 -13.937 -8.819 1.00 0.00 C ATOM 315 C LYS A 21 -8.910 -12.718 -8.301 1.00 0.00 C ATOM 316 O LYS A 21 -8.339 -11.857 -7.629 1.00 0.00 O ATOM 317 CB LYS A 21 -7.616 -13.637 -10.222 1.00 0.00 C ATOM 318 CG LYS A 21 -6.810 -14.771 -10.830 1.00 0.00 C ATOM 319 CD LYS A 21 -6.321 -14.421 -12.226 1.00 0.00 C ATOM 320 CE LYS A 21 -5.733 -15.634 -12.922 1.00 0.00 C ATOM 321 NZ LYS A 21 -5.130 -15.295 -14.237 1.00 0.00 N ATOM 0 H LYS A 21 -9.122 -15.555 -9.750 1.00 0.00 H new ATOM 0 HA LYS A 21 -7.319 -14.147 -8.151 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -8.454 -13.407 -10.880 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -6.992 -12.745 -10.177 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -5.957 -14.996 -10.190 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -7.422 -15.672 -10.873 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.148 -14.026 -12.815 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -5.569 -13.634 -12.164 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -4.974 -16.084 -12.282 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -6.513 -16.381 -13.065 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -4.742 -16.156 -14.673 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -5.858 -14.890 -14.859 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -4.367 -14.602 -14.101 1.00 0.00 H new ATOM 335 N THR A 22 -10.198 -12.665 -8.603 1.00 0.00 N ATOM 336 CA THR A 22 -11.029 -11.541 -8.210 1.00 0.00 C ATOM 337 C THR A 22 -11.133 -11.447 -6.686 1.00 0.00 C ATOM 338 O THR A 22 -11.040 -10.361 -6.110 1.00 0.00 O ATOM 339 CB THR A 22 -12.439 -11.659 -8.826 1.00 0.00 C ATOM 340 OG1 THR A 22 -12.336 -11.795 -10.253 1.00 0.00 O ATOM 341 CG2 THR A 22 -13.289 -10.441 -8.494 1.00 0.00 C ATOM 0 H THR A 22 -10.691 -13.392 -9.122 1.00 0.00 H new ATOM 0 HA THR A 22 -10.558 -10.633 -8.585 1.00 0.00 H new ATOM 0 HB THR A 22 -12.920 -12.541 -8.403 1.00 0.00 H new ATOM 0 HG1 THR A 22 -11.934 -12.662 -10.471 1.00 0.00 H new ATOM 0 HG21 THR A 22 -14.276 -10.553 -8.942 1.00 0.00 H new ATOM 0 HG22 THR A 22 -13.389 -10.351 -7.412 1.00 0.00 H new ATOM 0 HG23 THR A 22 -12.811 -9.545 -8.890 1.00 0.00 H new ATOM 349 N HIS A 23 -11.299 -12.589 -6.035 1.00 0.00 N ATOM 350 CA HIS A 23 -11.446 -12.622 -4.585 1.00 0.00 C ATOM 351 C HIS A 23 -10.085 -12.635 -3.903 1.00 0.00 C ATOM 352 O HIS A 23 -9.954 -12.247 -2.741 1.00 0.00 O ATOM 353 CB HIS A 23 -12.280 -13.833 -4.175 1.00 0.00 C ATOM 354 CG HIS A 23 -13.657 -13.788 -4.756 1.00 0.00 C ATOM 355 ND1 HIS A 23 -14.020 -14.597 -5.799 1.00 0.00 N ATOM 356 CD2 HIS A 23 -14.697 -12.986 -4.436 1.00 0.00 C ATOM 357 CE1 HIS A 23 -15.264 -14.273 -6.095 1.00 0.00 C ATOM 358 NE2 HIS A 23 -15.721 -13.297 -5.297 1.00 0.00 N ATOM 0 H HIS A 23 -11.335 -13.504 -6.485 1.00 0.00 H new ATOM 0 HA HIS A 23 -11.965 -11.719 -4.263 1.00 0.00 H new ATOM 0 HB2 HIS A 23 -11.779 -14.745 -4.500 1.00 0.00 H new ATOM 0 HB3 HIS A 23 -12.347 -13.876 -3.088 1.00 0.00 H new ATOM 0 HD2 HIS A 23 -14.719 -12.243 -3.653 1.00 0.00 H new ATOM 0 HE1 HIS A 23 -15.842 -14.736 -6.881 1.00 0.00 H new ATOM 0 HE2 HIS A 23 -16.647 -12.870 -5.324 1.00 0.00 H new ATOM 366 N LEU A 24 -9.074 -13.070 -4.641 1.00 0.00 N ATOM 367 CA LEU A 24 -7.697 -13.018 -4.175 1.00 0.00 C ATOM 368 C LEU A 24 -7.311 -11.564 -3.901 1.00 0.00 C ATOM 369 O LEU A 24 -6.833 -11.226 -2.818 1.00 0.00 O ATOM 370 CB LEU A 24 -6.775 -13.662 -5.230 1.00 0.00 C ATOM 371 CG LEU A 24 -5.305 -13.885 -4.837 1.00 0.00 C ATOM 372 CD1 LEU A 24 -4.482 -12.624 -5.052 1.00 0.00 C ATOM 373 CD2 LEU A 24 -5.200 -14.363 -3.395 1.00 0.00 C ATOM 0 H LEU A 24 -9.184 -13.467 -5.574 1.00 0.00 H new ATOM 0 HA LEU A 24 -7.589 -13.578 -3.246 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -7.201 -14.627 -5.507 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -6.795 -13.037 -6.123 1.00 0.00 H new ATOM 0 HG LEU A 24 -4.898 -14.662 -5.484 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -3.447 -12.812 -4.766 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -4.522 -12.339 -6.103 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -4.887 -11.817 -4.441 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -4.152 -14.515 -3.137 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -5.632 -13.614 -2.731 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -5.741 -15.303 -3.283 1.00 0.00 H new ATOM 385 N ASP A 25 -7.565 -10.703 -4.877 1.00 0.00 N ATOM 386 CA ASP A 25 -7.270 -9.279 -4.743 1.00 0.00 C ATOM 387 C ASP A 25 -8.219 -8.625 -3.736 1.00 0.00 C ATOM 388 O ASP A 25 -7.845 -7.678 -3.042 1.00 0.00 O ATOM 389 CB ASP A 25 -7.382 -8.589 -6.104 1.00 0.00 C ATOM 390 CG ASP A 25 -6.698 -7.234 -6.129 1.00 0.00 C ATOM 391 OD1 ASP A 25 -7.363 -6.221 -5.847 1.00 0.00 O ATOM 392 OD2 ASP A 25 -5.485 -7.175 -6.440 1.00 0.00 O ATOM 0 H ASP A 25 -7.976 -10.965 -5.773 1.00 0.00 H new ATOM 0 HA ASP A 25 -6.250 -9.169 -4.375 1.00 0.00 H new ATOM 0 HB2 ASP A 25 -6.941 -9.229 -6.869 1.00 0.00 H new ATOM 0 HB3 ASP A 25 -8.434 -8.465 -6.359 1.00 0.00 H new ATOM 397 N TRP A 26 -9.444 -9.145 -3.651 1.00 0.00 N ATOM 398 CA TRP A 26 -10.419 -8.664 -2.674 1.00 0.00 C ATOM 399 C TRP A 26 -9.897 -8.873 -1.257 1.00 0.00 C ATOM 400 O TRP A 26 -9.968 -7.975 -0.414 1.00 0.00 O ATOM 401 CB TRP A 26 -11.759 -9.397 -2.846 1.00 0.00 C ATOM 402 CG TRP A 26 -12.789 -9.035 -1.810 1.00 0.00 C ATOM 403 CD1 TRP A 26 -13.711 -8.032 -1.891 1.00 0.00 C ATOM 404 CD2 TRP A 26 -13.000 -9.674 -0.540 1.00 0.00 C ATOM 405 NE1 TRP A 26 -14.479 -8.003 -0.750 1.00 0.00 N ATOM 406 CE2 TRP A 26 -14.064 -9.004 0.092 1.00 0.00 C ATOM 407 CE3 TRP A 26 -12.396 -10.752 0.122 1.00 0.00 C ATOM 408 CZ2 TRP A 26 -14.531 -9.370 1.353 1.00 0.00 C ATOM 409 CZ3 TRP A 26 -12.862 -11.112 1.374 1.00 0.00 C ATOM 410 CH2 TRP A 26 -13.921 -10.425 1.975 1.00 0.00 C ATOM 0 H TRP A 26 -9.784 -9.899 -4.247 1.00 0.00 H new ATOM 0 HA TRP A 26 -10.575 -7.598 -2.843 1.00 0.00 H new ATOM 0 HB2 TRP A 26 -12.159 -9.175 -3.835 1.00 0.00 H new ATOM 0 HB3 TRP A 26 -11.582 -10.472 -2.808 1.00 0.00 H new ATOM 0 HD1 TRP A 26 -13.822 -7.359 -2.729 1.00 0.00 H new ATOM 0 HE1 TRP A 26 -15.234 -7.344 -0.561 1.00 0.00 H new ATOM 0 HE3 TRP A 26 -11.581 -11.292 -0.337 1.00 0.00 H new ATOM 0 HZ2 TRP A 26 -15.346 -8.839 1.823 1.00 0.00 H new ATOM 0 HZ3 TRP A 26 -12.400 -11.937 1.896 1.00 0.00 H new ATOM 0 HH2 TRP A 26 -14.265 -10.734 2.951 1.00 0.00 H new ATOM 421 N LEU A 27 -9.365 -10.064 -1.009 1.00 0.00 N ATOM 422 CA LEU A 27 -8.862 -10.429 0.309 1.00 0.00 C ATOM 423 C LEU A 27 -7.741 -9.493 0.744 1.00 0.00 C ATOM 424 O LEU A 27 -7.554 -9.238 1.935 1.00 0.00 O ATOM 425 CB LEU A 27 -8.368 -11.876 0.295 1.00 0.00 C ATOM 426 CG LEU A 27 -7.823 -12.387 1.627 1.00 0.00 C ATOM 427 CD1 LEU A 27 -8.867 -12.250 2.717 1.00 0.00 C ATOM 428 CD2 LEU A 27 -7.378 -13.832 1.497 1.00 0.00 C ATOM 0 H LEU A 27 -9.271 -10.799 -1.710 1.00 0.00 H new ATOM 0 HA LEU A 27 -9.677 -10.336 1.027 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -9.190 -12.521 -0.015 1.00 0.00 H new ATOM 0 HB3 LEU A 27 -7.587 -11.970 -0.459 1.00 0.00 H new ATOM 0 HG LEU A 27 -6.959 -11.782 1.901 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -8.461 -12.619 3.659 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -9.143 -11.201 2.827 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -9.750 -12.831 2.450 1.00 0.00 H new ATOM 0 HD21 LEU A 27 -6.992 -14.181 2.455 1.00 0.00 H new ATOM 0 HD22 LEU A 27 -8.227 -14.449 1.201 1.00 0.00 H new ATOM 0 HD23 LEU A 27 -6.595 -13.905 0.742 1.00 0.00 H new ATOM 440 N LYS A 28 -7.011 -8.974 -0.231 1.00 0.00 N ATOM 441 CA LYS A 28 -5.932 -8.044 0.027 1.00 0.00 C ATOM 442 C LYS A 28 -6.452 -6.796 0.739 1.00 0.00 C ATOM 443 O LYS A 28 -5.829 -6.298 1.677 1.00 0.00 O ATOM 444 CB LYS A 28 -5.280 -7.663 -1.292 1.00 0.00 C ATOM 445 CG LYS A 28 -3.905 -7.063 -1.142 1.00 0.00 C ATOM 446 CD LYS A 28 -3.285 -6.804 -2.497 1.00 0.00 C ATOM 447 CE LYS A 28 -1.788 -6.652 -2.382 1.00 0.00 C ATOM 448 NZ LYS A 28 -1.160 -6.327 -3.685 1.00 0.00 N ATOM 0 H LYS A 28 -7.152 -9.187 -1.219 1.00 0.00 H new ATOM 0 HA LYS A 28 -5.197 -8.520 0.676 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -5.212 -8.550 -1.922 1.00 0.00 H new ATOM 0 HB3 LYS A 28 -5.922 -6.951 -1.811 1.00 0.00 H new ATOM 0 HG2 LYS A 28 -3.969 -6.130 -0.581 1.00 0.00 H new ATOM 0 HG3 LYS A 28 -3.269 -7.737 -0.568 1.00 0.00 H new ATOM 0 HD2 LYS A 28 -3.521 -7.626 -3.173 1.00 0.00 H new ATOM 0 HD3 LYS A 28 -3.714 -5.901 -2.932 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -1.558 -5.866 -1.663 1.00 0.00 H new ATOM 0 HE3 LYS A 28 -1.359 -7.575 -1.993 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.302 -6.901 -3.810 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 -1.829 -6.533 -4.454 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -0.908 -5.318 -3.707 1.00 0.00 H new ATOM 462 N GLU A 29 -7.604 -6.304 0.295 1.00 0.00 N ATOM 463 CA GLU A 29 -8.208 -5.126 0.902 1.00 0.00 C ATOM 464 C GLU A 29 -8.897 -5.497 2.207 1.00 0.00 C ATOM 465 O GLU A 29 -8.949 -4.699 3.142 1.00 0.00 O ATOM 466 CB GLU A 29 -9.212 -4.474 -0.050 1.00 0.00 C ATOM 467 CG GLU A 29 -8.603 -4.015 -1.362 1.00 0.00 C ATOM 468 CD GLU A 29 -9.521 -3.089 -2.127 1.00 0.00 C ATOM 469 OE1 GLU A 29 -9.207 -1.885 -2.220 1.00 0.00 O ATOM 470 OE2 GLU A 29 -10.568 -3.550 -2.615 1.00 0.00 O ATOM 0 H GLU A 29 -8.135 -6.702 -0.480 1.00 0.00 H new ATOM 0 HA GLU A 29 -7.413 -4.409 1.110 1.00 0.00 H new ATOM 0 HB2 GLU A 29 -10.013 -5.183 -0.260 1.00 0.00 H new ATOM 0 HB3 GLU A 29 -9.667 -3.618 0.448 1.00 0.00 H new ATOM 0 HG2 GLU A 29 -7.660 -3.506 -1.164 1.00 0.00 H new ATOM 0 HG3 GLU A 29 -8.373 -4.885 -1.977 1.00 0.00 H new ATOM 477 N ALA A 30 -9.426 -6.714 2.257 1.00 0.00 N ATOM 478 CA ALA A 30 -10.062 -7.220 3.463 1.00 0.00 C ATOM 479 C ALA A 30 -9.061 -7.266 4.610 1.00 0.00 C ATOM 480 O ALA A 30 -9.269 -6.650 5.655 1.00 0.00 O ATOM 481 CB ALA A 30 -10.651 -8.601 3.215 1.00 0.00 C ATOM 0 H ALA A 30 -9.426 -7.368 1.474 1.00 0.00 H new ATOM 0 HA ALA A 30 -10.872 -6.544 3.737 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -11.123 -8.965 4.128 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -11.395 -8.542 2.421 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -9.858 -9.287 2.919 1.00 0.00 H new ATOM 487 N LEU A 31 -7.960 -7.978 4.388 1.00 0.00 N ATOM 488 CA LEU A 31 -6.900 -8.092 5.384 1.00 0.00 C ATOM 489 C LEU A 31 -6.259 -6.732 5.650 1.00 0.00 C ATOM 490 O LEU A 31 -5.796 -6.459 6.759 1.00 0.00 O ATOM 491 CB LEU A 31 -5.848 -9.107 4.923 1.00 0.00 C ATOM 492 CG LEU A 31 -6.297 -10.572 4.988 1.00 0.00 C ATOM 493 CD1 LEU A 31 -5.252 -11.484 4.371 1.00 0.00 C ATOM 494 CD2 LEU A 31 -6.567 -10.986 6.427 1.00 0.00 C ATOM 0 H LEU A 31 -7.778 -8.487 3.523 1.00 0.00 H new ATOM 0 HA LEU A 31 -7.338 -8.446 6.317 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -5.564 -8.874 3.897 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -4.955 -8.988 5.536 1.00 0.00 H new ATOM 0 HG LEU A 31 -7.221 -10.667 4.417 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -5.592 -12.518 4.428 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -5.100 -11.209 3.327 1.00 0.00 H new ATOM 0 HD13 LEU A 31 -4.312 -11.380 4.914 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -6.884 -12.028 6.452 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -5.657 -10.869 7.016 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -7.353 -10.357 6.845 1.00 0.00 H new ATOM 506 N GLY A 32 -6.225 -5.891 4.622 1.00 0.00 N ATOM 507 CA GLY A 32 -5.756 -4.528 4.782 1.00 0.00 C ATOM 508 C GLY A 32 -4.251 -4.406 4.663 1.00 0.00 C ATOM 509 O GLY A 32 -3.749 -3.507 3.988 1.00 0.00 O ATOM 0 H GLY A 32 -6.516 -6.132 3.675 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -6.228 -3.896 4.030 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -6.070 -4.153 5.756 1.00 0.00 H new ATOM 513 N ASN A 33 -3.536 -5.309 5.315 1.00 0.00 N ATOM 514 CA ASN A 33 -2.082 -5.267 5.324 1.00 0.00 C ATOM 515 C ASN A 33 -1.502 -6.265 4.329 1.00 0.00 C ATOM 516 O ASN A 33 -1.841 -7.449 4.355 1.00 0.00 O ATOM 517 CB ASN A 33 -1.551 -5.562 6.730 1.00 0.00 C ATOM 518 CG ASN A 33 -0.051 -5.375 6.839 1.00 0.00 C ATOM 519 OD1 ASN A 33 0.718 -6.307 6.631 1.00 0.00 O ATOM 520 ND2 ASN A 33 0.373 -4.169 7.174 1.00 0.00 N ATOM 0 H ASN A 33 -3.939 -6.081 5.846 1.00 0.00 H new ATOM 0 HA ASN A 33 -1.771 -4.265 5.028 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -2.048 -4.908 7.446 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -1.806 -6.586 7.003 1.00 0.00 H new ATOM 0 HD21 ASN A 33 1.372 -3.988 7.268 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -0.299 -3.420 7.339 1.00 0.00 H new ATOM 527 N ASP A 34 -0.629 -5.772 3.457 1.00 0.00 N ATOM 528 CA ASP A 34 0.042 -6.603 2.456 1.00 0.00 C ATOM 529 C ASP A 34 0.791 -7.756 3.120 1.00 0.00 C ATOM 530 O ASP A 34 0.721 -8.899 2.672 1.00 0.00 O ATOM 531 CB ASP A 34 1.015 -5.738 1.651 1.00 0.00 C ATOM 532 CG ASP A 34 1.722 -6.490 0.538 1.00 0.00 C ATOM 533 OD1 ASP A 34 2.717 -7.190 0.823 1.00 0.00 O ATOM 534 OD2 ASP A 34 1.317 -6.340 -0.636 1.00 0.00 O ATOM 0 H ASP A 34 -0.365 -4.787 3.422 1.00 0.00 H new ATOM 0 HA ASP A 34 -0.709 -7.028 1.790 1.00 0.00 H new ATOM 0 HB2 ASP A 34 0.470 -4.898 1.221 1.00 0.00 H new ATOM 0 HB3 ASP A 34 1.761 -5.321 2.327 1.00 0.00 H new ATOM 539 N GLY A 35 1.481 -7.447 4.211 1.00 0.00 N ATOM 540 CA GLY A 35 2.227 -8.455 4.939 1.00 0.00 C ATOM 541 C GLY A 35 1.338 -9.526 5.543 1.00 0.00 C ATOM 542 O GLY A 35 1.728 -10.690 5.624 1.00 0.00 O ATOM 0 H GLY A 35 1.537 -6.509 4.607 1.00 0.00 H new ATOM 0 HA2 GLY A 35 2.946 -8.923 4.267 1.00 0.00 H new ATOM 0 HA3 GLY A 35 2.799 -7.974 5.733 1.00 0.00 H new ATOM 546 N GLU A 36 0.146 -9.143 5.976 1.00 0.00 N ATOM 547 CA GLU A 36 -0.806 -10.103 6.521 1.00 0.00 C ATOM 548 C GLU A 36 -1.449 -10.910 5.397 1.00 0.00 C ATOM 549 O GLU A 36 -1.764 -12.088 5.564 1.00 0.00 O ATOM 550 CB GLU A 36 -1.878 -9.384 7.334 1.00 0.00 C ATOM 551 CG GLU A 36 -1.328 -8.657 8.548 1.00 0.00 C ATOM 552 CD GLU A 36 -0.743 -9.601 9.576 1.00 0.00 C ATOM 553 OE1 GLU A 36 0.429 -10.004 9.425 1.00 0.00 O ATOM 554 OE2 GLU A 36 -1.453 -9.940 10.545 1.00 0.00 O ATOM 0 H GLU A 36 -0.185 -8.178 5.961 1.00 0.00 H new ATOM 0 HA GLU A 36 -0.270 -10.787 7.179 1.00 0.00 H new ATOM 0 HB2 GLU A 36 -2.391 -8.668 6.692 1.00 0.00 H new ATOM 0 HB3 GLU A 36 -2.623 -10.109 7.661 1.00 0.00 H new ATOM 0 HG2 GLU A 36 -0.560 -7.953 8.228 1.00 0.00 H new ATOM 0 HG3 GLU A 36 -2.124 -8.072 9.009 1.00 0.00 H new ATOM 561 N PHE A 37 -1.632 -10.267 4.253 1.00 0.00 N ATOM 562 CA PHE A 37 -2.168 -10.927 3.069 1.00 0.00 C ATOM 563 C PHE A 37 -1.181 -11.977 2.563 1.00 0.00 C ATOM 564 O PHE A 37 -1.571 -13.005 2.006 1.00 0.00 O ATOM 565 CB PHE A 37 -2.472 -9.878 1.993 1.00 0.00 C ATOM 566 CG PHE A 37 -2.977 -10.441 0.698 1.00 0.00 C ATOM 567 CD1 PHE A 37 -2.260 -10.263 -0.474 1.00 0.00 C ATOM 568 CD2 PHE A 37 -4.169 -11.142 0.651 1.00 0.00 C ATOM 569 CE1 PHE A 37 -2.727 -10.769 -1.669 1.00 0.00 C ATOM 570 CE2 PHE A 37 -4.639 -11.654 -0.541 1.00 0.00 C ATOM 571 CZ PHE A 37 -3.917 -11.468 -1.703 1.00 0.00 C ATOM 0 H PHE A 37 -1.415 -9.279 4.118 1.00 0.00 H new ATOM 0 HA PHE A 37 -3.097 -11.439 3.321 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -3.212 -9.180 2.384 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -1.566 -9.305 1.796 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -1.325 -9.722 -0.452 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -4.738 -11.290 1.557 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -2.162 -10.619 -2.577 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -5.571 -12.200 -0.565 1.00 0.00 H new ATOM 0 HZ PHE A 37 -4.283 -11.869 -2.637 1.00 0.00 H new ATOM 581 N ASP A 38 0.097 -11.709 2.797 1.00 0.00 N ATOM 582 CA ASP A 38 1.181 -12.633 2.460 1.00 0.00 C ATOM 583 C ASP A 38 0.939 -14.000 3.082 1.00 0.00 C ATOM 584 O ASP A 38 1.185 -15.035 2.465 1.00 0.00 O ATOM 585 CB ASP A 38 2.495 -12.082 2.998 1.00 0.00 C ATOM 586 CG ASP A 38 3.714 -12.813 2.475 1.00 0.00 C ATOM 587 OD1 ASP A 38 4.024 -13.914 2.983 1.00 0.00 O ATOM 588 OD2 ASP A 38 4.388 -12.268 1.574 1.00 0.00 O ATOM 0 H ASP A 38 0.416 -10.841 3.228 1.00 0.00 H new ATOM 0 HA ASP A 38 1.221 -12.736 1.376 1.00 0.00 H new ATOM 0 HB2 ASP A 38 2.573 -11.027 2.735 1.00 0.00 H new ATOM 0 HB3 ASP A 38 2.486 -12.139 4.086 1.00 0.00 H new ATOM 593 N LYS A 39 0.459 -13.973 4.317 1.00 0.00 N ATOM 594 CA LYS A 39 0.211 -15.185 5.098 1.00 0.00 C ATOM 595 C LYS A 39 -0.663 -16.182 4.331 1.00 0.00 C ATOM 596 O LYS A 39 -0.385 -17.381 4.315 1.00 0.00 O ATOM 597 CB LYS A 39 -0.466 -14.822 6.423 1.00 0.00 C ATOM 598 CG LYS A 39 -0.438 -15.943 7.446 1.00 0.00 C ATOM 599 CD LYS A 39 0.986 -16.268 7.854 1.00 0.00 C ATOM 600 CE LYS A 39 1.040 -17.393 8.869 1.00 0.00 C ATOM 601 NZ LYS A 39 2.438 -17.695 9.263 1.00 0.00 N ATOM 0 H LYS A 39 0.229 -13.110 4.810 1.00 0.00 H new ATOM 0 HA LYS A 39 1.174 -15.658 5.291 1.00 0.00 H new ATOM 0 HB2 LYS A 39 0.025 -13.945 6.844 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -1.502 -14.545 6.228 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -1.015 -15.654 8.324 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -0.913 -16.832 7.031 1.00 0.00 H new ATOM 0 HD2 LYS A 39 1.562 -16.547 6.972 1.00 0.00 H new ATOM 0 HD3 LYS A 39 1.456 -15.378 8.273 1.00 0.00 H new ATOM 0 HE2 LYS A 39 0.462 -17.118 9.751 1.00 0.00 H new ATOM 0 HE3 LYS A 39 0.577 -18.286 8.450 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 2.443 -18.469 9.958 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 2.981 -17.980 8.423 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 2.871 -16.848 9.684 1.00 0.00 H new ATOM 615 N PHE A 40 -1.709 -15.671 3.692 1.00 0.00 N ATOM 616 CA PHE A 40 -2.660 -16.496 2.949 1.00 0.00 C ATOM 617 C PHE A 40 -2.017 -17.081 1.695 1.00 0.00 C ATOM 618 O PHE A 40 -2.336 -18.193 1.271 1.00 0.00 O ATOM 619 CB PHE A 40 -3.867 -15.635 2.569 1.00 0.00 C ATOM 620 CG PHE A 40 -4.901 -16.333 1.724 1.00 0.00 C ATOM 621 CD1 PHE A 40 -4.899 -16.179 0.346 1.00 0.00 C ATOM 622 CD2 PHE A 40 -5.881 -17.126 2.303 1.00 0.00 C ATOM 623 CE1 PHE A 40 -5.850 -16.801 -0.435 1.00 0.00 C ATOM 624 CE2 PHE A 40 -6.834 -17.753 1.524 1.00 0.00 C ATOM 625 CZ PHE A 40 -6.819 -17.588 0.154 1.00 0.00 C ATOM 0 H PHE A 40 -1.923 -14.674 3.673 1.00 0.00 H new ATOM 0 HA PHE A 40 -2.977 -17.328 3.578 1.00 0.00 H new ATOM 0 HB2 PHE A 40 -4.344 -15.280 3.482 1.00 0.00 H new ATOM 0 HB3 PHE A 40 -3.513 -14.755 2.032 1.00 0.00 H new ATOM 0 HD1 PHE A 40 -4.144 -15.565 -0.121 1.00 0.00 H new ATOM 0 HD2 PHE A 40 -5.899 -17.255 3.375 1.00 0.00 H new ATOM 0 HE1 PHE A 40 -5.837 -16.672 -1.507 1.00 0.00 H new ATOM 0 HE2 PHE A 40 -7.589 -18.371 1.986 1.00 0.00 H new ATOM 0 HZ PHE A 40 -7.565 -18.074 -0.457 1.00 0.00 H new ATOM 635 N LEU A 41 -1.097 -16.324 1.128 1.00 0.00 N ATOM 636 CA LEU A 41 -0.467 -16.673 -0.141 1.00 0.00 C ATOM 637 C LEU A 41 0.518 -17.834 0.006 1.00 0.00 C ATOM 638 O LEU A 41 0.995 -18.384 -0.989 1.00 0.00 O ATOM 639 CB LEU A 41 0.253 -15.449 -0.702 1.00 0.00 C ATOM 640 CG LEU A 41 -0.617 -14.199 -0.843 1.00 0.00 C ATOM 641 CD1 LEU A 41 0.242 -12.991 -1.180 1.00 0.00 C ATOM 642 CD2 LEU A 41 -1.683 -14.411 -1.908 1.00 0.00 C ATOM 0 H LEU A 41 -0.762 -15.449 1.530 1.00 0.00 H new ATOM 0 HA LEU A 41 -1.250 -16.996 -0.827 1.00 0.00 H new ATOM 0 HB2 LEU A 41 1.098 -15.215 -0.055 1.00 0.00 H new ATOM 0 HB3 LEU A 41 0.661 -15.702 -1.680 1.00 0.00 H new ATOM 0 HG LEU A 41 -1.114 -14.013 0.109 1.00 0.00 H new ATOM 0 HD11 LEU A 41 -0.392 -12.110 -1.277 1.00 0.00 H new ATOM 0 HD12 LEU A 41 0.970 -12.829 -0.385 1.00 0.00 H new ATOM 0 HD13 LEU A 41 0.765 -13.167 -2.120 1.00 0.00 H new ATOM 0 HD21 LEU A 41 -2.293 -13.512 -1.996 1.00 0.00 H new ATOM 0 HD22 LEU A 41 -1.205 -14.620 -2.865 1.00 0.00 H new ATOM 0 HD23 LEU A 41 -2.315 -15.253 -1.627 1.00 0.00 H new ATOM 654 N GLY A 42 0.814 -18.207 1.241 1.00 0.00 N ATOM 655 CA GLY A 42 1.774 -19.266 1.481 1.00 0.00 C ATOM 656 C GLY A 42 1.125 -20.575 1.886 1.00 0.00 C ATOM 657 O GLY A 42 1.754 -21.412 2.539 1.00 0.00 O ATOM 0 H GLY A 42 0.408 -17.796 2.082 1.00 0.00 H new ATOM 0 HA2 GLY A 42 2.365 -19.424 0.579 1.00 0.00 H new ATOM 0 HA3 GLY A 42 2.465 -18.952 2.264 1.00 0.00 H new ATOM 661 N TYR A 43 -0.125 -20.764 1.494 1.00 0.00 N ATOM 662 CA TYR A 43 -0.862 -21.962 1.868 1.00 0.00 C ATOM 663 C TYR A 43 -1.029 -22.922 0.700 1.00 0.00 C ATOM 664 O TYR A 43 -0.541 -22.672 -0.401 1.00 0.00 O ATOM 665 CB TYR A 43 -2.225 -21.592 2.442 1.00 0.00 C ATOM 666 CG TYR A 43 -2.150 -21.128 3.872 1.00 0.00 C ATOM 667 CD1 TYR A 43 -2.640 -19.890 4.259 1.00 0.00 C ATOM 668 CD2 TYR A 43 -1.586 -21.945 4.838 1.00 0.00 C ATOM 669 CE1 TYR A 43 -2.568 -19.480 5.576 1.00 0.00 C ATOM 670 CE2 TYR A 43 -1.511 -21.546 6.150 1.00 0.00 C ATOM 671 CZ TYR A 43 -2.003 -20.312 6.517 1.00 0.00 C ATOM 672 OH TYR A 43 -1.931 -19.908 7.828 1.00 0.00 O ATOM 0 H TYR A 43 -0.650 -20.106 0.918 1.00 0.00 H new ATOM 0 HA TYR A 43 -0.276 -22.474 2.631 1.00 0.00 H new ATOM 0 HB2 TYR A 43 -2.669 -20.805 1.832 1.00 0.00 H new ATOM 0 HB3 TYR A 43 -2.887 -22.456 2.379 1.00 0.00 H new ATOM 0 HD1 TYR A 43 -3.084 -19.238 3.521 1.00 0.00 H new ATOM 0 HD2 TYR A 43 -1.199 -22.912 4.555 1.00 0.00 H new ATOM 0 HE1 TYR A 43 -2.952 -18.513 5.866 1.00 0.00 H new ATOM 0 HE2 TYR A 43 -1.069 -22.196 6.890 1.00 0.00 H new ATOM 0 HH TYR A 43 -1.506 -20.610 8.364 1.00 0.00 H new ATOM 682 N ASP A 44 -1.707 -24.034 0.964 1.00 0.00 N ATOM 683 CA ASP A 44 -1.956 -25.048 -0.064 1.00 0.00 C ATOM 684 C ASP A 44 -2.965 -24.559 -1.082 1.00 0.00 C ATOM 685 O ASP A 44 -3.962 -23.941 -0.718 1.00 0.00 O ATOM 686 CB ASP A 44 -2.488 -26.337 0.556 1.00 0.00 C ATOM 687 CG ASP A 44 -2.671 -27.429 -0.473 1.00 0.00 C ATOM 688 OD1 ASP A 44 -1.663 -27.897 -1.044 1.00 0.00 O ATOM 689 OD2 ASP A 44 -3.822 -27.820 -0.722 1.00 0.00 O ATOM 0 H ASP A 44 -2.095 -24.259 1.880 1.00 0.00 H new ATOM 0 HA ASP A 44 -1.002 -25.240 -0.556 1.00 0.00 H new ATOM 0 HB2 ASP A 44 -1.799 -26.679 1.328 1.00 0.00 H new ATOM 0 HB3 ASP A 44 -3.441 -26.137 1.045 1.00 0.00 H new ATOM 694 N GLU A 45 -2.725 -24.870 -2.349 1.00 0.00 N ATOM 695 CA GLU A 45 -3.628 -24.487 -3.419 1.00 0.00 C ATOM 696 C GLU A 45 -5.037 -25.004 -3.171 1.00 0.00 C ATOM 697 O GLU A 45 -6.010 -24.286 -3.390 1.00 0.00 O ATOM 698 CB GLU A 45 -3.119 -25.016 -4.749 1.00 0.00 C ATOM 699 CG GLU A 45 -2.020 -24.175 -5.362 1.00 0.00 C ATOM 700 CD GLU A 45 -1.616 -24.688 -6.727 1.00 0.00 C ATOM 701 OE1 GLU A 45 -2.362 -24.450 -7.698 1.00 0.00 O ATOM 702 OE2 GLU A 45 -0.561 -25.351 -6.832 1.00 0.00 O ATOM 0 H GLU A 45 -1.905 -25.391 -2.659 1.00 0.00 H new ATOM 0 HA GLU A 45 -3.663 -23.398 -3.447 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -2.750 -26.032 -4.608 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -3.952 -25.074 -5.449 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -2.357 -23.142 -5.447 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -1.152 -24.174 -4.702 1.00 0.00 H new ATOM 709 N SER A 46 -5.147 -26.236 -2.690 1.00 0.00 N ATOM 710 CA SER A 46 -6.448 -26.839 -2.465 1.00 0.00 C ATOM 711 C SER A 46 -7.167 -26.131 -1.320 1.00 0.00 C ATOM 712 O SER A 46 -8.394 -26.026 -1.320 1.00 0.00 O ATOM 713 CB SER A 46 -6.310 -28.338 -2.172 1.00 0.00 C ATOM 714 OG SER A 46 -7.577 -28.966 -2.055 1.00 0.00 O ATOM 0 H SER A 46 -4.354 -26.832 -2.450 1.00 0.00 H new ATOM 0 HA SER A 46 -7.042 -26.726 -3.372 1.00 0.00 H new ATOM 0 HB2 SER A 46 -5.739 -28.814 -2.969 1.00 0.00 H new ATOM 0 HB3 SER A 46 -5.747 -28.479 -1.249 1.00 0.00 H new ATOM 0 HG SER A 46 -7.453 -29.920 -1.870 1.00 0.00 H new ATOM 720 N LYS A 47 -6.406 -25.610 -0.358 1.00 0.00 N ATOM 721 CA LYS A 47 -7.010 -24.895 0.754 1.00 0.00 C ATOM 722 C LYS A 47 -7.322 -23.461 0.344 1.00 0.00 C ATOM 723 O LYS A 47 -8.382 -22.930 0.669 1.00 0.00 O ATOM 724 CB LYS A 47 -6.093 -24.940 1.982 1.00 0.00 C ATOM 725 CG LYS A 47 -5.977 -26.338 2.570 1.00 0.00 C ATOM 726 CD LYS A 47 -5.090 -26.393 3.802 1.00 0.00 C ATOM 727 CE LYS A 47 -4.900 -27.832 4.259 1.00 0.00 C ATOM 728 NZ LYS A 47 -4.097 -27.933 5.504 1.00 0.00 N ATOM 0 H LYS A 47 -5.388 -25.670 -0.329 1.00 0.00 H new ATOM 0 HA LYS A 47 -7.947 -25.381 1.024 1.00 0.00 H new ATOM 0 HB2 LYS A 47 -5.101 -24.582 1.705 1.00 0.00 H new ATOM 0 HB3 LYS A 47 -6.476 -24.260 2.743 1.00 0.00 H new ATOM 0 HG2 LYS A 47 -6.972 -26.701 2.829 1.00 0.00 H new ATOM 0 HG3 LYS A 47 -5.579 -27.013 1.812 1.00 0.00 H new ATOM 0 HD2 LYS A 47 -4.121 -25.945 3.580 1.00 0.00 H new ATOM 0 HD3 LYS A 47 -5.536 -25.806 4.605 1.00 0.00 H new ATOM 0 HE2 LYS A 47 -5.876 -28.290 4.422 1.00 0.00 H new ATOM 0 HE3 LYS A 47 -4.410 -28.399 3.468 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 -3.670 -28.879 5.566 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 -3.346 -27.214 5.492 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 -4.712 -27.777 6.328 1.00 0.00 H new ATOM 742 N ILE A 48 -6.404 -22.862 -0.402 1.00 0.00 N ATOM 743 CA ILE A 48 -6.564 -21.504 -0.899 1.00 0.00 C ATOM 744 C ILE A 48 -7.775 -21.379 -1.817 1.00 0.00 C ATOM 745 O ILE A 48 -8.650 -20.545 -1.592 1.00 0.00 O ATOM 746 CB ILE A 48 -5.298 -21.053 -1.653 1.00 0.00 C ATOM 747 CG1 ILE A 48 -4.126 -20.952 -0.679 1.00 0.00 C ATOM 748 CG2 ILE A 48 -5.527 -19.730 -2.366 1.00 0.00 C ATOM 749 CD1 ILE A 48 -2.825 -20.551 -1.333 1.00 0.00 C ATOM 0 H ILE A 48 -5.528 -23.304 -0.679 1.00 0.00 H new ATOM 0 HA ILE A 48 -6.722 -20.860 -0.034 1.00 0.00 H new ATOM 0 HB ILE A 48 -5.061 -21.797 -2.414 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -4.371 -20.226 0.096 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -3.992 -21.914 -0.184 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -4.617 -19.436 -2.889 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -6.339 -19.840 -3.084 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -5.789 -18.964 -1.636 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -2.039 -20.500 -0.579 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -2.555 -21.289 -2.089 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -2.940 -19.575 -1.804 1.00 0.00 H new ATOM 761 N LYS A 49 -7.831 -22.220 -2.842 1.00 0.00 N ATOM 762 CA LYS A 49 -8.914 -22.170 -3.815 1.00 0.00 C ATOM 763 C LYS A 49 -10.268 -22.449 -3.165 1.00 0.00 C ATOM 764 O LYS A 49 -11.288 -21.906 -3.586 1.00 0.00 O ATOM 765 CB LYS A 49 -8.638 -23.151 -4.955 1.00 0.00 C ATOM 766 CG LYS A 49 -7.402 -22.775 -5.753 1.00 0.00 C ATOM 767 CD LYS A 49 -7.050 -23.812 -6.804 1.00 0.00 C ATOM 768 CE LYS A 49 -5.757 -23.440 -7.510 1.00 0.00 C ATOM 769 NZ LYS A 49 -5.355 -24.449 -8.524 1.00 0.00 N ATOM 0 H LYS A 49 -7.137 -22.946 -3.021 1.00 0.00 H new ATOM 0 HA LYS A 49 -8.958 -21.161 -4.224 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -8.513 -24.154 -4.546 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -9.501 -23.184 -5.620 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -7.565 -21.812 -6.238 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -6.559 -22.651 -5.073 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -6.947 -24.791 -6.336 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -7.858 -23.890 -7.531 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -5.876 -22.470 -7.994 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -4.961 -23.333 -6.773 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -4.332 -24.623 -8.454 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -5.870 -25.336 -8.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -5.581 -24.094 -9.475 1.00 0.00 H new ATOM 783 N THR A 50 -10.273 -23.273 -2.124 1.00 0.00 N ATOM 784 CA THR A 50 -11.494 -23.543 -1.385 1.00 0.00 C ATOM 785 C THR A 50 -11.883 -22.335 -0.529 1.00 0.00 C ATOM 786 O THR A 50 -13.056 -21.966 -0.463 1.00 0.00 O ATOM 787 CB THR A 50 -11.345 -24.795 -0.497 1.00 0.00 C ATOM 788 OG1 THR A 50 -11.037 -25.933 -1.316 1.00 0.00 O ATOM 789 CG2 THR A 50 -12.619 -25.068 0.290 1.00 0.00 C ATOM 0 H THR A 50 -9.448 -23.762 -1.776 1.00 0.00 H new ATOM 0 HA THR A 50 -12.285 -23.732 -2.110 1.00 0.00 H new ATOM 0 HB THR A 50 -10.536 -24.615 0.211 1.00 0.00 H new ATOM 0 HG1 THR A 50 -10.081 -26.138 -1.245 1.00 0.00 H new ATOM 0 HG21 THR A 50 -12.483 -25.957 0.906 1.00 0.00 H new ATOM 0 HG22 THR A 50 -12.842 -24.214 0.929 1.00 0.00 H new ATOM 0 HG23 THR A 50 -13.446 -25.229 -0.401 1.00 0.00 H new ATOM 797 N ALA A 51 -10.889 -21.708 0.102 1.00 0.00 N ATOM 798 CA ALA A 51 -11.120 -20.514 0.911 1.00 0.00 C ATOM 799 C ALA A 51 -11.673 -19.382 0.054 1.00 0.00 C ATOM 800 O ALA A 51 -12.658 -18.737 0.418 1.00 0.00 O ATOM 801 CB ALA A 51 -9.831 -20.075 1.592 1.00 0.00 C ATOM 0 H ALA A 51 -9.915 -22.009 0.067 1.00 0.00 H new ATOM 0 HA ALA A 51 -11.855 -20.759 1.677 1.00 0.00 H new ATOM 0 HB1 ALA A 51 -10.021 -19.184 2.191 1.00 0.00 H new ATOM 0 HB2 ALA A 51 -9.470 -20.876 2.237 1.00 0.00 H new ATOM 0 HB3 ALA A 51 -9.078 -19.851 0.836 1.00 0.00 H new ATOM 807 N LEU A 52 -11.041 -19.158 -1.091 1.00 0.00 N ATOM 808 CA LEU A 52 -11.473 -18.117 -2.016 1.00 0.00 C ATOM 809 C LEU A 52 -12.882 -18.386 -2.523 1.00 0.00 C ATOM 810 O LEU A 52 -13.718 -17.488 -2.546 1.00 0.00 O ATOM 811 CB LEU A 52 -10.514 -18.014 -3.199 1.00 0.00 C ATOM 812 CG LEU A 52 -9.119 -17.487 -2.866 1.00 0.00 C ATOM 813 CD1 LEU A 52 -8.212 -17.570 -4.085 1.00 0.00 C ATOM 814 CD2 LEU A 52 -9.199 -16.054 -2.368 1.00 0.00 C ATOM 0 H LEU A 52 -10.225 -19.685 -1.402 1.00 0.00 H new ATOM 0 HA LEU A 52 -11.471 -17.172 -1.472 1.00 0.00 H new ATOM 0 HB2 LEU A 52 -10.413 -19.001 -3.651 1.00 0.00 H new ATOM 0 HB3 LEU A 52 -10.960 -17.363 -3.951 1.00 0.00 H new ATOM 0 HG LEU A 52 -8.697 -18.108 -2.076 1.00 0.00 H new ATOM 0 HD11 LEU A 52 -7.223 -17.190 -3.829 1.00 0.00 H new ATOM 0 HD12 LEU A 52 -8.130 -18.608 -4.408 1.00 0.00 H new ATOM 0 HD13 LEU A 52 -8.633 -16.971 -4.893 1.00 0.00 H new ATOM 0 HD21 LEU A 52 -8.197 -15.693 -2.135 1.00 0.00 H new ATOM 0 HD22 LEU A 52 -9.641 -15.425 -3.140 1.00 0.00 H new ATOM 0 HD23 LEU A 52 -9.817 -16.015 -1.471 1.00 0.00 H new ATOM 826 N ASP A 53 -13.148 -19.630 -2.913 1.00 0.00 N ATOM 827 CA ASP A 53 -14.456 -19.997 -3.453 1.00 0.00 C ATOM 828 C ASP A 53 -15.542 -19.879 -2.383 1.00 0.00 C ATOM 829 O ASP A 53 -16.706 -19.619 -2.695 1.00 0.00 O ATOM 830 CB ASP A 53 -14.432 -21.416 -4.029 1.00 0.00 C ATOM 831 CG ASP A 53 -15.710 -21.767 -4.770 1.00 0.00 C ATOM 832 OD1 ASP A 53 -16.614 -22.366 -4.153 1.00 0.00 O ATOM 833 OD2 ASP A 53 -15.823 -21.443 -5.974 1.00 0.00 O ATOM 0 H ASP A 53 -12.479 -20.399 -2.866 1.00 0.00 H new ATOM 0 HA ASP A 53 -14.689 -19.301 -4.259 1.00 0.00 H new ATOM 0 HB2 ASP A 53 -13.584 -21.515 -4.707 1.00 0.00 H new ATOM 0 HB3 ASP A 53 -14.278 -22.130 -3.220 1.00 0.00 H new ATOM 838 N HIS A 54 -15.158 -20.064 -1.120 1.00 0.00 N ATOM 839 CA HIS A 54 -16.087 -19.868 -0.010 1.00 0.00 C ATOM 840 C HIS A 54 -16.441 -18.390 0.111 1.00 0.00 C ATOM 841 O HIS A 54 -17.615 -18.027 0.206 1.00 0.00 O ATOM 842 CB HIS A 54 -15.498 -20.373 1.311 1.00 0.00 C ATOM 843 CG HIS A 54 -16.417 -20.179 2.476 1.00 0.00 C ATOM 844 ND1 HIS A 54 -17.539 -20.950 2.637 1.00 0.00 N ATOM 845 CD2 HIS A 54 -16.360 -19.266 3.471 1.00 0.00 C ATOM 846 CE1 HIS A 54 -18.144 -20.488 3.716 1.00 0.00 C ATOM 847 NE2 HIS A 54 -17.467 -19.466 4.258 1.00 0.00 N ATOM 0 H HIS A 54 -14.218 -20.347 -0.843 1.00 0.00 H new ATOM 0 HA HIS A 54 -16.988 -20.446 -0.218 1.00 0.00 H new ATOM 0 HB2 HIS A 54 -15.262 -21.433 1.215 1.00 0.00 H new ATOM 0 HB3 HIS A 54 -14.560 -19.854 1.506 1.00 0.00 H new ATOM 0 HD2 HIS A 54 -15.591 -18.522 3.619 1.00 0.00 H new ATOM 0 HE1 HIS A 54 -19.068 -20.884 4.112 1.00 0.00 H new ATOM 0 HE2 HIS A 54 -17.724 -18.939 5.093 1.00 0.00 H new ATOM 855 N ILE A 55 -15.415 -17.543 0.106 1.00 0.00 N ATOM 856 CA ILE A 55 -15.613 -16.098 0.073 1.00 0.00 C ATOM 857 C ILE A 55 -16.482 -15.735 -1.123 1.00 0.00 C ATOM 858 O ILE A 55 -17.440 -14.975 -1.012 1.00 0.00 O ATOM 859 CB ILE A 55 -14.262 -15.349 -0.027 1.00 0.00 C ATOM 860 CG1 ILE A 55 -13.413 -15.620 1.219 1.00 0.00 C ATOM 861 CG2 ILE A 55 -14.486 -13.852 -0.212 1.00 0.00 C ATOM 862 CD1 ILE A 55 -12.038 -14.986 1.176 1.00 0.00 C ATOM 0 H ILE A 55 -14.437 -17.833 0.124 1.00 0.00 H new ATOM 0 HA ILE A 55 -16.103 -15.798 0.999 1.00 0.00 H new ATOM 0 HB ILE A 55 -13.725 -15.719 -0.900 1.00 0.00 H new ATOM 0 HG12 ILE A 55 -13.945 -15.251 2.096 1.00 0.00 H new ATOM 0 HG13 ILE A 55 -13.302 -16.697 1.343 1.00 0.00 H new ATOM 0 HG21 ILE A 55 -13.523 -13.346 -0.280 1.00 0.00 H new ATOM 0 HG22 ILE A 55 -15.052 -13.679 -1.127 1.00 0.00 H new ATOM 0 HG23 ILE A 55 -15.043 -13.460 0.639 1.00 0.00 H new ATOM 0 HD11 ILE A 55 -11.499 -15.224 2.093 1.00 0.00 H new ATOM 0 HD12 ILE A 55 -11.486 -15.373 0.320 1.00 0.00 H new ATOM 0 HD13 ILE A 55 -12.139 -13.905 1.084 1.00 0.00 H new ATOM 874 N LYS A 56 -16.138 -16.330 -2.251 1.00 0.00 N ATOM 875 CA LYS A 56 -16.858 -16.172 -3.506 1.00 0.00 C ATOM 876 C LYS A 56 -18.334 -16.562 -3.383 1.00 0.00 C ATOM 877 O LYS A 56 -19.171 -16.082 -4.141 1.00 0.00 O ATOM 878 CB LYS A 56 -16.155 -17.038 -4.551 1.00 0.00 C ATOM 879 CG LYS A 56 -16.876 -17.189 -5.876 1.00 0.00 C ATOM 880 CD LYS A 56 -16.035 -18.015 -6.827 1.00 0.00 C ATOM 881 CE LYS A 56 -16.890 -18.776 -7.816 1.00 0.00 C ATOM 882 NZ LYS A 56 -16.203 -20.004 -8.283 1.00 0.00 N ATOM 0 H LYS A 56 -15.332 -16.951 -2.324 1.00 0.00 H new ATOM 0 HA LYS A 56 -16.848 -15.122 -3.798 1.00 0.00 H new ATOM 0 HB2 LYS A 56 -15.169 -16.615 -4.742 1.00 0.00 H new ATOM 0 HB3 LYS A 56 -16.000 -18.031 -4.128 1.00 0.00 H new ATOM 0 HG2 LYS A 56 -17.843 -17.668 -5.722 1.00 0.00 H new ATOM 0 HG3 LYS A 56 -17.072 -16.208 -6.308 1.00 0.00 H new ATOM 0 HD2 LYS A 56 -15.349 -17.362 -7.366 1.00 0.00 H new ATOM 0 HD3 LYS A 56 -15.426 -18.717 -6.258 1.00 0.00 H new ATOM 0 HE2 LYS A 56 -17.840 -19.041 -7.351 1.00 0.00 H new ATOM 0 HE3 LYS A 56 -17.120 -18.138 -8.669 1.00 0.00 H new ATOM 0 HZ1 LYS A 56 -16.782 -20.470 -9.010 1.00 0.00 H new ATOM 0 HZ2 LYS A 56 -15.278 -19.752 -8.686 1.00 0.00 H new ATOM 0 HZ3 LYS A 56 -16.067 -20.652 -7.481 1.00 0.00 H new ATOM 896 N SER A 57 -18.652 -17.427 -2.435 1.00 0.00 N ATOM 897 CA SER A 57 -20.029 -17.855 -2.239 1.00 0.00 C ATOM 898 C SER A 57 -20.791 -16.838 -1.388 1.00 0.00 C ATOM 899 O SER A 57 -21.847 -16.338 -1.791 1.00 0.00 O ATOM 900 CB SER A 57 -20.066 -19.245 -1.590 1.00 0.00 C ATOM 901 OG SER A 57 -21.387 -19.759 -1.544 1.00 0.00 O ATOM 0 H SER A 57 -17.980 -17.846 -1.791 1.00 0.00 H new ATOM 0 HA SER A 57 -20.517 -17.916 -3.212 1.00 0.00 H new ATOM 0 HB2 SER A 57 -19.428 -19.927 -2.151 1.00 0.00 H new ATOM 0 HB3 SER A 57 -19.661 -19.188 -0.580 1.00 0.00 H new ATOM 0 HG SER A 57 -21.379 -20.646 -1.127 1.00 0.00 H new ATOM 907 N GLU A 58 -20.241 -16.520 -0.224 1.00 0.00 N ATOM 908 CA GLU A 58 -20.867 -15.576 0.692 1.00 0.00 C ATOM 909 C GLU A 58 -20.940 -14.177 0.082 1.00 0.00 C ATOM 910 O GLU A 58 -21.976 -13.515 0.125 1.00 0.00 O ATOM 911 CB GLU A 58 -20.089 -15.536 2.007 1.00 0.00 C ATOM 912 CG GLU A 58 -20.059 -16.872 2.730 1.00 0.00 C ATOM 913 CD GLU A 58 -21.448 -17.434 2.944 1.00 0.00 C ATOM 914 OE1 GLU A 58 -22.210 -16.844 3.737 1.00 0.00 O ATOM 915 OE2 GLU A 58 -21.782 -18.456 2.312 1.00 0.00 O ATOM 0 H GLU A 58 -19.357 -16.905 0.110 1.00 0.00 H new ATOM 0 HA GLU A 58 -21.886 -15.912 0.884 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -19.066 -15.217 1.806 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -20.534 -14.787 2.662 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -19.466 -17.582 2.154 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -19.565 -16.751 3.694 1.00 0.00 H new ATOM 922 N LEU A 59 -19.845 -13.749 -0.519 1.00 0.00 N ATOM 923 CA LEU A 59 -19.755 -12.418 -1.097 1.00 0.00 C ATOM 924 C LEU A 59 -20.713 -12.277 -2.282 1.00 0.00 C ATOM 925 O LEU A 59 -21.109 -11.168 -2.649 1.00 0.00 O ATOM 926 CB LEU A 59 -18.314 -12.157 -1.537 1.00 0.00 C ATOM 927 CG LEU A 59 -17.954 -10.702 -1.831 1.00 0.00 C ATOM 928 CD1 LEU A 59 -18.207 -9.826 -0.616 1.00 0.00 C ATOM 929 CD2 LEU A 59 -16.501 -10.614 -2.254 1.00 0.00 C ATOM 0 H LEU A 59 -18.998 -14.308 -0.621 1.00 0.00 H new ATOM 0 HA LEU A 59 -20.042 -11.681 -0.347 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -17.646 -12.525 -0.759 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -18.116 -12.747 -2.432 1.00 0.00 H new ATOM 0 HG LEU A 59 -18.586 -10.341 -2.642 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -17.943 -8.795 -0.850 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -19.261 -9.878 -0.343 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -17.599 -10.176 0.218 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -16.245 -9.575 -2.464 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -15.865 -10.990 -1.452 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -16.346 -11.214 -3.151 1.00 0.00 H new ATOM 941 N ASP A 60 -21.094 -13.416 -2.855 1.00 0.00 N ATOM 942 CA ASP A 60 -21.988 -13.448 -4.010 1.00 0.00 C ATOM 943 C ASP A 60 -23.450 -13.409 -3.593 1.00 0.00 C ATOM 944 O ASP A 60 -24.244 -12.697 -4.203 1.00 0.00 O ATOM 945 CB ASP A 60 -21.723 -14.693 -4.853 1.00 0.00 C ATOM 946 CG ASP A 60 -22.757 -14.902 -5.941 1.00 0.00 C ATOM 947 OD1 ASP A 60 -22.847 -14.061 -6.858 1.00 0.00 O ATOM 948 OD2 ASP A 60 -23.473 -15.924 -5.888 1.00 0.00 O ATOM 0 H ASP A 60 -20.794 -14.337 -2.535 1.00 0.00 H new ATOM 0 HA ASP A 60 -21.784 -12.557 -4.605 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -20.736 -14.614 -5.308 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -21.705 -15.568 -4.203 1.00 0.00 H new ATOM 953 N LYS A 61 -23.811 -14.158 -2.552 1.00 0.00 N ATOM 954 CA LYS A 61 -25.204 -14.215 -2.119 1.00 0.00 C ATOM 955 C LYS A 61 -25.671 -12.847 -1.626 1.00 0.00 C ATOM 956 O LYS A 61 -26.868 -12.563 -1.587 1.00 0.00 O ATOM 957 CB LYS A 61 -25.409 -15.285 -1.044 1.00 0.00 C ATOM 958 CG LYS A 61 -24.616 -15.047 0.221 1.00 0.00 C ATOM 959 CD LYS A 61 -24.881 -16.111 1.279 1.00 0.00 C ATOM 960 CE LYS A 61 -24.412 -17.496 0.841 1.00 0.00 C ATOM 961 NZ LYS A 61 -25.460 -18.240 0.090 1.00 0.00 N ATOM 0 H LYS A 61 -23.168 -14.726 -2.000 1.00 0.00 H new ATOM 0 HA LYS A 61 -25.812 -14.493 -2.980 1.00 0.00 H new ATOM 0 HB2 LYS A 61 -26.468 -15.334 -0.792 1.00 0.00 H new ATOM 0 HB3 LYS A 61 -25.134 -16.256 -1.456 1.00 0.00 H new ATOM 0 HG2 LYS A 61 -23.552 -15.032 -0.017 1.00 0.00 H new ATOM 0 HG3 LYS A 61 -24.866 -14.066 0.625 1.00 0.00 H new ATOM 0 HD2 LYS A 61 -24.374 -15.834 2.204 1.00 0.00 H new ATOM 0 HD3 LYS A 61 -25.948 -16.144 1.498 1.00 0.00 H new ATOM 0 HE2 LYS A 61 -23.524 -17.395 0.217 1.00 0.00 H new ATOM 0 HE3 LYS A 61 -24.120 -18.072 1.719 1.00 0.00 H new ATOM 0 HZ1 LYS A 61 -25.712 -19.105 0.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 61 -26.304 -17.641 -0.015 1.00 0.00 H new ATOM 0 HZ3 LYS A 61 -25.098 -18.495 -0.851 1.00 0.00 H new ATOM 975 N CYS A 62 -24.722 -11.998 -1.263 1.00 0.00 N ATOM 976 CA CYS A 62 -25.032 -10.617 -0.940 1.00 0.00 C ATOM 977 C CYS A 62 -25.078 -9.789 -2.219 1.00 0.00 C ATOM 978 O CYS A 62 -24.043 -9.372 -2.742 1.00 0.00 O ATOM 979 CB CYS A 62 -23.993 -10.044 0.020 1.00 0.00 C ATOM 980 SG CYS A 62 -23.709 -11.073 1.492 1.00 0.00 S ATOM 0 H CYS A 62 -23.734 -12.241 -1.185 1.00 0.00 H new ATOM 0 HA CYS A 62 -26.006 -10.580 -0.452 1.00 0.00 H new ATOM 0 HB2 CYS A 62 -23.050 -9.919 -0.512 1.00 0.00 H new ATOM 0 HB3 CYS A 62 -24.314 -9.052 0.338 1.00 0.00 H new ATOM 985 N ASN A 63 -26.281 -9.577 -2.733 1.00 0.00 N ATOM 986 CA ASN A 63 -26.476 -8.830 -3.960 1.00 0.00 C ATOM 987 C ASN A 63 -27.841 -8.165 -3.935 1.00 0.00 C ATOM 988 O ASN A 63 -28.881 -8.826 -3.920 1.00 0.00 O ATOM 989 CB ASN A 63 -26.312 -9.721 -5.211 1.00 0.00 C ATOM 990 CG ASN A 63 -27.249 -10.917 -5.244 1.00 0.00 C ATOM 991 OD1 ASN A 63 -28.376 -10.828 -5.733 1.00 0.00 O ATOM 992 ND2 ASN A 63 -26.776 -12.055 -4.767 1.00 0.00 N ATOM 0 H ASN A 63 -27.144 -9.918 -2.310 1.00 0.00 H new ATOM 0 HA ASN A 63 -25.704 -8.063 -4.022 1.00 0.00 H new ATOM 0 HB2 ASN A 63 -26.481 -9.115 -6.101 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -25.283 -10.077 -5.259 1.00 0.00 H new ATOM 0 HD21 ASN A 63 -27.350 -12.898 -4.797 1.00 0.00 H new ATOM 0 HD22 ASN A 63 -25.837 -12.090 -4.369 1.00 0.00 H new ATOM 999 N GLY A 64 -27.819 -6.851 -3.893 1.00 0.00 N ATOM 1000 CA GLY A 64 -29.036 -6.078 -3.811 1.00 0.00 C ATOM 1001 C GLY A 64 -28.816 -4.763 -3.092 1.00 0.00 C ATOM 1002 O GLY A 64 -27.836 -4.063 -3.352 1.00 0.00 O ATOM 0 H GLY A 64 -26.965 -6.294 -3.915 1.00 0.00 H new ATOM 0 HA2 GLY A 64 -29.413 -5.885 -4.815 1.00 0.00 H new ATOM 0 HA3 GLY A 64 -29.799 -6.655 -3.289 1.00 0.00 H new ATOM 1006 N ASN A 65 -29.703 -4.440 -2.165 1.00 0.00 N ATOM 1007 CA ASN A 65 -29.628 -3.177 -1.437 1.00 0.00 C ATOM 1008 C ASN A 65 -28.742 -3.334 -0.204 1.00 0.00 C ATOM 1009 O ASN A 65 -28.277 -2.359 0.384 1.00 0.00 O ATOM 1010 CB ASN A 65 -31.037 -2.729 -1.030 1.00 0.00 C ATOM 1011 CG ASN A 65 -31.088 -1.287 -0.564 1.00 0.00 C ATOM 1012 OD1 ASN A 65 -30.311 -0.448 -1.018 1.00 0.00 O ATOM 1013 ND2 ASN A 65 -32.006 -0.988 0.342 1.00 0.00 N ATOM 0 H ASN A 65 -30.487 -5.035 -1.896 1.00 0.00 H new ATOM 0 HA ASN A 65 -29.190 -2.417 -2.083 1.00 0.00 H new ATOM 0 HB2 ASN A 65 -31.711 -2.856 -1.877 1.00 0.00 H new ATOM 0 HB3 ASN A 65 -31.402 -3.376 -0.232 1.00 0.00 H new ATOM 0 HD21 ASN A 65 -32.088 -0.032 0.689 1.00 0.00 H new ATOM 0 HD22 ASN A 65 -32.631 -1.713 0.693 1.00 0.00 H new ATOM 1020 N ASP A 66 -28.502 -4.579 0.161 1.00 0.00 N ATOM 1021 CA ASP A 66 -27.706 -4.918 1.333 1.00 0.00 C ATOM 1022 C ASP A 66 -26.265 -5.233 0.945 1.00 0.00 C ATOM 1023 O ASP A 66 -25.382 -5.295 1.800 1.00 0.00 O ATOM 1024 CB ASP A 66 -28.317 -6.135 2.027 1.00 0.00 C ATOM 1025 CG ASP A 66 -28.396 -7.339 1.098 1.00 0.00 C ATOM 1026 OD1 ASP A 66 -29.072 -7.237 0.047 1.00 0.00 O ATOM 1027 OD2 ASP A 66 -27.783 -8.379 1.412 1.00 0.00 O ATOM 0 H ASP A 66 -28.854 -5.390 -0.347 1.00 0.00 H new ATOM 0 HA ASP A 66 -27.704 -4.061 2.006 1.00 0.00 H new ATOM 0 HB2 ASP A 66 -27.721 -6.391 2.903 1.00 0.00 H new ATOM 0 HB3 ASP A 66 -29.316 -5.886 2.384 1.00 0.00 H new ATOM 1032 N ALA A 67 -26.036 -5.383 -0.354 1.00 0.00 N ATOM 1033 CA ALA A 67 -24.777 -5.911 -0.870 1.00 0.00 C ATOM 1034 C ALA A 67 -23.574 -5.095 -0.421 1.00 0.00 C ATOM 1035 O ALA A 67 -22.662 -5.629 0.203 1.00 0.00 O ATOM 1036 CB ALA A 67 -24.825 -5.971 -2.387 1.00 0.00 C ATOM 0 H ALA A 67 -26.714 -5.143 -1.077 1.00 0.00 H new ATOM 0 HA ALA A 67 -24.656 -6.914 -0.461 1.00 0.00 H new ATOM 0 HB1 ALA A 67 -23.882 -6.366 -2.766 1.00 0.00 H new ATOM 0 HB2 ALA A 67 -25.642 -6.621 -2.700 1.00 0.00 H new ATOM 0 HB3 ALA A 67 -24.985 -4.969 -2.786 1.00 0.00 H new ATOM 1042 N ASP A 68 -23.590 -3.807 -0.730 1.00 0.00 N ATOM 1043 CA ASP A 68 -22.438 -2.933 -0.498 1.00 0.00 C ATOM 1044 C ASP A 68 -21.958 -2.982 0.953 1.00 0.00 C ATOM 1045 O ASP A 68 -20.764 -3.121 1.216 1.00 0.00 O ATOM 1046 CB ASP A 68 -22.792 -1.500 -0.893 1.00 0.00 C ATOM 1047 CG ASP A 68 -21.658 -0.525 -0.639 1.00 0.00 C ATOM 1048 OD1 ASP A 68 -20.554 -0.734 -1.186 1.00 0.00 O ATOM 1049 OD2 ASP A 68 -21.872 0.461 0.092 1.00 0.00 O ATOM 0 H ASP A 68 -24.393 -3.336 -1.146 1.00 0.00 H new ATOM 0 HA ASP A 68 -21.617 -3.293 -1.118 1.00 0.00 H new ATOM 0 HB2 ASP A 68 -23.058 -1.474 -1.950 1.00 0.00 H new ATOM 0 HB3 ASP A 68 -23.672 -1.181 -0.335 1.00 0.00 H new ATOM 1054 N GLN A 69 -22.893 -2.905 1.888 1.00 0.00 N ATOM 1055 CA GLN A 69 -22.551 -2.899 3.308 1.00 0.00 C ATOM 1056 C GLN A 69 -22.058 -4.267 3.757 1.00 0.00 C ATOM 1057 O GLN A 69 -21.037 -4.372 4.435 1.00 0.00 O ATOM 1058 CB GLN A 69 -23.748 -2.456 4.156 1.00 0.00 C ATOM 1059 CG GLN A 69 -23.863 -0.943 4.313 1.00 0.00 C ATOM 1060 CD GLN A 69 -23.731 -0.203 2.996 1.00 0.00 C ATOM 1061 OE1 GLN A 69 -24.713 0.010 2.286 1.00 0.00 O ATOM 1062 NE2 GLN A 69 -22.519 0.223 2.678 1.00 0.00 N ATOM 0 H GLN A 69 -23.892 -2.846 1.693 1.00 0.00 H new ATOM 0 HA GLN A 69 -21.743 -2.182 3.453 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -24.663 -2.836 3.702 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -23.670 -2.910 5.144 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -24.825 -0.701 4.765 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -23.092 -0.594 4.999 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -21.731 0.025 3.294 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -22.373 0.749 1.816 1.00 0.00 H new ATOM 1071 N GLN A 70 -22.770 -5.314 3.357 1.00 0.00 N ATOM 1072 CA GLN A 70 -22.380 -6.675 3.694 1.00 0.00 C ATOM 1073 C GLN A 70 -21.009 -7.011 3.120 1.00 0.00 C ATOM 1074 O GLN A 70 -20.195 -7.647 3.781 1.00 0.00 O ATOM 1075 CB GLN A 70 -23.427 -7.654 3.182 1.00 0.00 C ATOM 1076 CG GLN A 70 -24.744 -7.557 3.926 1.00 0.00 C ATOM 1077 CD GLN A 70 -24.645 -8.080 5.345 1.00 0.00 C ATOM 1078 OE1 GLN A 70 -24.342 -7.334 6.278 1.00 0.00 O ATOM 1079 NE2 GLN A 70 -24.893 -9.368 5.512 1.00 0.00 N ATOM 0 H GLN A 70 -23.621 -5.245 2.799 1.00 0.00 H new ATOM 0 HA GLN A 70 -22.316 -6.757 4.779 1.00 0.00 H new ATOM 0 HB2 GLN A 70 -23.601 -7.470 2.122 1.00 0.00 H new ATOM 0 HB3 GLN A 70 -23.041 -8.669 3.270 1.00 0.00 H new ATOM 0 HG2 GLN A 70 -25.071 -6.517 3.947 1.00 0.00 H new ATOM 0 HG3 GLN A 70 -25.506 -8.120 3.386 1.00 0.00 H new ATOM 0 HE21 GLN A 70 -25.140 -9.948 4.710 1.00 0.00 H new ATOM 0 HE22 GLN A 70 -24.837 -9.782 6.443 1.00 0.00 H new ATOM 1088 N LYS A 71 -20.751 -6.563 1.896 1.00 0.00 N ATOM 1089 CA LYS A 71 -19.452 -6.766 1.265 1.00 0.00 C ATOM 1090 C LYS A 71 -18.351 -6.060 2.052 1.00 0.00 C ATOM 1091 O LYS A 71 -17.215 -6.528 2.104 1.00 0.00 O ATOM 1092 CB LYS A 71 -19.466 -6.259 -0.179 1.00 0.00 C ATOM 1093 CG LYS A 71 -20.359 -7.065 -1.111 1.00 0.00 C ATOM 1094 CD LYS A 71 -20.419 -6.439 -2.495 1.00 0.00 C ATOM 1095 CE LYS A 71 -21.315 -7.229 -3.439 1.00 0.00 C ATOM 1096 NZ LYS A 71 -20.779 -8.588 -3.719 1.00 0.00 N ATOM 0 H LYS A 71 -21.424 -6.057 1.321 1.00 0.00 H new ATOM 0 HA LYS A 71 -19.247 -7.837 1.260 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -19.796 -5.220 -0.185 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -18.448 -6.272 -0.567 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -19.983 -8.085 -1.187 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -21.364 -7.126 -0.693 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -20.788 -5.417 -2.415 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -19.413 -6.383 -2.912 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -22.311 -7.316 -3.004 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -21.423 -6.683 -4.376 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -21.013 -8.859 -4.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -19.746 -8.585 -3.598 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -21.203 -9.271 -3.059 1.00 0.00 H new ATOM 1110 N THR A 72 -18.697 -4.938 2.673 1.00 0.00 N ATOM 1111 CA THR A 72 -17.737 -4.174 3.454 1.00 0.00 C ATOM 1112 C THR A 72 -17.467 -4.848 4.802 1.00 0.00 C ATOM 1113 O THR A 72 -16.317 -5.009 5.210 1.00 0.00 O ATOM 1114 CB THR A 72 -18.231 -2.731 3.683 1.00 0.00 C ATOM 1115 OG1 THR A 72 -18.593 -2.134 2.429 1.00 0.00 O ATOM 1116 CG2 THR A 72 -17.152 -1.888 4.348 1.00 0.00 C ATOM 0 H THR A 72 -19.635 -4.539 2.650 1.00 0.00 H new ATOM 0 HA THR A 72 -16.808 -4.139 2.885 1.00 0.00 H new ATOM 0 HB THR A 72 -19.101 -2.769 4.338 1.00 0.00 H new ATOM 0 HG1 THR A 72 -19.534 -2.328 2.234 1.00 0.00 H new ATOM 0 HG21 THR A 72 -17.524 -0.875 4.499 1.00 0.00 H new ATOM 0 HG22 THR A 72 -16.890 -2.326 5.311 1.00 0.00 H new ATOM 0 HG23 THR A 72 -16.268 -1.859 3.710 1.00 0.00 H new ATOM 1124 N THR A 73 -18.528 -5.258 5.481 1.00 0.00 N ATOM 1125 CA THR A 73 -18.401 -5.898 6.784 1.00 0.00 C ATOM 1126 C THR A 73 -17.796 -7.300 6.663 1.00 0.00 C ATOM 1127 O THR A 73 -17.076 -7.754 7.556 1.00 0.00 O ATOM 1128 CB THR A 73 -19.768 -5.976 7.488 1.00 0.00 C ATOM 1129 OG1 THR A 73 -20.374 -4.678 7.495 1.00 0.00 O ATOM 1130 CG2 THR A 73 -19.621 -6.473 8.920 1.00 0.00 C ATOM 0 H THR A 73 -19.488 -5.159 5.152 1.00 0.00 H new ATOM 0 HA THR A 73 -17.727 -5.286 7.383 1.00 0.00 H new ATOM 0 HB THR A 73 -20.396 -6.681 6.943 1.00 0.00 H new ATOM 0 HG1 THR A 73 -20.669 -4.450 6.589 1.00 0.00 H new ATOM 0 HG21 THR A 73 -20.602 -6.518 9.392 1.00 0.00 H new ATOM 0 HG22 THR A 73 -19.174 -7.467 8.916 1.00 0.00 H new ATOM 0 HG23 THR A 73 -18.981 -5.790 9.478 1.00 0.00 H new ATOM 1138 N PHE A 74 -18.060 -7.965 5.540 1.00 0.00 N ATOM 1139 CA PHE A 74 -17.574 -9.326 5.312 1.00 0.00 C ATOM 1140 C PHE A 74 -16.051 -9.357 5.286 1.00 0.00 C ATOM 1141 O PHE A 74 -15.432 -10.363 5.632 1.00 0.00 O ATOM 1142 CB PHE A 74 -18.143 -9.874 4.000 1.00 0.00 C ATOM 1143 CG PHE A 74 -17.794 -11.309 3.725 1.00 0.00 C ATOM 1144 CD1 PHE A 74 -17.922 -12.273 4.712 1.00 0.00 C ATOM 1145 CD2 PHE A 74 -17.356 -11.694 2.469 1.00 0.00 C ATOM 1146 CE1 PHE A 74 -17.616 -13.595 4.450 1.00 0.00 C ATOM 1147 CE2 PHE A 74 -17.047 -13.011 2.203 1.00 0.00 C ATOM 1148 CZ PHE A 74 -17.178 -13.963 3.193 1.00 0.00 C ATOM 0 H PHE A 74 -18.610 -7.582 4.771 1.00 0.00 H new ATOM 0 HA PHE A 74 -17.913 -9.958 6.133 1.00 0.00 H new ATOM 0 HB2 PHE A 74 -19.228 -9.774 4.018 1.00 0.00 H new ATOM 0 HB3 PHE A 74 -17.780 -9.260 3.176 1.00 0.00 H new ATOM 0 HD1 PHE A 74 -18.264 -11.988 5.696 1.00 0.00 H new ATOM 0 HD2 PHE A 74 -17.255 -10.954 1.689 1.00 0.00 H new ATOM 0 HE1 PHE A 74 -17.719 -14.339 5.226 1.00 0.00 H new ATOM 0 HE2 PHE A 74 -16.703 -13.297 1.220 1.00 0.00 H new ATOM 0 HZ PHE A 74 -16.938 -14.995 2.985 1.00 0.00 H new ATOM 1158 N LYS A 75 -15.458 -8.239 4.887 1.00 0.00 N ATOM 1159 CA LYS A 75 -14.014 -8.092 4.889 1.00 0.00 C ATOM 1160 C LYS A 75 -13.451 -8.343 6.281 1.00 0.00 C ATOM 1161 O LYS A 75 -12.451 -9.033 6.441 1.00 0.00 O ATOM 1162 CB LYS A 75 -13.634 -6.689 4.424 1.00 0.00 C ATOM 1163 CG LYS A 75 -13.979 -6.414 2.972 1.00 0.00 C ATOM 1164 CD LYS A 75 -13.660 -4.981 2.590 1.00 0.00 C ATOM 1165 CE LYS A 75 -13.737 -4.781 1.084 1.00 0.00 C ATOM 1166 NZ LYS A 75 -13.326 -3.408 0.678 1.00 0.00 N ATOM 0 H LYS A 75 -15.962 -7.417 4.556 1.00 0.00 H new ATOM 0 HA LYS A 75 -13.591 -8.827 4.204 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -14.140 -5.957 5.054 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -12.563 -6.546 4.567 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -13.423 -7.096 2.329 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -15.038 -6.610 2.805 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -14.358 -4.306 3.085 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -12.662 -4.722 2.943 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -13.097 -5.511 0.589 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -14.756 -4.969 0.746 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -13.394 -3.317 -0.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -13.952 -2.711 1.129 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -12.345 -3.237 0.977 1.00 0.00 H new ATOM 1180 N GLN A 76 -14.131 -7.808 7.284 1.00 0.00 N ATOM 1181 CA GLN A 76 -13.690 -7.894 8.659 1.00 0.00 C ATOM 1182 C GLN A 76 -13.878 -9.305 9.208 1.00 0.00 C ATOM 1183 O GLN A 76 -13.104 -9.768 10.047 1.00 0.00 O ATOM 1184 CB GLN A 76 -14.483 -6.884 9.483 1.00 0.00 C ATOM 1185 CG GLN A 76 -14.179 -5.438 9.122 1.00 0.00 C ATOM 1186 CD GLN A 76 -15.122 -4.451 9.783 1.00 0.00 C ATOM 1187 OE1 GLN A 76 -14.873 -3.974 10.890 1.00 0.00 O ATOM 1188 NE2 GLN A 76 -16.204 -4.121 9.098 1.00 0.00 N ATOM 0 H GLN A 76 -15.007 -7.301 7.161 1.00 0.00 H new ATOM 0 HA GLN A 76 -12.626 -7.666 8.716 1.00 0.00 H new ATOM 0 HB2 GLN A 76 -15.548 -7.069 9.344 1.00 0.00 H new ATOM 0 HB3 GLN A 76 -14.268 -7.040 10.540 1.00 0.00 H new ATOM 0 HG2 GLN A 76 -13.155 -5.204 9.413 1.00 0.00 H new ATOM 0 HG3 GLN A 76 -14.238 -5.319 8.040 1.00 0.00 H new ATOM 0 HE21 GLN A 76 -16.375 -4.538 8.183 1.00 0.00 H new ATOM 0 HE22 GLN A 76 -16.867 -3.449 9.484 1.00 0.00 H new ATOM 1197 N THR A 77 -14.909 -9.983 8.717 1.00 0.00 N ATOM 1198 CA THR A 77 -15.202 -11.351 9.123 1.00 0.00 C ATOM 1199 C THR A 77 -14.051 -12.291 8.778 1.00 0.00 C ATOM 1200 O THR A 77 -13.702 -13.179 9.559 1.00 0.00 O ATOM 1201 CB THR A 77 -16.472 -11.863 8.422 1.00 0.00 C ATOM 1202 OG1 THR A 77 -17.563 -10.964 8.666 1.00 0.00 O ATOM 1203 CG2 THR A 77 -16.834 -13.261 8.912 1.00 0.00 C ATOM 0 H THR A 77 -15.561 -9.603 8.031 1.00 0.00 H new ATOM 0 HA THR A 77 -15.348 -11.340 10.203 1.00 0.00 H new ATOM 0 HB THR A 77 -16.277 -11.911 7.351 1.00 0.00 H new ATOM 0 HG1 THR A 77 -18.367 -11.296 8.215 1.00 0.00 H new ATOM 0 HG21 THR A 77 -17.735 -13.603 8.403 1.00 0.00 H new ATOM 0 HG22 THR A 77 -16.014 -13.946 8.697 1.00 0.00 H new ATOM 0 HG23 THR A 77 -17.012 -13.235 9.987 1.00 0.00 H new ATOM 1211 N VAL A 78 -13.457 -12.077 7.612 1.00 0.00 N ATOM 1212 CA VAL A 78 -12.430 -12.966 7.096 1.00 0.00 C ATOM 1213 C VAL A 78 -11.198 -13.008 8.010 1.00 0.00 C ATOM 1214 O VAL A 78 -10.604 -14.070 8.205 1.00 0.00 O ATOM 1215 CB VAL A 78 -12.035 -12.577 5.658 1.00 0.00 C ATOM 1216 CG1 VAL A 78 -10.877 -13.430 5.166 1.00 0.00 C ATOM 1217 CG2 VAL A 78 -13.233 -12.722 4.727 1.00 0.00 C ATOM 0 H VAL A 78 -13.673 -11.288 7.003 1.00 0.00 H new ATOM 0 HA VAL A 78 -12.853 -13.970 7.075 1.00 0.00 H new ATOM 0 HB VAL A 78 -11.713 -11.535 5.660 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -10.616 -13.137 4.149 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -10.016 -13.285 5.818 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -11.168 -14.480 5.178 1.00 0.00 H new ATOM 0 HG21 VAL A 78 -12.942 -12.444 3.714 1.00 0.00 H new ATOM 0 HG22 VAL A 78 -13.577 -13.756 4.735 1.00 0.00 H new ATOM 0 HG23 VAL A 78 -14.038 -12.069 5.065 1.00 0.00 H new ATOM 1227 N GLN A 79 -10.840 -11.869 8.603 1.00 0.00 N ATOM 1228 CA GLN A 79 -9.727 -11.818 9.546 1.00 0.00 C ATOM 1229 C GLN A 79 -10.017 -12.681 10.767 1.00 0.00 C ATOM 1230 O GLN A 79 -9.121 -13.315 11.324 1.00 0.00 O ATOM 1231 CB GLN A 79 -9.455 -10.382 9.994 1.00 0.00 C ATOM 1232 CG GLN A 79 -8.720 -9.532 8.971 1.00 0.00 C ATOM 1233 CD GLN A 79 -9.579 -9.192 7.777 1.00 0.00 C ATOM 1234 OE1 GLN A 79 -9.609 -9.921 6.787 1.00 0.00 O ATOM 1235 NE2 GLN A 79 -10.277 -8.077 7.859 1.00 0.00 N ATOM 0 H GLN A 79 -11.303 -10.974 8.447 1.00 0.00 H new ATOM 0 HA GLN A 79 -8.844 -12.203 9.035 1.00 0.00 H new ATOM 0 HB2 GLN A 79 -10.405 -9.903 10.231 1.00 0.00 H new ATOM 0 HB3 GLN A 79 -8.872 -10.406 10.914 1.00 0.00 H new ATOM 0 HG2 GLN A 79 -8.381 -8.611 9.445 1.00 0.00 H new ATOM 0 HG3 GLN A 79 -7.830 -10.063 8.634 1.00 0.00 H new ATOM 0 HE21 GLN A 79 -10.222 -7.502 8.700 1.00 0.00 H new ATOM 0 HE22 GLN A 79 -10.872 -7.789 7.082 1.00 0.00 H new ATOM 1244 N GLY A 80 -11.278 -12.711 11.169 1.00 0.00 N ATOM 1245 CA GLY A 80 -11.677 -13.515 12.304 1.00 0.00 C ATOM 1246 C GLY A 80 -11.829 -14.974 11.932 1.00 0.00 C ATOM 1247 O GLY A 80 -11.939 -15.838 12.799 1.00 0.00 O ATOM 0 H GLY A 80 -12.035 -12.190 10.727 1.00 0.00 H new ATOM 0 HA2 GLY A 80 -10.936 -13.417 13.097 1.00 0.00 H new ATOM 0 HA3 GLY A 80 -12.621 -13.141 12.701 1.00 0.00 H new ATOM 1251 N ALA A 81 -11.837 -15.246 10.637 1.00 0.00 N ATOM 1252 CA ALA A 81 -11.967 -16.603 10.143 1.00 0.00 C ATOM 1253 C ALA A 81 -10.596 -17.237 9.930 1.00 0.00 C ATOM 1254 O ALA A 81 -10.453 -18.456 9.965 1.00 0.00 O ATOM 1255 CB ALA A 81 -12.775 -16.617 8.856 1.00 0.00 C ATOM 0 H ALA A 81 -11.754 -14.539 9.907 1.00 0.00 H new ATOM 0 HA ALA A 81 -12.496 -17.195 10.890 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -12.866 -17.641 8.495 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -13.768 -16.210 9.045 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -12.271 -16.010 8.104 1.00 0.00 H new ATOM 1261 N LEU A 82 -9.591 -16.395 9.717 1.00 0.00 N ATOM 1262 CA LEU A 82 -8.218 -16.851 9.543 1.00 0.00 C ATOM 1263 C LEU A 82 -7.435 -16.658 10.836 1.00 0.00 C ATOM 1264 O LEU A 82 -6.227 -16.411 10.816 1.00 0.00 O ATOM 1265 CB LEU A 82 -7.541 -16.074 8.406 1.00 0.00 C ATOM 1266 CG LEU A 82 -8.138 -16.289 7.014 1.00 0.00 C ATOM 1267 CD1 LEU A 82 -7.473 -15.366 6.004 1.00 0.00 C ATOM 1268 CD2 LEU A 82 -7.983 -17.741 6.592 1.00 0.00 C ATOM 0 H LEU A 82 -9.704 -15.383 9.660 1.00 0.00 H new ATOM 0 HA LEU A 82 -8.232 -17.911 9.289 1.00 0.00 H new ATOM 0 HB2 LEU A 82 -7.584 -15.010 8.640 1.00 0.00 H new ATOM 0 HB3 LEU A 82 -6.487 -16.351 8.377 1.00 0.00 H new ATOM 0 HG LEU A 82 -9.201 -16.051 7.050 1.00 0.00 H new ATOM 0 HD11 LEU A 82 -7.909 -15.531 5.019 1.00 0.00 H new ATOM 0 HD12 LEU A 82 -7.629 -14.329 6.301 1.00 0.00 H new ATOM 0 HD13 LEU A 82 -6.404 -15.576 5.968 1.00 0.00 H new ATOM 0 HD21 LEU A 82 -8.412 -17.879 5.600 1.00 0.00 H new ATOM 0 HD22 LEU A 82 -6.925 -18.002 6.569 1.00 0.00 H new ATOM 0 HD23 LEU A 82 -8.500 -18.384 7.304 1.00 0.00 H new ATOM 1280 N SER A 83 -8.128 -16.801 11.959 1.00 0.00 N ATOM 1281 CA SER A 83 -7.537 -16.585 13.275 1.00 0.00 C ATOM 1282 C SER A 83 -6.676 -17.774 13.706 1.00 0.00 C ATOM 1283 O SER A 83 -6.808 -18.291 14.818 1.00 0.00 O ATOM 1284 CB SER A 83 -8.649 -16.335 14.291 1.00 0.00 C ATOM 1285 OG SER A 83 -9.687 -17.294 14.154 1.00 0.00 O ATOM 0 H SER A 83 -9.112 -17.069 11.984 1.00 0.00 H new ATOM 0 HA SER A 83 -6.884 -15.714 13.224 1.00 0.00 H new ATOM 0 HB2 SER A 83 -8.241 -16.377 15.301 1.00 0.00 H new ATOM 0 HB3 SER A 83 -9.054 -15.333 14.153 1.00 0.00 H new ATOM 0 HG SER A 83 -10.460 -16.880 13.716 1.00 0.00 H new ATOM 1291 N GLY A 84 -5.786 -18.192 12.824 1.00 0.00 N ATOM 1292 CA GLY A 84 -4.898 -19.299 13.125 1.00 0.00 C ATOM 1293 C GLY A 84 -4.265 -19.869 11.876 1.00 0.00 C ATOM 1294 O GLY A 84 -3.093 -20.251 11.878 1.00 0.00 O ATOM 0 H GLY A 84 -5.660 -17.784 11.898 1.00 0.00 H new ATOM 0 HA2 GLY A 84 -4.117 -18.963 13.807 1.00 0.00 H new ATOM 0 HA3 GLY A 84 -5.455 -20.082 13.639 1.00 0.00 H new ATOM 1298 N GLY A 85 -5.044 -19.918 10.811 1.00 0.00 N ATOM 1299 CA GLY A 85 -4.580 -20.443 9.565 1.00 0.00 C ATOM 1300 C GLY A 85 -5.738 -20.627 8.625 1.00 0.00 C ATOM 1301 O GLY A 85 -6.887 -20.397 9.001 1.00 0.00 O ATOM 0 H GLY A 85 -6.011 -19.593 10.797 1.00 0.00 H new ATOM 0 HA2 GLY A 85 -3.847 -19.766 9.125 1.00 0.00 H new ATOM 0 HA3 GLY A 85 -4.077 -21.396 9.727 1.00 0.00 H new ATOM 1305 N ILE A 86 -5.447 -21.031 7.411 1.00 0.00 N ATOM 1306 CA ILE A 86 -6.480 -21.255 6.414 1.00 0.00 C ATOM 1307 C ILE A 86 -7.181 -22.588 6.670 1.00 0.00 C ATOM 1308 O ILE A 86 -8.292 -22.831 6.200 1.00 0.00 O ATOM 1309 CB ILE A 86 -5.865 -21.261 5.007 1.00 0.00 C ATOM 1310 CG1 ILE A 86 -6.950 -21.202 3.935 1.00 0.00 C ATOM 1311 CG2 ILE A 86 -5.007 -22.503 4.833 1.00 0.00 C ATOM 1312 CD1 ILE A 86 -6.398 -21.016 2.544 1.00 0.00 C ATOM 0 H ILE A 86 -4.498 -21.214 7.084 1.00 0.00 H new ATOM 0 HA ILE A 86 -7.209 -20.448 6.484 1.00 0.00 H new ATOM 0 HB ILE A 86 -5.240 -20.375 4.893 1.00 0.00 H new ATOM 0 HG12 ILE A 86 -7.535 -22.121 3.967 1.00 0.00 H new ATOM 0 HG13 ILE A 86 -7.632 -20.382 4.161 1.00 0.00 H new ATOM 0 HG21 ILE A 86 -4.571 -22.507 3.834 1.00 0.00 H new ATOM 0 HG22 ILE A 86 -4.210 -22.502 5.577 1.00 0.00 H new ATOM 0 HG23 ILE A 86 -5.624 -23.392 4.963 1.00 0.00 H new ATOM 0 HD11 ILE A 86 -7.219 -20.982 1.828 1.00 0.00 H new ATOM 0 HD12 ILE A 86 -5.837 -20.083 2.497 1.00 0.00 H new ATOM 0 HD13 ILE A 86 -5.738 -21.849 2.300 1.00 0.00 H new ATOM 1324 N ASP A 87 -6.515 -23.446 7.433 1.00 0.00 N ATOM 1325 CA ASP A 87 -7.036 -24.766 7.733 1.00 0.00 C ATOM 1326 C ASP A 87 -8.185 -24.650 8.730 1.00 0.00 C ATOM 1327 O ASP A 87 -7.963 -24.487 9.930 1.00 0.00 O ATOM 1328 CB ASP A 87 -5.927 -25.653 8.304 1.00 0.00 C ATOM 1329 CG ASP A 87 -6.306 -27.117 8.328 1.00 0.00 C ATOM 1330 OD1 ASP A 87 -5.951 -27.833 7.371 1.00 0.00 O ATOM 1331 OD2 ASP A 87 -6.943 -27.561 9.300 1.00 0.00 O ATOM 0 H ASP A 87 -5.608 -23.246 7.855 1.00 0.00 H new ATOM 0 HA ASP A 87 -7.406 -25.222 6.815 1.00 0.00 H new ATOM 0 HB2 ASP A 87 -5.023 -25.526 7.709 1.00 0.00 H new ATOM 0 HB3 ASP A 87 -5.691 -25.326 9.317 1.00 0.00 H new ATOM 1336 N GLY A 88 -9.407 -24.689 8.221 1.00 0.00 N ATOM 1337 CA GLY A 88 -10.571 -24.529 9.071 1.00 0.00 C ATOM 1338 C GLY A 88 -11.434 -23.362 8.635 1.00 0.00 C ATOM 1339 O GLY A 88 -12.508 -23.129 9.194 1.00 0.00 O ATOM 0 H GLY A 88 -9.615 -24.829 7.232 1.00 0.00 H new ATOM 0 HA2 GLY A 88 -11.162 -25.444 9.053 1.00 0.00 H new ATOM 0 HA3 GLY A 88 -10.250 -24.378 10.102 1.00 0.00 H new ATOM 1343 N PHE A 89 -10.961 -22.620 7.639 1.00 0.00 N ATOM 1344 CA PHE A 89 -11.719 -21.511 7.078 1.00 0.00 C ATOM 1345 C PHE A 89 -12.970 -22.031 6.381 1.00 0.00 C ATOM 1346 O PHE A 89 -12.892 -22.724 5.367 1.00 0.00 O ATOM 1347 CB PHE A 89 -10.852 -20.714 6.096 1.00 0.00 C ATOM 1348 CG PHE A 89 -11.529 -19.508 5.500 1.00 0.00 C ATOM 1349 CD1 PHE A 89 -11.469 -18.273 6.129 1.00 0.00 C ATOM 1350 CD2 PHE A 89 -12.217 -19.606 4.299 1.00 0.00 C ATOM 1351 CE1 PHE A 89 -12.081 -17.165 5.573 1.00 0.00 C ATOM 1352 CE2 PHE A 89 -12.831 -18.501 3.743 1.00 0.00 C ATOM 1353 CZ PHE A 89 -12.763 -17.280 4.380 1.00 0.00 C ATOM 0 H PHE A 89 -10.051 -22.769 7.203 1.00 0.00 H new ATOM 0 HA PHE A 89 -12.020 -20.847 7.889 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -9.948 -20.390 6.611 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -10.539 -21.375 5.288 1.00 0.00 H new ATOM 0 HD1 PHE A 89 -10.938 -18.176 7.064 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -12.273 -20.558 3.793 1.00 0.00 H new ATOM 0 HE1 PHE A 89 -12.025 -16.209 6.073 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -13.365 -18.593 2.809 1.00 0.00 H new ATOM 0 HZ PHE A 89 -13.243 -16.416 3.946 1.00 0.00 H new ATOM 1363 N GLY A 90 -14.118 -21.700 6.942 1.00 0.00 N ATOM 1364 CA GLY A 90 -15.375 -22.145 6.386 1.00 0.00 C ATOM 1365 C GLY A 90 -16.547 -21.360 6.930 1.00 0.00 C ATOM 1366 O GLY A 90 -16.362 -20.295 7.533 1.00 0.00 O ATOM 0 H GLY A 90 -14.203 -21.126 7.781 1.00 0.00 H new ATOM 0 HA2 GLY A 90 -15.346 -22.047 5.301 1.00 0.00 H new ATOM 0 HA3 GLY A 90 -15.514 -23.203 6.607 1.00 0.00 H new ATOM 1370 N SER A 91 -17.745 -21.902 6.757 1.00 0.00 N ATOM 1371 CA SER A 91 -18.975 -21.215 7.135 1.00 0.00 C ATOM 1372 C SER A 91 -19.188 -21.205 8.649 1.00 0.00 C ATOM 1373 O SER A 91 -20.190 -20.691 9.144 1.00 0.00 O ATOM 1374 CB SER A 91 -20.159 -21.874 6.427 1.00 0.00 C ATOM 1375 OG SER A 91 -20.017 -23.285 6.405 1.00 0.00 O ATOM 0 H SER A 91 -17.893 -22.827 6.352 1.00 0.00 H new ATOM 0 HA SER A 91 -18.893 -20.174 6.823 1.00 0.00 H new ATOM 0 HB2 SER A 91 -21.086 -21.606 6.935 1.00 0.00 H new ATOM 0 HB3 SER A 91 -20.233 -21.496 5.407 1.00 0.00 H new ATOM 0 HG SER A 91 -20.787 -23.684 5.949 1.00 0.00 H new ATOM 1381 N ASN A 92 -18.237 -21.761 9.384 1.00 0.00 N ATOM 1382 CA ASN A 92 -18.296 -21.739 10.836 1.00 0.00 C ATOM 1383 C ASN A 92 -17.956 -20.341 11.333 1.00 0.00 C ATOM 1384 O ASN A 92 -18.456 -19.893 12.362 1.00 0.00 O ATOM 1385 CB ASN A 92 -17.324 -22.763 11.432 1.00 0.00 C ATOM 1386 CG ASN A 92 -17.399 -22.826 12.949 1.00 0.00 C ATOM 1387 OD1 ASN A 92 -18.197 -23.576 13.511 1.00 0.00 O ATOM 1388 ND2 ASN A 92 -16.566 -22.048 13.624 1.00 0.00 N ATOM 0 H ASN A 92 -17.418 -22.232 9.000 1.00 0.00 H new ATOM 0 HA ASN A 92 -19.304 -22.003 11.154 1.00 0.00 H new ATOM 0 HB2 ASN A 92 -17.542 -23.748 11.020 1.00 0.00 H new ATOM 0 HB3 ASN A 92 -16.307 -22.510 11.132 1.00 0.00 H new ATOM 0 HD21 ASN A 92 -16.572 -22.058 14.644 1.00 0.00 H new ATOM 0 HD22 ASN A 92 -15.918 -21.439 13.124 1.00 0.00 H new ATOM 1395 N ASN A 93 -17.113 -19.651 10.575 1.00 0.00 N ATOM 1396 CA ASN A 93 -16.687 -18.312 10.946 1.00 0.00 C ATOM 1397 C ASN A 93 -17.209 -17.303 9.936 1.00 0.00 C ATOM 1398 O ASN A 93 -17.957 -16.386 10.275 1.00 0.00 O ATOM 1399 CB ASN A 93 -15.159 -18.193 10.997 1.00 0.00 C ATOM 1400 CG ASN A 93 -14.467 -19.348 11.694 1.00 0.00 C ATOM 1401 OD1 ASN A 93 -15.026 -20.000 12.572 1.00 0.00 O ATOM 1402 ND2 ASN A 93 -13.231 -19.605 11.299 1.00 0.00 N ATOM 0 H ASN A 93 -16.713 -19.997 9.703 1.00 0.00 H new ATOM 0 HA ASN A 93 -17.090 -18.110 11.939 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -14.778 -18.117 9.979 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -14.895 -17.266 11.506 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -12.707 -20.368 11.727 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -12.802 -19.040 10.566 1.00 0.00 H new ATOM 1409 N ALA A 94 -16.810 -17.490 8.686 1.00 0.00 N ATOM 1410 CA ALA A 94 -17.133 -16.546 7.632 1.00 0.00 C ATOM 1411 C ALA A 94 -18.456 -16.891 6.979 1.00 0.00 C ATOM 1412 O ALA A 94 -18.524 -17.767 6.115 1.00 0.00 O ATOM 1413 CB ALA A 94 -16.023 -16.513 6.594 1.00 0.00 C ATOM 0 H ALA A 94 -16.259 -18.292 8.379 1.00 0.00 H new ATOM 0 HA ALA A 94 -17.225 -15.557 8.080 1.00 0.00 H new ATOM 0 HB1 ALA A 94 -16.279 -15.801 5.810 1.00 0.00 H new ATOM 0 HB2 ALA A 94 -15.090 -16.210 7.069 1.00 0.00 H new ATOM 0 HB3 ALA A 94 -15.903 -17.505 6.158 1.00 0.00 H new ATOM 1419 N VAL A 95 -19.509 -16.224 7.423 1.00 0.00 N ATOM 1420 CA VAL A 95 -20.823 -16.381 6.827 1.00 0.00 C ATOM 1421 C VAL A 95 -21.496 -15.041 6.641 1.00 0.00 C ATOM 1422 O VAL A 95 -21.473 -14.184 7.528 1.00 0.00 O ATOM 1423 CB VAL A 95 -21.763 -17.272 7.661 1.00 0.00 C ATOM 1424 CG1 VAL A 95 -21.652 -18.721 7.223 1.00 0.00 C ATOM 1425 CG2 VAL A 95 -21.477 -17.133 9.152 1.00 0.00 C ATOM 0 H VAL A 95 -19.477 -15.564 8.200 1.00 0.00 H new ATOM 0 HA VAL A 95 -20.649 -16.864 5.866 1.00 0.00 H new ATOM 0 HB VAL A 95 -22.786 -16.937 7.487 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -22.323 -19.335 7.823 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -21.926 -18.805 6.171 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -20.627 -19.065 7.359 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -22.156 -17.774 9.714 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -20.448 -17.429 9.354 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -21.622 -16.096 9.455 1.00 0.00 H new ATOM 1435 N THR A 96 -22.080 -14.865 5.482 1.00 0.00 N ATOM 1436 CA THR A 96 -22.898 -13.710 5.224 1.00 0.00 C ATOM 1437 C THR A 96 -24.360 -14.052 5.467 1.00 0.00 C ATOM 1438 O THR A 96 -24.901 -14.978 4.865 1.00 0.00 O ATOM 1439 CB THR A 96 -22.711 -13.202 3.788 1.00 0.00 C ATOM 1440 OG1 THR A 96 -22.815 -14.291 2.862 1.00 0.00 O ATOM 1441 CG2 THR A 96 -21.364 -12.514 3.631 1.00 0.00 C ATOM 0 H THR A 96 -22.002 -15.513 4.698 1.00 0.00 H new ATOM 0 HA THR A 96 -22.589 -12.916 5.904 1.00 0.00 H new ATOM 0 HB THR A 96 -23.497 -12.477 3.576 1.00 0.00 H new ATOM 0 HG1 THR A 96 -22.670 -13.961 1.951 1.00 0.00 H new ATOM 0 HG21 THR A 96 -21.253 -12.162 2.605 1.00 0.00 H new ATOM 0 HG22 THR A 96 -21.307 -11.666 4.314 1.00 0.00 H new ATOM 0 HG23 THR A 96 -20.566 -13.220 3.861 1.00 0.00 H new ATOM 1449 N THR A 97 -24.998 -13.319 6.360 1.00 0.00 N ATOM 1450 CA THR A 97 -26.398 -13.549 6.680 1.00 0.00 C ATOM 1451 C THR A 97 -27.319 -12.951 5.608 1.00 0.00 C ATOM 1452 O THR A 97 -28.482 -12.631 5.870 1.00 0.00 O ATOM 1453 CB THR A 97 -26.742 -12.962 8.062 1.00 0.00 C ATOM 1454 OG1 THR A 97 -26.433 -11.561 8.101 1.00 0.00 O ATOM 1455 CG2 THR A 97 -25.970 -13.691 9.157 1.00 0.00 C ATOM 0 H THR A 97 -24.568 -12.555 6.880 1.00 0.00 H new ATOM 0 HA THR A 97 -26.559 -14.627 6.705 1.00 0.00 H new ATOM 0 HB THR A 97 -27.810 -13.094 8.234 1.00 0.00 H new ATOM 0 HG1 THR A 97 -26.658 -11.201 8.984 1.00 0.00 H new ATOM 0 HG21 THR A 97 -26.224 -13.264 10.127 1.00 0.00 H new ATOM 0 HG22 THR A 97 -26.233 -14.749 9.145 1.00 0.00 H new ATOM 0 HG23 THR A 97 -24.900 -13.582 8.982 1.00 0.00 H new ATOM 1463 N CYS A 98 -26.789 -12.838 4.393 1.00 0.00 N ATOM 1464 CA CYS A 98 -27.533 -12.302 3.264 1.00 0.00 C ATOM 1465 C CYS A 98 -28.532 -13.333 2.751 1.00 0.00 C ATOM 1466 O CYS A 98 -28.396 -14.530 3.013 1.00 0.00 O ATOM 1467 CB CYS A 98 -26.569 -11.894 2.149 1.00 0.00 C ATOM 1468 SG CYS A 98 -25.309 -10.691 2.681 1.00 0.00 S ATOM 0 H CYS A 98 -25.834 -13.116 4.167 1.00 0.00 H new ATOM 0 HA CYS A 98 -28.084 -11.421 3.592 1.00 0.00 H new ATOM 0 HB2 CYS A 98 -26.071 -12.785 1.767 1.00 0.00 H new ATOM 0 HB3 CYS A 98 -27.140 -11.469 1.324 1.00 0.00 H new ATOM 1473 N GLY A 99 -29.526 -12.866 2.015 1.00 0.00 N ATOM 1474 CA GLY A 99 -30.600 -13.734 1.589 1.00 0.00 C ATOM 1475 C GLY A 99 -31.796 -13.575 2.492 1.00 0.00 C ATOM 1476 O GLY A 99 -32.535 -14.524 2.753 1.00 0.00 O ATOM 0 H GLY A 99 -29.608 -11.898 1.704 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -30.879 -13.500 0.562 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -30.264 -14.771 1.600 1.00 0.00 H new ATOM 1480 N ASN A 100 -31.968 -12.356 2.981 1.00 0.00 N ATOM 1481 CA ASN A 100 -33.027 -12.045 3.924 1.00 0.00 C ATOM 1482 C ASN A 100 -34.374 -11.986 3.218 1.00 0.00 C ATOM 1483 O ASN A 100 -34.548 -11.243 2.252 1.00 0.00 O ATOM 1484 CB ASN A 100 -32.735 -10.716 4.621 1.00 0.00 C ATOM 1485 CG ASN A 100 -33.775 -10.354 5.667 1.00 0.00 C ATOM 1486 OD1 ASN A 100 -33.665 -10.751 6.825 1.00 0.00 O ATOM 1487 ND2 ASN A 100 -34.783 -9.590 5.271 1.00 0.00 N ATOM 0 H ASN A 100 -31.380 -11.560 2.736 1.00 0.00 H new ATOM 0 HA ASN A 100 -33.067 -12.836 4.673 1.00 0.00 H new ATOM 0 HB2 ASN A 100 -31.754 -10.768 5.094 1.00 0.00 H new ATOM 0 HB3 ASN A 100 -32.687 -9.923 3.874 1.00 0.00 H new ATOM 0 HD21 ASN A 100 -35.504 -9.311 5.937 1.00 0.00 H new ATOM 0 HD22 ASN A 100 -34.838 -9.281 4.300 1.00 0.00 H new ATOM 1494 N GLY A 101 -35.314 -12.779 3.699 1.00 0.00 N ATOM 1495 CA GLY A 101 -36.646 -12.794 3.133 1.00 0.00 C ATOM 1496 C GLY A 101 -37.615 -13.520 4.034 1.00 0.00 C ATOM 1497 O GLY A 101 -38.303 -12.903 4.845 1.00 0.00 O ATOM 0 H GLY A 101 -35.178 -13.420 4.480 1.00 0.00 H new ATOM 0 HA2 GLY A 101 -36.988 -11.771 2.976 1.00 0.00 H new ATOM 0 HA3 GLY A 101 -36.623 -13.276 2.156 1.00 0.00 H new ATOM 1501 N SER A 102 -37.663 -14.831 3.901 1.00 0.00 N ATOM 1502 CA SER A 102 -38.491 -15.651 4.761 1.00 0.00 C ATOM 1503 C SER A 102 -37.626 -16.698 5.454 1.00 0.00 C ATOM 1504 O SER A 102 -36.923 -16.333 6.422 1.00 0.00 O ATOM 1505 CB SER A 102 -39.606 -16.313 3.948 1.00 0.00 C ATOM 1506 OG SER A 102 -40.416 -15.338 3.302 1.00 0.00 O ATOM 0 H SER A 102 -37.135 -15.353 3.201 1.00 0.00 H new ATOM 0 HA SER A 102 -38.957 -15.024 5.521 1.00 0.00 H new ATOM 0 HB2 SER A 102 -39.171 -16.980 3.204 1.00 0.00 H new ATOM 0 HB3 SER A 102 -40.223 -16.927 4.604 1.00 0.00 H new ATOM 0 HG SER A 102 -41.120 -15.786 2.788 1.00 0.00 H new TER 1512 SER A 102