USER MOD reduce.3.24.130724 H: found=0, std=0, add=761, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 758 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 40 SER OG : rot 180:sc= -0.0265 USER MOD Set 1.2: A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -141:sc= 0.0119 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 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 14 MET CE :methyl 162:sc= -0.0201 (180deg=-0.287) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 LYS NZ :NH3+ -151:sc= -0.17 (180deg=-0.835) USER MOD Single : A 17 TYR OH : rot 180:sc= 0 USER MOD Single : A 20 THR OG1 : rot -34:sc= 0.323 USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 30 ASN : amide:sc= -3.07! C(o=-3.1!,f=-3.1!) USER MOD Single : A 31 LYS NZ :NH3+ -155:sc= 0.729 (180deg=0.242) USER MOD Single : A 33 THR OG1 : rot 154:sc= 0.709 USER MOD Single : A 35 GLN : amide:sc= -2.49 K(o=-2.5,f=-7.7!) USER MOD Single : A 38 TYR OH : rot 0:sc= -0.154 USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 ASN : amide:sc= -0.005 K(o=-0.005,f=-0.8) USER MOD Single : A 43 ASN : amide:sc= -0.837 K(o=-0.84,f=-2.4!) USER MOD Single : A 45 HIS : no HE2:sc= -2.67 X(o=-2.7,f=-2.4) USER MOD Single : A 47 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 60 CYS SG : rot 180:sc= 0 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 63 ASN : amide:sc= -2.07! K(o=-2.1!,f=-2.6) USER MOD Single : A 64 SER OG : rot 180:sc= 0 USER MOD Single : A 66 ASN : amide:sc= -2.14! C(o=-2.1!,f=-6.7!) USER MOD Single : A 67 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 71 THR OG1 : rot 180:sc= 0 USER MOD Single : A 72 ASN : amide:sc= -0.226 X(o=-0.23,f=-0.046) USER MOD Single : A 74 GLN : amide:sc= -0.0933 K(o=-0.093,f=-2.9!) USER MOD Single : A 75 TYR OH : rot 180:sc= 0 USER MOD Single : A 76 THR OG1 : rot 180:sc= 0 USER MOD Single : A 83 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 86 CYS SG : rot -81:sc= 0.00659 USER MOD Single : A 87 CYS SG : rot -160:sc= -0.0405 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 SER OG : rot 180:sc= 0 USER MOD Single : A 96 SER OG : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -14.809 -6.887 13.129 1.00 0.00 N ATOM 2 CA GLY A 1 -14.471 -8.162 13.734 1.00 0.00 C ATOM 3 C GLY A 1 -12.994 -8.481 13.626 1.00 0.00 C ATOM 4 O GLY A 1 -12.149 -7.596 13.758 1.00 0.00 O ATOM 0 H1 GLY A 1 -15.520 -6.403 13.714 1.00 0.00 H new ATOM 0 H2 GLY A 1 -13.955 -6.297 13.063 1.00 0.00 H new ATOM 0 H3 GLY A 1 -15.195 -7.046 12.176 1.00 0.00 H new ATOM 0 HA2 GLY A 1 -14.761 -8.150 14.785 1.00 0.00 H new ATOM 0 HA3 GLY A 1 -15.047 -8.953 13.253 1.00 0.00 H new ATOM 8 N SER A 2 -12.680 -9.751 13.387 1.00 0.00 N ATOM 9 CA SER A 2 -11.294 -10.186 13.266 1.00 0.00 C ATOM 10 C SER A 2 -10.993 -10.653 11.846 1.00 0.00 C ATOM 11 O SER A 2 -11.898 -11.014 11.094 1.00 0.00 O ATOM 12 CB SER A 2 -11.003 -11.314 14.259 1.00 0.00 C ATOM 13 OG SER A 2 -9.616 -11.409 14.530 1.00 0.00 O ATOM 0 H SER A 2 -13.367 -10.496 13.273 1.00 0.00 H new ATOM 0 HA SER A 2 -10.651 -9.336 13.494 1.00 0.00 H new ATOM 0 HB2 SER A 2 -11.547 -11.135 15.187 1.00 0.00 H new ATOM 0 HB3 SER A 2 -11.364 -12.260 13.855 1.00 0.00 H new ATOM 0 HG SER A 2 -9.456 -12.136 15.168 1.00 0.00 H new ATOM 19 N SER A 3 -9.713 -10.643 11.485 1.00 0.00 N ATOM 20 CA SER A 3 -9.291 -11.062 10.153 1.00 0.00 C ATOM 21 C SER A 3 -8.807 -12.508 10.167 1.00 0.00 C ATOM 22 O SER A 3 -8.733 -13.140 11.220 1.00 0.00 O ATOM 23 CB SER A 3 -8.182 -10.145 9.635 1.00 0.00 C ATOM 24 OG SER A 3 -8.714 -8.926 9.146 1.00 0.00 O ATOM 0 H SER A 3 -8.951 -10.349 12.096 1.00 0.00 H new ATOM 0 HA SER A 3 -10.151 -10.992 9.487 1.00 0.00 H new ATOM 0 HB2 SER A 3 -7.472 -9.940 10.436 1.00 0.00 H new ATOM 0 HB3 SER A 3 -7.630 -10.649 8.841 1.00 0.00 H new ATOM 0 HG SER A 3 -7.985 -8.357 8.822 1.00 0.00 H new ATOM 30 N GLY A 4 -8.477 -13.027 8.988 1.00 0.00 N ATOM 31 CA GLY A 4 -8.004 -14.395 8.885 1.00 0.00 C ATOM 32 C GLY A 4 -6.492 -14.490 8.931 1.00 0.00 C ATOM 33 O GLY A 4 -5.801 -13.474 9.018 1.00 0.00 O ATOM 0 H GLY A 4 -8.529 -12.524 8.102 1.00 0.00 H new ATOM 0 HA2 GLY A 4 -8.427 -14.985 9.698 1.00 0.00 H new ATOM 0 HA3 GLY A 4 -8.364 -14.832 7.954 1.00 0.00 H new ATOM 37 N SER A 5 -5.975 -15.713 8.875 1.00 0.00 N ATOM 38 CA SER A 5 -4.535 -15.938 8.917 1.00 0.00 C ATOM 39 C SER A 5 -3.861 -15.374 7.670 1.00 0.00 C ATOM 40 O SER A 5 -4.505 -15.172 6.640 1.00 0.00 O ATOM 41 CB SER A 5 -4.234 -17.433 9.041 1.00 0.00 C ATOM 42 OG SER A 5 -2.942 -17.649 9.581 1.00 0.00 O ATOM 0 H SER A 5 -6.532 -16.564 8.800 1.00 0.00 H new ATOM 0 HA SER A 5 -4.137 -15.421 9.790 1.00 0.00 H new ATOM 0 HB2 SER A 5 -4.982 -17.906 9.678 1.00 0.00 H new ATOM 0 HB3 SER A 5 -4.306 -17.904 8.061 1.00 0.00 H new ATOM 0 HG SER A 5 -2.774 -18.612 9.652 1.00 0.00 H new ATOM 48 N SER A 6 -2.560 -15.121 7.771 1.00 0.00 N ATOM 49 CA SER A 6 -1.798 -14.577 6.653 1.00 0.00 C ATOM 50 C SER A 6 -0.354 -15.071 6.688 1.00 0.00 C ATOM 51 O SER A 6 0.145 -15.491 7.731 1.00 0.00 O ATOM 52 CB SER A 6 -1.826 -13.047 6.686 1.00 0.00 C ATOM 53 OG SER A 6 -3.132 -12.556 6.437 1.00 0.00 O ATOM 0 H SER A 6 -2.012 -15.284 8.615 1.00 0.00 H new ATOM 0 HA SER A 6 -2.260 -14.922 5.728 1.00 0.00 H new ATOM 0 HB2 SER A 6 -1.481 -12.695 7.658 1.00 0.00 H new ATOM 0 HB3 SER A 6 -1.137 -12.651 5.940 1.00 0.00 H new ATOM 0 HG SER A 6 -3.124 -11.576 6.465 1.00 0.00 H new ATOM 59 N GLY A 7 0.311 -15.016 5.538 1.00 0.00 N ATOM 60 CA GLY A 7 1.690 -15.460 5.457 1.00 0.00 C ATOM 61 C GLY A 7 2.077 -15.898 4.059 1.00 0.00 C ATOM 62 O GLY A 7 1.540 -16.873 3.533 1.00 0.00 O ATOM 0 H GLY A 7 -0.081 -14.672 4.661 1.00 0.00 H new ATOM 0 HA2 GLY A 7 2.348 -14.652 5.776 1.00 0.00 H new ATOM 0 HA3 GLY A 7 1.843 -16.288 6.149 1.00 0.00 H new ATOM 66 N LYS A 8 3.012 -15.174 3.452 1.00 0.00 N ATOM 67 CA LYS A 8 3.472 -15.492 2.105 1.00 0.00 C ATOM 68 C LYS A 8 4.778 -14.771 1.791 1.00 0.00 C ATOM 69 O LYS A 8 4.809 -13.546 1.671 1.00 0.00 O ATOM 70 CB LYS A 8 2.405 -15.108 1.076 1.00 0.00 C ATOM 71 CG LYS A 8 2.637 -15.717 -0.296 1.00 0.00 C ATOM 72 CD LYS A 8 2.202 -17.172 -0.341 1.00 0.00 C ATOM 73 CE LYS A 8 2.116 -17.684 -1.771 1.00 0.00 C ATOM 74 NZ LYS A 8 3.441 -18.133 -2.279 1.00 0.00 N ATOM 0 H LYS A 8 3.466 -14.363 3.872 1.00 0.00 H new ATOM 0 HA LYS A 8 3.649 -16.566 2.053 1.00 0.00 H new ATOM 0 HB2 LYS A 8 1.428 -15.422 1.443 1.00 0.00 H new ATOM 0 HB3 LYS A 8 2.376 -14.022 0.982 1.00 0.00 H new ATOM 0 HG2 LYS A 8 2.086 -15.148 -1.045 1.00 0.00 H new ATOM 0 HG3 LYS A 8 3.694 -15.644 -0.554 1.00 0.00 H new ATOM 0 HD2 LYS A 8 2.908 -17.782 0.223 1.00 0.00 H new ATOM 0 HD3 LYS A 8 1.231 -17.278 0.144 1.00 0.00 H new ATOM 0 HE2 LYS A 8 1.409 -18.512 -1.818 1.00 0.00 H new ATOM 0 HE3 LYS A 8 1.728 -16.896 -2.416 1.00 0.00 H new ATOM 0 HZ1 LYS A 8 3.341 -18.475 -3.256 1.00 0.00 H new ATOM 0 HZ2 LYS A 8 4.109 -17.336 -2.258 1.00 0.00 H new ATOM 0 HZ3 LYS A 8 3.800 -18.902 -1.679 1.00 0.00 H new ATOM 88 N ALA A 9 5.856 -15.538 1.659 1.00 0.00 N ATOM 89 CA ALA A 9 7.164 -14.972 1.356 1.00 0.00 C ATOM 90 C ALA A 9 7.045 -13.804 0.383 1.00 0.00 C ATOM 91 O ALA A 9 7.801 -12.835 0.464 1.00 0.00 O ATOM 92 CB ALA A 9 8.084 -16.043 0.788 1.00 0.00 C ATOM 0 H ALA A 9 5.848 -16.553 1.757 1.00 0.00 H new ATOM 0 HA ALA A 9 7.593 -14.595 2.284 1.00 0.00 H new ATOM 0 HB1 ALA A 9 9.058 -15.606 0.566 1.00 0.00 H new ATOM 0 HB2 ALA A 9 8.203 -16.844 1.517 1.00 0.00 H new ATOM 0 HB3 ALA A 9 7.651 -16.447 -0.127 1.00 0.00 H new ATOM 98 N PHE A 10 6.092 -13.902 -0.538 1.00 0.00 N ATOM 99 CA PHE A 10 5.875 -12.853 -1.528 1.00 0.00 C ATOM 100 C PHE A 10 5.298 -11.600 -0.876 1.00 0.00 C ATOM 101 O PHE A 10 5.870 -10.514 -0.979 1.00 0.00 O ATOM 102 CB PHE A 10 4.934 -13.348 -2.629 1.00 0.00 C ATOM 103 CG PHE A 10 4.866 -12.432 -3.817 1.00 0.00 C ATOM 104 CD1 PHE A 10 4.073 -11.296 -3.787 1.00 0.00 C ATOM 105 CD2 PHE A 10 5.595 -12.707 -4.963 1.00 0.00 C ATOM 106 CE1 PHE A 10 4.009 -10.450 -4.879 1.00 0.00 C ATOM 107 CE2 PHE A 10 5.535 -11.864 -6.057 1.00 0.00 C ATOM 108 CZ PHE A 10 4.740 -10.736 -6.015 1.00 0.00 C ATOM 0 H PHE A 10 5.458 -14.697 -0.620 1.00 0.00 H new ATOM 0 HA PHE A 10 6.839 -12.600 -1.970 1.00 0.00 H new ATOM 0 HB2 PHE A 10 5.261 -14.334 -2.959 1.00 0.00 H new ATOM 0 HB3 PHE A 10 3.933 -13.466 -2.214 1.00 0.00 H new ATOM 0 HD1 PHE A 10 3.499 -11.069 -2.901 1.00 0.00 H new ATOM 0 HD2 PHE A 10 6.217 -13.589 -5.002 1.00 0.00 H new ATOM 0 HE1 PHE A 10 3.388 -9.567 -4.843 1.00 0.00 H new ATOM 0 HE2 PHE A 10 6.110 -12.088 -6.944 1.00 0.00 H new ATOM 0 HZ PHE A 10 4.690 -10.078 -6.870 1.00 0.00 H new ATOM 118 N LEU A 11 4.163 -11.759 -0.206 1.00 0.00 N ATOM 119 CA LEU A 11 3.506 -10.641 0.463 1.00 0.00 C ATOM 120 C LEU A 11 4.385 -10.082 1.578 1.00 0.00 C ATOM 121 O LEU A 11 4.651 -8.881 1.629 1.00 0.00 O ATOM 122 CB LEU A 11 2.158 -11.082 1.034 1.00 0.00 C ATOM 123 CG LEU A 11 1.069 -11.406 0.010 1.00 0.00 C ATOM 124 CD1 LEU A 11 -0.168 -11.957 0.702 1.00 0.00 C ATOM 125 CD2 LEU A 11 0.720 -10.169 -0.806 1.00 0.00 C ATOM 0 H LEU A 11 3.678 -12.651 -0.111 1.00 0.00 H new ATOM 0 HA LEU A 11 3.341 -9.855 -0.274 1.00 0.00 H new ATOM 0 HB2 LEU A 11 2.320 -11.964 1.654 1.00 0.00 H new ATOM 0 HB3 LEU A 11 1.789 -10.294 1.690 1.00 0.00 H new ATOM 0 HG LEU A 11 1.450 -12.169 -0.668 1.00 0.00 H new ATOM 0 HD11 LEU A 11 -0.932 -12.182 -0.043 1.00 0.00 H new ATOM 0 HD12 LEU A 11 0.092 -12.868 1.241 1.00 0.00 H new ATOM 0 HD13 LEU A 11 -0.552 -11.217 1.404 1.00 0.00 H new ATOM 0 HD21 LEU A 11 -0.056 -10.418 -1.530 1.00 0.00 H new ATOM 0 HD22 LEU A 11 0.359 -9.385 -0.141 1.00 0.00 H new ATOM 0 HD23 LEU A 11 1.608 -9.818 -1.332 1.00 0.00 H new ATOM 137 N GLU A 12 4.834 -10.962 2.468 1.00 0.00 N ATOM 138 CA GLU A 12 5.684 -10.555 3.581 1.00 0.00 C ATOM 139 C GLU A 12 6.790 -9.618 3.106 1.00 0.00 C ATOM 140 O GLU A 12 6.996 -8.546 3.675 1.00 0.00 O ATOM 141 CB GLU A 12 6.296 -11.783 4.259 1.00 0.00 C ATOM 142 CG GLU A 12 7.610 -12.228 3.639 1.00 0.00 C ATOM 143 CD GLU A 12 8.236 -13.396 4.376 1.00 0.00 C ATOM 144 OE1 GLU A 12 7.480 -14.247 4.890 1.00 0.00 O ATOM 145 OE2 GLU A 12 9.482 -13.459 4.440 1.00 0.00 O ATOM 0 H GLU A 12 4.624 -11.960 2.440 1.00 0.00 H new ATOM 0 HA GLU A 12 5.065 -10.021 4.302 1.00 0.00 H new ATOM 0 HB2 GLU A 12 6.458 -11.562 5.314 1.00 0.00 H new ATOM 0 HB3 GLU A 12 5.584 -12.607 4.211 1.00 0.00 H new ATOM 0 HG2 GLU A 12 7.441 -12.508 2.599 1.00 0.00 H new ATOM 0 HG3 GLU A 12 8.307 -11.390 3.634 1.00 0.00 H new ATOM 152 N ASP A 13 7.499 -10.030 2.062 1.00 0.00 N ATOM 153 CA ASP A 13 8.585 -9.228 1.509 1.00 0.00 C ATOM 154 C ASP A 13 8.071 -7.874 1.031 1.00 0.00 C ATOM 155 O ASP A 13 8.825 -6.905 0.954 1.00 0.00 O ATOM 156 CB ASP A 13 9.258 -9.969 0.354 1.00 0.00 C ATOM 157 CG ASP A 13 10.361 -10.897 0.825 1.00 0.00 C ATOM 158 OD1 ASP A 13 11.513 -10.433 0.951 1.00 0.00 O ATOM 159 OD2 ASP A 13 10.072 -12.088 1.067 1.00 0.00 O ATOM 0 H ASP A 13 7.342 -10.915 1.581 1.00 0.00 H new ATOM 0 HA ASP A 13 9.318 -9.060 2.298 1.00 0.00 H new ATOM 0 HB2 ASP A 13 8.509 -10.546 -0.189 1.00 0.00 H new ATOM 0 HB3 ASP A 13 9.672 -9.244 -0.347 1.00 0.00 H new ATOM 164 N MET A 14 6.783 -7.816 0.709 1.00 0.00 N ATOM 165 CA MET A 14 6.168 -6.580 0.238 1.00 0.00 C ATOM 166 C MET A 14 5.770 -5.689 1.410 1.00 0.00 C ATOM 167 O MET A 14 6.238 -4.556 1.529 1.00 0.00 O ATOM 168 CB MET A 14 4.940 -6.891 -0.621 1.00 0.00 C ATOM 169 CG MET A 14 4.200 -5.651 -1.094 1.00 0.00 C ATOM 170 SD MET A 14 2.504 -6.003 -1.595 1.00 0.00 S ATOM 171 CE MET A 14 1.726 -6.257 -0.002 1.00 0.00 C ATOM 0 H MET A 14 6.145 -8.610 0.765 1.00 0.00 H new ATOM 0 HA MET A 14 6.901 -6.047 -0.368 1.00 0.00 H new ATOM 0 HB2 MET A 14 5.252 -7.471 -1.489 1.00 0.00 H new ATOM 0 HB3 MET A 14 4.255 -7.517 -0.048 1.00 0.00 H new ATOM 0 HG2 MET A 14 4.192 -4.910 -0.294 1.00 0.00 H new ATOM 0 HG3 MET A 14 4.738 -5.209 -1.933 1.00 0.00 H new ATOM 0 HE1 MET A 14 0.645 -6.167 -0.107 1.00 0.00 H new ATOM 0 HE2 MET A 14 1.973 -7.252 0.369 1.00 0.00 H new ATOM 0 HE3 MET A 14 2.086 -5.507 0.703 1.00 0.00 H new ATOM 181 N LYS A 15 4.905 -6.208 2.275 1.00 0.00 N ATOM 182 CA LYS A 15 4.445 -5.460 3.439 1.00 0.00 C ATOM 183 C LYS A 15 5.623 -4.992 4.286 1.00 0.00 C ATOM 184 O LYS A 15 5.667 -3.844 4.728 1.00 0.00 O ATOM 185 CB LYS A 15 3.505 -6.322 4.285 1.00 0.00 C ATOM 186 CG LYS A 15 4.068 -7.694 4.613 1.00 0.00 C ATOM 187 CD LYS A 15 3.002 -8.612 5.188 1.00 0.00 C ATOM 188 CE LYS A 15 2.962 -8.536 6.706 1.00 0.00 C ATOM 189 NZ LYS A 15 2.512 -9.820 7.313 1.00 0.00 N ATOM 0 H LYS A 15 4.508 -7.144 2.192 1.00 0.00 H new ATOM 0 HA LYS A 15 3.904 -4.582 3.085 1.00 0.00 H new ATOM 0 HB2 LYS A 15 3.283 -5.798 5.215 1.00 0.00 H new ATOM 0 HB3 LYS A 15 2.561 -6.443 3.754 1.00 0.00 H new ATOM 0 HG2 LYS A 15 4.487 -8.141 3.712 1.00 0.00 H new ATOM 0 HG3 LYS A 15 4.885 -7.592 5.327 1.00 0.00 H new ATOM 0 HD2 LYS A 15 2.028 -8.339 4.783 1.00 0.00 H new ATOM 0 HD3 LYS A 15 3.199 -9.639 4.879 1.00 0.00 H new ATOM 0 HE2 LYS A 15 3.953 -8.283 7.083 1.00 0.00 H new ATOM 0 HE3 LYS A 15 2.290 -7.734 7.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 2.498 -9.728 8.349 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 1.556 -10.049 6.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 3.167 -10.581 7.042 1.00 0.00 H new ATOM 203 N LYS A 16 6.579 -5.888 4.508 1.00 0.00 N ATOM 204 CA LYS A 16 7.761 -5.567 5.300 1.00 0.00 C ATOM 205 C LYS A 16 8.442 -4.307 4.774 1.00 0.00 C ATOM 206 O LYS A 16 8.992 -3.520 5.545 1.00 0.00 O ATOM 207 CB LYS A 16 8.746 -6.738 5.281 1.00 0.00 C ATOM 208 CG LYS A 16 9.653 -6.750 4.063 1.00 0.00 C ATOM 209 CD LYS A 16 10.790 -7.746 4.224 1.00 0.00 C ATOM 210 CE LYS A 16 12.010 -7.099 4.862 1.00 0.00 C ATOM 211 NZ LYS A 16 12.545 -5.984 4.032 1.00 0.00 N ATOM 0 H LYS A 16 6.558 -6.843 4.150 1.00 0.00 H new ATOM 0 HA LYS A 16 7.442 -5.385 6.326 1.00 0.00 H new ATOM 0 HB2 LYS A 16 9.360 -6.700 6.181 1.00 0.00 H new ATOM 0 HB3 LYS A 16 8.187 -7.673 5.316 1.00 0.00 H new ATOM 0 HG2 LYS A 16 9.070 -7.002 3.177 1.00 0.00 H new ATOM 0 HG3 LYS A 16 10.062 -5.752 3.903 1.00 0.00 H new ATOM 0 HD2 LYS A 16 10.458 -8.583 4.838 1.00 0.00 H new ATOM 0 HD3 LYS A 16 11.060 -8.153 3.249 1.00 0.00 H new ATOM 0 HE2 LYS A 16 11.746 -6.722 5.850 1.00 0.00 H new ATOM 0 HE3 LYS A 16 12.787 -7.850 5.005 1.00 0.00 H new ATOM 0 HZ1 LYS A 16 13.569 -5.895 4.189 1.00 0.00 H new ATOM 0 HZ2 LYS A 16 12.364 -6.182 3.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 16 12.075 -5.096 4.300 1.00 0.00 H new ATOM 225 N TYR A 17 8.400 -4.122 3.460 1.00 0.00 N ATOM 226 CA TYR A 17 9.014 -2.958 2.832 1.00 0.00 C ATOM 227 C TYR A 17 8.098 -1.742 2.926 1.00 0.00 C ATOM 228 O TYR A 17 8.481 -0.702 3.461 1.00 0.00 O ATOM 229 CB TYR A 17 9.338 -3.255 1.366 1.00 0.00 C ATOM 230 CG TYR A 17 9.601 -2.015 0.542 1.00 0.00 C ATOM 231 CD1 TYR A 17 10.850 -1.407 0.544 1.00 0.00 C ATOM 232 CD2 TYR A 17 8.600 -1.451 -0.239 1.00 0.00 C ATOM 233 CE1 TYR A 17 11.095 -0.274 -0.207 1.00 0.00 C ATOM 234 CE2 TYR A 17 8.836 -0.319 -0.995 1.00 0.00 C ATOM 235 CZ TYR A 17 10.085 0.266 -0.975 1.00 0.00 C ATOM 236 OH TYR A 17 10.324 1.395 -1.725 1.00 0.00 O ATOM 0 H TYR A 17 7.947 -4.763 2.808 1.00 0.00 H new ATOM 0 HA TYR A 17 9.939 -2.735 3.364 1.00 0.00 H new ATOM 0 HB2 TYR A 17 10.212 -3.904 1.320 1.00 0.00 H new ATOM 0 HB3 TYR A 17 8.508 -3.806 0.923 1.00 0.00 H new ATOM 0 HD1 TYR A 17 11.644 -1.828 1.144 1.00 0.00 H new ATOM 0 HD2 TYR A 17 7.620 -1.905 -0.255 1.00 0.00 H new ATOM 0 HE1 TYR A 17 12.072 0.186 -0.193 1.00 0.00 H new ATOM 0 HE2 TYR A 17 8.047 0.105 -1.598 1.00 0.00 H new ATOM 0 HH TYR A 17 9.509 1.645 -2.208 1.00 0.00 H new ATOM 246 N ALA A 18 6.885 -1.881 2.401 1.00 0.00 N ATOM 247 CA ALA A 18 5.912 -0.796 2.428 1.00 0.00 C ATOM 248 C ALA A 18 5.779 -0.212 3.830 1.00 0.00 C ATOM 249 O ALA A 18 5.506 0.977 3.993 1.00 0.00 O ATOM 250 CB ALA A 18 4.561 -1.286 1.928 1.00 0.00 C ATOM 0 H ALA A 18 6.553 -2.734 1.952 1.00 0.00 H new ATOM 0 HA ALA A 18 6.268 -0.006 1.766 1.00 0.00 H new ATOM 0 HB1 ALA A 18 3.844 -0.465 1.954 1.00 0.00 H new ATOM 0 HB2 ALA A 18 4.661 -1.648 0.905 1.00 0.00 H new ATOM 0 HB3 ALA A 18 4.208 -2.096 2.567 1.00 0.00 H new ATOM 256 N GLU A 19 5.974 -1.055 4.839 1.00 0.00 N ATOM 257 CA GLU A 19 5.874 -0.621 6.227 1.00 0.00 C ATOM 258 C GLU A 19 6.933 0.431 6.546 1.00 0.00 C ATOM 259 O GLU A 19 6.621 1.609 6.724 1.00 0.00 O ATOM 260 CB GLU A 19 6.027 -1.816 7.171 1.00 0.00 C ATOM 261 CG GLU A 19 4.709 -2.487 7.521 1.00 0.00 C ATOM 262 CD GLU A 19 4.893 -3.903 8.031 1.00 0.00 C ATOM 263 OE1 GLU A 19 5.108 -4.810 7.201 1.00 0.00 O ATOM 264 OE2 GLU A 19 4.822 -4.103 9.262 1.00 0.00 O ATOM 0 H GLU A 19 6.202 -2.042 4.721 1.00 0.00 H new ATOM 0 HA GLU A 19 4.889 -0.176 6.371 1.00 0.00 H new ATOM 0 HB2 GLU A 19 6.688 -2.550 6.710 1.00 0.00 H new ATOM 0 HB3 GLU A 19 6.511 -1.483 8.089 1.00 0.00 H new ATOM 0 HG2 GLU A 19 4.195 -1.896 8.279 1.00 0.00 H new ATOM 0 HG3 GLU A 19 4.068 -2.503 6.639 1.00 0.00 H new ATOM 271 N THR A 20 8.187 -0.003 6.617 1.00 0.00 N ATOM 272 CA THR A 20 9.293 0.899 6.915 1.00 0.00 C ATOM 273 C THR A 20 9.461 1.944 5.819 1.00 0.00 C ATOM 274 O THR A 20 10.196 2.918 5.983 1.00 0.00 O ATOM 275 CB THR A 20 10.616 0.129 7.083 1.00 0.00 C ATOM 276 OG1 THR A 20 11.653 1.023 7.503 1.00 0.00 O ATOM 277 CG2 THR A 20 11.019 -0.546 5.780 1.00 0.00 C ATOM 0 H THR A 20 8.463 -0.974 6.472 1.00 0.00 H new ATOM 0 HA THR A 20 9.050 1.398 7.853 1.00 0.00 H new ATOM 0 HB THR A 20 10.469 -0.640 7.842 1.00 0.00 H new ATOM 0 HG1 THR A 20 11.514 1.901 7.091 1.00 0.00 H new ATOM 0 HG21 THR A 20 11.956 -1.084 5.923 1.00 0.00 H new ATOM 0 HG22 THR A 20 10.241 -1.247 5.478 1.00 0.00 H new ATOM 0 HG23 THR A 20 11.149 0.209 5.004 1.00 0.00 H new ATOM 285 N PHE A 21 8.776 1.736 4.699 1.00 0.00 N ATOM 286 CA PHE A 21 8.850 2.661 3.574 1.00 0.00 C ATOM 287 C PHE A 21 7.746 3.711 3.660 1.00 0.00 C ATOM 288 O PHE A 21 7.932 4.858 3.252 1.00 0.00 O ATOM 289 CB PHE A 21 8.743 1.898 2.252 1.00 0.00 C ATOM 290 CG PHE A 21 8.363 2.768 1.088 1.00 0.00 C ATOM 291 CD1 PHE A 21 8.937 4.018 0.923 1.00 0.00 C ATOM 292 CD2 PHE A 21 7.431 2.335 0.158 1.00 0.00 C ATOM 293 CE1 PHE A 21 8.588 4.821 -0.146 1.00 0.00 C ATOM 294 CE2 PHE A 21 7.079 3.133 -0.914 1.00 0.00 C ATOM 295 CZ PHE A 21 7.658 4.377 -1.067 1.00 0.00 C ATOM 0 H PHE A 21 8.163 0.935 4.546 1.00 0.00 H new ATOM 0 HA PHE A 21 9.814 3.169 3.615 1.00 0.00 H new ATOM 0 HB2 PHE A 21 9.698 1.418 2.040 1.00 0.00 H new ATOM 0 HB3 PHE A 21 8.004 1.104 2.359 1.00 0.00 H new ATOM 0 HD1 PHE A 21 9.666 4.369 1.638 1.00 0.00 H new ATOM 0 HD2 PHE A 21 6.975 1.363 0.272 1.00 0.00 H new ATOM 0 HE1 PHE A 21 9.041 5.794 -0.262 1.00 0.00 H new ATOM 0 HE2 PHE A 21 6.351 2.784 -1.632 1.00 0.00 H new ATOM 0 HZ PHE A 21 7.385 5.002 -1.905 1.00 0.00 H new ATOM 305 N LEU A 22 6.597 3.310 4.192 1.00 0.00 N ATOM 306 CA LEU A 22 5.462 4.215 4.331 1.00 0.00 C ATOM 307 C LEU A 22 5.356 4.741 5.759 1.00 0.00 C ATOM 308 O LEU A 22 4.502 5.572 6.063 1.00 0.00 O ATOM 309 CB LEU A 22 4.165 3.503 3.941 1.00 0.00 C ATOM 310 CG LEU A 22 4.087 2.993 2.502 1.00 0.00 C ATOM 311 CD1 LEU A 22 3.015 1.922 2.372 1.00 0.00 C ATOM 312 CD2 LEU A 22 3.815 4.142 1.542 1.00 0.00 C ATOM 0 H LEU A 22 6.427 2.364 4.534 1.00 0.00 H new ATOM 0 HA LEU A 22 5.620 5.061 3.662 1.00 0.00 H new ATOM 0 HB2 LEU A 22 4.022 2.657 4.613 1.00 0.00 H new ATOM 0 HB3 LEU A 22 3.334 4.188 4.108 1.00 0.00 H new ATOM 0 HG LEU A 22 5.048 2.549 2.242 1.00 0.00 H new ATOM 0 HD11 LEU A 22 2.974 1.571 1.341 1.00 0.00 H new ATOM 0 HD12 LEU A 22 3.254 1.087 3.030 1.00 0.00 H new ATOM 0 HD13 LEU A 22 2.048 2.340 2.652 1.00 0.00 H new ATOM 0 HD21 LEU A 22 3.763 3.760 0.523 1.00 0.00 H new ATOM 0 HD22 LEU A 22 2.868 4.616 1.801 1.00 0.00 H new ATOM 0 HD23 LEU A 22 4.619 4.874 1.614 1.00 0.00 H new ATOM 324 N GLU A 23 6.232 4.251 6.631 1.00 0.00 N ATOM 325 CA GLU A 23 6.238 4.673 8.027 1.00 0.00 C ATOM 326 C GLU A 23 6.088 6.188 8.138 1.00 0.00 C ATOM 327 O GLU A 23 5.166 6.701 8.772 1.00 0.00 O ATOM 328 CB GLU A 23 7.530 4.226 8.713 1.00 0.00 C ATOM 329 CG GLU A 23 7.407 2.896 9.437 1.00 0.00 C ATOM 330 CD GLU A 23 8.534 2.663 10.424 1.00 0.00 C ATOM 331 OE1 GLU A 23 9.704 2.895 10.056 1.00 0.00 O ATOM 332 OE2 GLU A 23 8.245 2.247 11.566 1.00 0.00 O ATOM 0 H GLU A 23 6.946 3.562 6.395 1.00 0.00 H new ATOM 0 HA GLU A 23 5.390 4.203 8.525 1.00 0.00 H new ATOM 0 HB2 GLU A 23 8.321 4.152 7.966 1.00 0.00 H new ATOM 0 HB3 GLU A 23 7.836 4.991 9.426 1.00 0.00 H new ATOM 0 HG2 GLU A 23 6.454 2.861 9.965 1.00 0.00 H new ATOM 0 HG3 GLU A 23 7.397 2.088 8.706 1.00 0.00 H new ATOM 339 N PRO A 24 7.016 6.922 7.506 1.00 0.00 N ATOM 340 CA PRO A 24 7.010 8.388 7.519 1.00 0.00 C ATOM 341 C PRO A 24 5.857 8.969 6.707 1.00 0.00 C ATOM 342 O PRO A 24 5.630 10.179 6.713 1.00 0.00 O ATOM 343 CB PRO A 24 8.352 8.754 6.880 1.00 0.00 C ATOM 344 CG PRO A 24 8.696 7.584 6.024 1.00 0.00 C ATOM 345 CD PRO A 24 8.144 6.377 6.731 1.00 0.00 C ATOM 0 HA PRO A 24 6.879 8.787 8.525 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.273 9.667 6.290 1.00 0.00 H new ATOM 0 HB3 PRO A 24 9.116 8.929 7.637 1.00 0.00 H new ATOM 0 HG2 PRO A 24 8.261 7.687 5.030 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.775 7.500 5.893 1.00 0.00 H new ATOM 0 HD2 PRO A 24 7.815 5.614 6.026 1.00 0.00 H new ATOM 0 HD3 PRO A 24 8.889 5.914 7.378 1.00 0.00 H new ATOM 353 N TRP A 25 5.132 8.101 6.012 1.00 0.00 N ATOM 354 CA TRP A 25 4.002 8.529 5.195 1.00 0.00 C ATOM 355 C TRP A 25 2.680 8.146 5.851 1.00 0.00 C ATOM 356 O TRP A 25 1.631 8.701 5.526 1.00 0.00 O ATOM 357 CB TRP A 25 4.091 7.910 3.800 1.00 0.00 C ATOM 358 CG TRP A 25 4.854 8.754 2.823 1.00 0.00 C ATOM 359 CD1 TRP A 25 4.377 9.819 2.114 1.00 0.00 C ATOM 360 CD2 TRP A 25 6.227 8.601 2.448 1.00 0.00 C ATOM 361 NE1 TRP A 25 5.372 10.337 1.320 1.00 0.00 N ATOM 362 CE2 TRP A 25 6.516 9.609 1.507 1.00 0.00 C ATOM 363 CE3 TRP A 25 7.241 7.712 2.816 1.00 0.00 C ATOM 364 CZ2 TRP A 25 7.776 9.749 0.931 1.00 0.00 C ATOM 365 CZ3 TRP A 25 8.490 7.853 2.243 1.00 0.00 C ATOM 366 CH2 TRP A 25 8.750 8.865 1.310 1.00 0.00 C ATOM 0 H TRP A 25 5.306 7.096 5.997 1.00 0.00 H new ATOM 0 HA TRP A 25 4.041 9.615 5.106 1.00 0.00 H new ATOM 0 HB2 TRP A 25 4.567 6.932 3.874 1.00 0.00 H new ATOM 0 HB3 TRP A 25 3.083 7.746 3.418 1.00 0.00 H new ATOM 0 HD1 TRP A 25 3.367 10.198 2.169 1.00 0.00 H new ATOM 0 HE1 TRP A 25 5.274 11.135 0.693 1.00 0.00 H new ATOM 0 HE3 TRP A 25 7.051 6.929 3.535 1.00 0.00 H new ATOM 0 HZ2 TRP A 25 7.978 10.528 0.210 1.00 0.00 H new ATOM 0 HZ3 TRP A 25 9.280 7.171 2.519 1.00 0.00 H new ATOM 0 HH2 TRP A 25 9.738 8.949 0.882 1.00 0.00 H new ATOM 377 N PHE A 26 2.738 7.194 6.777 1.00 0.00 N ATOM 378 CA PHE A 26 1.544 6.736 7.478 1.00 0.00 C ATOM 379 C PHE A 26 1.792 6.662 8.982 1.00 0.00 C ATOM 380 O PHE A 26 0.946 7.060 9.783 1.00 0.00 O ATOM 381 CB PHE A 26 1.113 5.365 6.953 1.00 0.00 C ATOM 382 CG PHE A 26 0.474 5.418 5.595 1.00 0.00 C ATOM 383 CD1 PHE A 26 -0.476 6.382 5.298 1.00 0.00 C ATOM 384 CD2 PHE A 26 0.824 4.503 4.614 1.00 0.00 C ATOM 385 CE1 PHE A 26 -1.065 6.433 4.048 1.00 0.00 C ATOM 386 CE2 PHE A 26 0.238 4.550 3.363 1.00 0.00 C ATOM 387 CZ PHE A 26 -0.708 5.515 3.080 1.00 0.00 C ATOM 0 H PHE A 26 3.599 6.725 7.059 1.00 0.00 H new ATOM 0 HA PHE A 26 0.746 7.455 7.294 1.00 0.00 H new ATOM 0 HB2 PHE A 26 1.984 4.711 6.911 1.00 0.00 H new ATOM 0 HB3 PHE A 26 0.412 4.918 7.658 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -0.760 7.102 6.052 1.00 0.00 H new ATOM 0 HD2 PHE A 26 1.563 3.745 4.830 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -1.803 7.190 3.829 1.00 0.00 H new ATOM 0 HE2 PHE A 26 0.520 3.832 2.607 1.00 0.00 H new ATOM 0 HZ PHE A 26 -1.168 5.552 2.104 1.00 0.00 H new ATOM 397 N LYS A 27 2.958 6.148 9.359 1.00 0.00 N ATOM 398 CA LYS A 27 3.320 6.022 10.766 1.00 0.00 C ATOM 399 C LYS A 27 3.720 7.373 11.349 1.00 0.00 C ATOM 400 O LYS A 27 4.481 8.122 10.737 1.00 0.00 O ATOM 401 CB LYS A 27 4.468 5.023 10.930 1.00 0.00 C ATOM 402 CG LYS A 27 4.540 4.402 12.315 1.00 0.00 C ATOM 403 CD LYS A 27 5.956 3.972 12.660 1.00 0.00 C ATOM 404 CE LYS A 27 6.210 4.041 14.158 1.00 0.00 C ATOM 405 NZ LYS A 27 6.459 5.436 14.615 1.00 0.00 N ATOM 0 H LYS A 27 3.669 5.812 8.709 1.00 0.00 H new ATOM 0 HA LYS A 27 2.448 5.657 11.309 1.00 0.00 H new ATOM 0 HB2 LYS A 27 4.357 4.230 10.191 1.00 0.00 H new ATOM 0 HB3 LYS A 27 5.411 5.527 10.717 1.00 0.00 H new ATOM 0 HG2 LYS A 27 4.186 5.119 13.055 1.00 0.00 H new ATOM 0 HG3 LYS A 27 3.875 3.540 12.363 1.00 0.00 H new ATOM 0 HD2 LYS A 27 6.124 2.954 12.308 1.00 0.00 H new ATOM 0 HD3 LYS A 27 6.669 4.611 12.139 1.00 0.00 H new ATOM 0 HE2 LYS A 27 5.352 3.632 14.691 1.00 0.00 H new ATOM 0 HE3 LYS A 27 7.068 3.418 14.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 6.628 5.440 15.641 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 7.293 5.818 14.125 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 5.630 6.026 14.398 1.00 0.00 H new ATOM 419 N ALA A 28 3.204 7.677 12.535 1.00 0.00 N ATOM 420 CA ALA A 28 3.511 8.937 13.201 1.00 0.00 C ATOM 421 C ALA A 28 4.990 9.283 13.066 1.00 0.00 C ATOM 422 O ALA A 28 5.836 8.419 12.839 1.00 0.00 O ATOM 423 CB ALA A 28 3.115 8.868 14.669 1.00 0.00 C ATOM 0 H ALA A 28 2.572 7.068 13.054 1.00 0.00 H new ATOM 0 HA ALA A 28 2.935 9.725 12.717 1.00 0.00 H new ATOM 0 HB1 ALA A 28 3.350 9.815 15.154 1.00 0.00 H new ATOM 0 HB2 ALA A 28 2.045 8.675 14.749 1.00 0.00 H new ATOM 0 HB3 ALA A 28 3.666 8.064 15.157 1.00 0.00 H new ATOM 429 N PRO A 29 5.311 10.578 13.208 1.00 0.00 N ATOM 430 CA PRO A 29 4.311 11.616 13.478 1.00 0.00 C ATOM 431 C PRO A 29 3.403 11.871 12.280 1.00 0.00 C ATOM 432 O PRO A 29 2.488 12.691 12.347 1.00 0.00 O ATOM 433 CB PRO A 29 5.159 12.854 13.780 1.00 0.00 C ATOM 434 CG PRO A 29 6.447 12.614 13.070 1.00 0.00 C ATOM 435 CD PRO A 29 6.673 11.128 13.116 1.00 0.00 C ATOM 0 HA PRO A 29 3.639 11.335 14.289 1.00 0.00 H new ATOM 0 HB2 PRO A 29 4.674 13.763 13.423 1.00 0.00 H new ATOM 0 HB3 PRO A 29 5.315 12.975 14.852 1.00 0.00 H new ATOM 0 HG2 PRO A 29 6.398 12.970 12.041 1.00 0.00 H new ATOM 0 HG3 PRO A 29 7.265 13.149 13.553 1.00 0.00 H new ATOM 0 HD2 PRO A 29 7.190 10.773 12.225 1.00 0.00 H new ATOM 0 HD3 PRO A 29 7.281 10.840 13.974 1.00 0.00 H new ATOM 443 N ASN A 30 3.661 11.164 11.186 1.00 0.00 N ATOM 444 CA ASN A 30 2.866 11.314 9.972 1.00 0.00 C ATOM 445 C ASN A 30 1.576 10.505 10.064 1.00 0.00 C ATOM 446 O ASN A 30 1.521 9.478 10.740 1.00 0.00 O ATOM 447 CB ASN A 30 3.673 10.872 8.750 1.00 0.00 C ATOM 448 CG ASN A 30 4.665 11.927 8.300 1.00 0.00 C ATOM 449 OD1 ASN A 30 4.408 12.673 7.355 1.00 0.00 O ATOM 450 ND2 ASN A 30 5.806 11.994 8.975 1.00 0.00 N ATOM 0 H ASN A 30 4.415 10.481 11.114 1.00 0.00 H new ATOM 0 HA ASN A 30 2.607 12.367 9.865 1.00 0.00 H new ATOM 0 HB2 ASN A 30 4.207 9.951 8.984 1.00 0.00 H new ATOM 0 HB3 ASN A 30 2.991 10.645 7.930 1.00 0.00 H new ATOM 0 HD21 ASN A 30 6.512 12.684 8.717 1.00 0.00 H new ATOM 0 HD22 ASN A 30 5.977 11.356 9.752 1.00 0.00 H new ATOM 457 N LYS A 31 0.540 10.975 9.378 1.00 0.00 N ATOM 458 CA LYS A 31 -0.750 10.295 9.379 1.00 0.00 C ATOM 459 C LYS A 31 -1.713 10.953 8.395 1.00 0.00 C ATOM 460 O LYS A 31 -1.439 12.033 7.872 1.00 0.00 O ATOM 461 CB LYS A 31 -1.355 10.306 10.784 1.00 0.00 C ATOM 462 CG LYS A 31 -1.297 11.665 11.461 1.00 0.00 C ATOM 463 CD LYS A 31 -2.425 11.837 12.464 1.00 0.00 C ATOM 464 CE LYS A 31 -3.697 12.333 11.793 1.00 0.00 C ATOM 465 NZ LYS A 31 -4.627 12.969 12.767 1.00 0.00 N ATOM 0 H LYS A 31 0.568 11.824 8.814 1.00 0.00 H new ATOM 0 HA LYS A 31 -0.588 9.263 9.068 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -2.394 9.983 10.725 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -0.829 9.579 11.403 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -0.338 11.780 11.967 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -1.356 12.451 10.708 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -2.621 10.886 12.959 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -2.121 12.543 13.237 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -3.440 13.051 11.014 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -4.199 11.498 11.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -5.601 12.910 12.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -4.565 12.475 13.680 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -4.366 13.967 12.895 1.00 0.00 H new ATOM 479 N GLY A 32 -2.842 10.296 8.149 1.00 0.00 N ATOM 480 CA GLY A 32 -3.828 10.833 7.229 1.00 0.00 C ATOM 481 C GLY A 32 -4.539 9.750 6.443 1.00 0.00 C ATOM 482 O GLY A 32 -4.592 8.596 6.870 1.00 0.00 O ATOM 0 H GLY A 32 -3.092 9.401 8.570 1.00 0.00 H new ATOM 0 HA2 GLY A 32 -4.562 11.414 7.787 1.00 0.00 H new ATOM 0 HA3 GLY A 32 -3.339 11.518 6.537 1.00 0.00 H new ATOM 486 N THR A 33 -5.090 10.121 5.292 1.00 0.00 N ATOM 487 CA THR A 33 -5.804 9.173 4.445 1.00 0.00 C ATOM 488 C THR A 33 -4.978 8.799 3.220 1.00 0.00 C ATOM 489 O THR A 33 -3.937 9.400 2.953 1.00 0.00 O ATOM 490 CB THR A 33 -7.158 9.743 3.983 1.00 0.00 C ATOM 491 OG1 THR A 33 -6.970 11.032 3.389 1.00 0.00 O ATOM 492 CG2 THR A 33 -8.126 9.853 5.151 1.00 0.00 C ATOM 0 H THR A 33 -5.056 11.072 4.924 1.00 0.00 H new ATOM 0 HA THR A 33 -5.979 8.281 5.047 1.00 0.00 H new ATOM 0 HB THR A 33 -7.581 9.062 3.245 1.00 0.00 H new ATOM 0 HG1 THR A 33 -7.693 11.207 2.752 1.00 0.00 H new ATOM 0 HG21 THR A 33 -9.075 10.258 4.800 1.00 0.00 H new ATOM 0 HG22 THR A 33 -8.290 8.865 5.582 1.00 0.00 H new ATOM 0 HG23 THR A 33 -7.707 10.515 5.909 1.00 0.00 H new ATOM 500 N PHE A 34 -5.448 7.802 2.477 1.00 0.00 N ATOM 501 CA PHE A 34 -4.752 7.348 1.279 1.00 0.00 C ATOM 502 C PHE A 34 -5.653 6.453 0.433 1.00 0.00 C ATOM 503 O PHE A 34 -6.692 5.985 0.898 1.00 0.00 O ATOM 504 CB PHE A 34 -3.477 6.592 1.660 1.00 0.00 C ATOM 505 CG PHE A 34 -3.707 5.492 2.657 1.00 0.00 C ATOM 506 CD1 PHE A 34 -3.983 5.786 3.982 1.00 0.00 C ATOM 507 CD2 PHE A 34 -3.646 4.164 2.268 1.00 0.00 C ATOM 508 CE1 PHE A 34 -4.195 4.776 4.901 1.00 0.00 C ATOM 509 CE2 PHE A 34 -3.859 3.149 3.182 1.00 0.00 C ATOM 510 CZ PHE A 34 -4.132 3.456 4.501 1.00 0.00 C ATOM 0 H PHE A 34 -6.308 7.293 2.684 1.00 0.00 H new ATOM 0 HA PHE A 34 -4.484 8.225 0.690 1.00 0.00 H new ATOM 0 HB2 PHE A 34 -3.033 6.168 0.759 1.00 0.00 H new ATOM 0 HB3 PHE A 34 -2.755 7.298 2.070 1.00 0.00 H new ATOM 0 HD1 PHE A 34 -4.033 6.817 4.301 1.00 0.00 H new ATOM 0 HD2 PHE A 34 -3.430 3.919 1.239 1.00 0.00 H new ATOM 0 HE1 PHE A 34 -4.410 5.019 5.931 1.00 0.00 H new ATOM 0 HE2 PHE A 34 -3.812 2.118 2.865 1.00 0.00 H new ATOM 0 HZ PHE A 34 -4.296 2.665 5.218 1.00 0.00 H new ATOM 520 N GLN A 35 -5.246 6.220 -0.810 1.00 0.00 N ATOM 521 CA GLN A 35 -6.017 5.383 -1.722 1.00 0.00 C ATOM 522 C GLN A 35 -5.128 4.333 -2.381 1.00 0.00 C ATOM 523 O GLN A 35 -4.246 4.663 -3.173 1.00 0.00 O ATOM 524 CB GLN A 35 -6.691 6.243 -2.792 1.00 0.00 C ATOM 525 CG GLN A 35 -5.742 7.211 -3.480 1.00 0.00 C ATOM 526 CD GLN A 35 -6.376 7.904 -4.670 1.00 0.00 C ATOM 527 OE1 GLN A 35 -6.673 9.098 -4.623 1.00 0.00 O ATOM 528 NE2 GLN A 35 -6.587 7.156 -5.747 1.00 0.00 N ATOM 0 H GLN A 35 -4.387 6.599 -1.209 1.00 0.00 H new ATOM 0 HA GLN A 35 -6.785 4.870 -1.143 1.00 0.00 H new ATOM 0 HB2 GLN A 35 -7.138 5.591 -3.542 1.00 0.00 H new ATOM 0 HB3 GLN A 35 -7.504 6.807 -2.334 1.00 0.00 H new ATOM 0 HG2 GLN A 35 -5.411 7.961 -2.762 1.00 0.00 H new ATOM 0 HG3 GLN A 35 -4.854 6.671 -3.809 1.00 0.00 H new ATOM 0 HE21 GLN A 35 -6.325 6.170 -5.742 1.00 0.00 H new ATOM 0 HE22 GLN A 35 -7.011 7.567 -6.579 1.00 0.00 H new ATOM 537 N ILE A 36 -5.366 3.069 -2.047 1.00 0.00 N ATOM 538 CA ILE A 36 -4.587 1.972 -2.608 1.00 0.00 C ATOM 539 C ILE A 36 -5.141 1.540 -3.961 1.00 0.00 C ATOM 540 O ILE A 36 -6.354 1.432 -4.142 1.00 0.00 O ATOM 541 CB ILE A 36 -4.566 0.756 -1.662 1.00 0.00 C ATOM 542 CG1 ILE A 36 -3.896 1.125 -0.337 1.00 0.00 C ATOM 543 CG2 ILE A 36 -3.847 -0.412 -2.318 1.00 0.00 C ATOM 544 CD1 ILE A 36 -3.920 0.009 0.683 1.00 0.00 C ATOM 0 H ILE A 36 -6.092 2.779 -1.391 1.00 0.00 H new ATOM 0 HA ILE A 36 -3.569 2.340 -2.736 1.00 0.00 H new ATOM 0 HB ILE A 36 -5.593 0.456 -1.457 1.00 0.00 H new ATOM 0 HG12 ILE A 36 -2.861 1.409 -0.529 1.00 0.00 H new ATOM 0 HG13 ILE A 36 -4.394 2.000 0.081 1.00 0.00 H new ATOM 0 HG21 ILE A 36 -3.840 -1.264 -1.638 1.00 0.00 H new ATOM 0 HG22 ILE A 36 -4.363 -0.687 -3.238 1.00 0.00 H new ATOM 0 HG23 ILE A 36 -2.821 -0.124 -2.549 1.00 0.00 H new ATOM 0 HD11 ILE A 36 -3.428 0.341 1.597 1.00 0.00 H new ATOM 0 HD12 ILE A 36 -4.953 -0.260 0.904 1.00 0.00 H new ATOM 0 HD13 ILE A 36 -3.396 -0.860 0.284 1.00 0.00 H new ATOM 556 N VAL A 37 -4.244 1.291 -4.910 1.00 0.00 N ATOM 557 CA VAL A 37 -4.642 0.867 -6.247 1.00 0.00 C ATOM 558 C VAL A 37 -3.687 -0.186 -6.796 1.00 0.00 C ATOM 559 O VAL A 37 -2.484 0.051 -6.910 1.00 0.00 O ATOM 560 CB VAL A 37 -4.692 2.059 -7.222 1.00 0.00 C ATOM 561 CG1 VAL A 37 -5.031 1.585 -8.627 1.00 0.00 C ATOM 562 CG2 VAL A 37 -5.695 3.097 -6.743 1.00 0.00 C ATOM 0 H VAL A 37 -3.236 1.376 -4.777 1.00 0.00 H new ATOM 0 HA VAL A 37 -5.640 0.437 -6.159 1.00 0.00 H new ATOM 0 HB VAL A 37 -3.707 2.526 -7.250 1.00 0.00 H new ATOM 0 HG11 VAL A 37 -5.062 2.440 -9.302 1.00 0.00 H new ATOM 0 HG12 VAL A 37 -4.271 0.882 -8.967 1.00 0.00 H new ATOM 0 HG13 VAL A 37 -6.004 1.093 -8.620 1.00 0.00 H new ATOM 0 HG21 VAL A 37 -5.717 3.932 -7.443 1.00 0.00 H new ATOM 0 HG22 VAL A 37 -6.686 2.646 -6.684 1.00 0.00 H new ATOM 0 HG23 VAL A 37 -5.402 3.458 -5.757 1.00 0.00 H new ATOM 572 N TYR A 38 -4.230 -1.349 -7.137 1.00 0.00 N ATOM 573 CA TYR A 38 -3.426 -2.441 -7.674 1.00 0.00 C ATOM 574 C TYR A 38 -3.458 -2.442 -9.199 1.00 0.00 C ATOM 575 O TYR A 38 -4.484 -2.739 -9.810 1.00 0.00 O ATOM 576 CB TYR A 38 -3.930 -3.783 -7.141 1.00 0.00 C ATOM 577 CG TYR A 38 -3.118 -4.966 -7.616 1.00 0.00 C ATOM 578 CD1 TYR A 38 -3.271 -5.466 -8.904 1.00 0.00 C ATOM 579 CD2 TYR A 38 -2.199 -5.585 -6.778 1.00 0.00 C ATOM 580 CE1 TYR A 38 -2.531 -6.548 -9.343 1.00 0.00 C ATOM 581 CE2 TYR A 38 -1.455 -6.666 -7.209 1.00 0.00 C ATOM 582 CZ TYR A 38 -1.624 -7.144 -8.492 1.00 0.00 C ATOM 583 OH TYR A 38 -0.886 -8.221 -8.924 1.00 0.00 O ATOM 0 H TYR A 38 -5.224 -1.560 -7.051 1.00 0.00 H new ATOM 0 HA TYR A 38 -2.396 -2.293 -7.351 1.00 0.00 H new ATOM 0 HB2 TYR A 38 -3.919 -3.759 -6.051 1.00 0.00 H new ATOM 0 HB3 TYR A 38 -4.968 -3.919 -7.446 1.00 0.00 H new ATOM 0 HD1 TYR A 38 -3.980 -5.001 -9.573 1.00 0.00 H new ATOM 0 HD2 TYR A 38 -2.064 -5.215 -5.772 1.00 0.00 H new ATOM 0 HE1 TYR A 38 -2.662 -6.924 -10.347 1.00 0.00 H new ATOM 0 HE2 TYR A 38 -0.744 -7.135 -6.545 1.00 0.00 H new ATOM 0 HH TYR A 38 -1.127 -8.433 -9.850 1.00 0.00 H new ATOM 593 N LYS A 39 -2.326 -2.107 -9.808 1.00 0.00 N ATOM 594 CA LYS A 39 -2.220 -2.071 -11.262 1.00 0.00 C ATOM 595 C LYS A 39 -1.277 -3.159 -11.766 1.00 0.00 C ATOM 596 O LYS A 39 -0.091 -3.166 -11.439 1.00 0.00 O ATOM 597 CB LYS A 39 -1.725 -0.698 -11.723 1.00 0.00 C ATOM 598 CG LYS A 39 -2.543 0.459 -11.175 1.00 0.00 C ATOM 599 CD LYS A 39 -2.034 1.794 -11.691 1.00 0.00 C ATOM 600 CE LYS A 39 -2.722 2.191 -12.988 1.00 0.00 C ATOM 601 NZ LYS A 39 -3.955 2.989 -12.740 1.00 0.00 N ATOM 0 H LYS A 39 -1.468 -1.856 -9.317 1.00 0.00 H new ATOM 0 HA LYS A 39 -3.211 -2.252 -11.679 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -0.686 -0.574 -11.417 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -1.743 -0.661 -12.812 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -3.588 0.333 -11.458 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -2.504 0.450 -10.086 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -2.203 2.564 -10.938 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -0.958 1.736 -11.852 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -2.032 2.770 -13.603 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -2.977 1.294 -13.553 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -4.395 3.240 -13.648 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -4.624 2.428 -12.175 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -3.709 3.857 -12.223 1.00 0.00 H new ATOM 615 N SER A 40 -1.813 -4.076 -12.566 1.00 0.00 N ATOM 616 CA SER A 40 -1.019 -5.169 -13.114 1.00 0.00 C ATOM 617 C SER A 40 -1.406 -5.449 -14.563 1.00 0.00 C ATOM 618 O SER A 40 -2.475 -5.044 -15.020 1.00 0.00 O ATOM 619 CB SER A 40 -1.204 -6.433 -12.272 1.00 0.00 C ATOM 620 OG SER A 40 -0.338 -7.467 -12.706 1.00 0.00 O ATOM 0 H SER A 40 -2.793 -4.083 -12.849 1.00 0.00 H new ATOM 0 HA SER A 40 0.030 -4.872 -13.087 1.00 0.00 H new ATOM 0 HB2 SER A 40 -1.009 -6.207 -11.224 1.00 0.00 H new ATOM 0 HB3 SER A 40 -2.239 -6.769 -12.338 1.00 0.00 H new ATOM 0 HG SER A 40 -0.475 -8.263 -12.151 1.00 0.00 H new ATOM 626 N ARG A 41 -0.529 -6.143 -15.280 1.00 0.00 N ATOM 627 CA ARG A 41 -0.777 -6.476 -16.677 1.00 0.00 C ATOM 628 C ARG A 41 -2.077 -7.262 -16.826 1.00 0.00 C ATOM 629 O ARG A 41 -2.700 -7.642 -15.836 1.00 0.00 O ATOM 630 CB ARG A 41 0.389 -7.287 -17.245 1.00 0.00 C ATOM 631 CG ARG A 41 1.728 -6.574 -17.154 1.00 0.00 C ATOM 632 CD ARG A 41 1.828 -5.445 -18.169 1.00 0.00 C ATOM 633 NE ARG A 41 3.213 -5.057 -18.420 1.00 0.00 N ATOM 634 CZ ARG A 41 3.563 -3.909 -18.991 1.00 0.00 C ATOM 635 NH1 ARG A 41 2.633 -3.042 -19.367 1.00 0.00 N ATOM 636 NH2 ARG A 41 4.844 -3.627 -19.187 1.00 0.00 N ATOM 0 H ARG A 41 0.360 -6.486 -14.916 1.00 0.00 H new ATOM 0 HA ARG A 41 -0.869 -5.545 -17.236 1.00 0.00 H new ATOM 0 HB2 ARG A 41 0.455 -8.235 -16.712 1.00 0.00 H new ATOM 0 HB3 ARG A 41 0.182 -7.522 -18.289 1.00 0.00 H new ATOM 0 HG2 ARG A 41 1.861 -6.174 -16.149 1.00 0.00 H new ATOM 0 HG3 ARG A 41 2.534 -7.288 -17.322 1.00 0.00 H new ATOM 0 HD2 ARG A 41 1.363 -5.756 -19.105 1.00 0.00 H new ATOM 0 HD3 ARG A 41 1.269 -4.582 -17.807 1.00 0.00 H new ATOM 0 HE ARG A 41 3.952 -5.702 -18.142 1.00 0.00 H new ATOM 0 HH11 ARG A 41 1.647 -3.255 -19.218 1.00 0.00 H new ATOM 0 HH12 ARG A 41 2.904 -2.162 -19.805 1.00 0.00 H new ATOM 0 HH21 ARG A 41 5.562 -4.292 -18.899 1.00 0.00 H new ATOM 0 HH22 ARG A 41 5.111 -2.746 -19.625 1.00 0.00 H new ATOM 650 N ASN A 42 -2.479 -7.499 -18.071 1.00 0.00 N ATOM 651 CA ASN A 42 -3.705 -8.238 -18.349 1.00 0.00 C ATOM 652 C ASN A 42 -3.858 -9.418 -17.396 1.00 0.00 C ATOM 653 O ASN A 42 -4.895 -9.582 -16.755 1.00 0.00 O ATOM 654 CB ASN A 42 -3.709 -8.733 -19.797 1.00 0.00 C ATOM 655 CG ASN A 42 -5.112 -8.896 -20.349 1.00 0.00 C ATOM 656 OD1 ASN A 42 -6.081 -8.986 -19.595 1.00 0.00 O ATOM 657 ND2 ASN A 42 -5.227 -8.935 -21.671 1.00 0.00 N ATOM 0 H ASN A 42 -1.974 -7.190 -18.902 1.00 0.00 H new ATOM 0 HA ASN A 42 -4.548 -7.563 -18.200 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -3.156 -8.030 -20.420 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -3.186 -9.688 -19.853 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -6.146 -9.043 -22.100 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -4.396 -8.857 -22.258 1.00 0.00 H new ATOM 664 N ASN A 43 -2.816 -10.239 -17.307 1.00 0.00 N ATOM 665 CA ASN A 43 -2.834 -11.405 -16.431 1.00 0.00 C ATOM 666 C ASN A 43 -2.300 -11.053 -15.046 1.00 0.00 C ATOM 667 O ASN A 43 -1.589 -10.063 -14.877 1.00 0.00 O ATOM 668 CB ASN A 43 -2.003 -12.537 -17.038 1.00 0.00 C ATOM 669 CG ASN A 43 -0.582 -12.109 -17.349 1.00 0.00 C ATOM 670 OD1 ASN A 43 0.037 -11.371 -16.582 1.00 0.00 O ATOM 671 ND2 ASN A 43 -0.058 -12.572 -18.477 1.00 0.00 N ATOM 0 H ASN A 43 -1.949 -10.118 -17.831 1.00 0.00 H new ATOM 0 HA ASN A 43 -3.867 -11.736 -16.329 1.00 0.00 H new ATOM 0 HB2 ASN A 43 -1.983 -13.380 -16.347 1.00 0.00 H new ATOM 0 HB3 ASN A 43 -2.483 -12.886 -17.952 1.00 0.00 H new ATOM 0 HD21 ASN A 43 0.895 -12.319 -18.738 1.00 0.00 H new ATOM 0 HD22 ASN A 43 -0.608 -13.181 -19.082 1.00 0.00 H new ATOM 678 N SER A 44 -2.647 -11.873 -14.058 1.00 0.00 N ATOM 679 CA SER A 44 -2.205 -11.647 -12.687 1.00 0.00 C ATOM 680 C SER A 44 -2.005 -12.971 -11.956 1.00 0.00 C ATOM 681 O SER A 44 -2.757 -13.924 -12.157 1.00 0.00 O ATOM 682 CB SER A 44 -3.223 -10.786 -11.936 1.00 0.00 C ATOM 683 OG SER A 44 -3.201 -9.448 -12.402 1.00 0.00 O ATOM 0 H SER A 44 -3.232 -12.699 -14.182 1.00 0.00 H new ATOM 0 HA SER A 44 -1.250 -11.122 -12.721 1.00 0.00 H new ATOM 0 HB2 SER A 44 -4.222 -11.203 -12.065 1.00 0.00 H new ATOM 0 HB3 SER A 44 -3.004 -10.806 -10.868 1.00 0.00 H new ATOM 0 HG SER A 44 -3.861 -8.919 -11.908 1.00 0.00 H new ATOM 689 N HIS A 45 -0.983 -13.022 -11.107 1.00 0.00 N ATOM 690 CA HIS A 45 -0.682 -14.228 -10.344 1.00 0.00 C ATOM 691 C HIS A 45 -1.046 -14.046 -8.874 1.00 0.00 C ATOM 692 O HIS A 45 -1.875 -14.779 -8.334 1.00 0.00 O ATOM 693 CB HIS A 45 0.799 -14.584 -10.475 1.00 0.00 C ATOM 694 CG HIS A 45 1.716 -13.422 -10.245 1.00 0.00 C ATOM 695 ND1 HIS A 45 2.541 -13.321 -9.145 1.00 0.00 N ATOM 696 CD2 HIS A 45 1.937 -12.309 -10.982 1.00 0.00 C ATOM 697 CE1 HIS A 45 3.229 -12.195 -9.215 1.00 0.00 C ATOM 698 NE2 HIS A 45 2.880 -11.562 -10.321 1.00 0.00 N ATOM 0 H HIS A 45 -0.350 -12.242 -10.930 1.00 0.00 H new ATOM 0 HA HIS A 45 -1.281 -15.043 -10.750 1.00 0.00 H new ATOM 0 HB2 HIS A 45 1.039 -15.373 -9.762 1.00 0.00 H new ATOM 0 HB3 HIS A 45 0.981 -14.988 -11.471 1.00 0.00 H new ATOM 0 HD1 HIS A 45 2.610 -14.008 -8.394 1.00 0.00 H new ATOM 0 HD2 HIS A 45 1.460 -12.055 -11.917 1.00 0.00 H new ATOM 0 HE1 HIS A 45 3.953 -11.851 -8.491 1.00 0.00 H new ATOM 706 N VAL A 46 -0.420 -13.066 -8.231 1.00 0.00 N ATOM 707 CA VAL A 46 -0.678 -12.788 -6.823 1.00 0.00 C ATOM 708 C VAL A 46 -2.066 -12.190 -6.626 1.00 0.00 C ATOM 709 O VAL A 46 -2.526 -11.383 -7.433 1.00 0.00 O ATOM 710 CB VAL A 46 0.372 -11.822 -6.240 1.00 0.00 C ATOM 711 CG1 VAL A 46 0.284 -10.464 -6.920 1.00 0.00 C ATOM 712 CG2 VAL A 46 0.193 -11.688 -4.736 1.00 0.00 C ATOM 0 H VAL A 46 0.270 -12.451 -8.663 1.00 0.00 H new ATOM 0 HA VAL A 46 -0.618 -13.740 -6.296 1.00 0.00 H new ATOM 0 HB VAL A 46 1.364 -12.232 -6.430 1.00 0.00 H new ATOM 0 HG11 VAL A 46 1.033 -9.795 -6.495 1.00 0.00 H new ATOM 0 HG12 VAL A 46 0.465 -10.580 -7.989 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -0.709 -10.043 -6.764 1.00 0.00 H new ATOM 0 HG21 VAL A 46 0.942 -11.002 -4.340 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -0.803 -11.301 -4.521 1.00 0.00 H new ATOM 0 HG23 VAL A 46 0.311 -12.665 -4.267 1.00 0.00 H new ATOM 722 N ASN A 47 -2.730 -12.592 -5.548 1.00 0.00 N ATOM 723 CA ASN A 47 -4.068 -12.096 -5.244 1.00 0.00 C ATOM 724 C ASN A 47 -4.109 -10.572 -5.303 1.00 0.00 C ATOM 725 O ASN A 47 -3.389 -9.893 -4.571 1.00 0.00 O ATOM 726 CB ASN A 47 -4.511 -12.577 -3.861 1.00 0.00 C ATOM 727 CG ASN A 47 -5.235 -13.908 -3.915 1.00 0.00 C ATOM 728 OD1 ASN A 47 -4.613 -14.969 -3.855 1.00 0.00 O ATOM 729 ND2 ASN A 47 -6.557 -13.858 -4.031 1.00 0.00 N ATOM 0 H ASN A 47 -2.364 -13.260 -4.870 1.00 0.00 H new ATOM 0 HA ASN A 47 -4.754 -12.489 -5.994 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -3.638 -12.668 -3.214 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -5.165 -11.829 -3.412 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -7.098 -14.722 -4.074 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -7.031 -12.956 -4.077 1.00 0.00 H new ATOM 736 N ARG A 48 -4.957 -10.043 -6.179 1.00 0.00 N ATOM 737 CA ARG A 48 -5.093 -8.599 -6.334 1.00 0.00 C ATOM 738 C ARG A 48 -5.610 -7.960 -5.048 1.00 0.00 C ATOM 739 O ARG A 48 -5.079 -6.950 -4.589 1.00 0.00 O ATOM 740 CB ARG A 48 -6.038 -8.276 -7.492 1.00 0.00 C ATOM 741 CG ARG A 48 -6.375 -6.798 -7.609 1.00 0.00 C ATOM 742 CD ARG A 48 -6.808 -6.436 -9.021 1.00 0.00 C ATOM 743 NE ARG A 48 -6.954 -4.993 -9.195 1.00 0.00 N ATOM 744 CZ ARG A 48 -7.184 -4.414 -10.368 1.00 0.00 C ATOM 745 NH1 ARG A 48 -7.295 -5.151 -11.464 1.00 0.00 N ATOM 746 NH2 ARG A 48 -7.306 -3.095 -10.445 1.00 0.00 N ATOM 0 H ARG A 48 -5.560 -10.592 -6.792 1.00 0.00 H new ATOM 0 HA ARG A 48 -4.107 -8.188 -6.553 1.00 0.00 H new ATOM 0 HB2 ARG A 48 -5.584 -8.611 -8.425 1.00 0.00 H new ATOM 0 HB3 ARG A 48 -6.961 -8.842 -7.365 1.00 0.00 H new ATOM 0 HG2 ARG A 48 -7.171 -6.549 -6.908 1.00 0.00 H new ATOM 0 HG3 ARG A 48 -5.506 -6.202 -7.330 1.00 0.00 H new ATOM 0 HD2 ARG A 48 -6.075 -6.815 -9.733 1.00 0.00 H new ATOM 0 HD3 ARG A 48 -7.755 -6.926 -9.247 1.00 0.00 H new ATOM 0 HE ARG A 48 -6.875 -4.398 -8.371 1.00 0.00 H new ATOM 0 HH11 ARG A 48 -7.204 -6.165 -11.408 1.00 0.00 H new ATOM 0 HH12 ARG A 48 -7.472 -4.704 -12.364 1.00 0.00 H new ATOM 0 HH21 ARG A 48 -7.223 -2.525 -9.603 1.00 0.00 H new ATOM 0 HH22 ARG A 48 -7.483 -2.651 -11.346 1.00 0.00 H new ATOM 760 N GLU A 49 -6.649 -8.558 -4.473 1.00 0.00 N ATOM 761 CA GLU A 49 -7.238 -8.045 -3.241 1.00 0.00 C ATOM 762 C GLU A 49 -6.254 -8.158 -2.080 1.00 0.00 C ATOM 763 O GLU A 49 -5.990 -7.180 -1.380 1.00 0.00 O ATOM 764 CB GLU A 49 -8.524 -8.805 -2.910 1.00 0.00 C ATOM 765 CG GLU A 49 -9.703 -8.416 -3.786 1.00 0.00 C ATOM 766 CD GLU A 49 -9.605 -8.990 -5.186 1.00 0.00 C ATOM 767 OE1 GLU A 49 -8.826 -8.444 -5.996 1.00 0.00 O ATOM 768 OE2 GLU A 49 -10.305 -9.982 -5.472 1.00 0.00 O ATOM 0 H GLU A 49 -7.100 -9.396 -4.840 1.00 0.00 H new ATOM 0 HA GLU A 49 -7.475 -6.992 -3.392 1.00 0.00 H new ATOM 0 HB2 GLU A 49 -8.341 -9.874 -3.015 1.00 0.00 H new ATOM 0 HB3 GLU A 49 -8.783 -8.627 -1.866 1.00 0.00 H new ATOM 0 HG2 GLU A 49 -10.626 -8.761 -3.320 1.00 0.00 H new ATOM 0 HG3 GLU A 49 -9.763 -7.329 -3.846 1.00 0.00 H new ATOM 775 N GLU A 50 -5.716 -9.357 -1.882 1.00 0.00 N ATOM 776 CA GLU A 50 -4.763 -9.598 -0.805 1.00 0.00 C ATOM 777 C GLU A 50 -3.792 -8.429 -0.667 1.00 0.00 C ATOM 778 O GLU A 50 -3.661 -7.839 0.406 1.00 0.00 O ATOM 779 CB GLU A 50 -3.988 -10.892 -1.059 1.00 0.00 C ATOM 780 CG GLU A 50 -4.739 -12.144 -0.636 1.00 0.00 C ATOM 781 CD GLU A 50 -5.199 -12.088 0.808 1.00 0.00 C ATOM 782 OE1 GLU A 50 -4.485 -11.481 1.634 1.00 0.00 O ATOM 783 OE2 GLU A 50 -6.271 -12.652 1.111 1.00 0.00 O ATOM 0 H GLU A 50 -5.924 -10.176 -2.453 1.00 0.00 H new ATOM 0 HA GLU A 50 -5.322 -9.696 0.125 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -3.752 -10.962 -2.121 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -3.040 -10.849 -0.523 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -5.605 -12.280 -1.284 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -4.096 -13.013 -0.775 1.00 0.00 H new ATOM 790 N VAL A 51 -3.111 -8.100 -1.761 1.00 0.00 N ATOM 791 CA VAL A 51 -2.152 -7.003 -1.763 1.00 0.00 C ATOM 792 C VAL A 51 -2.802 -5.703 -1.301 1.00 0.00 C ATOM 793 O VAL A 51 -2.240 -4.972 -0.485 1.00 0.00 O ATOM 794 CB VAL A 51 -1.545 -6.791 -3.163 1.00 0.00 C ATOM 795 CG1 VAL A 51 -0.677 -5.542 -3.185 1.00 0.00 C ATOM 796 CG2 VAL A 51 -0.746 -8.014 -3.587 1.00 0.00 C ATOM 0 H VAL A 51 -3.206 -8.578 -2.657 1.00 0.00 H new ATOM 0 HA VAL A 51 -1.358 -7.276 -1.068 1.00 0.00 H new ATOM 0 HB VAL A 51 -2.358 -6.651 -3.876 1.00 0.00 H new ATOM 0 HG11 VAL A 51 -0.257 -5.408 -4.182 1.00 0.00 H new ATOM 0 HG12 VAL A 51 -1.283 -4.673 -2.927 1.00 0.00 H new ATOM 0 HG13 VAL A 51 0.131 -5.648 -2.462 1.00 0.00 H new ATOM 0 HG21 VAL A 51 -0.324 -7.847 -4.578 1.00 0.00 H new ATOM 0 HG22 VAL A 51 0.060 -8.187 -2.874 1.00 0.00 H new ATOM 0 HG23 VAL A 51 -1.401 -8.885 -3.613 1.00 0.00 H new ATOM 806 N ILE A 52 -3.989 -5.422 -1.828 1.00 0.00 N ATOM 807 CA ILE A 52 -4.717 -4.212 -1.469 1.00 0.00 C ATOM 808 C ILE A 52 -5.183 -4.261 -0.018 1.00 0.00 C ATOM 809 O ILE A 52 -4.644 -3.564 0.842 1.00 0.00 O ATOM 810 CB ILE A 52 -5.938 -3.997 -2.382 1.00 0.00 C ATOM 811 CG1 ILE A 52 -5.491 -3.811 -3.833 1.00 0.00 C ATOM 812 CG2 ILE A 52 -6.745 -2.795 -1.913 1.00 0.00 C ATOM 813 CD1 ILE A 52 -6.589 -4.068 -4.841 1.00 0.00 C ATOM 0 H ILE A 52 -4.467 -6.016 -2.505 1.00 0.00 H new ATOM 0 HA ILE A 52 -4.026 -3.379 -1.598 1.00 0.00 H new ATOM 0 HB ILE A 52 -6.574 -4.881 -2.328 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -5.120 -2.794 -3.963 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -4.657 -4.483 -4.037 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -7.605 -2.656 -2.568 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -7.090 -2.964 -0.893 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -6.119 -1.903 -1.941 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -6.201 -3.917 -5.848 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -6.944 -5.093 -4.739 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -7.414 -3.379 -4.664 1.00 0.00 H new ATOM 825 N ARG A 53 -6.187 -5.091 0.248 1.00 0.00 N ATOM 826 CA ARG A 53 -6.725 -5.233 1.595 1.00 0.00 C ATOM 827 C ARG A 53 -5.602 -5.283 2.627 1.00 0.00 C ATOM 828 O ARG A 53 -5.685 -4.649 3.679 1.00 0.00 O ATOM 829 CB ARG A 53 -7.581 -6.496 1.695 1.00 0.00 C ATOM 830 CG ARG A 53 -8.425 -6.760 0.458 1.00 0.00 C ATOM 831 CD ARG A 53 -9.739 -7.437 0.815 1.00 0.00 C ATOM 832 NE ARG A 53 -9.634 -8.893 0.772 1.00 0.00 N ATOM 833 CZ ARG A 53 -10.443 -9.708 1.440 1.00 0.00 C ATOM 834 NH1 ARG A 53 -11.412 -9.212 2.198 1.00 0.00 N ATOM 835 NH2 ARG A 53 -10.285 -11.022 1.350 1.00 0.00 N ATOM 0 H ARG A 53 -6.644 -5.675 -0.452 1.00 0.00 H new ATOM 0 HA ARG A 53 -7.348 -4.363 1.804 1.00 0.00 H new ATOM 0 HB2 ARG A 53 -6.930 -7.353 1.870 1.00 0.00 H new ATOM 0 HB3 ARG A 53 -8.237 -6.412 2.561 1.00 0.00 H new ATOM 0 HG2 ARG A 53 -8.626 -5.819 -0.054 1.00 0.00 H new ATOM 0 HG3 ARG A 53 -7.868 -7.388 -0.237 1.00 0.00 H new ATOM 0 HD2 ARG A 53 -10.048 -7.125 1.813 1.00 0.00 H new ATOM 0 HD3 ARG A 53 -10.515 -7.109 0.124 1.00 0.00 H new ATOM 0 HE ARG A 53 -8.899 -9.307 0.198 1.00 0.00 H new ATOM 0 HH11 ARG A 53 -11.538 -8.202 2.269 1.00 0.00 H new ATOM 0 HH12 ARG A 53 -12.032 -9.840 2.710 1.00 0.00 H new ATOM 0 HH21 ARG A 53 -9.542 -11.408 0.767 1.00 0.00 H new ATOM 0 HH22 ARG A 53 -10.907 -11.647 1.863 1.00 0.00 H new ATOM 849 N GLU A 54 -4.555 -6.041 2.318 1.00 0.00 N ATOM 850 CA GLU A 54 -3.417 -6.174 3.220 1.00 0.00 C ATOM 851 C GLU A 54 -2.703 -4.837 3.397 1.00 0.00 C ATOM 852 O GLU A 54 -2.628 -4.302 4.504 1.00 0.00 O ATOM 853 CB GLU A 54 -2.436 -7.221 2.688 1.00 0.00 C ATOM 854 CG GLU A 54 -1.229 -7.436 3.585 1.00 0.00 C ATOM 855 CD GLU A 54 -0.656 -8.835 3.467 1.00 0.00 C ATOM 856 OE1 GLU A 54 -0.298 -9.236 2.339 1.00 0.00 O ATOM 857 OE2 GLU A 54 -0.564 -9.528 4.501 1.00 0.00 O ATOM 0 H GLU A 54 -4.471 -6.572 1.451 1.00 0.00 H new ATOM 0 HA GLU A 54 -3.792 -6.497 4.191 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -2.960 -8.169 2.566 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -2.093 -6.916 1.699 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -0.458 -6.709 3.330 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -1.513 -7.250 4.621 1.00 0.00 H new ATOM 864 N LEU A 55 -2.181 -4.302 2.299 1.00 0.00 N ATOM 865 CA LEU A 55 -1.472 -3.027 2.331 1.00 0.00 C ATOM 866 C LEU A 55 -2.188 -2.029 3.236 1.00 0.00 C ATOM 867 O LEU A 55 -1.551 -1.258 3.951 1.00 0.00 O ATOM 868 CB LEU A 55 -1.348 -2.455 0.918 1.00 0.00 C ATOM 869 CG LEU A 55 -0.100 -2.863 0.135 1.00 0.00 C ATOM 870 CD1 LEU A 55 -0.253 -2.510 -1.336 1.00 0.00 C ATOM 871 CD2 LEU A 55 1.137 -2.197 0.719 1.00 0.00 C ATOM 0 H LEU A 55 -2.235 -4.731 1.375 1.00 0.00 H new ATOM 0 HA LEU A 55 -0.474 -3.203 2.733 1.00 0.00 H new ATOM 0 HB2 LEU A 55 -2.226 -2.758 0.347 1.00 0.00 H new ATOM 0 HB3 LEU A 55 -1.371 -1.367 0.985 1.00 0.00 H new ATOM 0 HG LEU A 55 0.020 -3.943 0.217 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.645 -2.808 -1.877 1.00 0.00 H new ATOM 0 HD12 LEU A 55 -1.115 -3.034 -1.748 1.00 0.00 H new ATOM 0 HD13 LEU A 55 -0.399 -1.435 -1.439 1.00 0.00 H new ATOM 0 HD21 LEU A 55 2.016 -2.499 0.149 1.00 0.00 H new ATOM 0 HD22 LEU A 55 1.026 -1.114 0.668 1.00 0.00 H new ATOM 0 HD23 LEU A 55 1.257 -2.501 1.759 1.00 0.00 H new ATOM 883 N ALA A 56 -3.516 -2.052 3.199 1.00 0.00 N ATOM 884 CA ALA A 56 -4.319 -1.153 4.019 1.00 0.00 C ATOM 885 C ALA A 56 -4.281 -1.567 5.486 1.00 0.00 C ATOM 886 O ALA A 56 -4.103 -0.732 6.372 1.00 0.00 O ATOM 887 CB ALA A 56 -5.754 -1.118 3.514 1.00 0.00 C ATOM 0 H ALA A 56 -4.059 -2.683 2.610 1.00 0.00 H new ATOM 0 HA ALA A 56 -3.894 -0.152 3.941 1.00 0.00 H new ATOM 0 HB1 ALA A 56 -6.342 -0.443 4.136 1.00 0.00 H new ATOM 0 HB2 ALA A 56 -5.768 -0.766 2.482 1.00 0.00 H new ATOM 0 HB3 ALA A 56 -6.181 -2.120 3.562 1.00 0.00 H new ATOM 893 N GLY A 57 -4.451 -2.862 5.735 1.00 0.00 N ATOM 894 CA GLY A 57 -4.434 -3.363 7.097 1.00 0.00 C ATOM 895 C GLY A 57 -3.168 -2.983 7.839 1.00 0.00 C ATOM 896 O GLY A 57 -3.166 -2.889 9.067 1.00 0.00 O ATOM 0 H GLY A 57 -4.600 -3.572 5.018 1.00 0.00 H new ATOM 0 HA2 GLY A 57 -5.298 -2.973 7.635 1.00 0.00 H new ATOM 0 HA3 GLY A 57 -4.531 -4.449 7.083 1.00 0.00 H new ATOM 900 N ILE A 58 -2.090 -2.767 7.094 1.00 0.00 N ATOM 901 CA ILE A 58 -0.812 -2.396 7.689 1.00 0.00 C ATOM 902 C ILE A 58 -0.797 -0.923 8.085 1.00 0.00 C ATOM 903 O ILE A 58 -0.558 -0.583 9.244 1.00 0.00 O ATOM 904 CB ILE A 58 0.358 -2.669 6.727 1.00 0.00 C ATOM 905 CG1 ILE A 58 0.405 -4.153 6.354 1.00 0.00 C ATOM 906 CG2 ILE A 58 1.674 -2.234 7.354 1.00 0.00 C ATOM 907 CD1 ILE A 58 1.163 -4.431 5.075 1.00 0.00 C ATOM 0 H ILE A 58 -2.076 -2.842 6.077 1.00 0.00 H new ATOM 0 HA ILE A 58 -0.689 -3.011 8.580 1.00 0.00 H new ATOM 0 HB ILE A 58 0.203 -2.089 5.817 1.00 0.00 H new ATOM 0 HG12 ILE A 58 0.867 -4.710 7.169 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -0.614 -4.526 6.251 1.00 0.00 H new ATOM 0 HG21 ILE A 58 2.491 -2.434 6.661 1.00 0.00 H new ATOM 0 HG22 ILE A 58 1.637 -1.167 7.573 1.00 0.00 H new ATOM 0 HG23 ILE A 58 1.838 -2.789 8.278 1.00 0.00 H new ATOM 0 HD11 ILE A 58 1.155 -5.502 4.873 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.688 -3.902 4.248 1.00 0.00 H new ATOM 0 HD13 ILE A 58 2.193 -4.089 5.181 1.00 0.00 H new ATOM 919 N VAL A 59 -1.056 -0.053 7.115 1.00 0.00 N ATOM 920 CA VAL A 59 -1.075 1.384 7.362 1.00 0.00 C ATOM 921 C VAL A 59 -1.676 1.699 8.727 1.00 0.00 C ATOM 922 O VAL A 59 -1.257 2.643 9.398 1.00 0.00 O ATOM 923 CB VAL A 59 -1.875 2.129 6.277 1.00 0.00 C ATOM 924 CG1 VAL A 59 -1.955 3.614 6.598 1.00 0.00 C ATOM 925 CG2 VAL A 59 -1.251 1.905 4.907 1.00 0.00 C ATOM 0 H VAL A 59 -1.256 -0.318 6.150 1.00 0.00 H new ATOM 0 HA VAL A 59 -0.039 1.723 7.337 1.00 0.00 H new ATOM 0 HB VAL A 59 -2.889 1.730 6.259 1.00 0.00 H new ATOM 0 HG11 VAL A 59 -2.524 4.124 5.821 1.00 0.00 H new ATOM 0 HG12 VAL A 59 -2.450 3.752 7.559 1.00 0.00 H new ATOM 0 HG13 VAL A 59 -0.949 4.031 6.644 1.00 0.00 H new ATOM 0 HG21 VAL A 59 -1.829 2.438 4.152 1.00 0.00 H new ATOM 0 HG22 VAL A 59 -0.226 2.276 4.909 1.00 0.00 H new ATOM 0 HG23 VAL A 59 -1.250 0.839 4.677 1.00 0.00 H new ATOM 935 N CYS A 60 -2.659 0.903 9.132 1.00 0.00 N ATOM 936 CA CYS A 60 -3.319 1.097 10.418 1.00 0.00 C ATOM 937 C CYS A 60 -2.379 0.752 11.569 1.00 0.00 C ATOM 938 O CYS A 60 -2.255 1.509 12.532 1.00 0.00 O ATOM 939 CB CYS A 60 -4.583 0.240 10.501 1.00 0.00 C ATOM 940 SG CYS A 60 -5.581 0.537 11.979 1.00 0.00 S ATOM 0 H CYS A 60 -3.017 0.117 8.589 1.00 0.00 H new ATOM 0 HA CYS A 60 -3.596 2.148 10.501 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -5.195 0.428 9.619 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -4.298 -0.812 10.473 1.00 0.00 H new ATOM 0 HG CYS A 60 -6.628 -0.233 11.957 1.00 0.00 H new ATOM 946 N THR A 61 -1.720 -0.397 11.463 1.00 0.00 N ATOM 947 CA THR A 61 -0.793 -0.845 12.495 1.00 0.00 C ATOM 948 C THR A 61 0.256 0.220 12.792 1.00 0.00 C ATOM 949 O THR A 61 0.904 0.194 13.839 1.00 0.00 O ATOM 950 CB THR A 61 -0.083 -2.149 12.085 1.00 0.00 C ATOM 951 OG1 THR A 61 0.474 -2.787 13.240 1.00 0.00 O ATOM 952 CG2 THR A 61 1.018 -1.870 11.073 1.00 0.00 C ATOM 0 H THR A 61 -1.811 -1.035 10.672 1.00 0.00 H new ATOM 0 HA THR A 61 -1.384 -1.029 13.392 1.00 0.00 H new ATOM 0 HB THR A 61 -0.819 -2.809 11.625 1.00 0.00 H new ATOM 0 HG1 THR A 61 0.922 -3.616 12.971 1.00 0.00 H new ATOM 0 HG21 THR A 61 1.505 -2.806 10.798 1.00 0.00 H new ATOM 0 HG22 THR A 61 0.587 -1.411 10.184 1.00 0.00 H new ATOM 0 HG23 THR A 61 1.752 -1.194 11.511 1.00 0.00 H new ATOM 960 N LEU A 62 0.419 1.158 11.865 1.00 0.00 N ATOM 961 CA LEU A 62 1.390 2.234 12.028 1.00 0.00 C ATOM 962 C LEU A 62 0.813 3.365 12.874 1.00 0.00 C ATOM 963 O LEU A 62 1.396 3.758 13.883 1.00 0.00 O ATOM 964 CB LEU A 62 1.818 2.772 10.661 1.00 0.00 C ATOM 965 CG LEU A 62 2.321 1.733 9.659 1.00 0.00 C ATOM 966 CD1 LEU A 62 2.273 2.290 8.244 1.00 0.00 C ATOM 967 CD2 LEU A 62 3.733 1.290 10.012 1.00 0.00 C ATOM 0 H LEU A 62 -0.109 1.195 10.993 1.00 0.00 H new ATOM 0 HA LEU A 62 2.262 1.829 12.542 1.00 0.00 H new ATOM 0 HB2 LEU A 62 0.971 3.295 10.217 1.00 0.00 H new ATOM 0 HB3 LEU A 62 2.605 3.511 10.814 1.00 0.00 H new ATOM 0 HG LEU A 62 1.667 0.863 9.708 1.00 0.00 H new ATOM 0 HD11 LEU A 62 2.635 1.537 7.544 1.00 0.00 H new ATOM 0 HD12 LEU A 62 1.246 2.556 7.992 1.00 0.00 H new ATOM 0 HD13 LEU A 62 2.904 3.177 8.180 1.00 0.00 H new ATOM 0 HD21 LEU A 62 4.074 0.550 9.288 1.00 0.00 H new ATOM 0 HD22 LEU A 62 4.400 2.152 9.992 1.00 0.00 H new ATOM 0 HD23 LEU A 62 3.738 0.850 11.009 1.00 0.00 H new ATOM 979 N ASN A 63 -0.338 3.882 12.456 1.00 0.00 N ATOM 980 CA ASN A 63 -0.995 4.966 13.176 1.00 0.00 C ATOM 981 C ASN A 63 -2.513 4.830 13.097 1.00 0.00 C ATOM 982 O ASN A 63 -3.095 4.872 12.013 1.00 0.00 O ATOM 983 CB ASN A 63 -0.563 6.320 12.608 1.00 0.00 C ATOM 984 CG ASN A 63 -0.625 7.427 13.642 1.00 0.00 C ATOM 985 OD1 ASN A 63 -1.413 7.367 14.586 1.00 0.00 O ATOM 986 ND2 ASN A 63 0.208 8.447 13.467 1.00 0.00 N ATOM 0 H ASN A 63 -0.835 3.567 11.622 1.00 0.00 H new ATOM 0 HA ASN A 63 -0.696 4.907 14.223 1.00 0.00 H new ATOM 0 HB2 ASN A 63 0.454 6.242 12.224 1.00 0.00 H new ATOM 0 HB3 ASN A 63 -1.203 6.578 11.765 1.00 0.00 H new ATOM 0 HD21 ASN A 63 0.211 9.222 14.130 1.00 0.00 H new ATOM 0 HD22 ASN A 63 0.844 8.455 12.670 1.00 0.00 H new ATOM 993 N SER A 64 -3.148 4.669 14.254 1.00 0.00 N ATOM 994 CA SER A 64 -4.598 4.523 14.316 1.00 0.00 C ATOM 995 C SER A 64 -5.290 5.664 13.576 1.00 0.00 C ATOM 996 O SER A 64 -6.350 5.477 12.981 1.00 0.00 O ATOM 997 CB SER A 64 -5.065 4.487 15.772 1.00 0.00 C ATOM 998 OG SER A 64 -6.377 3.961 15.873 1.00 0.00 O ATOM 0 H SER A 64 -2.682 4.636 15.160 1.00 0.00 H new ATOM 0 HA SER A 64 -4.866 3.584 13.832 1.00 0.00 H new ATOM 0 HB2 SER A 64 -4.379 3.879 16.362 1.00 0.00 H new ATOM 0 HB3 SER A 64 -5.040 5.493 16.190 1.00 0.00 H new ATOM 0 HG SER A 64 -6.652 3.947 16.813 1.00 0.00 H new ATOM 1004 N GLU A 65 -4.682 6.845 13.620 1.00 0.00 N ATOM 1005 CA GLU A 65 -5.240 8.016 12.955 1.00 0.00 C ATOM 1006 C GLU A 65 -5.343 7.789 11.449 1.00 0.00 C ATOM 1007 O GLU A 65 -6.159 8.413 10.771 1.00 0.00 O ATOM 1008 CB GLU A 65 -4.380 9.250 13.238 1.00 0.00 C ATOM 1009 CG GLU A 65 -4.421 9.700 14.688 1.00 0.00 C ATOM 1010 CD GLU A 65 -5.630 10.560 14.998 1.00 0.00 C ATOM 1011 OE1 GLU A 65 -6.756 10.019 15.009 1.00 0.00 O ATOM 1012 OE2 GLU A 65 -5.452 11.774 15.230 1.00 0.00 O ATOM 0 H GLU A 65 -3.803 7.016 14.109 1.00 0.00 H new ATOM 0 HA GLU A 65 -6.242 8.183 13.350 1.00 0.00 H new ATOM 0 HB2 GLU A 65 -3.348 9.034 12.962 1.00 0.00 H new ATOM 0 HB3 GLU A 65 -4.715 10.070 12.602 1.00 0.00 H new ATOM 0 HG2 GLU A 65 -4.427 8.824 15.336 1.00 0.00 H new ATOM 0 HG3 GLU A 65 -3.514 10.259 14.917 1.00 0.00 H new ATOM 1019 N ASN A 66 -4.508 6.893 10.933 1.00 0.00 N ATOM 1020 CA ASN A 66 -4.504 6.584 9.508 1.00 0.00 C ATOM 1021 C ASN A 66 -5.834 5.972 9.080 1.00 0.00 C ATOM 1022 O ASN A 66 -6.372 5.093 9.755 1.00 0.00 O ATOM 1023 CB ASN A 66 -3.358 5.625 9.176 1.00 0.00 C ATOM 1024 CG ASN A 66 -2.000 6.205 9.521 1.00 0.00 C ATOM 1025 OD1 ASN A 66 -1.806 7.421 9.490 1.00 0.00 O ATOM 1026 ND2 ASN A 66 -1.052 5.336 9.852 1.00 0.00 N ATOM 0 H ASN A 66 -3.826 6.368 11.480 1.00 0.00 H new ATOM 0 HA ASN A 66 -4.360 7.515 8.960 1.00 0.00 H new ATOM 0 HB2 ASN A 66 -3.500 4.691 9.720 1.00 0.00 H new ATOM 0 HB3 ASN A 66 -3.387 5.382 8.114 1.00 0.00 H new ATOM 0 HD21 ASN A 66 -0.118 5.668 10.094 1.00 0.00 H new ATOM 0 HD22 ASN A 66 -1.258 4.337 9.864 1.00 0.00 H new ATOM 1033 N LYS A 67 -6.360 6.441 7.954 1.00 0.00 N ATOM 1034 CA LYS A 67 -7.626 5.940 7.433 1.00 0.00 C ATOM 1035 C LYS A 67 -7.654 6.013 5.909 1.00 0.00 C ATOM 1036 O LYS A 67 -7.808 7.089 5.332 1.00 0.00 O ATOM 1037 CB LYS A 67 -8.793 6.742 8.014 1.00 0.00 C ATOM 1038 CG LYS A 67 -9.183 6.317 9.419 1.00 0.00 C ATOM 1039 CD LYS A 67 -9.928 4.993 9.414 1.00 0.00 C ATOM 1040 CE LYS A 67 -10.213 4.509 10.828 1.00 0.00 C ATOM 1041 NZ LYS A 67 -11.508 5.034 11.343 1.00 0.00 N ATOM 0 H LYS A 67 -5.928 7.168 7.384 1.00 0.00 H new ATOM 0 HA LYS A 67 -7.726 4.896 7.731 1.00 0.00 H new ATOM 0 HB2 LYS A 67 -8.527 7.799 8.024 1.00 0.00 H new ATOM 0 HB3 LYS A 67 -9.657 6.637 7.358 1.00 0.00 H new ATOM 0 HG2 LYS A 67 -8.288 6.230 10.035 1.00 0.00 H new ATOM 0 HG3 LYS A 67 -9.809 7.086 9.872 1.00 0.00 H new ATOM 0 HD2 LYS A 67 -10.866 5.104 8.870 1.00 0.00 H new ATOM 0 HD3 LYS A 67 -9.339 4.245 8.884 1.00 0.00 H new ATOM 0 HE2 LYS A 67 -10.231 3.419 10.842 1.00 0.00 H new ATOM 0 HE3 LYS A 67 -9.405 4.823 11.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 67 -11.666 4.682 12.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 67 -11.482 6.074 11.354 1.00 0.00 H new ATOM 0 HZ3 LYS A 67 -12.282 4.714 10.727 1.00 0.00 H new ATOM 1055 N VAL A 68 -7.506 4.860 5.264 1.00 0.00 N ATOM 1056 CA VAL A 68 -7.518 4.792 3.807 1.00 0.00 C ATOM 1057 C VAL A 68 -8.844 5.290 3.244 1.00 0.00 C ATOM 1058 O VAL A 68 -9.908 4.773 3.586 1.00 0.00 O ATOM 1059 CB VAL A 68 -7.268 3.356 3.310 1.00 0.00 C ATOM 1060 CG1 VAL A 68 -8.217 2.382 3.992 1.00 0.00 C ATOM 1061 CG2 VAL A 68 -7.413 3.284 1.798 1.00 0.00 C ATOM 0 H VAL A 68 -7.376 3.961 5.727 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.713 5.436 3.454 1.00 0.00 H new ATOM 0 HB VAL A 68 -6.248 3.073 3.568 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -8.026 1.372 3.628 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -8.060 2.415 5.070 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -9.247 2.659 3.767 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -7.233 2.262 1.463 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -8.421 3.587 1.514 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -6.689 3.952 1.331 1.00 0.00 H new ATOM 1071 N ASP A 69 -8.773 6.296 2.380 1.00 0.00 N ATOM 1072 CA ASP A 69 -9.969 6.864 1.768 1.00 0.00 C ATOM 1073 C ASP A 69 -9.849 6.872 0.247 1.00 0.00 C ATOM 1074 O ASP A 69 -8.747 6.944 -0.299 1.00 0.00 O ATOM 1075 CB ASP A 69 -10.205 8.285 2.281 1.00 0.00 C ATOM 1076 CG ASP A 69 -11.671 8.671 2.264 1.00 0.00 C ATOM 1077 OD1 ASP A 69 -12.513 7.816 2.612 1.00 0.00 O ATOM 1078 OD2 ASP A 69 -11.977 9.826 1.902 1.00 0.00 O ATOM 0 H ASP A 69 -7.900 6.735 2.087 1.00 0.00 H new ATOM 0 HA ASP A 69 -10.820 6.241 2.044 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -9.822 8.369 3.298 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -9.640 8.988 1.668 1.00 0.00 H new ATOM 1083 N LEU A 70 -10.988 6.796 -0.432 1.00 0.00 N ATOM 1084 CA LEU A 70 -11.011 6.794 -1.891 1.00 0.00 C ATOM 1085 C LEU A 70 -11.657 8.067 -2.427 1.00 0.00 C ATOM 1086 O LEU A 70 -11.779 8.253 -3.638 1.00 0.00 O ATOM 1087 CB LEU A 70 -11.768 5.568 -2.406 1.00 0.00 C ATOM 1088 CG LEU A 70 -11.231 4.210 -1.956 1.00 0.00 C ATOM 1089 CD1 LEU A 70 -12.116 3.087 -2.475 1.00 0.00 C ATOM 1090 CD2 LEU A 70 -9.796 4.021 -2.426 1.00 0.00 C ATOM 0 H LEU A 70 -11.908 6.735 0.004 1.00 0.00 H new ATOM 0 HA LEU A 70 -9.981 6.754 -2.247 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -12.808 5.648 -2.089 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -11.764 5.595 -3.496 1.00 0.00 H new ATOM 0 HG LEU A 70 -11.242 4.180 -0.866 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -11.718 2.128 -2.145 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -13.127 3.213 -2.089 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -12.138 3.115 -3.564 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.430 3.049 -2.096 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -9.760 4.073 -3.514 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -9.169 4.806 -2.005 1.00 0.00 H new ATOM 1102 N THR A 71 -12.069 8.945 -1.517 1.00 0.00 N ATOM 1103 CA THR A 71 -12.701 10.202 -1.898 1.00 0.00 C ATOM 1104 C THR A 71 -11.770 11.383 -1.649 1.00 0.00 C ATOM 1105 O THR A 71 -11.493 12.168 -2.555 1.00 0.00 O ATOM 1106 CB THR A 71 -14.015 10.426 -1.126 1.00 0.00 C ATOM 1107 OG1 THR A 71 -14.890 9.308 -1.312 1.00 0.00 O ATOM 1108 CG2 THR A 71 -14.705 11.700 -1.591 1.00 0.00 C ATOM 0 H THR A 71 -11.976 8.808 -0.511 1.00 0.00 H new ATOM 0 HA THR A 71 -12.921 10.135 -2.963 1.00 0.00 H new ATOM 0 HB THR A 71 -13.776 10.527 -0.067 1.00 0.00 H new ATOM 0 HG1 THR A 71 -15.722 9.458 -0.817 1.00 0.00 H new ATOM 0 HG21 THR A 71 -15.631 11.837 -1.032 1.00 0.00 H new ATOM 0 HG22 THR A 71 -14.048 12.553 -1.420 1.00 0.00 H new ATOM 0 HG23 THR A 71 -14.931 11.624 -2.654 1.00 0.00 H new ATOM 1116 N ASN A 72 -11.290 11.503 -0.416 1.00 0.00 N ATOM 1117 CA ASN A 72 -10.390 12.589 -0.048 1.00 0.00 C ATOM 1118 C ASN A 72 -9.036 12.046 0.400 1.00 0.00 C ATOM 1119 O ASN A 72 -8.526 12.385 1.468 1.00 0.00 O ATOM 1120 CB ASN A 72 -11.007 13.436 1.067 1.00 0.00 C ATOM 1121 CG ASN A 72 -11.844 14.580 0.529 1.00 0.00 C ATOM 1122 OD1 ASN A 72 -13.009 14.737 0.893 1.00 0.00 O ATOM 1123 ND2 ASN A 72 -11.251 15.387 -0.344 1.00 0.00 N ATOM 0 H ASN A 72 -11.509 10.861 0.346 1.00 0.00 H new ATOM 0 HA ASN A 72 -10.238 13.214 -0.928 1.00 0.00 H new ATOM 0 HB2 ASN A 72 -11.628 12.802 1.700 1.00 0.00 H new ATOM 0 HB3 ASN A 72 -10.213 13.836 1.697 1.00 0.00 H new ATOM 0 HD21 ASN A 72 -11.764 16.174 -0.741 1.00 0.00 H new ATOM 0 HD22 ASN A 72 -10.283 15.219 -0.618 1.00 0.00 H new ATOM 1130 N PRO A 73 -8.439 11.183 -0.435 1.00 0.00 N ATOM 1131 CA PRO A 73 -7.137 10.576 -0.147 1.00 0.00 C ATOM 1132 C PRO A 73 -5.997 11.586 -0.220 1.00 0.00 C ATOM 1133 O PRO A 73 -5.882 12.336 -1.189 1.00 0.00 O ATOM 1134 CB PRO A 73 -6.987 9.521 -1.247 1.00 0.00 C ATOM 1135 CG PRO A 73 -7.833 10.018 -2.367 1.00 0.00 C ATOM 1136 CD PRO A 73 -8.989 10.735 -1.725 1.00 0.00 C ATOM 0 HA PRO A 73 -7.092 10.169 0.863 1.00 0.00 H new ATOM 0 HB2 PRO A 73 -5.947 9.415 -1.554 1.00 0.00 H new ATOM 0 HB3 PRO A 73 -7.320 8.541 -0.904 1.00 0.00 H new ATOM 0 HG2 PRO A 73 -7.269 10.689 -3.015 1.00 0.00 H new ATOM 0 HG3 PRO A 73 -8.182 9.193 -2.989 1.00 0.00 H new ATOM 0 HD2 PRO A 73 -9.327 11.575 -2.331 1.00 0.00 H new ATOM 0 HD3 PRO A 73 -9.846 10.075 -1.589 1.00 0.00 H new ATOM 1144 N GLN A 74 -5.157 11.599 0.811 1.00 0.00 N ATOM 1145 CA GLN A 74 -4.027 12.519 0.863 1.00 0.00 C ATOM 1146 C GLN A 74 -2.789 11.896 0.224 1.00 0.00 C ATOM 1147 O GLN A 74 -1.926 12.602 -0.297 1.00 0.00 O ATOM 1148 CB GLN A 74 -3.726 12.909 2.311 1.00 0.00 C ATOM 1149 CG GLN A 74 -4.807 13.771 2.945 1.00 0.00 C ATOM 1150 CD GLN A 74 -4.660 15.239 2.599 1.00 0.00 C ATOM 1151 OE1 GLN A 74 -4.438 15.598 1.442 1.00 0.00 O ATOM 1152 NE2 GLN A 74 -4.783 16.099 3.604 1.00 0.00 N ATOM 0 H GLN A 74 -5.238 10.983 1.620 1.00 0.00 H new ATOM 0 HA GLN A 74 -4.293 13.414 0.301 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -3.600 12.003 2.904 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -2.778 13.446 2.345 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.785 13.420 2.616 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -4.773 13.652 4.028 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -4.967 15.758 4.548 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -4.694 17.100 3.432 1.00 0.00 H new ATOM 1161 N TYR A 75 -2.710 10.571 0.269 1.00 0.00 N ATOM 1162 CA TYR A 75 -1.576 9.854 -0.302 1.00 0.00 C ATOM 1163 C TYR A 75 -2.047 8.659 -1.126 1.00 0.00 C ATOM 1164 O TYR A 75 -2.800 7.813 -0.642 1.00 0.00 O ATOM 1165 CB TYR A 75 -0.632 9.384 0.806 1.00 0.00 C ATOM 1166 CG TYR A 75 -0.240 10.478 1.772 1.00 0.00 C ATOM 1167 CD1 TYR A 75 0.865 11.284 1.529 1.00 0.00 C ATOM 1168 CD2 TYR A 75 -0.976 10.707 2.928 1.00 0.00 C ATOM 1169 CE1 TYR A 75 1.227 12.284 2.410 1.00 0.00 C ATOM 1170 CE2 TYR A 75 -0.622 11.707 3.814 1.00 0.00 C ATOM 1171 CZ TYR A 75 0.480 12.492 3.550 1.00 0.00 C ATOM 1172 OH TYR A 75 0.837 13.489 4.430 1.00 0.00 O ATOM 0 H TYR A 75 -3.417 9.972 0.695 1.00 0.00 H new ATOM 0 HA TYR A 75 -1.040 10.538 -0.960 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -1.110 8.576 1.360 1.00 0.00 H new ATOM 0 HB3 TYR A 75 0.269 8.971 0.353 1.00 0.00 H new ATOM 0 HD1 TYR A 75 1.451 11.126 0.636 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -1.839 10.093 3.138 1.00 0.00 H new ATOM 0 HE1 TYR A 75 2.091 12.900 2.207 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -1.205 11.872 4.708 1.00 0.00 H new ATOM 0 HH TYR A 75 0.207 13.504 5.181 1.00 0.00 H new ATOM 1182 N THR A 76 -1.598 8.596 -2.375 1.00 0.00 N ATOM 1183 CA THR A 76 -1.972 7.506 -3.268 1.00 0.00 C ATOM 1184 C THR A 76 -0.889 6.434 -3.311 1.00 0.00 C ATOM 1185 O THR A 76 0.202 6.660 -3.834 1.00 0.00 O ATOM 1186 CB THR A 76 -2.231 8.015 -4.699 1.00 0.00 C ATOM 1187 OG1 THR A 76 -3.249 9.022 -4.683 1.00 0.00 O ATOM 1188 CG2 THR A 76 -2.654 6.874 -5.611 1.00 0.00 C ATOM 0 H THR A 76 -0.974 9.287 -2.792 1.00 0.00 H new ATOM 0 HA THR A 76 -2.891 7.075 -2.872 1.00 0.00 H new ATOM 0 HB THR A 76 -1.304 8.441 -5.083 1.00 0.00 H new ATOM 0 HG1 THR A 76 -3.407 9.342 -5.596 1.00 0.00 H new ATOM 0 HG21 THR A 76 -2.831 7.258 -6.616 1.00 0.00 H new ATOM 0 HG22 THR A 76 -1.865 6.123 -5.644 1.00 0.00 H new ATOM 0 HG23 THR A 76 -3.569 6.423 -5.228 1.00 0.00 H new ATOM 1196 N VAL A 77 -1.198 5.265 -2.758 1.00 0.00 N ATOM 1197 CA VAL A 77 -0.251 4.156 -2.735 1.00 0.00 C ATOM 1198 C VAL A 77 -0.632 3.087 -3.753 1.00 0.00 C ATOM 1199 O VAL A 77 -1.523 2.273 -3.510 1.00 0.00 O ATOM 1200 CB VAL A 77 -0.172 3.515 -1.337 1.00 0.00 C ATOM 1201 CG1 VAL A 77 0.878 4.213 -0.488 1.00 0.00 C ATOM 1202 CG2 VAL A 77 -1.532 3.553 -0.657 1.00 0.00 C ATOM 0 H VAL A 77 -2.096 5.062 -2.320 1.00 0.00 H new ATOM 0 HA VAL A 77 0.725 4.567 -2.993 1.00 0.00 H new ATOM 0 HB VAL A 77 0.123 2.472 -1.450 1.00 0.00 H new ATOM 0 HG11 VAL A 77 0.919 3.746 0.496 1.00 0.00 H new ATOM 0 HG12 VAL A 77 1.852 4.128 -0.971 1.00 0.00 H new ATOM 0 HG13 VAL A 77 0.617 5.266 -0.380 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -1.458 3.096 0.330 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -1.859 4.588 -0.554 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -2.255 3.002 -1.259 1.00 0.00 H new ATOM 1212 N VAL A 78 0.049 3.094 -4.894 1.00 0.00 N ATOM 1213 CA VAL A 78 -0.217 2.124 -5.949 1.00 0.00 C ATOM 1214 C VAL A 78 0.827 1.012 -5.949 1.00 0.00 C ATOM 1215 O VAL A 78 1.975 1.224 -5.559 1.00 0.00 O ATOM 1216 CB VAL A 78 -0.237 2.793 -7.336 1.00 0.00 C ATOM 1217 CG1 VAL A 78 -0.864 4.177 -7.252 1.00 0.00 C ATOM 1218 CG2 VAL A 78 1.170 2.871 -7.910 1.00 0.00 C ATOM 0 H VAL A 78 0.789 3.761 -5.111 1.00 0.00 H new ATOM 0 HA VAL A 78 -1.199 1.697 -5.746 1.00 0.00 H new ATOM 0 HB VAL A 78 -0.845 2.184 -8.005 1.00 0.00 H new ATOM 0 HG11 VAL A 78 -0.870 4.635 -8.241 1.00 0.00 H new ATOM 0 HG12 VAL A 78 -1.887 4.091 -6.886 1.00 0.00 H new ATOM 0 HG13 VAL A 78 -0.285 4.798 -6.568 1.00 0.00 H new ATOM 0 HG21 VAL A 78 1.137 3.346 -8.890 1.00 0.00 H new ATOM 0 HG22 VAL A 78 1.803 3.457 -7.244 1.00 0.00 H new ATOM 0 HG23 VAL A 78 1.579 1.866 -8.008 1.00 0.00 H new ATOM 1228 N VAL A 79 0.420 -0.174 -6.389 1.00 0.00 N ATOM 1229 CA VAL A 79 1.319 -1.320 -6.442 1.00 0.00 C ATOM 1230 C VAL A 79 1.361 -1.923 -7.841 1.00 0.00 C ATOM 1231 O VAL A 79 0.450 -2.645 -8.244 1.00 0.00 O ATOM 1232 CB VAL A 79 0.899 -2.410 -5.438 1.00 0.00 C ATOM 1233 CG1 VAL A 79 -0.615 -2.546 -5.399 1.00 0.00 C ATOM 1234 CG2 VAL A 79 1.553 -3.738 -5.789 1.00 0.00 C ATOM 0 H VAL A 79 -0.527 -0.366 -6.714 1.00 0.00 H new ATOM 0 HA VAL A 79 2.311 -0.955 -6.177 1.00 0.00 H new ATOM 0 HB VAL A 79 1.239 -2.115 -4.445 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -0.892 -3.321 -4.684 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -1.058 -1.597 -5.096 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -0.982 -2.818 -6.389 1.00 0.00 H new ATOM 0 HG21 VAL A 79 1.245 -4.497 -5.069 1.00 0.00 H new ATOM 0 HG22 VAL A 79 1.246 -4.042 -6.790 1.00 0.00 H new ATOM 0 HG23 VAL A 79 2.637 -3.629 -5.760 1.00 0.00 H new ATOM 1244 N GLU A 80 2.426 -1.621 -8.578 1.00 0.00 N ATOM 1245 CA GLU A 80 2.586 -2.133 -9.934 1.00 0.00 C ATOM 1246 C GLU A 80 3.357 -3.450 -9.931 1.00 0.00 C ATOM 1247 O GLU A 80 4.153 -3.712 -9.029 1.00 0.00 O ATOM 1248 CB GLU A 80 3.310 -1.108 -10.809 1.00 0.00 C ATOM 1249 CG GLU A 80 3.424 -1.523 -12.266 1.00 0.00 C ATOM 1250 CD GLU A 80 4.235 -0.542 -13.090 1.00 0.00 C ATOM 1251 OE1 GLU A 80 5.050 0.198 -12.500 1.00 0.00 O ATOM 1252 OE2 GLU A 80 4.055 -0.515 -14.326 1.00 0.00 O ATOM 0 H GLU A 80 3.190 -1.025 -8.259 1.00 0.00 H new ATOM 0 HA GLU A 80 1.593 -2.314 -10.345 1.00 0.00 H new ATOM 0 HB2 GLU A 80 2.782 -0.156 -10.751 1.00 0.00 H new ATOM 0 HB3 GLU A 80 4.310 -0.942 -10.408 1.00 0.00 H new ATOM 0 HG2 GLU A 80 3.885 -2.509 -12.324 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.425 -1.613 -12.694 1.00 0.00 H new ATOM 1259 N ILE A 81 3.114 -4.274 -10.945 1.00 0.00 N ATOM 1260 CA ILE A 81 3.785 -5.562 -11.059 1.00 0.00 C ATOM 1261 C ILE A 81 4.652 -5.621 -12.313 1.00 0.00 C ATOM 1262 O ILE A 81 4.145 -5.796 -13.421 1.00 0.00 O ATOM 1263 CB ILE A 81 2.774 -6.723 -11.093 1.00 0.00 C ATOM 1264 CG1 ILE A 81 1.689 -6.513 -10.035 1.00 0.00 C ATOM 1265 CG2 ILE A 81 3.484 -8.051 -10.874 1.00 0.00 C ATOM 1266 CD1 ILE A 81 2.147 -6.829 -8.628 1.00 0.00 C ATOM 0 H ILE A 81 2.457 -4.072 -11.699 1.00 0.00 H new ATOM 0 HA ILE A 81 4.417 -5.667 -10.177 1.00 0.00 H new ATOM 0 HB ILE A 81 2.300 -6.744 -12.074 1.00 0.00 H new ATOM 0 HG12 ILE A 81 1.350 -5.478 -10.074 1.00 0.00 H new ATOM 0 HG13 ILE A 81 0.830 -7.139 -10.278 1.00 0.00 H new ATOM 0 HG21 ILE A 81 2.756 -8.862 -10.901 1.00 0.00 H new ATOM 0 HG22 ILE A 81 4.224 -8.202 -11.660 1.00 0.00 H new ATOM 0 HG23 ILE A 81 3.981 -8.042 -9.904 1.00 0.00 H new ATOM 0 HD11 ILE A 81 1.327 -6.658 -7.931 1.00 0.00 H new ATOM 0 HD12 ILE A 81 2.458 -7.872 -8.572 1.00 0.00 H new ATOM 0 HD13 ILE A 81 2.987 -6.185 -8.365 1.00 0.00 H new ATOM 1278 N ILE A 82 5.960 -5.476 -12.129 1.00 0.00 N ATOM 1279 CA ILE A 82 6.896 -5.516 -13.245 1.00 0.00 C ATOM 1280 C ILE A 82 7.901 -6.651 -13.079 1.00 0.00 C ATOM 1281 O ILE A 82 8.875 -6.530 -12.335 1.00 0.00 O ATOM 1282 CB ILE A 82 7.661 -4.186 -13.386 1.00 0.00 C ATOM 1283 CG1 ILE A 82 6.680 -3.028 -13.581 1.00 0.00 C ATOM 1284 CG2 ILE A 82 8.641 -4.259 -14.547 1.00 0.00 C ATOM 1285 CD1 ILE A 82 7.236 -1.687 -13.155 1.00 0.00 C ATOM 0 H ILE A 82 6.395 -5.330 -11.218 1.00 0.00 H new ATOM 0 HA ILE A 82 6.306 -5.684 -14.146 1.00 0.00 H new ATOM 0 HB ILE A 82 8.226 -4.009 -12.471 1.00 0.00 H new ATOM 0 HG12 ILE A 82 6.395 -2.977 -14.632 1.00 0.00 H new ATOM 0 HG13 ILE A 82 5.772 -3.232 -13.014 1.00 0.00 H new ATOM 0 HG21 ILE A 82 9.174 -3.312 -14.634 1.00 0.00 H new ATOM 0 HG22 ILE A 82 9.356 -5.063 -14.370 1.00 0.00 H new ATOM 0 HG23 ILE A 82 8.097 -4.455 -15.471 1.00 0.00 H new ATOM 0 HD11 ILE A 82 6.487 -0.913 -13.321 1.00 0.00 H new ATOM 0 HD12 ILE A 82 7.495 -1.720 -12.097 1.00 0.00 H new ATOM 0 HD13 ILE A 82 8.128 -1.460 -13.740 1.00 0.00 H new ATOM 1297 N LYS A 83 7.659 -7.755 -13.778 1.00 0.00 N ATOM 1298 CA LYS A 83 8.543 -8.912 -13.712 1.00 0.00 C ATOM 1299 C LYS A 83 8.516 -9.539 -12.322 1.00 0.00 C ATOM 1300 O LYS A 83 9.560 -9.754 -11.708 1.00 0.00 O ATOM 1301 CB LYS A 83 9.974 -8.508 -14.074 1.00 0.00 C ATOM 1302 CG LYS A 83 10.090 -7.824 -15.425 1.00 0.00 C ATOM 1303 CD LYS A 83 11.460 -7.195 -15.616 1.00 0.00 C ATOM 1304 CE LYS A 83 12.514 -8.242 -15.941 1.00 0.00 C ATOM 1305 NZ LYS A 83 13.806 -7.622 -16.344 1.00 0.00 N ATOM 0 H LYS A 83 6.857 -7.872 -14.397 1.00 0.00 H new ATOM 0 HA LYS A 83 8.188 -9.650 -14.431 1.00 0.00 H new ATOM 0 HB2 LYS A 83 10.360 -7.840 -13.304 1.00 0.00 H new ATOM 0 HB3 LYS A 83 10.605 -9.397 -14.071 1.00 0.00 H new ATOM 0 HG2 LYS A 83 9.908 -8.549 -16.218 1.00 0.00 H new ATOM 0 HG3 LYS A 83 9.321 -7.057 -15.512 1.00 0.00 H new ATOM 0 HD2 LYS A 83 11.415 -6.461 -16.420 1.00 0.00 H new ATOM 0 HD3 LYS A 83 11.745 -6.659 -14.710 1.00 0.00 H new ATOM 0 HE2 LYS A 83 12.673 -8.879 -15.071 1.00 0.00 H new ATOM 0 HE3 LYS A 83 12.153 -8.884 -16.745 1.00 0.00 H new ATOM 0 HZ1 LYS A 83 14.498 -8.369 -16.557 1.00 0.00 H new ATOM 0 HZ2 LYS A 83 13.660 -7.034 -17.189 1.00 0.00 H new ATOM 0 HZ3 LYS A 83 14.164 -7.030 -15.568 1.00 0.00 H new ATOM 1319 N ALA A 84 7.315 -9.831 -11.832 1.00 0.00 N ATOM 1320 CA ALA A 84 7.154 -10.436 -10.516 1.00 0.00 C ATOM 1321 C ALA A 84 7.792 -9.573 -9.433 1.00 0.00 C ATOM 1322 O ALA A 84 8.432 -10.085 -8.514 1.00 0.00 O ATOM 1323 CB ALA A 84 7.753 -11.835 -10.501 1.00 0.00 C ATOM 0 H ALA A 84 6.440 -9.658 -12.327 1.00 0.00 H new ATOM 0 HA ALA A 84 6.087 -10.508 -10.305 1.00 0.00 H new ATOM 0 HB1 ALA A 84 7.626 -12.275 -9.512 1.00 0.00 H new ATOM 0 HB2 ALA A 84 7.248 -12.455 -11.242 1.00 0.00 H new ATOM 0 HB3 ALA A 84 8.815 -11.779 -10.739 1.00 0.00 H new ATOM 1329 N VAL A 85 7.613 -8.261 -9.547 1.00 0.00 N ATOM 1330 CA VAL A 85 8.172 -7.327 -8.577 1.00 0.00 C ATOM 1331 C VAL A 85 7.124 -6.318 -8.120 1.00 0.00 C ATOM 1332 O VAL A 85 6.320 -5.838 -8.919 1.00 0.00 O ATOM 1333 CB VAL A 85 9.380 -6.568 -9.158 1.00 0.00 C ATOM 1334 CG1 VAL A 85 8.918 -5.344 -9.935 1.00 0.00 C ATOM 1335 CG2 VAL A 85 10.345 -6.174 -8.051 1.00 0.00 C ATOM 0 H VAL A 85 7.086 -7.821 -10.301 1.00 0.00 H new ATOM 0 HA VAL A 85 8.502 -7.918 -7.723 1.00 0.00 H new ATOM 0 HB VAL A 85 9.905 -7.229 -9.847 1.00 0.00 H new ATOM 0 HG11 VAL A 85 9.785 -4.820 -10.338 1.00 0.00 H new ATOM 0 HG12 VAL A 85 8.270 -5.656 -10.754 1.00 0.00 H new ATOM 0 HG13 VAL A 85 8.368 -4.677 -9.271 1.00 0.00 H new ATOM 0 HG21 VAL A 85 11.192 -5.639 -8.480 1.00 0.00 H new ATOM 0 HG22 VAL A 85 9.834 -5.530 -7.335 1.00 0.00 H new ATOM 0 HG23 VAL A 85 10.702 -7.070 -7.543 1.00 0.00 H new ATOM 1345 N CYS A 86 7.140 -6.000 -6.830 1.00 0.00 N ATOM 1346 CA CYS A 86 6.191 -5.047 -6.266 1.00 0.00 C ATOM 1347 C CYS A 86 6.756 -3.631 -6.300 1.00 0.00 C ATOM 1348 O CYS A 86 7.775 -3.344 -5.671 1.00 0.00 O ATOM 1349 CB CYS A 86 5.841 -5.435 -4.828 1.00 0.00 C ATOM 1350 SG CYS A 86 5.935 -7.211 -4.499 1.00 0.00 S ATOM 0 H CYS A 86 7.799 -6.388 -6.155 1.00 0.00 H new ATOM 0 HA CYS A 86 5.286 -5.072 -6.872 1.00 0.00 H new ATOM 0 HB2 CYS A 86 6.515 -4.914 -4.148 1.00 0.00 H new ATOM 0 HB3 CYS A 86 4.832 -5.088 -4.605 1.00 0.00 H new ATOM 0 HG CYS A 86 4.846 -7.787 -4.913 1.00 0.00 H new ATOM 1356 N CYS A 87 6.089 -2.751 -7.038 1.00 0.00 N ATOM 1357 CA CYS A 87 6.526 -1.365 -7.157 1.00 0.00 C ATOM 1358 C CYS A 87 5.528 -0.421 -6.494 1.00 0.00 C ATOM 1359 O CYS A 87 4.476 -0.117 -7.058 1.00 0.00 O ATOM 1360 CB CYS A 87 6.703 -0.988 -8.628 1.00 0.00 C ATOM 1361 SG CYS A 87 8.310 -1.446 -9.320 1.00 0.00 S ATOM 0 H CYS A 87 5.243 -2.973 -7.563 1.00 0.00 H new ATOM 0 HA CYS A 87 7.484 -1.268 -6.647 1.00 0.00 H new ATOM 0 HB2 CYS A 87 5.918 -1.468 -9.212 1.00 0.00 H new ATOM 0 HB3 CYS A 87 6.567 0.088 -8.735 1.00 0.00 H new ATOM 0 HG CYS A 87 8.538 -0.744 -10.390 1.00 0.00 H new ATOM 1367 N LEU A 88 5.864 0.038 -5.293 1.00 0.00 N ATOM 1368 CA LEU A 88 4.996 0.946 -4.552 1.00 0.00 C ATOM 1369 C LEU A 88 5.280 2.397 -4.926 1.00 0.00 C ATOM 1370 O LEU A 88 6.411 2.869 -4.808 1.00 0.00 O ATOM 1371 CB LEU A 88 5.185 0.749 -3.047 1.00 0.00 C ATOM 1372 CG LEU A 88 4.515 -0.486 -2.442 1.00 0.00 C ATOM 1373 CD1 LEU A 88 5.403 -1.709 -2.607 1.00 0.00 C ATOM 1374 CD2 LEU A 88 4.193 -0.252 -0.973 1.00 0.00 C ATOM 0 H LEU A 88 6.731 -0.204 -4.812 1.00 0.00 H new ATOM 0 HA LEU A 88 3.963 0.718 -4.815 1.00 0.00 H new ATOM 0 HB2 LEU A 88 6.254 0.696 -2.839 1.00 0.00 H new ATOM 0 HB3 LEU A 88 4.804 1.632 -2.535 1.00 0.00 H new ATOM 0 HG LEU A 88 3.581 -0.667 -2.974 1.00 0.00 H new ATOM 0 HD11 LEU A 88 4.910 -2.578 -2.171 1.00 0.00 H new ATOM 0 HD12 LEU A 88 5.583 -1.888 -3.667 1.00 0.00 H new ATOM 0 HD13 LEU A 88 6.354 -1.539 -2.102 1.00 0.00 H new ATOM 0 HD21 LEU A 88 3.717 -1.141 -0.559 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.114 -0.046 -0.427 1.00 0.00 H new ATOM 0 HD23 LEU A 88 3.518 0.598 -0.880 1.00 0.00 H new ATOM 1386 N SER A 89 4.245 3.101 -5.374 1.00 0.00 N ATOM 1387 CA SER A 89 4.384 4.499 -5.767 1.00 0.00 C ATOM 1388 C SER A 89 3.558 5.403 -4.857 1.00 0.00 C ATOM 1389 O SER A 89 2.339 5.262 -4.763 1.00 0.00 O ATOM 1390 CB SER A 89 3.950 4.687 -7.222 1.00 0.00 C ATOM 1391 OG SER A 89 4.673 5.739 -7.837 1.00 0.00 O ATOM 0 H SER A 89 3.301 2.727 -5.474 1.00 0.00 H new ATOM 0 HA SER A 89 5.434 4.776 -5.670 1.00 0.00 H new ATOM 0 HB2 SER A 89 4.108 3.761 -7.775 1.00 0.00 H new ATOM 0 HB3 SER A 89 2.882 4.903 -7.261 1.00 0.00 H new ATOM 0 HG SER A 89 4.379 5.838 -8.767 1.00 0.00 H new ATOM 1397 N VAL A 90 4.232 6.333 -4.187 1.00 0.00 N ATOM 1398 CA VAL A 90 3.563 7.262 -3.285 1.00 0.00 C ATOM 1399 C VAL A 90 3.402 8.634 -3.929 1.00 0.00 C ATOM 1400 O VAL A 90 4.353 9.187 -4.482 1.00 0.00 O ATOM 1401 CB VAL A 90 4.336 7.415 -1.962 1.00 0.00 C ATOM 1402 CG1 VAL A 90 3.514 8.199 -0.950 1.00 0.00 C ATOM 1403 CG2 VAL A 90 4.718 6.051 -1.407 1.00 0.00 C ATOM 0 H VAL A 90 5.242 6.463 -4.252 1.00 0.00 H new ATOM 0 HA VAL A 90 2.578 6.845 -3.075 1.00 0.00 H new ATOM 0 HB VAL A 90 5.252 7.971 -2.160 1.00 0.00 H new ATOM 0 HG11 VAL A 90 4.077 8.297 -0.022 1.00 0.00 H new ATOM 0 HG12 VAL A 90 3.296 9.190 -1.348 1.00 0.00 H new ATOM 0 HG13 VAL A 90 2.580 7.673 -0.754 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.264 6.178 -0.472 1.00 0.00 H new ATOM 0 HG22 VAL A 90 3.816 5.467 -1.224 1.00 0.00 H new ATOM 0 HG23 VAL A 90 5.349 5.529 -2.127 1.00 0.00 H new ATOM 1413 N VAL A 91 2.192 9.179 -3.854 1.00 0.00 N ATOM 1414 CA VAL A 91 1.907 10.489 -4.428 1.00 0.00 C ATOM 1415 C VAL A 91 0.992 11.300 -3.518 1.00 0.00 C ATOM 1416 O VAL A 91 -0.087 10.845 -3.137 1.00 0.00 O ATOM 1417 CB VAL A 91 1.251 10.362 -5.816 1.00 0.00 C ATOM 1418 CG1 VAL A 91 0.896 11.735 -6.367 1.00 0.00 C ATOM 1419 CG2 VAL A 91 2.168 9.615 -6.772 1.00 0.00 C ATOM 0 H VAL A 91 1.394 8.734 -3.402 1.00 0.00 H new ATOM 0 HA VAL A 91 2.862 11.005 -4.531 1.00 0.00 H new ATOM 0 HB VAL A 91 0.329 9.790 -5.712 1.00 0.00 H new ATOM 0 HG11 VAL A 91 0.434 11.625 -7.348 1.00 0.00 H new ATOM 0 HG12 VAL A 91 0.199 12.229 -5.691 1.00 0.00 H new ATOM 0 HG13 VAL A 91 1.801 12.336 -6.458 1.00 0.00 H new ATOM 0 HG21 VAL A 91 1.689 9.534 -7.748 1.00 0.00 H new ATOM 0 HG22 VAL A 91 3.108 10.158 -6.873 1.00 0.00 H new ATOM 0 HG23 VAL A 91 2.366 8.617 -6.381 1.00 0.00 H new ATOM 1429 N LYS A 92 1.429 12.506 -3.172 1.00 0.00 N ATOM 1430 CA LYS A 92 0.650 13.385 -2.307 1.00 0.00 C ATOM 1431 C LYS A 92 -0.283 14.269 -3.129 1.00 0.00 C ATOM 1432 O LYS A 92 0.168 15.084 -3.933 1.00 0.00 O ATOM 1433 CB LYS A 92 1.580 14.255 -1.459 1.00 0.00 C ATOM 1434 CG LYS A 92 0.938 14.763 -0.180 1.00 0.00 C ATOM 1435 CD LYS A 92 1.902 15.618 0.627 1.00 0.00 C ATOM 1436 CE LYS A 92 1.900 17.062 0.148 1.00 0.00 C ATOM 1437 NZ LYS A 92 2.534 17.975 1.139 1.00 0.00 N ATOM 0 H LYS A 92 2.320 12.898 -3.478 1.00 0.00 H new ATOM 0 HA LYS A 92 0.045 12.763 -1.648 1.00 0.00 H new ATOM 0 HB2 LYS A 92 2.471 13.680 -1.205 1.00 0.00 H new ATOM 0 HB3 LYS A 92 1.909 15.107 -2.054 1.00 0.00 H new ATOM 0 HG2 LYS A 92 0.050 15.346 -0.424 1.00 0.00 H new ATOM 0 HG3 LYS A 92 0.608 13.917 0.423 1.00 0.00 H new ATOM 0 HD2 LYS A 92 1.627 15.583 1.681 1.00 0.00 H new ATOM 0 HD3 LYS A 92 2.909 15.208 0.547 1.00 0.00 H new ATOM 0 HE2 LYS A 92 2.431 17.131 -0.801 1.00 0.00 H new ATOM 0 HE3 LYS A 92 0.875 17.382 -0.037 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 2.513 18.949 0.776 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 2.012 17.929 2.037 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 3.520 17.685 1.297 1.00 0.00 H new ATOM 1451 N SER A 93 -1.585 14.103 -2.919 1.00 0.00 N ATOM 1452 CA SER A 93 -2.581 14.885 -3.642 1.00 0.00 C ATOM 1453 C SER A 93 -3.554 15.552 -2.675 1.00 0.00 C ATOM 1454 O SER A 93 -4.073 14.914 -1.760 1.00 0.00 O ATOM 1455 CB SER A 93 -3.347 13.993 -4.621 1.00 0.00 C ATOM 1456 OG SER A 93 -3.979 14.766 -5.627 1.00 0.00 O ATOM 0 H SER A 93 -1.975 13.434 -2.254 1.00 0.00 H new ATOM 0 HA SER A 93 -2.061 15.663 -4.201 1.00 0.00 H new ATOM 0 HB2 SER A 93 -2.662 13.281 -5.081 1.00 0.00 H new ATOM 0 HB3 SER A 93 -4.095 13.412 -4.081 1.00 0.00 H new ATOM 0 HG SER A 93 -4.460 14.173 -6.241 1.00 0.00 H new ATOM 1462 N GLY A 94 -3.797 16.842 -2.886 1.00 0.00 N ATOM 1463 CA GLY A 94 -4.707 17.576 -2.026 1.00 0.00 C ATOM 1464 C GLY A 94 -5.699 18.412 -2.810 1.00 0.00 C ATOM 1465 O GLY A 94 -6.036 18.104 -3.954 1.00 0.00 O ATOM 0 H GLY A 94 -3.380 17.392 -3.637 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -5.249 16.874 -1.393 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -4.133 18.225 -1.364 1.00 0.00 H new ATOM 1469 N PRO A 95 -6.187 19.496 -2.189 1.00 0.00 N ATOM 1470 CA PRO A 95 -7.154 20.400 -2.818 1.00 0.00 C ATOM 1471 C PRO A 95 -6.539 21.208 -3.955 1.00 0.00 C ATOM 1472 O PRO A 95 -5.765 22.137 -3.722 1.00 0.00 O ATOM 1473 CB PRO A 95 -7.572 21.325 -1.671 1.00 0.00 C ATOM 1474 CG PRO A 95 -6.420 21.303 -0.728 1.00 0.00 C ATOM 1475 CD PRO A 95 -5.830 19.923 -0.826 1.00 0.00 C ATOM 0 HA PRO A 95 -7.983 19.857 -3.272 1.00 0.00 H new ATOM 0 HB2 PRO A 95 -7.771 22.335 -2.029 1.00 0.00 H new ATOM 0 HB3 PRO A 95 -8.484 20.972 -1.190 1.00 0.00 H new ATOM 0 HG2 PRO A 95 -5.684 22.062 -0.994 1.00 0.00 H new ATOM 0 HG3 PRO A 95 -6.745 21.517 0.290 1.00 0.00 H new ATOM 0 HD2 PRO A 95 -4.750 19.936 -0.679 1.00 0.00 H new ATOM 0 HD3 PRO A 95 -6.246 19.254 -0.073 1.00 0.00 H new ATOM 1483 N SER A 96 -6.887 20.848 -5.186 1.00 0.00 N ATOM 1484 CA SER A 96 -6.366 21.537 -6.361 1.00 0.00 C ATOM 1485 C SER A 96 -6.800 23.000 -6.370 1.00 0.00 C ATOM 1486 O SER A 96 -5.967 23.906 -6.365 1.00 0.00 O ATOM 1487 CB SER A 96 -6.842 20.844 -7.639 1.00 0.00 C ATOM 1488 OG SER A 96 -6.069 19.688 -7.911 1.00 0.00 O ATOM 0 H SER A 96 -7.528 20.083 -5.396 1.00 0.00 H new ATOM 0 HA SER A 96 -5.277 21.499 -6.320 1.00 0.00 H new ATOM 0 HB2 SER A 96 -7.891 20.568 -7.537 1.00 0.00 H new ATOM 0 HB3 SER A 96 -6.775 21.536 -8.478 1.00 0.00 H new ATOM 0 HG SER A 96 -6.394 19.263 -8.732 1.00 0.00 H new ATOM 1494 N SER A 97 -8.111 23.221 -6.383 1.00 0.00 N ATOM 1495 CA SER A 97 -8.658 24.573 -6.396 1.00 0.00 C ATOM 1496 C SER A 97 -8.352 25.295 -5.088 1.00 0.00 C ATOM 1497 O SER A 97 -8.524 24.739 -4.004 1.00 0.00 O ATOM 1498 CB SER A 97 -10.169 24.532 -6.629 1.00 0.00 C ATOM 1499 OG SER A 97 -10.489 23.744 -7.762 1.00 0.00 O ATOM 0 H SER A 97 -8.814 22.482 -6.385 1.00 0.00 H new ATOM 0 HA SER A 97 -8.187 25.122 -7.212 1.00 0.00 H new ATOM 0 HB2 SER A 97 -10.665 24.126 -5.748 1.00 0.00 H new ATOM 0 HB3 SER A 97 -10.546 25.545 -6.768 1.00 0.00 H new ATOM 0 HG SER A 97 -11.461 23.732 -7.888 1.00 0.00 H new ATOM 1505 N GLY A 98 -7.899 26.540 -5.198 1.00 0.00 N ATOM 1506 CA GLY A 98 -7.576 27.320 -4.017 1.00 0.00 C ATOM 1507 C GLY A 98 -6.083 27.413 -3.773 1.00 0.00 C ATOM 1508 O GLY A 98 -5.601 28.387 -3.195 1.00 0.00 O ATOM 0 H GLY A 98 -7.750 27.023 -6.084 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -7.986 28.324 -4.125 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -8.056 26.872 -3.147 1.00 0.00 H new TER 1512 GLY A 98