USER MOD reduce.3.24.130724 H: found=0, std=0, add=687, rem=0, adj=11 USER MOD reduce.3.24.130724 removed 687 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: p 70 LYS NZ :NH3+ -170:sc= 0 (180deg=0) USER MOD Set 1.2: p 73 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Set 2.1: p 40 ASN : amide:sc= 0.0911 X(o=0.091,f=-0.0032) USER MOD Set 2.2: p 44 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : p 1 MET N :NH3+ -112:sc= 0.0633 (180deg=-0.00273) USER MOD Single : p 2 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 6 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 10 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 11 ASN : amide:sc= -0.155 K(o=-0.16,f=-1.1!) USER MOD Single : p 16 GLN : amide:sc= 0 K(o=0,f=0.93) USER MOD Single : p 20 LYS NZ :NH3+ -179:sc= 0 (180deg=-0.000289) USER MOD Single : p 24 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 30 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 33 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 34 CYS SG : rot 30:sc= 0.0565 USER MOD Single : p 36 CYS SG : rot 180:sc= 0 USER MOD Single : p 41 CYS SG : rot 180:sc= 0 USER MOD Single : p 42 SER OG : rot 180:sc= 0 USER MOD Single : p 43 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 48 TYR OH : rot 180:sc= 0 USER MOD Single : p 49 SER OG : rot 180:sc= 0 USER MOD Single : p 51 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 55 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 56 LYS NZ :NH3+ -176:sc= -0.0122 (180deg=-0.0133) USER MOD Single : p 59 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 61 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 63 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 65 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 68 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 69 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 71 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : p 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 76 LYS NZ :NH3+ 178:sc= 0 (180deg=-0.00497) USER MOD Single : p 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : p 79 GLN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET p 1 -8.864 24.393 3.549 1.00 0.00 N ATOM 2 CA MET p 1 -7.646 24.174 2.724 1.00 0.00 C ATOM 3 C MET p 1 -6.472 23.723 3.591 1.00 0.00 C ATOM 4 O MET p 1 -6.446 23.991 4.795 1.00 0.00 O ATOM 5 CB MET p 1 -7.277 25.456 1.966 1.00 0.00 C ATOM 6 CG MET p 1 -8.209 25.770 0.801 1.00 0.00 C ATOM 7 SD MET p 1 -7.756 27.284 -0.074 1.00 0.00 S ATOM 8 CE MET p 1 -6.426 26.701 -1.126 1.00 0.00 C ATOM 0 H1 MET p 1 -9.576 23.672 3.315 1.00 0.00 H new ATOM 0 H2 MET p 1 -8.618 24.322 4.557 1.00 0.00 H new ATOM 0 H3 MET p 1 -9.251 25.338 3.353 1.00 0.00 H new ATOM 0 HA MET p 1 -7.864 23.386 2.004 1.00 0.00 H new ATOM 0 HB2 MET p 1 -7.286 26.294 2.663 1.00 0.00 H new ATOM 0 HB3 MET p 1 -6.258 25.364 1.590 1.00 0.00 H new ATOM 0 HG2 MET p 1 -8.200 24.935 0.100 1.00 0.00 H new ATOM 0 HG3 MET p 1 -9.229 25.863 1.173 1.00 0.00 H new ATOM 0 HE1 MET p 1 -6.047 27.529 -1.726 1.00 0.00 H new ATOM 0 HE2 MET p 1 -5.621 26.302 -0.508 1.00 0.00 H new ATOM 0 HE3 MET p 1 -6.800 25.917 -1.785 1.00 0.00 H new ATOM 20 N GLN p 2 -5.490 23.041 2.949 1.00 0.00 N ATOM 21 CA GLN p 2 -4.278 22.498 3.561 1.00 0.00 C ATOM 22 C GLN p 2 -4.524 21.612 4.812 1.00 0.00 C ATOM 23 O GLN p 2 -3.583 21.106 5.419 1.00 0.00 O ATOM 24 CB GLN p 2 -3.286 23.642 3.800 1.00 0.00 C ATOM 25 CG GLN p 2 -3.516 24.462 5.065 1.00 0.00 C ATOM 26 CD GLN p 2 -2.228 24.804 5.787 1.00 0.00 C ATOM 27 OE1 GLN p 2 -1.617 25.842 5.531 1.00 0.00 O ATOM 28 NE2 GLN p 2 -1.806 23.931 6.694 1.00 0.00 N ATOM 0 H GLN p 2 -5.535 22.853 1.947 1.00 0.00 H new ATOM 0 HA GLN p 2 -3.838 21.790 2.858 1.00 0.00 H new ATOM 0 HB2 GLN p 2 -2.280 23.224 3.838 1.00 0.00 H new ATOM 0 HB3 GLN p 2 -3.320 24.314 2.942 1.00 0.00 H new ATOM 0 HG2 GLN p 2 -4.037 25.384 4.805 1.00 0.00 H new ATOM 0 HG3 GLN p 2 -4.168 23.906 5.739 1.00 0.00 H new ATOM 0 HE21 GLN p 2 -2.344 23.083 6.875 1.00 0.00 H new ATOM 0 HE22 GLN p 2 -0.944 24.108 7.210 1.00 0.00 H new ATOM 37 N ALA p 3 -5.790 21.472 5.192 1.00 0.00 N ATOM 38 CA ALA p 3 -6.204 20.647 6.325 1.00 0.00 C ATOM 39 C ALA p 3 -6.572 19.254 5.838 1.00 0.00 C ATOM 40 O ALA p 3 -6.244 18.243 6.457 1.00 0.00 O ATOM 41 CB ALA p 3 -7.367 21.295 7.067 1.00 0.00 C ATOM 0 H ALA p 3 -6.567 21.933 4.718 1.00 0.00 H new ATOM 0 HA ALA p 3 -5.373 20.562 7.026 1.00 0.00 H new ATOM 0 HB1 ALA p 3 -7.659 20.664 7.907 1.00 0.00 H new ATOM 0 HB2 ALA p 3 -7.062 22.274 7.437 1.00 0.00 H new ATOM 0 HB3 ALA p 3 -8.212 21.411 6.389 1.00 0.00 H new ATOM 47 N LEU p 4 -7.288 19.266 4.715 1.00 0.00 N ATOM 48 CA LEU p 4 -7.786 18.111 4.018 1.00 0.00 C ATOM 49 C LEU p 4 -6.798 17.747 2.930 1.00 0.00 C ATOM 50 O LEU p 4 -6.349 16.615 2.820 1.00 0.00 O ATOM 51 CB LEU p 4 -9.148 18.476 3.420 1.00 0.00 C ATOM 52 CG LEU p 4 -10.081 17.328 3.045 1.00 0.00 C ATOM 53 CD1 LEU p 4 -11.465 17.895 2.866 1.00 0.00 C ATOM 54 CD2 LEU p 4 -9.625 16.642 1.766 1.00 0.00 C ATOM 0 H LEU p 4 -7.543 20.138 4.252 1.00 0.00 H new ATOM 0 HA LEU p 4 -7.903 17.256 4.684 1.00 0.00 H new ATOM 0 HB2 LEU p 4 -9.669 19.114 4.134 1.00 0.00 H new ATOM 0 HB3 LEU p 4 -8.974 19.074 2.526 1.00 0.00 H new ATOM 0 HG LEU p 4 -10.072 16.578 3.835 1.00 0.00 H new ATOM 0 HD11 LEU p 4 -12.154 17.095 2.597 1.00 0.00 H new ATOM 0 HD12 LEU p 4 -11.792 18.358 3.797 1.00 0.00 H new ATOM 0 HD13 LEU p 4 -11.452 18.644 2.074 1.00 0.00 H new ATOM 0 HD21 LEU p 4 -10.310 15.829 1.525 1.00 0.00 H new ATOM 0 HD22 LEU p 4 -9.617 17.364 0.949 1.00 0.00 H new ATOM 0 HD23 LEU p 4 -8.621 16.241 1.906 1.00 0.00 H new ATOM 66 N GLU p 5 -6.500 18.770 2.121 1.00 0.00 N ATOM 67 CA GLU p 5 -5.551 18.700 0.991 1.00 0.00 C ATOM 68 C GLU p 5 -4.183 18.206 1.440 1.00 0.00 C ATOM 69 O GLU p 5 -3.474 17.552 0.680 1.00 0.00 O ATOM 70 CB GLU p 5 -5.378 20.075 0.328 1.00 0.00 C ATOM 71 CG GLU p 5 -6.639 20.930 0.316 1.00 0.00 C ATOM 72 CD GLU p 5 -7.006 21.416 -1.073 1.00 0.00 C ATOM 73 OE1 GLU p 5 -6.532 22.502 -1.467 1.00 0.00 O ATOM 74 OE2 GLU p 5 -7.766 20.709 -1.768 1.00 0.00 O ATOM 0 H GLU p 5 -6.919 19.693 2.232 1.00 0.00 H new ATOM 0 HA GLU p 5 -5.972 17.995 0.274 1.00 0.00 H new ATOM 0 HB2 GLU p 5 -4.589 20.619 0.848 1.00 0.00 H new ATOM 0 HB3 GLU p 5 -5.042 19.930 -0.699 1.00 0.00 H new ATOM 0 HG2 GLU p 5 -7.468 20.352 0.725 1.00 0.00 H new ATOM 0 HG3 GLU p 5 -6.496 21.790 0.971 1.00 0.00 H new ATOM 81 N LYS p 6 -3.847 18.546 2.679 1.00 0.00 N ATOM 82 CA LYS p 6 -2.582 18.148 3.305 1.00 0.00 C ATOM 83 C LYS p 6 -2.767 16.866 4.103 1.00 0.00 C ATOM 84 O LYS p 6 -1.796 16.259 4.537 1.00 0.00 O ATOM 85 CB LYS p 6 -2.018 19.249 4.205 1.00 0.00 C ATOM 86 CG LYS p 6 -1.303 20.373 3.454 1.00 0.00 C ATOM 87 CD LYS p 6 0.123 19.991 3.045 1.00 0.00 C ATOM 88 CE LYS p 6 1.157 20.479 4.053 1.00 0.00 C ATOM 89 NZ LYS p 6 2.546 20.161 3.621 1.00 0.00 N ATOM 0 H LYS p 6 -4.445 19.109 3.285 1.00 0.00 H new ATOM 0 HA LYS p 6 -1.863 17.975 2.504 1.00 0.00 H new ATOM 0 HB2 LYS p 6 -2.833 19.679 4.788 1.00 0.00 H new ATOM 0 HB3 LYS p 6 -1.321 18.801 4.914 1.00 0.00 H new ATOM 0 HG2 LYS p 6 -1.876 20.632 2.564 1.00 0.00 H new ATOM 0 HG3 LYS p 6 -1.271 21.263 4.083 1.00 0.00 H new ATOM 0 HD2 LYS p 6 0.194 18.908 2.948 1.00 0.00 H new ATOM 0 HD3 LYS p 6 0.345 20.414 2.065 1.00 0.00 H new ATOM 0 HE2 LYS p 6 1.055 21.556 4.185 1.00 0.00 H new ATOM 0 HE3 LYS p 6 0.964 20.020 5.022 1.00 0.00 H new ATOM 0 HZ1 LYS p 6 3.219 20.509 4.333 1.00 0.00 H new ATOM 0 HZ2 LYS p 6 2.651 19.131 3.520 1.00 0.00 H new ATOM 0 HZ3 LYS p 6 2.739 20.620 2.708 1.00 0.00 H new ATOM 103 N GLU p 7 -4.038 16.495 4.302 1.00 0.00 N ATOM 104 CA GLU p 7 -4.436 15.261 4.976 1.00 0.00 C ATOM 105 C GLU p 7 -4.551 14.191 3.892 1.00 0.00 C ATOM 106 O GLU p 7 -4.476 12.991 4.143 1.00 0.00 O ATOM 107 CB GLU p 7 -5.768 15.500 5.694 1.00 0.00 C ATOM 108 CG GLU p 7 -6.683 14.291 5.794 1.00 0.00 C ATOM 109 CD GLU p 7 -6.975 13.888 7.226 1.00 0.00 C ATOM 110 OE1 GLU p 7 -7.958 14.402 7.799 1.00 0.00 O ATOM 111 OE2 GLU p 7 -6.220 13.057 7.774 1.00 0.00 O ATOM 0 H GLU p 7 -4.830 17.057 3.992 1.00 0.00 H new ATOM 0 HA GLU p 7 -3.716 14.940 5.728 1.00 0.00 H new ATOM 0 HB2 GLU p 7 -5.558 15.860 6.701 1.00 0.00 H new ATOM 0 HB3 GLU p 7 -6.302 16.296 5.176 1.00 0.00 H new ATOM 0 HG2 GLU p 7 -7.622 14.509 5.285 1.00 0.00 H new ATOM 0 HG3 GLU p 7 -6.225 13.451 5.272 1.00 0.00 H new ATOM 118 N LEU p 8 -4.744 14.725 2.691 1.00 0.00 N ATOM 119 CA LEU p 8 -4.851 14.018 1.443 1.00 0.00 C ATOM 120 C LEU p 8 -3.455 13.944 0.850 1.00 0.00 C ATOM 121 O LEU p 8 -3.126 13.024 0.113 1.00 0.00 O ATOM 122 CB LEU p 8 -5.817 14.791 0.521 1.00 0.00 C ATOM 123 CG LEU p 8 -5.545 14.716 -0.984 1.00 0.00 C ATOM 124 CD1 LEU p 8 -5.808 13.318 -1.482 1.00 0.00 C ATOM 125 CD2 LEU p 8 -6.386 15.737 -1.726 1.00 0.00 C ATOM 0 H LEU p 8 -4.835 15.733 2.567 1.00 0.00 H new ATOM 0 HA LEU p 8 -5.244 13.009 1.572 1.00 0.00 H new ATOM 0 HB2 LEU p 8 -6.827 14.423 0.702 1.00 0.00 H new ATOM 0 HB3 LEU p 8 -5.802 15.840 0.817 1.00 0.00 H new ATOM 0 HG LEU p 8 -4.498 14.953 -1.173 1.00 0.00 H new ATOM 0 HD11 LEU p 8 -5.613 13.271 -2.553 1.00 0.00 H new ATOM 0 HD12 LEU p 8 -5.154 12.618 -0.963 1.00 0.00 H new ATOM 0 HD13 LEU p 8 -6.848 13.053 -1.291 1.00 0.00 H new ATOM 0 HD21 LEU p 8 -6.180 15.670 -2.794 1.00 0.00 H new ATOM 0 HD22 LEU p 8 -7.442 15.538 -1.547 1.00 0.00 H new ATOM 0 HD23 LEU p 8 -6.140 16.738 -1.371 1.00 0.00 H new ATOM 137 N ALA p 9 -2.689 14.992 1.167 1.00 0.00 N ATOM 138 CA ALA p 9 -1.277 15.113 0.789 1.00 0.00 C ATOM 139 C ALA p 9 -0.463 14.327 1.803 1.00 0.00 C ATOM 140 O ALA p 9 0.684 13.941 1.556 1.00 0.00 O ATOM 141 CB ALA p 9 -0.802 16.557 0.729 1.00 0.00 C ATOM 0 H ALA p 9 -3.036 15.790 1.700 1.00 0.00 H new ATOM 0 HA ALA p 9 -1.147 14.716 -0.218 1.00 0.00 H new ATOM 0 HB1 ALA p 9 0.250 16.582 0.444 1.00 0.00 H new ATOM 0 HB2 ALA p 9 -1.391 17.103 -0.008 1.00 0.00 H new ATOM 0 HB3 ALA p 9 -0.924 17.021 1.708 1.00 0.00 H new ATOM 147 N GLN p 10 -1.111 14.111 2.959 1.00 0.00 N ATOM 148 CA GLN p 10 -0.577 13.318 4.046 1.00 0.00 C ATOM 149 C GLN p 10 -1.035 11.896 3.796 1.00 0.00 C ATOM 150 O GLN p 10 -0.368 10.950 4.171 1.00 0.00 O ATOM 151 CB GLN p 10 -1.077 13.859 5.390 1.00 0.00 C ATOM 152 CG GLN p 10 -1.301 12.822 6.481 1.00 0.00 C ATOM 153 CD GLN p 10 -0.323 12.955 7.630 1.00 0.00 C ATOM 154 OE1 GLN p 10 -0.576 13.674 8.597 1.00 0.00 O ATOM 155 NE2 GLN p 10 0.804 12.259 7.531 1.00 0.00 N ATOM 0 H GLN p 10 -2.036 14.495 3.155 1.00 0.00 H new ATOM 0 HA GLN p 10 0.511 13.359 4.089 1.00 0.00 H new ATOM 0 HB2 GLN p 10 -0.358 14.593 5.755 1.00 0.00 H new ATOM 0 HB3 GLN p 10 -2.015 14.389 5.221 1.00 0.00 H new ATOM 0 HG2 GLN p 10 -2.317 12.917 6.863 1.00 0.00 H new ATOM 0 HG3 GLN p 10 -1.214 11.824 6.050 1.00 0.00 H new ATOM 0 HE21 GLN p 10 0.973 11.675 6.712 1.00 0.00 H new ATOM 0 HE22 GLN p 10 1.501 12.308 8.274 1.00 0.00 H new ATOM 164 N ASN p 11 -2.200 11.814 3.133 1.00 0.00 N ATOM 165 CA ASN p 11 -2.825 10.557 2.703 1.00 0.00 C ATOM 166 C ASN p 11 -2.141 10.144 1.422 1.00 0.00 C ATOM 167 O ASN p 11 -2.196 8.988 1.005 1.00 0.00 O ATOM 168 CB ASN p 11 -4.332 10.707 2.466 1.00 0.00 C ATOM 169 CG ASN p 11 -5.105 9.415 2.699 1.00 0.00 C ATOM 170 OD1 ASN p 11 -4.773 8.619 3.581 1.00 0.00 O ATOM 171 ND2 ASN p 11 -6.146 9.202 1.903 1.00 0.00 N ATOM 0 H ASN p 11 -2.743 12.638 2.877 1.00 0.00 H new ATOM 0 HA ASN p 11 -2.710 9.807 3.486 1.00 0.00 H new ATOM 0 HB2 ASN p 11 -4.722 11.481 3.127 1.00 0.00 H new ATOM 0 HB3 ASN p 11 -4.501 11.045 1.444 1.00 0.00 H new ATOM 0 HD21 ASN p 11 -6.704 8.355 2.009 1.00 0.00 H new ATOM 0 HD22 ASN p 11 -6.388 9.885 1.185 1.00 0.00 H new ATOM 178 N GLU p 12 -1.510 11.158 0.808 1.00 0.00 N ATOM 179 CA GLU p 12 -0.711 11.030 -0.361 1.00 0.00 C ATOM 180 C GLU p 12 0.644 10.586 0.130 1.00 0.00 C ATOM 181 O GLU p 12 1.356 9.851 -0.524 1.00 0.00 O ATOM 182 CB GLU p 12 -0.613 12.393 -0.991 1.00 0.00 C ATOM 183 CG GLU p 12 0.188 12.422 -2.246 1.00 0.00 C ATOM 184 CD GLU p 12 -0.611 12.837 -3.465 1.00 0.00 C ATOM 185 OE1 GLU p 12 -0.672 14.051 -3.751 1.00 0.00 O ATOM 186 OE2 GLU p 12 -1.174 11.946 -4.137 1.00 0.00 O ATOM 0 H GLU p 12 -1.563 12.118 1.149 1.00 0.00 H new ATOM 0 HA GLU p 12 -1.113 10.328 -1.091 1.00 0.00 H new ATOM 0 HB2 GLU p 12 -1.618 12.757 -1.205 1.00 0.00 H new ATOM 0 HB3 GLU p 12 -0.170 13.083 -0.273 1.00 0.00 H new ATOM 0 HG2 GLU p 12 1.024 13.110 -2.118 1.00 0.00 H new ATOM 0 HG3 GLU p 12 0.613 11.433 -2.419 1.00 0.00 H new ATOM 193 N TRP p 13 0.939 11.122 1.311 1.00 0.00 N ATOM 194 CA TRP p 13 2.147 10.830 2.084 1.00 0.00 C ATOM 195 C TRP p 13 1.961 9.501 2.805 1.00 0.00 C ATOM 196 O TRP p 13 2.926 8.900 3.260 1.00 0.00 O ATOM 197 CB TRP p 13 2.453 11.948 3.083 1.00 0.00 C ATOM 198 CG TRP p 13 3.914 12.064 3.424 1.00 0.00 C ATOM 199 CD1 TRP p 13 4.539 11.541 4.519 1.00 0.00 C ATOM 200 CD2 TRP p 13 4.930 12.744 2.669 1.00 0.00 C ATOM 201 NE1 TRP p 13 5.877 11.851 4.494 1.00 0.00 N ATOM 202 CE2 TRP p 13 6.142 12.588 3.370 1.00 0.00 C ATOM 203 CE3 TRP p 13 4.936 13.469 1.470 1.00 0.00 C ATOM 204 CZ2 TRP p 13 7.342 13.128 2.914 1.00 0.00 C ATOM 205 CZ3 TRP p 13 6.129 14.003 1.019 1.00 0.00 C ATOM 206 CH2 TRP p 13 7.316 13.830 1.740 1.00 0.00 C ATOM 0 H TRP p 13 0.326 11.793 1.773 1.00 0.00 H new ATOM 0 HA TRP p 13 2.997 10.764 1.404 1.00 0.00 H new ATOM 0 HB2 TRP p 13 2.107 12.897 2.672 1.00 0.00 H new ATOM 0 HB3 TRP p 13 1.887 11.772 3.998 1.00 0.00 H new ATOM 0 HD1 TRP p 13 4.052 10.967 5.293 1.00 0.00 H new ATOM 0 HE1 TRP p 13 6.562 11.577 5.198 1.00 0.00 H new ATOM 0 HE3 TRP p 13 4.024 13.608 0.908 1.00 0.00 H new ATOM 0 HZ2 TRP p 13 8.260 12.997 3.467 1.00 0.00 H new ATOM 0 HZ3 TRP p 13 6.145 14.563 0.095 1.00 0.00 H new ATOM 0 HH2 TRP p 13 8.231 14.260 1.361 1.00 0.00 H new ATOM 217 N GLU p 14 0.682 9.096 2.933 1.00 0.00 N ATOM 218 CA GLU p 14 0.299 7.783 3.497 1.00 0.00 C ATOM 219 C GLU p 14 0.233 6.853 2.330 1.00 0.00 C ATOM 220 O GLU p 14 0.234 5.632 2.457 1.00 0.00 O ATOM 221 CB GLU p 14 -1.049 7.786 4.204 1.00 0.00 C ATOM 222 CG GLU p 14 -1.123 8.821 5.283 1.00 0.00 C ATOM 223 CD GLU p 14 -1.750 8.313 6.566 1.00 0.00 C ATOM 224 OE1 GLU p 14 -1.006 7.799 7.428 1.00 0.00 O ATOM 225 OE2 GLU p 14 -2.985 8.428 6.709 1.00 0.00 O ATOM 0 H GLU p 14 -0.114 9.667 2.650 1.00 0.00 H new ATOM 0 HA GLU p 14 1.027 7.493 4.255 1.00 0.00 H new ATOM 0 HB2 GLU p 14 -1.839 7.968 3.475 1.00 0.00 H new ATOM 0 HB3 GLU p 14 -1.233 6.802 4.635 1.00 0.00 H new ATOM 0 HG2 GLU p 14 -0.118 9.183 5.498 1.00 0.00 H new ATOM 0 HG3 GLU p 14 -1.698 9.673 4.920 1.00 0.00 H new ATOM 232 N LEU p 15 0.120 7.523 1.186 1.00 0.00 N ATOM 233 CA LEU p 15 0.124 6.907 -0.129 1.00 0.00 C ATOM 234 C LEU p 15 1.585 6.741 -0.540 1.00 0.00 C ATOM 235 O LEU p 15 1.941 5.799 -1.228 1.00 0.00 O ATOM 236 CB LEU p 15 -0.653 7.766 -1.151 1.00 0.00 C ATOM 237 CG LEU p 15 -0.826 7.208 -2.581 1.00 0.00 C ATOM 238 CD1 LEU p 15 0.277 7.742 -3.478 1.00 0.00 C ATOM 239 CD2 LEU p 15 -0.825 5.690 -2.589 1.00 0.00 C ATOM 0 H LEU p 15 0.021 8.538 1.152 1.00 0.00 H new ATOM 0 HA LEU p 15 -0.377 5.939 -0.101 1.00 0.00 H new ATOM 0 HB2 LEU p 15 -1.646 7.954 -0.743 1.00 0.00 H new ATOM 0 HB3 LEU p 15 -0.151 8.731 -1.227 1.00 0.00 H new ATOM 0 HG LEU p 15 -1.793 7.539 -2.961 1.00 0.00 H new ATOM 0 HD11 LEU p 15 0.151 7.346 -4.485 1.00 0.00 H new ATOM 0 HD12 LEU p 15 0.227 8.830 -3.507 1.00 0.00 H new ATOM 0 HD13 LEU p 15 1.246 7.434 -3.086 1.00 0.00 H new ATOM 0 HD21 LEU p 15 -0.949 5.331 -3.611 1.00 0.00 H new ATOM 0 HD22 LEU p 15 0.121 5.325 -2.188 1.00 0.00 H new ATOM 0 HD23 LEU p 15 -1.646 5.322 -1.974 1.00 0.00 H new ATOM 251 N GLN p 16 2.392 7.698 -0.060 1.00 0.00 N ATOM 252 CA GLN p 16 3.859 7.744 -0.244 1.00 0.00 C ATOM 253 C GLN p 16 4.437 6.855 0.802 1.00 0.00 C ATOM 254 O GLN p 16 5.540 6.344 0.678 1.00 0.00 O ATOM 255 CB GLN p 16 4.433 9.146 -0.060 1.00 0.00 C ATOM 256 CG GLN p 16 3.840 10.146 -1.009 1.00 0.00 C ATOM 257 CD GLN p 16 4.880 10.907 -1.806 1.00 0.00 C ATOM 258 OE1 GLN p 16 5.352 11.963 -1.384 1.00 0.00 O ATOM 259 NE2 GLN p 16 5.242 10.374 -2.967 1.00 0.00 N ATOM 0 H GLN p 16 2.037 8.486 0.483 1.00 0.00 H new ATOM 0 HA GLN p 16 4.103 7.432 -1.260 1.00 0.00 H new ATOM 0 HB2 GLN p 16 4.256 9.475 0.964 1.00 0.00 H new ATOM 0 HB3 GLN p 16 5.513 9.113 -0.202 1.00 0.00 H new ATOM 0 HG2 GLN p 16 3.171 9.630 -1.698 1.00 0.00 H new ATOM 0 HG3 GLN p 16 3.233 10.855 -0.446 1.00 0.00 H new ATOM 0 HE21 GLN p 16 4.825 9.497 -3.278 1.00 0.00 H new ATOM 0 HE22 GLN p 16 5.938 10.842 -3.548 1.00 0.00 H new ATOM 268 N ALA p 17 3.646 6.765 1.865 1.00 0.00 N ATOM 269 CA ALA p 17 3.908 5.876 2.998 1.00 0.00 C ATOM 270 C ALA p 17 3.350 4.518 2.627 1.00 0.00 C ATOM 271 O ALA p 17 3.658 3.514 3.258 1.00 0.00 O ATOM 272 CB ALA p 17 3.301 6.365 4.303 1.00 0.00 C ATOM 0 H ALA p 17 2.792 7.314 1.969 1.00 0.00 H new ATOM 0 HA ALA p 17 4.982 5.839 3.180 1.00 0.00 H new ATOM 0 HB1 ALA p 17 3.534 5.659 5.100 1.00 0.00 H new ATOM 0 HB2 ALA p 17 3.714 7.343 4.552 1.00 0.00 H new ATOM 0 HB3 ALA p 17 2.219 6.445 4.194 1.00 0.00 H new ATOM 278 N LEU p 18 2.479 4.548 1.595 1.00 0.00 N ATOM 279 CA LEU p 18 1.899 3.359 0.993 1.00 0.00 C ATOM 280 C LEU p 18 2.842 2.928 -0.122 1.00 0.00 C ATOM 281 O LEU p 18 2.906 1.759 -0.489 1.00 0.00 O ATOM 282 CB LEU p 18 0.487 3.631 0.440 1.00 0.00 C ATOM 283 CG LEU p 18 -0.314 2.425 -0.096 1.00 0.00 C ATOM 284 CD1 LEU p 18 -0.130 2.310 -1.597 1.00 0.00 C ATOM 285 CD2 LEU p 18 0.110 1.136 0.586 1.00 0.00 C ATOM 0 H LEU p 18 2.164 5.416 1.162 1.00 0.00 H new ATOM 0 HA LEU p 18 1.787 2.574 1.740 1.00 0.00 H new ATOM 0 HB2 LEU p 18 -0.099 4.099 1.231 1.00 0.00 H new ATOM 0 HB3 LEU p 18 0.576 4.360 -0.365 1.00 0.00 H new ATOM 0 HG LEU p 18 -1.368 2.589 0.126 1.00 0.00 H new ATOM 0 HD11 LEU p 18 -0.698 1.457 -1.969 1.00 0.00 H new ATOM 0 HD12 LEU p 18 -0.486 3.221 -2.078 1.00 0.00 H new ATOM 0 HD13 LEU p 18 0.927 2.169 -1.824 1.00 0.00 H new ATOM 0 HD21 LEU p 18 -0.472 0.305 0.187 1.00 0.00 H new ATOM 0 HD22 LEU p 18 1.170 0.958 0.402 1.00 0.00 H new ATOM 0 HD23 LEU p 18 -0.063 1.218 1.659 1.00 0.00 H new ATOM 297 N GLU p 19 3.549 3.935 -0.652 1.00 0.00 N ATOM 298 CA GLU p 19 4.589 3.745 -1.686 1.00 0.00 C ATOM 299 C GLU p 19 5.845 3.373 -0.954 1.00 0.00 C ATOM 300 O GLU p 19 6.727 2.714 -1.483 1.00 0.00 O ATOM 301 CB GLU p 19 4.872 4.996 -2.516 1.00 0.00 C ATOM 302 CG GLU p 19 3.646 5.570 -3.172 1.00 0.00 C ATOM 303 CD GLU p 19 3.755 5.641 -4.683 1.00 0.00 C ATOM 304 OE1 GLU p 19 3.383 4.654 -5.353 1.00 0.00 O ATOM 305 OE2 GLU p 19 4.210 6.684 -5.197 1.00 0.00 O ATOM 0 H GLU p 19 3.419 4.909 -0.379 1.00 0.00 H new ATOM 0 HA GLU p 19 4.242 2.985 -2.386 1.00 0.00 H new ATOM 0 HB2 GLU p 19 5.320 5.755 -1.874 1.00 0.00 H new ATOM 0 HB3 GLU p 19 5.606 4.754 -3.284 1.00 0.00 H new ATOM 0 HG2 GLU p 19 2.781 4.963 -2.905 1.00 0.00 H new ATOM 0 HG3 GLU p 19 3.467 6.571 -2.780 1.00 0.00 H new ATOM 312 N LYS p 20 5.893 3.904 0.268 1.00 0.00 N ATOM 313 CA LYS p 20 6.963 3.638 1.235 1.00 0.00 C ATOM 314 C LYS p 20 6.667 2.336 1.966 1.00 0.00 C ATOM 315 O LYS p 20 7.555 1.726 2.561 1.00 0.00 O ATOM 316 CB LYS p 20 7.090 4.779 2.231 1.00 0.00 C ATOM 317 CG LYS p 20 8.471 5.407 2.287 1.00 0.00 C ATOM 318 CD LYS p 20 9.212 5.021 3.559 1.00 0.00 C ATOM 319 CE LYS p 20 10.598 5.648 3.616 1.00 0.00 C ATOM 320 NZ LYS p 20 11.546 5.012 2.658 1.00 0.00 N ATOM 0 H LYS p 20 5.179 4.541 0.621 1.00 0.00 H new ATOM 0 HA LYS p 20 7.908 3.552 0.699 1.00 0.00 H new ATOM 0 HB2 LYS p 20 6.363 5.550 1.977 1.00 0.00 H new ATOM 0 HB3 LYS p 20 6.831 4.410 3.223 1.00 0.00 H new ATOM 0 HG2 LYS p 20 9.050 5.092 1.419 1.00 0.00 H new ATOM 0 HG3 LYS p 20 8.380 6.492 2.233 1.00 0.00 H new ATOM 0 HD2 LYS p 20 8.634 5.337 4.427 1.00 0.00 H new ATOM 0 HD3 LYS p 20 9.301 3.936 3.613 1.00 0.00 H new ATOM 0 HE2 LYS p 20 10.522 6.713 3.396 1.00 0.00 H new ATOM 0 HE3 LYS p 20 10.993 5.559 4.628 1.00 0.00 H new ATOM 0 HZ1 LYS p 20 12.480 5.460 2.745 1.00 0.00 H new ATOM 0 HZ2 LYS p 20 11.627 3.998 2.872 1.00 0.00 H new ATOM 0 HZ3 LYS p 20 11.193 5.134 1.687 1.00 0.00 H new ATOM 334 N GLU p 21 5.383 1.943 1.910 1.00 0.00 N ATOM 335 CA GLU p 21 4.892 0.695 2.457 1.00 0.00 C ATOM 336 C GLU p 21 5.085 -0.299 1.334 1.00 0.00 C ATOM 337 O GLU p 21 5.296 -1.498 1.542 1.00 0.00 O ATOM 338 CB GLU p 21 3.425 0.837 2.871 1.00 0.00 C ATOM 339 CG GLU p 21 2.608 -0.438 2.810 1.00 0.00 C ATOM 340 CD GLU p 21 2.239 -0.972 4.180 1.00 0.00 C ATOM 341 OE1 GLU p 21 1.173 -0.583 4.702 1.00 0.00 O ATOM 342 OE2 GLU p 21 3.018 -1.778 4.732 1.00 0.00 O ATOM 0 H GLU p 21 4.653 2.505 1.472 1.00 0.00 H new ATOM 0 HA GLU p 21 5.414 0.379 3.360 1.00 0.00 H new ATOM 0 HB2 GLU p 21 3.388 1.224 3.889 1.00 0.00 H new ATOM 0 HB3 GLU p 21 2.954 1.582 2.229 1.00 0.00 H new ATOM 0 HG2 GLU p 21 1.697 -0.252 2.241 1.00 0.00 H new ATOM 0 HG3 GLU p 21 3.172 -1.198 2.270 1.00 0.00 H new ATOM 349 N LEU p 22 4.984 0.269 0.123 1.00 0.00 N ATOM 350 CA LEU p 22 5.254 -0.451 -1.114 1.00 0.00 C ATOM 351 C LEU p 22 6.742 -0.631 -1.177 1.00 0.00 C ATOM 352 O LEU p 22 7.258 -1.721 -1.404 1.00 0.00 O ATOM 353 CB LEU p 22 4.805 0.373 -2.309 1.00 0.00 C ATOM 354 CG LEU p 22 3.788 -0.261 -3.236 1.00 0.00 C ATOM 355 CD1 LEU p 22 2.444 -0.354 -2.545 1.00 0.00 C ATOM 356 CD2 LEU p 22 3.701 0.579 -4.487 1.00 0.00 C ATOM 0 H LEU p 22 4.712 1.242 -0.018 1.00 0.00 H new ATOM 0 HA LEU p 22 4.723 -1.403 -1.136 1.00 0.00 H new ATOM 0 HB2 LEU p 22 4.388 1.309 -1.938 1.00 0.00 H new ATOM 0 HB3 LEU p 22 5.687 0.627 -2.896 1.00 0.00 H new ATOM 0 HG LEU p 22 4.092 -1.274 -3.501 1.00 0.00 H new ATOM 0 HD11 LEU p 22 1.719 -0.811 -3.219 1.00 0.00 H new ATOM 0 HD12 LEU p 22 2.538 -0.963 -1.646 1.00 0.00 H new ATOM 0 HD13 LEU p 22 2.105 0.645 -2.272 1.00 0.00 H new ATOM 0 HD21 LEU p 22 2.973 0.140 -5.170 1.00 0.00 H new ATOM 0 HD22 LEU p 22 3.389 1.590 -4.225 1.00 0.00 H new ATOM 0 HD23 LEU p 22 4.677 0.614 -4.970 1.00 0.00 H new ATOM 368 N ALA p 23 7.407 0.496 -0.902 1.00 0.00 N ATOM 369 CA ALA p 23 8.878 0.559 -0.842 1.00 0.00 C ATOM 370 C ALA p 23 9.400 -0.241 0.352 1.00 0.00 C ATOM 371 O ALA p 23 10.594 -0.505 0.448 1.00 0.00 O ATOM 372 CB ALA p 23 9.385 1.993 -0.773 1.00 0.00 C ATOM 0 H ALA p 23 6.948 1.387 -0.715 1.00 0.00 H new ATOM 0 HA ALA p 23 9.258 0.118 -1.764 1.00 0.00 H new ATOM 0 HB1 ALA p 23 10.474 1.992 -0.730 1.00 0.00 H new ATOM 0 HB2 ALA p 23 9.057 2.538 -1.658 1.00 0.00 H new ATOM 0 HB3 ALA p 23 8.987 2.477 0.119 1.00 0.00 H new ATOM 378 N GLN p 24 8.468 -0.607 1.251 1.00 0.00 N ATOM 379 CA GLN p 24 8.730 -1.404 2.435 1.00 0.00 C ATOM 380 C GLN p 24 8.703 -2.893 2.064 1.00 0.00 C ATOM 381 O GLN p 24 9.328 -3.723 2.712 1.00 0.00 O ATOM 382 CB GLN p 24 7.642 -1.078 3.453 1.00 0.00 C ATOM 383 CG GLN p 24 7.507 -2.082 4.563 1.00 0.00 C ATOM 384 CD GLN p 24 7.544 -1.458 5.945 1.00 0.00 C ATOM 385 OE1 GLN p 24 8.610 -1.298 6.538 1.00 0.00 O ATOM 386 NE2 GLN p 24 6.375 -1.102 6.465 1.00 0.00 N ATOM 0 H GLN p 24 7.487 -0.342 1.159 1.00 0.00 H new ATOM 0 HA GLN p 24 9.711 -1.181 2.855 1.00 0.00 H new ATOM 0 HB2 GLN p 24 7.850 -0.100 3.888 1.00 0.00 H new ATOM 0 HB3 GLN p 24 6.687 -0.999 2.933 1.00 0.00 H new ATOM 0 HG2 GLN p 24 6.569 -2.623 4.442 1.00 0.00 H new ATOM 0 HG3 GLN p 24 8.310 -2.814 4.481 1.00 0.00 H new ATOM 0 HE21 GLN p 24 5.515 -1.253 5.938 1.00 0.00 H new ATOM 0 HE22 GLN p 24 6.337 -0.677 7.392 1.00 0.00 H new ATOM 395 N LEU p 25 7.968 -3.162 0.989 1.00 0.00 N ATOM 396 CA LEU p 25 7.758 -4.471 0.401 1.00 0.00 C ATOM 397 C LEU p 25 8.902 -4.726 -0.546 1.00 0.00 C ATOM 398 O LEU p 25 9.452 -5.803 -0.579 1.00 0.00 O ATOM 399 CB LEU p 25 6.424 -4.444 -0.350 1.00 0.00 C ATOM 400 CG LEU p 25 5.723 -5.775 -0.615 1.00 0.00 C ATOM 401 CD1 LEU p 25 4.353 -5.472 -1.171 1.00 0.00 C ATOM 402 CD2 LEU p 25 6.506 -6.628 -1.599 1.00 0.00 C ATOM 0 H LEU p 25 7.477 -2.427 0.480 1.00 0.00 H new ATOM 0 HA LEU p 25 7.724 -5.261 1.151 1.00 0.00 H new ATOM 0 HB2 LEU p 25 5.737 -3.811 0.212 1.00 0.00 H new ATOM 0 HB3 LEU p 25 6.592 -3.958 -1.311 1.00 0.00 H new ATOM 0 HG LEU p 25 5.650 -6.339 0.315 1.00 0.00 H new ATOM 0 HD11 LEU p 25 3.827 -6.405 -1.371 1.00 0.00 H new ATOM 0 HD12 LEU p 25 3.788 -4.885 -0.447 1.00 0.00 H new ATOM 0 HD13 LEU p 25 4.453 -4.907 -2.097 1.00 0.00 H new ATOM 0 HD21 LEU p 25 5.979 -7.568 -1.765 1.00 0.00 H new ATOM 0 HD22 LEU p 25 6.604 -6.095 -2.545 1.00 0.00 H new ATOM 0 HD23 LEU p 25 7.497 -6.834 -1.194 1.00 0.00 H new ATOM 414 N GLU p 26 9.186 -3.691 -1.339 1.00 0.00 N ATOM 415 CA GLU p 26 10.316 -3.621 -2.263 1.00 0.00 C ATOM 416 C GLU p 26 11.573 -3.537 -1.422 1.00 0.00 C ATOM 417 O GLU p 26 12.683 -3.763 -1.871 1.00 0.00 O ATOM 418 CB GLU p 26 10.204 -2.393 -3.161 1.00 0.00 C ATOM 419 CG GLU p 26 8.809 -2.159 -3.703 1.00 0.00 C ATOM 420 CD GLU p 26 8.781 -1.945 -5.204 1.00 0.00 C ATOM 421 OE1 GLU p 26 8.900 -0.781 -5.641 1.00 0.00 O ATOM 422 OE2 GLU p 26 8.641 -2.943 -5.943 1.00 0.00 O ATOM 0 H GLU p 26 8.613 -2.848 -1.355 1.00 0.00 H new ATOM 0 HA GLU p 26 10.334 -4.498 -2.910 1.00 0.00 H new ATOM 0 HB2 GLU p 26 10.518 -1.513 -2.599 1.00 0.00 H new ATOM 0 HB3 GLU p 26 10.895 -2.501 -3.997 1.00 0.00 H new ATOM 0 HG2 GLU p 26 8.180 -3.013 -3.452 1.00 0.00 H new ATOM 0 HG3 GLU p 26 8.376 -1.289 -3.210 1.00 0.00 H new ATOM 429 N LYS p 27 11.348 -3.111 -0.191 1.00 0.00 N ATOM 430 CA LYS p 27 12.398 -3.097 0.837 1.00 0.00 C ATOM 431 C LYS p 27 12.583 -4.535 1.294 1.00 0.00 C ATOM 432 O LYS p 27 13.649 -4.938 1.763 1.00 0.00 O ATOM 433 CB LYS p 27 12.029 -2.221 2.028 1.00 0.00 C ATOM 434 CG LYS p 27 12.959 -1.036 2.247 1.00 0.00 C ATOM 435 CD LYS p 27 13.946 -1.298 3.375 1.00 0.00 C ATOM 436 CE LYS p 27 14.846 -0.099 3.620 1.00 0.00 C ATOM 437 NZ LYS p 27 15.779 -0.328 4.758 1.00 0.00 N ATOM 0 H LYS p 27 10.444 -2.766 0.131 1.00 0.00 H new ATOM 0 HA LYS p 27 13.313 -2.680 0.417 1.00 0.00 H new ATOM 0 HB2 LYS p 27 11.013 -1.850 1.890 1.00 0.00 H new ATOM 0 HB3 LYS p 27 12.025 -2.835 2.928 1.00 0.00 H new ATOM 0 HG2 LYS p 27 13.505 -0.826 1.327 1.00 0.00 H new ATOM 0 HG3 LYS p 27 12.370 -0.148 2.477 1.00 0.00 H new ATOM 0 HD2 LYS p 27 13.401 -1.537 4.288 1.00 0.00 H new ATOM 0 HD3 LYS p 27 14.556 -2.168 3.131 1.00 0.00 H new ATOM 0 HE2 LYS p 27 15.419 0.115 2.718 1.00 0.00 H new ATOM 0 HE3 LYS p 27 14.233 0.779 3.824 1.00 0.00 H new ATOM 0 HZ1 LYS p 27 16.376 0.513 4.892 1.00 0.00 H new ATOM 0 HZ2 LYS p 27 15.232 -0.507 5.624 1.00 0.00 H new ATOM 0 HZ3 LYS p 27 16.382 -1.150 4.553 1.00 0.00 H new ATOM 451 N GLU p 28 11.484 -5.286 1.153 1.00 0.00 N ATOM 452 CA GLU p 28 11.471 -6.729 1.451 1.00 0.00 C ATOM 453 C GLU p 28 11.719 -7.503 0.169 1.00 0.00 C ATOM 454 O GLU p 28 12.410 -8.524 0.152 1.00 0.00 O ATOM 455 CB GLU p 28 10.128 -7.186 2.031 1.00 0.00 C ATOM 456 CG GLU p 28 9.659 -6.367 3.202 1.00 0.00 C ATOM 457 CD GLU p 28 9.613 -7.151 4.499 1.00 0.00 C ATOM 458 OE1 GLU p 28 10.635 -7.175 5.215 1.00 0.00 O ATOM 459 OE2 GLU p 28 8.553 -7.741 4.798 1.00 0.00 O ATOM 0 H GLU p 28 10.587 -4.919 0.833 1.00 0.00 H new ATOM 0 HA GLU p 28 12.250 -6.918 2.190 1.00 0.00 H new ATOM 0 HB2 GLU p 28 9.372 -7.146 1.247 1.00 0.00 H new ATOM 0 HB3 GLU p 28 10.212 -8.228 2.340 1.00 0.00 H new ATOM 0 HG2 GLU p 28 10.321 -5.510 3.326 1.00 0.00 H new ATOM 0 HG3 GLU p 28 8.665 -5.974 2.987 1.00 0.00 H new ATOM 466 N LEU p 29 11.123 -6.975 -0.896 1.00 0.00 N ATOM 467 CA LEU p 29 11.199 -7.556 -2.231 1.00 0.00 C ATOM 468 C LEU p 29 12.479 -7.215 -2.978 1.00 0.00 C ATOM 469 O LEU p 29 13.193 -8.109 -3.439 1.00 0.00 O ATOM 470 CB LEU p 29 10.012 -7.068 -3.067 1.00 0.00 C ATOM 471 CG LEU p 29 9.210 -8.120 -3.824 1.00 0.00 C ATOM 472 CD1 LEU p 29 8.099 -7.423 -4.580 1.00 0.00 C ATOM 473 CD2 LEU p 29 10.101 -8.895 -4.781 1.00 0.00 C ATOM 0 H LEU p 29 10.567 -6.121 -0.855 1.00 0.00 H new ATOM 0 HA LEU p 29 11.182 -8.637 -2.092 1.00 0.00 H new ATOM 0 HB2 LEU p 29 9.329 -6.536 -2.405 1.00 0.00 H new ATOM 0 HB3 LEU p 29 10.385 -6.343 -3.791 1.00 0.00 H new ATOM 0 HG LEU p 29 8.788 -8.835 -3.118 1.00 0.00 H new ATOM 0 HD11 LEU p 29 7.514 -8.161 -5.129 1.00 0.00 H new ATOM 0 HD12 LEU p 29 7.453 -6.898 -3.876 1.00 0.00 H new ATOM 0 HD13 LEU p 29 8.529 -6.707 -5.281 1.00 0.00 H new ATOM 0 HD21 LEU p 29 9.506 -9.640 -5.310 1.00 0.00 H new ATOM 0 HD22 LEU p 29 10.546 -8.208 -5.501 1.00 0.00 H new ATOM 0 HD23 LEU p 29 10.891 -9.394 -4.220 1.00 0.00 H new ATOM 485 N GLN p 30 12.758 -5.920 -3.090 1.00 0.00 N ATOM 486 CA GLN p 30 13.929 -5.449 -3.859 1.00 0.00 C ATOM 487 C GLN p 30 15.222 -5.373 -3.039 1.00 0.00 C ATOM 488 O GLN p 30 16.283 -5.805 -3.499 1.00 0.00 O ATOM 489 CB GLN p 30 13.576 -4.100 -4.523 1.00 0.00 C ATOM 490 CG GLN p 30 14.686 -3.055 -4.548 1.00 0.00 C ATOM 491 CD GLN p 30 15.226 -2.807 -5.943 1.00 0.00 C ATOM 492 OE1 GLN p 30 16.172 -3.462 -6.380 1.00 0.00 O ATOM 493 NE2 GLN p 30 14.624 -1.859 -6.651 1.00 0.00 N ATOM 0 H GLN p 30 12.202 -5.177 -2.667 1.00 0.00 H new ATOM 0 HA GLN p 30 14.147 -6.191 -4.627 1.00 0.00 H new ATOM 0 HB2 GLN p 30 13.264 -4.294 -5.549 1.00 0.00 H new ATOM 0 HB3 GLN p 30 12.717 -3.676 -4.003 1.00 0.00 H new ATOM 0 HG2 GLN p 30 14.307 -2.119 -4.138 1.00 0.00 H new ATOM 0 HG3 GLN p 30 15.500 -3.380 -3.900 1.00 0.00 H new ATOM 0 HE21 GLN p 30 13.843 -1.341 -6.249 1.00 0.00 H new ATOM 0 HE22 GLN p 30 14.942 -1.649 -7.597 1.00 0.00 H new ATOM 502 N ALA p 31 15.115 -4.826 -1.840 1.00 0.00 N ATOM 503 CA ALA p 31 16.268 -4.643 -0.934 1.00 0.00 C ATOM 504 C ALA p 31 16.842 -5.964 -0.393 1.00 0.00 C ATOM 505 O ALA p 31 17.907 -5.967 0.234 1.00 0.00 O ATOM 506 CB ALA p 31 15.885 -3.724 0.216 1.00 0.00 C ATOM 0 H ALA p 31 14.232 -4.492 -1.454 1.00 0.00 H new ATOM 0 HA ALA p 31 17.060 -4.188 -1.529 1.00 0.00 H new ATOM 0 HB1 ALA p 31 16.741 -3.595 0.879 1.00 0.00 H new ATOM 0 HB2 ALA p 31 15.582 -2.754 -0.179 1.00 0.00 H new ATOM 0 HB3 ALA p 31 15.058 -4.164 0.773 1.00 0.00 H new ATOM 512 N TRP p 32 16.142 -7.077 -0.645 1.00 0.00 N ATOM 513 CA TRP p 32 16.589 -8.401 -0.194 1.00 0.00 C ATOM 514 C TRP p 32 17.428 -9.112 -1.262 1.00 0.00 C ATOM 515 O TRP p 32 18.088 -10.114 -0.972 1.00 0.00 O ATOM 516 CB TRP p 32 15.383 -9.265 0.193 1.00 0.00 C ATOM 517 CG TRP p 32 14.961 -9.111 1.632 1.00 0.00 C ATOM 518 CD1 TRP p 32 14.541 -7.962 2.248 1.00 0.00 C ATOM 519 CD2 TRP p 32 14.911 -10.141 2.634 1.00 0.00 C ATOM 520 NE1 TRP p 32 14.241 -8.214 3.565 1.00 0.00 N ATOM 521 CE2 TRP p 32 14.457 -9.542 3.826 1.00 0.00 C ATOM 522 CE3 TRP p 32 15.205 -11.511 2.641 1.00 0.00 C ATOM 523 CZ2 TRP p 32 14.291 -10.262 5.007 1.00 0.00 C ATOM 524 CZ3 TRP p 32 15.039 -12.223 3.815 1.00 0.00 C ATOM 525 CH2 TRP p 32 14.586 -11.597 4.982 1.00 0.00 C ATOM 0 H TRP p 32 15.262 -7.087 -1.160 1.00 0.00 H new ATOM 0 HA TRP p 32 17.222 -8.255 0.681 1.00 0.00 H new ATOM 0 HB2 TRP p 32 14.542 -9.009 -0.452 1.00 0.00 H new ATOM 0 HB3 TRP p 32 15.622 -10.312 0.004 1.00 0.00 H new ATOM 0 HD1 TRP p 32 14.458 -6.998 1.768 1.00 0.00 H new ATOM 0 HE1 TRP p 32 13.911 -7.524 4.240 1.00 0.00 H new ATOM 0 HE3 TRP p 32 15.555 -12.002 1.745 1.00 0.00 H new ATOM 0 HZ2 TRP p 32 13.942 -9.783 5.910 1.00 0.00 H new ATOM 0 HZ3 TRP p 32 15.263 -13.279 3.832 1.00 0.00 H new ATOM 0 HH2 TRP p 32 14.467 -12.181 5.883 1.00 0.00 H new ATOM 536 N ASN p 33 17.401 -8.576 -2.503 1.00 0.00 N ATOM 537 CA ASN p 33 18.156 -9.120 -3.660 1.00 0.00 C ATOM 538 C ASN p 33 17.706 -10.535 -4.034 1.00 0.00 C ATOM 539 O ASN p 33 17.694 -11.438 -3.192 1.00 0.00 O ATOM 540 CB ASN p 33 19.675 -9.104 -3.409 1.00 0.00 C ATOM 541 CG ASN p 33 20.240 -7.697 -3.330 1.00 0.00 C ATOM 542 OD1 ASN p 33 20.643 -7.121 -4.340 1.00 0.00 O ATOM 543 ND2 ASN p 33 20.269 -7.139 -2.126 1.00 0.00 N ATOM 0 H ASN p 33 16.852 -7.748 -2.734 1.00 0.00 H new ATOM 0 HA ASN p 33 17.934 -8.461 -4.500 1.00 0.00 H new ATOM 0 HB2 ASN p 33 19.891 -9.631 -2.480 1.00 0.00 H new ATOM 0 HB3 ASN p 33 20.177 -9.649 -4.209 1.00 0.00 H new ATOM 0 HD21 ASN p 33 20.636 -6.195 -2.010 1.00 0.00 H new ATOM 0 HD22 ASN p 33 19.924 -7.655 -1.316 1.00 0.00 H new ATOM 550 N CYS p 34 17.342 -10.707 -5.310 1.00 0.00 N ATOM 551 CA CYS p 34 16.894 -11.998 -5.834 1.00 0.00 C ATOM 552 C CYS p 34 17.606 -12.320 -7.144 1.00 0.00 C ATOM 553 O CYS p 34 17.711 -11.462 -8.024 1.00 0.00 O ATOM 554 CB CYS p 34 15.378 -11.986 -6.053 1.00 0.00 C ATOM 555 SG CYS p 34 14.798 -10.676 -7.159 1.00 0.00 S ATOM 0 H CYS p 34 17.350 -9.959 -6.003 1.00 0.00 H new ATOM 0 HA CYS p 34 17.140 -12.768 -5.103 1.00 0.00 H new ATOM 0 HB2 CYS p 34 15.073 -12.950 -6.459 1.00 0.00 H new ATOM 0 HB3 CYS p 34 14.884 -11.876 -5.088 1.00 0.00 H new ATOM 0 HG CYS p 34 15.728 -10.394 -8.022 1.00 0.00 H new ATOM 561 N ILE p 35 18.091 -13.560 -7.263 1.00 0.00 N ATOM 562 CA ILE p 35 18.800 -14.003 -8.469 1.00 0.00 C ATOM 563 C ILE p 35 17.967 -15.006 -9.278 1.00 0.00 C ATOM 564 O ILE p 35 17.652 -14.752 -10.444 1.00 0.00 O ATOM 565 CB ILE p 35 20.214 -14.593 -8.159 1.00 0.00 C ATOM 566 CG1 ILE p 35 20.207 -15.537 -6.939 1.00 0.00 C ATOM 567 CG2 ILE p 35 21.214 -13.468 -7.941 1.00 0.00 C ATOM 568 CD1 ILE p 35 20.368 -16.997 -7.303 1.00 0.00 C ATOM 0 H ILE p 35 18.006 -14.275 -6.540 1.00 0.00 H new ATOM 0 HA ILE p 35 18.949 -13.108 -9.074 1.00 0.00 H new ATOM 0 HB ILE p 35 20.510 -15.187 -9.024 1.00 0.00 H new ATOM 0 HG12 ILE p 35 21.011 -15.249 -6.262 1.00 0.00 H new ATOM 0 HG13 ILE p 35 19.271 -15.408 -6.395 1.00 0.00 H new ATOM 0 HG21 ILE p 35 22.196 -13.890 -7.726 1.00 0.00 H new ATOM 0 HG22 ILE p 35 21.272 -12.854 -8.840 1.00 0.00 H new ATOM 0 HG23 ILE p 35 20.892 -12.852 -7.101 1.00 0.00 H new ATOM 0 HD11 ILE p 35 20.354 -17.602 -6.396 1.00 0.00 H new ATOM 0 HD12 ILE p 35 19.550 -17.302 -7.955 1.00 0.00 H new ATOM 0 HD13 ILE p 35 21.317 -17.141 -7.820 1.00 0.00 H new ATOM 580 N CYS p 36 17.616 -16.144 -8.652 1.00 0.00 N ATOM 581 CA CYS p 36 16.819 -17.192 -9.307 1.00 0.00 C ATOM 582 C CYS p 36 16.048 -18.028 -8.280 1.00 0.00 C ATOM 583 O CYS p 36 14.867 -18.328 -8.482 1.00 0.00 O ATOM 584 CB CYS p 36 17.714 -18.113 -10.156 1.00 0.00 C ATOM 585 SG CYS p 36 16.808 -19.324 -11.147 1.00 0.00 S ATOM 0 H CYS p 36 17.874 -16.360 -7.689 1.00 0.00 H new ATOM 0 HA CYS p 36 16.102 -16.693 -9.959 1.00 0.00 H new ATOM 0 HB2 CYS p 36 18.321 -17.498 -10.821 1.00 0.00 H new ATOM 0 HB3 CYS p 36 18.401 -18.642 -9.495 1.00 0.00 H new ATOM 0 HG CYS p 36 17.650 -20.047 -11.825 1.00 0.00 H new ATOM 591 N ASP p 37 16.726 -18.395 -7.185 1.00 0.00 N ATOM 592 CA ASP p 37 16.121 -19.209 -6.122 1.00 0.00 C ATOM 593 C ASP p 37 15.554 -18.351 -4.985 1.00 0.00 C ATOM 594 O ASP p 37 14.795 -18.854 -4.156 1.00 0.00 O ATOM 595 CB ASP p 37 17.149 -20.196 -5.561 1.00 0.00 C ATOM 596 CG ASP p 37 17.501 -21.298 -6.544 1.00 0.00 C ATOM 597 OD1 ASP p 37 16.824 -22.346 -6.528 1.00 0.00 O ATOM 598 OD2 ASP p 37 18.455 -21.110 -7.329 1.00 0.00 O ATOM 0 H ASP p 37 17.698 -18.140 -7.011 1.00 0.00 H new ATOM 0 HA ASP p 37 15.291 -19.755 -6.570 1.00 0.00 H new ATOM 0 HB2 ASP p 37 18.055 -19.655 -5.289 1.00 0.00 H new ATOM 0 HB3 ASP p 37 16.757 -20.642 -4.647 1.00 0.00 H new ATOM 603 N ILE p 38 15.949 -17.057 -4.948 1.00 0.00 N ATOM 604 CA ILE p 38 15.509 -16.072 -3.924 1.00 0.00 C ATOM 605 C ILE p 38 15.811 -16.544 -2.476 1.00 0.00 C ATOM 606 O ILE p 38 16.157 -17.707 -2.251 1.00 0.00 O ATOM 607 CB ILE p 38 13.994 -15.659 -4.115 1.00 0.00 C ATOM 608 CG1 ILE p 38 13.730 -14.243 -3.559 1.00 0.00 C ATOM 609 CG2 ILE p 38 13.023 -16.667 -3.485 1.00 0.00 C ATOM 610 CD1 ILE p 38 12.698 -13.454 -4.344 1.00 0.00 C ATOM 0 H ILE p 38 16.590 -16.660 -5.635 1.00 0.00 H new ATOM 0 HA ILE p 38 16.105 -15.173 -4.081 1.00 0.00 H new ATOM 0 HB ILE p 38 13.808 -15.658 -5.189 1.00 0.00 H new ATOM 0 HG12 ILE p 38 13.398 -14.326 -2.524 1.00 0.00 H new ATOM 0 HG13 ILE p 38 14.667 -13.687 -3.550 1.00 0.00 H new ATOM 0 HG21 ILE p 38 11.998 -16.334 -3.646 1.00 0.00 H new ATOM 0 HG22 ILE p 38 13.164 -17.645 -3.946 1.00 0.00 H new ATOM 0 HG23 ILE p 38 13.217 -16.739 -2.415 1.00 0.00 H new ATOM 0 HD11 ILE p 38 12.569 -12.471 -3.891 1.00 0.00 H new ATOM 0 HD12 ILE p 38 13.036 -13.337 -5.374 1.00 0.00 H new ATOM 0 HD13 ILE p 38 11.747 -13.986 -4.332 1.00 0.00 H new ATOM 622 N GLU p 39 15.685 -15.620 -1.513 1.00 0.00 N ATOM 623 CA GLU p 39 15.938 -15.921 -0.101 1.00 0.00 C ATOM 624 C GLU p 39 14.649 -16.310 0.618 1.00 0.00 C ATOM 625 O GLU p 39 13.583 -15.752 0.343 1.00 0.00 O ATOM 626 CB GLU p 39 16.582 -14.721 0.599 1.00 0.00 C ATOM 627 CG GLU p 39 18.051 -14.523 0.252 1.00 0.00 C ATOM 628 CD GLU p 39 18.680 -13.375 1.017 1.00 0.00 C ATOM 629 OE1 GLU p 39 18.638 -12.233 0.515 1.00 0.00 O ATOM 630 OE2 GLU p 39 19.216 -13.620 2.119 1.00 0.00 O ATOM 0 H GLU p 39 15.408 -14.654 -1.690 1.00 0.00 H new ATOM 0 HA GLU p 39 16.625 -16.766 -0.061 1.00 0.00 H new ATOM 0 HB2 GLU p 39 16.031 -13.819 0.334 1.00 0.00 H new ATOM 0 HB3 GLU p 39 16.487 -14.847 1.677 1.00 0.00 H new ATOM 0 HG2 GLU p 39 18.598 -15.441 0.466 1.00 0.00 H new ATOM 0 HG3 GLU p 39 18.146 -14.338 -0.818 1.00 0.00 H new ATOM 637 N ASN p 40 14.765 -17.273 1.539 1.00 0.00 N ATOM 638 CA ASN p 40 13.623 -17.760 2.314 1.00 0.00 C ATOM 639 C ASN p 40 13.584 -17.101 3.697 1.00 0.00 C ATOM 640 O ASN p 40 14.590 -16.557 4.164 1.00 0.00 O ATOM 641 CB ASN p 40 13.696 -19.288 2.447 1.00 0.00 C ATOM 642 CG ASN p 40 12.334 -19.926 2.657 1.00 0.00 C ATOM 643 OD1 ASN p 40 11.650 -20.288 1.700 1.00 0.00 O ATOM 644 ND2 ASN p 40 11.934 -20.066 3.916 1.00 0.00 N ATOM 0 H ASN p 40 15.647 -17.733 1.766 1.00 0.00 H new ATOM 0 HA ASN p 40 12.706 -17.494 1.789 1.00 0.00 H new ATOM 0 HB2 ASN p 40 14.153 -19.705 1.549 1.00 0.00 H new ATOM 0 HB3 ASN p 40 14.345 -19.545 3.284 1.00 0.00 H new ATOM 0 HD21 ASN p 40 11.028 -20.488 4.119 1.00 0.00 H new ATOM 0 HD22 ASN p 40 12.533 -19.752 4.679 1.00 0.00 H new ATOM 651 N CYS p 41 12.411 -17.163 4.344 1.00 0.00 N ATOM 652 CA CYS p 41 12.212 -16.580 5.675 1.00 0.00 C ATOM 653 C CYS p 41 12.557 -17.584 6.780 1.00 0.00 C ATOM 654 O CYS p 41 12.607 -18.793 6.535 1.00 0.00 O ATOM 655 CB CYS p 41 10.763 -16.106 5.826 1.00 0.00 C ATOM 656 SG CYS p 41 10.269 -14.846 4.628 1.00 0.00 S ATOM 0 H CYS p 41 11.581 -17.615 3.961 1.00 0.00 H new ATOM 0 HA CYS p 41 12.883 -15.727 5.776 1.00 0.00 H new ATOM 0 HB2 CYS p 41 10.099 -16.965 5.728 1.00 0.00 H new ATOM 0 HB3 CYS p 41 10.625 -15.709 6.832 1.00 0.00 H new ATOM 0 HG CYS p 41 9.030 -14.512 4.835 1.00 0.00 H new ATOM 662 N SER p 42 12.792 -17.066 7.995 1.00 0.00 N ATOM 663 CA SER p 42 13.139 -17.897 9.155 1.00 0.00 C ATOM 664 C SER p 42 11.895 -18.484 9.830 1.00 0.00 C ATOM 665 O SER p 42 11.927 -19.620 10.313 1.00 0.00 O ATOM 666 CB SER p 42 13.939 -17.077 10.169 1.00 0.00 C ATOM 667 OG SER p 42 15.141 -16.591 9.597 1.00 0.00 O ATOM 0 H SER p 42 12.747 -16.068 8.199 1.00 0.00 H new ATOM 0 HA SER p 42 13.746 -18.727 8.793 1.00 0.00 H new ATOM 0 HB2 SER p 42 13.336 -16.240 10.521 1.00 0.00 H new ATOM 0 HB3 SER p 42 14.169 -17.693 11.039 1.00 0.00 H new ATOM 0 HG SER p 42 15.633 -16.069 10.264 1.00 0.00 H new ATOM 673 N ASN p 43 10.807 -17.702 9.857 1.00 0.00 N ATOM 674 CA ASN p 43 9.547 -18.134 10.469 1.00 0.00 C ATOM 675 C ASN p 43 8.626 -18.787 9.434 1.00 0.00 C ATOM 676 O ASN p 43 8.082 -19.867 9.677 1.00 0.00 O ATOM 677 CB ASN p 43 8.837 -16.948 11.135 1.00 0.00 C ATOM 678 CG ASN p 43 9.558 -16.458 12.378 1.00 0.00 C ATOM 679 OD1 ASN p 43 10.422 -15.584 12.304 1.00 0.00 O ATOM 680 ND2 ASN p 43 9.206 -17.023 13.528 1.00 0.00 N ATOM 0 H ASN p 43 10.777 -16.763 9.460 1.00 0.00 H new ATOM 0 HA ASN p 43 9.784 -18.876 11.232 1.00 0.00 H new ATOM 0 HB2 ASN p 43 8.757 -16.129 10.420 1.00 0.00 H new ATOM 0 HB3 ASN p 43 7.821 -17.240 11.400 1.00 0.00 H new ATOM 0 HD21 ASN p 43 9.657 -16.736 14.397 1.00 0.00 H new ATOM 0 HD22 ASN p 43 8.485 -17.744 13.542 1.00 0.00 H new ATOM 687 N MET p 44 8.467 -18.120 8.267 1.00 0.00 N ATOM 688 CA MET p 44 7.619 -18.596 7.147 1.00 0.00 C ATOM 689 C MET p 44 6.146 -18.745 7.562 1.00 0.00 C ATOM 690 O MET p 44 5.825 -19.494 8.490 1.00 0.00 O ATOM 691 CB MET p 44 8.149 -19.925 6.569 1.00 0.00 C ATOM 692 CG MET p 44 7.894 -20.097 5.077 1.00 0.00 C ATOM 693 SD MET p 44 8.520 -21.665 4.443 1.00 0.00 S ATOM 694 CE MET p 44 8.080 -21.529 2.711 1.00 0.00 C ATOM 0 H MET p 44 8.927 -17.230 8.074 1.00 0.00 H new ATOM 0 HA MET p 44 7.670 -17.834 6.369 1.00 0.00 H new ATOM 0 HB2 MET p 44 9.221 -19.988 6.753 1.00 0.00 H new ATOM 0 HB3 MET p 44 7.685 -20.753 7.104 1.00 0.00 H new ATOM 0 HG2 MET p 44 6.823 -20.034 4.886 1.00 0.00 H new ATOM 0 HG3 MET p 44 8.364 -19.276 4.535 1.00 0.00 H new ATOM 0 HE1 MET p 44 8.402 -22.426 2.182 1.00 0.00 H new ATOM 0 HE2 MET p 44 6.999 -21.421 2.618 1.00 0.00 H new ATOM 0 HE3 MET p 44 8.570 -20.657 2.278 1.00 0.00 H new ATOM 704 N ALA p 45 5.268 -18.024 6.858 1.00 0.00 N ATOM 705 CA ALA p 45 3.831 -18.064 7.129 1.00 0.00 C ATOM 706 C ALA p 45 3.027 -18.525 5.896 1.00 0.00 C ATOM 707 O ALA p 45 2.189 -19.420 6.033 1.00 0.00 O ATOM 708 CB ALA p 45 3.336 -16.709 7.629 1.00 0.00 C ATOM 0 H ALA p 45 5.531 -17.403 6.093 1.00 0.00 H new ATOM 0 HA ALA p 45 3.667 -18.801 7.915 1.00 0.00 H new ATOM 0 HB1 ALA p 45 2.265 -16.762 7.824 1.00 0.00 H new ATOM 0 HB2 ALA p 45 3.860 -16.447 8.548 1.00 0.00 H new ATOM 0 HB3 ALA p 45 3.530 -15.949 6.872 1.00 0.00 H new ATOM 714 N PRO p 46 3.249 -17.939 4.666 1.00 0.00 N ATOM 715 CA PRO p 46 2.512 -18.345 3.453 1.00 0.00 C ATOM 716 C PRO p 46 3.071 -19.624 2.825 1.00 0.00 C ATOM 717 O PRO p 46 4.238 -19.966 3.036 1.00 0.00 O ATOM 718 CB PRO p 46 2.700 -17.156 2.490 1.00 0.00 C ATOM 719 CG PRO p 46 3.467 -16.117 3.248 1.00 0.00 C ATOM 720 CD PRO p 46 4.193 -16.847 4.338 1.00 0.00 C ATOM 0 HA PRO p 46 1.469 -18.568 3.679 1.00 0.00 H new ATOM 0 HB2 PRO p 46 3.241 -17.463 1.595 1.00 0.00 H new ATOM 0 HB3 PRO p 46 1.737 -16.766 2.162 1.00 0.00 H new ATOM 0 HG2 PRO p 46 4.167 -15.596 2.595 1.00 0.00 H new ATOM 0 HG3 PRO p 46 2.797 -15.364 3.663 1.00 0.00 H new ATOM 0 HD2 PRO p 46 5.156 -17.229 4.000 1.00 0.00 H new ATOM 0 HD3 PRO p 46 4.388 -16.206 5.198 1.00 0.00 H new ATOM 728 N LEU p 47 2.226 -20.317 2.054 1.00 0.00 N ATOM 729 CA LEU p 47 2.621 -21.561 1.384 1.00 0.00 C ATOM 730 C LEU p 47 3.072 -21.312 -0.056 1.00 0.00 C ATOM 731 O LEU p 47 3.644 -22.199 -0.697 1.00 0.00 O ATOM 732 CB LEU p 47 1.454 -22.556 1.393 1.00 0.00 C ATOM 733 CG LEU p 47 1.069 -23.126 2.767 1.00 0.00 C ATOM 734 CD1 LEU p 47 -0.374 -23.605 2.756 1.00 0.00 C ATOM 735 CD2 LEU p 47 1.999 -24.266 3.165 1.00 0.00 C ATOM 0 H LEU p 47 1.261 -20.036 1.878 1.00 0.00 H new ATOM 0 HA LEU p 47 3.465 -21.977 1.934 1.00 0.00 H new ATOM 0 HB2 LEU p 47 0.579 -22.064 0.967 1.00 0.00 H new ATOM 0 HB3 LEU p 47 1.705 -23.387 0.734 1.00 0.00 H new ATOM 0 HG LEU p 47 1.171 -22.329 3.504 1.00 0.00 H new ATOM 0 HD11 LEU p 47 -0.632 -24.006 3.736 1.00 0.00 H new ATOM 0 HD12 LEU p 47 -1.033 -22.769 2.521 1.00 0.00 H new ATOM 0 HD13 LEU p 47 -0.493 -24.384 2.003 1.00 0.00 H new ATOM 0 HD21 LEU p 47 1.705 -24.652 4.141 1.00 0.00 H new ATOM 0 HD22 LEU p 47 1.934 -25.064 2.425 1.00 0.00 H new ATOM 0 HD23 LEU p 47 3.024 -23.899 3.214 1.00 0.00 H new ATOM 747 N TYR p 48 2.813 -20.100 -0.546 1.00 0.00 N ATOM 748 CA TYR p 48 3.169 -19.712 -1.914 1.00 0.00 C ATOM 749 C TYR p 48 4.355 -18.745 -1.916 1.00 0.00 C ATOM 750 O TYR p 48 5.358 -18.994 -2.591 1.00 0.00 O ATOM 751 CB TYR p 48 1.961 -19.077 -2.628 1.00 0.00 C ATOM 752 CG TYR p 48 0.687 -19.900 -2.556 1.00 0.00 C ATOM 753 CD1 TYR p 48 -0.132 -19.848 -1.434 1.00 0.00 C ATOM 754 CD2 TYR p 48 0.309 -20.727 -3.606 1.00 0.00 C ATOM 755 CE1 TYR p 48 -1.289 -20.597 -1.358 1.00 0.00 C ATOM 756 CE2 TYR p 48 -0.850 -21.478 -3.539 1.00 0.00 C ATOM 757 CZ TYR p 48 -1.644 -21.410 -2.412 1.00 0.00 C ATOM 758 OH TYR p 48 -2.798 -22.157 -2.343 1.00 0.00 O ATOM 0 H TYR p 48 2.354 -19.363 -0.012 1.00 0.00 H new ATOM 0 HA TYR p 48 3.460 -20.612 -2.455 1.00 0.00 H new ATOM 0 HB2 TYR p 48 1.771 -18.096 -2.192 1.00 0.00 H new ATOM 0 HB3 TYR p 48 2.217 -18.916 -3.675 1.00 0.00 H new ATOM 0 HD1 TYR p 48 0.142 -19.210 -0.607 1.00 0.00 H new ATOM 0 HD2 TYR p 48 0.930 -20.784 -4.488 1.00 0.00 H new ATOM 0 HE1 TYR p 48 -1.912 -20.546 -0.477 1.00 0.00 H new ATOM 0 HE2 TYR p 48 -1.133 -22.115 -4.364 1.00 0.00 H new ATOM 0 HH TYR p 48 -2.903 -22.674 -3.169 1.00 0.00 H new ATOM 768 N SER p 49 4.227 -17.634 -1.148 1.00 0.00 N ATOM 769 CA SER p 49 5.268 -16.578 -1.014 1.00 0.00 C ATOM 770 C SER p 49 5.458 -15.748 -2.296 1.00 0.00 C ATOM 771 O SER p 49 5.714 -14.543 -2.220 1.00 0.00 O ATOM 772 CB SER p 49 6.619 -17.161 -0.566 1.00 0.00 C ATOM 773 OG SER p 49 6.503 -17.817 0.685 1.00 0.00 O ATOM 0 H SER p 49 3.390 -17.442 -0.598 1.00 0.00 H new ATOM 0 HA SER p 49 4.897 -15.906 -0.240 1.00 0.00 H new ATOM 0 HB2 SER p 49 6.982 -17.864 -1.316 1.00 0.00 H new ATOM 0 HB3 SER p 49 7.357 -16.362 -0.494 1.00 0.00 H new ATOM 0 HG SER p 49 7.375 -18.180 0.946 1.00 0.00 H new ATOM 779 N ASP p 50 5.333 -16.397 -3.460 1.00 0.00 N ATOM 780 CA ASP p 50 5.503 -15.728 -4.756 1.00 0.00 C ATOM 781 C ASP p 50 4.154 -15.323 -5.353 1.00 0.00 C ATOM 782 O ASP p 50 4.003 -14.203 -5.850 1.00 0.00 O ATOM 783 CB ASP p 50 6.261 -16.635 -5.733 1.00 0.00 C ATOM 784 CG ASP p 50 7.719 -16.816 -5.353 1.00 0.00 C ATOM 785 OD1 ASP p 50 8.023 -17.762 -4.596 1.00 0.00 O ATOM 786 OD2 ASP p 50 8.557 -16.011 -5.813 1.00 0.00 O ATOM 0 H ASP p 50 5.113 -17.391 -3.531 1.00 0.00 H new ATOM 0 HA ASP p 50 6.086 -14.822 -4.588 1.00 0.00 H new ATOM 0 HB2 ASP p 50 5.775 -17.610 -5.768 1.00 0.00 H new ATOM 0 HB3 ASP p 50 6.201 -16.212 -6.736 1.00 0.00 H new ATOM 791 N GLN p 51 3.182 -16.244 -5.300 1.00 0.00 N ATOM 792 CA GLN p 51 1.833 -16.003 -5.828 1.00 0.00 C ATOM 793 C GLN p 51 0.926 -15.351 -4.776 1.00 0.00 C ATOM 794 O GLN p 51 -0.192 -14.940 -5.083 1.00 0.00 O ATOM 795 CB GLN p 51 1.206 -17.311 -6.327 1.00 0.00 C ATOM 796 CG GLN p 51 1.813 -17.829 -7.623 1.00 0.00 C ATOM 797 CD GLN p 51 1.166 -19.116 -8.097 1.00 0.00 C ATOM 798 OE1 GLN p 51 0.191 -19.095 -8.847 1.00 0.00 O ATOM 799 NE2 GLN p 51 1.708 -20.247 -7.658 1.00 0.00 N ATOM 0 H GLN p 51 3.308 -17.171 -4.893 1.00 0.00 H new ATOM 0 HA GLN p 51 1.928 -15.313 -6.667 1.00 0.00 H new ATOM 0 HB2 GLN p 51 1.316 -18.073 -5.555 1.00 0.00 H new ATOM 0 HB3 GLN p 51 0.137 -17.158 -6.474 1.00 0.00 H new ATOM 0 HG2 GLN p 51 1.710 -17.069 -8.397 1.00 0.00 H new ATOM 0 HG3 GLN p 51 2.881 -17.995 -7.479 1.00 0.00 H new ATOM 0 HE21 GLN p 51 2.517 -20.218 -7.037 1.00 0.00 H new ATOM 0 HE22 GLN p 51 1.315 -21.145 -7.942 1.00 0.00 H new ATOM 808 N ALA p 52 1.417 -15.284 -3.534 1.00 0.00 N ATOM 809 CA ALA p 52 0.678 -14.688 -2.417 1.00 0.00 C ATOM 810 C ALA p 52 1.093 -13.227 -2.168 1.00 0.00 C ATOM 811 O ALA p 52 0.498 -12.543 -1.340 1.00 0.00 O ATOM 812 CB ALA p 52 0.899 -15.522 -1.163 1.00 0.00 C ATOM 0 H ALA p 52 2.337 -15.641 -3.275 1.00 0.00 H new ATOM 0 HA ALA p 52 -0.381 -14.682 -2.675 1.00 0.00 H new ATOM 0 HB1 ALA p 52 0.350 -15.081 -0.331 1.00 0.00 H new ATOM 0 HB2 ALA p 52 0.543 -16.538 -1.334 1.00 0.00 H new ATOM 0 HB3 ALA p 52 1.962 -15.546 -0.924 1.00 0.00 H new ATOM 818 N LEU p 53 2.131 -12.782 -2.879 1.00 0.00 N ATOM 819 CA LEU p 53 2.681 -11.446 -2.764 1.00 0.00 C ATOM 820 C LEU p 53 2.109 -10.525 -3.822 1.00 0.00 C ATOM 821 O LEU p 53 1.353 -9.607 -3.519 1.00 0.00 O ATOM 822 CB LEU p 53 4.211 -11.510 -2.881 1.00 0.00 C ATOM 823 CG LEU p 53 4.987 -11.434 -1.567 1.00 0.00 C ATOM 824 CD1 LEU p 53 6.471 -11.577 -1.838 1.00 0.00 C ATOM 825 CD2 LEU p 53 4.700 -10.124 -0.857 1.00 0.00 C ATOM 0 H LEU p 53 2.618 -13.360 -3.564 1.00 0.00 H new ATOM 0 HA LEU p 53 2.408 -11.040 -1.790 1.00 0.00 H new ATOM 0 HB2 LEU p 53 4.478 -12.439 -3.385 1.00 0.00 H new ATOM 0 HB3 LEU p 53 4.541 -10.693 -3.523 1.00 0.00 H new ATOM 0 HG LEU p 53 4.667 -12.250 -0.919 1.00 0.00 H new ATOM 0 HD11 LEU p 53 7.020 -11.522 -0.898 1.00 0.00 H new ATOM 0 HD12 LEU p 53 6.663 -12.538 -2.314 1.00 0.00 H new ATOM 0 HD13 LEU p 53 6.800 -10.773 -2.497 1.00 0.00 H new ATOM 0 HD21 LEU p 53 5.261 -10.086 0.077 1.00 0.00 H new ATOM 0 HD22 LEU p 53 4.999 -9.292 -1.494 1.00 0.00 H new ATOM 0 HD23 LEU p 53 3.634 -10.052 -0.643 1.00 0.00 H new ATOM 837 N LYS p 54 2.487 -10.811 -5.071 1.00 0.00 N ATOM 838 CA LYS p 54 2.047 -10.056 -6.265 1.00 0.00 C ATOM 839 C LYS p 54 0.523 -10.080 -6.437 1.00 0.00 C ATOM 840 O LYS p 54 -0.033 -9.312 -7.223 1.00 0.00 O ATOM 841 CB LYS p 54 2.719 -10.611 -7.526 1.00 0.00 C ATOM 842 CG LYS p 54 4.202 -10.285 -7.628 1.00 0.00 C ATOM 843 CD LYS p 54 4.810 -10.841 -8.908 1.00 0.00 C ATOM 844 CE LYS p 54 6.293 -10.514 -9.019 1.00 0.00 C ATOM 845 NZ LYS p 54 6.529 -9.080 -9.353 1.00 0.00 N ATOM 0 H LYS p 54 3.116 -11.583 -5.293 1.00 0.00 H new ATOM 0 HA LYS p 54 2.348 -9.019 -6.116 1.00 0.00 H new ATOM 0 HB2 LYS p 54 2.593 -11.693 -7.547 1.00 0.00 H new ATOM 0 HB3 LYS p 54 2.208 -10.213 -8.403 1.00 0.00 H new ATOM 0 HG2 LYS p 54 4.341 -9.204 -7.598 1.00 0.00 H new ATOM 0 HG3 LYS p 54 4.726 -10.698 -6.766 1.00 0.00 H new ATOM 0 HD2 LYS p 54 4.673 -11.922 -8.935 1.00 0.00 H new ATOM 0 HD3 LYS p 54 4.282 -10.431 -9.769 1.00 0.00 H new ATOM 0 HE2 LYS p 54 6.788 -10.752 -8.077 1.00 0.00 H new ATOM 0 HE3 LYS p 54 6.746 -11.143 -9.785 1.00 0.00 H new ATOM 0 HZ1 LYS p 54 7.552 -8.903 -9.419 1.00 0.00 H new ATOM 0 HZ2 LYS p 54 6.080 -8.857 -10.264 1.00 0.00 H new ATOM 0 HZ3 LYS p 54 6.120 -8.479 -8.609 1.00 0.00 H new ATOM 859 N LYS p 55 -0.120 -10.980 -5.692 1.00 0.00 N ATOM 860 CA LYS p 55 -1.554 -11.147 -5.672 1.00 0.00 C ATOM 861 C LYS p 55 -2.119 -10.343 -4.523 1.00 0.00 C ATOM 862 O LYS p 55 -3.189 -9.749 -4.637 1.00 0.00 O ATOM 863 CB LYS p 55 -1.917 -12.617 -5.535 1.00 0.00 C ATOM 864 CG LYS p 55 -2.063 -13.331 -6.868 1.00 0.00 C ATOM 865 CD LYS p 55 -2.777 -14.665 -6.714 1.00 0.00 C ATOM 866 CE LYS p 55 -2.928 -15.373 -8.050 1.00 0.00 C ATOM 867 NZ LYS p 55 -3.632 -16.677 -7.912 1.00 0.00 N ATOM 0 H LYS p 55 0.367 -11.627 -5.071 1.00 0.00 H new ATOM 0 HA LYS p 55 -1.981 -10.789 -6.609 1.00 0.00 H new ATOM 0 HB2 LYS p 55 -1.150 -13.119 -4.945 1.00 0.00 H new ATOM 0 HB3 LYS p 55 -2.852 -12.702 -4.982 1.00 0.00 H new ATOM 0 HG2 LYS p 55 -2.618 -12.699 -7.561 1.00 0.00 H new ATOM 0 HG3 LYS p 55 -1.077 -13.494 -7.304 1.00 0.00 H new ATOM 0 HD2 LYS p 55 -2.219 -15.300 -6.025 1.00 0.00 H new ATOM 0 HD3 LYS p 55 -3.761 -14.504 -6.273 1.00 0.00 H new ATOM 0 HE2 LYS p 55 -3.480 -14.734 -8.739 1.00 0.00 H new ATOM 0 HE3 LYS p 55 -1.943 -15.537 -8.487 1.00 0.00 H new ATOM 0 HZ1 LYS p 55 -3.714 -17.128 -8.846 1.00 0.00 H new ATOM 0 HZ2 LYS p 55 -3.092 -17.297 -7.275 1.00 0.00 H new ATOM 0 HZ3 LYS p 55 -4.582 -16.519 -7.519 1.00 0.00 H new ATOM 881 N LYS p 56 -1.372 -10.342 -3.405 1.00 0.00 N ATOM 882 CA LYS p 56 -1.738 -9.534 -2.220 1.00 0.00 C ATOM 883 C LYS p 56 -1.380 -8.063 -2.484 1.00 0.00 C ATOM 884 O LYS p 56 -1.773 -7.153 -1.754 1.00 0.00 O ATOM 885 CB LYS p 56 -1.025 -10.026 -0.965 1.00 0.00 C ATOM 886 CG LYS p 56 -1.794 -11.104 -0.219 1.00 0.00 C ATOM 887 CD LYS p 56 -1.133 -11.443 1.109 1.00 0.00 C ATOM 888 CE LYS p 56 -1.900 -12.521 1.863 1.00 0.00 C ATOM 889 NZ LYS p 56 -1.737 -13.867 1.243 1.00 0.00 N ATOM 0 H LYS p 56 -0.517 -10.886 -3.294 1.00 0.00 H new ATOM 0 HA LYS p 56 -2.810 -9.634 -2.051 1.00 0.00 H new ATOM 0 HB2 LYS p 56 -0.045 -10.414 -1.241 1.00 0.00 H new ATOM 0 HB3 LYS p 56 -0.857 -9.181 -0.297 1.00 0.00 H new ATOM 0 HG2 LYS p 56 -2.816 -10.768 -0.043 1.00 0.00 H new ATOM 0 HG3 LYS p 56 -1.856 -12.001 -0.835 1.00 0.00 H new ATOM 0 HD2 LYS p 56 -0.112 -11.780 0.931 1.00 0.00 H new ATOM 0 HD3 LYS p 56 -1.070 -10.545 1.723 1.00 0.00 H new ATOM 0 HE2 LYS p 56 -1.555 -12.555 2.896 1.00 0.00 H new ATOM 0 HE3 LYS p 56 -2.958 -12.261 1.889 1.00 0.00 H new ATOM 0 HZ1 LYS p 56 -2.330 -14.556 1.748 1.00 0.00 H new ATOM 0 HZ2 LYS p 56 -2.027 -13.827 0.245 1.00 0.00 H new ATOM 0 HZ3 LYS p 56 -0.740 -14.158 1.302 1.00 0.00 H new ATOM 903 N LEU p 57 -0.613 -7.902 -3.564 1.00 0.00 N ATOM 904 CA LEU p 57 -0.126 -6.660 -4.098 1.00 0.00 C ATOM 905 C LEU p 57 -1.123 -6.215 -5.140 1.00 0.00 C ATOM 906 O LEU p 57 -1.498 -5.047 -5.219 1.00 0.00 O ATOM 907 CB LEU p 57 1.231 -6.919 -4.750 1.00 0.00 C ATOM 908 CG LEU p 57 2.240 -5.783 -4.758 1.00 0.00 C ATOM 909 CD1 LEU p 57 3.552 -6.344 -5.243 1.00 0.00 C ATOM 910 CD2 LEU p 57 1.789 -4.651 -5.662 1.00 0.00 C ATOM 0 H LEU p 57 -0.303 -8.701 -4.116 1.00 0.00 H new ATOM 0 HA LEU p 57 -0.011 -5.897 -3.328 1.00 0.00 H new ATOM 0 HB2 LEU p 57 1.688 -7.770 -4.245 1.00 0.00 H new ATOM 0 HB3 LEU p 57 1.055 -7.218 -5.783 1.00 0.00 H new ATOM 0 HG LEU p 57 2.340 -5.371 -3.754 1.00 0.00 H new ATOM 0 HD11 LEU p 57 4.302 -5.553 -5.261 1.00 0.00 H new ATOM 0 HD12 LEU p 57 3.879 -7.138 -4.571 1.00 0.00 H new ATOM 0 HD13 LEU p 57 3.426 -6.748 -6.248 1.00 0.00 H new ATOM 0 HD21 LEU p 57 2.532 -3.854 -5.646 1.00 0.00 H new ATOM 0 HD22 LEU p 57 1.677 -5.022 -6.681 1.00 0.00 H new ATOM 0 HD23 LEU p 57 0.833 -4.263 -5.310 1.00 0.00 H new ATOM 922 N ALA p 58 -1.520 -7.207 -5.958 1.00 0.00 N ATOM 923 CA ALA p 58 -2.553 -7.015 -6.997 1.00 0.00 C ATOM 924 C ALA p 58 -3.912 -6.753 -6.342 1.00 0.00 C ATOM 925 O ALA p 58 -4.836 -6.230 -6.969 1.00 0.00 O ATOM 926 CB ALA p 58 -2.643 -8.219 -7.922 1.00 0.00 C ATOM 0 H ALA p 58 -1.141 -8.153 -5.920 1.00 0.00 H new ATOM 0 HA ALA p 58 -2.268 -6.152 -7.598 1.00 0.00 H new ATOM 0 HB1 ALA p 58 -3.413 -8.044 -8.674 1.00 0.00 H new ATOM 0 HB2 ALA p 58 -1.683 -8.372 -8.415 1.00 0.00 H new ATOM 0 HB3 ALA p 58 -2.898 -9.106 -7.342 1.00 0.00 H new ATOM 932 N GLN p 59 -3.995 -7.141 -5.063 1.00 0.00 N ATOM 933 CA GLN p 59 -5.152 -6.959 -4.226 1.00 0.00 C ATOM 934 C GLN p 59 -5.003 -5.634 -3.480 1.00 0.00 C ATOM 935 O GLN p 59 -5.982 -5.028 -3.075 1.00 0.00 O ATOM 936 CB GLN p 59 -5.222 -8.144 -3.262 1.00 0.00 C ATOM 937 CG GLN p 59 -6.070 -7.912 -2.036 1.00 0.00 C ATOM 938 CD GLN p 59 -7.155 -8.955 -1.856 1.00 0.00 C ATOM 939 OE1 GLN p 59 -6.946 -9.981 -1.207 1.00 0.00 O ATOM 940 NE2 GLN p 59 -8.325 -8.698 -2.431 1.00 0.00 N ATOM 0 H GLN p 59 -3.224 -7.604 -4.581 1.00 0.00 H new ATOM 0 HA GLN p 59 -6.075 -6.922 -4.805 1.00 0.00 H new ATOM 0 HB2 GLN p 59 -5.613 -9.009 -3.799 1.00 0.00 H new ATOM 0 HB3 GLN p 59 -4.210 -8.396 -2.945 1.00 0.00 H new ATOM 0 HG2 GLN p 59 -5.429 -7.907 -1.154 1.00 0.00 H new ATOM 0 HG3 GLN p 59 -6.530 -6.926 -2.101 1.00 0.00 H new ATOM 0 HE21 GLN p 59 -8.455 -7.835 -2.960 1.00 0.00 H new ATOM 0 HE22 GLN p 59 -9.093 -9.363 -2.344 1.00 0.00 H new ATOM 949 N LEU p 60 -3.740 -5.240 -3.308 1.00 0.00 N ATOM 950 CA LEU p 60 -3.346 -3.990 -2.649 1.00 0.00 C ATOM 951 C LEU p 60 -3.356 -2.843 -3.671 1.00 0.00 C ATOM 952 O LEU p 60 -3.312 -1.666 -3.323 1.00 0.00 O ATOM 953 CB LEU p 60 -1.944 -4.163 -2.027 1.00 0.00 C ATOM 954 CG LEU p 60 -1.395 -3.009 -1.159 1.00 0.00 C ATOM 955 CD1 LEU p 60 -0.557 -2.076 -2.011 1.00 0.00 C ATOM 956 CD2 LEU p 60 -2.522 -2.244 -0.481 1.00 0.00 C ATOM 0 H LEU p 60 -2.944 -5.792 -3.629 1.00 0.00 H new ATOM 0 HA LEU p 60 -4.052 -3.747 -1.855 1.00 0.00 H new ATOM 0 HB2 LEU p 60 -1.958 -5.065 -1.415 1.00 0.00 H new ATOM 0 HB3 LEU p 60 -1.237 -4.338 -2.838 1.00 0.00 H new ATOM 0 HG LEU p 60 -0.768 -3.437 -0.377 1.00 0.00 H new ATOM 0 HD11 LEU p 60 -0.173 -1.265 -1.392 1.00 0.00 H new ATOM 0 HD12 LEU p 60 0.277 -2.629 -2.443 1.00 0.00 H new ATOM 0 HD13 LEU p 60 -1.172 -1.663 -2.811 1.00 0.00 H new ATOM 0 HD21 LEU p 60 -2.103 -1.439 0.122 1.00 0.00 H new ATOM 0 HD22 LEU p 60 -3.184 -1.824 -1.238 1.00 0.00 H new ATOM 0 HD23 LEU p 60 -3.087 -2.921 0.159 1.00 0.00 H new ATOM 968 N LYS p 61 -3.400 -3.259 -4.925 1.00 0.00 N ATOM 969 CA LYS p 61 -3.454 -2.415 -6.108 1.00 0.00 C ATOM 970 C LYS p 61 -4.915 -2.286 -6.471 1.00 0.00 C ATOM 971 O LYS p 61 -5.369 -1.291 -7.043 1.00 0.00 O ATOM 972 CB LYS p 61 -2.661 -3.063 -7.242 1.00 0.00 C ATOM 973 CG LYS p 61 -1.287 -2.448 -7.468 1.00 0.00 C ATOM 974 CD LYS p 61 -1.317 -1.382 -8.554 1.00 0.00 C ATOM 975 CE LYS p 61 0.052 -0.750 -8.751 1.00 0.00 C ATOM 976 NZ LYS p 61 0.029 0.317 -9.790 1.00 0.00 N ATOM 0 H LYS p 61 -3.399 -4.252 -5.159 1.00 0.00 H new ATOM 0 HA LYS p 61 -3.015 -1.434 -5.928 1.00 0.00 H new ATOM 0 HB2 LYS p 61 -2.541 -4.125 -7.027 1.00 0.00 H new ATOM 0 HB3 LYS p 61 -3.238 -2.987 -8.164 1.00 0.00 H new ATOM 0 HG2 LYS p 61 -0.928 -2.009 -6.537 1.00 0.00 H new ATOM 0 HG3 LYS p 61 -0.580 -3.230 -7.745 1.00 0.00 H new ATOM 0 HD2 LYS p 61 -1.653 -1.825 -9.491 1.00 0.00 H new ATOM 0 HD3 LYS p 61 -2.040 -0.611 -8.289 1.00 0.00 H new ATOM 0 HE2 LYS p 61 0.396 -0.329 -7.806 1.00 0.00 H new ATOM 0 HE3 LYS p 61 0.769 -1.520 -9.037 1.00 0.00 H new ATOM 0 HZ1 LYS p 61 0.981 0.722 -9.893 1.00 0.00 H new ATOM 0 HZ2 LYS p 61 -0.275 -0.089 -10.698 1.00 0.00 H new ATOM 0 HZ3 LYS p 61 -0.636 1.064 -9.505 1.00 0.00 H new ATOM 990 N TRP p 62 -5.629 -3.358 -6.107 1.00 0.00 N ATOM 991 CA TRP p 62 -7.069 -3.460 -6.257 1.00 0.00 C ATOM 992 C TRP p 62 -7.688 -2.748 -5.073 1.00 0.00 C ATOM 993 O TRP p 62 -8.764 -2.159 -5.176 1.00 0.00 O ATOM 994 CB TRP p 62 -7.509 -4.921 -6.293 1.00 0.00 C ATOM 995 CG TRP p 62 -8.561 -5.203 -7.324 1.00 0.00 C ATOM 996 CD1 TRP p 62 -8.353 -5.611 -8.611 1.00 0.00 C ATOM 997 CD2 TRP p 62 -9.985 -5.096 -7.163 1.00 0.00 C ATOM 998 NE1 TRP p 62 -9.555 -5.766 -9.258 1.00 0.00 N ATOM 999 CE2 TRP p 62 -10.571 -5.456 -8.392 1.00 0.00 C ATOM 1000 CE3 TRP p 62 -10.823 -4.732 -6.100 1.00 0.00 C ATOM 1001 CZ2 TRP p 62 -11.950 -5.464 -8.587 1.00 0.00 C ATOM 1002 CZ3 TRP p 62 -12.191 -4.740 -6.297 1.00 0.00 C ATOM 1003 CH2 TRP p 62 -12.742 -5.105 -7.531 1.00 0.00 C ATOM 0 H TRP p 62 -5.206 -4.189 -5.693 1.00 0.00 H new ATOM 0 HA TRP p 62 -7.390 -3.007 -7.195 1.00 0.00 H new ATOM 0 HB2 TRP p 62 -6.640 -5.549 -6.490 1.00 0.00 H new ATOM 0 HB3 TRP p 62 -7.889 -5.202 -5.311 1.00 0.00 H new ATOM 0 HD1 TRP p 62 -7.384 -5.786 -9.055 1.00 0.00 H new ATOM 0 HE1 TRP p 62 -9.672 -6.064 -10.227 1.00 0.00 H new ATOM 0 HE3 TRP p 62 -10.407 -4.450 -5.144 1.00 0.00 H new ATOM 0 HZ2 TRP p 62 -12.379 -5.744 -9.538 1.00 0.00 H new ATOM 0 HZ3 TRP p 62 -12.846 -4.460 -5.485 1.00 0.00 H new ATOM 0 HH2 TRP p 62 -13.815 -5.103 -7.652 1.00 0.00 H new ATOM 1014 N LYS p 63 -6.966 -2.829 -3.941 1.00 0.00 N ATOM 1015 CA LYS p 63 -7.359 -2.128 -2.707 1.00 0.00 C ATOM 1016 C LYS p 63 -6.890 -0.669 -2.771 1.00 0.00 C ATOM 1017 O LYS p 63 -7.310 0.171 -1.976 1.00 0.00 O ATOM 1018 CB LYS p 63 -6.790 -2.803 -1.462 1.00 0.00 C ATOM 1019 CG LYS p 63 -7.681 -3.899 -0.901 1.00 0.00 C ATOM 1020 CD LYS p 63 -7.187 -4.380 0.454 1.00 0.00 C ATOM 1021 CE LYS p 63 -8.069 -5.487 1.009 1.00 0.00 C ATOM 1022 NZ LYS p 63 -7.590 -5.965 2.334 1.00 0.00 N ATOM 0 H LYS p 63 -6.107 -3.373 -3.856 1.00 0.00 H new ATOM 0 HA LYS p 63 -8.446 -2.166 -2.633 1.00 0.00 H new ATOM 0 HB2 LYS p 63 -5.815 -3.227 -1.703 1.00 0.00 H new ATOM 0 HB3 LYS p 63 -6.628 -2.049 -0.692 1.00 0.00 H new ATOM 0 HG2 LYS p 63 -8.701 -3.527 -0.806 1.00 0.00 H new ATOM 0 HG3 LYS p 63 -7.711 -4.737 -1.597 1.00 0.00 H new ATOM 0 HD2 LYS p 63 -6.163 -4.742 0.361 1.00 0.00 H new ATOM 0 HD3 LYS p 63 -7.168 -3.544 1.153 1.00 0.00 H new ATOM 0 HE2 LYS p 63 -9.092 -5.124 1.102 1.00 0.00 H new ATOM 0 HE3 LYS p 63 -8.090 -6.321 0.308 1.00 0.00 H new ATOM 0 HZ1 LYS p 63 -8.218 -6.719 2.679 1.00 0.00 H new ATOM 0 HZ2 LYS p 63 -6.623 -6.335 2.241 1.00 0.00 H new ATOM 0 HZ3 LYS p 63 -7.594 -5.175 3.010 1.00 0.00 H new ATOM 1036 N LEU p 64 -5.994 -0.413 -3.738 1.00 0.00 N ATOM 1037 CA LEU p 64 -5.413 0.899 -4.018 1.00 0.00 C ATOM 1038 C LEU p 64 -6.357 1.688 -4.912 1.00 0.00 C ATOM 1039 O LEU p 64 -6.495 2.893 -4.799 1.00 0.00 O ATOM 1040 CB LEU p 64 -4.077 0.673 -4.735 1.00 0.00 C ATOM 1041 CG LEU p 64 -3.032 1.794 -4.758 1.00 0.00 C ATOM 1042 CD1 LEU p 64 -1.837 1.279 -5.521 1.00 0.00 C ATOM 1043 CD2 LEU p 64 -3.554 3.060 -5.420 1.00 0.00 C ATOM 0 H LEU p 64 -5.647 -1.140 -4.363 1.00 0.00 H new ATOM 0 HA LEU p 64 -5.257 1.460 -3.097 1.00 0.00 H new ATOM 0 HB2 LEU p 64 -3.608 -0.201 -4.283 1.00 0.00 H new ATOM 0 HB3 LEU p 64 -4.302 0.415 -5.770 1.00 0.00 H new ATOM 0 HG LEU p 64 -2.774 2.060 -3.733 1.00 0.00 H new ATOM 0 HD11 LEU p 64 -1.069 2.052 -5.559 1.00 0.00 H new ATOM 0 HD12 LEU p 64 -1.439 0.396 -5.021 1.00 0.00 H new ATOM 0 HD13 LEU p 64 -2.138 1.017 -6.535 1.00 0.00 H new ATOM 0 HD21 LEU p 64 -2.776 3.823 -5.411 1.00 0.00 H new ATOM 0 HD22 LEU p 64 -3.836 2.842 -6.450 1.00 0.00 H new ATOM 0 HD23 LEU p 64 -4.425 3.423 -4.874 1.00 0.00 H new ATOM 1055 N GLN p 65 -6.933 0.934 -5.824 1.00 0.00 N ATOM 1056 CA GLN p 65 -7.927 1.347 -6.787 1.00 0.00 C ATOM 1057 C GLN p 65 -9.268 1.406 -6.063 1.00 0.00 C ATOM 1058 O GLN p 65 -10.229 2.003 -6.530 1.00 0.00 O ATOM 1059 CB GLN p 65 -7.923 0.301 -7.911 1.00 0.00 C ATOM 1060 CG GLN p 65 -9.233 0.158 -8.656 1.00 0.00 C ATOM 1061 CD GLN p 65 -9.066 0.163 -10.163 1.00 0.00 C ATOM 1062 OE1 GLN p 65 -8.879 -0.883 -10.782 1.00 0.00 O ATOM 1063 NE2 GLN p 65 -9.134 1.347 -10.760 1.00 0.00 N ATOM 0 H GLN p 65 -6.701 -0.055 -5.917 1.00 0.00 H new ATOM 0 HA GLN p 65 -7.728 2.328 -7.219 1.00 0.00 H new ATOM 0 HB2 GLN p 65 -7.142 0.561 -8.626 1.00 0.00 H new ATOM 0 HB3 GLN p 65 -7.657 -0.667 -7.486 1.00 0.00 H new ATOM 0 HG2 GLN p 65 -9.716 -0.771 -8.353 1.00 0.00 H new ATOM 0 HG3 GLN p 65 -9.898 0.972 -8.368 1.00 0.00 H new ATOM 0 HE21 GLN p 65 -9.291 2.189 -10.206 1.00 0.00 H new ATOM 0 HE22 GLN p 65 -9.030 1.414 -11.772 1.00 0.00 H new ATOM 1072 N ALA p 66 -9.258 0.748 -4.907 1.00 0.00 N ATOM 1073 CA ALA p 66 -10.388 0.678 -3.982 1.00 0.00 C ATOM 1074 C ALA p 66 -10.207 1.779 -2.963 1.00 0.00 C ATOM 1075 O ALA p 66 -11.159 2.221 -2.324 1.00 0.00 O ATOM 1076 CB ALA p 66 -10.481 -0.673 -3.296 1.00 0.00 C ATOM 0 H ALA p 66 -8.441 0.234 -4.578 1.00 0.00 H new ATOM 0 HA ALA p 66 -11.319 0.805 -4.535 1.00 0.00 H new ATOM 0 HB1 ALA p 66 -11.335 -0.679 -2.618 1.00 0.00 H new ATOM 0 HB2 ALA p 66 -10.607 -1.454 -4.046 1.00 0.00 H new ATOM 0 HB3 ALA p 66 -9.568 -0.858 -2.730 1.00 0.00 H new ATOM 1082 N LEU p 67 -8.934 2.190 -2.831 1.00 0.00 N ATOM 1083 CA LEU p 67 -8.523 3.287 -1.986 1.00 0.00 C ATOM 1084 C LEU p 67 -8.693 4.538 -2.831 1.00 0.00 C ATOM 1085 O LEU p 67 -9.071 5.592 -2.344 1.00 0.00 O ATOM 1086 CB LEU p 67 -7.057 3.096 -1.531 1.00 0.00 C ATOM 1087 CG LEU p 67 -6.026 4.101 -2.085 1.00 0.00 C ATOM 1088 CD1 LEU p 67 -6.105 5.418 -1.348 1.00 0.00 C ATOM 1089 CD2 LEU p 67 -4.624 3.547 -2.037 1.00 0.00 C ATOM 0 H LEU p 67 -8.158 1.749 -3.326 1.00 0.00 H new ATOM 0 HA LEU p 67 -9.117 3.351 -1.074 1.00 0.00 H new ATOM 0 HB2 LEU p 67 -7.029 3.144 -0.442 1.00 0.00 H new ATOM 0 HB3 LEU p 67 -6.740 2.092 -1.814 1.00 0.00 H new ATOM 0 HG LEU p 67 -6.275 4.276 -3.132 1.00 0.00 H new ATOM 0 HD11 LEU p 67 -5.368 6.109 -1.758 1.00 0.00 H new ATOM 0 HD12 LEU p 67 -7.103 5.841 -1.464 1.00 0.00 H new ATOM 0 HD13 LEU p 67 -5.901 5.255 -0.290 1.00 0.00 H new ATOM 0 HD21 LEU p 67 -3.927 4.285 -2.436 1.00 0.00 H new ATOM 0 HD22 LEU p 67 -4.358 3.318 -1.005 1.00 0.00 H new ATOM 0 HD23 LEU p 67 -4.571 2.638 -2.636 1.00 0.00 H new ATOM 1101 N LYS p 68 -8.323 4.361 -4.106 1.00 0.00 N ATOM 1102 CA LYS p 68 -8.450 5.372 -5.149 1.00 0.00 C ATOM 1103 C LYS p 68 -9.913 5.534 -5.498 1.00 0.00 C ATOM 1104 O LYS p 68 -10.336 6.601 -5.927 1.00 0.00 O ATOM 1105 CB LYS p 68 -7.641 4.990 -6.389 1.00 0.00 C ATOM 1106 CG LYS p 68 -6.532 5.972 -6.739 1.00 0.00 C ATOM 1107 CD LYS p 68 -7.009 7.044 -7.709 1.00 0.00 C ATOM 1108 CE LYS p 68 -5.895 8.020 -8.052 1.00 0.00 C ATOM 1109 NZ LYS p 68 -6.347 9.058 -9.018 1.00 0.00 N ATOM 0 H LYS p 68 -7.918 3.488 -4.443 1.00 0.00 H new ATOM 0 HA LYS p 68 -8.053 6.318 -4.780 1.00 0.00 H new ATOM 0 HB2 LYS p 68 -7.202 4.005 -6.233 1.00 0.00 H new ATOM 0 HB3 LYS p 68 -8.318 4.906 -7.239 1.00 0.00 H new ATOM 0 HG2 LYS p 68 -6.164 6.444 -5.828 1.00 0.00 H new ATOM 0 HG3 LYS p 68 -5.694 5.432 -7.179 1.00 0.00 H new ATOM 0 HD2 LYS p 68 -7.376 6.574 -8.621 1.00 0.00 H new ATOM 0 HD3 LYS p 68 -7.847 7.586 -7.271 1.00 0.00 H new ATOM 0 HE2 LYS p 68 -5.540 8.502 -7.141 1.00 0.00 H new ATOM 0 HE3 LYS p 68 -5.051 7.474 -8.473 1.00 0.00 H new ATOM 0 HZ1 LYS p 68 -5.559 9.704 -9.227 1.00 0.00 H new ATOM 0 HZ2 LYS p 68 -6.662 8.600 -9.897 1.00 0.00 H new ATOM 0 HZ3 LYS p 68 -7.136 9.596 -8.606 1.00 0.00 H new ATOM 1123 N LYS p 69 -10.666 4.431 -5.336 1.00 0.00 N ATOM 1124 CA LYS p 69 -12.114 4.452 -5.507 1.00 0.00 C ATOM 1125 C LYS p 69 -12.716 4.966 -4.206 1.00 0.00 C ATOM 1126 O LYS p 69 -13.878 5.368 -4.149 1.00 0.00 O ATOM 1127 CB LYS p 69 -12.665 3.072 -5.841 1.00 0.00 C ATOM 1128 CG LYS p 69 -13.014 2.894 -7.307 1.00 0.00 C ATOM 1129 CD LYS p 69 -14.030 1.782 -7.510 1.00 0.00 C ATOM 1130 CE LYS p 69 -14.381 1.611 -8.979 1.00 0.00 C ATOM 1131 NZ LYS p 69 -15.379 0.526 -9.190 1.00 0.00 N ATOM 0 H LYS p 69 -10.287 3.517 -5.087 1.00 0.00 H new ATOM 0 HA LYS p 69 -12.376 5.100 -6.343 1.00 0.00 H new ATOM 0 HB2 LYS p 69 -11.930 2.319 -5.557 1.00 0.00 H new ATOM 0 HB3 LYS p 69 -13.556 2.891 -5.240 1.00 0.00 H new ATOM 0 HG2 LYS p 69 -13.413 3.828 -7.703 1.00 0.00 H new ATOM 0 HG3 LYS p 69 -12.110 2.669 -7.872 1.00 0.00 H new ATOM 0 HD2 LYS p 69 -13.630 0.846 -7.119 1.00 0.00 H new ATOM 0 HD3 LYS p 69 -14.933 2.005 -6.942 1.00 0.00 H new ATOM 0 HE2 LYS p 69 -14.777 2.549 -9.369 1.00 0.00 H new ATOM 0 HE3 LYS p 69 -13.476 1.387 -9.544 1.00 0.00 H new ATOM 0 HZ1 LYS p 69 -15.591 0.442 -10.205 1.00 0.00 H new ATOM 0 HZ2 LYS p 69 -14.992 -0.374 -8.841 1.00 0.00 H new ATOM 0 HZ3 LYS p 69 -16.252 0.752 -8.671 1.00 0.00 H new ATOM 1145 N LYS p 70 -11.868 4.918 -3.162 1.00 0.00 N ATOM 1146 CA LYS p 70 -12.181 5.426 -1.834 1.00 0.00 C ATOM 1147 C LYS p 70 -11.694 6.864 -1.770 1.00 0.00 C ATOM 1148 O LYS p 70 -12.147 7.657 -0.948 1.00 0.00 O ATOM 1149 CB LYS p 70 -11.507 4.593 -0.750 1.00 0.00 C ATOM 1150 CG LYS p 70 -12.475 3.835 0.149 1.00 0.00 C ATOM 1151 CD LYS p 70 -12.433 4.355 1.579 1.00 0.00 C ATOM 1152 CE LYS p 70 -13.388 3.591 2.486 1.00 0.00 C ATOM 1153 NZ LYS p 70 -14.813 3.950 2.232 1.00 0.00 N ATOM 0 H LYS p 70 -10.933 4.516 -3.230 1.00 0.00 H new ATOM 0 HA LYS p 70 -13.255 5.370 -1.659 1.00 0.00 H new ATOM 0 HB2 LYS p 70 -10.833 3.879 -1.223 1.00 0.00 H new ATOM 0 HB3 LYS p 70 -10.893 5.249 -0.132 1.00 0.00 H new ATOM 0 HG2 LYS p 70 -13.487 3.929 -0.244 1.00 0.00 H new ATOM 0 HG3 LYS p 70 -12.227 2.774 0.139 1.00 0.00 H new ATOM 0 HD2 LYS p 70 -11.418 4.271 1.967 1.00 0.00 H new ATOM 0 HD3 LYS p 70 -12.691 5.414 1.589 1.00 0.00 H new ATOM 0 HE2 LYS p 70 -13.252 2.520 2.334 1.00 0.00 H new ATOM 0 HE3 LYS p 70 -13.142 3.799 3.527 1.00 0.00 H new ATOM 0 HZ1 LYS p 70 -15.412 3.540 2.977 1.00 0.00 H new ATOM 0 HZ2 LYS p 70 -14.916 4.985 2.235 1.00 0.00 H new ATOM 0 HZ3 LYS p 70 -15.106 3.576 1.307 1.00 0.00 H new ATOM 1167 N ASN p 71 -10.724 7.148 -2.657 1.00 0.00 N ATOM 1168 CA ASN p 71 -10.145 8.481 -2.837 1.00 0.00 C ATOM 1169 C ASN p 71 -10.969 9.203 -3.901 1.00 0.00 C ATOM 1170 O ASN p 71 -10.862 10.411 -4.079 1.00 0.00 O ATOM 1171 CB ASN p 71 -8.676 8.406 -3.265 1.00 0.00 C ATOM 1172 CG ASN p 71 -7.869 9.599 -2.786 1.00 0.00 C ATOM 1173 OD1 ASN p 71 -7.293 9.577 -1.698 1.00 0.00 O ATOM 1174 ND2 ASN p 71 -7.825 10.648 -3.598 1.00 0.00 N ATOM 0 H ASN p 71 -10.318 6.445 -3.275 1.00 0.00 H new ATOM 0 HA ASN p 71 -10.172 9.021 -1.890 1.00 0.00 H new ATOM 0 HB2 ASN p 71 -8.233 7.491 -2.873 1.00 0.00 H new ATOM 0 HB3 ASN p 71 -8.620 8.347 -4.352 1.00 0.00 H new ATOM 0 HD21 ASN p 71 -7.299 11.479 -3.329 1.00 0.00 H new ATOM 0 HD22 ASN p 71 -8.318 10.623 -4.491 1.00 0.00 H new ATOM 1181 N ALA p 72 -11.761 8.384 -4.614 1.00 0.00 N ATOM 1182 CA ALA p 72 -12.709 8.813 -5.635 1.00 0.00 C ATOM 1183 C ALA p 72 -14.029 8.985 -4.927 1.00 0.00 C ATOM 1184 O ALA p 72 -14.926 9.683 -5.391 1.00 0.00 O ATOM 1185 CB ALA p 72 -12.837 7.795 -6.761 1.00 0.00 C ATOM 0 H ALA p 72 -11.752 7.372 -4.485 1.00 0.00 H new ATOM 0 HA ALA p 72 -12.372 9.737 -6.104 1.00 0.00 H new ATOM 0 HB1 ALA p 72 -13.554 8.156 -7.499 1.00 0.00 H new ATOM 0 HB2 ALA p 72 -11.866 7.655 -7.237 1.00 0.00 H new ATOM 0 HB3 ALA p 72 -13.183 6.845 -6.355 1.00 0.00 H new ATOM 1191 N GLN p 73 -14.097 8.286 -3.780 1.00 0.00 N ATOM 1192 CA GLN p 73 -15.186 8.311 -2.858 1.00 0.00 C ATOM 1193 C GLN p 73 -14.961 9.513 -1.970 1.00 0.00 C ATOM 1194 O GLN p 73 -15.888 10.170 -1.518 1.00 0.00 O ATOM 1195 CB GLN p 73 -15.096 7.043 -2.051 1.00 0.00 C ATOM 1196 CG GLN p 73 -16.208 6.861 -1.080 1.00 0.00 C ATOM 1197 CD GLN p 73 -17.103 5.679 -1.399 1.00 0.00 C ATOM 1198 OE1 GLN p 73 -18.089 5.810 -2.122 1.00 0.00 O ATOM 1199 NE2 GLN p 73 -16.761 4.516 -0.856 1.00 0.00 N ATOM 0 H GLN p 73 -13.344 7.666 -3.480 1.00 0.00 H new ATOM 0 HA GLN p 73 -16.163 8.376 -3.338 1.00 0.00 H new ATOM 0 HB2 GLN p 73 -15.080 6.192 -2.732 1.00 0.00 H new ATOM 0 HB3 GLN p 73 -14.150 7.036 -1.509 1.00 0.00 H new ATOM 0 HG2 GLN p 73 -15.790 6.731 -0.082 1.00 0.00 H new ATOM 0 HG3 GLN p 73 -16.812 7.768 -1.057 1.00 0.00 H new ATOM 0 HE21 GLN p 73 -15.934 4.454 -0.262 1.00 0.00 H new ATOM 0 HE22 GLN p 73 -17.325 3.685 -1.033 1.00 0.00 H new ATOM 1208 N LEU p 74 -13.669 9.708 -1.716 1.00 0.00 N ATOM 1209 CA LEU p 74 -13.138 10.832 -0.958 1.00 0.00 C ATOM 1210 C LEU p 74 -13.138 12.050 -1.862 1.00 0.00 C ATOM 1211 O LEU p 74 -13.258 13.161 -1.411 1.00 0.00 O ATOM 1212 CB LEU p 74 -11.719 10.531 -0.481 1.00 0.00 C ATOM 1213 CG LEU p 74 -11.178 11.378 0.677 1.00 0.00 C ATOM 1214 CD1 LEU p 74 -11.781 10.963 2.016 1.00 0.00 C ATOM 1215 CD2 LEU p 74 -9.672 11.242 0.705 1.00 0.00 C ATOM 0 H LEU p 74 -12.944 9.069 -2.042 1.00 0.00 H new ATOM 0 HA LEU p 74 -13.756 11.014 -0.078 1.00 0.00 H new ATOM 0 HB2 LEU p 74 -11.677 9.484 -0.182 1.00 0.00 H new ATOM 0 HB3 LEU p 74 -11.045 10.648 -1.329 1.00 0.00 H new ATOM 0 HG LEU p 74 -11.460 12.419 0.517 1.00 0.00 H new ATOM 0 HD11 LEU p 74 -11.371 11.588 2.809 1.00 0.00 H new ATOM 0 HD12 LEU p 74 -12.864 11.085 1.981 1.00 0.00 H new ATOM 0 HD13 LEU p 74 -11.540 9.919 2.216 1.00 0.00 H new ATOM 0 HD21 LEU p 74 -9.268 11.838 1.523 1.00 0.00 H new ATOM 0 HD22 LEU p 74 -9.404 10.196 0.852 1.00 0.00 H new ATOM 0 HD23 LEU p 74 -9.257 11.594 -0.240 1.00 0.00 H new ATOM 1227 N LYS p 75 -13.020 11.786 -3.160 1.00 0.00 N ATOM 1228 CA LYS p 75 -13.066 12.811 -4.199 1.00 0.00 C ATOM 1229 C LYS p 75 -14.526 13.077 -4.466 1.00 0.00 C ATOM 1230 O LYS p 75 -14.916 14.119 -5.001 1.00 0.00 O ATOM 1231 CB LYS p 75 -12.377 12.334 -5.473 1.00 0.00 C ATOM 1232 CG LYS p 75 -11.216 13.204 -5.924 1.00 0.00 C ATOM 1233 CD LYS p 75 -11.547 13.959 -7.202 1.00 0.00 C ATOM 1234 CE LYS p 75 -10.384 14.830 -7.650 1.00 0.00 C ATOM 1235 NZ LYS p 75 -10.694 15.567 -8.906 1.00 0.00 N ATOM 0 H LYS p 75 -12.888 10.843 -3.525 1.00 0.00 H new ATOM 0 HA LYS p 75 -12.545 13.712 -3.875 1.00 0.00 H new ATOM 0 HB2 LYS p 75 -12.014 11.318 -5.316 1.00 0.00 H new ATOM 0 HB3 LYS p 75 -13.114 12.289 -6.275 1.00 0.00 H new ATOM 0 HG2 LYS p 75 -10.965 13.914 -5.136 1.00 0.00 H new ATOM 0 HG3 LYS p 75 -10.336 12.582 -6.086 1.00 0.00 H new ATOM 0 HD2 LYS p 75 -11.797 13.250 -7.991 1.00 0.00 H new ATOM 0 HD3 LYS p 75 -12.428 14.580 -7.041 1.00 0.00 H new ATOM 0 HE2 LYS p 75 -10.139 15.542 -6.862 1.00 0.00 H new ATOM 0 HE3 LYS p 75 -9.502 14.208 -7.802 1.00 0.00 H new ATOM 0 HZ1 LYS p 75 -9.876 16.149 -9.178 1.00 0.00 H new ATOM 0 HZ2 LYS p 75 -10.903 14.887 -9.665 1.00 0.00 H new ATOM 0 HZ3 LYS p 75 -11.520 16.180 -8.754 1.00 0.00 H new ATOM 1249 N LYS p 76 -15.318 12.074 -4.065 1.00 0.00 N ATOM 1250 CA LYS p 76 -16.768 12.136 -4.151 1.00 0.00 C ATOM 1251 C LYS p 76 -17.287 12.742 -2.868 1.00 0.00 C ATOM 1252 O LYS p 76 -18.304 13.440 -2.856 1.00 0.00 O ATOM 1253 CB LYS p 76 -17.366 10.752 -4.363 1.00 0.00 C ATOM 1254 CG LYS p 76 -17.847 10.493 -5.783 1.00 0.00 C ATOM 1255 CD LYS p 76 -19.328 10.812 -5.946 1.00 0.00 C ATOM 1256 CE LYS p 76 -19.817 10.522 -7.359 1.00 0.00 C ATOM 1257 NZ LYS p 76 -19.919 9.058 -7.630 1.00 0.00 N ATOM 0 H LYS p 76 -14.964 11.201 -3.673 1.00 0.00 H new ATOM 0 HA LYS p 76 -17.058 12.748 -5.005 1.00 0.00 H new ATOM 0 HB2 LYS p 76 -16.620 10.002 -4.101 1.00 0.00 H new ATOM 0 HB3 LYS p 76 -18.204 10.621 -3.678 1.00 0.00 H new ATOM 0 HG2 LYS p 76 -17.266 11.098 -6.479 1.00 0.00 H new ATOM 0 HG3 LYS p 76 -17.669 9.449 -6.042 1.00 0.00 H new ATOM 0 HD2 LYS p 76 -19.907 10.225 -5.233 1.00 0.00 H new ATOM 0 HD3 LYS p 76 -19.502 11.862 -5.709 1.00 0.00 H new ATOM 0 HE2 LYS p 76 -20.792 10.986 -7.507 1.00 0.00 H new ATOM 0 HE3 LYS p 76 -19.135 10.976 -8.078 1.00 0.00 H new ATOM 0 HZ1 LYS p 76 -20.287 8.908 -8.591 1.00 0.00 H new ATOM 0 HZ2 LYS p 76 -18.978 8.623 -7.548 1.00 0.00 H new ATOM 0 HZ3 LYS p 76 -20.563 8.621 -6.940 1.00 0.00 H new ATOM 1271 N LYS p 77 -16.557 12.455 -1.784 1.00 0.00 N ATOM 1272 CA LYS p 77 -16.876 13.005 -0.472 1.00 0.00 C ATOM 1273 C LYS p 77 -16.214 14.367 -0.304 1.00 0.00 C ATOM 1274 O LYS p 77 -16.603 15.153 0.564 1.00 0.00 O ATOM 1275 CB LYS p 77 -16.427 12.056 0.635 1.00 0.00 C ATOM 1276 CG LYS p 77 -17.560 11.276 1.290 1.00 0.00 C ATOM 1277 CD LYS p 77 -18.118 12.002 2.507 1.00 0.00 C ATOM 1278 CE LYS p 77 -19.222 11.200 3.176 1.00 0.00 C ATOM 1279 NZ LYS p 77 -19.774 11.901 4.368 1.00 0.00 N ATOM 0 H LYS p 77 -15.741 11.843 -1.795 1.00 0.00 H new ATOM 0 HA LYS p 77 -17.957 13.125 -0.399 1.00 0.00 H new ATOM 0 HB2 LYS p 77 -15.707 11.350 0.222 1.00 0.00 H new ATOM 0 HB3 LYS p 77 -15.907 12.631 1.401 1.00 0.00 H new ATOM 0 HG2 LYS p 77 -18.358 11.116 0.565 1.00 0.00 H new ATOM 0 HG3 LYS p 77 -17.199 10.292 1.588 1.00 0.00 H new ATOM 0 HD2 LYS p 77 -17.316 12.186 3.222 1.00 0.00 H new ATOM 0 HD3 LYS p 77 -18.505 12.975 2.206 1.00 0.00 H new ATOM 0 HE2 LYS p 77 -20.023 11.017 2.460 1.00 0.00 H new ATOM 0 HE3 LYS p 77 -18.833 10.227 3.475 1.00 0.00 H new ATOM 0 HZ1 LYS p 77 -20.524 11.321 4.795 1.00 0.00 H new ATOM 0 HZ2 LYS p 77 -19.016 12.053 5.063 1.00 0.00 H new ATOM 0 HZ3 LYS p 77 -20.168 12.819 4.079 1.00 0.00 H new ATOM 1293 N LEU p 78 -15.201 14.628 -1.151 1.00 0.00 N ATOM 1294 CA LEU p 78 -14.471 15.907 -1.148 1.00 0.00 C ATOM 1295 C LEU p 78 -15.393 17.109 -1.345 1.00 0.00 C ATOM 1296 O LEU p 78 -15.477 17.999 -0.494 1.00 0.00 O ATOM 1297 CB LEU p 78 -13.422 15.890 -2.267 1.00 0.00 C ATOM 1298 CG LEU p 78 -11.958 15.856 -1.829 1.00 0.00 C ATOM 1299 CD1 LEU p 78 -11.067 15.662 -3.040 1.00 0.00 C ATOM 1300 CD2 LEU p 78 -11.584 17.133 -1.099 1.00 0.00 C ATOM 0 H LEU p 78 -14.869 13.964 -1.850 1.00 0.00 H new ATOM 0 HA LEU p 78 -13.999 16.012 -0.171 1.00 0.00 H new ATOM 0 HB2 LEU p 78 -13.610 15.021 -2.897 1.00 0.00 H new ATOM 0 HB3 LEU p 78 -13.572 16.773 -2.888 1.00 0.00 H new ATOM 0 HG LEU p 78 -11.818 15.021 -1.143 1.00 0.00 H new ATOM 0 HD11 LEU p 78 -10.024 15.638 -2.724 1.00 0.00 H new ATOM 0 HD12 LEU p 78 -11.319 14.722 -3.530 1.00 0.00 H new ATOM 0 HD13 LEU p 78 -11.216 16.486 -3.737 1.00 0.00 H new ATOM 0 HD21 LEU p 78 -10.538 17.086 -0.797 1.00 0.00 H new ATOM 0 HD22 LEU p 78 -11.733 17.987 -1.760 1.00 0.00 H new ATOM 0 HD23 LEU p 78 -12.212 17.244 -0.215 1.00 0.00 H new ATOM 1312 N GLN p 79 -16.071 17.101 -2.483 1.00 0.00 N ATOM 1313 CA GLN p 79 -17.016 18.144 -2.872 1.00 0.00 C ATOM 1314 C GLN p 79 -18.393 17.935 -2.244 1.00 0.00 C ATOM 1315 O GLN p 79 -19.036 18.887 -1.793 1.00 0.00 O ATOM 1316 CB GLN p 79 -17.138 18.199 -4.405 1.00 0.00 C ATOM 1317 CG GLN p 79 -17.072 16.849 -5.120 1.00 0.00 C ATOM 1318 CD GLN p 79 -17.209 16.981 -6.625 1.00 0.00 C ATOM 1319 OE1 GLN p 79 -18.315 16.945 -7.165 1.00 0.00 O ATOM 1320 NE2 GLN p 79 -16.081 17.134 -7.311 1.00 0.00 N ATOM 0 H GLN p 79 -15.980 16.358 -3.176 1.00 0.00 H new ATOM 0 HA GLN p 79 -16.628 19.093 -2.501 1.00 0.00 H new ATOM 0 HB2 GLN p 79 -18.083 18.679 -4.660 1.00 0.00 H new ATOM 0 HB3 GLN p 79 -16.342 18.835 -4.793 1.00 0.00 H new ATOM 0 HG2 GLN p 79 -16.125 16.364 -4.886 1.00 0.00 H new ATOM 0 HG3 GLN p 79 -17.864 16.202 -4.742 1.00 0.00 H new ATOM 0 HE21 GLN p 79 -15.186 17.158 -6.822 1.00 0.00 H new ATOM 0 HE22 GLN p 79 -16.110 17.227 -8.326 1.00 0.00 H new ATOM 1329 N ALA p 80 -18.819 16.681 -2.228 1.00 0.00 N ATOM 1330 CA ALA p 80 -20.115 16.292 -1.669 1.00 0.00 C ATOM 1331 C ALA p 80 -19.973 15.793 -0.230 1.00 0.00 C ATOM 1332 O ALA p 80 -20.552 16.431 0.673 1.00 0.00 O ATOM 1333 CB ALA p 80 -20.774 15.234 -2.546 1.00 0.00 C ATOM 1334 OXT ALA p 80 -19.275 14.776 -0.017 1.00 0.00 O ATOM 0 H ALA p 80 -18.279 15.900 -2.601 1.00 0.00 H new ATOM 0 HA ALA p 80 -20.754 17.175 -1.650 1.00 0.00 H new ATOM 0 HB1 ALA p 80 -21.737 14.955 -2.118 1.00 0.00 H new ATOM 0 HB2 ALA p 80 -20.925 15.635 -3.548 1.00 0.00 H new ATOM 0 HB3 ALA p 80 -20.132 14.355 -2.600 1.00 0.00 H new TER 1340 ALA p 80