USER MOD reduce.3.24.130724 H: found=0, std=0, add=879, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 883 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: B 468 ASN : amide:sc= 2.41 K(o=1.5,f=-0.35) USER MOD Set 1.2: B 472 GLN : amide:sc= -0.952 K(o=1.5,f=2.1) USER MOD Set 2.1: A 143 CYS SG : rot -5:sc= -1.3! USER MOD Set 2.2: B 473 CYS SG : rot 56:sc= 1.18 USER MOD Set 3.1: A 116 ASN : amide:sc= -0.377 K(o=-0.4,f=-2.3!) USER MOD Set 3.2: A 119 GLN : amide:sc= -0.0282 K(o=-0.4,f=-1.1) USER MOD Single : A 83 HIS : no HD1:sc= 0 X(o=0,f=-0.00035) USER MOD Single : A 84 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 GLN : amide:sc= -0.93 K(o=-0.93,f=0) USER MOD Single : A 91 ASN : amide:sc= 0.365 K(o=0.37,f=-4.5!) USER MOD Single : A 93 LYS NZ :NH3+ -163:sc= -0.0189 (180deg=-0.203) USER MOD Single : A 94 ASN : amide:sc= -0.337 X(o=-0.34,f=-0.016) USER MOD Single : A 98 SER OG : rot 78:sc= 1.27 USER MOD Single : A 100 THR OG1 : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 94:sc= 1.26 USER MOD Single : A 107 ASN : amide:sc= 0 K(o=0,f=-0.67) USER MOD Single : A 109 HIS : no HD1:sc= -0.769 K(o=-0.77,f=-6.2!) USER MOD Single : A 112 GLN : amide:sc= -1.33! K(o=-1.3!,f=-0.71) USER MOD Single : A 114 MET CE :methyl 170:sc= -0.621 (180deg=-0.992) USER MOD Single : A 123 LYS NZ :NH3+ 162:sc= 0.651 (180deg=0.481) USER MOD Single : A 125 LYS NZ :NH3+ 162:sc= 1.26 (180deg=1.11) USER MOD Single : A 127 MET CE :methyl 167:sc= -1.18 (180deg=-1.62) USER MOD Single : A 130 TYR OH : rot 18:sc= 0.441 USER MOD Single : A 131 MET CE :methyl 153:sc= -4.61! (180deg=-5.2!) USER MOD Single : A 132 GLN : amide:sc= 0 X(o=0,f=-0.29) USER MOD Single : A 142 CYS SG : rot 87:sc= -0.801 USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 GLN : amide:sc= 0 K(o=0,f=-0.62) USER MOD Single : A 152 ASN : amide:sc= 0 K(o=0,f=-0.76) USER MOD Single : A 155 SER OG : rot 180:sc= 0 USER MOD Single : B 465 HIS : no HD1:sc= -1.07 X(o=-1.1,f=-0.75) USER MOD Single : B 476 TYR OH : rot 180:sc= 0.00034 USER MOD Single : B 479 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0223) USER MOD Single : B 480 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 487 THR OG1 : rot -43:sc= 0.693 USER MOD Single : B 488 ASN : amide:sc= -0.827 K(o=-0.83,f=-4.1!) USER MOD Single : B 489 SER OG : rot 180:sc= -0.0664 USER MOD Single : B 491 LYS NZ :NH3+ 168:sc= 2.2 (180deg=1.67) USER MOD Single : B 492 SER OG : rot 180:sc= 0 USER MOD Single : B 493 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 81 -1.756 -16.824 3.593 1.00 0.00 N ATOM 2 CA GLY A 81 -0.974 -17.578 4.603 1.00 0.00 C ATOM 3 C GLY A 81 0.242 -16.805 5.063 1.00 0.00 C ATOM 4 O GLY A 81 0.395 -15.642 4.703 1.00 0.00 O ATOM 0 HA2 GLY A 81 -1.608 -17.802 5.461 1.00 0.00 H new ATOM 0 HA3 GLY A 81 -0.660 -18.533 4.181 1.00 0.00 H new ATOM 10 N PRO A 82 1.130 -17.435 5.854 1.00 0.00 N ATOM 11 CA PRO A 82 2.346 -16.791 6.373 1.00 0.00 C ATOM 12 C PRO A 82 3.132 -16.066 5.284 1.00 0.00 C ATOM 13 O PRO A 82 3.615 -16.694 4.339 1.00 0.00 O ATOM 14 CB PRO A 82 3.155 -17.963 6.925 1.00 0.00 C ATOM 15 CG PRO A 82 2.133 -18.973 7.307 1.00 0.00 C ATOM 16 CD PRO A 82 1.017 -18.834 6.308 1.00 0.00 C ATOM 0 HA PRO A 82 2.117 -16.024 7.113 1.00 0.00 H new ATOM 0 HB2 PRO A 82 3.843 -18.358 6.177 1.00 0.00 H new ATOM 0 HB3 PRO A 82 3.756 -17.662 7.783 1.00 0.00 H new ATOM 0 HG2 PRO A 82 2.552 -19.979 7.286 1.00 0.00 H new ATOM 0 HG3 PRO A 82 1.773 -18.799 8.321 1.00 0.00 H new ATOM 0 HD2 PRO A 82 1.130 -19.534 5.481 1.00 0.00 H new ATOM 0 HD3 PRO A 82 0.046 -19.031 6.762 1.00 0.00 H new ATOM 24 N HIS A 83 3.225 -14.740 5.422 1.00 0.00 N ATOM 25 CA HIS A 83 3.891 -13.863 4.448 1.00 0.00 C ATOM 26 C HIS A 83 3.069 -13.720 3.166 1.00 0.00 C ATOM 27 O HIS A 83 2.850 -12.607 2.679 1.00 0.00 O ATOM 28 CB HIS A 83 5.310 -14.349 4.116 1.00 0.00 C ATOM 29 CG HIS A 83 6.286 -14.176 5.239 1.00 0.00 C ATOM 30 ND1 HIS A 83 7.160 -13.117 5.270 1.00 0.00 N ATOM 31 CD2 HIS A 83 6.482 -14.943 6.338 1.00 0.00 C ATOM 32 CE1 HIS A 83 7.862 -13.260 6.382 1.00 0.00 C ATOM 33 NE2 HIS A 83 7.488 -14.353 7.060 1.00 0.00 N ATOM 0 H HIS A 83 2.837 -14.238 6.220 1.00 0.00 H new ATOM 0 HA HIS A 83 3.971 -12.882 4.917 1.00 0.00 H new ATOM 0 HB2 HIS A 83 5.268 -15.403 3.842 1.00 0.00 H new ATOM 0 HB3 HIS A 83 5.675 -13.807 3.243 1.00 0.00 H new ATOM 0 HD2 HIS A 83 5.949 -15.846 6.596 1.00 0.00 H new ATOM 0 HE1 HIS A 83 8.638 -12.581 6.703 1.00 0.00 H new ATOM 0 HE2 HIS A 83 7.877 -14.683 7.943 1.00 0.00 H new ATOM 41 N MET A 84 2.601 -14.839 2.633 1.00 0.00 N ATOM 42 CA MET A 84 1.841 -14.840 1.393 1.00 0.00 C ATOM 43 C MET A 84 0.359 -14.598 1.647 1.00 0.00 C ATOM 44 O MET A 84 -0.461 -15.509 1.550 1.00 0.00 O ATOM 45 CB MET A 84 2.038 -16.154 0.637 1.00 0.00 C ATOM 46 CG MET A 84 3.435 -16.325 0.067 1.00 0.00 C ATOM 47 SD MET A 84 3.874 -15.009 -1.084 1.00 0.00 S ATOM 48 CE MET A 84 5.543 -15.493 -1.517 1.00 0.00 C ATOM 0 H MET A 84 2.736 -15.763 3.043 1.00 0.00 H new ATOM 0 HA MET A 84 2.217 -14.021 0.779 1.00 0.00 H new ATOM 0 HB2 MET A 84 1.825 -16.985 1.309 1.00 0.00 H new ATOM 0 HB3 MET A 84 1.314 -16.208 -0.176 1.00 0.00 H new ATOM 0 HG2 MET A 84 4.157 -16.346 0.883 1.00 0.00 H new ATOM 0 HG3 MET A 84 3.501 -17.286 -0.442 1.00 0.00 H new ATOM 0 HE1 MET A 84 5.957 -14.776 -2.226 1.00 0.00 H new ATOM 0 HE2 MET A 84 6.160 -15.514 -0.619 1.00 0.00 H new ATOM 0 HE3 MET A 84 5.528 -16.484 -1.970 1.00 0.00 H new ATOM 58 N ASP A 85 0.036 -13.365 2.003 1.00 0.00 N ATOM 59 CA ASP A 85 -1.351 -12.919 2.083 1.00 0.00 C ATOM 60 C ASP A 85 -1.580 -11.837 1.044 1.00 0.00 C ATOM 61 O ASP A 85 -2.461 -10.988 1.184 1.00 0.00 O ATOM 62 CB ASP A 85 -1.694 -12.379 3.479 1.00 0.00 C ATOM 63 CG ASP A 85 -1.897 -13.471 4.511 1.00 0.00 C ATOM 64 OD1 ASP A 85 -1.291 -13.390 5.598 1.00 0.00 O ATOM 65 OD2 ASP A 85 -2.674 -14.413 4.239 1.00 0.00 O ATOM 0 H ASP A 85 0.720 -12.648 2.244 1.00 0.00 H new ATOM 0 HA ASP A 85 -2.000 -13.774 1.892 1.00 0.00 H new ATOM 0 HB2 ASP A 85 -0.894 -11.718 3.812 1.00 0.00 H new ATOM 0 HB3 ASP A 85 -2.600 -11.776 3.415 1.00 0.00 H new ATOM 70 N ARG A 86 -0.771 -11.883 -0.004 1.00 0.00 N ATOM 71 CA ARG A 86 -0.763 -10.845 -1.020 1.00 0.00 C ATOM 72 C ARG A 86 -1.963 -10.956 -1.954 1.00 0.00 C ATOM 73 O ARG A 86 -2.604 -12.002 -2.051 1.00 0.00 O ATOM 74 CB ARG A 86 0.557 -10.875 -1.810 1.00 0.00 C ATOM 75 CG ARG A 86 0.957 -12.242 -2.366 1.00 0.00 C ATOM 76 CD ARG A 86 0.150 -12.632 -3.597 1.00 0.00 C ATOM 77 NE ARG A 86 0.215 -11.612 -4.649 1.00 0.00 N ATOM 78 CZ ARG A 86 0.723 -11.817 -5.866 1.00 0.00 C ATOM 79 NH1 ARG A 86 1.239 -12.996 -6.195 1.00 0.00 N ATOM 80 NH2 ARG A 86 0.709 -10.832 -6.757 1.00 0.00 N ATOM 0 H ARG A 86 -0.105 -12.637 -0.172 1.00 0.00 H new ATOM 0 HA ARG A 86 -0.841 -9.884 -0.512 1.00 0.00 H new ATOM 0 HB2 ARG A 86 0.480 -10.172 -2.640 1.00 0.00 H new ATOM 0 HB3 ARG A 86 1.357 -10.517 -1.162 1.00 0.00 H new ATOM 0 HG2 ARG A 86 2.017 -12.231 -2.619 1.00 0.00 H new ATOM 0 HG3 ARG A 86 0.822 -12.998 -1.593 1.00 0.00 H new ATOM 0 HD2 ARG A 86 0.522 -13.579 -3.988 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -0.890 -12.792 -3.312 1.00 0.00 H new ATOM 0 HE ARG A 86 -0.152 -10.685 -4.436 1.00 0.00 H new ATOM 0 HH11 ARG A 86 1.250 -13.756 -5.515 1.00 0.00 H new ATOM 0 HH12 ARG A 86 1.625 -13.142 -7.128 1.00 0.00 H new ATOM 0 HH21 ARG A 86 0.312 -9.926 -6.509 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.096 -10.982 -7.689 1.00 0.00 H new ATOM 94 N VAL A 87 -2.255 -9.861 -2.632 1.00 0.00 N ATOM 95 CA VAL A 87 -3.358 -9.808 -3.570 1.00 0.00 C ATOM 96 C VAL A 87 -2.811 -9.782 -5.000 1.00 0.00 C ATOM 97 O VAL A 87 -1.648 -9.422 -5.217 1.00 0.00 O ATOM 98 CB VAL A 87 -4.246 -8.571 -3.290 1.00 0.00 C ATOM 99 CG1 VAL A 87 -3.473 -7.280 -3.511 1.00 0.00 C ATOM 100 CG2 VAL A 87 -5.515 -8.596 -4.130 1.00 0.00 C ATOM 0 H VAL A 87 -1.736 -8.987 -2.548 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.979 -10.696 -3.450 1.00 0.00 H new ATOM 0 HB VAL A 87 -4.542 -8.611 -2.242 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -4.122 -6.428 -3.307 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -2.614 -7.251 -2.841 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -3.128 -7.235 -4.544 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -6.115 -7.714 -3.909 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -5.251 -8.600 -5.188 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -6.089 -9.493 -3.896 1.00 0.00 H new ATOM 110 N SER A 88 -3.638 -10.184 -5.957 1.00 0.00 N ATOM 111 CA SER A 88 -3.231 -10.281 -7.354 1.00 0.00 C ATOM 112 C SER A 88 -2.873 -8.907 -7.924 1.00 0.00 C ATOM 113 O SER A 88 -3.455 -7.887 -7.547 1.00 0.00 O ATOM 114 CB SER A 88 -4.364 -10.915 -8.163 1.00 0.00 C ATOM 115 OG SER A 88 -4.817 -12.111 -7.544 1.00 0.00 O ATOM 0 H SER A 88 -4.608 -10.452 -5.788 1.00 0.00 H new ATOM 0 HA SER A 88 -2.340 -10.905 -7.418 1.00 0.00 H new ATOM 0 HB2 SER A 88 -5.191 -10.211 -8.253 1.00 0.00 H new ATOM 0 HB3 SER A 88 -4.018 -11.132 -9.174 1.00 0.00 H new ATOM 0 HG SER A 88 -5.543 -12.500 -8.076 1.00 0.00 H new ATOM 121 N LEU A 89 -1.915 -8.908 -8.849 1.00 0.00 N ATOM 122 CA LEU A 89 -1.369 -7.685 -9.422 1.00 0.00 C ATOM 123 C LEU A 89 -2.422 -6.985 -10.268 1.00 0.00 C ATOM 124 O LEU A 89 -2.441 -5.761 -10.369 1.00 0.00 O ATOM 125 CB LEU A 89 -0.145 -8.016 -10.288 1.00 0.00 C ATOM 126 CG LEU A 89 1.068 -7.089 -10.123 1.00 0.00 C ATOM 127 CD1 LEU A 89 0.691 -5.631 -10.349 1.00 0.00 C ATOM 128 CD2 LEU A 89 1.703 -7.278 -8.753 1.00 0.00 C ATOM 0 H LEU A 89 -1.496 -9.760 -9.221 1.00 0.00 H new ATOM 0 HA LEU A 89 -1.068 -7.021 -8.611 1.00 0.00 H new ATOM 0 HB2 LEU A 89 0.169 -9.035 -10.064 1.00 0.00 H new ATOM 0 HB3 LEU A 89 -0.450 -7.999 -11.334 1.00 0.00 H new ATOM 0 HG LEU A 89 1.800 -7.360 -10.884 1.00 0.00 H new ATOM 0 HD11 LEU A 89 1.573 -5.003 -10.224 1.00 0.00 H new ATOM 0 HD12 LEU A 89 0.299 -5.509 -11.359 1.00 0.00 H new ATOM 0 HD13 LEU A 89 -0.069 -5.336 -9.626 1.00 0.00 H new ATOM 0 HD21 LEU A 89 2.561 -6.613 -8.655 1.00 0.00 H new ATOM 0 HD22 LEU A 89 0.973 -7.045 -7.978 1.00 0.00 H new ATOM 0 HD23 LEU A 89 2.031 -8.312 -8.643 1.00 0.00 H new ATOM 140 N GLN A 90 -3.297 -7.776 -10.876 1.00 0.00 N ATOM 141 CA GLN A 90 -4.398 -7.241 -11.663 1.00 0.00 C ATOM 142 C GLN A 90 -5.268 -6.326 -10.806 1.00 0.00 C ATOM 143 O GLN A 90 -5.680 -5.258 -11.249 1.00 0.00 O ATOM 144 CB GLN A 90 -5.238 -8.375 -12.258 1.00 0.00 C ATOM 145 CG GLN A 90 -5.771 -9.358 -11.226 1.00 0.00 C ATOM 146 CD GLN A 90 -6.637 -10.442 -11.836 1.00 0.00 C ATOM 147 OE1 GLN A 90 -7.555 -10.952 -11.194 1.00 0.00 O ATOM 148 NE2 GLN A 90 -6.351 -10.805 -13.073 1.00 0.00 N ATOM 0 H GLN A 90 -3.264 -8.795 -10.838 1.00 0.00 H new ATOM 0 HA GLN A 90 -3.982 -6.657 -12.484 1.00 0.00 H new ATOM 0 HB2 GLN A 90 -6.078 -7.944 -12.802 1.00 0.00 H new ATOM 0 HB3 GLN A 90 -4.634 -8.919 -12.984 1.00 0.00 H new ATOM 0 HG2 GLN A 90 -4.933 -9.820 -10.705 1.00 0.00 H new ATOM 0 HG3 GLN A 90 -6.350 -8.815 -10.479 1.00 0.00 H new ATOM 0 HE21 GLN A 90 -5.582 -10.357 -13.571 1.00 0.00 H new ATOM 0 HE22 GLN A 90 -6.900 -11.533 -13.531 1.00 0.00 H new ATOM 157 N ASN A 91 -5.510 -6.743 -9.567 1.00 0.00 N ATOM 158 CA ASN A 91 -6.298 -5.954 -8.628 1.00 0.00 C ATOM 159 C ASN A 91 -5.586 -4.647 -8.312 1.00 0.00 C ATOM 160 O ASN A 91 -6.210 -3.588 -8.235 1.00 0.00 O ATOM 161 CB ASN A 91 -6.537 -6.739 -7.331 1.00 0.00 C ATOM 162 CG ASN A 91 -7.540 -7.871 -7.487 1.00 0.00 C ATOM 163 OD1 ASN A 91 -7.692 -8.444 -8.565 1.00 0.00 O ATOM 164 ND2 ASN A 91 -8.222 -8.208 -6.402 1.00 0.00 N ATOM 0 H ASN A 91 -5.170 -7.627 -9.189 1.00 0.00 H new ATOM 0 HA ASN A 91 -7.261 -5.735 -9.089 1.00 0.00 H new ATOM 0 HB2 ASN A 91 -5.589 -7.149 -6.983 1.00 0.00 H new ATOM 0 HB3 ASN A 91 -6.890 -6.054 -6.560 1.00 0.00 H new ATOM 0 HD21 ASN A 91 -8.902 -8.967 -6.442 1.00 0.00 H new ATOM 0 HD22 ASN A 91 -8.067 -7.708 -5.526 1.00 0.00 H new ATOM 171 N LEU A 92 -4.272 -4.731 -8.158 1.00 0.00 N ATOM 172 CA LEU A 92 -3.454 -3.569 -7.831 1.00 0.00 C ATOM 173 C LEU A 92 -3.425 -2.582 -8.990 1.00 0.00 C ATOM 174 O LEU A 92 -3.434 -1.375 -8.785 1.00 0.00 O ATOM 175 CB LEU A 92 -2.027 -4.001 -7.487 1.00 0.00 C ATOM 176 CG LEU A 92 -1.906 -4.954 -6.301 1.00 0.00 C ATOM 177 CD1 LEU A 92 -0.471 -5.431 -6.156 1.00 0.00 C ATOM 178 CD2 LEU A 92 -2.372 -4.272 -5.024 1.00 0.00 C ATOM 0 H LEU A 92 -3.745 -5.599 -8.255 1.00 0.00 H new ATOM 0 HA LEU A 92 -3.899 -3.078 -6.965 1.00 0.00 H new ATOM 0 HB2 LEU A 92 -1.588 -4.478 -8.363 1.00 0.00 H new ATOM 0 HB3 LEU A 92 -1.435 -3.110 -7.279 1.00 0.00 H new ATOM 0 HG LEU A 92 -2.544 -5.820 -6.481 1.00 0.00 H new ATOM 0 HD11 LEU A 92 -0.397 -6.110 -5.307 1.00 0.00 H new ATOM 0 HD12 LEU A 92 -0.167 -5.951 -7.064 1.00 0.00 H new ATOM 0 HD13 LEU A 92 0.183 -4.574 -5.993 1.00 0.00 H new ATOM 0 HD21 LEU A 92 -2.280 -4.964 -4.187 1.00 0.00 H new ATOM 0 HD22 LEU A 92 -1.757 -3.392 -4.836 1.00 0.00 H new ATOM 0 HD23 LEU A 92 -3.414 -3.970 -5.132 1.00 0.00 H new ATOM 190 N LYS A 93 -3.409 -3.104 -10.211 1.00 0.00 N ATOM 191 CA LYS A 93 -3.337 -2.260 -11.402 1.00 0.00 C ATOM 192 C LYS A 93 -4.549 -1.343 -11.548 1.00 0.00 C ATOM 193 O LYS A 93 -4.486 -0.337 -12.255 1.00 0.00 O ATOM 194 CB LYS A 93 -3.166 -3.117 -12.653 1.00 0.00 C ATOM 195 CG LYS A 93 -1.736 -3.573 -12.869 1.00 0.00 C ATOM 196 CD LYS A 93 -1.607 -4.457 -14.095 1.00 0.00 C ATOM 197 CE LYS A 93 -0.149 -4.719 -14.432 1.00 0.00 C ATOM 198 NZ LYS A 93 0.533 -3.498 -14.932 1.00 0.00 N ATOM 0 H LYS A 93 -3.445 -4.105 -10.404 1.00 0.00 H new ATOM 0 HA LYS A 93 -2.465 -1.617 -11.282 1.00 0.00 H new ATOM 0 HB2 LYS A 93 -3.813 -3.991 -12.579 1.00 0.00 H new ATOM 0 HB3 LYS A 93 -3.496 -2.549 -13.523 1.00 0.00 H new ATOM 0 HG2 LYS A 93 -1.089 -2.702 -12.979 1.00 0.00 H new ATOM 0 HG3 LYS A 93 -1.391 -4.118 -11.990 1.00 0.00 H new ATOM 0 HD2 LYS A 93 -2.118 -5.404 -13.920 1.00 0.00 H new ATOM 0 HD3 LYS A 93 -2.099 -3.981 -14.943 1.00 0.00 H new ATOM 0 HE2 LYS A 93 0.368 -5.086 -13.545 1.00 0.00 H new ATOM 0 HE3 LYS A 93 -0.086 -5.504 -15.186 1.00 0.00 H new ATOM 0 HZ1 LYS A 93 1.415 -3.766 -15.414 1.00 0.00 H new ATOM 0 HZ2 LYS A 93 -0.090 -3.001 -15.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 93 0.753 -2.871 -14.132 1.00 0.00 H new ATOM 212 N ASN A 94 -5.642 -1.669 -10.869 1.00 0.00 N ATOM 213 CA ASN A 94 -6.839 -0.833 -10.919 1.00 0.00 C ATOM 214 C ASN A 94 -6.697 0.380 -10.009 1.00 0.00 C ATOM 215 O ASN A 94 -7.425 1.360 -10.154 1.00 0.00 O ATOM 216 CB ASN A 94 -8.092 -1.621 -10.527 1.00 0.00 C ATOM 217 CG ASN A 94 -8.484 -2.661 -11.552 1.00 0.00 C ATOM 218 OD1 ASN A 94 -9.168 -2.362 -12.530 1.00 0.00 O ATOM 219 ND2 ASN A 94 -8.080 -3.896 -11.322 1.00 0.00 N ATOM 0 H ASN A 94 -5.726 -2.499 -10.282 1.00 0.00 H new ATOM 0 HA ASN A 94 -6.948 -0.496 -11.950 1.00 0.00 H new ATOM 0 HB2 ASN A 94 -7.921 -2.111 -9.568 1.00 0.00 H new ATOM 0 HB3 ASN A 94 -8.921 -0.927 -10.387 1.00 0.00 H new ATOM 0 HD21 ASN A 94 -8.334 -4.644 -11.967 1.00 0.00 H new ATOM 0 HD22 ASN A 94 -7.514 -4.102 -10.499 1.00 0.00 H new ATOM 226 N LEU A 95 -5.752 0.316 -9.080 1.00 0.00 N ATOM 227 CA LEU A 95 -5.562 1.381 -8.100 1.00 0.00 C ATOM 228 C LEU A 95 -5.198 2.696 -8.775 1.00 0.00 C ATOM 229 O LEU A 95 -5.844 3.720 -8.551 1.00 0.00 O ATOM 230 CB LEU A 95 -4.468 0.997 -7.104 1.00 0.00 C ATOM 231 CG LEU A 95 -4.764 -0.238 -6.257 1.00 0.00 C ATOM 232 CD1 LEU A 95 -3.554 -0.604 -5.417 1.00 0.00 C ATOM 233 CD2 LEU A 95 -5.975 -0.004 -5.373 1.00 0.00 C ATOM 0 H LEU A 95 -5.102 -0.464 -8.983 1.00 0.00 H new ATOM 0 HA LEU A 95 -6.505 1.515 -7.570 1.00 0.00 H new ATOM 0 HB2 LEU A 95 -3.542 0.828 -7.653 1.00 0.00 H new ATOM 0 HB3 LEU A 95 -4.293 1.842 -6.437 1.00 0.00 H new ATOM 0 HG LEU A 95 -4.986 -1.069 -6.926 1.00 0.00 H new ATOM 0 HD11 LEU A 95 -3.780 -1.486 -4.818 1.00 0.00 H new ATOM 0 HD12 LEU A 95 -2.708 -0.816 -6.071 1.00 0.00 H new ATOM 0 HD13 LEU A 95 -3.304 0.227 -4.758 1.00 0.00 H new ATOM 0 HD21 LEU A 95 -6.169 -0.896 -4.778 1.00 0.00 H new ATOM 0 HD22 LEU A 95 -5.784 0.840 -4.710 1.00 0.00 H new ATOM 0 HD23 LEU A 95 -6.843 0.213 -5.995 1.00 0.00 H new ATOM 245 N GLY A 96 -4.172 2.653 -9.616 1.00 0.00 N ATOM 246 CA GLY A 96 -3.679 3.853 -10.263 1.00 0.00 C ATOM 247 C GLY A 96 -4.680 4.496 -11.205 1.00 0.00 C ATOM 248 O GLY A 96 -4.593 5.694 -11.479 1.00 0.00 O ATOM 0 H GLY A 96 -3.669 1.801 -9.863 1.00 0.00 H new ATOM 0 HA2 GLY A 96 -3.397 4.577 -9.499 1.00 0.00 H new ATOM 0 HA3 GLY A 96 -2.775 3.609 -10.820 1.00 0.00 H new ATOM 252 N GLU A 97 -5.640 3.720 -11.695 1.00 0.00 N ATOM 253 CA GLU A 97 -6.592 4.236 -12.675 1.00 0.00 C ATOM 254 C GLU A 97 -7.895 4.672 -12.015 1.00 0.00 C ATOM 255 O GLU A 97 -8.690 5.391 -12.617 1.00 0.00 O ATOM 256 CB GLU A 97 -6.866 3.197 -13.765 1.00 0.00 C ATOM 257 CG GLU A 97 -7.352 1.861 -13.234 1.00 0.00 C ATOM 258 CD GLU A 97 -7.578 0.847 -14.333 1.00 0.00 C ATOM 259 OE1 GLU A 97 -8.748 0.571 -14.662 1.00 0.00 O ATOM 260 OE2 GLU A 97 -6.585 0.325 -14.876 1.00 0.00 O ATOM 0 H GLU A 97 -5.780 2.744 -11.435 1.00 0.00 H new ATOM 0 HA GLU A 97 -6.142 5.115 -13.137 1.00 0.00 H new ATOM 0 HB2 GLU A 97 -7.611 3.596 -14.454 1.00 0.00 H new ATOM 0 HB3 GLU A 97 -5.953 3.038 -14.339 1.00 0.00 H new ATOM 0 HG2 GLU A 97 -6.622 1.468 -12.526 1.00 0.00 H new ATOM 0 HG3 GLU A 97 -8.281 2.009 -12.684 1.00 0.00 H new ATOM 267 N SER A 98 -8.108 4.251 -10.776 1.00 0.00 N ATOM 268 CA SER A 98 -9.300 4.635 -10.045 1.00 0.00 C ATOM 269 C SER A 98 -9.216 6.104 -9.653 1.00 0.00 C ATOM 270 O SER A 98 -8.337 6.506 -8.883 1.00 0.00 O ATOM 271 CB SER A 98 -9.469 3.756 -8.806 1.00 0.00 C ATOM 272 OG SER A 98 -9.633 2.395 -9.169 1.00 0.00 O ATOM 0 H SER A 98 -7.470 3.645 -10.260 1.00 0.00 H new ATOM 0 HA SER A 98 -10.171 4.493 -10.685 1.00 0.00 H new ATOM 0 HB2 SER A 98 -8.598 3.861 -8.159 1.00 0.00 H new ATOM 0 HB3 SER A 98 -10.334 4.090 -8.233 1.00 0.00 H new ATOM 0 HG SER A 98 -8.761 2.010 -9.396 1.00 0.00 H new ATOM 278 N ALA A 99 -10.136 6.897 -10.197 1.00 0.00 N ATOM 279 CA ALA A 99 -10.132 8.342 -10.015 1.00 0.00 C ATOM 280 C ALA A 99 -10.210 8.724 -8.545 1.00 0.00 C ATOM 281 O ALA A 99 -9.691 9.763 -8.142 1.00 0.00 O ATOM 282 CB ALA A 99 -11.281 8.975 -10.781 1.00 0.00 C ATOM 0 H ALA A 99 -10.903 6.554 -10.775 1.00 0.00 H new ATOM 0 HA ALA A 99 -9.188 8.720 -10.408 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -11.264 10.055 -10.635 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -11.178 8.751 -11.843 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -12.226 8.574 -10.416 1.00 0.00 H new ATOM 288 N THR A 100 -10.837 7.880 -7.745 1.00 0.00 N ATOM 289 CA THR A 100 -10.992 8.159 -6.328 1.00 0.00 C ATOM 290 C THR A 100 -9.649 8.090 -5.610 1.00 0.00 C ATOM 291 O THR A 100 -9.275 9.006 -4.876 1.00 0.00 O ATOM 292 CB THR A 100 -11.956 7.164 -5.661 1.00 0.00 C ATOM 293 OG1 THR A 100 -13.166 7.056 -6.426 1.00 0.00 O ATOM 294 CG2 THR A 100 -12.279 7.608 -4.245 1.00 0.00 C ATOM 0 H THR A 100 -11.246 6.997 -8.051 1.00 0.00 H new ATOM 0 HA THR A 100 -11.403 9.166 -6.247 1.00 0.00 H new ATOM 0 HB THR A 100 -11.472 6.188 -5.622 1.00 0.00 H new ATOM 0 HG1 THR A 100 -13.771 6.419 -5.993 1.00 0.00 H new ATOM 0 HG21 THR A 100 -12.962 6.893 -3.787 1.00 0.00 H new ATOM 0 HG22 THR A 100 -11.360 7.658 -3.661 1.00 0.00 H new ATOM 0 HG23 THR A 100 -12.747 8.592 -4.270 1.00 0.00 H new ATOM 302 N LEU A 101 -8.909 7.016 -5.862 1.00 0.00 N ATOM 303 CA LEU A 101 -7.686 6.746 -5.125 1.00 0.00 C ATOM 304 C LEU A 101 -6.613 7.761 -5.477 1.00 0.00 C ATOM 305 O LEU A 101 -5.987 8.342 -4.595 1.00 0.00 O ATOM 306 CB LEU A 101 -7.176 5.332 -5.415 1.00 0.00 C ATOM 307 CG LEU A 101 -5.956 4.914 -4.593 1.00 0.00 C ATOM 308 CD1 LEU A 101 -6.316 4.799 -3.121 1.00 0.00 C ATOM 309 CD2 LEU A 101 -5.384 3.606 -5.108 1.00 0.00 C ATOM 0 H LEU A 101 -9.137 6.320 -6.572 1.00 0.00 H new ATOM 0 HA LEU A 101 -7.913 6.825 -4.062 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -7.983 4.624 -5.229 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -6.926 5.260 -6.474 1.00 0.00 H new ATOM 0 HG LEU A 101 -5.193 5.685 -4.699 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -5.435 4.501 -2.553 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -6.673 5.763 -2.757 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -7.099 4.051 -2.995 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -4.517 3.327 -4.509 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -6.141 2.825 -5.037 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -5.083 3.725 -6.149 1.00 0.00 H new ATOM 321 N ARG A 102 -6.421 7.989 -6.768 1.00 0.00 N ATOM 322 CA ARG A 102 -5.401 8.922 -7.232 1.00 0.00 C ATOM 323 C ARG A 102 -5.651 10.332 -6.703 1.00 0.00 C ATOM 324 O ARG A 102 -4.710 11.096 -6.509 1.00 0.00 O ATOM 325 CB ARG A 102 -5.330 8.938 -8.758 1.00 0.00 C ATOM 326 CG ARG A 102 -6.678 9.115 -9.429 1.00 0.00 C ATOM 327 CD ARG A 102 -6.524 9.479 -10.891 1.00 0.00 C ATOM 328 NE ARG A 102 -5.745 8.484 -11.629 1.00 0.00 N ATOM 329 CZ ARG A 102 -5.513 8.536 -12.941 1.00 0.00 C ATOM 330 NH1 ARG A 102 -6.024 9.518 -13.676 1.00 0.00 N ATOM 331 NH2 ARG A 102 -4.774 7.599 -13.517 1.00 0.00 N ATOM 0 H ARG A 102 -6.956 7.542 -7.513 1.00 0.00 H new ATOM 0 HA ARG A 102 -4.444 8.577 -6.841 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -4.668 9.745 -9.074 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -4.883 8.005 -9.102 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -7.254 8.194 -9.341 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -7.242 9.894 -8.916 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -7.510 9.576 -11.345 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -6.038 10.451 -10.972 1.00 0.00 H new ATOM 0 HE ARG A 102 -5.354 7.700 -11.106 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -6.598 10.238 -13.237 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -5.843 9.552 -14.679 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -4.384 6.841 -12.957 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -4.595 7.636 -14.520 1.00 0.00 H new ATOM 345 N SER A 103 -6.915 10.665 -6.450 1.00 0.00 N ATOM 346 CA SER A 103 -7.260 11.967 -5.892 1.00 0.00 C ATOM 347 C SER A 103 -6.729 12.104 -4.470 1.00 0.00 C ATOM 348 O SER A 103 -6.470 13.209 -3.994 1.00 0.00 O ATOM 349 CB SER A 103 -8.774 12.171 -5.915 1.00 0.00 C ATOM 350 OG SER A 103 -9.261 12.166 -7.247 1.00 0.00 O ATOM 0 H SER A 103 -7.713 10.053 -6.622 1.00 0.00 H new ATOM 0 HA SER A 103 -6.794 12.737 -6.507 1.00 0.00 H new ATOM 0 HB2 SER A 103 -9.261 11.382 -5.342 1.00 0.00 H new ATOM 0 HB3 SER A 103 -9.026 13.116 -5.434 1.00 0.00 H new ATOM 0 HG SER A 103 -9.556 11.262 -7.484 1.00 0.00 H new ATOM 356 N LEU A 104 -6.551 10.974 -3.799 1.00 0.00 N ATOM 357 CA LEU A 104 -6.009 10.967 -2.450 1.00 0.00 C ATOM 358 C LEU A 104 -4.490 11.070 -2.511 1.00 0.00 C ATOM 359 O LEU A 104 -3.859 11.684 -1.653 1.00 0.00 O ATOM 360 CB LEU A 104 -6.419 9.692 -1.709 1.00 0.00 C ATOM 361 CG LEU A 104 -7.906 9.336 -1.789 1.00 0.00 C ATOM 362 CD1 LEU A 104 -8.212 8.144 -0.899 1.00 0.00 C ATOM 363 CD2 LEU A 104 -8.772 10.528 -1.411 1.00 0.00 C ATOM 0 H LEU A 104 -6.775 10.050 -4.169 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.410 11.822 -1.906 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -5.841 8.858 -2.108 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -6.144 9.797 -0.660 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.139 9.067 -2.819 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -9.273 7.903 -0.966 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -7.623 7.286 -1.224 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.960 8.386 0.133 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -9.824 10.249 -1.476 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -8.541 10.837 -0.392 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -8.573 11.354 -2.094 1.00 0.00 H new ATOM 375 N LEU A 105 -3.916 10.483 -3.555 1.00 0.00 N ATOM 376 CA LEU A 105 -2.474 10.539 -3.787 1.00 0.00 C ATOM 377 C LEU A 105 -2.042 11.960 -4.124 1.00 0.00 C ATOM 378 O LEU A 105 -0.857 12.275 -4.146 1.00 0.00 O ATOM 379 CB LEU A 105 -2.071 9.607 -4.933 1.00 0.00 C ATOM 380 CG LEU A 105 -1.877 8.131 -4.571 1.00 0.00 C ATOM 381 CD1 LEU A 105 -3.142 7.528 -3.991 1.00 0.00 C ATOM 382 CD2 LEU A 105 -1.432 7.354 -5.798 1.00 0.00 C ATOM 0 H LEU A 105 -4.431 9.958 -4.261 1.00 0.00 H new ATOM 0 HA LEU A 105 -1.978 10.216 -2.872 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -2.832 9.671 -5.710 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -1.142 9.978 -5.365 1.00 0.00 H new ATOM 0 HG LEU A 105 -1.104 8.068 -3.805 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -2.967 6.480 -3.746 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -3.422 8.070 -3.088 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -3.948 7.600 -4.722 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -1.296 6.305 -5.535 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -2.191 7.437 -6.576 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -0.490 7.761 -6.165 1.00 0.00 H new ATOM 394 N LEU A 106 -3.018 12.805 -4.404 1.00 0.00 N ATOM 395 CA LEU A 106 -2.761 14.203 -4.695 1.00 0.00 C ATOM 396 C LEU A 106 -2.489 14.973 -3.404 1.00 0.00 C ATOM 397 O LEU A 106 -2.099 16.144 -3.430 1.00 0.00 O ATOM 398 CB LEU A 106 -3.949 14.796 -5.442 1.00 0.00 C ATOM 399 CG LEU A 106 -4.277 14.101 -6.764 1.00 0.00 C ATOM 400 CD1 LEU A 106 -5.408 14.816 -7.471 1.00 0.00 C ATOM 401 CD2 LEU A 106 -3.050 14.026 -7.662 1.00 0.00 C ATOM 0 H LEU A 106 -4.003 12.544 -4.436 1.00 0.00 H new ATOM 0 HA LEU A 106 -1.876 14.283 -5.326 1.00 0.00 H new ATOM 0 HB2 LEU A 106 -4.826 14.754 -4.796 1.00 0.00 H new ATOM 0 HB3 LEU A 106 -3.749 15.849 -5.639 1.00 0.00 H new ATOM 0 HG LEU A 106 -4.594 13.082 -6.541 1.00 0.00 H new ATOM 0 HD11 LEU A 106 -5.629 14.308 -8.410 1.00 0.00 H new ATOM 0 HD12 LEU A 106 -6.295 14.809 -6.838 1.00 0.00 H new ATOM 0 HD13 LEU A 106 -5.116 15.846 -7.675 1.00 0.00 H new ATOM 0 HD21 LEU A 106 -3.312 13.527 -8.595 1.00 0.00 H new ATOM 0 HD22 LEU A 106 -2.694 15.034 -7.877 1.00 0.00 H new ATOM 0 HD23 LEU A 106 -2.264 13.463 -7.158 1.00 0.00 H new ATOM 413 N ASN A 107 -2.695 14.299 -2.279 1.00 0.00 N ATOM 414 CA ASN A 107 -2.402 14.864 -0.968 1.00 0.00 C ATOM 415 C ASN A 107 -0.926 14.662 -0.639 1.00 0.00 C ATOM 416 O ASN A 107 -0.461 13.530 -0.493 1.00 0.00 O ATOM 417 CB ASN A 107 -3.272 14.202 0.105 1.00 0.00 C ATOM 418 CG ASN A 107 -4.752 14.469 -0.092 1.00 0.00 C ATOM 419 OD1 ASN A 107 -5.147 15.515 -0.602 1.00 0.00 O ATOM 420 ND2 ASN A 107 -5.580 13.516 0.306 1.00 0.00 N ATOM 0 H ASN A 107 -3.068 13.350 -2.250 1.00 0.00 H new ATOM 0 HA ASN A 107 -2.624 15.931 -0.987 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.097 13.126 0.095 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -2.969 14.565 1.087 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -6.587 13.635 0.194 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -5.211 12.662 0.725 1.00 0.00 H new ATOM 427 N PRO A 108 -0.174 15.773 -0.527 1.00 0.00 N ATOM 428 CA PRO A 108 1.281 15.749 -0.306 1.00 0.00 C ATOM 429 C PRO A 108 1.695 14.925 0.909 1.00 0.00 C ATOM 430 O PRO A 108 2.728 14.254 0.886 1.00 0.00 O ATOM 431 CB PRO A 108 1.635 17.222 -0.087 1.00 0.00 C ATOM 432 CG PRO A 108 0.556 17.980 -0.775 1.00 0.00 C ATOM 433 CD PRO A 108 -0.687 17.153 -0.618 1.00 0.00 C ATOM 0 HA PRO A 108 1.797 15.283 -1.145 1.00 0.00 H new ATOM 0 HB2 PRO A 108 1.674 17.466 0.975 1.00 0.00 H new ATOM 0 HB3 PRO A 108 2.613 17.460 -0.505 1.00 0.00 H new ATOM 0 HG2 PRO A 108 0.428 18.967 -0.332 1.00 0.00 H new ATOM 0 HG3 PRO A 108 0.795 18.132 -1.828 1.00 0.00 H new ATOM 0 HD2 PRO A 108 -1.245 17.433 0.275 1.00 0.00 H new ATOM 0 HD3 PRO A 108 -1.360 17.276 -1.466 1.00 0.00 H new ATOM 441 N HIS A 109 0.892 14.973 1.964 1.00 0.00 N ATOM 442 CA HIS A 109 1.206 14.241 3.184 1.00 0.00 C ATOM 443 C HIS A 109 1.079 12.736 2.963 1.00 0.00 C ATOM 444 O HIS A 109 1.949 11.968 3.370 1.00 0.00 O ATOM 445 CB HIS A 109 0.298 14.685 4.334 1.00 0.00 C ATOM 446 CG HIS A 109 0.537 13.931 5.609 1.00 0.00 C ATOM 447 ND1 HIS A 109 1.442 14.367 6.548 1.00 0.00 N ATOM 448 CD2 HIS A 109 -0.027 12.779 6.039 1.00 0.00 C ATOM 449 CE1 HIS A 109 1.407 13.471 7.522 1.00 0.00 C ATOM 450 NE2 HIS A 109 0.533 12.497 7.256 1.00 0.00 N ATOM 0 H HIS A 109 0.024 15.507 2.000 1.00 0.00 H new ATOM 0 HA HIS A 109 2.239 14.465 3.451 1.00 0.00 H new ATOM 0 HB2 HIS A 109 0.449 15.749 4.516 1.00 0.00 H new ATOM 0 HB3 HIS A 109 -0.742 14.558 4.035 1.00 0.00 H new ATOM 0 HD2 HIS A 109 -0.774 12.195 5.522 1.00 0.00 H new ATOM 0 HE1 HIS A 109 2.009 13.521 8.418 1.00 0.00 H new ATOM 0 HE2 HIS A 109 0.322 11.694 7.848 1.00 0.00 H new ATOM 458 N LEU A 110 0.000 12.323 2.306 1.00 0.00 N ATOM 459 CA LEU A 110 -0.245 10.914 2.054 1.00 0.00 C ATOM 460 C LEU A 110 0.867 10.339 1.189 1.00 0.00 C ATOM 461 O LEU A 110 1.313 9.208 1.393 1.00 0.00 O ATOM 462 CB LEU A 110 -1.604 10.729 1.378 1.00 0.00 C ATOM 463 CG LEU A 110 -1.897 9.309 0.902 1.00 0.00 C ATOM 464 CD1 LEU A 110 -1.873 8.333 2.064 1.00 0.00 C ATOM 465 CD2 LEU A 110 -3.234 9.249 0.188 1.00 0.00 C ATOM 0 H LEU A 110 -0.718 12.948 1.939 1.00 0.00 H new ATOM 0 HA LEU A 110 -0.257 10.379 3.004 1.00 0.00 H new ATOM 0 HB2 LEU A 110 -2.385 11.031 2.076 1.00 0.00 H new ATOM 0 HB3 LEU A 110 -1.663 11.403 0.523 1.00 0.00 H new ATOM 0 HG LEU A 110 -1.116 9.022 0.198 1.00 0.00 H new ATOM 0 HD11 LEU A 110 -2.085 7.328 1.699 1.00 0.00 H new ATOM 0 HD12 LEU A 110 -0.889 8.349 2.533 1.00 0.00 H new ATOM 0 HD13 LEU A 110 -2.628 8.620 2.796 1.00 0.00 H new ATOM 0 HD21 LEU A 110 -3.424 8.228 -0.143 1.00 0.00 H new ATOM 0 HD22 LEU A 110 -4.025 9.562 0.870 1.00 0.00 H new ATOM 0 HD23 LEU A 110 -3.215 9.913 -0.676 1.00 0.00 H new ATOM 477 N ARG A 111 1.319 11.143 0.235 1.00 0.00 N ATOM 478 CA ARG A 111 2.457 10.783 -0.600 1.00 0.00 C ATOM 479 C ARG A 111 3.665 10.475 0.270 1.00 0.00 C ATOM 480 O ARG A 111 4.293 9.428 0.125 1.00 0.00 O ATOM 481 CB ARG A 111 2.800 11.917 -1.566 1.00 0.00 C ATOM 482 CG ARG A 111 1.743 12.153 -2.624 1.00 0.00 C ATOM 483 CD ARG A 111 2.064 13.371 -3.475 1.00 0.00 C ATOM 484 NE ARG A 111 3.371 13.266 -4.122 1.00 0.00 N ATOM 485 CZ ARG A 111 3.771 14.056 -5.116 1.00 0.00 C ATOM 486 NH1 ARG A 111 2.967 15.006 -5.575 1.00 0.00 N ATOM 487 NH2 ARG A 111 4.975 13.897 -5.649 1.00 0.00 N ATOM 0 H ARG A 111 0.912 12.053 0.020 1.00 0.00 H new ATOM 0 HA ARG A 111 2.189 9.898 -1.178 1.00 0.00 H new ATOM 0 HB2 ARG A 111 2.945 12.836 -0.998 1.00 0.00 H new ATOM 0 HB3 ARG A 111 3.748 11.692 -2.055 1.00 0.00 H new ATOM 0 HG2 ARG A 111 1.664 11.273 -3.263 1.00 0.00 H new ATOM 0 HG3 ARG A 111 0.773 12.288 -2.146 1.00 0.00 H new ATOM 0 HD2 ARG A 111 1.293 13.494 -4.236 1.00 0.00 H new ATOM 0 HD3 ARG A 111 2.041 14.264 -2.851 1.00 0.00 H new ATOM 0 HE ARG A 111 4.014 12.546 -3.793 1.00 0.00 H new ATOM 0 HH11 ARG A 111 2.041 15.132 -5.166 1.00 0.00 H new ATOM 0 HH12 ARG A 111 3.275 15.611 -6.337 1.00 0.00 H new ATOM 0 HH21 ARG A 111 5.596 13.168 -5.297 1.00 0.00 H new ATOM 0 HH22 ARG A 111 5.280 14.503 -6.411 1.00 0.00 H new ATOM 501 N GLN A 112 3.956 11.382 1.196 1.00 0.00 N ATOM 502 CA GLN A 112 5.093 11.233 2.093 1.00 0.00 C ATOM 503 C GLN A 112 4.954 10.011 2.988 1.00 0.00 C ATOM 504 O GLN A 112 5.948 9.455 3.437 1.00 0.00 O ATOM 505 CB GLN A 112 5.280 12.486 2.946 1.00 0.00 C ATOM 506 CG GLN A 112 6.251 13.484 2.341 1.00 0.00 C ATOM 507 CD GLN A 112 7.636 12.893 2.162 1.00 0.00 C ATOM 508 OE1 GLN A 112 8.478 12.965 3.058 1.00 0.00 O ATOM 509 NE2 GLN A 112 7.879 12.299 1.007 1.00 0.00 N ATOM 0 H GLN A 112 3.415 12.234 1.344 1.00 0.00 H new ATOM 0 HA GLN A 112 5.975 11.093 1.469 1.00 0.00 H new ATOM 0 HB2 GLN A 112 4.313 12.969 3.086 1.00 0.00 H new ATOM 0 HB3 GLN A 112 5.637 12.195 3.934 1.00 0.00 H new ATOM 0 HG2 GLN A 112 5.872 13.818 1.375 1.00 0.00 H new ATOM 0 HG3 GLN A 112 6.312 14.364 2.981 1.00 0.00 H new ATOM 0 HE21 GLN A 112 7.154 12.261 0.291 1.00 0.00 H new ATOM 0 HE22 GLN A 112 8.792 11.878 0.832 1.00 0.00 H new ATOM 518 N LEU A 113 3.731 9.564 3.216 1.00 0.00 N ATOM 519 CA LEU A 113 3.510 8.436 4.101 1.00 0.00 C ATOM 520 C LEU A 113 3.832 7.166 3.354 1.00 0.00 C ATOM 521 O LEU A 113 4.655 6.355 3.780 1.00 0.00 O ATOM 522 CB LEU A 113 2.059 8.386 4.586 1.00 0.00 C ATOM 523 CG LEU A 113 1.619 9.525 5.506 1.00 0.00 C ATOM 524 CD1 LEU A 113 0.169 9.333 5.909 1.00 0.00 C ATOM 525 CD2 LEU A 113 2.503 9.590 6.739 1.00 0.00 C ATOM 0 H LEU A 113 2.885 9.960 2.805 1.00 0.00 H new ATOM 0 HA LEU A 113 4.154 8.544 4.974 1.00 0.00 H new ATOM 0 HB2 LEU A 113 1.406 8.377 3.714 1.00 0.00 H new ATOM 0 HB3 LEU A 113 1.904 7.443 5.110 1.00 0.00 H new ATOM 0 HG LEU A 113 1.716 10.466 4.965 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -0.137 10.148 6.564 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -0.459 9.328 5.018 1.00 0.00 H new ATOM 0 HD13 LEU A 113 0.060 8.384 6.435 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.173 10.407 7.381 1.00 0.00 H new ATOM 0 HD22 LEU A 113 2.435 8.649 7.286 1.00 0.00 H new ATOM 0 HD23 LEU A 113 3.536 9.760 6.437 1.00 0.00 H new ATOM 537 N MET A 114 3.204 7.038 2.205 1.00 0.00 N ATOM 538 CA MET A 114 3.337 5.873 1.379 1.00 0.00 C ATOM 539 C MET A 114 4.786 5.667 0.924 1.00 0.00 C ATOM 540 O MET A 114 5.293 4.548 0.956 1.00 0.00 O ATOM 541 CB MET A 114 2.382 6.013 0.199 1.00 0.00 C ATOM 542 CG MET A 114 2.636 5.008 -0.883 1.00 0.00 C ATOM 543 SD MET A 114 1.372 4.998 -2.167 1.00 0.00 S ATOM 544 CE MET A 114 1.502 6.672 -2.771 1.00 0.00 C ATOM 0 H MET A 114 2.583 7.750 1.821 1.00 0.00 H new ATOM 0 HA MET A 114 3.075 4.983 1.951 1.00 0.00 H new ATOM 0 HB2 MET A 114 1.357 5.905 0.554 1.00 0.00 H new ATOM 0 HB3 MET A 114 2.472 7.017 -0.217 1.00 0.00 H new ATOM 0 HG2 MET A 114 3.604 5.214 -1.339 1.00 0.00 H new ATOM 0 HG3 MET A 114 2.698 4.015 -0.438 1.00 0.00 H new ATOM 0 HE1 MET A 114 0.914 6.776 -3.683 1.00 0.00 H new ATOM 0 HE2 MET A 114 1.126 7.362 -2.015 1.00 0.00 H new ATOM 0 HE3 MET A 114 2.546 6.902 -2.984 1.00 0.00 H new ATOM 554 N VAL A 115 5.467 6.743 0.536 1.00 0.00 N ATOM 555 CA VAL A 115 6.854 6.627 0.086 1.00 0.00 C ATOM 556 C VAL A 115 7.800 6.359 1.258 1.00 0.00 C ATOM 557 O VAL A 115 8.845 5.730 1.089 1.00 0.00 O ATOM 558 CB VAL A 115 7.330 7.871 -0.696 1.00 0.00 C ATOM 559 CG1 VAL A 115 6.443 8.116 -1.909 1.00 0.00 C ATOM 560 CG2 VAL A 115 7.378 9.101 0.197 1.00 0.00 C ATOM 0 H VAL A 115 5.090 7.691 0.523 1.00 0.00 H new ATOM 0 HA VAL A 115 6.880 5.776 -0.595 1.00 0.00 H new ATOM 0 HB VAL A 115 8.344 7.677 -1.046 1.00 0.00 H new ATOM 0 HG11 VAL A 115 6.796 8.997 -2.446 1.00 0.00 H new ATOM 0 HG12 VAL A 115 6.482 7.249 -2.569 1.00 0.00 H new ATOM 0 HG13 VAL A 115 5.416 8.278 -1.582 1.00 0.00 H new ATOM 0 HG21 VAL A 115 7.717 9.959 -0.384 1.00 0.00 H new ATOM 0 HG22 VAL A 115 6.383 9.301 0.594 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.069 8.925 1.022 1.00 0.00 H new ATOM 570 N ASN A 116 7.432 6.837 2.445 1.00 0.00 N ATOM 571 CA ASN A 116 8.200 6.557 3.660 1.00 0.00 C ATOM 572 C ASN A 116 8.211 5.069 3.955 1.00 0.00 C ATOM 573 O ASN A 116 9.253 4.487 4.251 1.00 0.00 O ATOM 574 CB ASN A 116 7.616 7.299 4.863 1.00 0.00 C ATOM 575 CG ASN A 116 8.324 8.607 5.142 1.00 0.00 C ATOM 576 OD1 ASN A 116 9.501 8.776 4.826 1.00 0.00 O ATOM 577 ND2 ASN A 116 7.613 9.538 5.744 1.00 0.00 N ATOM 0 H ASN A 116 6.608 7.420 2.593 1.00 0.00 H new ATOM 0 HA ASN A 116 9.220 6.902 3.488 1.00 0.00 H new ATOM 0 HB2 ASN A 116 6.558 7.494 4.686 1.00 0.00 H new ATOM 0 HB3 ASN A 116 7.680 6.661 5.744 1.00 0.00 H new ATOM 0 HD21 ASN A 116 8.036 10.440 5.965 1.00 0.00 H new ATOM 0 HD22 ASN A 116 6.639 9.358 5.989 1.00 0.00 H new ATOM 584 N LEU A 117 7.038 4.462 3.866 1.00 0.00 N ATOM 585 CA LEU A 117 6.874 3.035 4.123 1.00 0.00 C ATOM 586 C LEU A 117 7.788 2.197 3.225 1.00 0.00 C ATOM 587 O LEU A 117 8.290 1.151 3.640 1.00 0.00 O ATOM 588 CB LEU A 117 5.409 2.640 3.913 1.00 0.00 C ATOM 589 CG LEU A 117 5.065 1.182 4.220 1.00 0.00 C ATOM 590 CD1 LEU A 117 5.342 0.855 5.679 1.00 0.00 C ATOM 591 CD2 LEU A 117 3.611 0.902 3.877 1.00 0.00 C ATOM 0 H LEU A 117 6.173 4.941 3.614 1.00 0.00 H new ATOM 0 HA LEU A 117 7.158 2.837 5.157 1.00 0.00 H new ATOM 0 HB2 LEU A 117 4.786 3.280 4.538 1.00 0.00 H new ATOM 0 HB3 LEU A 117 5.141 2.847 2.877 1.00 0.00 H new ATOM 0 HG LEU A 117 5.699 0.543 3.605 1.00 0.00 H new ATOM 0 HD11 LEU A 117 5.089 -0.188 5.873 1.00 0.00 H new ATOM 0 HD12 LEU A 117 6.398 1.019 5.894 1.00 0.00 H new ATOM 0 HD13 LEU A 117 4.737 1.499 6.317 1.00 0.00 H new ATOM 0 HD21 LEU A 117 3.379 -0.139 4.100 1.00 0.00 H new ATOM 0 HD22 LEU A 117 2.966 1.552 4.468 1.00 0.00 H new ATOM 0 HD23 LEU A 117 3.444 1.092 2.817 1.00 0.00 H new ATOM 603 N ASP A 118 8.014 2.671 2.004 1.00 0.00 N ATOM 604 CA ASP A 118 8.882 1.970 1.049 1.00 0.00 C ATOM 605 C ASP A 118 10.333 1.947 1.522 1.00 0.00 C ATOM 606 O ASP A 118 11.059 0.985 1.270 1.00 0.00 O ATOM 607 CB ASP A 118 8.796 2.620 -0.335 1.00 0.00 C ATOM 608 CG ASP A 118 9.890 2.140 -1.276 1.00 0.00 C ATOM 609 OD1 ASP A 118 9.873 0.954 -1.667 1.00 0.00 O ATOM 610 OD2 ASP A 118 10.774 2.954 -1.624 1.00 0.00 O ATOM 0 H ASP A 118 7.611 3.537 1.647 1.00 0.00 H new ATOM 0 HA ASP A 118 8.530 0.941 0.983 1.00 0.00 H new ATOM 0 HB2 ASP A 118 7.823 2.402 -0.775 1.00 0.00 H new ATOM 0 HB3 ASP A 118 8.863 3.703 -0.229 1.00 0.00 H new ATOM 615 N GLN A 119 10.744 2.996 2.229 1.00 0.00 N ATOM 616 CA GLN A 119 12.117 3.102 2.721 1.00 0.00 C ATOM 617 C GLN A 119 12.431 1.962 3.677 1.00 0.00 C ATOM 618 O GLN A 119 13.576 1.528 3.808 1.00 0.00 O ATOM 619 CB GLN A 119 12.328 4.442 3.418 1.00 0.00 C ATOM 620 CG GLN A 119 12.002 5.624 2.529 1.00 0.00 C ATOM 621 CD GLN A 119 12.292 6.957 3.185 1.00 0.00 C ATOM 622 OE1 GLN A 119 13.176 7.069 4.035 1.00 0.00 O ATOM 623 NE2 GLN A 119 11.557 7.979 2.786 1.00 0.00 N ATOM 0 H GLN A 119 10.147 3.786 2.475 1.00 0.00 H new ATOM 0 HA GLN A 119 12.793 3.038 1.868 1.00 0.00 H new ATOM 0 HB2 GLN A 119 11.706 4.483 4.312 1.00 0.00 H new ATOM 0 HB3 GLN A 119 13.364 4.516 3.747 1.00 0.00 H new ATOM 0 HG2 GLN A 119 12.577 5.547 1.606 1.00 0.00 H new ATOM 0 HG3 GLN A 119 10.949 5.583 2.252 1.00 0.00 H new ATOM 0 HE21 GLN A 119 10.835 7.842 2.079 1.00 0.00 H new ATOM 0 HE22 GLN A 119 11.712 8.905 3.185 1.00 0.00 H new ATOM 632 N GLY A 120 11.391 1.493 4.344 1.00 0.00 N ATOM 633 CA GLY A 120 11.491 0.300 5.167 1.00 0.00 C ATOM 634 C GLY A 120 12.278 0.504 6.445 1.00 0.00 C ATOM 635 O GLY A 120 12.726 -0.462 7.061 1.00 0.00 O ATOM 0 H GLY A 120 10.465 1.921 4.332 1.00 0.00 H new ATOM 0 HA2 GLY A 120 10.487 -0.041 5.420 1.00 0.00 H new ATOM 0 HA3 GLY A 120 11.960 -0.493 4.585 1.00 0.00 H new ATOM 639 N GLU A 121 12.438 1.750 6.859 1.00 0.00 N ATOM 640 CA GLU A 121 13.147 2.049 8.093 1.00 0.00 C ATOM 641 C GLU A 121 12.324 1.603 9.288 1.00 0.00 C ATOM 642 O GLU A 121 12.767 0.784 10.092 1.00 0.00 O ATOM 643 CB GLU A 121 13.453 3.543 8.186 1.00 0.00 C ATOM 644 CG GLU A 121 14.472 4.016 7.164 1.00 0.00 C ATOM 645 CD GLU A 121 15.836 3.400 7.385 1.00 0.00 C ATOM 646 OE1 GLU A 121 16.646 3.993 8.123 1.00 0.00 O ATOM 647 OE2 GLU A 121 16.104 2.315 6.829 1.00 0.00 O ATOM 0 H GLU A 121 12.088 2.569 6.361 1.00 0.00 H new ATOM 0 HA GLU A 121 14.091 1.504 8.094 1.00 0.00 H new ATOM 0 HB2 GLU A 121 12.528 4.104 8.052 1.00 0.00 H new ATOM 0 HB3 GLU A 121 13.821 3.769 9.187 1.00 0.00 H new ATOM 0 HG2 GLU A 121 14.121 3.767 6.163 1.00 0.00 H new ATOM 0 HG3 GLU A 121 14.554 5.102 7.212 1.00 0.00 H new ATOM 654 N ASP A 122 11.101 2.100 9.371 1.00 0.00 N ATOM 655 CA ASP A 122 10.215 1.758 10.473 1.00 0.00 C ATOM 656 C ASP A 122 8.924 1.175 9.951 1.00 0.00 C ATOM 657 O ASP A 122 7.853 1.471 10.465 1.00 0.00 O ATOM 658 CB ASP A 122 9.919 2.986 11.339 1.00 0.00 C ATOM 659 CG ASP A 122 11.137 3.501 12.074 1.00 0.00 C ATOM 660 OD1 ASP A 122 11.501 2.916 13.113 1.00 0.00 O ATOM 661 OD2 ASP A 122 11.725 4.508 11.632 1.00 0.00 O ATOM 0 H ASP A 122 10.698 2.742 8.688 1.00 0.00 H new ATOM 0 HA ASP A 122 10.718 1.013 11.089 1.00 0.00 H new ATOM 0 HB2 ASP A 122 9.520 3.780 10.708 1.00 0.00 H new ATOM 0 HB3 ASP A 122 9.144 2.734 12.063 1.00 0.00 H new ATOM 666 N LYS A 123 9.043 0.324 8.939 1.00 0.00 N ATOM 667 CA LYS A 123 7.882 -0.273 8.289 1.00 0.00 C ATOM 668 C LYS A 123 6.942 -0.943 9.295 1.00 0.00 C ATOM 669 O LYS A 123 5.727 -0.927 9.113 1.00 0.00 O ATOM 670 CB LYS A 123 8.303 -1.288 7.212 1.00 0.00 C ATOM 671 CG LYS A 123 8.976 -2.559 7.736 1.00 0.00 C ATOM 672 CD LYS A 123 10.490 -2.416 7.859 1.00 0.00 C ATOM 673 CE LYS A 123 10.938 -2.223 9.302 1.00 0.00 C ATOM 674 NZ LYS A 123 12.421 -2.172 9.421 1.00 0.00 N ATOM 0 H LYS A 123 9.938 0.030 8.548 1.00 0.00 H new ATOM 0 HA LYS A 123 7.341 0.544 7.811 1.00 0.00 H new ATOM 0 HB2 LYS A 123 7.420 -1.574 6.641 1.00 0.00 H new ATOM 0 HB3 LYS A 123 8.985 -0.795 6.519 1.00 0.00 H new ATOM 0 HG2 LYS A 123 8.559 -2.811 8.711 1.00 0.00 H new ATOM 0 HG3 LYS A 123 8.747 -3.389 7.067 1.00 0.00 H new ATOM 0 HD2 LYS A 123 10.971 -3.303 7.447 1.00 0.00 H new ATOM 0 HD3 LYS A 123 10.822 -1.567 7.261 1.00 0.00 H new ATOM 0 HE2 LYS A 123 10.510 -1.300 9.694 1.00 0.00 H new ATOM 0 HE3 LYS A 123 10.553 -3.039 9.914 1.00 0.00 H new ATOM 0 HZ1 LYS A 123 12.682 -1.745 10.333 1.00 0.00 H new ATOM 0 HZ2 LYS A 123 12.807 -3.136 9.367 1.00 0.00 H new ATOM 0 HZ3 LYS A 123 12.812 -1.599 8.646 1.00 0.00 H new ATOM 688 N ALA A 124 7.498 -1.503 10.366 1.00 0.00 N ATOM 689 CA ALA A 124 6.688 -2.212 11.345 1.00 0.00 C ATOM 690 C ALA A 124 5.882 -1.237 12.191 1.00 0.00 C ATOM 691 O ALA A 124 4.716 -1.480 12.507 1.00 0.00 O ATOM 692 CB ALA A 124 7.553 -3.098 12.229 1.00 0.00 C ATOM 0 H ALA A 124 8.496 -1.479 10.575 1.00 0.00 H new ATOM 0 HA ALA A 124 5.991 -2.850 10.802 1.00 0.00 H new ATOM 0 HB1 ALA A 124 6.923 -3.617 12.952 1.00 0.00 H new ATOM 0 HB2 ALA A 124 8.075 -3.829 11.612 1.00 0.00 H new ATOM 0 HB3 ALA A 124 8.282 -2.484 12.758 1.00 0.00 H new ATOM 698 N LYS A 125 6.507 -0.125 12.531 1.00 0.00 N ATOM 699 CA LYS A 125 5.874 0.898 13.346 1.00 0.00 C ATOM 700 C LYS A 125 4.934 1.750 12.499 1.00 0.00 C ATOM 701 O LYS A 125 3.844 2.115 12.938 1.00 0.00 O ATOM 702 CB LYS A 125 6.949 1.768 13.994 1.00 0.00 C ATOM 703 CG LYS A 125 7.851 0.995 14.945 1.00 0.00 C ATOM 704 CD LYS A 125 9.239 1.609 15.030 1.00 0.00 C ATOM 705 CE LYS A 125 9.196 3.069 15.451 1.00 0.00 C ATOM 706 NZ LYS A 125 10.552 3.677 15.470 1.00 0.00 N ATOM 0 H LYS A 125 7.463 0.095 12.252 1.00 0.00 H new ATOM 0 HA LYS A 125 5.283 0.419 14.127 1.00 0.00 H new ATOM 0 HB2 LYS A 125 7.559 2.223 13.213 1.00 0.00 H new ATOM 0 HB3 LYS A 125 6.470 2.582 14.538 1.00 0.00 H new ATOM 0 HG2 LYS A 125 7.401 0.975 15.938 1.00 0.00 H new ATOM 0 HG3 LYS A 125 7.931 -0.039 14.610 1.00 0.00 H new ATOM 0 HD2 LYS A 125 9.841 1.045 15.742 1.00 0.00 H new ATOM 0 HD3 LYS A 125 9.731 1.526 14.061 1.00 0.00 H new ATOM 0 HE2 LYS A 125 8.557 3.626 14.766 1.00 0.00 H new ATOM 0 HE3 LYS A 125 8.748 3.149 16.441 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 10.468 4.714 15.458 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 11.053 3.380 16.331 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 11.085 3.363 14.634 1.00 0.00 H new ATOM 720 N LEU A 126 5.359 2.039 11.273 1.00 0.00 N ATOM 721 CA LEU A 126 4.577 2.855 10.353 1.00 0.00 C ATOM 722 C LEU A 126 3.243 2.193 10.037 1.00 0.00 C ATOM 723 O LEU A 126 2.227 2.863 9.955 1.00 0.00 O ATOM 724 CB LEU A 126 5.351 3.109 9.056 1.00 0.00 C ATOM 725 CG LEU A 126 6.685 3.843 9.214 1.00 0.00 C ATOM 726 CD1 LEU A 126 7.398 3.938 7.877 1.00 0.00 C ATOM 727 CD2 LEU A 126 6.492 5.228 9.809 1.00 0.00 C ATOM 0 H LEU A 126 6.249 1.717 10.892 1.00 0.00 H new ATOM 0 HA LEU A 126 4.386 3.811 10.841 1.00 0.00 H new ATOM 0 HB2 LEU A 126 5.539 2.150 8.573 1.00 0.00 H new ATOM 0 HB3 LEU A 126 4.717 3.686 8.383 1.00 0.00 H new ATOM 0 HG LEU A 126 7.301 3.267 9.904 1.00 0.00 H new ATOM 0 HD11 LEU A 126 8.345 4.462 8.006 1.00 0.00 H new ATOM 0 HD12 LEU A 126 7.588 2.935 7.494 1.00 0.00 H new ATOM 0 HD13 LEU A 126 6.774 4.484 7.170 1.00 0.00 H new ATOM 0 HD21 LEU A 126 7.460 5.720 9.907 1.00 0.00 H new ATOM 0 HD22 LEU A 126 5.849 5.818 9.156 1.00 0.00 H new ATOM 0 HD23 LEU A 126 6.028 5.140 10.792 1.00 0.00 H new ATOM 739 N MET A 127 3.246 0.873 9.881 1.00 0.00 N ATOM 740 CA MET A 127 2.014 0.133 9.600 1.00 0.00 C ATOM 741 C MET A 127 0.929 0.454 10.622 1.00 0.00 C ATOM 742 O MET A 127 -0.251 0.527 10.287 1.00 0.00 O ATOM 743 CB MET A 127 2.278 -1.372 9.595 1.00 0.00 C ATOM 744 CG MET A 127 2.871 -1.899 8.295 1.00 0.00 C ATOM 745 SD MET A 127 1.622 -2.499 7.129 1.00 0.00 S ATOM 746 CE MET A 127 0.677 -1.013 6.792 1.00 0.00 C ATOM 0 H MET A 127 4.083 0.293 9.943 1.00 0.00 H new ATOM 0 HA MET A 127 1.667 0.442 8.614 1.00 0.00 H new ATOM 0 HB2 MET A 127 2.956 -1.613 10.414 1.00 0.00 H new ATOM 0 HB3 MET A 127 1.342 -1.894 9.792 1.00 0.00 H new ATOM 0 HG2 MET A 127 3.450 -1.107 7.821 1.00 0.00 H new ATOM 0 HG3 MET A 127 3.565 -2.709 8.522 1.00 0.00 H new ATOM 0 HE1 MET A 127 0.033 -1.179 5.928 1.00 0.00 H new ATOM 0 HE2 MET A 127 0.064 -0.767 7.659 1.00 0.00 H new ATOM 0 HE3 MET A 127 1.358 -0.188 6.583 1.00 0.00 H new ATOM 756 N ARG A 128 1.340 0.655 11.864 1.00 0.00 N ATOM 757 CA ARG A 128 0.410 0.978 12.935 1.00 0.00 C ATOM 758 C ARG A 128 0.123 2.474 12.950 1.00 0.00 C ATOM 759 O ARG A 128 -1.030 2.901 13.053 1.00 0.00 O ATOM 760 CB ARG A 128 0.996 0.560 14.280 1.00 0.00 C ATOM 761 CG ARG A 128 1.517 -0.866 14.305 1.00 0.00 C ATOM 762 CD ARG A 128 2.253 -1.160 15.600 1.00 0.00 C ATOM 763 NE ARG A 128 3.051 -2.381 15.513 1.00 0.00 N ATOM 764 CZ ARG A 128 4.334 -2.454 15.875 1.00 0.00 C ATOM 765 NH1 ARG A 128 4.950 -1.384 16.366 1.00 0.00 N ATOM 766 NH2 ARG A 128 5.001 -3.595 15.756 1.00 0.00 N ATOM 0 H ARG A 128 2.316 0.600 12.156 1.00 0.00 H new ATOM 0 HA ARG A 128 -0.520 0.437 12.762 1.00 0.00 H new ATOM 0 HB2 ARG A 128 1.809 1.239 14.538 1.00 0.00 H new ATOM 0 HB3 ARG A 128 0.232 0.671 15.049 1.00 0.00 H new ATOM 0 HG2 ARG A 128 0.686 -1.562 14.190 1.00 0.00 H new ATOM 0 HG3 ARG A 128 2.186 -1.026 13.459 1.00 0.00 H new ATOM 0 HD2 ARG A 128 2.902 -0.320 15.846 1.00 0.00 H new ATOM 0 HD3 ARG A 128 1.533 -1.255 16.412 1.00 0.00 H new ATOM 0 HE ARG A 128 2.603 -3.225 15.156 1.00 0.00 H new ATOM 0 HH11 ARG A 128 4.443 -0.505 16.467 1.00 0.00 H new ATOM 0 HH12 ARG A 128 5.930 -1.442 16.642 1.00 0.00 H new ATOM 0 HH21 ARG A 128 4.534 -4.423 15.386 1.00 0.00 H new ATOM 0 HH22 ARG A 128 5.981 -3.644 16.034 1.00 0.00 H new ATOM 780 N ALA A 129 1.185 3.261 12.832 1.00 0.00 N ATOM 781 CA ALA A 129 1.086 4.712 12.884 1.00 0.00 C ATOM 782 C ALA A 129 0.271 5.264 11.722 1.00 0.00 C ATOM 783 O ALA A 129 -0.417 6.267 11.861 1.00 0.00 O ATOM 784 CB ALA A 129 2.473 5.332 12.890 1.00 0.00 C ATOM 0 H ALA A 129 2.134 2.913 12.698 1.00 0.00 H new ATOM 0 HA ALA A 129 0.569 4.975 13.807 1.00 0.00 H new ATOM 0 HB1 ALA A 129 2.386 6.418 12.929 1.00 0.00 H new ATOM 0 HB2 ALA A 129 3.025 4.981 13.762 1.00 0.00 H new ATOM 0 HB3 ALA A 129 3.005 5.043 11.983 1.00 0.00 H new ATOM 790 N TYR A 130 0.332 4.598 10.582 1.00 0.00 N ATOM 791 CA TYR A 130 -0.378 5.069 9.398 1.00 0.00 C ATOM 792 C TYR A 130 -1.873 4.853 9.556 1.00 0.00 C ATOM 793 O TYR A 130 -2.683 5.535 8.933 1.00 0.00 O ATOM 794 CB TYR A 130 0.122 4.357 8.138 1.00 0.00 C ATOM 795 CG TYR A 130 1.496 4.797 7.675 1.00 0.00 C ATOM 796 CD1 TYR A 130 1.923 4.537 6.381 1.00 0.00 C ATOM 797 CD2 TYR A 130 2.365 5.470 8.524 1.00 0.00 C ATOM 798 CE1 TYR A 130 3.170 4.932 5.952 1.00 0.00 C ATOM 799 CE2 TYR A 130 3.611 5.865 8.099 1.00 0.00 C ATOM 800 CZ TYR A 130 4.009 5.592 6.815 1.00 0.00 C ATOM 801 OH TYR A 130 5.252 5.992 6.389 1.00 0.00 O ATOM 0 H TYR A 130 0.860 3.736 10.448 1.00 0.00 H new ATOM 0 HA TYR A 130 -0.182 6.136 9.292 1.00 0.00 H new ATOM 0 HB2 TYR A 130 0.141 3.283 8.325 1.00 0.00 H new ATOM 0 HB3 TYR A 130 -0.592 4.527 7.332 1.00 0.00 H new ATOM 0 HD1 TYR A 130 1.267 4.016 5.699 1.00 0.00 H new ATOM 0 HD2 TYR A 130 2.056 5.687 9.536 1.00 0.00 H new ATOM 0 HE1 TYR A 130 3.487 4.724 4.941 1.00 0.00 H new ATOM 0 HE2 TYR A 130 4.274 6.388 8.773 1.00 0.00 H new ATOM 0 HH TYR A 130 5.276 5.996 5.409 1.00 0.00 H new ATOM 811 N MET A 131 -2.235 3.921 10.423 1.00 0.00 N ATOM 812 CA MET A 131 -3.631 3.593 10.643 1.00 0.00 C ATOM 813 C MET A 131 -4.253 4.521 11.678 1.00 0.00 C ATOM 814 O MET A 131 -5.426 4.384 12.016 1.00 0.00 O ATOM 815 CB MET A 131 -3.779 2.131 11.076 1.00 0.00 C ATOM 816 CG MET A 131 -3.375 1.120 10.005 1.00 0.00 C ATOM 817 SD MET A 131 -4.710 0.688 8.858 1.00 0.00 S ATOM 818 CE MET A 131 -5.003 2.240 8.007 1.00 0.00 C ATOM 0 H MET A 131 -1.579 3.379 10.986 1.00 0.00 H new ATOM 0 HA MET A 131 -4.162 3.731 9.701 1.00 0.00 H new ATOM 0 HB2 MET A 131 -3.172 1.964 11.966 1.00 0.00 H new ATOM 0 HB3 MET A 131 -4.816 1.950 11.359 1.00 0.00 H new ATOM 0 HG2 MET A 131 -2.538 1.524 9.436 1.00 0.00 H new ATOM 0 HG3 MET A 131 -3.021 0.212 10.492 1.00 0.00 H new ATOM 0 HE1 MET A 131 -5.405 2.040 7.014 1.00 0.00 H new ATOM 0 HE2 MET A 131 -5.718 2.837 8.574 1.00 0.00 H new ATOM 0 HE3 MET A 131 -4.065 2.788 7.916 1.00 0.00 H new ATOM 828 N GLN A 132 -3.471 5.469 12.182 1.00 0.00 N ATOM 829 CA GLN A 132 -4.004 6.469 13.096 1.00 0.00 C ATOM 830 C GLN A 132 -4.244 7.768 12.337 1.00 0.00 C ATOM 831 O GLN A 132 -4.937 8.667 12.817 1.00 0.00 O ATOM 832 CB GLN A 132 -3.052 6.705 14.277 1.00 0.00 C ATOM 833 CG GLN A 132 -1.896 7.636 13.960 1.00 0.00 C ATOM 834 CD GLN A 132 -0.842 7.661 15.045 1.00 0.00 C ATOM 835 OE1 GLN A 132 -1.132 7.466 16.224 1.00 0.00 O ATOM 836 NE2 GLN A 132 0.395 7.900 14.647 1.00 0.00 N ATOM 0 H GLN A 132 -2.477 5.565 11.975 1.00 0.00 H new ATOM 0 HA GLN A 132 -4.948 6.105 13.502 1.00 0.00 H new ATOM 0 HB2 GLN A 132 -3.619 7.118 15.111 1.00 0.00 H new ATOM 0 HB3 GLN A 132 -2.653 5.746 14.606 1.00 0.00 H new ATOM 0 HG2 GLN A 132 -1.436 7.328 13.021 1.00 0.00 H new ATOM 0 HG3 GLN A 132 -2.280 8.645 13.811 1.00 0.00 H new ATOM 0 HE21 GLN A 132 0.591 8.056 13.658 1.00 0.00 H new ATOM 0 HE22 GLN A 132 1.154 7.928 15.328 1.00 0.00 H new ATOM 845 N GLU A 133 -3.677 7.849 11.138 1.00 0.00 N ATOM 846 CA GLU A 133 -3.780 9.044 10.321 1.00 0.00 C ATOM 847 C GLU A 133 -4.991 8.956 9.407 1.00 0.00 C ATOM 848 O GLU A 133 -5.078 8.056 8.570 1.00 0.00 O ATOM 849 CB GLU A 133 -2.517 9.220 9.481 1.00 0.00 C ATOM 850 CG GLU A 133 -1.249 8.888 10.239 1.00 0.00 C ATOM 851 CD GLU A 133 0.002 9.396 9.556 1.00 0.00 C ATOM 852 OE1 GLU A 133 0.008 10.566 9.111 1.00 0.00 O ATOM 853 OE2 GLU A 133 0.997 8.647 9.501 1.00 0.00 O ATOM 0 H GLU A 133 -3.139 7.094 10.712 1.00 0.00 H new ATOM 0 HA GLU A 133 -3.894 9.904 10.981 1.00 0.00 H new ATOM 0 HB2 GLU A 133 -2.583 8.584 8.599 1.00 0.00 H new ATOM 0 HB3 GLU A 133 -2.463 10.250 9.128 1.00 0.00 H new ATOM 0 HG2 GLU A 133 -1.309 9.316 11.240 1.00 0.00 H new ATOM 0 HG3 GLU A 133 -1.177 7.807 10.358 1.00 0.00 H new ATOM 860 N PRO A 134 -5.932 9.905 9.539 1.00 0.00 N ATOM 861 CA PRO A 134 -7.160 9.930 8.735 1.00 0.00 C ATOM 862 C PRO A 134 -6.874 10.096 7.245 1.00 0.00 C ATOM 863 O PRO A 134 -7.746 9.886 6.409 1.00 0.00 O ATOM 864 CB PRO A 134 -7.932 11.137 9.278 1.00 0.00 C ATOM 865 CG PRO A 134 -6.906 11.983 9.946 1.00 0.00 C ATOM 866 CD PRO A 134 -5.877 11.032 10.487 1.00 0.00 C ATOM 0 HA PRO A 134 -7.713 8.994 8.814 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -8.430 11.681 8.475 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -8.706 10.827 9.980 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -6.458 12.683 9.241 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -7.349 12.576 10.746 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -4.886 11.485 10.518 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -6.115 10.716 11.503 1.00 0.00 H new ATOM 874 N LEU A 135 -5.648 10.467 6.918 1.00 0.00 N ATOM 875 CA LEU A 135 -5.256 10.621 5.530 1.00 0.00 C ATOM 876 C LEU A 135 -4.855 9.280 4.921 1.00 0.00 C ATOM 877 O LEU A 135 -5.073 9.044 3.734 1.00 0.00 O ATOM 878 CB LEU A 135 -4.111 11.629 5.407 1.00 0.00 C ATOM 879 CG LEU A 135 -4.444 13.045 5.884 1.00 0.00 C ATOM 880 CD1 LEU A 135 -3.250 13.965 5.706 1.00 0.00 C ATOM 881 CD2 LEU A 135 -5.651 13.595 5.138 1.00 0.00 C ATOM 0 H LEU A 135 -4.910 10.666 7.593 1.00 0.00 H new ATOM 0 HA LEU A 135 -6.115 10.999 4.976 1.00 0.00 H new ATOM 0 HB2 LEU A 135 -3.259 11.260 5.978 1.00 0.00 H new ATOM 0 HB3 LEU A 135 -3.799 11.677 4.364 1.00 0.00 H new ATOM 0 HG LEU A 135 -4.688 12.996 6.945 1.00 0.00 H new ATOM 0 HD11 LEU A 135 -3.508 14.966 6.051 1.00 0.00 H new ATOM 0 HD12 LEU A 135 -2.409 13.586 6.287 1.00 0.00 H new ATOM 0 HD13 LEU A 135 -2.975 14.004 4.652 1.00 0.00 H new ATOM 0 HD21 LEU A 135 -5.870 14.602 5.493 1.00 0.00 H new ATOM 0 HD22 LEU A 135 -5.436 13.625 4.070 1.00 0.00 H new ATOM 0 HD23 LEU A 135 -6.513 12.952 5.316 1.00 0.00 H new ATOM 893 N PHE A 136 -4.285 8.390 5.731 1.00 0.00 N ATOM 894 CA PHE A 136 -3.824 7.109 5.217 1.00 0.00 C ATOM 895 C PHE A 136 -4.933 6.071 5.314 1.00 0.00 C ATOM 896 O PHE A 136 -5.055 5.196 4.463 1.00 0.00 O ATOM 897 CB PHE A 136 -2.577 6.629 5.962 1.00 0.00 C ATOM 898 CG PHE A 136 -1.909 5.447 5.312 1.00 0.00 C ATOM 899 CD1 PHE A 136 -0.955 5.632 4.325 1.00 0.00 C ATOM 900 CD2 PHE A 136 -2.237 4.152 5.686 1.00 0.00 C ATOM 901 CE1 PHE A 136 -0.339 4.551 3.724 1.00 0.00 C ATOM 902 CE2 PHE A 136 -1.623 3.068 5.088 1.00 0.00 C ATOM 903 CZ PHE A 136 -0.673 3.269 4.106 1.00 0.00 C ATOM 0 H PHE A 136 -4.134 8.531 6.730 1.00 0.00 H new ATOM 0 HA PHE A 136 -3.557 7.243 4.169 1.00 0.00 H new ATOM 0 HB2 PHE A 136 -1.863 7.450 6.026 1.00 0.00 H new ATOM 0 HB3 PHE A 136 -2.852 6.365 6.983 1.00 0.00 H new ATOM 0 HD1 PHE A 136 -0.689 6.634 4.021 1.00 0.00 H new ATOM 0 HD2 PHE A 136 -2.980 3.989 6.453 1.00 0.00 H new ATOM 0 HE1 PHE A 136 0.403 4.710 2.956 1.00 0.00 H new ATOM 0 HE2 PHE A 136 -1.886 2.064 5.388 1.00 0.00 H new ATOM 0 HZ PHE A 136 -0.192 2.423 3.638 1.00 0.00 H new ATOM 913 N VAL A 137 -5.742 6.179 6.360 1.00 0.00 N ATOM 914 CA VAL A 137 -6.871 5.279 6.554 1.00 0.00 C ATOM 915 C VAL A 137 -7.819 5.309 5.359 1.00 0.00 C ATOM 916 O VAL A 137 -8.254 4.268 4.879 1.00 0.00 O ATOM 917 CB VAL A 137 -7.663 5.637 7.819 1.00 0.00 C ATOM 918 CG1 VAL A 137 -6.911 5.253 9.081 1.00 0.00 C ATOM 919 CG2 VAL A 137 -7.993 7.091 7.832 1.00 0.00 C ATOM 0 H VAL A 137 -5.636 6.884 7.090 1.00 0.00 H new ATOM 0 HA VAL A 137 -6.454 4.277 6.660 1.00 0.00 H new ATOM 0 HB VAL A 137 -8.590 5.063 7.801 1.00 0.00 H new ATOM 0 HG11 VAL A 137 -7.505 5.523 9.955 1.00 0.00 H new ATOM 0 HG12 VAL A 137 -6.729 4.178 9.083 1.00 0.00 H new ATOM 0 HG13 VAL A 137 -5.959 5.782 9.112 1.00 0.00 H new ATOM 0 HG21 VAL A 137 -8.555 7.329 8.735 1.00 0.00 H new ATOM 0 HG22 VAL A 137 -7.072 7.673 7.814 1.00 0.00 H new ATOM 0 HG23 VAL A 137 -8.594 7.335 6.956 1.00 0.00 H new ATOM 929 N GLU A 138 -8.139 6.511 4.900 1.00 0.00 N ATOM 930 CA GLU A 138 -8.984 6.699 3.726 1.00 0.00 C ATOM 931 C GLU A 138 -8.324 6.103 2.497 1.00 0.00 C ATOM 932 O GLU A 138 -8.971 5.425 1.704 1.00 0.00 O ATOM 933 CB GLU A 138 -9.255 8.183 3.497 1.00 0.00 C ATOM 934 CG GLU A 138 -10.014 8.840 4.634 1.00 0.00 C ATOM 935 CD GLU A 138 -11.464 8.408 4.708 1.00 0.00 C ATOM 936 OE1 GLU A 138 -12.346 9.293 4.720 1.00 0.00 O ATOM 937 OE2 GLU A 138 -11.735 7.188 4.755 1.00 0.00 O ATOM 0 H GLU A 138 -7.822 7.381 5.328 1.00 0.00 H new ATOM 0 HA GLU A 138 -9.931 6.189 3.902 1.00 0.00 H new ATOM 0 HB2 GLU A 138 -8.306 8.700 3.357 1.00 0.00 H new ATOM 0 HB3 GLU A 138 -9.823 8.303 2.574 1.00 0.00 H new ATOM 0 HG2 GLU A 138 -9.522 8.602 5.577 1.00 0.00 H new ATOM 0 HG3 GLU A 138 -9.969 9.923 4.515 1.00 0.00 H new ATOM 944 N PHE A 139 -7.030 6.358 2.359 1.00 0.00 N ATOM 945 CA PHE A 139 -6.240 5.783 1.281 1.00 0.00 C ATOM 946 C PHE A 139 -6.370 4.268 1.298 1.00 0.00 C ATOM 947 O PHE A 139 -6.679 3.643 0.282 1.00 0.00 O ATOM 948 CB PHE A 139 -4.778 6.204 1.446 1.00 0.00 C ATOM 949 CG PHE A 139 -3.799 5.432 0.600 1.00 0.00 C ATOM 950 CD1 PHE A 139 -3.810 5.540 -0.779 1.00 0.00 C ATOM 951 CD2 PHE A 139 -2.859 4.607 1.197 1.00 0.00 C ATOM 952 CE1 PHE A 139 -2.900 4.837 -1.548 1.00 0.00 C ATOM 953 CE2 PHE A 139 -1.947 3.901 0.432 1.00 0.00 C ATOM 954 CZ PHE A 139 -1.968 4.018 -0.942 1.00 0.00 C ATOM 0 H PHE A 139 -6.502 6.965 2.987 1.00 0.00 H new ATOM 0 HA PHE A 139 -6.605 6.147 0.321 1.00 0.00 H new ATOM 0 HB2 PHE A 139 -4.690 7.263 1.204 1.00 0.00 H new ATOM 0 HB3 PHE A 139 -4.498 6.092 2.494 1.00 0.00 H new ATOM 0 HD1 PHE A 139 -4.536 6.179 -1.260 1.00 0.00 H new ATOM 0 HD2 PHE A 139 -2.838 4.514 2.273 1.00 0.00 H new ATOM 0 HE1 PHE A 139 -2.919 4.929 -2.624 1.00 0.00 H new ATOM 0 HE2 PHE A 139 -1.221 3.260 0.910 1.00 0.00 H new ATOM 0 HZ PHE A 139 -1.257 3.470 -1.543 1.00 0.00 H new ATOM 964 N ALA A 140 -6.167 3.700 2.476 1.00 0.00 N ATOM 965 CA ALA A 140 -6.279 2.269 2.670 1.00 0.00 C ATOM 966 C ALA A 140 -7.695 1.792 2.391 1.00 0.00 C ATOM 967 O ALA A 140 -7.895 0.845 1.636 1.00 0.00 O ATOM 968 CB ALA A 140 -5.858 1.899 4.083 1.00 0.00 C ATOM 0 H ALA A 140 -5.921 4.218 3.319 1.00 0.00 H new ATOM 0 HA ALA A 140 -5.613 1.772 1.964 1.00 0.00 H new ATOM 0 HB1 ALA A 140 -5.946 0.821 4.218 1.00 0.00 H new ATOM 0 HB2 ALA A 140 -4.824 2.202 4.246 1.00 0.00 H new ATOM 0 HB3 ALA A 140 -6.502 2.408 4.800 1.00 0.00 H new ATOM 974 N ASP A 141 -8.674 2.484 2.960 1.00 0.00 N ATOM 975 CA ASP A 141 -10.071 2.071 2.832 1.00 0.00 C ATOM 976 C ASP A 141 -10.501 2.091 1.375 1.00 0.00 C ATOM 977 O ASP A 141 -11.287 1.259 0.928 1.00 0.00 O ATOM 978 CB ASP A 141 -10.983 2.983 3.659 1.00 0.00 C ATOM 979 CG ASP A 141 -12.451 2.627 3.512 1.00 0.00 C ATOM 980 OD1 ASP A 141 -13.181 3.362 2.808 1.00 0.00 O ATOM 981 OD2 ASP A 141 -12.883 1.612 4.101 1.00 0.00 O ATOM 0 H ASP A 141 -8.531 3.330 3.512 1.00 0.00 H new ATOM 0 HA ASP A 141 -10.159 1.053 3.211 1.00 0.00 H new ATOM 0 HB2 ASP A 141 -10.700 2.917 4.710 1.00 0.00 H new ATOM 0 HB3 ASP A 141 -10.831 4.018 3.352 1.00 0.00 H new ATOM 986 N CYS A 142 -9.945 3.027 0.631 1.00 0.00 N ATOM 987 CA CYS A 142 -10.295 3.197 -0.764 1.00 0.00 C ATOM 988 C CYS A 142 -9.637 2.136 -1.638 1.00 0.00 C ATOM 989 O CYS A 142 -10.274 1.594 -2.541 1.00 0.00 O ATOM 990 CB CYS A 142 -9.904 4.595 -1.229 1.00 0.00 C ATOM 991 SG CYS A 142 -10.955 5.904 -0.561 1.00 0.00 S ATOM 0 H CYS A 142 -9.245 3.685 0.973 1.00 0.00 H new ATOM 0 HA CYS A 142 -11.374 3.077 -0.862 1.00 0.00 H new ATOM 0 HB2 CYS A 142 -8.871 4.788 -0.941 1.00 0.00 H new ATOM 0 HB3 CYS A 142 -9.943 4.630 -2.318 1.00 0.00 H new ATOM 0 HG CYS A 142 -10.500 6.276 0.598 1.00 0.00 H new ATOM 997 N CYS A 143 -8.377 1.818 -1.360 1.00 0.00 N ATOM 998 CA CYS A 143 -7.654 0.853 -2.172 1.00 0.00 C ATOM 999 C CYS A 143 -8.156 -0.560 -1.900 1.00 0.00 C ATOM 1000 O CYS A 143 -8.142 -1.412 -2.789 1.00 0.00 O ATOM 1001 CB CYS A 143 -6.143 0.949 -1.930 1.00 0.00 C ATOM 1002 SG CYS A 143 -5.636 0.663 -0.222 1.00 0.00 S ATOM 0 H CYS A 143 -7.842 2.211 -0.586 1.00 0.00 H new ATOM 0 HA CYS A 143 -7.840 1.088 -3.220 1.00 0.00 H new ATOM 0 HB2 CYS A 143 -5.639 0.225 -2.571 1.00 0.00 H new ATOM 0 HB3 CYS A 143 -5.801 1.938 -2.236 1.00 0.00 H new ATOM 0 HG CYS A 143 -6.690 0.524 0.526 1.00 0.00 H new ATOM 1008 N LEU A 144 -8.632 -0.793 -0.679 1.00 0.00 N ATOM 1009 CA LEU A 144 -9.162 -2.098 -0.304 1.00 0.00 C ATOM 1010 C LEU A 144 -10.348 -2.467 -1.183 1.00 0.00 C ATOM 1011 O LEU A 144 -10.433 -3.585 -1.681 1.00 0.00 O ATOM 1012 CB LEU A 144 -9.580 -2.119 1.169 1.00 0.00 C ATOM 1013 CG LEU A 144 -8.445 -1.910 2.173 1.00 0.00 C ATOM 1014 CD1 LEU A 144 -8.963 -1.999 3.597 1.00 0.00 C ATOM 1015 CD2 LEU A 144 -7.332 -2.915 1.940 1.00 0.00 C ATOM 0 H LEU A 144 -8.661 -0.096 0.065 1.00 0.00 H new ATOM 0 HA LEU A 144 -8.370 -2.833 -0.450 1.00 0.00 H new ATOM 0 HB2 LEU A 144 -10.331 -1.345 1.328 1.00 0.00 H new ATOM 0 HB3 LEU A 144 -10.059 -3.075 1.380 1.00 0.00 H new ATOM 0 HG LEU A 144 -8.037 -0.910 2.023 1.00 0.00 H new ATOM 0 HD11 LEU A 144 -8.139 -1.847 4.294 1.00 0.00 H new ATOM 0 HD12 LEU A 144 -9.720 -1.231 3.757 1.00 0.00 H new ATOM 0 HD13 LEU A 144 -9.403 -2.982 3.763 1.00 0.00 H new ATOM 0 HD21 LEU A 144 -6.535 -2.749 2.664 1.00 0.00 H new ATOM 0 HD22 LEU A 144 -7.724 -3.925 2.057 1.00 0.00 H new ATOM 0 HD23 LEU A 144 -6.937 -2.793 0.931 1.00 0.00 H new ATOM 1027 N GLY A 145 -11.239 -1.504 -1.404 1.00 0.00 N ATOM 1028 CA GLY A 145 -12.427 -1.755 -2.201 1.00 0.00 C ATOM 1029 C GLY A 145 -12.097 -2.040 -3.653 1.00 0.00 C ATOM 1030 O GLY A 145 -12.891 -2.642 -4.374 1.00 0.00 O ATOM 0 H GLY A 145 -11.159 -0.553 -1.045 1.00 0.00 H new ATOM 0 HA2 GLY A 145 -12.971 -2.601 -1.782 1.00 0.00 H new ATOM 0 HA3 GLY A 145 -13.089 -0.891 -2.144 1.00 0.00 H new ATOM 1034 N ILE A 146 -10.915 -1.617 -4.074 1.00 0.00 N ATOM 1035 CA ILE A 146 -10.476 -1.808 -5.445 1.00 0.00 C ATOM 1036 C ILE A 146 -9.782 -3.160 -5.603 1.00 0.00 C ATOM 1037 O ILE A 146 -9.844 -3.781 -6.664 1.00 0.00 O ATOM 1038 CB ILE A 146 -9.515 -0.674 -5.869 1.00 0.00 C ATOM 1039 CG1 ILE A 146 -10.169 0.685 -5.614 1.00 0.00 C ATOM 1040 CG2 ILE A 146 -9.125 -0.806 -7.336 1.00 0.00 C ATOM 1041 CD1 ILE A 146 -9.220 1.854 -5.758 1.00 0.00 C ATOM 0 H ILE A 146 -10.239 -1.136 -3.480 1.00 0.00 H new ATOM 0 HA ILE A 146 -11.355 -1.786 -6.089 1.00 0.00 H new ATOM 0 HB ILE A 146 -8.607 -0.752 -5.272 1.00 0.00 H new ATOM 0 HG12 ILE A 146 -10.999 0.815 -6.309 1.00 0.00 H new ATOM 0 HG13 ILE A 146 -10.590 0.692 -4.609 1.00 0.00 H new ATOM 0 HG21 ILE A 146 -8.449 0.005 -7.607 1.00 0.00 H new ATOM 0 HG22 ILE A 146 -8.627 -1.763 -7.496 1.00 0.00 H new ATOM 0 HG23 ILE A 146 -10.020 -0.755 -7.956 1.00 0.00 H new ATOM 0 HD11 ILE A 146 -9.755 2.783 -5.563 1.00 0.00 H new ATOM 0 HD12 ILE A 146 -8.403 1.749 -5.045 1.00 0.00 H new ATOM 0 HD13 ILE A 146 -8.818 1.873 -6.771 1.00 0.00 H new ATOM 1053 N VAL A 147 -9.139 -3.626 -4.537 1.00 0.00 N ATOM 1054 CA VAL A 147 -8.385 -4.874 -4.601 1.00 0.00 C ATOM 1055 C VAL A 147 -9.140 -6.036 -3.962 1.00 0.00 C ATOM 1056 O VAL A 147 -8.573 -7.114 -3.776 1.00 0.00 O ATOM 1057 CB VAL A 147 -7.002 -4.750 -3.930 1.00 0.00 C ATOM 1058 CG1 VAL A 147 -6.190 -3.638 -4.567 1.00 0.00 C ATOM 1059 CG2 VAL A 147 -7.152 -4.525 -2.435 1.00 0.00 C ATOM 0 H VAL A 147 -9.124 -3.164 -3.628 1.00 0.00 H new ATOM 0 HA VAL A 147 -8.249 -5.080 -5.663 1.00 0.00 H new ATOM 0 HB VAL A 147 -6.464 -5.686 -4.081 1.00 0.00 H new ATOM 0 HG11 VAL A 147 -5.219 -3.570 -4.077 1.00 0.00 H new ATOM 0 HG12 VAL A 147 -6.048 -3.852 -5.626 1.00 0.00 H new ATOM 0 HG13 VAL A 147 -6.719 -2.692 -4.456 1.00 0.00 H new ATOM 0 HG21 VAL A 147 -6.166 -4.440 -1.979 1.00 0.00 H new ATOM 0 HG22 VAL A 147 -7.713 -3.607 -2.260 1.00 0.00 H new ATOM 0 HG23 VAL A 147 -7.685 -5.366 -1.992 1.00 0.00 H new ATOM 1069 N GLU A 148 -10.404 -5.813 -3.619 1.00 0.00 N ATOM 1070 CA GLU A 148 -11.245 -6.877 -3.078 1.00 0.00 C ATOM 1071 C GLU A 148 -11.313 -8.055 -4.044 1.00 0.00 C ATOM 1072 O GLU A 148 -11.788 -7.916 -5.169 1.00 0.00 O ATOM 1073 CB GLU A 148 -12.659 -6.363 -2.796 1.00 0.00 C ATOM 1074 CG GLU A 148 -12.773 -5.552 -1.517 1.00 0.00 C ATOM 1075 CD GLU A 148 -12.441 -6.367 -0.285 1.00 0.00 C ATOM 1076 OE1 GLU A 148 -13.248 -7.249 0.085 1.00 0.00 O ATOM 1077 OE2 GLU A 148 -11.377 -6.136 0.325 1.00 0.00 O ATOM 0 H GLU A 148 -10.868 -4.909 -3.705 1.00 0.00 H new ATOM 0 HA GLU A 148 -10.797 -7.210 -2.142 1.00 0.00 H new ATOM 0 HB2 GLU A 148 -12.986 -5.749 -3.635 1.00 0.00 H new ATOM 0 HB3 GLU A 148 -13.340 -7.213 -2.738 1.00 0.00 H new ATOM 0 HG2 GLU A 148 -12.103 -4.694 -1.573 1.00 0.00 H new ATOM 0 HG3 GLU A 148 -13.786 -5.160 -1.428 1.00 0.00 H new ATOM 1084 N PRO A 149 -10.831 -9.233 -3.619 1.00 0.00 N ATOM 1085 CA PRO A 149 -10.830 -10.433 -4.458 1.00 0.00 C ATOM 1086 C PRO A 149 -12.221 -11.048 -4.585 1.00 0.00 C ATOM 1087 O PRO A 149 -12.433 -11.977 -5.366 1.00 0.00 O ATOM 1088 CB PRO A 149 -9.884 -11.379 -3.719 1.00 0.00 C ATOM 1089 CG PRO A 149 -9.982 -10.970 -2.290 1.00 0.00 C ATOM 1090 CD PRO A 149 -10.233 -9.484 -2.295 1.00 0.00 C ATOM 0 HA PRO A 149 -10.522 -10.220 -5.482 1.00 0.00 H new ATOM 0 HB2 PRO A 149 -10.179 -12.420 -3.854 1.00 0.00 H new ATOM 0 HB3 PRO A 149 -8.863 -11.286 -4.088 1.00 0.00 H new ATOM 0 HG2 PRO A 149 -10.791 -11.500 -1.788 1.00 0.00 H new ATOM 0 HG3 PRO A 149 -9.064 -11.208 -1.753 1.00 0.00 H new ATOM 0 HD2 PRO A 149 -10.906 -9.189 -1.490 1.00 0.00 H new ATOM 0 HD3 PRO A 149 -9.309 -8.922 -2.160 1.00 0.00 H new ATOM 1098 N SER A 150 -13.155 -10.498 -3.809 1.00 0.00 N ATOM 1099 CA SER A 150 -14.540 -10.941 -3.781 1.00 0.00 C ATOM 1100 C SER A 150 -14.645 -12.333 -3.163 1.00 0.00 C ATOM 1101 O SER A 150 -14.710 -13.343 -3.864 1.00 0.00 O ATOM 1102 CB SER A 150 -15.160 -10.911 -5.185 1.00 0.00 C ATOM 1103 OG SER A 150 -16.560 -11.142 -5.134 1.00 0.00 O ATOM 0 H SER A 150 -12.963 -9.722 -3.175 1.00 0.00 H new ATOM 0 HA SER A 150 -15.105 -10.248 -3.157 1.00 0.00 H new ATOM 0 HB2 SER A 150 -14.965 -9.945 -5.651 1.00 0.00 H new ATOM 0 HB3 SER A 150 -14.687 -11.668 -5.811 1.00 0.00 H new ATOM 0 HG SER A 150 -16.929 -11.116 -6.041 1.00 0.00 H new ATOM 1109 N GLN A 151 -14.668 -12.372 -1.837 1.00 0.00 N ATOM 1110 CA GLN A 151 -14.769 -13.626 -1.101 1.00 0.00 C ATOM 1111 C GLN A 151 -16.224 -14.065 -0.972 1.00 0.00 C ATOM 1112 O GLN A 151 -16.601 -14.752 -0.022 1.00 0.00 O ATOM 1113 CB GLN A 151 -14.127 -13.480 0.277 1.00 0.00 C ATOM 1114 CG GLN A 151 -12.623 -13.271 0.216 1.00 0.00 C ATOM 1115 CD GLN A 151 -11.996 -13.063 1.581 1.00 0.00 C ATOM 1116 OE1 GLN A 151 -12.622 -12.524 2.496 1.00 0.00 O ATOM 1117 NE2 GLN A 151 -10.754 -13.494 1.728 1.00 0.00 N ATOM 0 H GLN A 151 -14.618 -11.543 -1.245 1.00 0.00 H new ATOM 0 HA GLN A 151 -14.234 -14.396 -1.656 1.00 0.00 H new ATOM 0 HB2 GLN A 151 -14.584 -12.638 0.796 1.00 0.00 H new ATOM 0 HB3 GLN A 151 -14.340 -14.372 0.867 1.00 0.00 H new ATOM 0 HG2 GLN A 151 -12.161 -14.135 -0.262 1.00 0.00 H new ATOM 0 HG3 GLN A 151 -12.407 -12.407 -0.412 1.00 0.00 H new ATOM 0 HE21 GLN A 151 -10.271 -13.935 0.945 1.00 0.00 H new ATOM 0 HE22 GLN A 151 -10.279 -13.386 2.624 1.00 0.00 H new ATOM 1126 N ASN A 152 -17.034 -13.658 -1.933 1.00 0.00 N ATOM 1127 CA ASN A 152 -18.430 -14.046 -1.985 1.00 0.00 C ATOM 1128 C ASN A 152 -18.764 -14.546 -3.382 1.00 0.00 C ATOM 1129 O ASN A 152 -18.459 -13.881 -4.377 1.00 0.00 O ATOM 1130 CB ASN A 152 -19.323 -12.866 -1.614 1.00 0.00 C ATOM 1131 CG ASN A 152 -20.786 -13.252 -1.534 1.00 0.00 C ATOM 1132 OD1 ASN A 152 -21.131 -14.382 -1.184 1.00 0.00 O ATOM 1133 ND2 ASN A 152 -21.655 -12.315 -1.853 1.00 0.00 N ATOM 0 H ASN A 152 -16.742 -13.050 -2.698 1.00 0.00 H new ATOM 0 HA ASN A 152 -18.607 -14.846 -1.267 1.00 0.00 H new ATOM 0 HB2 ASN A 152 -19.004 -12.460 -0.654 1.00 0.00 H new ATOM 0 HB3 ASN A 152 -19.199 -12.074 -2.352 1.00 0.00 H new ATOM 0 HD21 ASN A 152 -22.655 -12.513 -1.815 1.00 0.00 H new ATOM 0 HD22 ASN A 152 -21.328 -11.392 -2.138 1.00 0.00 H new ATOM 1140 N GLU A 153 -19.370 -15.724 -3.452 1.00 0.00 N ATOM 1141 CA GLU A 153 -19.671 -16.357 -4.729 1.00 0.00 C ATOM 1142 C GLU A 153 -20.694 -15.546 -5.521 1.00 0.00 C ATOM 1143 O GLU A 153 -21.607 -14.940 -4.951 1.00 0.00 O ATOM 1144 CB GLU A 153 -20.170 -17.790 -4.516 1.00 0.00 C ATOM 1145 CG GLU A 153 -21.449 -17.888 -3.702 1.00 0.00 C ATOM 1146 CD GLU A 153 -21.896 -19.319 -3.499 1.00 0.00 C ATOM 1147 OE1 GLU A 153 -21.841 -19.810 -2.351 1.00 0.00 O ATOM 1148 OE2 GLU A 153 -22.300 -19.967 -4.486 1.00 0.00 O ATOM 0 H GLU A 153 -19.664 -16.262 -2.637 1.00 0.00 H new ATOM 0 HA GLU A 153 -18.749 -16.393 -5.310 1.00 0.00 H new ATOM 0 HB2 GLU A 153 -20.335 -18.254 -5.488 1.00 0.00 H new ATOM 0 HB3 GLU A 153 -19.390 -18.364 -4.017 1.00 0.00 H new ATOM 0 HG2 GLU A 153 -21.295 -17.417 -2.731 1.00 0.00 H new ATOM 0 HG3 GLU A 153 -22.240 -17.331 -4.205 1.00 0.00 H new ATOM 1155 N GLU A 154 -20.523 -15.541 -6.834 1.00 0.00 N ATOM 1156 CA GLU A 154 -21.375 -14.785 -7.730 1.00 0.00 C ATOM 1157 C GLU A 154 -21.228 -15.341 -9.140 1.00 0.00 C ATOM 1158 O GLU A 154 -20.235 -16.007 -9.443 1.00 0.00 O ATOM 1159 CB GLU A 154 -20.982 -13.303 -7.693 1.00 0.00 C ATOM 1160 CG GLU A 154 -21.886 -12.396 -8.510 1.00 0.00 C ATOM 1161 CD GLU A 154 -21.450 -10.949 -8.459 1.00 0.00 C ATOM 1162 OE1 GLU A 154 -22.205 -10.113 -7.917 1.00 0.00 O ATOM 1163 OE2 GLU A 154 -20.346 -10.640 -8.955 1.00 0.00 O ATOM 0 H GLU A 154 -19.786 -16.064 -7.307 1.00 0.00 H new ATOM 0 HA GLU A 154 -22.415 -14.873 -7.416 1.00 0.00 H new ATOM 0 HB2 GLU A 154 -20.987 -12.964 -6.657 1.00 0.00 H new ATOM 0 HB3 GLU A 154 -19.960 -13.201 -8.057 1.00 0.00 H new ATOM 0 HG2 GLU A 154 -21.894 -12.734 -9.546 1.00 0.00 H new ATOM 0 HG3 GLU A 154 -22.908 -12.478 -8.140 1.00 0.00 H new ATOM 1170 N SER A 155 -22.222 -15.099 -9.978 1.00 0.00 N ATOM 1171 CA SER A 155 -22.165 -15.505 -11.373 1.00 0.00 C ATOM 1172 C SER A 155 -21.027 -14.777 -12.088 1.00 0.00 C ATOM 1173 O SER A 155 -19.969 -15.400 -12.313 1.00 0.00 O ATOM 1174 CB SER A 155 -23.499 -15.218 -12.062 1.00 0.00 C ATOM 1175 OG SER A 155 -24.569 -15.875 -11.397 1.00 0.00 O ATOM 1176 OXT SER A 155 -21.185 -13.578 -12.398 1.00 0.00 O ATOM 0 H SER A 155 -23.083 -14.620 -9.715 1.00 0.00 H new ATOM 0 HA SER A 155 -21.975 -16.577 -11.419 1.00 0.00 H new ATOM 0 HB2 SER A 155 -23.681 -14.143 -12.077 1.00 0.00 H new ATOM 0 HB3 SER A 155 -23.454 -15.548 -13.100 1.00 0.00 H new ATOM 0 HG SER A 155 -25.412 -15.674 -11.856 1.00 0.00 H new TER 1182 SER A 155 ATOM 1183 N ASP B 462 -9.912 -9.525 7.618 1.00 0.00 N ATOM 1184 CA ASP B 462 -8.790 -9.548 8.584 1.00 0.00 C ATOM 1185 C ASP B 462 -7.846 -8.379 8.341 1.00 0.00 C ATOM 1186 O ASP B 462 -7.335 -8.197 7.238 1.00 0.00 O ATOM 1187 CB ASP B 462 -8.029 -10.866 8.469 1.00 0.00 C ATOM 1188 CG ASP B 462 -6.723 -10.855 9.226 1.00 0.00 C ATOM 1189 OD1 ASP B 462 -5.665 -10.778 8.577 1.00 0.00 O ATOM 1190 OD2 ASP B 462 -6.751 -10.912 10.471 1.00 0.00 O ATOM 0 HA ASP B 462 -9.199 -9.457 9.590 1.00 0.00 H new ATOM 0 HB2 ASP B 462 -8.655 -11.676 8.845 1.00 0.00 H new ATOM 0 HB3 ASP B 462 -7.833 -11.076 7.418 1.00 0.00 H new ATOM 1197 N ILE B 463 -7.603 -7.608 9.395 1.00 0.00 N ATOM 1198 CA ILE B 463 -6.829 -6.372 9.293 1.00 0.00 C ATOM 1199 C ILE B 463 -5.360 -6.656 8.982 1.00 0.00 C ATOM 1200 O ILE B 463 -4.703 -5.871 8.296 1.00 0.00 O ATOM 1201 CB ILE B 463 -6.936 -5.522 10.580 1.00 0.00 C ATOM 1202 CG1 ILE B 463 -8.408 -5.249 10.906 1.00 0.00 C ATOM 1203 CG2 ILE B 463 -6.176 -4.207 10.423 1.00 0.00 C ATOM 1204 CD1 ILE B 463 -8.613 -4.480 12.192 1.00 0.00 C ATOM 0 H ILE B 463 -7.933 -7.818 10.337 1.00 0.00 H new ATOM 0 HA ILE B 463 -7.257 -5.803 8.468 1.00 0.00 H new ATOM 0 HB ILE B 463 -6.488 -6.079 11.402 1.00 0.00 H new ATOM 0 HG12 ILE B 463 -8.856 -4.691 10.084 1.00 0.00 H new ATOM 0 HG13 ILE B 463 -8.939 -6.199 10.972 1.00 0.00 H new ATOM 0 HG21 ILE B 463 -6.264 -3.624 11.340 1.00 0.00 H new ATOM 0 HG22 ILE B 463 -5.125 -4.416 10.225 1.00 0.00 H new ATOM 0 HG23 ILE B 463 -6.596 -3.641 9.591 1.00 0.00 H new ATOM 0 HD11 ILE B 463 -9.679 -4.324 12.357 1.00 0.00 H new ATOM 0 HD12 ILE B 463 -8.196 -5.046 13.025 1.00 0.00 H new ATOM 0 HD13 ILE B 463 -8.112 -3.515 12.122 1.00 0.00 H new ATOM 1216 N ARG B 464 -4.850 -7.782 9.476 1.00 0.00 N ATOM 1217 CA ARG B 464 -3.487 -8.197 9.156 1.00 0.00 C ATOM 1218 C ARG B 464 -3.336 -8.350 7.647 1.00 0.00 C ATOM 1219 O ARG B 464 -2.339 -7.920 7.060 1.00 0.00 O ATOM 1220 CB ARG B 464 -3.134 -9.515 9.853 1.00 0.00 C ATOM 1221 CG ARG B 464 -3.031 -9.414 11.367 1.00 0.00 C ATOM 1222 CD ARG B 464 -1.863 -8.542 11.800 1.00 0.00 C ATOM 1223 NE ARG B 464 -0.583 -9.036 11.283 1.00 0.00 N ATOM 1224 CZ ARG B 464 0.576 -8.928 11.933 1.00 0.00 C ATOM 1225 NH1 ARG B 464 0.626 -8.362 13.132 1.00 0.00 N ATOM 1226 NH2 ARG B 464 1.690 -9.393 11.380 1.00 0.00 N ATOM 0 H ARG B 464 -5.355 -8.418 10.094 1.00 0.00 H new ATOM 0 HA ARG B 464 -2.801 -7.429 9.515 1.00 0.00 H new ATOM 0 HB2 ARG B 464 -3.889 -10.260 9.601 1.00 0.00 H new ATOM 0 HB3 ARG B 464 -2.185 -9.878 9.459 1.00 0.00 H new ATOM 0 HG2 ARG B 464 -3.958 -9.004 11.767 1.00 0.00 H new ATOM 0 HG3 ARG B 464 -2.915 -10.412 11.790 1.00 0.00 H new ATOM 0 HD2 ARG B 464 -2.024 -7.522 11.452 1.00 0.00 H new ATOM 0 HD3 ARG B 464 -1.823 -8.505 12.889 1.00 0.00 H new ATOM 0 HE ARG B 464 -0.579 -9.490 10.370 1.00 0.00 H new ATOM 0 HH11 ARG B 464 -0.227 -8.005 13.564 1.00 0.00 H new ATOM 0 HH12 ARG B 464 1.517 -8.284 13.622 1.00 0.00 H new ATOM 0 HH21 ARG B 464 1.658 -9.832 10.460 1.00 0.00 H new ATOM 0 HH22 ARG B 464 2.578 -9.311 11.875 1.00 0.00 H new ATOM 1240 N HIS B 465 -4.351 -8.942 7.026 1.00 0.00 N ATOM 1241 CA HIS B 465 -4.387 -9.107 5.582 1.00 0.00 C ATOM 1242 C HIS B 465 -4.484 -7.751 4.905 1.00 0.00 C ATOM 1243 O HIS B 465 -3.754 -7.472 3.957 1.00 0.00 O ATOM 1244 CB HIS B 465 -5.575 -9.992 5.168 1.00 0.00 C ATOM 1245 CG HIS B 465 -5.841 -10.008 3.690 1.00 0.00 C ATOM 1246 ND1 HIS B 465 -5.154 -10.809 2.805 1.00 0.00 N ATOM 1247 CD2 HIS B 465 -6.710 -9.287 2.941 1.00 0.00 C ATOM 1248 CE1 HIS B 465 -5.584 -10.577 1.580 1.00 0.00 C ATOM 1249 NE2 HIS B 465 -6.528 -9.661 1.636 1.00 0.00 N ATOM 0 H HIS B 465 -5.167 -9.318 7.509 1.00 0.00 H new ATOM 0 HA HIS B 465 -3.466 -9.596 5.266 1.00 0.00 H new ATOM 0 HB2 HIS B 465 -5.389 -11.012 5.504 1.00 0.00 H new ATOM 0 HB3 HIS B 465 -6.470 -9.645 5.684 1.00 0.00 H new ATOM 0 HD2 HIS B 465 -7.415 -8.554 3.305 1.00 0.00 H new ATOM 0 HE1 HIS B 465 -5.223 -11.057 0.683 1.00 0.00 H new ATOM 0 HE2 HIS B 465 -7.041 -9.290 0.836 1.00 0.00 H new ATOM 1258 N GLU B 466 -5.384 -6.918 5.403 1.00 0.00 N ATOM 1259 CA GLU B 466 -5.615 -5.600 4.828 1.00 0.00 C ATOM 1260 C GLU B 466 -4.324 -4.789 4.780 1.00 0.00 C ATOM 1261 O GLU B 466 -3.960 -4.258 3.737 1.00 0.00 O ATOM 1262 CB GLU B 466 -6.666 -4.844 5.636 1.00 0.00 C ATOM 1263 CG GLU B 466 -7.978 -5.596 5.804 1.00 0.00 C ATOM 1264 CD GLU B 466 -8.705 -5.847 4.499 1.00 0.00 C ATOM 1265 OE1 GLU B 466 -8.318 -6.778 3.767 1.00 0.00 O ATOM 1266 OE2 GLU B 466 -9.693 -5.139 4.223 1.00 0.00 O ATOM 0 H GLU B 466 -5.971 -7.132 6.209 1.00 0.00 H new ATOM 0 HA GLU B 466 -5.976 -5.739 3.809 1.00 0.00 H new ATOM 0 HB2 GLU B 466 -6.259 -4.620 6.622 1.00 0.00 H new ATOM 0 HB3 GLU B 466 -6.866 -3.890 5.149 1.00 0.00 H new ATOM 0 HG2 GLU B 466 -7.780 -6.552 6.289 1.00 0.00 H new ATOM 0 HG3 GLU B 466 -8.629 -5.029 6.470 1.00 0.00 H new ATOM 1273 N ARG B 467 -3.620 -4.722 5.906 1.00 0.00 N ATOM 1274 CA ARG B 467 -2.394 -3.932 5.995 1.00 0.00 C ATOM 1275 C ARG B 467 -1.297 -4.492 5.092 1.00 0.00 C ATOM 1276 O ARG B 467 -0.490 -3.738 4.550 1.00 0.00 O ATOM 1277 CB ARG B 467 -1.885 -3.858 7.434 1.00 0.00 C ATOM 1278 CG ARG B 467 -2.826 -3.134 8.382 1.00 0.00 C ATOM 1279 CD ARG B 467 -2.160 -2.846 9.719 1.00 0.00 C ATOM 1280 NE ARG B 467 -1.499 -4.025 10.280 1.00 0.00 N ATOM 1281 CZ ARG B 467 -1.220 -4.176 11.573 1.00 0.00 C ATOM 1282 NH1 ARG B 467 -1.619 -3.268 12.456 1.00 0.00 N ATOM 1283 NH2 ARG B 467 -0.561 -5.250 11.983 1.00 0.00 N ATOM 0 H ARG B 467 -3.876 -5.204 6.768 1.00 0.00 H new ATOM 0 HA ARG B 467 -2.643 -2.926 5.656 1.00 0.00 H new ATOM 0 HB2 ARG B 467 -1.720 -4.870 7.803 1.00 0.00 H new ATOM 0 HB3 ARG B 467 -0.918 -3.354 7.442 1.00 0.00 H new ATOM 0 HG2 ARG B 467 -3.152 -2.198 7.928 1.00 0.00 H new ATOM 0 HG3 ARG B 467 -3.719 -3.739 8.542 1.00 0.00 H new ATOM 0 HD2 ARG B 467 -1.428 -2.048 9.592 1.00 0.00 H new ATOM 0 HD3 ARG B 467 -2.908 -2.483 10.424 1.00 0.00 H new ATOM 0 HE ARG B 467 -1.236 -4.776 9.642 1.00 0.00 H new ATOM 0 HH11 ARG B 467 -2.142 -2.450 12.145 1.00 0.00 H new ATOM 0 HH12 ARG B 467 -1.402 -3.389 13.445 1.00 0.00 H new ATOM 0 HH21 ARG B 467 -0.269 -5.958 11.309 1.00 0.00 H new ATOM 0 HH22 ARG B 467 -0.345 -5.369 12.973 1.00 0.00 H new ATOM 1297 N ASN B 468 -1.269 -5.809 4.921 1.00 0.00 N ATOM 1298 CA ASN B 468 -0.276 -6.425 4.056 1.00 0.00 C ATOM 1299 C ASN B 468 -0.655 -6.153 2.607 1.00 0.00 C ATOM 1300 O ASN B 468 0.200 -6.004 1.740 1.00 0.00 O ATOM 1301 CB ASN B 468 -0.171 -7.931 4.342 1.00 0.00 C ATOM 1302 CG ASN B 468 -0.517 -8.796 3.146 1.00 0.00 C ATOM 1303 OD1 ASN B 468 0.354 -9.188 2.369 1.00 0.00 O ATOM 1304 ND2 ASN B 468 -1.796 -9.082 2.981 1.00 0.00 N ATOM 0 H ASN B 468 -1.915 -6.462 5.365 1.00 0.00 H new ATOM 0 HA ASN B 468 0.707 -5.995 4.250 1.00 0.00 H new ATOM 0 HB2 ASN B 468 0.844 -8.162 4.667 1.00 0.00 H new ATOM 0 HB3 ASN B 468 -0.835 -8.184 5.168 1.00 0.00 H new ATOM 0 HD21 ASN B 468 -2.094 -9.648 2.186 1.00 0.00 H new ATOM 0 HD22 ASN B 468 -2.486 -8.737 3.648 1.00 0.00 H new ATOM 1311 N VAL B 469 -1.955 -6.060 2.373 1.00 0.00 N ATOM 1312 CA VAL B 469 -2.488 -5.696 1.075 1.00 0.00 C ATOM 1313 C VAL B 469 -2.114 -4.254 0.736 1.00 0.00 C ATOM 1314 O VAL B 469 -1.817 -3.931 -0.418 1.00 0.00 O ATOM 1315 CB VAL B 469 -4.022 -5.897 1.053 1.00 0.00 C ATOM 1316 CG1 VAL B 469 -4.725 -4.841 0.215 1.00 0.00 C ATOM 1317 CG2 VAL B 469 -4.355 -7.287 0.543 1.00 0.00 C ATOM 0 H VAL B 469 -2.669 -6.236 3.080 1.00 0.00 H new ATOM 0 HA VAL B 469 -2.051 -6.344 0.315 1.00 0.00 H new ATOM 0 HB VAL B 469 -4.385 -5.790 2.075 1.00 0.00 H new ATOM 0 HG11 VAL B 469 -5.800 -5.022 0.228 1.00 0.00 H new ATOM 0 HG12 VAL B 469 -4.518 -3.853 0.626 1.00 0.00 H new ATOM 0 HG13 VAL B 469 -4.362 -4.890 -0.812 1.00 0.00 H new ATOM 0 HG21 VAL B 469 -5.437 -7.421 0.531 1.00 0.00 H new ATOM 0 HG22 VAL B 469 -3.963 -7.408 -0.467 1.00 0.00 H new ATOM 0 HG23 VAL B 469 -3.905 -8.033 1.198 1.00 0.00 H new ATOM 1327 N ILE B 470 -2.103 -3.401 1.755 1.00 0.00 N ATOM 1328 CA ILE B 470 -1.692 -2.013 1.588 1.00 0.00 C ATOM 1329 C ILE B 470 -0.245 -1.946 1.110 1.00 0.00 C ATOM 1330 O ILE B 470 0.113 -1.086 0.306 1.00 0.00 O ATOM 1331 CB ILE B 470 -1.830 -1.207 2.899 1.00 0.00 C ATOM 1332 CG1 ILE B 470 -3.243 -1.337 3.473 1.00 0.00 C ATOM 1333 CG2 ILE B 470 -1.496 0.255 2.656 1.00 0.00 C ATOM 1334 CD1 ILE B 470 -4.333 -0.909 2.517 1.00 0.00 C ATOM 0 H ILE B 470 -2.375 -3.648 2.707 1.00 0.00 H new ATOM 0 HA ILE B 470 -2.353 -1.570 0.844 1.00 0.00 H new ATOM 0 HB ILE B 470 -1.126 -1.615 3.625 1.00 0.00 H new ATOM 0 HG12 ILE B 470 -3.413 -2.374 3.762 1.00 0.00 H new ATOM 0 HG13 ILE B 470 -3.313 -0.737 4.381 1.00 0.00 H new ATOM 0 HG21 ILE B 470 -1.597 0.811 3.588 1.00 0.00 H new ATOM 0 HG22 ILE B 470 -0.472 0.339 2.293 1.00 0.00 H new ATOM 0 HG23 ILE B 470 -2.179 0.666 1.912 1.00 0.00 H new ATOM 0 HD11 ILE B 470 -5.305 -1.030 2.996 1.00 0.00 H new ATOM 0 HD12 ILE B 470 -4.190 0.137 2.246 1.00 0.00 H new ATOM 0 HD13 ILE B 470 -4.292 -1.525 1.619 1.00 0.00 H new ATOM 1346 N LEU B 471 0.578 -2.871 1.599 1.00 0.00 N ATOM 1347 CA LEU B 471 1.970 -2.966 1.169 1.00 0.00 C ATOM 1348 C LEU B 471 2.041 -3.132 -0.343 1.00 0.00 C ATOM 1349 O LEU B 471 2.780 -2.422 -1.019 1.00 0.00 O ATOM 1350 CB LEU B 471 2.676 -4.141 1.854 1.00 0.00 C ATOM 1351 CG LEU B 471 2.742 -4.072 3.382 1.00 0.00 C ATOM 1352 CD1 LEU B 471 3.385 -5.331 3.944 1.00 0.00 C ATOM 1353 CD2 LEU B 471 3.512 -2.839 3.830 1.00 0.00 C ATOM 0 H LEU B 471 0.304 -3.566 2.294 1.00 0.00 H new ATOM 0 HA LEU B 471 2.477 -2.044 1.455 1.00 0.00 H new ATOM 0 HB2 LEU B 471 2.167 -5.062 1.571 1.00 0.00 H new ATOM 0 HB3 LEU B 471 3.693 -4.207 1.467 1.00 0.00 H new ATOM 0 HG LEU B 471 1.724 -4.001 3.766 1.00 0.00 H new ATOM 0 HD11 LEU B 471 3.424 -5.265 5.031 1.00 0.00 H new ATOM 0 HD12 LEU B 471 2.796 -6.201 3.654 1.00 0.00 H new ATOM 0 HD13 LEU B 471 4.396 -5.430 3.550 1.00 0.00 H new ATOM 0 HD21 LEU B 471 3.548 -2.808 4.919 1.00 0.00 H new ATOM 0 HD22 LEU B 471 4.527 -2.880 3.435 1.00 0.00 H new ATOM 0 HD23 LEU B 471 3.014 -1.944 3.458 1.00 0.00 H new ATOM 1365 N GLN B 472 1.247 -4.061 -0.868 1.00 0.00 N ATOM 1366 CA GLN B 472 1.181 -4.296 -2.309 1.00 0.00 C ATOM 1367 C GLN B 472 0.742 -3.038 -3.049 1.00 0.00 C ATOM 1368 O GLN B 472 1.275 -2.718 -4.109 1.00 0.00 O ATOM 1369 CB GLN B 472 0.221 -5.445 -2.633 1.00 0.00 C ATOM 1370 CG GLN B 472 0.851 -6.828 -2.554 1.00 0.00 C ATOM 1371 CD GLN B 472 1.332 -7.184 -1.165 1.00 0.00 C ATOM 1372 OE1 GLN B 472 2.482 -6.934 -0.807 1.00 0.00 O ATOM 1373 NE2 GLN B 472 0.452 -7.766 -0.370 1.00 0.00 N ATOM 0 H GLN B 472 0.638 -4.665 -0.316 1.00 0.00 H new ATOM 0 HA GLN B 472 2.183 -4.568 -2.642 1.00 0.00 H new ATOM 0 HB2 GLN B 472 -0.623 -5.403 -1.944 1.00 0.00 H new ATOM 0 HB3 GLN B 472 -0.179 -5.297 -3.636 1.00 0.00 H new ATOM 0 HG2 GLN B 472 0.124 -7.571 -2.881 1.00 0.00 H new ATOM 0 HG3 GLN B 472 1.691 -6.878 -3.247 1.00 0.00 H new ATOM 0 HE21 GLN B 472 -0.492 -7.956 -0.706 1.00 0.00 H new ATOM 0 HE22 GLN B 472 0.717 -8.026 0.580 1.00 0.00 H new ATOM 1382 N CYS B 473 -0.222 -2.326 -2.478 1.00 0.00 N ATOM 1383 CA CYS B 473 -0.718 -1.091 -3.069 1.00 0.00 C ATOM 1384 C CYS B 473 0.405 -0.062 -3.150 1.00 0.00 C ATOM 1385 O CYS B 473 0.723 0.445 -4.225 1.00 0.00 O ATOM 1386 CB CYS B 473 -1.881 -0.546 -2.239 1.00 0.00 C ATOM 1387 SG CYS B 473 -3.223 -1.735 -1.990 1.00 0.00 S ATOM 0 H CYS B 473 -0.677 -2.585 -1.603 1.00 0.00 H new ATOM 0 HA CYS B 473 -1.075 -1.297 -4.078 1.00 0.00 H new ATOM 0 HB2 CYS B 473 -1.504 -0.229 -1.267 1.00 0.00 H new ATOM 0 HB3 CYS B 473 -2.281 0.341 -2.730 1.00 0.00 H new ATOM 0 HG CYS B 473 -2.748 -2.820 -1.453 1.00 0.00 H new ATOM 1393 N VAL B 474 1.014 0.210 -2.001 1.00 0.00 N ATOM 1394 CA VAL B 474 2.145 1.126 -1.900 1.00 0.00 C ATOM 1395 C VAL B 474 3.246 0.773 -2.900 1.00 0.00 C ATOM 1396 O VAL B 474 3.705 1.630 -3.659 1.00 0.00 O ATOM 1397 CB VAL B 474 2.727 1.100 -0.466 1.00 0.00 C ATOM 1398 CG1 VAL B 474 4.075 1.807 -0.393 1.00 0.00 C ATOM 1399 CG2 VAL B 474 1.741 1.714 0.516 1.00 0.00 C ATOM 0 H VAL B 474 0.736 -0.200 -1.109 1.00 0.00 H new ATOM 0 HA VAL B 474 1.778 2.126 -2.132 1.00 0.00 H new ATOM 0 HB VAL B 474 2.892 0.058 -0.192 1.00 0.00 H new ATOM 0 HG11 VAL B 474 4.451 1.768 0.629 1.00 0.00 H new ATOM 0 HG12 VAL B 474 4.782 1.312 -1.059 1.00 0.00 H new ATOM 0 HG13 VAL B 474 3.957 2.847 -0.697 1.00 0.00 H new ATOM 0 HG21 VAL B 474 2.164 1.689 1.520 1.00 0.00 H new ATOM 0 HG22 VAL B 474 1.541 2.747 0.233 1.00 0.00 H new ATOM 0 HG23 VAL B 474 0.810 1.147 0.500 1.00 0.00 H new ATOM 1409 N ARG B 475 3.641 -0.496 -2.912 1.00 0.00 N ATOM 1410 CA ARG B 475 4.746 -0.953 -3.747 1.00 0.00 C ATOM 1411 C ARG B 475 4.419 -0.804 -5.227 1.00 0.00 C ATOM 1412 O ARG B 475 5.274 -0.427 -6.024 1.00 0.00 O ATOM 1413 CB ARG B 475 5.085 -2.410 -3.432 1.00 0.00 C ATOM 1414 CG ARG B 475 5.599 -2.624 -2.018 1.00 0.00 C ATOM 1415 CD ARG B 475 5.935 -4.083 -1.765 1.00 0.00 C ATOM 1416 NE ARG B 475 6.959 -4.569 -2.685 1.00 0.00 N ATOM 1417 CZ ARG B 475 7.251 -5.853 -2.871 1.00 0.00 C ATOM 1418 NH1 ARG B 475 6.599 -6.791 -2.195 1.00 0.00 N ATOM 1419 NH2 ARG B 475 8.195 -6.197 -3.737 1.00 0.00 N ATOM 0 H ARG B 475 3.210 -1.230 -2.350 1.00 0.00 H new ATOM 0 HA ARG B 475 5.611 -0.328 -3.524 1.00 0.00 H new ATOM 0 HB2 ARG B 475 4.196 -3.022 -3.583 1.00 0.00 H new ATOM 0 HB3 ARG B 475 5.836 -2.760 -4.140 1.00 0.00 H new ATOM 0 HG2 ARG B 475 6.486 -2.011 -1.855 1.00 0.00 H new ATOM 0 HG3 ARG B 475 4.847 -2.293 -1.302 1.00 0.00 H new ATOM 0 HD2 ARG B 475 6.281 -4.204 -0.739 1.00 0.00 H new ATOM 0 HD3 ARG B 475 5.034 -4.687 -1.871 1.00 0.00 H new ATOM 0 HE ARG B 475 7.485 -3.878 -3.220 1.00 0.00 H new ATOM 0 HH11 ARG B 475 5.871 -6.528 -1.530 1.00 0.00 H new ATOM 0 HH12 ARG B 475 6.826 -7.775 -2.340 1.00 0.00 H new ATOM 0 HH21 ARG B 475 8.695 -5.477 -4.259 1.00 0.00 H new ATOM 0 HH22 ARG B 475 8.421 -7.181 -3.881 1.00 0.00 H new ATOM 1433 N TYR B 476 3.175 -1.090 -5.588 1.00 0.00 N ATOM 1434 CA TYR B 476 2.740 -0.978 -6.965 1.00 0.00 C ATOM 1435 C TYR B 476 2.725 0.485 -7.404 1.00 0.00 C ATOM 1436 O TYR B 476 3.222 0.828 -8.479 1.00 0.00 O ATOM 1437 CB TYR B 476 1.351 -1.614 -7.118 1.00 0.00 C ATOM 1438 CG TYR B 476 0.495 -0.971 -8.185 1.00 0.00 C ATOM 1439 CD1 TYR B 476 -0.381 0.048 -7.853 1.00 0.00 C ATOM 1440 CD2 TYR B 476 0.578 -1.364 -9.515 1.00 0.00 C ATOM 1441 CE1 TYR B 476 -1.152 0.670 -8.813 1.00 0.00 C ATOM 1442 CE2 TYR B 476 -0.196 -0.754 -10.485 1.00 0.00 C ATOM 1443 CZ TYR B 476 -1.060 0.267 -10.128 1.00 0.00 C ATOM 1444 OH TYR B 476 -1.824 0.896 -11.086 1.00 0.00 O ATOM 0 H TYR B 476 2.451 -1.402 -4.941 1.00 0.00 H new ATOM 0 HA TYR B 476 3.441 -1.510 -7.608 1.00 0.00 H new ATOM 0 HB2 TYR B 476 1.471 -2.672 -7.351 1.00 0.00 H new ATOM 0 HB3 TYR B 476 0.829 -1.555 -6.163 1.00 0.00 H new ATOM 0 HD1 TYR B 476 -0.462 0.362 -6.823 1.00 0.00 H new ATOM 0 HD2 TYR B 476 1.256 -2.157 -9.795 1.00 0.00 H new ATOM 0 HE1 TYR B 476 -1.824 1.469 -8.536 1.00 0.00 H new ATOM 0 HE2 TYR B 476 -0.127 -1.072 -11.515 1.00 0.00 H new ATOM 0 HH TYR B 476 -1.644 0.497 -11.963 1.00 0.00 H new ATOM 1454 N ILE B 477 2.171 1.345 -6.556 1.00 0.00 N ATOM 1455 CA ILE B 477 2.006 2.751 -6.890 1.00 0.00 C ATOM 1456 C ILE B 477 3.348 3.438 -7.079 1.00 0.00 C ATOM 1457 O ILE B 477 3.642 3.931 -8.161 1.00 0.00 O ATOM 1458 CB ILE B 477 1.194 3.497 -5.818 1.00 0.00 C ATOM 1459 CG1 ILE B 477 -0.222 2.929 -5.754 1.00 0.00 C ATOM 1460 CG2 ILE B 477 1.160 4.991 -6.114 1.00 0.00 C ATOM 1461 CD1 ILE B 477 -1.039 3.481 -4.615 1.00 0.00 C ATOM 0 H ILE B 477 1.828 1.090 -5.630 1.00 0.00 H new ATOM 0 HA ILE B 477 1.456 2.785 -7.831 1.00 0.00 H new ATOM 0 HB ILE B 477 1.675 3.356 -4.850 1.00 0.00 H new ATOM 0 HG12 ILE B 477 -0.733 3.141 -6.693 1.00 0.00 H new ATOM 0 HG13 ILE B 477 -0.166 1.845 -5.659 1.00 0.00 H new ATOM 0 HG21 ILE B 477 0.581 5.501 -5.344 1.00 0.00 H new ATOM 0 HG22 ILE B 477 2.177 5.383 -6.123 1.00 0.00 H new ATOM 0 HG23 ILE B 477 0.698 5.159 -7.087 1.00 0.00 H new ATOM 0 HD11 ILE B 477 -2.033 3.034 -4.630 1.00 0.00 H new ATOM 0 HD12 ILE B 477 -0.550 3.246 -3.669 1.00 0.00 H new ATOM 0 HD13 ILE B 477 -1.126 4.562 -4.720 1.00 0.00 H new ATOM 1473 N ILE B 478 4.168 3.447 -6.034 1.00 0.00 N ATOM 1474 CA ILE B 478 5.471 4.112 -6.079 1.00 0.00 C ATOM 1475 C ILE B 478 6.301 3.626 -7.262 1.00 0.00 C ATOM 1476 O ILE B 478 7.122 4.370 -7.805 1.00 0.00 O ATOM 1477 CB ILE B 478 6.276 3.869 -4.785 1.00 0.00 C ATOM 1478 CG1 ILE B 478 5.451 4.267 -3.562 1.00 0.00 C ATOM 1479 CG2 ILE B 478 7.585 4.648 -4.809 1.00 0.00 C ATOM 1480 CD1 ILE B 478 6.146 3.979 -2.252 1.00 0.00 C ATOM 0 H ILE B 478 3.955 3.001 -5.142 1.00 0.00 H new ATOM 0 HA ILE B 478 5.270 5.178 -6.186 1.00 0.00 H new ATOM 0 HB ILE B 478 6.508 2.806 -4.723 1.00 0.00 H new ATOM 0 HG12 ILE B 478 5.222 5.331 -3.618 1.00 0.00 H new ATOM 0 HG13 ILE B 478 4.500 3.735 -3.585 1.00 0.00 H new ATOM 0 HG21 ILE B 478 8.136 4.462 -3.887 1.00 0.00 H new ATOM 0 HG22 ILE B 478 8.184 4.327 -5.661 1.00 0.00 H new ATOM 0 HG23 ILE B 478 7.373 5.714 -4.896 1.00 0.00 H new ATOM 0 HD11 ILE B 478 5.505 4.286 -1.425 1.00 0.00 H new ATOM 0 HD12 ILE B 478 6.351 2.911 -2.176 1.00 0.00 H new ATOM 0 HD13 ILE B 478 7.084 4.532 -2.209 1.00 0.00 H new ATOM 1492 N LYS B 479 6.055 2.393 -7.676 1.00 0.00 N ATOM 1493 CA LYS B 479 6.874 1.757 -8.692 1.00 0.00 C ATOM 1494 C LYS B 479 6.554 2.273 -10.093 1.00 0.00 C ATOM 1495 O LYS B 479 7.437 2.348 -10.946 1.00 0.00 O ATOM 1496 CB LYS B 479 6.709 0.241 -8.629 1.00 0.00 C ATOM 1497 CG LYS B 479 7.735 -0.525 -9.448 1.00 0.00 C ATOM 1498 CD LYS B 479 7.752 -2.000 -9.074 1.00 0.00 C ATOM 1499 CE LYS B 479 6.416 -2.672 -9.343 1.00 0.00 C ATOM 1500 NZ LYS B 479 6.125 -2.773 -10.797 1.00 0.00 N ATOM 0 H LYS B 479 5.294 1.813 -7.323 1.00 0.00 H new ATOM 0 HA LYS B 479 7.913 2.013 -8.484 1.00 0.00 H new ATOM 0 HB2 LYS B 479 6.776 -0.079 -7.589 1.00 0.00 H new ATOM 0 HB3 LYS B 479 5.710 -0.021 -8.979 1.00 0.00 H new ATOM 0 HG2 LYS B 479 7.509 -0.419 -10.509 1.00 0.00 H new ATOM 0 HG3 LYS B 479 8.724 -0.096 -9.289 1.00 0.00 H new ATOM 0 HD2 LYS B 479 8.533 -2.508 -9.639 1.00 0.00 H new ATOM 0 HD3 LYS B 479 8.004 -2.103 -8.018 1.00 0.00 H new ATOM 0 HE2 LYS B 479 6.417 -3.670 -8.904 1.00 0.00 H new ATOM 0 HE3 LYS B 479 5.622 -2.109 -8.853 1.00 0.00 H new ATOM 0 HZ1 LYS B 479 5.256 -3.326 -10.940 1.00 0.00 H new ATOM 0 HZ2 LYS B 479 5.997 -1.820 -11.193 1.00 0.00 H new ATOM 0 HZ3 LYS B 479 6.918 -3.244 -11.278 1.00 0.00 H new ATOM 1514 N LYS B 480 5.306 2.630 -10.343 1.00 0.00 N ATOM 1515 CA LYS B 480 4.939 3.123 -11.666 1.00 0.00 C ATOM 1516 C LYS B 480 4.512 4.588 -11.635 1.00 0.00 C ATOM 1517 O LYS B 480 4.465 5.249 -12.673 1.00 0.00 O ATOM 1518 CB LYS B 480 3.849 2.232 -12.288 1.00 0.00 C ATOM 1519 CG LYS B 480 2.649 1.971 -11.383 1.00 0.00 C ATOM 1520 CD LYS B 480 1.647 3.112 -11.410 1.00 0.00 C ATOM 1521 CE LYS B 480 0.835 3.118 -12.698 1.00 0.00 C ATOM 1522 NZ LYS B 480 -0.253 4.131 -12.671 1.00 0.00 N ATOM 0 H LYS B 480 4.543 2.591 -9.667 1.00 0.00 H new ATOM 0 HA LYS B 480 5.827 3.071 -12.297 1.00 0.00 H new ATOM 0 HB2 LYS B 480 3.498 2.699 -13.209 1.00 0.00 H new ATOM 0 HB3 LYS B 480 4.294 1.276 -12.564 1.00 0.00 H new ATOM 0 HG2 LYS B 480 2.156 1.050 -11.694 1.00 0.00 H new ATOM 0 HG3 LYS B 480 2.994 1.818 -10.361 1.00 0.00 H new ATOM 0 HD2 LYS B 480 0.975 3.026 -10.556 1.00 0.00 H new ATOM 0 HD3 LYS B 480 2.173 4.061 -11.307 1.00 0.00 H new ATOM 0 HE2 LYS B 480 1.496 3.319 -13.541 1.00 0.00 H new ATOM 0 HE3 LYS B 480 0.405 2.129 -12.859 1.00 0.00 H new ATOM 0 HZ1 LYS B 480 -0.779 4.099 -13.568 1.00 0.00 H new ATOM 0 HZ2 LYS B 480 -0.899 3.925 -11.883 1.00 0.00 H new ATOM 0 HZ3 LYS B 480 0.158 5.078 -12.544 1.00 0.00 H new ATOM 1536 N ASP B 481 4.220 5.099 -10.449 1.00 0.00 N ATOM 1537 CA ASP B 481 3.757 6.476 -10.318 1.00 0.00 C ATOM 1538 C ASP B 481 4.912 7.440 -10.093 1.00 0.00 C ATOM 1539 O ASP B 481 5.148 8.346 -10.893 1.00 0.00 O ATOM 1540 CB ASP B 481 2.742 6.614 -9.179 1.00 0.00 C ATOM 1541 CG ASP B 481 2.015 7.946 -9.209 1.00 0.00 C ATOM 1542 OD1 ASP B 481 0.866 7.985 -9.699 1.00 0.00 O ATOM 1543 OD2 ASP B 481 2.583 8.959 -8.754 1.00 0.00 O ATOM 0 H ASP B 481 4.294 4.588 -9.569 1.00 0.00 H new ATOM 0 HA ASP B 481 3.271 6.734 -11.259 1.00 0.00 H new ATOM 0 HB2 ASP B 481 2.015 5.805 -9.244 1.00 0.00 H new ATOM 0 HB3 ASP B 481 3.255 6.505 -8.224 1.00 0.00 H new ATOM 1548 N PHE B 482 5.642 7.228 -9.007 1.00 0.00 N ATOM 1549 CA PHE B 482 6.610 8.213 -8.546 1.00 0.00 C ATOM 1550 C PHE B 482 8.037 7.874 -8.965 1.00 0.00 C ATOM 1551 O PHE B 482 8.482 8.244 -10.052 1.00 0.00 O ATOM 1552 CB PHE B 482 6.545 8.356 -7.023 1.00 0.00 C ATOM 1553 CG PHE B 482 5.217 8.828 -6.503 1.00 0.00 C ATOM 1554 CD1 PHE B 482 4.854 10.160 -6.600 1.00 0.00 C ATOM 1555 CD2 PHE B 482 4.338 7.942 -5.903 1.00 0.00 C ATOM 1556 CE1 PHE B 482 3.640 10.599 -6.111 1.00 0.00 C ATOM 1557 CE2 PHE B 482 3.122 8.375 -5.414 1.00 0.00 C ATOM 1558 CZ PHE B 482 2.773 9.706 -5.517 1.00 0.00 C ATOM 0 H PHE B 482 5.583 6.388 -8.432 1.00 0.00 H new ATOM 0 HA PHE B 482 6.342 9.158 -9.019 1.00 0.00 H new ATOM 0 HB2 PHE B 482 6.778 7.393 -6.569 1.00 0.00 H new ATOM 0 HB3 PHE B 482 7.317 9.055 -6.702 1.00 0.00 H new ATOM 0 HD1 PHE B 482 5.529 10.864 -7.064 1.00 0.00 H new ATOM 0 HD2 PHE B 482 4.607 6.900 -5.817 1.00 0.00 H new ATOM 0 HE1 PHE B 482 3.369 11.641 -6.194 1.00 0.00 H new ATOM 0 HE2 PHE B 482 2.444 7.673 -4.951 1.00 0.00 H new ATOM 0 HZ PHE B 482 1.823 10.048 -5.133 1.00 0.00 H new ATOM 1568 N PHE B 483 8.745 7.154 -8.103 1.00 0.00 N ATOM 1569 CA PHE B 483 10.177 6.946 -8.279 1.00 0.00 C ATOM 1570 C PHE B 483 10.458 5.689 -9.087 1.00 0.00 C ATOM 1571 O PHE B 483 11.399 5.643 -9.880 1.00 0.00 O ATOM 1572 CB PHE B 483 10.872 6.847 -6.917 1.00 0.00 C ATOM 1573 CG PHE B 483 10.606 8.017 -6.009 1.00 0.00 C ATOM 1574 CD1 PHE B 483 9.542 7.992 -5.122 1.00 0.00 C ATOM 1575 CD2 PHE B 483 11.418 9.138 -6.041 1.00 0.00 C ATOM 1576 CE1 PHE B 483 9.292 9.062 -4.286 1.00 0.00 C ATOM 1577 CE2 PHE B 483 11.173 10.213 -5.208 1.00 0.00 C ATOM 1578 CZ PHE B 483 10.108 10.175 -4.329 1.00 0.00 C ATOM 0 H PHE B 483 8.351 6.705 -7.276 1.00 0.00 H new ATOM 0 HA PHE B 483 10.571 7.803 -8.826 1.00 0.00 H new ATOM 0 HB2 PHE B 483 10.547 5.933 -6.420 1.00 0.00 H new ATOM 0 HB3 PHE B 483 11.947 6.759 -7.074 1.00 0.00 H new ATOM 0 HD1 PHE B 483 8.900 7.124 -5.084 1.00 0.00 H new ATOM 0 HD2 PHE B 483 12.253 9.173 -6.725 1.00 0.00 H new ATOM 0 HE1 PHE B 483 8.459 9.028 -3.599 1.00 0.00 H new ATOM 0 HE2 PHE B 483 11.813 11.082 -5.244 1.00 0.00 H new ATOM 0 HZ PHE B 483 9.914 11.014 -3.677 1.00 0.00 H new ATOM 1588 N GLY B 484 9.635 4.674 -8.885 1.00 0.00 N ATOM 1589 CA GLY B 484 9.832 3.415 -9.568 1.00 0.00 C ATOM 1590 C GLY B 484 10.641 2.444 -8.747 1.00 0.00 C ATOM 1591 O GLY B 484 11.015 1.370 -9.221 1.00 0.00 O ATOM 0 H GLY B 484 8.831 4.700 -8.258 1.00 0.00 H new ATOM 0 HA2 GLY B 484 8.863 2.973 -9.800 1.00 0.00 H new ATOM 0 HA3 GLY B 484 10.336 3.594 -10.518 1.00 0.00 H new ATOM 1595 N LEU B 485 10.913 2.822 -7.511 1.00 0.00 N ATOM 1596 CA LEU B 485 11.714 2.004 -6.625 1.00 0.00 C ATOM 1597 C LEU B 485 10.851 0.983 -5.908 1.00 0.00 C ATOM 1598 O LEU B 485 9.627 1.115 -5.858 1.00 0.00 O ATOM 1599 CB LEU B 485 12.430 2.880 -5.605 1.00 0.00 C ATOM 1600 CG LEU B 485 13.201 4.057 -6.197 1.00 0.00 C ATOM 1601 CD1 LEU B 485 13.780 4.917 -5.091 1.00 0.00 C ATOM 1602 CD2 LEU B 485 14.301 3.563 -7.125 1.00 0.00 C ATOM 0 H LEU B 485 10.588 3.696 -7.098 1.00 0.00 H new ATOM 0 HA LEU B 485 12.453 1.475 -7.226 1.00 0.00 H new ATOM 0 HB2 LEU B 485 11.695 3.265 -4.898 1.00 0.00 H new ATOM 0 HB3 LEU B 485 13.123 2.259 -5.037 1.00 0.00 H new ATOM 0 HG LEU B 485 12.511 4.665 -6.781 1.00 0.00 H new ATOM 0 HD11 LEU B 485 14.327 5.752 -5.528 1.00 0.00 H new ATOM 0 HD12 LEU B 485 12.972 5.299 -4.467 1.00 0.00 H new ATOM 0 HD13 LEU B 485 14.458 4.319 -4.482 1.00 0.00 H new ATOM 0 HD21 LEU B 485 14.840 4.416 -7.537 1.00 0.00 H new ATOM 0 HD22 LEU B 485 14.993 2.933 -6.566 1.00 0.00 H new ATOM 0 HD23 LEU B 485 13.860 2.986 -7.937 1.00 0.00 H new ATOM 1614 N ASP B 486 11.507 -0.025 -5.359 1.00 0.00 N ATOM 1615 CA ASP B 486 10.837 -1.087 -4.616 1.00 0.00 C ATOM 1616 C ASP B 486 11.868 -2.025 -4.022 1.00 0.00 C ATOM 1617 O ASP B 486 11.794 -2.420 -2.858 1.00 0.00 O ATOM 1618 CB ASP B 486 9.894 -1.881 -5.521 1.00 0.00 C ATOM 1619 CG ASP B 486 9.228 -3.027 -4.791 1.00 0.00 C ATOM 1620 OD1 ASP B 486 8.215 -2.792 -4.112 1.00 0.00 O ATOM 1621 OD2 ASP B 486 9.708 -4.176 -4.904 1.00 0.00 O ATOM 0 H ASP B 486 12.520 -0.133 -5.414 1.00 0.00 H new ATOM 0 HA ASP B 486 10.250 -0.627 -3.821 1.00 0.00 H new ATOM 0 HB2 ASP B 486 9.130 -1.214 -5.920 1.00 0.00 H new ATOM 0 HB3 ASP B 486 10.453 -2.271 -6.372 1.00 0.00 H new ATOM 1626 N THR B 487 12.844 -2.351 -4.837 1.00 0.00 N ATOM 1627 CA THR B 487 13.910 -3.252 -4.450 1.00 0.00 C ATOM 1628 C THR B 487 15.187 -2.461 -4.171 1.00 0.00 C ATOM 1629 O THR B 487 16.300 -2.965 -4.319 1.00 0.00 O ATOM 1630 CB THR B 487 14.154 -4.291 -5.559 1.00 0.00 C ATOM 1631 OG1 THR B 487 15.130 -5.259 -5.150 1.00 0.00 O ATOM 1632 CG2 THR B 487 14.608 -3.598 -6.828 1.00 0.00 C ATOM 0 H THR B 487 12.923 -1.999 -5.791 1.00 0.00 H new ATOM 0 HA THR B 487 13.618 -3.777 -3.540 1.00 0.00 H new ATOM 0 HB THR B 487 13.217 -4.813 -5.751 1.00 0.00 H new ATOM 0 HG1 THR B 487 15.875 -4.804 -4.704 1.00 0.00 H new ATOM 0 HG21 THR B 487 14.778 -4.341 -7.607 1.00 0.00 H new ATOM 0 HG22 THR B 487 13.839 -2.898 -7.155 1.00 0.00 H new ATOM 0 HG23 THR B 487 15.534 -3.056 -6.635 1.00 0.00 H new ATOM 1640 N ASN B 488 15.016 -1.218 -3.753 1.00 0.00 N ATOM 1641 CA ASN B 488 16.138 -0.307 -3.618 1.00 0.00 C ATOM 1642 C ASN B 488 16.332 0.106 -2.170 1.00 0.00 C ATOM 1643 O ASN B 488 15.532 0.854 -1.611 1.00 0.00 O ATOM 1644 CB ASN B 488 15.916 0.923 -4.497 1.00 0.00 C ATOM 1645 CG ASN B 488 15.651 0.540 -5.933 1.00 0.00 C ATOM 1646 OD1 ASN B 488 14.502 0.324 -6.332 1.00 0.00 O ATOM 1647 ND2 ASN B 488 16.706 0.444 -6.713 1.00 0.00 N ATOM 0 H ASN B 488 14.112 -0.818 -3.502 1.00 0.00 H new ATOM 0 HA ASN B 488 17.042 -0.821 -3.945 1.00 0.00 H new ATOM 0 HB2 ASN B 488 15.074 1.499 -4.112 1.00 0.00 H new ATOM 0 HB3 ASN B 488 16.793 1.569 -4.448 1.00 0.00 H new ATOM 0 HD21 ASN B 488 16.594 0.182 -7.692 1.00 0.00 H new ATOM 0 HD22 ASN B 488 17.636 0.632 -6.339 1.00 0.00 H new ATOM 1654 N SER B 489 17.386 -0.408 -1.556 1.00 0.00 N ATOM 1655 CA SER B 489 17.709 -0.077 -0.179 1.00 0.00 C ATOM 1656 C SER B 489 19.206 -0.228 0.063 1.00 0.00 C ATOM 1657 O SER B 489 19.712 -1.340 0.227 1.00 0.00 O ATOM 1658 CB SER B 489 16.925 -0.970 0.784 1.00 0.00 C ATOM 1659 OG SER B 489 15.525 -0.844 0.579 1.00 0.00 O ATOM 0 H SER B 489 18.036 -1.061 -1.994 1.00 0.00 H new ATOM 0 HA SER B 489 17.427 0.960 0.003 1.00 0.00 H new ATOM 0 HB2 SER B 489 17.223 -2.009 0.645 1.00 0.00 H new ATOM 0 HB3 SER B 489 17.170 -0.703 1.812 1.00 0.00 H new ATOM 0 HG SER B 489 15.049 -1.427 1.207 1.00 0.00 H new ATOM 1665 N ALA B 490 19.905 0.894 0.063 1.00 0.00 N ATOM 1666 CA ALA B 490 21.345 0.912 0.273 1.00 0.00 C ATOM 1667 C ALA B 490 21.733 2.111 1.127 1.00 0.00 C ATOM 1668 O ALA B 490 22.603 2.904 0.766 1.00 0.00 O ATOM 1669 CB ALA B 490 22.075 0.946 -1.056 1.00 0.00 C ATOM 0 H ALA B 490 19.493 1.816 -0.082 1.00 0.00 H new ATOM 0 HA ALA B 490 21.634 0.001 0.798 1.00 0.00 H new ATOM 0 HB1 ALA B 490 23.151 0.959 -0.880 1.00 0.00 H new ATOM 0 HB2 ALA B 490 21.813 0.062 -1.638 1.00 0.00 H new ATOM 0 HB3 ALA B 490 21.787 1.841 -1.607 1.00 0.00 H new ATOM 1675 N LYS B 491 21.065 2.234 2.258 1.00 0.00 N ATOM 1676 CA LYS B 491 21.268 3.361 3.160 1.00 0.00 C ATOM 1677 C LYS B 491 21.732 2.892 4.534 1.00 0.00 C ATOM 1678 O LYS B 491 21.630 3.624 5.516 1.00 0.00 O ATOM 1679 CB LYS B 491 19.969 4.157 3.290 1.00 0.00 C ATOM 1680 CG LYS B 491 18.758 3.274 3.533 1.00 0.00 C ATOM 1681 CD LYS B 491 17.483 4.080 3.676 1.00 0.00 C ATOM 1682 CE LYS B 491 16.258 3.212 3.439 1.00 0.00 C ATOM 1683 NZ LYS B 491 16.285 1.961 4.247 1.00 0.00 N ATOM 0 H LYS B 491 20.369 1.562 2.580 1.00 0.00 H new ATOM 0 HA LYS B 491 22.047 3.999 2.742 1.00 0.00 H new ATOM 0 HB2 LYS B 491 20.065 4.868 4.111 1.00 0.00 H new ATOM 0 HB3 LYS B 491 19.812 4.738 2.381 1.00 0.00 H new ATOM 0 HG2 LYS B 491 18.651 2.571 2.707 1.00 0.00 H new ATOM 0 HG3 LYS B 491 18.916 2.683 4.435 1.00 0.00 H new ATOM 0 HD2 LYS B 491 17.435 4.517 4.673 1.00 0.00 H new ATOM 0 HD3 LYS B 491 17.490 4.907 2.966 1.00 0.00 H new ATOM 0 HE2 LYS B 491 15.360 3.780 3.683 1.00 0.00 H new ATOM 0 HE3 LYS B 491 16.196 2.957 2.381 1.00 0.00 H new ATOM 0 HZ1 LYS B 491 15.351 1.504 4.211 1.00 0.00 H new ATOM 0 HZ2 LYS B 491 17.002 1.314 3.861 1.00 0.00 H new ATOM 0 HZ3 LYS B 491 16.521 2.190 5.234 1.00 0.00 H new ATOM 1697 N SER B 492 22.239 1.674 4.599 1.00 0.00 N ATOM 1698 CA SER B 492 22.709 1.124 5.857 1.00 0.00 C ATOM 1699 C SER B 492 24.155 0.671 5.722 1.00 0.00 C ATOM 1700 O SER B 492 24.530 0.051 4.729 1.00 0.00 O ATOM 1701 CB SER B 492 21.824 -0.048 6.290 1.00 0.00 C ATOM 1702 OG SER B 492 22.177 -0.510 7.586 1.00 0.00 O ATOM 0 H SER B 492 22.336 1.049 3.799 1.00 0.00 H new ATOM 0 HA SER B 492 22.654 1.900 6.620 1.00 0.00 H new ATOM 0 HB2 SER B 492 20.779 0.261 6.284 1.00 0.00 H new ATOM 0 HB3 SER B 492 21.919 -0.863 5.573 1.00 0.00 H new ATOM 0 HG SER B 492 21.594 -1.257 7.837 1.00 0.00 H new ATOM 1708 N LYS B 493 24.965 0.982 6.722 1.00 0.00 N ATOM 1709 CA LYS B 493 26.368 0.601 6.710 1.00 0.00 C ATOM 1710 C LYS B 493 26.582 -0.668 7.517 1.00 0.00 C ATOM 1711 O LYS B 493 27.712 -1.060 7.799 1.00 0.00 O ATOM 1712 CB LYS B 493 27.238 1.732 7.260 1.00 0.00 C ATOM 1713 CG LYS B 493 27.114 3.023 6.470 1.00 0.00 C ATOM 1714 CD LYS B 493 28.069 4.091 6.975 1.00 0.00 C ATOM 1715 CE LYS B 493 27.712 4.553 8.377 1.00 0.00 C ATOM 1716 NZ LYS B 493 28.600 5.651 8.838 1.00 0.00 N ATOM 0 H LYS B 493 24.674 1.498 7.553 1.00 0.00 H new ATOM 0 HA LYS B 493 26.661 0.410 5.678 1.00 0.00 H new ATOM 0 HB2 LYS B 493 26.963 1.921 8.298 1.00 0.00 H new ATOM 0 HB3 LYS B 493 28.280 1.413 7.260 1.00 0.00 H new ATOM 0 HG2 LYS B 493 27.315 2.825 5.417 1.00 0.00 H new ATOM 0 HG3 LYS B 493 26.090 3.391 6.535 1.00 0.00 H new ATOM 0 HD2 LYS B 493 29.086 3.700 6.970 1.00 0.00 H new ATOM 0 HD3 LYS B 493 28.052 4.944 6.296 1.00 0.00 H new ATOM 0 HE2 LYS B 493 26.676 4.891 8.396 1.00 0.00 H new ATOM 0 HE3 LYS B 493 27.785 3.712 9.067 1.00 0.00 H new ATOM 0 HZ1 LYS B 493 28.325 5.939 9.799 1.00 0.00 H new ATOM 0 HZ2 LYS B 493 29.586 5.321 8.844 1.00 0.00 H new ATOM 0 HZ3 LYS B 493 28.511 6.463 8.194 1.00 0.00 H new ATOM 1730 N ASP B 494 25.482 -1.304 7.878 1.00 0.00 N ATOM 1731 CA ASP B 494 25.525 -2.554 8.628 1.00 0.00 C ATOM 1732 C ASP B 494 25.328 -3.732 7.688 1.00 0.00 C ATOM 1733 O ASP B 494 25.633 -4.878 8.025 1.00 0.00 O ATOM 1734 CB ASP B 494 24.449 -2.570 9.719 1.00 0.00 C ATOM 1735 CG ASP B 494 24.667 -1.502 10.773 1.00 0.00 C ATOM 1736 OD1 ASP B 494 24.004 -0.446 10.705 1.00 0.00 O ATOM 1737 OD2 ASP B 494 25.508 -1.712 11.675 1.00 0.00 O ATOM 0 H ASP B 494 24.540 -0.976 7.664 1.00 0.00 H new ATOM 0 HA ASP B 494 26.502 -2.635 9.105 1.00 0.00 H new ATOM 0 HB2 ASP B 494 23.471 -2.427 9.260 1.00 0.00 H new ATOM 0 HB3 ASP B 494 24.437 -3.549 10.197 1.00 0.00 H new ATOM 1742 N VAL B 495 24.821 -3.438 6.501 1.00 0.00 N ATOM 1743 CA VAL B 495 24.569 -4.460 5.499 1.00 0.00 C ATOM 1744 C VAL B 495 25.541 -4.300 4.338 1.00 0.00 C ATOM 1745 O VAL B 495 26.490 -5.105 4.244 1.00 0.00 O ATOM 1746 CB VAL B 495 23.118 -4.396 4.972 1.00 0.00 C ATOM 1747 CG1 VAL B 495 22.841 -5.537 4.003 1.00 0.00 C ATOM 1748 CG2 VAL B 495 22.127 -4.418 6.126 1.00 0.00 C ATOM 1749 OXT VAL B 495 25.371 -3.353 3.542 1.00 0.00 O ATOM 0 H VAL B 495 24.575 -2.493 6.207 1.00 0.00 H new ATOM 0 HA VAL B 495 24.715 -5.431 5.972 1.00 0.00 H new ATOM 0 HB VAL B 495 22.995 -3.457 4.432 1.00 0.00 H new ATOM 0 HG11 VAL B 495 21.813 -5.470 3.646 1.00 0.00 H new ATOM 0 HG12 VAL B 495 23.524 -5.469 3.156 1.00 0.00 H new ATOM 0 HG13 VAL B 495 22.987 -6.490 4.512 1.00 0.00 H new ATOM 0 HG21 VAL B 495 21.111 -4.372 5.734 1.00 0.00 H new ATOM 0 HG22 VAL B 495 22.254 -5.337 6.697 1.00 0.00 H new ATOM 0 HG23 VAL B 495 22.305 -3.560 6.775 1.00 0.00 H new TER 1759 VAL B 495