USER MOD reduce.3.24.130724 H: found=0, std=0, add=1036, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 1031 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 69 SER OG : rot 180:sc= 0 USER MOD Set 1.2: A 73 GLN : amide:sc= -0.337 X(o=-0.34,f=-0.35) USER MOD Single : A 3 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 HIS : no HD1:sc= -2.33 X(o=-2.3,f=-2!) USER MOD Single : A 6 HIS : no HD1:sc= -1.38! C(o=-1.4!,f=-2.8!) USER MOD Single : A 11 ASN : amide:sc= -6.16! C(o=-6.2!,f=-12!) USER MOD Single : A 12 HIS : no HD1:sc= -1.52 K(o=-1.5,f=-0.94) USER MOD Single : A 16 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 17 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 18 LYS NZ :NH3+ 157:sc= -1.09 (180deg=-2.02!) USER MOD Single : A 21 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 28 SER OG : rot 180:sc= 0 USER MOD Single : A 29 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 34 SER OG : rot 150:sc= -0.394 USER MOD Single : A 36 GLN : amide:sc= -0.166 X(o=-0.17,f=-0.17) USER MOD Single : A 38 MET CE :methyl 175:sc= -0.21 (180deg=-0.24) USER MOD Single : A 39 GLN : amide:sc= -5.51! K(o=-5.5!,f=-2.1) USER MOD Single : A 40 THR OG1 : rot -97:sc= 1.02 USER MOD Single : A 46 GLN : amide:sc= -0.0464 K(o=-0.046,f=-1.6!) USER MOD Single : A 47 GLN : amide:sc= -2.82! C(o=-2.8!,f=-5.1!) USER MOD Single : A 51 THR OG1 : rot -100:sc= -0.301 USER MOD Single : A 53 LYS NZ :NH3+ 163:sc= -0.0404 (180deg=-0.431) USER MOD Single : A 56 GLN : amide:sc= -0.171 X(o=-0.17,f=-0.17) USER MOD Single : A 60 GLN : amide:sc= -1.14 K(o=-1.1,f=0) USER MOD Single : A 61 TYR OH : rot 180:sc= 0 USER MOD Single : A 63 CYS SG : rot -150:sc= -1.39 USER MOD Single : A 64 SER OG : rot -5:sc= 0.576 USER MOD Single : A 65 SER OG : rot 180:sc= 0 USER MOD Single : A 71 HIS : no HD1:sc= -9.85! C(o=-9.9!,f=-18!) USER MOD Single : A 72 HIS : no HD1:sc= -2.62! K(o=-2.6!,f=-1.1) USER MOD Single : A 74 GLN : amide:sc= -1.61 X(o=-1.6,f=-1.4) USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 180:sc= -0.0251 USER MOD Single : A 84 THR OG1 : rot -64:sc= -0.187 USER MOD Single : A 88 THR OG1 : rot 180:sc= 0 USER MOD Single : A 89 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 91 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 100 GLN : amide:sc= -0.768 K(o=-0.77,f=-2.4!) USER MOD Single : A 102 ASN : amide:sc= -1.55! X(o=-1.6!,f=-1.4) USER MOD Single : A 103 ASN : amide:sc= -2.11! C(o=-2.1!,f=-13!) USER MOD Single : A 105 GLN : amide:sc= -0.11 X(o=-0.11,f=-0.21) USER MOD Single : A 106 GLN : amide:sc= -0.426 X(o=-0.43,f=-0.052) USER MOD Single : A 107 GLN : amide:sc= -0.715 X(o=-0.72,f=-0.63) USER MOD Single : A 113 TYR OH : rot -138:sc= 1.31 USER MOD Single : A 114 GLN : amide:sc= -7.87! C(o=-7.9!,f=-4.9!) USER MOD Single : A 115 GLN : amide:sc= -0.0644 K(o=-0.064,f=-1.2!) USER MOD Single : A 127 SER OG : rot 74:sc= 0.983 USER MOD Single : A 129 LYS NZ :NH3+ 149:sc= -5.29! (180deg=-7.87!) USER MOD Single : A 132 SER OG : rot -65:sc= 0.93 USER MOD ----------------------------------------------------------------- ATOM 1 N PRO A 1 7.139 10.071 0.668 1.00 0.00 N ATOM 2 CA PRO A 1 7.802 9.158 1.651 1.00 0.00 C ATOM 3 C PRO A 1 7.701 9.772 3.060 1.00 0.00 C ATOM 4 O PRO A 1 7.106 10.810 3.249 1.00 0.00 O ATOM 5 CB PRO A 1 9.276 8.986 1.224 1.00 0.00 C ATOM 6 CG PRO A 1 9.518 9.948 0.054 1.00 0.00 C ATOM 7 CD PRO A 1 8.160 10.580 -0.298 1.00 0.00 C ATOM 0 H2 PRO A 1 6.697 10.851 1.155 1.00 0.00 H new ATOM 0 H3 PRO A 1 6.401 9.574 0.170 1.00 0.00 H new ATOM 0 HA PRO A 1 7.317 8.182 1.671 1.00 0.00 H new ATOM 0 HB2 PRO A 1 9.947 9.211 2.053 1.00 0.00 H new ATOM 0 HB3 PRO A 1 9.473 7.957 0.924 1.00 0.00 H new ATOM 0 HG2 PRO A 1 10.241 10.716 0.330 1.00 0.00 H new ATOM 0 HG3 PRO A 1 9.930 9.416 -0.804 1.00 0.00 H new ATOM 0 HD2 PRO A 1 8.223 11.667 -0.246 1.00 0.00 H new ATOM 0 HD3 PRO A 1 7.876 10.325 -1.319 1.00 0.00 H new ATOM 17 N VAL A 2 8.301 9.140 4.032 1.00 0.00 N ATOM 18 CA VAL A 2 8.278 9.664 5.433 1.00 0.00 C ATOM 19 C VAL A 2 9.385 8.946 6.200 1.00 0.00 C ATOM 20 O VAL A 2 9.539 7.749 6.073 1.00 0.00 O ATOM 21 CB VAL A 2 6.928 9.360 6.111 1.00 0.00 C ATOM 22 CG1 VAL A 2 5.812 10.214 5.498 1.00 0.00 C ATOM 23 CG2 VAL A 2 6.585 7.878 5.936 1.00 0.00 C ATOM 0 H VAL A 2 8.816 8.267 3.915 1.00 0.00 H new ATOM 0 HA VAL A 2 8.422 10.744 5.427 1.00 0.00 H new ATOM 0 HB VAL A 2 7.012 9.597 7.171 1.00 0.00 H new ATOM 0 HG11 VAL A 2 4.867 9.985 5.990 1.00 0.00 H new ATOM 0 HG12 VAL A 2 6.045 11.270 5.634 1.00 0.00 H new ATOM 0 HG13 VAL A 2 5.729 9.995 4.433 1.00 0.00 H new ATOM 0 HG21 VAL A 2 5.630 7.666 6.417 1.00 0.00 H new ATOM 0 HG22 VAL A 2 6.517 7.643 4.874 1.00 0.00 H new ATOM 0 HG23 VAL A 2 7.364 7.268 6.393 1.00 0.00 H new ATOM 33 N MET A 3 10.167 9.642 6.992 1.00 0.00 N ATOM 34 CA MET A 3 11.260 8.938 7.742 1.00 0.00 C ATOM 35 C MET A 3 11.454 9.576 9.123 1.00 0.00 C ATOM 36 O MET A 3 10.711 10.446 9.530 1.00 0.00 O ATOM 37 CB MET A 3 12.568 8.978 6.940 1.00 0.00 C ATOM 38 CG MET A 3 12.266 8.836 5.444 1.00 0.00 C ATOM 39 SD MET A 3 13.821 8.824 4.517 1.00 0.00 S ATOM 40 CE MET A 3 13.122 9.224 2.896 1.00 0.00 C ATOM 0 H MET A 3 10.100 10.647 7.151 1.00 0.00 H new ATOM 0 HA MET A 3 10.973 7.896 7.881 1.00 0.00 H new ATOM 0 HB2 MET A 3 13.091 9.916 7.127 1.00 0.00 H new ATOM 0 HB3 MET A 3 13.229 8.174 7.265 1.00 0.00 H new ATOM 0 HG2 MET A 3 11.712 7.916 5.259 1.00 0.00 H new ATOM 0 HG3 MET A 3 11.636 9.660 5.109 1.00 0.00 H new ATOM 0 HE1 MET A 3 13.921 9.269 2.156 1.00 0.00 H new ATOM 0 HE2 MET A 3 12.405 8.455 2.609 1.00 0.00 H new ATOM 0 HE3 MET A 3 12.618 10.189 2.945 1.00 0.00 H new ATOM 50 N HIS A 4 12.445 9.128 9.850 1.00 0.00 N ATOM 51 CA HIS A 4 12.695 9.677 11.214 1.00 0.00 C ATOM 52 C HIS A 4 14.145 9.371 11.636 1.00 0.00 C ATOM 53 O HIS A 4 14.400 8.304 12.156 1.00 0.00 O ATOM 54 CB HIS A 4 11.744 8.990 12.198 1.00 0.00 C ATOM 55 CG HIS A 4 11.889 7.498 12.075 1.00 0.00 C ATOM 56 ND1 HIS A 4 12.425 6.721 13.091 1.00 0.00 N ATOM 57 CD2 HIS A 4 11.573 6.627 11.063 1.00 0.00 C ATOM 58 CE1 HIS A 4 12.414 5.443 12.671 1.00 0.00 C ATOM 59 NE2 HIS A 4 11.905 5.329 11.441 1.00 0.00 N ATOM 0 H HIS A 4 13.096 8.400 9.554 1.00 0.00 H new ATOM 0 HA HIS A 4 12.533 10.755 11.212 1.00 0.00 H new ATOM 0 HB2 HIS A 4 11.968 9.305 13.217 1.00 0.00 H new ATOM 0 HB3 HIS A 4 10.715 9.285 11.992 1.00 0.00 H new ATOM 0 HD2 HIS A 4 11.133 6.906 10.117 1.00 0.00 H new ATOM 0 HE1 HIS A 4 12.773 4.610 13.257 1.00 0.00 H new ATOM 0 HE2 HIS A 4 11.785 4.475 10.896 1.00 0.00 H new ATOM 67 N PRO A 5 15.064 10.293 11.419 1.00 0.00 N ATOM 68 CA PRO A 5 16.467 10.063 11.809 1.00 0.00 C ATOM 69 C PRO A 5 16.537 9.884 13.332 1.00 0.00 C ATOM 70 O PRO A 5 16.032 10.697 14.079 1.00 0.00 O ATOM 71 CB PRO A 5 17.221 11.336 11.349 1.00 0.00 C ATOM 72 CG PRO A 5 16.199 12.233 10.592 1.00 0.00 C ATOM 73 CD PRO A 5 14.803 11.603 10.783 1.00 0.00 C ATOM 0 HA PRO A 5 16.902 9.169 11.362 1.00 0.00 H new ATOM 0 HB2 PRO A 5 17.637 11.867 12.206 1.00 0.00 H new ATOM 0 HB3 PRO A 5 18.057 11.074 10.700 1.00 0.00 H new ATOM 0 HG2 PRO A 5 16.218 13.250 10.983 1.00 0.00 H new ATOM 0 HG3 PRO A 5 16.451 12.293 9.533 1.00 0.00 H new ATOM 0 HD2 PRO A 5 14.169 12.229 11.411 1.00 0.00 H new ATOM 0 HD3 PRO A 5 14.289 11.484 9.829 1.00 0.00 H new ATOM 81 N HIS A 6 17.143 8.819 13.794 1.00 0.00 N ATOM 82 CA HIS A 6 17.230 8.582 15.266 1.00 0.00 C ATOM 83 C HIS A 6 17.621 9.876 15.982 1.00 0.00 C ATOM 84 O HIS A 6 18.787 10.170 16.158 1.00 0.00 O ATOM 85 CB HIS A 6 18.284 7.508 15.548 1.00 0.00 C ATOM 86 CG HIS A 6 18.342 7.239 17.027 1.00 0.00 C ATOM 87 ND1 HIS A 6 17.548 7.922 17.934 1.00 0.00 N ATOM 88 CD2 HIS A 6 19.096 6.366 17.772 1.00 0.00 C ATOM 89 CE1 HIS A 6 17.838 7.453 19.161 1.00 0.00 C ATOM 90 NE2 HIS A 6 18.776 6.503 19.119 1.00 0.00 N ATOM 0 H HIS A 6 17.581 8.103 13.214 1.00 0.00 H new ATOM 0 HA HIS A 6 16.258 8.250 15.632 1.00 0.00 H new ATOM 0 HB2 HIS A 6 18.038 6.592 15.010 1.00 0.00 H new ATOM 0 HB3 HIS A 6 19.259 7.837 15.189 1.00 0.00 H new ATOM 0 HD2 HIS A 6 19.826 5.678 17.373 1.00 0.00 H new ATOM 0 HE1 HIS A 6 17.370 7.802 20.069 1.00 0.00 H new ATOM 0 HE2 HIS A 6 19.172 5.989 19.905 1.00 0.00 H new ATOM 98 N GLY A 7 16.650 10.650 16.400 1.00 0.00 N ATOM 99 CA GLY A 7 16.950 11.931 17.111 1.00 0.00 C ATOM 100 C GLY A 7 16.028 13.043 16.600 1.00 0.00 C ATOM 101 O GLY A 7 15.303 13.654 17.360 1.00 0.00 O ATOM 0 H GLY A 7 15.658 10.448 16.279 1.00 0.00 H new ATOM 0 HA2 GLY A 7 16.815 11.801 18.185 1.00 0.00 H new ATOM 0 HA3 GLY A 7 17.992 12.209 16.952 1.00 0.00 H new ATOM 105 N ALA A 8 16.071 13.337 15.326 1.00 0.00 N ATOM 106 CA ALA A 8 15.220 14.435 14.790 1.00 0.00 C ATOM 107 C ALA A 8 13.736 14.028 14.880 1.00 0.00 C ATOM 108 O ALA A 8 13.433 12.951 15.355 1.00 0.00 O ATOM 109 CB ALA A 8 15.631 14.702 13.327 1.00 0.00 C ATOM 0 H ALA A 8 16.657 12.865 14.638 1.00 0.00 H new ATOM 0 HA ALA A 8 15.357 15.346 15.373 1.00 0.00 H new ATOM 0 HB1 ALA A 8 15.017 15.504 12.917 1.00 0.00 H new ATOM 0 HB2 ALA A 8 16.681 14.994 13.291 1.00 0.00 H new ATOM 0 HB3 ALA A 8 15.486 13.797 12.737 1.00 0.00 H new ATOM 115 N PRO A 9 12.847 14.890 14.422 1.00 0.00 N ATOM 116 CA PRO A 9 11.411 14.605 14.454 1.00 0.00 C ATOM 117 C PRO A 9 11.104 13.702 13.266 1.00 0.00 C ATOM 118 O PRO A 9 11.953 13.517 12.417 1.00 0.00 O ATOM 119 CB PRO A 9 10.734 15.980 14.264 1.00 0.00 C ATOM 120 CG PRO A 9 11.858 16.998 13.926 1.00 0.00 C ATOM 121 CD PRO A 9 13.174 16.199 13.834 1.00 0.00 C ATOM 0 HA PRO A 9 11.074 14.118 15.369 1.00 0.00 H new ATOM 0 HB2 PRO A 9 9.997 15.939 13.462 1.00 0.00 H new ATOM 0 HB3 PRO A 9 10.204 16.277 15.169 1.00 0.00 H new ATOM 0 HG2 PRO A 9 11.648 17.506 12.985 1.00 0.00 H new ATOM 0 HG3 PRO A 9 11.926 17.767 14.695 1.00 0.00 H new ATOM 0 HD2 PRO A 9 13.507 16.099 12.801 1.00 0.00 H new ATOM 0 HD3 PRO A 9 13.977 16.692 14.382 1.00 0.00 H new ATOM 129 N PRO A 10 9.913 13.183 13.198 1.00 0.00 N ATOM 130 CA PRO A 10 9.560 12.342 12.064 1.00 0.00 C ATOM 131 C PRO A 10 9.501 13.197 10.792 1.00 0.00 C ATOM 132 O PRO A 10 8.713 14.117 10.693 1.00 0.00 O ATOM 133 CB PRO A 10 8.171 11.762 12.414 1.00 0.00 C ATOM 134 CG PRO A 10 7.680 12.489 13.701 1.00 0.00 C ATOM 135 CD PRO A 10 8.852 13.354 14.218 1.00 0.00 C ATOM 0 HA PRO A 10 10.285 11.549 11.880 1.00 0.00 H new ATOM 0 HB2 PRO A 10 7.471 11.918 11.593 1.00 0.00 H new ATOM 0 HB3 PRO A 10 8.234 10.686 12.580 1.00 0.00 H new ATOM 0 HG2 PRO A 10 6.811 13.110 13.483 1.00 0.00 H new ATOM 0 HG3 PRO A 10 7.374 11.766 14.457 1.00 0.00 H new ATOM 0 HD2 PRO A 10 8.561 14.400 14.317 1.00 0.00 H new ATOM 0 HD3 PRO A 10 9.188 13.022 15.200 1.00 0.00 H new ATOM 143 N ASN A 11 10.324 12.911 9.822 1.00 0.00 N ATOM 144 CA ASN A 11 10.296 13.723 8.577 1.00 0.00 C ATOM 145 C ASN A 11 8.989 13.455 7.835 1.00 0.00 C ATOM 146 O ASN A 11 8.419 12.385 7.933 1.00 0.00 O ATOM 147 CB ASN A 11 11.481 13.342 7.687 1.00 0.00 C ATOM 148 CG ASN A 11 11.583 14.328 6.522 1.00 0.00 C ATOM 149 OD1 ASN A 11 10.691 14.410 5.701 1.00 0.00 O ATOM 150 ND2 ASN A 11 12.640 15.086 6.415 1.00 0.00 N ATOM 0 H ASN A 11 11.009 12.156 9.838 1.00 0.00 H new ATOM 0 HA ASN A 11 10.365 14.781 8.828 1.00 0.00 H new ATOM 0 HB2 ASN A 11 12.403 13.352 8.268 1.00 0.00 H new ATOM 0 HB3 ASN A 11 11.354 12.328 7.309 1.00 0.00 H new ATOM 0 HD21 ASN A 11 12.717 15.747 5.642 1.00 0.00 H new ATOM 0 HD22 ASN A 11 13.389 15.017 7.104 1.00 0.00 H new ATOM 157 N HIS A 12 8.510 14.419 7.090 1.00 0.00 N ATOM 158 CA HIS A 12 7.232 14.231 6.337 1.00 0.00 C ATOM 159 C HIS A 12 7.344 14.875 4.955 1.00 0.00 C ATOM 160 O HIS A 12 7.462 16.078 4.828 1.00 0.00 O ATOM 161 CB HIS A 12 6.086 14.887 7.110 1.00 0.00 C ATOM 162 CG HIS A 12 6.395 16.343 7.328 1.00 0.00 C ATOM 163 ND1 HIS A 12 5.633 17.353 6.763 1.00 0.00 N ATOM 164 CD2 HIS A 12 7.379 16.974 8.049 1.00 0.00 C ATOM 165 CE1 HIS A 12 6.165 18.527 7.149 1.00 0.00 C ATOM 166 NE2 HIS A 12 7.232 18.354 7.934 1.00 0.00 N ATOM 0 H HIS A 12 8.950 15.331 6.970 1.00 0.00 H new ATOM 0 HA HIS A 12 7.036 13.165 6.222 1.00 0.00 H new ATOM 0 HB2 HIS A 12 5.153 14.781 6.557 1.00 0.00 H new ATOM 0 HB3 HIS A 12 5.947 14.387 8.068 1.00 0.00 H new ATOM 0 HD2 HIS A 12 8.150 16.476 8.619 1.00 0.00 H new ATOM 0 HE1 HIS A 12 5.777 19.492 6.859 1.00 0.00 H new ATOM 0 HE2 HIS A 12 7.814 19.077 8.358 1.00 0.00 H new ATOM 174 N ARG A 13 7.299 14.084 3.918 1.00 0.00 N ATOM 175 CA ARG A 13 7.394 14.646 2.539 1.00 0.00 C ATOM 176 C ARG A 13 5.980 15.053 2.092 1.00 0.00 C ATOM 177 O ARG A 13 5.018 14.473 2.554 1.00 0.00 O ATOM 178 CB ARG A 13 7.931 13.559 1.588 1.00 0.00 C ATOM 179 CG ARG A 13 9.459 13.404 1.737 1.00 0.00 C ATOM 180 CD ARG A 13 9.802 12.475 2.927 1.00 0.00 C ATOM 181 NE ARG A 13 10.946 13.048 3.707 1.00 0.00 N ATOM 182 CZ ARG A 13 12.025 13.485 3.108 1.00 0.00 C ATOM 183 NH1 ARG A 13 12.183 13.319 1.824 1.00 0.00 N ATOM 184 NH2 ARG A 13 12.966 14.057 3.808 1.00 0.00 N ATOM 0 H ARG A 13 7.200 13.070 3.966 1.00 0.00 H new ATOM 0 HA ARG A 13 8.062 15.507 2.522 1.00 0.00 H new ATOM 0 HB2 ARG A 13 7.442 12.609 1.802 1.00 0.00 H new ATOM 0 HB3 ARG A 13 7.686 13.818 0.558 1.00 0.00 H new ATOM 0 HG2 ARG A 13 9.879 12.996 0.818 1.00 0.00 H new ATOM 0 HG3 ARG A 13 9.915 14.382 1.890 1.00 0.00 H new ATOM 0 HD2 ARG A 13 8.931 12.360 3.573 1.00 0.00 H new ATOM 0 HD3 ARG A 13 10.061 11.481 2.561 1.00 0.00 H new ATOM 0 HE ARG A 13 10.883 13.099 4.724 1.00 0.00 H new ATOM 0 HH11 ARG A 13 11.463 12.846 1.279 1.00 0.00 H new ATOM 0 HH12 ARG A 13 13.027 13.663 1.365 1.00 0.00 H new ATOM 0 HH21 ARG A 13 12.859 14.162 4.817 1.00 0.00 H new ATOM 0 HH22 ARG A 13 13.809 14.399 3.346 1.00 0.00 H new ATOM 198 N PRO A 14 5.870 16.025 1.208 1.00 0.00 N ATOM 199 CA PRO A 14 4.549 16.461 0.727 1.00 0.00 C ATOM 200 C PRO A 14 3.707 15.234 0.348 1.00 0.00 C ATOM 201 O PRO A 14 4.009 14.537 -0.601 1.00 0.00 O ATOM 202 CB PRO A 14 4.857 17.353 -0.497 1.00 0.00 C ATOM 203 CG PRO A 14 6.393 17.608 -0.512 1.00 0.00 C ATOM 204 CD PRO A 14 7.014 16.757 0.618 1.00 0.00 C ATOM 0 HA PRO A 14 3.973 17.005 1.475 1.00 0.00 H new ATOM 0 HB2 PRO A 14 4.540 16.864 -1.418 1.00 0.00 H new ATOM 0 HB3 PRO A 14 4.312 18.295 -0.433 1.00 0.00 H new ATOM 0 HG2 PRO A 14 6.818 17.333 -1.477 1.00 0.00 H new ATOM 0 HG3 PRO A 14 6.608 18.665 -0.358 1.00 0.00 H new ATOM 0 HD2 PRO A 14 7.766 16.070 0.229 1.00 0.00 H new ATOM 0 HD3 PRO A 14 7.508 17.384 1.360 1.00 0.00 H new ATOM 212 N TRP A 15 2.658 14.960 1.075 1.00 0.00 N ATOM 213 CA TRP A 15 1.816 13.776 0.743 1.00 0.00 C ATOM 214 C TRP A 15 1.025 14.060 -0.532 1.00 0.00 C ATOM 215 O TRP A 15 0.169 13.295 -0.929 1.00 0.00 O ATOM 216 CB TRP A 15 0.848 13.497 1.894 1.00 0.00 C ATOM 217 CG TRP A 15 1.606 13.451 3.182 1.00 0.00 C ATOM 218 CD1 TRP A 15 2.747 12.754 3.388 1.00 0.00 C ATOM 219 CD2 TRP A 15 1.298 14.114 4.443 1.00 0.00 C ATOM 220 NE1 TRP A 15 3.160 12.947 4.694 1.00 0.00 N ATOM 221 CE2 TRP A 15 2.299 13.778 5.385 1.00 0.00 C ATOM 222 CE3 TRP A 15 0.258 14.965 4.856 1.00 0.00 C ATOM 223 CZ2 TRP A 15 2.270 14.269 6.690 1.00 0.00 C ATOM 224 CZ3 TRP A 15 0.225 15.462 6.170 1.00 0.00 C ATOM 225 CH2 TRP A 15 1.229 15.114 7.085 1.00 0.00 C ATOM 0 H TRP A 15 2.349 15.503 1.881 1.00 0.00 H new ATOM 0 HA TRP A 15 2.455 12.906 0.590 1.00 0.00 H new ATOM 0 HB2 TRP A 15 0.084 14.273 1.937 1.00 0.00 H new ATOM 0 HB3 TRP A 15 0.333 12.551 1.729 1.00 0.00 H new ATOM 0 HD1 TRP A 15 3.253 12.146 2.653 1.00 0.00 H new ATOM 0 HE1 TRP A 15 3.998 12.527 5.098 1.00 0.00 H new ATOM 0 HE3 TRP A 15 -0.520 15.238 4.159 1.00 0.00 H new ATOM 0 HZ2 TRP A 15 3.046 13.998 7.390 1.00 0.00 H new ATOM 0 HZ3 TRP A 15 -0.578 16.116 6.477 1.00 0.00 H new ATOM 0 HH2 TRP A 15 1.198 15.498 8.094 1.00 0.00 H new ATOM 236 N GLN A 16 1.306 15.157 -1.178 1.00 0.00 N ATOM 237 CA GLN A 16 0.575 15.494 -2.429 1.00 0.00 C ATOM 238 C GLN A 16 -0.936 15.407 -2.187 1.00 0.00 C ATOM 239 O GLN A 16 -1.597 14.536 -2.709 1.00 0.00 O ATOM 240 CB GLN A 16 0.966 14.510 -3.536 1.00 0.00 C ATOM 241 CG GLN A 16 2.350 14.870 -4.076 1.00 0.00 C ATOM 242 CD GLN A 16 2.868 13.732 -4.956 1.00 0.00 C ATOM 243 OE1 GLN A 16 3.741 12.987 -4.555 1.00 0.00 O ATOM 244 NE2 GLN A 16 2.365 13.565 -6.148 1.00 0.00 N ATOM 0 H GLN A 16 2.012 15.835 -0.892 1.00 0.00 H new ATOM 0 HA GLN A 16 0.837 16.508 -2.732 1.00 0.00 H new ATOM 0 HB2 GLN A 16 0.970 13.492 -3.147 1.00 0.00 H new ATOM 0 HB3 GLN A 16 0.231 14.541 -4.340 1.00 0.00 H new ATOM 0 HG2 GLN A 16 2.298 15.794 -4.652 1.00 0.00 H new ATOM 0 HG3 GLN A 16 3.039 15.047 -3.250 1.00 0.00 H new ATOM 0 HE21 GLN A 16 1.633 14.190 -6.485 1.00 0.00 H new ATOM 0 HE22 GLN A 16 2.704 12.809 -6.743 1.00 0.00 H new ATOM 253 N MET A 17 -1.486 16.315 -1.414 1.00 0.00 N ATOM 254 CA MET A 17 -2.960 16.315 -1.152 1.00 0.00 C ATOM 255 C MET A 17 -3.737 15.914 -2.411 1.00 0.00 C ATOM 256 O MET A 17 -4.630 15.097 -2.353 1.00 0.00 O ATOM 257 CB MET A 17 -3.386 17.727 -0.735 1.00 0.00 C ATOM 258 CG MET A 17 -3.052 18.723 -1.849 1.00 0.00 C ATOM 259 SD MET A 17 -3.041 20.401 -1.170 1.00 0.00 S ATOM 260 CE MET A 17 -2.268 21.216 -2.589 1.00 0.00 C ATOM 0 H MET A 17 -0.970 17.063 -0.950 1.00 0.00 H new ATOM 0 HA MET A 17 -3.178 15.596 -0.362 1.00 0.00 H new ATOM 0 HB2 MET A 17 -4.456 17.747 -0.526 1.00 0.00 H new ATOM 0 HB3 MET A 17 -2.877 18.013 0.185 1.00 0.00 H new ATOM 0 HG2 MET A 17 -2.080 18.488 -2.283 1.00 0.00 H new ATOM 0 HG3 MET A 17 -3.786 18.648 -2.651 1.00 0.00 H new ATOM 0 HE1 MET A 17 -2.162 22.281 -2.384 1.00 0.00 H new ATOM 0 HE2 MET A 17 -1.284 20.781 -2.767 1.00 0.00 H new ATOM 0 HE3 MET A 17 -2.891 21.077 -3.472 1.00 0.00 H new ATOM 270 N LYS A 18 -3.407 16.464 -3.544 1.00 0.00 N ATOM 271 CA LYS A 18 -4.144 16.093 -4.788 1.00 0.00 C ATOM 272 C LYS A 18 -4.090 14.576 -4.993 1.00 0.00 C ATOM 273 O LYS A 18 -4.987 13.983 -5.564 1.00 0.00 O ATOM 274 CB LYS A 18 -3.502 16.791 -5.989 1.00 0.00 C ATOM 275 CG LYS A 18 -1.979 16.608 -5.936 1.00 0.00 C ATOM 276 CD LYS A 18 -1.314 17.263 -7.169 1.00 0.00 C ATOM 277 CE LYS A 18 -1.177 16.246 -8.313 1.00 0.00 C ATOM 278 NZ LYS A 18 -2.529 15.843 -8.794 1.00 0.00 N ATOM 0 H LYS A 18 -2.663 17.151 -3.666 1.00 0.00 H new ATOM 0 HA LYS A 18 -5.184 16.406 -4.694 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -3.896 16.377 -6.917 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -3.752 17.852 -5.982 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -1.584 17.053 -5.023 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -1.735 15.546 -5.904 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -1.909 18.114 -7.501 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -0.331 17.648 -6.897 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -0.604 16.681 -9.132 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -0.627 15.370 -7.969 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -2.459 15.489 -9.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -2.907 15.094 -8.180 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -3.166 16.665 -8.769 1.00 0.00 H new ATOM 292 N ASP A 19 -3.048 13.944 -4.532 1.00 0.00 N ATOM 293 CA ASP A 19 -2.930 12.468 -4.702 1.00 0.00 C ATOM 294 C ASP A 19 -4.119 11.753 -4.056 1.00 0.00 C ATOM 295 O ASP A 19 -5.059 11.340 -4.715 1.00 0.00 O ATOM 296 CB ASP A 19 -1.647 11.990 -4.022 1.00 0.00 C ATOM 297 CG ASP A 19 -1.498 10.480 -4.218 1.00 0.00 C ATOM 298 OD1 ASP A 19 -1.906 9.995 -5.260 1.00 0.00 O ATOM 299 OD2 ASP A 19 -0.979 9.835 -3.322 1.00 0.00 O ATOM 0 H ASP A 19 -2.270 14.387 -4.043 1.00 0.00 H new ATOM 0 HA ASP A 19 -2.912 12.239 -5.768 1.00 0.00 H new ATOM 0 HB2 ASP A 19 -0.785 12.509 -4.442 1.00 0.00 H new ATOM 0 HB3 ASP A 19 -1.676 12.228 -2.959 1.00 0.00 H new ATOM 304 N LEU A 20 -4.076 11.584 -2.764 1.00 0.00 N ATOM 305 CA LEU A 20 -5.183 10.875 -2.078 1.00 0.00 C ATOM 306 C LEU A 20 -6.484 11.669 -2.205 1.00 0.00 C ATOM 307 O LEU A 20 -7.531 11.107 -2.416 1.00 0.00 O ATOM 308 CB LEU A 20 -4.827 10.660 -0.600 1.00 0.00 C ATOM 309 CG LEU A 20 -4.509 12.016 0.091 1.00 0.00 C ATOM 310 CD1 LEU A 20 -5.729 12.515 0.879 1.00 0.00 C ATOM 311 CD2 LEU A 20 -3.333 11.847 1.065 1.00 0.00 C ATOM 0 H LEU A 20 -3.322 11.907 -2.157 1.00 0.00 H new ATOM 0 HA LEU A 20 -5.328 9.903 -2.551 1.00 0.00 H new ATOM 0 HB2 LEU A 20 -5.656 10.171 -0.088 1.00 0.00 H new ATOM 0 HB3 LEU A 20 -3.967 9.995 -0.521 1.00 0.00 H new ATOM 0 HG LEU A 20 -4.252 12.740 -0.683 1.00 0.00 H new ATOM 0 HD11 LEU A 20 -5.490 13.465 1.357 1.00 0.00 H new ATOM 0 HD12 LEU A 20 -6.570 12.652 0.199 1.00 0.00 H new ATOM 0 HD13 LEU A 20 -5.994 11.782 1.641 1.00 0.00 H new ATOM 0 HD21 LEU A 20 -3.117 12.802 1.544 1.00 0.00 H new ATOM 0 HD22 LEU A 20 -3.593 11.110 1.825 1.00 0.00 H new ATOM 0 HD23 LEU A 20 -2.453 11.509 0.518 1.00 0.00 H new ATOM 323 N GLN A 21 -6.429 12.967 -2.071 1.00 0.00 N ATOM 324 CA GLN A 21 -7.679 13.791 -2.176 1.00 0.00 C ATOM 325 C GLN A 21 -8.537 13.304 -3.347 1.00 0.00 C ATOM 326 O GLN A 21 -9.750 13.360 -3.302 1.00 0.00 O ATOM 327 CB GLN A 21 -7.321 15.262 -2.398 1.00 0.00 C ATOM 328 CG GLN A 21 -8.606 16.083 -2.531 1.00 0.00 C ATOM 329 CD GLN A 21 -8.273 17.572 -2.426 1.00 0.00 C ATOM 330 OE1 GLN A 21 -8.583 18.208 -1.437 1.00 0.00 O ATOM 331 NE2 GLN A 21 -7.651 18.161 -3.410 1.00 0.00 N ATOM 0 H GLN A 21 -5.576 13.497 -1.893 1.00 0.00 H new ATOM 0 HA GLN A 21 -8.239 13.687 -1.247 1.00 0.00 H new ATOM 0 HB2 GLN A 21 -6.724 15.632 -1.564 1.00 0.00 H new ATOM 0 HB3 GLN A 21 -6.714 15.368 -3.297 1.00 0.00 H new ATOM 0 HG2 GLN A 21 -9.087 15.873 -3.487 1.00 0.00 H new ATOM 0 HG3 GLN A 21 -9.313 15.802 -1.750 1.00 0.00 H new ATOM 0 HE21 GLN A 21 -7.390 17.629 -4.240 1.00 0.00 H new ATOM 0 HE22 GLN A 21 -7.425 19.154 -3.349 1.00 0.00 H new ATOM 340 N ALA A 22 -7.921 12.820 -4.393 1.00 0.00 N ATOM 341 CA ALA A 22 -8.715 12.323 -5.557 1.00 0.00 C ATOM 342 C ALA A 22 -9.146 10.876 -5.292 1.00 0.00 C ATOM 343 O ALA A 22 -10.197 10.443 -5.725 1.00 0.00 O ATOM 344 CB ALA A 22 -7.865 12.395 -6.829 1.00 0.00 C ATOM 0 H ALA A 22 -6.909 12.747 -4.493 1.00 0.00 H new ATOM 0 HA ALA A 22 -9.601 12.944 -5.691 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -8.447 12.032 -7.676 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -7.567 13.428 -7.009 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -6.976 11.777 -6.708 1.00 0.00 H new ATOM 350 N ILE A 23 -8.364 10.133 -4.553 1.00 0.00 N ATOM 351 CA ILE A 23 -8.750 8.722 -4.235 1.00 0.00 C ATOM 352 C ILE A 23 -9.472 8.717 -2.886 1.00 0.00 C ATOM 353 O ILE A 23 -10.003 7.716 -2.443 1.00 0.00 O ATOM 354 CB ILE A 23 -7.484 7.856 -4.136 1.00 0.00 C ATOM 355 CG1 ILE A 23 -6.824 7.711 -5.536 1.00 0.00 C ATOM 356 CG2 ILE A 23 -7.845 6.464 -3.564 1.00 0.00 C ATOM 357 CD1 ILE A 23 -5.837 8.860 -5.782 1.00 0.00 C ATOM 0 H ILE A 23 -7.476 10.440 -4.156 1.00 0.00 H new ATOM 0 HA ILE A 23 -9.398 8.322 -5.015 1.00 0.00 H new ATOM 0 HB ILE A 23 -6.773 8.339 -3.466 1.00 0.00 H new ATOM 0 HG12 ILE A 23 -6.304 6.755 -5.603 1.00 0.00 H new ATOM 0 HG13 ILE A 23 -7.592 7.711 -6.309 1.00 0.00 H new ATOM 0 HG21 ILE A 23 -6.944 5.854 -3.496 1.00 0.00 H new ATOM 0 HG22 ILE A 23 -8.281 6.580 -2.572 1.00 0.00 H new ATOM 0 HG23 ILE A 23 -8.565 5.976 -4.221 1.00 0.00 H new ATOM 0 HD11 ILE A 23 -5.383 8.745 -6.766 1.00 0.00 H new ATOM 0 HD12 ILE A 23 -6.367 9.811 -5.736 1.00 0.00 H new ATOM 0 HD13 ILE A 23 -5.059 8.841 -5.019 1.00 0.00 H new ATOM 369 N LYS A 24 -9.522 9.852 -2.253 1.00 0.00 N ATOM 370 CA LYS A 24 -10.213 9.992 -0.946 1.00 0.00 C ATOM 371 C LYS A 24 -11.524 10.740 -1.190 1.00 0.00 C ATOM 372 O LYS A 24 -12.471 10.655 -0.415 1.00 0.00 O ATOM 373 CB LYS A 24 -9.299 10.779 0.004 1.00 0.00 C ATOM 374 CG LYS A 24 -10.019 11.144 1.313 1.00 0.00 C ATOM 375 CD LYS A 24 -10.544 9.875 2.014 1.00 0.00 C ATOM 376 CE LYS A 24 -10.513 10.051 3.539 1.00 0.00 C ATOM 377 NZ LYS A 24 -10.905 8.771 4.194 1.00 0.00 N ATOM 0 H LYS A 24 -9.100 10.714 -2.599 1.00 0.00 H new ATOM 0 HA LYS A 24 -10.430 9.023 -0.497 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -8.412 10.187 0.229 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -8.958 11.689 -0.490 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -9.335 11.675 1.975 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -10.848 11.819 1.102 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -11.563 9.667 1.687 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -9.936 9.017 1.729 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -9.515 10.346 3.862 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -11.193 10.848 3.838 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -10.884 8.889 5.227 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -11.866 8.508 3.895 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -10.239 8.022 3.918 1.00 0.00 H new ATOM 391 N GLN A 25 -11.649 11.382 -2.318 1.00 0.00 N ATOM 392 CA GLN A 25 -12.931 12.048 -2.643 1.00 0.00 C ATOM 393 C GLN A 25 -13.772 10.998 -3.357 1.00 0.00 C ATOM 394 O GLN A 25 -14.989 10.993 -3.317 1.00 0.00 O ATOM 395 CB GLN A 25 -12.653 13.228 -3.584 1.00 0.00 C ATOM 396 CG GLN A 25 -13.957 13.699 -4.236 1.00 0.00 C ATOM 397 CD GLN A 25 -13.751 15.085 -4.851 1.00 0.00 C ATOM 398 OE1 GLN A 25 -14.487 16.007 -4.559 1.00 0.00 O ATOM 399 NE2 GLN A 25 -12.776 15.272 -5.698 1.00 0.00 N ATOM 0 H GLN A 25 -10.918 11.472 -3.024 1.00 0.00 H new ATOM 0 HA GLN A 25 -13.439 12.428 -1.757 1.00 0.00 H new ATOM 0 HB2 GLN A 25 -12.199 14.048 -3.028 1.00 0.00 H new ATOM 0 HB3 GLN A 25 -11.940 12.930 -4.353 1.00 0.00 H new ATOM 0 HG2 GLN A 25 -14.268 12.991 -5.005 1.00 0.00 H new ATOM 0 HG3 GLN A 25 -14.755 13.734 -3.494 1.00 0.00 H new ATOM 0 HE21 GLN A 25 -12.158 14.498 -5.943 1.00 0.00 H new ATOM 0 HE22 GLN A 25 -12.632 16.192 -6.115 1.00 0.00 H new ATOM 408 N GLU A 26 -13.085 10.101 -4.026 1.00 0.00 N ATOM 409 CA GLU A 26 -13.757 9.021 -4.780 1.00 0.00 C ATOM 410 C GLU A 26 -13.954 7.785 -3.892 1.00 0.00 C ATOM 411 O GLU A 26 -14.853 6.982 -4.133 1.00 0.00 O ATOM 412 CB GLU A 26 -12.897 8.652 -5.988 1.00 0.00 C ATOM 413 CG GLU A 26 -13.642 7.634 -6.850 1.00 0.00 C ATOM 414 CD GLU A 26 -12.963 7.520 -8.217 1.00 0.00 C ATOM 415 OE1 GLU A 26 -12.414 8.511 -8.670 1.00 0.00 O ATOM 416 OE2 GLU A 26 -13.003 6.442 -8.788 1.00 0.00 O ATOM 0 H GLU A 26 -12.066 10.081 -4.075 1.00 0.00 H new ATOM 0 HA GLU A 26 -14.736 9.370 -5.108 1.00 0.00 H new ATOM 0 HB2 GLU A 26 -12.670 9.544 -6.573 1.00 0.00 H new ATOM 0 HB3 GLU A 26 -11.945 8.237 -5.657 1.00 0.00 H new ATOM 0 HG2 GLU A 26 -13.652 6.662 -6.356 1.00 0.00 H new ATOM 0 HG3 GLU A 26 -14.681 7.939 -6.974 1.00 0.00 H new ATOM 423 N VAL A 27 -13.212 7.633 -2.809 1.00 0.00 N ATOM 424 CA VAL A 27 -13.507 6.459 -1.955 1.00 0.00 C ATOM 425 C VAL A 27 -14.895 6.728 -1.421 1.00 0.00 C ATOM 426 O VAL A 27 -15.764 5.882 -1.370 1.00 0.00 O ATOM 427 CB VAL A 27 -12.543 6.353 -0.773 1.00 0.00 C ATOM 428 CG1 VAL A 27 -12.618 7.605 0.083 1.00 0.00 C ATOM 429 CG2 VAL A 27 -12.922 5.134 0.084 1.00 0.00 C ATOM 0 H VAL A 27 -12.455 8.244 -2.502 1.00 0.00 H new ATOM 0 HA VAL A 27 -13.416 5.532 -2.521 1.00 0.00 H new ATOM 0 HB VAL A 27 -11.528 6.242 -1.154 1.00 0.00 H new ATOM 0 HG11 VAL A 27 -11.926 7.515 0.921 1.00 0.00 H new ATOM 0 HG12 VAL A 27 -12.349 8.473 -0.518 1.00 0.00 H new ATOM 0 HG13 VAL A 27 -13.633 7.726 0.462 1.00 0.00 H new ATOM 0 HG21 VAL A 27 -12.237 5.055 0.928 1.00 0.00 H new ATOM 0 HG22 VAL A 27 -13.941 5.252 0.454 1.00 0.00 H new ATOM 0 HG23 VAL A 27 -12.858 4.230 -0.521 1.00 0.00 H new ATOM 439 N SER A 28 -15.093 8.002 -1.063 1.00 0.00 N ATOM 440 CA SER A 28 -16.431 8.439 -0.572 1.00 0.00 C ATOM 441 C SER A 28 -17.421 7.953 -1.620 1.00 0.00 C ATOM 442 O SER A 28 -18.034 6.938 -1.434 1.00 0.00 O ATOM 443 CB SER A 28 -16.484 9.963 -0.456 1.00 0.00 C ATOM 444 OG SER A 28 -17.793 10.359 -0.070 1.00 0.00 O ATOM 0 H SER A 28 -14.383 8.733 -1.096 1.00 0.00 H new ATOM 0 HA SER A 28 -16.653 8.036 0.416 1.00 0.00 H new ATOM 0 HB2 SER A 28 -15.756 10.309 0.278 1.00 0.00 H new ATOM 0 HB3 SER A 28 -16.219 10.421 -1.409 1.00 0.00 H new ATOM 0 HG SER A 28 -17.830 11.335 0.007 1.00 0.00 H new ATOM 450 N GLN A 29 -17.539 8.689 -2.718 1.00 0.00 N ATOM 451 CA GLN A 29 -18.445 8.319 -3.874 1.00 0.00 C ATOM 452 C GLN A 29 -19.124 6.962 -3.682 1.00 0.00 C ATOM 453 O GLN A 29 -20.326 6.822 -3.783 1.00 0.00 O ATOM 454 CB GLN A 29 -17.577 8.196 -5.128 1.00 0.00 C ATOM 455 CG GLN A 29 -18.476 8.041 -6.358 1.00 0.00 C ATOM 456 CD GLN A 29 -17.614 8.014 -7.621 1.00 0.00 C ATOM 457 OE1 GLN A 29 -17.353 6.961 -8.170 1.00 0.00 O ATOM 458 NE2 GLN A 29 -17.158 9.134 -8.110 1.00 0.00 N ATOM 0 H GLN A 29 -17.027 9.559 -2.863 1.00 0.00 H new ATOM 0 HA GLN A 29 -19.213 9.089 -3.948 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -16.946 9.078 -5.234 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -16.912 7.337 -5.040 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -19.058 7.122 -6.283 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -19.187 8.866 -6.408 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -17.377 10.018 -7.650 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -16.583 9.126 -8.952 1.00 0.00 H new ATOM 467 N ALA A 30 -18.328 5.961 -3.381 1.00 0.00 N ATOM 468 CA ALA A 30 -18.876 4.587 -3.148 1.00 0.00 C ATOM 469 C ALA A 30 -19.188 4.386 -1.664 1.00 0.00 C ATOM 470 O ALA A 30 -19.528 5.301 -0.945 1.00 0.00 O ATOM 471 CB ALA A 30 -17.826 3.559 -3.576 1.00 0.00 C ATOM 0 H ALA A 30 -17.315 6.039 -3.286 1.00 0.00 H new ATOM 0 HA ALA A 30 -19.792 4.463 -3.726 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -18.213 2.553 -3.411 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -17.597 3.691 -4.634 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -16.919 3.699 -2.988 1.00 0.00 H new ATOM 477 N ALA A 31 -19.066 3.180 -1.212 1.00 0.00 N ATOM 478 CA ALA A 31 -19.328 2.875 0.224 1.00 0.00 C ATOM 479 C ALA A 31 -18.053 3.254 1.008 1.00 0.00 C ATOM 480 O ALA A 31 -17.085 3.654 0.394 1.00 0.00 O ATOM 481 CB ALA A 31 -19.641 1.366 0.340 1.00 0.00 C ATOM 0 H ALA A 31 -18.793 2.377 -1.778 1.00 0.00 H new ATOM 0 HA ALA A 31 -20.174 3.432 0.626 1.00 0.00 H new ATOM 0 HB1 ALA A 31 -19.837 1.114 1.382 1.00 0.00 H new ATOM 0 HB2 ALA A 31 -20.518 1.129 -0.262 1.00 0.00 H new ATOM 0 HB3 ALA A 31 -18.789 0.789 -0.018 1.00 0.00 H new ATOM 487 N PRO A 32 -18.064 3.128 2.324 1.00 0.00 N ATOM 488 CA PRO A 32 -16.869 3.464 3.132 1.00 0.00 C ATOM 489 C PRO A 32 -15.737 2.482 2.773 1.00 0.00 C ATOM 490 O PRO A 32 -15.081 1.916 3.624 1.00 0.00 O ATOM 491 CB PRO A 32 -17.328 3.312 4.603 1.00 0.00 C ATOM 492 CG PRO A 32 -18.806 2.819 4.583 1.00 0.00 C ATOM 493 CD PRO A 32 -19.233 2.668 3.105 1.00 0.00 C ATOM 0 HA PRO A 32 -16.484 4.468 2.953 1.00 0.00 H new ATOM 0 HB2 PRO A 32 -16.693 2.600 5.131 1.00 0.00 H new ATOM 0 HB3 PRO A 32 -17.248 4.263 5.130 1.00 0.00 H new ATOM 0 HG2 PRO A 32 -18.899 1.867 5.107 1.00 0.00 H new ATOM 0 HG3 PRO A 32 -19.453 3.530 5.097 1.00 0.00 H new ATOM 0 HD2 PRO A 32 -19.484 1.634 2.870 1.00 0.00 H new ATOM 0 HD3 PRO A 32 -20.116 3.268 2.885 1.00 0.00 H new ATOM 501 N GLY A 33 -15.534 2.274 1.504 1.00 0.00 N ATOM 502 CA GLY A 33 -14.492 1.328 1.024 1.00 0.00 C ATOM 503 C GLY A 33 -14.982 0.772 -0.310 1.00 0.00 C ATOM 504 O GLY A 33 -14.966 1.445 -1.322 1.00 0.00 O ATOM 0 H GLY A 33 -16.061 2.733 0.761 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -13.535 1.836 0.903 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -14.338 0.525 1.744 1.00 0.00 H new ATOM 508 N SER A 34 -15.465 -0.434 -0.306 1.00 0.00 N ATOM 509 CA SER A 34 -16.019 -1.038 -1.552 1.00 0.00 C ATOM 510 C SER A 34 -14.931 -1.105 -2.645 1.00 0.00 C ATOM 511 O SER A 34 -13.889 -0.497 -2.500 1.00 0.00 O ATOM 512 CB SER A 34 -17.201 -0.158 -2.016 1.00 0.00 C ATOM 513 OG SER A 34 -16.948 0.348 -3.322 1.00 0.00 O ATOM 0 H SER A 34 -15.502 -1.037 0.516 1.00 0.00 H new ATOM 0 HA SER A 34 -16.359 -2.056 -1.363 1.00 0.00 H new ATOM 0 HB2 SER A 34 -18.122 -0.741 -2.015 1.00 0.00 H new ATOM 0 HB3 SER A 34 -17.346 0.667 -1.319 1.00 0.00 H new ATOM 0 HG SER A 34 -17.797 0.473 -3.795 1.00 0.00 H new ATOM 519 N PRO A 35 -15.201 -1.828 -3.720 1.00 0.00 N ATOM 520 CA PRO A 35 -14.240 -1.948 -4.837 1.00 0.00 C ATOM 521 C PRO A 35 -13.801 -0.560 -5.336 1.00 0.00 C ATOM 522 O PRO A 35 -12.648 -0.345 -5.595 1.00 0.00 O ATOM 523 CB PRO A 35 -14.996 -2.735 -5.934 1.00 0.00 C ATOM 524 CG PRO A 35 -16.349 -3.201 -5.324 1.00 0.00 C ATOM 525 CD PRO A 35 -16.465 -2.580 -3.914 1.00 0.00 C ATOM 0 HA PRO A 35 -13.324 -2.458 -4.539 1.00 0.00 H new ATOM 0 HB2 PRO A 35 -15.165 -2.107 -6.809 1.00 0.00 H new ATOM 0 HB3 PRO A 35 -14.409 -3.592 -6.265 1.00 0.00 H new ATOM 0 HG2 PRO A 35 -17.182 -2.883 -5.952 1.00 0.00 H new ATOM 0 HG3 PRO A 35 -16.389 -4.289 -5.268 1.00 0.00 H new ATOM 0 HD2 PRO A 35 -17.331 -1.922 -3.843 1.00 0.00 H new ATOM 0 HD3 PRO A 35 -16.587 -3.350 -3.152 1.00 0.00 H new ATOM 533 N GLN A 36 -14.709 0.360 -5.519 1.00 0.00 N ATOM 534 CA GLN A 36 -14.325 1.719 -6.039 1.00 0.00 C ATOM 535 C GLN A 36 -12.977 2.189 -5.456 1.00 0.00 C ATOM 536 O GLN A 36 -12.222 2.883 -6.108 1.00 0.00 O ATOM 537 CB GLN A 36 -15.412 2.714 -5.662 1.00 0.00 C ATOM 538 CG GLN A 36 -15.222 4.008 -6.455 1.00 0.00 C ATOM 539 CD GLN A 36 -15.628 3.776 -7.912 1.00 0.00 C ATOM 540 OE1 GLN A 36 -14.789 3.744 -8.791 1.00 0.00 O ATOM 541 NE2 GLN A 36 -16.888 3.613 -8.207 1.00 0.00 N ATOM 0 H GLN A 36 -15.704 0.236 -5.333 1.00 0.00 H new ATOM 0 HA GLN A 36 -14.218 1.657 -7.122 1.00 0.00 H new ATOM 0 HB2 GLN A 36 -16.395 2.290 -5.869 1.00 0.00 H new ATOM 0 HB3 GLN A 36 -15.373 2.922 -4.593 1.00 0.00 H new ATOM 0 HG2 GLN A 36 -15.825 4.805 -6.021 1.00 0.00 H new ATOM 0 HG3 GLN A 36 -14.182 4.330 -6.403 1.00 0.00 H new ATOM 0 HE21 GLN A 36 -17.592 3.640 -7.469 1.00 0.00 H new ATOM 0 HE22 GLN A 36 -17.169 3.459 -9.175 1.00 0.00 H new ATOM 550 N PHE A 37 -12.656 1.791 -4.256 1.00 0.00 N ATOM 551 CA PHE A 37 -11.347 2.173 -3.639 1.00 0.00 C ATOM 552 C PHE A 37 -10.229 1.312 -4.242 1.00 0.00 C ATOM 553 O PHE A 37 -9.066 1.638 -4.143 1.00 0.00 O ATOM 554 CB PHE A 37 -11.438 1.959 -2.133 1.00 0.00 C ATOM 555 CG PHE A 37 -10.116 2.280 -1.473 1.00 0.00 C ATOM 556 CD1 PHE A 37 -9.660 3.602 -1.427 1.00 0.00 C ATOM 557 CD2 PHE A 37 -9.351 1.255 -0.897 1.00 0.00 C ATOM 558 CE1 PHE A 37 -8.440 3.901 -0.808 1.00 0.00 C ATOM 559 CE2 PHE A 37 -8.131 1.555 -0.279 1.00 0.00 C ATOM 560 CZ PHE A 37 -7.676 2.878 -0.234 1.00 0.00 C ATOM 0 H PHE A 37 -13.251 1.209 -3.666 1.00 0.00 H new ATOM 0 HA PHE A 37 -11.122 3.220 -3.839 1.00 0.00 H new ATOM 0 HB2 PHE A 37 -12.222 2.591 -1.716 1.00 0.00 H new ATOM 0 HB3 PHE A 37 -11.715 0.926 -1.922 1.00 0.00 H new ATOM 0 HD1 PHE A 37 -10.249 4.392 -1.869 1.00 0.00 H new ATOM 0 HD2 PHE A 37 -9.703 0.235 -0.930 1.00 0.00 H new ATOM 0 HE1 PHE A 37 -8.088 4.922 -0.773 1.00 0.00 H new ATOM 0 HE2 PHE A 37 -7.541 0.766 0.163 1.00 0.00 H new ATOM 0 HZ PHE A 37 -6.735 3.110 0.244 1.00 0.00 H new ATOM 570 N MET A 38 -10.569 0.267 -4.924 1.00 0.00 N ATOM 571 CA MET A 38 -9.531 -0.557 -5.603 1.00 0.00 C ATOM 572 C MET A 38 -9.266 0.096 -6.962 1.00 0.00 C ATOM 573 O MET A 38 -8.136 0.294 -7.351 1.00 0.00 O ATOM 574 CB MET A 38 -10.040 -2.001 -5.795 1.00 0.00 C ATOM 575 CG MET A 38 -9.229 -2.727 -6.882 1.00 0.00 C ATOM 576 SD MET A 38 -9.889 -2.312 -8.517 1.00 0.00 S ATOM 577 CE MET A 38 -8.803 -3.393 -9.481 1.00 0.00 C ATOM 0 H MET A 38 -11.528 -0.060 -5.045 1.00 0.00 H new ATOM 0 HA MET A 38 -8.619 -0.604 -5.009 1.00 0.00 H new ATOM 0 HB2 MET A 38 -9.965 -2.546 -4.854 1.00 0.00 H new ATOM 0 HB3 MET A 38 -11.094 -1.986 -6.071 1.00 0.00 H new ATOM 0 HG2 MET A 38 -8.180 -2.439 -6.819 1.00 0.00 H new ATOM 0 HG3 MET A 38 -9.274 -3.805 -6.724 1.00 0.00 H new ATOM 0 HE1 MET A 38 -9.098 -3.363 -10.530 1.00 0.00 H new ATOM 0 HE2 MET A 38 -7.772 -3.053 -9.384 1.00 0.00 H new ATOM 0 HE3 MET A 38 -8.884 -4.415 -9.110 1.00 0.00 H new ATOM 587 N GLN A 39 -10.300 0.439 -7.674 1.00 0.00 N ATOM 588 CA GLN A 39 -10.125 1.084 -9.005 1.00 0.00 C ATOM 589 C GLN A 39 -9.240 2.326 -8.875 1.00 0.00 C ATOM 590 O GLN A 39 -8.374 2.589 -9.689 1.00 0.00 O ATOM 591 CB GLN A 39 -11.503 1.515 -9.511 1.00 0.00 C ATOM 592 CG GLN A 39 -11.400 1.940 -10.975 1.00 0.00 C ATOM 593 CD GLN A 39 -11.159 0.710 -11.851 1.00 0.00 C ATOM 594 OE1 GLN A 39 -11.946 -0.215 -11.850 1.00 0.00 O ATOM 595 NE2 GLN A 39 -10.095 0.661 -12.606 1.00 0.00 N ATOM 0 H GLN A 39 -11.269 0.299 -7.389 1.00 0.00 H new ATOM 0 HA GLN A 39 -9.657 0.382 -9.694 1.00 0.00 H new ATOM 0 HB2 GLN A 39 -12.212 0.694 -9.409 1.00 0.00 H new ATOM 0 HB3 GLN A 39 -11.882 2.340 -8.908 1.00 0.00 H new ATOM 0 HG2 GLN A 39 -12.316 2.444 -11.283 1.00 0.00 H new ATOM 0 HG3 GLN A 39 -10.586 2.653 -11.101 1.00 0.00 H new ATOM 0 HE21 GLN A 39 -9.434 1.438 -12.607 1.00 0.00 H new ATOM 0 HE22 GLN A 39 -9.925 -0.154 -13.195 1.00 0.00 H new ATOM 604 N THR A 40 -9.470 3.093 -7.846 1.00 0.00 N ATOM 605 CA THR A 40 -8.691 4.328 -7.611 1.00 0.00 C ATOM 606 C THR A 40 -7.316 3.981 -7.042 1.00 0.00 C ATOM 607 O THR A 40 -6.335 4.611 -7.384 1.00 0.00 O ATOM 608 CB THR A 40 -9.477 5.182 -6.624 1.00 0.00 C ATOM 609 OG1 THR A 40 -10.102 4.328 -5.679 1.00 0.00 O ATOM 610 CG2 THR A 40 -10.552 6.001 -7.343 1.00 0.00 C ATOM 0 H THR A 40 -10.185 2.905 -7.143 1.00 0.00 H new ATOM 0 HA THR A 40 -8.536 4.871 -8.543 1.00 0.00 H new ATOM 0 HB THR A 40 -8.790 5.869 -6.130 1.00 0.00 H new ATOM 0 HG1 THR A 40 -11.030 4.166 -5.948 1.00 0.00 H new ATOM 0 HG21 THR A 40 -11.099 6.602 -6.616 1.00 0.00 H new ATOM 0 HG22 THR A 40 -10.081 6.657 -8.075 1.00 0.00 H new ATOM 0 HG23 THR A 40 -11.243 5.328 -7.851 1.00 0.00 H new ATOM 618 N ILE A 41 -7.201 2.993 -6.222 1.00 0.00 N ATOM 619 CA ILE A 41 -5.846 2.646 -5.710 1.00 0.00 C ATOM 620 C ILE A 41 -5.132 1.847 -6.794 1.00 0.00 C ATOM 621 O ILE A 41 -3.932 1.659 -6.763 1.00 0.00 O ATOM 622 CB ILE A 41 -5.974 1.831 -4.427 1.00 0.00 C ATOM 623 CG1 ILE A 41 -6.722 2.674 -3.367 1.00 0.00 C ATOM 624 CG2 ILE A 41 -4.579 1.434 -3.930 1.00 0.00 C ATOM 625 CD1 ILE A 41 -5.748 3.579 -2.593 1.00 0.00 C ATOM 0 H ILE A 41 -7.968 2.412 -5.882 1.00 0.00 H new ATOM 0 HA ILE A 41 -5.274 3.544 -5.477 1.00 0.00 H new ATOM 0 HB ILE A 41 -6.541 0.919 -4.614 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -7.482 3.285 -3.854 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -7.240 2.014 -2.672 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -4.671 0.852 -3.013 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -4.078 0.836 -4.691 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -3.994 2.332 -3.732 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -6.300 4.160 -1.855 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -5.003 2.964 -2.088 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -5.249 4.255 -3.288 1.00 0.00 H new ATOM 637 N ARG A 42 -5.871 1.398 -7.769 1.00 0.00 N ATOM 638 CA ARG A 42 -5.254 0.634 -8.883 1.00 0.00 C ATOM 639 C ARG A 42 -4.365 1.567 -9.697 1.00 0.00 C ATOM 640 O ARG A 42 -3.221 1.269 -9.972 1.00 0.00 O ATOM 641 CB ARG A 42 -6.345 0.095 -9.805 1.00 0.00 C ATOM 642 CG ARG A 42 -5.723 -0.816 -10.868 1.00 0.00 C ATOM 643 CD ARG A 42 -6.814 -1.304 -11.823 1.00 0.00 C ATOM 644 NE ARG A 42 -7.221 -0.188 -12.723 1.00 0.00 N ATOM 645 CZ ARG A 42 -7.908 -0.438 -13.804 1.00 0.00 C ATOM 646 NH1 ARG A 42 -8.239 -1.666 -14.097 1.00 0.00 N ATOM 647 NH2 ARG A 42 -8.264 0.539 -14.591 1.00 0.00 N ATOM 0 H ARG A 42 -6.880 1.529 -7.841 1.00 0.00 H new ATOM 0 HA ARG A 42 -4.672 -0.190 -8.470 1.00 0.00 H new ATOM 0 HB2 ARG A 42 -7.083 -0.459 -9.225 1.00 0.00 H new ATOM 0 HB3 ARG A 42 -6.871 0.921 -10.284 1.00 0.00 H new ATOM 0 HG2 ARG A 42 -4.955 -0.275 -11.422 1.00 0.00 H new ATOM 0 HG3 ARG A 42 -5.234 -1.666 -10.393 1.00 0.00 H new ATOM 0 HD2 ARG A 42 -6.448 -2.145 -12.412 1.00 0.00 H new ATOM 0 HD3 ARG A 42 -7.674 -1.662 -11.257 1.00 0.00 H new ATOM 0 HE ARG A 42 -6.962 0.772 -12.494 1.00 0.00 H new ATOM 0 HH11 ARG A 42 -7.961 -2.430 -13.481 1.00 0.00 H new ATOM 0 HH12 ARG A 42 -8.776 -1.862 -14.942 1.00 0.00 H new ATOM 0 HH21 ARG A 42 -8.005 1.499 -14.362 1.00 0.00 H new ATOM 0 HH22 ARG A 42 -8.801 0.343 -15.436 1.00 0.00 H new ATOM 661 N LEU A 43 -4.897 2.687 -10.116 1.00 0.00 N ATOM 662 CA LEU A 43 -4.096 3.631 -10.956 1.00 0.00 C ATOM 663 C LEU A 43 -3.321 4.624 -10.090 1.00 0.00 C ATOM 664 O LEU A 43 -2.461 5.323 -10.575 1.00 0.00 O ATOM 665 CB LEU A 43 -5.038 4.411 -11.879 1.00 0.00 C ATOM 666 CG LEU A 43 -5.849 3.439 -12.749 1.00 0.00 C ATOM 667 CD1 LEU A 43 -7.053 4.173 -13.345 1.00 0.00 C ATOM 668 CD2 LEU A 43 -4.980 2.891 -13.891 1.00 0.00 C ATOM 0 H LEU A 43 -5.850 2.989 -9.914 1.00 0.00 H new ATOM 0 HA LEU A 43 -3.384 3.046 -11.538 1.00 0.00 H new ATOM 0 HB2 LEU A 43 -5.712 5.029 -11.286 1.00 0.00 H new ATOM 0 HB3 LEU A 43 -4.462 5.085 -12.513 1.00 0.00 H new ATOM 0 HG LEU A 43 -6.186 2.610 -12.127 1.00 0.00 H new ATOM 0 HD11 LEU A 43 -7.630 3.484 -13.963 1.00 0.00 H new ATOM 0 HD12 LEU A 43 -7.683 4.553 -12.540 1.00 0.00 H new ATOM 0 HD13 LEU A 43 -6.705 5.005 -13.957 1.00 0.00 H new ATOM 0 HD21 LEU A 43 -5.569 2.204 -14.499 1.00 0.00 H new ATOM 0 HD22 LEU A 43 -4.632 3.717 -14.511 1.00 0.00 H new ATOM 0 HD23 LEU A 43 -4.122 2.363 -13.474 1.00 0.00 H new ATOM 680 N ALA A 44 -3.582 4.691 -8.816 1.00 0.00 N ATOM 681 CA ALA A 44 -2.807 5.654 -7.967 1.00 0.00 C ATOM 682 C ALA A 44 -1.522 4.982 -7.480 1.00 0.00 C ATOM 683 O ALA A 44 -0.447 5.543 -7.593 1.00 0.00 O ATOM 684 CB ALA A 44 -3.651 6.115 -6.781 1.00 0.00 C ATOM 0 H ALA A 44 -4.283 4.135 -8.327 1.00 0.00 H new ATOM 0 HA ALA A 44 -2.549 6.530 -8.562 1.00 0.00 H new ATOM 0 HB1 ALA A 44 -3.075 6.813 -6.174 1.00 0.00 H new ATOM 0 HB2 ALA A 44 -4.552 6.609 -7.146 1.00 0.00 H new ATOM 0 HB3 ALA A 44 -3.930 5.252 -6.176 1.00 0.00 H new ATOM 690 N VAL A 45 -1.600 3.793 -6.964 1.00 0.00 N ATOM 691 CA VAL A 45 -0.363 3.115 -6.504 1.00 0.00 C ATOM 692 C VAL A 45 0.383 2.571 -7.725 1.00 0.00 C ATOM 693 O VAL A 45 1.582 2.416 -7.711 1.00 0.00 O ATOM 694 CB VAL A 45 -0.735 1.972 -5.551 1.00 0.00 C ATOM 695 CG1 VAL A 45 0.481 1.075 -5.308 1.00 0.00 C ATOM 696 CG2 VAL A 45 -1.198 2.562 -4.218 1.00 0.00 C ATOM 0 H VAL A 45 -2.463 3.263 -6.841 1.00 0.00 H new ATOM 0 HA VAL A 45 0.280 3.817 -5.973 1.00 0.00 H new ATOM 0 HB VAL A 45 -1.534 1.379 -5.996 1.00 0.00 H new ATOM 0 HG11 VAL A 45 0.207 0.266 -4.630 1.00 0.00 H new ATOM 0 HG12 VAL A 45 0.819 0.655 -6.256 1.00 0.00 H new ATOM 0 HG13 VAL A 45 1.284 1.663 -4.865 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -1.464 1.755 -3.536 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -0.393 3.154 -3.783 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -2.067 3.198 -4.384 1.00 0.00 H new ATOM 706 N GLN A 46 -0.311 2.280 -8.790 1.00 0.00 N ATOM 707 CA GLN A 46 0.385 1.745 -9.995 1.00 0.00 C ATOM 708 C GLN A 46 0.999 2.887 -10.811 1.00 0.00 C ATOM 709 O GLN A 46 1.865 2.665 -11.634 1.00 0.00 O ATOM 710 CB GLN A 46 -0.614 0.991 -10.871 1.00 0.00 C ATOM 711 CG GLN A 46 0.133 0.304 -12.015 1.00 0.00 C ATOM 712 CD GLN A 46 -0.819 -0.636 -12.757 1.00 0.00 C ATOM 713 OE1 GLN A 46 -1.764 -1.139 -12.182 1.00 0.00 O ATOM 714 NE2 GLN A 46 -0.610 -0.895 -14.018 1.00 0.00 N ATOM 0 H GLN A 46 -1.321 2.388 -8.879 1.00 0.00 H new ATOM 0 HA GLN A 46 1.178 1.073 -9.667 1.00 0.00 H new ATOM 0 HB2 GLN A 46 -1.151 0.252 -10.276 1.00 0.00 H new ATOM 0 HB3 GLN A 46 -1.358 1.681 -11.270 1.00 0.00 H new ATOM 0 HG2 GLN A 46 0.533 1.050 -12.702 1.00 0.00 H new ATOM 0 HG3 GLN A 46 0.982 -0.256 -11.624 1.00 0.00 H new ATOM 0 HE21 GLN A 46 0.183 -0.473 -14.501 1.00 0.00 H new ATOM 0 HE22 GLN A 46 -1.240 -1.520 -14.522 1.00 0.00 H new ATOM 723 N GLN A 47 0.550 4.106 -10.624 1.00 0.00 N ATOM 724 CA GLN A 47 1.115 5.229 -11.437 1.00 0.00 C ATOM 725 C GLN A 47 2.364 5.821 -10.782 1.00 0.00 C ATOM 726 O GLN A 47 3.448 5.776 -11.328 1.00 0.00 O ATOM 727 CB GLN A 47 0.058 6.337 -11.583 1.00 0.00 C ATOM 728 CG GLN A 47 -0.948 5.957 -12.681 1.00 0.00 C ATOM 729 CD GLN A 47 -2.149 6.903 -12.628 1.00 0.00 C ATOM 730 OE1 GLN A 47 -2.408 7.519 -11.613 1.00 0.00 O ATOM 731 NE2 GLN A 47 -2.899 7.045 -13.687 1.00 0.00 N ATOM 0 H GLN A 47 -0.173 4.369 -9.954 1.00 0.00 H new ATOM 0 HA GLN A 47 1.391 4.831 -12.413 1.00 0.00 H new ATOM 0 HB2 GLN A 47 -0.462 6.483 -10.636 1.00 0.00 H new ATOM 0 HB3 GLN A 47 0.541 7.282 -11.831 1.00 0.00 H new ATOM 0 HG2 GLN A 47 -0.471 6.013 -13.660 1.00 0.00 H new ATOM 0 HG3 GLN A 47 -1.278 4.927 -12.545 1.00 0.00 H new ATOM 0 HE21 GLN A 47 -2.682 6.528 -14.539 1.00 0.00 H new ATOM 0 HE22 GLN A 47 -3.702 7.673 -13.662 1.00 0.00 H new ATOM 740 N PHE A 48 2.207 6.411 -9.625 1.00 0.00 N ATOM 741 CA PHE A 48 3.372 7.048 -8.943 1.00 0.00 C ATOM 742 C PHE A 48 4.078 6.044 -8.037 1.00 0.00 C ATOM 743 O PHE A 48 5.076 6.371 -7.426 1.00 0.00 O ATOM 744 CB PHE A 48 2.877 8.223 -8.097 1.00 0.00 C ATOM 745 CG PHE A 48 2.038 9.144 -8.949 1.00 0.00 C ATOM 746 CD1 PHE A 48 0.673 8.888 -9.124 1.00 0.00 C ATOM 747 CD2 PHE A 48 2.625 10.257 -9.565 1.00 0.00 C ATOM 748 CE1 PHE A 48 -0.105 9.743 -9.913 1.00 0.00 C ATOM 749 CE2 PHE A 48 1.847 11.112 -10.354 1.00 0.00 C ATOM 750 CZ PHE A 48 0.482 10.855 -10.528 1.00 0.00 C ATOM 0 H PHE A 48 1.322 6.479 -9.123 1.00 0.00 H new ATOM 0 HA PHE A 48 4.075 7.396 -9.700 1.00 0.00 H new ATOM 0 HB2 PHE A 48 2.291 7.856 -7.255 1.00 0.00 H new ATOM 0 HB3 PHE A 48 3.725 8.768 -7.682 1.00 0.00 H new ATOM 0 HD1 PHE A 48 0.220 8.030 -8.650 1.00 0.00 H new ATOM 0 HD2 PHE A 48 3.678 10.455 -9.431 1.00 0.00 H new ATOM 0 HE1 PHE A 48 -1.158 9.545 -10.047 1.00 0.00 H new ATOM 0 HE2 PHE A 48 2.300 11.970 -10.829 1.00 0.00 H new ATOM 0 HZ PHE A 48 -0.118 11.515 -11.137 1.00 0.00 H new ATOM 760 N ASP A 49 3.583 4.827 -7.958 1.00 0.00 N ATOM 761 CA ASP A 49 4.235 3.783 -7.087 1.00 0.00 C ATOM 762 C ASP A 49 4.933 4.420 -5.870 1.00 0.00 C ATOM 763 O ASP A 49 6.147 4.471 -5.828 1.00 0.00 O ATOM 764 CB ASP A 49 5.285 3.032 -7.904 1.00 0.00 C ATOM 765 CG ASP A 49 4.624 2.389 -9.125 1.00 0.00 C ATOM 766 OD1 ASP A 49 4.160 3.127 -9.979 1.00 0.00 O ATOM 767 OD2 ASP A 49 4.593 1.171 -9.185 1.00 0.00 O ATOM 0 H ASP A 49 2.754 4.509 -8.459 1.00 0.00 H new ATOM 0 HA ASP A 49 3.457 3.108 -6.732 1.00 0.00 H new ATOM 0 HB2 ASP A 49 6.071 3.717 -8.222 1.00 0.00 H new ATOM 0 HB3 ASP A 49 5.759 2.267 -7.290 1.00 0.00 H new ATOM 772 N PRO A 50 4.163 4.895 -4.919 1.00 0.00 N ATOM 773 CA PRO A 50 4.734 5.532 -3.716 1.00 0.00 C ATOM 774 C PRO A 50 5.716 4.570 -3.029 1.00 0.00 C ATOM 775 O PRO A 50 5.608 3.367 -3.157 1.00 0.00 O ATOM 776 CB PRO A 50 3.510 5.846 -2.824 1.00 0.00 C ATOM 777 CG PRO A 50 2.237 5.588 -3.681 1.00 0.00 C ATOM 778 CD PRO A 50 2.686 4.838 -4.954 1.00 0.00 C ATOM 0 HA PRO A 50 5.304 6.435 -3.937 1.00 0.00 H new ATOM 0 HB2 PRO A 50 3.510 5.215 -1.935 1.00 0.00 H new ATOM 0 HB3 PRO A 50 3.539 6.880 -2.481 1.00 0.00 H new ATOM 0 HG2 PRO A 50 1.511 4.997 -3.123 1.00 0.00 H new ATOM 0 HG3 PRO A 50 1.751 6.529 -3.940 1.00 0.00 H new ATOM 0 HD2 PRO A 50 2.329 3.808 -4.954 1.00 0.00 H new ATOM 0 HD3 PRO A 50 2.292 5.312 -5.853 1.00 0.00 H new ATOM 786 N THR A 51 6.669 5.089 -2.298 1.00 0.00 N ATOM 787 CA THR A 51 7.640 4.193 -1.608 1.00 0.00 C ATOM 788 C THR A 51 6.932 3.513 -0.439 1.00 0.00 C ATOM 789 O THR A 51 5.864 3.922 -0.035 1.00 0.00 O ATOM 790 CB THR A 51 8.827 5.009 -1.090 1.00 0.00 C ATOM 791 OG1 THR A 51 8.385 5.889 -0.066 1.00 0.00 O ATOM 792 CG2 THR A 51 9.432 5.818 -2.238 1.00 0.00 C ATOM 0 H THR A 51 6.815 6.088 -2.151 1.00 0.00 H new ATOM 0 HA THR A 51 8.010 3.443 -2.307 1.00 0.00 H new ATOM 0 HB THR A 51 9.583 4.335 -0.687 1.00 0.00 H new ATOM 0 HG1 THR A 51 8.266 6.788 -0.436 1.00 0.00 H new ATOM 0 HG21 THR A 51 10.277 6.399 -1.868 1.00 0.00 H new ATOM 0 HG22 THR A 51 9.772 5.140 -3.021 1.00 0.00 H new ATOM 0 HG23 THR A 51 8.678 6.493 -2.644 1.00 0.00 H new ATOM 800 N ALA A 52 7.507 2.483 0.112 1.00 0.00 N ATOM 801 CA ALA A 52 6.830 1.801 1.249 1.00 0.00 C ATOM 802 C ALA A 52 6.630 2.821 2.376 1.00 0.00 C ATOM 803 O ALA A 52 5.772 2.689 3.231 1.00 0.00 O ATOM 804 CB ALA A 52 7.698 0.639 1.738 1.00 0.00 C ATOM 0 H ALA A 52 8.404 2.087 -0.170 1.00 0.00 H new ATOM 0 HA ALA A 52 5.864 1.406 0.934 1.00 0.00 H new ATOM 0 HB1 ALA A 52 7.202 0.140 2.571 1.00 0.00 H new ATOM 0 HB2 ALA A 52 7.846 -0.072 0.925 1.00 0.00 H new ATOM 0 HB3 ALA A 52 8.665 1.020 2.067 1.00 0.00 H new ATOM 810 N LYS A 53 7.434 3.848 2.359 1.00 0.00 N ATOM 811 CA LYS A 53 7.350 4.915 3.396 1.00 0.00 C ATOM 812 C LYS A 53 6.044 5.700 3.221 1.00 0.00 C ATOM 813 O LYS A 53 5.304 5.911 4.161 1.00 0.00 O ATOM 814 CB LYS A 53 8.552 5.854 3.232 1.00 0.00 C ATOM 815 CG LYS A 53 9.871 5.061 3.316 1.00 0.00 C ATOM 816 CD LYS A 53 10.300 4.910 4.776 1.00 0.00 C ATOM 817 CE LYS A 53 11.470 3.928 4.868 1.00 0.00 C ATOM 818 NZ LYS A 53 12.597 4.419 4.025 1.00 0.00 N ATOM 0 H LYS A 53 8.159 3.995 1.657 1.00 0.00 H new ATOM 0 HA LYS A 53 7.363 4.472 4.392 1.00 0.00 H new ATOM 0 HB2 LYS A 53 8.491 6.369 2.273 1.00 0.00 H new ATOM 0 HB3 LYS A 53 8.531 6.620 4.007 1.00 0.00 H new ATOM 0 HG2 LYS A 53 9.743 4.078 2.863 1.00 0.00 H new ATOM 0 HG3 LYS A 53 10.649 5.574 2.751 1.00 0.00 H new ATOM 0 HD2 LYS A 53 10.592 5.879 5.182 1.00 0.00 H new ATOM 0 HD3 LYS A 53 9.464 4.552 5.376 1.00 0.00 H new ATOM 0 HE2 LYS A 53 11.794 3.827 5.904 1.00 0.00 H new ATOM 0 HE3 LYS A 53 11.156 2.939 4.534 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 13.474 3.932 4.300 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 12.392 4.225 3.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 12.713 5.443 4.162 1.00 0.00 H new ATOM 832 N ASP A 54 5.720 6.066 2.013 1.00 0.00 N ATOM 833 CA ASP A 54 4.431 6.771 1.748 1.00 0.00 C ATOM 834 C ASP A 54 3.289 5.796 2.014 1.00 0.00 C ATOM 835 O ASP A 54 2.159 6.203 2.201 1.00 0.00 O ATOM 836 CB ASP A 54 4.395 7.253 0.295 1.00 0.00 C ATOM 837 CG ASP A 54 2.994 7.766 -0.046 1.00 0.00 C ATOM 838 OD1 ASP A 54 2.733 8.930 0.208 1.00 0.00 O ATOM 839 OD2 ASP A 54 2.206 6.986 -0.556 1.00 0.00 O ATOM 0 H ASP A 54 6.298 5.906 1.188 1.00 0.00 H new ATOM 0 HA ASP A 54 4.332 7.640 2.399 1.00 0.00 H new ATOM 0 HB2 ASP A 54 5.129 8.045 0.147 1.00 0.00 H new ATOM 0 HB3 ASP A 54 4.667 6.438 -0.375 1.00 0.00 H new ATOM 844 N LEU A 55 3.565 4.529 2.114 1.00 0.00 N ATOM 845 CA LEU A 55 2.474 3.572 2.457 1.00 0.00 C ATOM 846 C LEU A 55 2.426 3.487 3.990 1.00 0.00 C ATOM 847 O LEU A 55 1.511 2.938 4.570 1.00 0.00 O ATOM 848 CB LEU A 55 2.774 2.188 1.850 1.00 0.00 C ATOM 849 CG LEU A 55 2.120 2.051 0.460 1.00 0.00 C ATOM 850 CD1 LEU A 55 0.580 2.039 0.578 1.00 0.00 C ATOM 851 CD2 LEU A 55 2.564 3.216 -0.437 1.00 0.00 C ATOM 0 H LEU A 55 4.487 4.115 1.976 1.00 0.00 H new ATOM 0 HA LEU A 55 1.517 3.906 2.057 1.00 0.00 H new ATOM 0 HB2 LEU A 55 3.852 2.048 1.766 1.00 0.00 H new ATOM 0 HB3 LEU A 55 2.401 1.406 2.512 1.00 0.00 H new ATOM 0 HG LEU A 55 2.439 1.107 0.018 1.00 0.00 H new ATOM 0 HD11 LEU A 55 0.140 1.942 -0.414 1.00 0.00 H new ATOM 0 HD12 LEU A 55 0.269 1.197 1.197 1.00 0.00 H new ATOM 0 HD13 LEU A 55 0.243 2.969 1.035 1.00 0.00 H new ATOM 0 HD21 LEU A 55 2.100 3.117 -1.418 1.00 0.00 H new ATOM 0 HD22 LEU A 55 2.259 4.160 0.015 1.00 0.00 H new ATOM 0 HD23 LEU A 55 3.649 3.199 -0.545 1.00 0.00 H new ATOM 863 N GLN A 56 3.416 4.046 4.642 1.00 0.00 N ATOM 864 CA GLN A 56 3.455 4.023 6.132 1.00 0.00 C ATOM 865 C GLN A 56 2.562 5.132 6.703 1.00 0.00 C ATOM 866 O GLN A 56 1.756 4.896 7.580 1.00 0.00 O ATOM 867 CB GLN A 56 4.894 4.243 6.603 1.00 0.00 C ATOM 868 CG GLN A 56 4.995 3.934 8.098 1.00 0.00 C ATOM 869 CD GLN A 56 4.881 2.424 8.317 1.00 0.00 C ATOM 870 OE1 GLN A 56 5.789 1.682 8.000 1.00 0.00 O ATOM 871 NE2 GLN A 56 3.795 1.935 8.850 1.00 0.00 N ATOM 0 H GLN A 56 4.203 4.520 4.200 1.00 0.00 H new ATOM 0 HA GLN A 56 3.091 3.057 6.482 1.00 0.00 H new ATOM 0 HB2 GLN A 56 5.574 3.602 6.042 1.00 0.00 H new ATOM 0 HB3 GLN A 56 5.197 5.273 6.412 1.00 0.00 H new ATOM 0 HG2 GLN A 56 5.944 4.299 8.492 1.00 0.00 H new ATOM 0 HG3 GLN A 56 4.204 4.452 8.641 1.00 0.00 H new ATOM 0 HE21 GLN A 56 3.032 2.558 9.116 1.00 0.00 H new ATOM 0 HE22 GLN A 56 3.709 0.930 9.000 1.00 0.00 H new ATOM 880 N ASP A 57 2.699 6.340 6.219 1.00 0.00 N ATOM 881 CA ASP A 57 1.856 7.460 6.746 1.00 0.00 C ATOM 882 C ASP A 57 0.528 7.520 5.988 1.00 0.00 C ATOM 883 O ASP A 57 -0.420 8.130 6.442 1.00 0.00 O ATOM 884 CB ASP A 57 2.602 8.786 6.595 1.00 0.00 C ATOM 885 CG ASP A 57 1.693 9.938 7.029 1.00 0.00 C ATOM 886 OD1 ASP A 57 1.299 9.952 8.184 1.00 0.00 O ATOM 887 OD2 ASP A 57 1.407 10.786 6.200 1.00 0.00 O ATOM 0 H ASP A 57 3.356 6.601 5.484 1.00 0.00 H new ATOM 0 HA ASP A 57 1.652 7.283 7.802 1.00 0.00 H new ATOM 0 HB2 ASP A 57 3.508 8.776 7.201 1.00 0.00 H new ATOM 0 HB3 ASP A 57 2.912 8.924 5.559 1.00 0.00 H new ATOM 892 N LEU A 58 0.425 6.864 4.866 1.00 0.00 N ATOM 893 CA LEU A 58 -0.874 6.864 4.128 1.00 0.00 C ATOM 894 C LEU A 58 -1.731 5.736 4.702 1.00 0.00 C ATOM 895 O LEU A 58 -2.945 5.797 4.681 1.00 0.00 O ATOM 896 CB LEU A 58 -0.634 6.648 2.628 1.00 0.00 C ATOM 897 CG LEU A 58 -1.949 6.828 1.844 1.00 0.00 C ATOM 898 CD1 LEU A 58 -2.220 8.316 1.588 1.00 0.00 C ATOM 899 CD2 LEU A 58 -1.846 6.104 0.497 1.00 0.00 C ATOM 0 H LEU A 58 1.177 6.331 4.429 1.00 0.00 H new ATOM 0 HA LEU A 58 -1.381 7.822 4.246 1.00 0.00 H new ATOM 0 HB2 LEU A 58 0.112 7.355 2.267 1.00 0.00 H new ATOM 0 HB3 LEU A 58 -0.235 5.648 2.457 1.00 0.00 H new ATOM 0 HG LEU A 58 -2.765 6.410 2.433 1.00 0.00 H new ATOM 0 HD11 LEU A 58 -3.152 8.426 1.033 1.00 0.00 H new ATOM 0 HD12 LEU A 58 -2.300 8.840 2.540 1.00 0.00 H new ATOM 0 HD13 LEU A 58 -1.401 8.741 1.008 1.00 0.00 H new ATOM 0 HD21 LEU A 58 -2.776 6.232 -0.057 1.00 0.00 H new ATOM 0 HD22 LEU A 58 -1.021 6.522 -0.079 1.00 0.00 H new ATOM 0 HD23 LEU A 58 -1.668 5.042 0.667 1.00 0.00 H new ATOM 911 N LEU A 59 -1.113 4.734 5.265 1.00 0.00 N ATOM 912 CA LEU A 59 -1.892 3.629 5.895 1.00 0.00 C ATOM 913 C LEU A 59 -2.115 3.981 7.369 1.00 0.00 C ATOM 914 O LEU A 59 -2.939 3.401 8.039 1.00 0.00 O ATOM 915 CB LEU A 59 -1.113 2.311 5.781 1.00 0.00 C ATOM 916 CG LEU A 59 -2.041 1.112 6.080 1.00 0.00 C ATOM 917 CD1 LEU A 59 -2.801 0.700 4.813 1.00 0.00 C ATOM 918 CD2 LEU A 59 -1.205 -0.078 6.564 1.00 0.00 C ATOM 0 H LEU A 59 -0.099 4.632 5.316 1.00 0.00 H new ATOM 0 HA LEU A 59 -2.850 3.507 5.390 1.00 0.00 H new ATOM 0 HB2 LEU A 59 -0.694 2.214 4.780 1.00 0.00 H new ATOM 0 HB3 LEU A 59 -0.275 2.314 6.479 1.00 0.00 H new ATOM 0 HG LEU A 59 -2.753 1.407 6.851 1.00 0.00 H new ATOM 0 HD11 LEU A 59 -3.451 -0.146 5.037 1.00 0.00 H new ATOM 0 HD12 LEU A 59 -3.403 1.538 4.462 1.00 0.00 H new ATOM 0 HD13 LEU A 59 -2.089 0.415 4.038 1.00 0.00 H new ATOM 0 HD21 LEU A 59 -1.862 -0.922 6.774 1.00 0.00 H new ATOM 0 HD22 LEU A 59 -0.489 -0.358 5.791 1.00 0.00 H new ATOM 0 HD23 LEU A 59 -0.669 0.199 7.471 1.00 0.00 H new ATOM 930 N GLN A 60 -1.376 4.924 7.885 1.00 0.00 N ATOM 931 CA GLN A 60 -1.543 5.310 9.320 1.00 0.00 C ATOM 932 C GLN A 60 -2.507 6.494 9.442 1.00 0.00 C ATOM 933 O GLN A 60 -3.108 6.711 10.476 1.00 0.00 O ATOM 934 CB GLN A 60 -0.184 5.736 9.871 1.00 0.00 C ATOM 935 CG GLN A 60 -0.264 5.842 11.395 1.00 0.00 C ATOM 936 CD GLN A 60 1.105 6.238 11.953 1.00 0.00 C ATOM 937 OE1 GLN A 60 1.388 6.016 13.114 1.00 0.00 O ATOM 938 NE2 GLN A 60 1.972 6.820 11.170 1.00 0.00 N ATOM 0 H GLN A 60 -0.662 5.446 7.377 1.00 0.00 H new ATOM 0 HA GLN A 60 -1.941 4.461 9.875 1.00 0.00 H new ATOM 0 HB2 GLN A 60 0.580 5.012 9.585 1.00 0.00 H new ATOM 0 HB3 GLN A 60 0.110 6.695 9.444 1.00 0.00 H new ATOM 0 HG2 GLN A 60 -1.012 6.582 11.680 1.00 0.00 H new ATOM 0 HG3 GLN A 60 -0.580 4.889 11.820 1.00 0.00 H new ATOM 0 HE21 GLN A 60 1.735 7.006 10.196 1.00 0.00 H new ATOM 0 HE22 GLN A 60 2.887 7.088 11.532 1.00 0.00 H new ATOM 947 N TYR A 61 -2.642 7.275 8.395 1.00 0.00 N ATOM 948 CA TYR A 61 -3.548 8.469 8.438 1.00 0.00 C ATOM 949 C TYR A 61 -4.803 8.213 7.603 1.00 0.00 C ATOM 950 O TYR A 61 -5.911 8.290 8.095 1.00 0.00 O ATOM 951 CB TYR A 61 -2.807 9.679 7.866 1.00 0.00 C ATOM 952 CG TYR A 61 -3.653 10.918 8.042 1.00 0.00 C ATOM 953 CD1 TYR A 61 -4.595 11.266 7.067 1.00 0.00 C ATOM 954 CD2 TYR A 61 -3.495 11.718 9.180 1.00 0.00 C ATOM 955 CE1 TYR A 61 -5.380 12.414 7.230 1.00 0.00 C ATOM 956 CE2 TYR A 61 -4.279 12.866 9.343 1.00 0.00 C ATOM 957 CZ TYR A 61 -5.222 13.214 8.368 1.00 0.00 C ATOM 958 OH TYR A 61 -5.995 14.346 8.529 1.00 0.00 O ATOM 0 H TYR A 61 -2.160 7.135 7.507 1.00 0.00 H new ATOM 0 HA TYR A 61 -3.840 8.657 9.471 1.00 0.00 H new ATOM 0 HB2 TYR A 61 -1.850 9.805 8.372 1.00 0.00 H new ATOM 0 HB3 TYR A 61 -2.591 9.520 6.809 1.00 0.00 H new ATOM 0 HD1 TYR A 61 -4.716 10.649 6.189 1.00 0.00 H new ATOM 0 HD2 TYR A 61 -2.768 11.449 9.932 1.00 0.00 H new ATOM 0 HE1 TYR A 61 -6.107 12.682 6.478 1.00 0.00 H new ATOM 0 HE2 TYR A 61 -4.157 13.483 10.221 1.00 0.00 H new ATOM 0 HH TYR A 61 -5.760 14.786 9.373 1.00 0.00 H new ATOM 968 N LEU A 62 -4.644 7.916 6.340 1.00 0.00 N ATOM 969 CA LEU A 62 -5.844 7.668 5.487 1.00 0.00 C ATOM 970 C LEU A 62 -6.629 6.490 6.068 1.00 0.00 C ATOM 971 O LEU A 62 -7.841 6.458 5.985 1.00 0.00 O ATOM 972 CB LEU A 62 -5.416 7.385 4.035 1.00 0.00 C ATOM 973 CG LEU A 62 -6.510 7.846 3.051 1.00 0.00 C ATOM 974 CD1 LEU A 62 -6.357 9.345 2.767 1.00 0.00 C ATOM 975 CD2 LEU A 62 -6.380 7.073 1.734 1.00 0.00 C ATOM 0 H LEU A 62 -3.745 7.835 5.866 1.00 0.00 H new ATOM 0 HA LEU A 62 -6.482 8.552 5.478 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -4.481 7.902 3.818 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -5.228 6.319 3.906 1.00 0.00 H new ATOM 0 HG LEU A 62 -7.487 7.656 3.495 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -7.133 9.665 2.071 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -6.452 9.903 3.698 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -5.377 9.534 2.329 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -7.155 7.402 1.041 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -5.399 7.261 1.297 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -6.493 6.006 1.926 1.00 0.00 H new ATOM 987 N CYS A 63 -5.967 5.552 6.694 1.00 0.00 N ATOM 988 CA CYS A 63 -6.700 4.409 7.326 1.00 0.00 C ATOM 989 C CYS A 63 -6.689 4.642 8.839 1.00 0.00 C ATOM 990 O CYS A 63 -6.932 5.740 9.298 1.00 0.00 O ATOM 991 CB CYS A 63 -6.005 3.089 6.984 1.00 0.00 C ATOM 992 SG CYS A 63 -5.497 3.112 5.248 1.00 0.00 S ATOM 0 H CYS A 63 -4.952 5.526 6.796 1.00 0.00 H new ATOM 0 HA CYS A 63 -7.724 4.352 6.957 1.00 0.00 H new ATOM 0 HB2 CYS A 63 -5.137 2.945 7.627 1.00 0.00 H new ATOM 0 HB3 CYS A 63 -6.679 2.252 7.166 1.00 0.00 H new ATOM 0 HG CYS A 63 -5.506 1.900 4.777 1.00 0.00 H new ATOM 998 N SER A 64 -6.404 3.640 9.623 1.00 0.00 N ATOM 999 CA SER A 64 -6.379 3.852 11.099 1.00 0.00 C ATOM 1000 C SER A 64 -5.761 2.642 11.805 1.00 0.00 C ATOM 1001 O SER A 64 -5.417 1.652 11.191 1.00 0.00 O ATOM 1002 CB SER A 64 -7.802 4.051 11.610 1.00 0.00 C ATOM 1003 OG SER A 64 -8.292 5.311 11.171 1.00 0.00 O ATOM 0 H SER A 64 -6.189 2.693 9.311 1.00 0.00 H new ATOM 0 HA SER A 64 -5.777 4.735 11.312 1.00 0.00 H new ATOM 0 HB2 SER A 64 -8.446 3.251 11.245 1.00 0.00 H new ATOM 0 HB3 SER A 64 -7.819 4.002 12.699 1.00 0.00 H new ATOM 0 HG SER A 64 -7.575 5.800 10.716 1.00 0.00 H new ATOM 1009 N SER A 65 -5.609 2.736 13.100 1.00 0.00 N ATOM 1010 CA SER A 65 -5.003 1.622 13.887 1.00 0.00 C ATOM 1011 C SER A 65 -5.525 0.264 13.407 1.00 0.00 C ATOM 1012 O SER A 65 -4.828 -0.469 12.732 1.00 0.00 O ATOM 1013 CB SER A 65 -5.353 1.802 15.365 1.00 0.00 C ATOM 1014 OG SER A 65 -4.835 3.044 15.822 1.00 0.00 O ATOM 0 H SER A 65 -5.883 3.548 13.653 1.00 0.00 H new ATOM 0 HA SER A 65 -3.922 1.647 13.748 1.00 0.00 H new ATOM 0 HB2 SER A 65 -6.434 1.774 15.501 1.00 0.00 H new ATOM 0 HB3 SER A 65 -4.937 0.983 15.952 1.00 0.00 H new ATOM 0 HG SER A 65 -5.059 3.163 16.769 1.00 0.00 H new ATOM 1020 N LEU A 66 -6.733 -0.096 13.758 1.00 0.00 N ATOM 1021 CA LEU A 66 -7.270 -1.419 13.330 1.00 0.00 C ATOM 1022 C LEU A 66 -7.050 -1.615 11.829 1.00 0.00 C ATOM 1023 O LEU A 66 -6.275 -2.450 11.424 1.00 0.00 O ATOM 1024 CB LEU A 66 -8.774 -1.485 13.644 1.00 0.00 C ATOM 1025 CG LEU A 66 -9.004 -1.809 15.132 1.00 0.00 C ATOM 1026 CD1 LEU A 66 -8.559 -3.250 15.457 1.00 0.00 C ATOM 1027 CD2 LEU A 66 -8.225 -0.815 16.003 1.00 0.00 C ATOM 0 H LEU A 66 -7.368 0.469 14.321 1.00 0.00 H new ATOM 0 HA LEU A 66 -6.748 -2.209 13.870 1.00 0.00 H new ATOM 0 HB2 LEU A 66 -9.245 -0.533 13.397 1.00 0.00 H new ATOM 0 HB3 LEU A 66 -9.247 -2.246 13.023 1.00 0.00 H new ATOM 0 HG LEU A 66 -10.070 -1.724 15.344 1.00 0.00 H new ATOM 0 HD11 LEU A 66 -8.732 -3.455 16.514 1.00 0.00 H new ATOM 0 HD12 LEU A 66 -9.133 -3.953 14.853 1.00 0.00 H new ATOM 0 HD13 LEU A 66 -7.498 -3.362 15.234 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -8.390 -1.047 17.055 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -7.161 -0.889 15.777 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -8.570 0.198 15.796 1.00 0.00 H new ATOM 1039 N VAL A 67 -7.776 -0.894 11.010 1.00 0.00 N ATOM 1040 CA VAL A 67 -7.663 -1.060 9.521 1.00 0.00 C ATOM 1041 C VAL A 67 -6.226 -1.444 9.118 1.00 0.00 C ATOM 1042 O VAL A 67 -6.002 -2.408 8.414 1.00 0.00 O ATOM 1043 CB VAL A 67 -8.048 0.249 8.844 1.00 0.00 C ATOM 1044 CG1 VAL A 67 -8.277 0.010 7.354 1.00 0.00 C ATOM 1045 CG2 VAL A 67 -9.329 0.795 9.478 1.00 0.00 C ATOM 0 H VAL A 67 -8.450 -0.189 11.310 1.00 0.00 H new ATOM 0 HA VAL A 67 -8.333 -1.859 9.205 1.00 0.00 H new ATOM 0 HB VAL A 67 -7.242 0.972 8.973 1.00 0.00 H new ATOM 0 HG11 VAL A 67 -8.552 0.949 6.873 1.00 0.00 H new ATOM 0 HG12 VAL A 67 -7.363 -0.375 6.902 1.00 0.00 H new ATOM 0 HG13 VAL A 67 -9.080 -0.715 7.221 1.00 0.00 H new ATOM 0 HG21 VAL A 67 -9.604 1.732 8.993 1.00 0.00 H new ATOM 0 HG22 VAL A 67 -10.134 0.071 9.352 1.00 0.00 H new ATOM 0 HG23 VAL A 67 -9.162 0.972 10.541 1.00 0.00 H new ATOM 1055 N ALA A 68 -5.250 -0.701 9.589 1.00 0.00 N ATOM 1056 CA ALA A 68 -3.824 -1.025 9.269 1.00 0.00 C ATOM 1057 C ALA A 68 -3.592 -2.515 9.524 1.00 0.00 C ATOM 1058 O ALA A 68 -2.961 -3.208 8.745 1.00 0.00 O ATOM 1059 CB ALA A 68 -2.904 -0.207 10.178 1.00 0.00 C ATOM 0 H ALA A 68 -5.382 0.118 10.183 1.00 0.00 H new ATOM 0 HA ALA A 68 -3.610 -0.786 8.227 1.00 0.00 H new ATOM 0 HB1 ALA A 68 -1.864 -0.440 9.948 1.00 0.00 H new ATOM 0 HB2 ALA A 68 -3.082 0.856 10.015 1.00 0.00 H new ATOM 0 HB3 ALA A 68 -3.109 -0.453 11.220 1.00 0.00 H new ATOM 1065 N SER A 69 -4.163 -3.015 10.583 1.00 0.00 N ATOM 1066 CA SER A 69 -4.068 -4.461 10.903 1.00 0.00 C ATOM 1067 C SER A 69 -4.597 -5.265 9.716 1.00 0.00 C ATOM 1068 O SER A 69 -3.868 -5.910 8.990 1.00 0.00 O ATOM 1069 CB SER A 69 -4.971 -4.733 12.121 1.00 0.00 C ATOM 1070 OG SER A 69 -4.649 -6.010 12.660 1.00 0.00 O ATOM 0 H SER A 69 -4.703 -2.468 11.253 1.00 0.00 H new ATOM 0 HA SER A 69 -3.036 -4.742 11.112 1.00 0.00 H new ATOM 0 HB2 SER A 69 -4.829 -3.959 12.875 1.00 0.00 H new ATOM 0 HB3 SER A 69 -6.020 -4.702 11.826 1.00 0.00 H new ATOM 0 HG SER A 69 -5.219 -6.190 13.437 1.00 0.00 H new ATOM 1076 N LEU A 70 -5.894 -5.226 9.554 1.00 0.00 N ATOM 1077 CA LEU A 70 -6.613 -5.958 8.479 1.00 0.00 C ATOM 1078 C LEU A 70 -5.846 -6.063 7.154 1.00 0.00 C ATOM 1079 O LEU A 70 -5.443 -7.135 6.738 1.00 0.00 O ATOM 1080 CB LEU A 70 -7.931 -5.205 8.205 1.00 0.00 C ATOM 1081 CG LEU A 70 -8.597 -4.795 9.527 1.00 0.00 C ATOM 1082 CD1 LEU A 70 -10.011 -4.285 9.242 1.00 0.00 C ATOM 1083 CD2 LEU A 70 -8.675 -6.001 10.472 1.00 0.00 C ATOM 0 H LEU A 70 -6.512 -4.685 10.159 1.00 0.00 H new ATOM 0 HA LEU A 70 -6.757 -6.978 8.834 1.00 0.00 H new ATOM 0 HB2 LEU A 70 -7.733 -4.320 7.600 1.00 0.00 H new ATOM 0 HB3 LEU A 70 -8.607 -5.839 7.631 1.00 0.00 H new ATOM 0 HG LEU A 70 -8.006 -4.009 9.997 1.00 0.00 H new ATOM 0 HD11 LEU A 70 -10.488 -3.993 10.178 1.00 0.00 H new ATOM 0 HD12 LEU A 70 -9.960 -3.423 8.576 1.00 0.00 H new ATOM 0 HD13 LEU A 70 -10.594 -5.075 8.769 1.00 0.00 H new ATOM 0 HD21 LEU A 70 -9.149 -5.701 11.407 1.00 0.00 H new ATOM 0 HD22 LEU A 70 -9.262 -6.792 10.005 1.00 0.00 H new ATOM 0 HD23 LEU A 70 -7.669 -6.369 10.677 1.00 0.00 H new ATOM 1095 N HIS A 71 -5.775 -4.986 6.410 1.00 0.00 N ATOM 1096 CA HIS A 71 -5.190 -5.099 5.047 1.00 0.00 C ATOM 1097 C HIS A 71 -3.774 -5.679 5.074 1.00 0.00 C ATOM 1098 O HIS A 71 -3.452 -6.619 4.347 1.00 0.00 O ATOM 1099 CB HIS A 71 -5.179 -3.740 4.343 1.00 0.00 C ATOM 1100 CG HIS A 71 -6.432 -2.976 4.668 1.00 0.00 C ATOM 1101 ND1 HIS A 71 -7.488 -3.543 5.363 1.00 0.00 N ATOM 1102 CD2 HIS A 71 -6.808 -1.683 4.403 1.00 0.00 C ATOM 1103 CE1 HIS A 71 -8.440 -2.600 5.491 1.00 0.00 C ATOM 1104 NE2 HIS A 71 -8.077 -1.448 4.923 1.00 0.00 N ATOM 0 H HIS A 71 -6.090 -4.055 6.683 1.00 0.00 H new ATOM 0 HA HIS A 71 -5.825 -5.788 4.489 1.00 0.00 H new ATOM 0 HB2 HIS A 71 -4.305 -3.168 4.654 1.00 0.00 H new ATOM 0 HB3 HIS A 71 -5.100 -3.881 3.265 1.00 0.00 H new ATOM 0 HD2 HIS A 71 -6.210 -0.958 3.871 1.00 0.00 H new ATOM 0 HE1 HIS A 71 -9.384 -2.757 5.993 1.00 0.00 H new ATOM 0 HE2 HIS A 71 -8.614 -0.582 4.880 1.00 0.00 H new ATOM 1112 N HIS A 72 -2.886 -5.107 5.862 1.00 0.00 N ATOM 1113 CA HIS A 72 -1.502 -5.640 5.836 1.00 0.00 C ATOM 1114 C HIS A 72 -1.530 -7.053 6.408 1.00 0.00 C ATOM 1115 O HIS A 72 -0.599 -7.818 6.254 1.00 0.00 O ATOM 1116 CB HIS A 72 -0.532 -4.736 6.598 1.00 0.00 C ATOM 1117 CG HIS A 72 0.838 -5.355 6.593 1.00 0.00 C ATOM 1118 ND1 HIS A 72 1.862 -4.877 5.791 1.00 0.00 N ATOM 1119 CD2 HIS A 72 1.368 -6.416 7.285 1.00 0.00 C ATOM 1120 CE1 HIS A 72 2.946 -5.641 6.018 1.00 0.00 C ATOM 1121 NE2 HIS A 72 2.700 -6.594 6.921 1.00 0.00 N ATOM 0 H HIS A 72 -3.059 -4.326 6.494 1.00 0.00 H new ATOM 0 HA HIS A 72 -1.137 -5.667 4.809 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -0.499 -3.749 6.136 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -0.876 -4.597 7.623 1.00 0.00 H new ATOM 0 HD2 HIS A 72 0.833 -7.020 8.002 1.00 0.00 H new ATOM 0 HE1 HIS A 72 3.899 -5.501 5.530 1.00 0.00 H new ATOM 0 HE2 HIS A 72 3.348 -7.300 7.269 1.00 0.00 H new ATOM 1129 N GLN A 73 -2.629 -7.425 7.015 1.00 0.00 N ATOM 1130 CA GLN A 73 -2.748 -8.812 7.532 1.00 0.00 C ATOM 1131 C GLN A 73 -2.537 -9.719 6.325 1.00 0.00 C ATOM 1132 O GLN A 73 -1.618 -10.508 6.277 1.00 0.00 O ATOM 1133 CB GLN A 73 -4.146 -9.041 8.139 1.00 0.00 C ATOM 1134 CG GLN A 73 -4.093 -10.181 9.159 1.00 0.00 C ATOM 1135 CD GLN A 73 -3.312 -9.728 10.395 1.00 0.00 C ATOM 1136 OE1 GLN A 73 -3.703 -8.793 11.065 1.00 0.00 O ATOM 1137 NE2 GLN A 73 -2.217 -10.356 10.726 1.00 0.00 N ATOM 0 H GLN A 73 -3.442 -6.829 7.172 1.00 0.00 H new ATOM 0 HA GLN A 73 -2.021 -9.013 8.319 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -4.497 -8.128 8.620 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -4.859 -9.280 7.350 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -5.103 -10.476 9.443 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -3.618 -11.056 8.717 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -1.889 -11.141 10.163 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -1.689 -10.062 11.548 1.00 0.00 H new ATOM 1146 N GLN A 74 -3.393 -9.603 5.337 1.00 0.00 N ATOM 1147 CA GLN A 74 -3.239 -10.448 4.114 1.00 0.00 C ATOM 1148 C GLN A 74 -1.757 -10.442 3.720 1.00 0.00 C ATOM 1149 O GLN A 74 -1.053 -11.412 3.919 1.00 0.00 O ATOM 1150 CB GLN A 74 -4.075 -9.851 2.983 1.00 0.00 C ATOM 1151 CG GLN A 74 -5.561 -10.065 3.279 1.00 0.00 C ATOM 1152 CD GLN A 74 -6.402 -9.378 2.201 1.00 0.00 C ATOM 1153 OE1 GLN A 74 -6.830 -10.009 1.255 1.00 0.00 O ATOM 1154 NE2 GLN A 74 -6.658 -8.103 2.305 1.00 0.00 N ATOM 0 H GLN A 74 -4.187 -8.963 5.326 1.00 0.00 H new ATOM 0 HA GLN A 74 -3.575 -11.467 4.304 1.00 0.00 H new ATOM 0 HB2 GLN A 74 -3.863 -8.787 2.883 1.00 0.00 H new ATOM 0 HB3 GLN A 74 -3.811 -10.320 2.035 1.00 0.00 H new ATOM 0 HG2 GLN A 74 -5.787 -11.131 3.307 1.00 0.00 H new ATOM 0 HG3 GLN A 74 -5.809 -9.661 4.261 1.00 0.00 H new ATOM 0 HE21 GLN A 74 -6.298 -7.574 3.099 1.00 0.00 H new ATOM 0 HE22 GLN A 74 -7.218 -7.635 1.592 1.00 0.00 H new ATOM 1163 N LEU A 75 -1.270 -9.308 3.223 1.00 0.00 N ATOM 1164 CA LEU A 75 0.193 -9.165 2.875 1.00 0.00 C ATOM 1165 C LEU A 75 1.042 -9.935 3.885 1.00 0.00 C ATOM 1166 O LEU A 75 1.824 -10.779 3.499 1.00 0.00 O ATOM 1167 CB LEU A 75 0.568 -7.670 2.932 1.00 0.00 C ATOM 1168 CG LEU A 75 0.347 -7.003 1.550 1.00 0.00 C ATOM 1169 CD1 LEU A 75 0.065 -5.508 1.730 1.00 0.00 C ATOM 1170 CD2 LEU A 75 1.603 -7.170 0.684 1.00 0.00 C ATOM 0 H LEU A 75 -1.831 -8.475 3.045 1.00 0.00 H new ATOM 0 HA LEU A 75 0.375 -9.563 1.877 1.00 0.00 H new ATOM 0 HB2 LEU A 75 -0.036 -7.166 3.687 1.00 0.00 H new ATOM 0 HB3 LEU A 75 1.610 -7.561 3.233 1.00 0.00 H new ATOM 0 HG LEU A 75 -0.503 -7.481 1.063 1.00 0.00 H new ATOM 0 HD11 LEU A 75 -0.089 -5.047 0.754 1.00 0.00 H new ATOM 0 HD12 LEU A 75 -0.830 -5.377 2.339 1.00 0.00 H new ATOM 0 HD13 LEU A 75 0.913 -5.035 2.225 1.00 0.00 H new ATOM 0 HD21 LEU A 75 1.442 -6.699 -0.286 1.00 0.00 H new ATOM 0 HD22 LEU A 75 2.452 -6.699 1.179 1.00 0.00 H new ATOM 0 HD23 LEU A 75 1.809 -8.231 0.543 1.00 0.00 H new ATOM 1182 N ASP A 76 0.885 -9.660 5.163 1.00 0.00 N ATOM 1183 CA ASP A 76 1.664 -10.391 6.222 1.00 0.00 C ATOM 1184 C ASP A 76 2.022 -11.798 5.727 1.00 0.00 C ATOM 1185 O ASP A 76 3.157 -12.110 5.400 1.00 0.00 O ATOM 1186 CB ASP A 76 0.759 -10.514 7.477 1.00 0.00 C ATOM 1187 CG ASP A 76 1.624 -10.628 8.740 1.00 0.00 C ATOM 1188 OD1 ASP A 76 2.476 -11.501 8.774 1.00 0.00 O ATOM 1189 OD2 ASP A 76 1.418 -9.841 9.649 1.00 0.00 O ATOM 0 H ASP A 76 0.243 -8.953 5.521 1.00 0.00 H new ATOM 0 HA ASP A 76 2.582 -9.851 6.453 1.00 0.00 H new ATOM 0 HB2 ASP A 76 0.106 -9.644 7.551 1.00 0.00 H new ATOM 0 HB3 ASP A 76 0.116 -11.389 7.387 1.00 0.00 H new ATOM 1194 N SER A 77 1.031 -12.642 5.659 1.00 0.00 N ATOM 1195 CA SER A 77 1.244 -14.025 5.191 1.00 0.00 C ATOM 1196 C SER A 77 1.282 -14.071 3.667 1.00 0.00 C ATOM 1197 O SER A 77 1.939 -14.919 3.096 1.00 0.00 O ATOM 1198 CB SER A 77 0.084 -14.885 5.664 1.00 0.00 C ATOM 1199 OG SER A 77 0.141 -15.021 7.078 1.00 0.00 O ATOM 0 H SER A 77 0.069 -12.421 5.914 1.00 0.00 H new ATOM 0 HA SER A 77 2.191 -14.391 5.589 1.00 0.00 H new ATOM 0 HB2 SER A 77 -0.863 -14.432 5.369 1.00 0.00 H new ATOM 0 HB3 SER A 77 0.128 -15.866 5.191 1.00 0.00 H new ATOM 0 HG SER A 77 -0.608 -15.574 7.384 1.00 0.00 H new ATOM 1205 N LEU A 78 0.572 -13.195 2.981 1.00 0.00 N ATOM 1206 CA LEU A 78 0.597 -13.266 1.495 1.00 0.00 C ATOM 1207 C LEU A 78 2.051 -13.317 1.067 1.00 0.00 C ATOM 1208 O LEU A 78 2.482 -14.240 0.413 1.00 0.00 O ATOM 1209 CB LEU A 78 -0.119 -12.045 0.869 1.00 0.00 C ATOM 1210 CG LEU A 78 -1.038 -12.504 -0.264 1.00 0.00 C ATOM 1211 CD1 LEU A 78 -1.992 -11.369 -0.649 1.00 0.00 C ATOM 1212 CD2 LEU A 78 -0.193 -12.891 -1.479 1.00 0.00 C ATOM 0 H LEU A 78 -0.006 -12.456 3.382 1.00 0.00 H new ATOM 0 HA LEU A 78 0.067 -14.154 1.150 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -0.699 -11.523 1.630 1.00 0.00 H new ATOM 0 HB3 LEU A 78 0.617 -11.337 0.488 1.00 0.00 H new ATOM 0 HG LEU A 78 -1.618 -13.365 0.069 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -2.645 -11.701 -1.457 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -2.596 -11.092 0.215 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -1.415 -10.505 -0.980 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -0.847 -13.218 -2.287 1.00 0.00 H new ATOM 0 HD22 LEU A 78 0.387 -12.029 -1.808 1.00 0.00 H new ATOM 0 HD23 LEU A 78 0.483 -13.702 -1.208 1.00 0.00 H new ATOM 1224 N ILE A 79 2.832 -12.357 1.488 1.00 0.00 N ATOM 1225 CA ILE A 79 4.273 -12.379 1.171 1.00 0.00 C ATOM 1226 C ILE A 79 4.794 -13.765 1.553 1.00 0.00 C ATOM 1227 O ILE A 79 5.355 -14.472 0.740 1.00 0.00 O ATOM 1228 CB ILE A 79 4.946 -11.275 2.023 1.00 0.00 C ATOM 1229 CG1 ILE A 79 4.889 -9.919 1.288 1.00 0.00 C ATOM 1230 CG2 ILE A 79 6.401 -11.621 2.353 1.00 0.00 C ATOM 1231 CD1 ILE A 79 5.628 -9.970 -0.063 1.00 0.00 C ATOM 0 H ILE A 79 2.523 -11.557 2.041 1.00 0.00 H new ATOM 0 HA ILE A 79 4.482 -12.194 0.117 1.00 0.00 H new ATOM 0 HB ILE A 79 4.393 -11.205 2.960 1.00 0.00 H new ATOM 0 HG12 ILE A 79 3.849 -9.638 1.123 1.00 0.00 H new ATOM 0 HG13 ILE A 79 5.332 -9.146 1.916 1.00 0.00 H new ATOM 0 HG21 ILE A 79 6.838 -10.822 2.952 1.00 0.00 H new ATOM 0 HG22 ILE A 79 6.435 -12.555 2.914 1.00 0.00 H new ATOM 0 HG23 ILE A 79 6.967 -11.733 1.428 1.00 0.00 H new ATOM 0 HD11 ILE A 79 5.565 -8.996 -0.549 1.00 0.00 H new ATOM 0 HD12 ILE A 79 6.674 -10.225 0.104 1.00 0.00 H new ATOM 0 HD13 ILE A 79 5.168 -10.725 -0.701 1.00 0.00 H new ATOM 1243 N SER A 80 4.613 -14.158 2.790 1.00 0.00 N ATOM 1244 CA SER A 80 5.104 -15.498 3.207 1.00 0.00 C ATOM 1245 C SER A 80 4.675 -16.548 2.176 1.00 0.00 C ATOM 1246 O SER A 80 5.477 -17.336 1.704 1.00 0.00 O ATOM 1247 CB SER A 80 4.518 -15.861 4.570 1.00 0.00 C ATOM 1248 OG SER A 80 4.676 -14.761 5.458 1.00 0.00 O ATOM 0 H SER A 80 4.151 -13.613 3.518 1.00 0.00 H new ATOM 0 HA SER A 80 6.192 -15.475 3.273 1.00 0.00 H new ATOM 0 HB2 SER A 80 3.462 -16.113 4.469 1.00 0.00 H new ATOM 0 HB3 SER A 80 5.019 -16.742 4.971 1.00 0.00 H new ATOM 0 HG SER A 80 4.299 -14.990 6.333 1.00 0.00 H new ATOM 1254 N GLU A 81 3.415 -16.591 1.832 1.00 0.00 N ATOM 1255 CA GLU A 81 2.966 -17.618 0.862 1.00 0.00 C ATOM 1256 C GLU A 81 3.357 -17.239 -0.568 1.00 0.00 C ATOM 1257 O GLU A 81 3.464 -18.096 -1.424 1.00 0.00 O ATOM 1258 CB GLU A 81 1.444 -17.751 0.943 1.00 0.00 C ATOM 1259 CG GLU A 81 1.036 -18.092 2.377 1.00 0.00 C ATOM 1260 CD GLU A 81 -0.490 -18.134 2.477 1.00 0.00 C ATOM 1261 OE1 GLU A 81 -1.059 -19.157 2.132 1.00 0.00 O ATOM 1262 OE2 GLU A 81 -1.065 -17.143 2.897 1.00 0.00 O ATOM 0 H GLU A 81 2.688 -15.965 2.179 1.00 0.00 H new ATOM 0 HA GLU A 81 3.449 -18.562 1.113 1.00 0.00 H new ATOM 0 HB2 GLU A 81 0.970 -16.820 0.631 1.00 0.00 H new ATOM 0 HB3 GLU A 81 1.100 -18.529 0.261 1.00 0.00 H new ATOM 0 HG2 GLU A 81 1.457 -19.055 2.667 1.00 0.00 H new ATOM 0 HG3 GLU A 81 1.436 -17.349 3.067 1.00 0.00 H new ATOM 1269 N ALA A 82 3.507 -15.970 -0.877 1.00 0.00 N ATOM 1270 CA ALA A 82 3.807 -15.619 -2.298 1.00 0.00 C ATOM 1271 C ALA A 82 5.261 -15.946 -2.627 1.00 0.00 C ATOM 1272 O ALA A 82 5.587 -16.387 -3.706 1.00 0.00 O ATOM 1273 CB ALA A 82 3.556 -14.130 -2.534 1.00 0.00 C ATOM 0 H ALA A 82 3.437 -15.187 -0.227 1.00 0.00 H new ATOM 0 HA ALA A 82 3.153 -16.204 -2.945 1.00 0.00 H new ATOM 0 HB1 ALA A 82 3.777 -13.884 -3.572 1.00 0.00 H new ATOM 0 HB2 ALA A 82 2.512 -13.899 -2.321 1.00 0.00 H new ATOM 0 HB3 ALA A 82 4.199 -13.544 -1.877 1.00 0.00 H new ATOM 1279 N GLU A 83 6.150 -15.697 -1.696 1.00 0.00 N ATOM 1280 CA GLU A 83 7.586 -15.967 -1.968 1.00 0.00 C ATOM 1281 C GLU A 83 7.782 -17.472 -2.074 1.00 0.00 C ATOM 1282 O GLU A 83 8.607 -17.950 -2.827 1.00 0.00 O ATOM 1283 CB GLU A 83 8.469 -15.383 -0.863 1.00 0.00 C ATOM 1284 CG GLU A 83 8.161 -16.078 0.463 1.00 0.00 C ATOM 1285 CD GLU A 83 8.888 -15.356 1.599 1.00 0.00 C ATOM 1286 OE1 GLU A 83 8.548 -14.214 1.862 1.00 0.00 O ATOM 1287 OE2 GLU A 83 9.771 -15.957 2.188 1.00 0.00 O ATOM 0 H GLU A 83 5.941 -15.322 -0.771 1.00 0.00 H new ATOM 0 HA GLU A 83 7.878 -15.490 -2.904 1.00 0.00 H new ATOM 0 HB2 GLU A 83 9.521 -15.514 -1.117 1.00 0.00 H new ATOM 0 HB3 GLU A 83 8.294 -14.311 -0.772 1.00 0.00 H new ATOM 0 HG2 GLU A 83 7.086 -16.076 0.646 1.00 0.00 H new ATOM 0 HG3 GLU A 83 8.475 -17.121 0.421 1.00 0.00 H new ATOM 1294 N THR A 84 7.008 -18.231 -1.348 1.00 0.00 N ATOM 1295 CA THR A 84 7.137 -19.705 -1.445 1.00 0.00 C ATOM 1296 C THR A 84 6.886 -20.107 -2.909 1.00 0.00 C ATOM 1297 O THR A 84 7.631 -20.871 -3.491 1.00 0.00 O ATOM 1298 CB THR A 84 6.091 -20.357 -0.505 1.00 0.00 C ATOM 1299 OG1 THR A 84 5.439 -19.334 0.231 1.00 0.00 O ATOM 1300 CG2 THR A 84 6.768 -21.321 0.479 1.00 0.00 C ATOM 0 H THR A 84 6.298 -17.894 -0.698 1.00 0.00 H new ATOM 0 HA THR A 84 8.130 -20.040 -1.145 1.00 0.00 H new ATOM 0 HB THR A 84 5.376 -20.917 -1.108 1.00 0.00 H new ATOM 0 HG1 THR A 84 6.090 -18.878 0.805 1.00 0.00 H new ATOM 0 HG21 THR A 84 6.014 -21.767 1.128 1.00 0.00 H new ATOM 0 HG22 THR A 84 7.280 -22.107 -0.076 1.00 0.00 H new ATOM 0 HG23 THR A 84 7.491 -20.775 1.084 1.00 0.00 H new ATOM 1308 N ARG A 85 5.822 -19.605 -3.494 1.00 0.00 N ATOM 1309 CA ARG A 85 5.483 -19.952 -4.910 1.00 0.00 C ATOM 1310 C ARG A 85 6.743 -20.000 -5.776 1.00 0.00 C ATOM 1311 O ARG A 85 6.836 -20.803 -6.684 1.00 0.00 O ATOM 1312 CB ARG A 85 4.509 -18.905 -5.479 1.00 0.00 C ATOM 1313 CG ARG A 85 4.374 -19.060 -7.014 1.00 0.00 C ATOM 1314 CD ARG A 85 5.534 -18.350 -7.770 1.00 0.00 C ATOM 1315 NE ARG A 85 4.983 -17.510 -8.884 1.00 0.00 N ATOM 1316 CZ ARG A 85 4.092 -17.985 -9.717 1.00 0.00 C ATOM 1317 NH1 ARG A 85 3.720 -19.234 -9.644 1.00 0.00 N ATOM 1318 NH2 ARG A 85 3.591 -17.213 -10.641 1.00 0.00 N ATOM 0 H ARG A 85 5.169 -18.963 -3.045 1.00 0.00 H new ATOM 0 HA ARG A 85 5.016 -20.937 -4.921 1.00 0.00 H new ATOM 0 HB2 ARG A 85 3.532 -19.017 -5.010 1.00 0.00 H new ATOM 0 HB3 ARG A 85 4.864 -17.903 -5.240 1.00 0.00 H new ATOM 0 HG2 ARG A 85 4.365 -20.119 -7.273 1.00 0.00 H new ATOM 0 HG3 ARG A 85 3.420 -18.644 -7.339 1.00 0.00 H new ATOM 0 HD2 ARG A 85 6.101 -17.726 -7.079 1.00 0.00 H new ATOM 0 HD3 ARG A 85 6.225 -19.091 -8.170 1.00 0.00 H new ATOM 0 HE ARG A 85 5.309 -16.550 -8.995 1.00 0.00 H new ATOM 0 HH11 ARG A 85 4.124 -19.846 -8.935 1.00 0.00 H new ATOM 0 HH12 ARG A 85 3.025 -19.598 -10.296 1.00 0.00 H new ATOM 0 HH21 ARG A 85 3.894 -16.242 -10.713 1.00 0.00 H new ATOM 0 HH22 ARG A 85 2.897 -17.581 -11.291 1.00 0.00 H new ATOM 1332 N GLY A 86 7.718 -19.160 -5.512 1.00 0.00 N ATOM 1333 CA GLY A 86 8.976 -19.175 -6.333 1.00 0.00 C ATOM 1334 C GLY A 86 9.071 -17.901 -7.187 1.00 0.00 C ATOM 1335 O GLY A 86 9.169 -17.963 -8.396 1.00 0.00 O ATOM 0 H GLY A 86 7.698 -18.466 -4.765 1.00 0.00 H new ATOM 0 HA2 GLY A 86 9.845 -19.248 -5.678 1.00 0.00 H new ATOM 0 HA3 GLY A 86 8.988 -20.054 -6.977 1.00 0.00 H new ATOM 1339 N ILE A 87 9.059 -16.747 -6.569 1.00 0.00 N ATOM 1340 CA ILE A 87 9.168 -15.474 -7.348 1.00 0.00 C ATOM 1341 C ILE A 87 10.520 -15.471 -8.099 1.00 0.00 C ATOM 1342 O ILE A 87 11.042 -16.511 -8.446 1.00 0.00 O ATOM 1343 CB ILE A 87 9.066 -14.283 -6.359 1.00 0.00 C ATOM 1344 CG1 ILE A 87 7.747 -14.398 -5.584 1.00 0.00 C ATOM 1345 CG2 ILE A 87 9.098 -12.914 -7.092 1.00 0.00 C ATOM 1346 CD1 ILE A 87 7.751 -13.398 -4.425 1.00 0.00 C ATOM 0 H ILE A 87 8.978 -16.630 -5.559 1.00 0.00 H new ATOM 0 HA ILE A 87 8.366 -15.386 -8.081 1.00 0.00 H new ATOM 0 HB ILE A 87 9.924 -14.326 -5.688 1.00 0.00 H new ATOM 0 HG12 ILE A 87 6.904 -14.200 -6.247 1.00 0.00 H new ATOM 0 HG13 ILE A 87 7.623 -15.412 -5.204 1.00 0.00 H new ATOM 0 HG21 ILE A 87 9.024 -12.108 -6.362 1.00 0.00 H new ATOM 0 HG22 ILE A 87 10.033 -12.819 -7.644 1.00 0.00 H new ATOM 0 HG23 ILE A 87 8.259 -12.853 -7.786 1.00 0.00 H new ATOM 0 HD11 ILE A 87 6.815 -13.478 -3.873 1.00 0.00 H new ATOM 0 HD12 ILE A 87 8.585 -13.617 -3.759 1.00 0.00 H new ATOM 0 HD13 ILE A 87 7.856 -12.387 -4.818 1.00 0.00 H new ATOM 1358 N THR A 88 11.074 -14.316 -8.355 1.00 0.00 N ATOM 1359 CA THR A 88 12.376 -14.238 -9.078 1.00 0.00 C ATOM 1360 C THR A 88 13.459 -14.865 -8.202 1.00 0.00 C ATOM 1361 O THR A 88 14.409 -14.216 -7.810 1.00 0.00 O ATOM 1362 CB THR A 88 12.725 -12.774 -9.358 1.00 0.00 C ATOM 1363 OG1 THR A 88 11.595 -12.118 -9.914 1.00 0.00 O ATOM 1364 CG2 THR A 88 13.894 -12.706 -10.342 1.00 0.00 C ATOM 0 H THR A 88 10.676 -13.415 -8.091 1.00 0.00 H new ATOM 0 HA THR A 88 12.307 -14.772 -10.026 1.00 0.00 H new ATOM 0 HB THR A 88 13.008 -12.283 -8.427 1.00 0.00 H new ATOM 0 HG1 THR A 88 11.816 -11.180 -10.092 1.00 0.00 H new ATOM 0 HG21 THR A 88 14.142 -11.663 -10.541 1.00 0.00 H new ATOM 0 HG22 THR A 88 14.760 -13.210 -9.913 1.00 0.00 H new ATOM 0 HG23 THR A 88 13.614 -13.197 -11.274 1.00 0.00 H new ATOM 1372 N SER A 89 13.314 -16.126 -7.883 1.00 0.00 N ATOM 1373 CA SER A 89 14.318 -16.814 -7.017 1.00 0.00 C ATOM 1374 C SER A 89 14.663 -15.909 -5.831 1.00 0.00 C ATOM 1375 O SER A 89 15.652 -16.107 -5.161 1.00 0.00 O ATOM 1376 CB SER A 89 15.579 -17.125 -7.823 1.00 0.00 C ATOM 1377 OG SER A 89 15.215 -17.781 -9.030 1.00 0.00 O ATOM 0 H SER A 89 12.537 -16.712 -8.188 1.00 0.00 H new ATOM 0 HA SER A 89 13.900 -17.751 -6.650 1.00 0.00 H new ATOM 0 HB2 SER A 89 16.119 -16.205 -8.045 1.00 0.00 H new ATOM 0 HB3 SER A 89 16.250 -17.756 -7.241 1.00 0.00 H new ATOM 0 HG SER A 89 16.021 -17.980 -9.550 1.00 0.00 H new ATOM 1383 N TYR A 90 13.822 -14.933 -5.580 1.00 0.00 N ATOM 1384 CA TYR A 90 14.009 -13.968 -4.447 1.00 0.00 C ATOM 1385 C TYR A 90 15.452 -13.437 -4.360 1.00 0.00 C ATOM 1386 O TYR A 90 16.411 -14.178 -4.332 1.00 0.00 O ATOM 1387 CB TYR A 90 13.604 -14.623 -3.121 1.00 0.00 C ATOM 1388 CG TYR A 90 14.168 -16.021 -3.027 1.00 0.00 C ATOM 1389 CD1 TYR A 90 13.429 -17.106 -3.515 1.00 0.00 C ATOM 1390 CD2 TYR A 90 15.427 -16.233 -2.453 1.00 0.00 C ATOM 1391 CE1 TYR A 90 13.949 -18.403 -3.430 1.00 0.00 C ATOM 1392 CE2 TYR A 90 15.947 -17.531 -2.367 1.00 0.00 C ATOM 1393 CZ TYR A 90 15.208 -18.615 -2.856 1.00 0.00 C ATOM 1394 OH TYR A 90 15.721 -19.894 -2.771 1.00 0.00 O ATOM 0 H TYR A 90 12.983 -14.760 -6.134 1.00 0.00 H new ATOM 0 HA TYR A 90 13.363 -13.112 -4.643 1.00 0.00 H new ATOM 0 HB2 TYR A 90 13.965 -14.022 -2.287 1.00 0.00 H new ATOM 0 HB3 TYR A 90 12.517 -14.657 -3.042 1.00 0.00 H new ATOM 0 HD1 TYR A 90 12.457 -16.942 -3.957 1.00 0.00 H new ATOM 0 HD2 TYR A 90 15.997 -15.396 -2.077 1.00 0.00 H new ATOM 0 HE1 TYR A 90 13.379 -19.239 -3.807 1.00 0.00 H new ATOM 0 HE2 TYR A 90 16.918 -17.695 -1.924 1.00 0.00 H new ATOM 0 HH TYR A 90 16.604 -19.865 -2.347 1.00 0.00 H new ATOM 1404 N ASN A 91 15.604 -12.135 -4.311 1.00 0.00 N ATOM 1405 CA ASN A 91 16.967 -11.527 -4.229 1.00 0.00 C ATOM 1406 C ASN A 91 17.000 -10.363 -3.192 1.00 0.00 C ATOM 1407 O ASN A 91 17.752 -10.453 -2.241 1.00 0.00 O ATOM 1408 CB ASN A 91 17.392 -11.044 -5.649 1.00 0.00 C ATOM 1409 CG ASN A 91 18.452 -11.986 -6.247 1.00 0.00 C ATOM 1410 OD1 ASN A 91 18.121 -12.999 -6.829 1.00 0.00 O ATOM 1411 ND2 ASN A 91 19.717 -11.690 -6.121 1.00 0.00 N ATOM 0 H ASN A 91 14.836 -11.464 -4.324 1.00 0.00 H new ATOM 0 HA ASN A 91 17.679 -12.276 -3.882 1.00 0.00 H new ATOM 0 HB2 ASN A 91 16.520 -11.007 -6.302 1.00 0.00 H new ATOM 0 HB3 ASN A 91 17.790 -10.031 -5.591 1.00 0.00 H new ATOM 0 HD21 ASN A 91 20.427 -12.310 -6.511 1.00 0.00 H new ATOM 0 HD22 ASN A 91 19.995 -10.839 -5.632 1.00 0.00 H new ATOM 1418 N PRO A 92 16.219 -9.288 -3.375 1.00 0.00 N ATOM 1419 CA PRO A 92 16.236 -8.148 -2.420 1.00 0.00 C ATOM 1420 C PRO A 92 15.292 -8.366 -1.237 1.00 0.00 C ATOM 1421 O PRO A 92 15.474 -7.766 -0.196 1.00 0.00 O ATOM 1422 CB PRO A 92 15.715 -6.972 -3.251 1.00 0.00 C ATOM 1423 CG PRO A 92 14.845 -7.592 -4.370 1.00 0.00 C ATOM 1424 CD PRO A 92 15.277 -9.071 -4.510 1.00 0.00 C ATOM 0 HA PRO A 92 17.231 -8.003 -1.998 1.00 0.00 H new ATOM 0 HB2 PRO A 92 15.130 -6.288 -2.636 1.00 0.00 H new ATOM 0 HB3 PRO A 92 16.539 -6.396 -3.672 1.00 0.00 H new ATOM 0 HG2 PRO A 92 13.786 -7.521 -4.120 1.00 0.00 H new ATOM 0 HG3 PRO A 92 14.987 -7.058 -5.310 1.00 0.00 H new ATOM 0 HD2 PRO A 92 14.421 -9.743 -4.450 1.00 0.00 H new ATOM 0 HD3 PRO A 92 15.761 -9.255 -5.469 1.00 0.00 H new ATOM 1432 N LEU A 93 14.283 -9.181 -1.363 1.00 0.00 N ATOM 1433 CA LEU A 93 13.370 -9.354 -0.197 1.00 0.00 C ATOM 1434 C LEU A 93 14.222 -9.678 1.011 1.00 0.00 C ATOM 1435 O LEU A 93 14.154 -8.996 1.995 1.00 0.00 O ATOM 1436 CB LEU A 93 12.354 -10.467 -0.451 1.00 0.00 C ATOM 1437 CG LEU A 93 11.881 -10.413 -1.921 1.00 0.00 C ATOM 1438 CD1 LEU A 93 12.720 -11.377 -2.772 1.00 0.00 C ATOM 1439 CD2 LEU A 93 10.396 -10.815 -1.998 1.00 0.00 C ATOM 0 H LEU A 93 14.053 -9.722 -2.197 1.00 0.00 H new ATOM 0 HA LEU A 93 12.804 -8.438 -0.031 1.00 0.00 H new ATOM 0 HB2 LEU A 93 12.802 -11.438 -0.238 1.00 0.00 H new ATOM 0 HB3 LEU A 93 11.502 -10.355 0.220 1.00 0.00 H new ATOM 0 HG LEU A 93 12.003 -9.399 -2.302 1.00 0.00 H new ATOM 0 HD11 LEU A 93 12.383 -11.336 -3.808 1.00 0.00 H new ATOM 0 HD12 LEU A 93 13.770 -11.088 -2.720 1.00 0.00 H new ATOM 0 HD13 LEU A 93 12.604 -12.392 -2.393 1.00 0.00 H new ATOM 0 HD21 LEU A 93 10.062 -10.777 -3.035 1.00 0.00 H new ATOM 0 HD22 LEU A 93 10.273 -11.828 -1.614 1.00 0.00 H new ATOM 0 HD23 LEU A 93 9.801 -10.125 -1.400 1.00 0.00 H new ATOM 1451 N ALA A 94 15.005 -10.728 0.890 1.00 0.00 N ATOM 1452 CA ALA A 94 15.934 -11.206 1.978 1.00 0.00 C ATOM 1453 C ALA A 94 15.956 -10.208 3.145 1.00 0.00 C ATOM 1454 O ALA A 94 15.652 -10.538 4.274 1.00 0.00 O ATOM 1455 CB ALA A 94 17.332 -11.338 1.374 1.00 0.00 C ATOM 0 H ALA A 94 15.041 -11.299 0.045 1.00 0.00 H new ATOM 0 HA ALA A 94 15.593 -12.166 2.367 1.00 0.00 H new ATOM 0 HB1 ALA A 94 18.028 -11.683 2.139 1.00 0.00 H new ATOM 0 HB2 ALA A 94 17.308 -12.057 0.555 1.00 0.00 H new ATOM 0 HB3 ALA A 94 17.658 -10.369 0.997 1.00 0.00 H new ATOM 1461 N GLY A 95 16.266 -8.977 2.848 1.00 0.00 N ATOM 1462 CA GLY A 95 16.258 -7.915 3.901 1.00 0.00 C ATOM 1463 C GLY A 95 14.801 -7.710 4.363 1.00 0.00 C ATOM 1464 O GLY A 95 13.976 -8.574 4.158 1.00 0.00 O ATOM 0 H GLY A 95 16.527 -8.656 1.916 1.00 0.00 H new ATOM 0 HA2 GLY A 95 16.886 -8.208 4.742 1.00 0.00 H new ATOM 0 HA3 GLY A 95 16.667 -6.985 3.507 1.00 0.00 H new ATOM 1468 N PRO A 96 14.499 -6.590 4.978 1.00 0.00 N ATOM 1469 CA PRO A 96 13.113 -6.337 5.422 1.00 0.00 C ATOM 1470 C PRO A 96 12.241 -6.077 4.172 1.00 0.00 C ATOM 1471 O PRO A 96 12.769 -5.939 3.087 1.00 0.00 O ATOM 1472 CB PRO A 96 13.219 -5.095 6.333 1.00 0.00 C ATOM 1473 CG PRO A 96 14.691 -4.578 6.240 1.00 0.00 C ATOM 1474 CD PRO A 96 15.474 -5.545 5.316 1.00 0.00 C ATOM 0 HA PRO A 96 12.654 -7.167 5.960 1.00 0.00 H new ATOM 0 HB2 PRO A 96 12.519 -4.323 6.014 1.00 0.00 H new ATOM 0 HB3 PRO A 96 12.965 -5.350 7.362 1.00 0.00 H new ATOM 0 HG2 PRO A 96 14.715 -3.564 5.841 1.00 0.00 H new ATOM 0 HG3 PRO A 96 15.147 -4.542 7.230 1.00 0.00 H new ATOM 0 HD2 PRO A 96 15.837 -5.036 4.423 1.00 0.00 H new ATOM 0 HD3 PRO A 96 16.345 -5.962 5.822 1.00 0.00 H new ATOM 1482 N LEU A 97 10.931 -6.005 4.276 1.00 0.00 N ATOM 1483 CA LEU A 97 10.122 -5.752 3.038 1.00 0.00 C ATOM 1484 C LEU A 97 10.300 -4.289 2.597 1.00 0.00 C ATOM 1485 O LEU A 97 10.731 -4.031 1.493 1.00 0.00 O ATOM 1486 CB LEU A 97 8.635 -6.056 3.295 1.00 0.00 C ATOM 1487 CG LEU A 97 8.487 -7.310 4.203 1.00 0.00 C ATOM 1488 CD1 LEU A 97 8.261 -6.888 5.664 1.00 0.00 C ATOM 1489 CD2 LEU A 97 7.290 -8.156 3.738 1.00 0.00 C ATOM 0 H LEU A 97 10.399 -6.107 5.141 1.00 0.00 H new ATOM 0 HA LEU A 97 10.472 -6.411 2.243 1.00 0.00 H new ATOM 0 HB2 LEU A 97 8.158 -5.198 3.769 1.00 0.00 H new ATOM 0 HB3 LEU A 97 8.122 -6.223 2.348 1.00 0.00 H new ATOM 0 HG LEU A 97 9.404 -7.896 4.132 1.00 0.00 H new ATOM 0 HD11 LEU A 97 8.159 -7.776 6.288 1.00 0.00 H new ATOM 0 HD12 LEU A 97 9.111 -6.298 6.008 1.00 0.00 H new ATOM 0 HD13 LEU A 97 7.352 -6.290 5.734 1.00 0.00 H new ATOM 0 HD21 LEU A 97 7.193 -9.032 4.379 1.00 0.00 H new ATOM 0 HD22 LEU A 97 6.379 -7.561 3.797 1.00 0.00 H new ATOM 0 HD23 LEU A 97 7.449 -8.475 2.708 1.00 0.00 H new ATOM 1501 N ARG A 98 9.936 -3.333 3.428 1.00 0.00 N ATOM 1502 CA ARG A 98 10.074 -1.877 3.047 1.00 0.00 C ATOM 1503 C ARG A 98 11.374 -1.666 2.251 1.00 0.00 C ATOM 1504 O ARG A 98 11.521 -0.742 1.482 1.00 0.00 O ATOM 1505 CB ARG A 98 10.149 -1.039 4.333 1.00 0.00 C ATOM 1506 CG ARG A 98 8.749 -0.883 4.937 1.00 0.00 C ATOM 1507 CD ARG A 98 8.865 -0.396 6.384 1.00 0.00 C ATOM 1508 NE ARG A 98 9.589 -1.413 7.197 1.00 0.00 N ATOM 1509 CZ ARG A 98 10.067 -1.091 8.368 1.00 0.00 C ATOM 1510 NH1 ARG A 98 9.913 0.122 8.824 1.00 0.00 N ATOM 1511 NH2 ARG A 98 10.699 -1.982 9.082 1.00 0.00 N ATOM 0 H ARG A 98 9.548 -3.496 4.357 1.00 0.00 H new ATOM 0 HA ARG A 98 9.220 -1.578 2.439 1.00 0.00 H new ATOM 0 HB2 ARG A 98 10.813 -1.519 5.052 1.00 0.00 H new ATOM 0 HB3 ARG A 98 10.571 -0.058 4.114 1.00 0.00 H new ATOM 0 HG2 ARG A 98 8.166 -0.174 4.350 1.00 0.00 H new ATOM 0 HG3 ARG A 98 8.220 -1.835 4.905 1.00 0.00 H new ATOM 0 HD2 ARG A 98 9.396 0.555 6.417 1.00 0.00 H new ATOM 0 HD3 ARG A 98 7.873 -0.222 6.800 1.00 0.00 H new ATOM 0 HE ARG A 98 9.711 -2.360 6.839 1.00 0.00 H new ATOM 0 HH11 ARG A 98 9.419 0.818 8.265 1.00 0.00 H new ATOM 0 HH12 ARG A 98 10.286 0.374 9.739 1.00 0.00 H new ATOM 0 HH21 ARG A 98 10.819 -2.930 8.725 1.00 0.00 H new ATOM 0 HH22 ARG A 98 11.073 -1.731 9.997 1.00 0.00 H new ATOM 1525 N VAL A 99 12.291 -2.566 2.444 1.00 0.00 N ATOM 1526 CA VAL A 99 13.598 -2.521 1.731 1.00 0.00 C ATOM 1527 C VAL A 99 13.435 -3.197 0.363 1.00 0.00 C ATOM 1528 O VAL A 99 13.949 -2.732 -0.635 1.00 0.00 O ATOM 1529 CB VAL A 99 14.656 -3.254 2.590 1.00 0.00 C ATOM 1530 CG1 VAL A 99 15.761 -3.858 1.707 1.00 0.00 C ATOM 1531 CG2 VAL A 99 15.296 -2.257 3.569 1.00 0.00 C ATOM 0 H VAL A 99 12.188 -3.354 3.084 1.00 0.00 H new ATOM 0 HA VAL A 99 13.925 -1.493 1.576 1.00 0.00 H new ATOM 0 HB VAL A 99 14.159 -4.058 3.132 1.00 0.00 H new ATOM 0 HG11 VAL A 99 16.491 -4.367 2.336 1.00 0.00 H new ATOM 0 HG12 VAL A 99 15.321 -4.572 1.011 1.00 0.00 H new ATOM 0 HG13 VAL A 99 16.255 -3.063 1.148 1.00 0.00 H new ATOM 0 HG21 VAL A 99 16.042 -2.771 4.176 1.00 0.00 H new ATOM 0 HG22 VAL A 99 15.774 -1.453 3.009 1.00 0.00 H new ATOM 0 HG23 VAL A 99 14.526 -1.839 4.218 1.00 0.00 H new ATOM 1541 N GLN A 100 12.741 -4.295 0.314 1.00 0.00 N ATOM 1542 CA GLN A 100 12.563 -5.006 -0.979 1.00 0.00 C ATOM 1543 C GLN A 100 12.138 -4.025 -2.081 1.00 0.00 C ATOM 1544 O GLN A 100 12.721 -4.000 -3.147 1.00 0.00 O ATOM 1545 CB GLN A 100 11.528 -6.146 -0.813 1.00 0.00 C ATOM 1546 CG GLN A 100 10.092 -5.674 -1.102 1.00 0.00 C ATOM 1547 CD GLN A 100 9.111 -6.785 -0.725 1.00 0.00 C ATOM 1548 OE1 GLN A 100 9.496 -7.928 -0.577 1.00 0.00 O ATOM 1549 NE2 GLN A 100 7.848 -6.496 -0.563 1.00 0.00 N ATOM 0 H GLN A 100 12.288 -4.733 1.116 1.00 0.00 H new ATOM 0 HA GLN A 100 13.515 -5.445 -1.278 1.00 0.00 H new ATOM 0 HB2 GLN A 100 11.782 -6.965 -1.486 1.00 0.00 H new ATOM 0 HB3 GLN A 100 11.582 -6.539 0.202 1.00 0.00 H new ATOM 0 HG2 GLN A 100 9.872 -4.770 -0.533 1.00 0.00 H new ATOM 0 HG3 GLN A 100 9.985 -5.421 -2.157 1.00 0.00 H new ATOM 0 HE21 GLN A 100 7.524 -5.537 -0.687 1.00 0.00 H new ATOM 0 HE22 GLN A 100 7.185 -7.230 -0.312 1.00 0.00 H new ATOM 1558 N ALA A 101 11.109 -3.243 -1.859 1.00 0.00 N ATOM 1559 CA ALA A 101 10.642 -2.306 -2.935 1.00 0.00 C ATOM 1560 C ALA A 101 11.355 -0.952 -2.839 1.00 0.00 C ATOM 1561 O ALA A 101 11.625 -0.327 -3.845 1.00 0.00 O ATOM 1562 CB ALA A 101 9.131 -2.109 -2.819 1.00 0.00 C ATOM 0 H ALA A 101 10.576 -3.211 -0.990 1.00 0.00 H new ATOM 0 HA ALA A 101 10.883 -2.745 -3.903 1.00 0.00 H new ATOM 0 HB1 ALA A 101 8.792 -1.429 -3.600 1.00 0.00 H new ATOM 0 HB2 ALA A 101 8.629 -3.070 -2.932 1.00 0.00 H new ATOM 0 HB3 ALA A 101 8.893 -1.688 -1.842 1.00 0.00 H new ATOM 1568 N ASN A 102 11.670 -0.484 -1.666 1.00 0.00 N ATOM 1569 CA ASN A 102 12.371 0.831 -1.574 1.00 0.00 C ATOM 1570 C ASN A 102 13.788 0.675 -2.130 1.00 0.00 C ATOM 1571 O ASN A 102 14.737 1.208 -1.590 1.00 0.00 O ATOM 1572 CB ASN A 102 12.447 1.288 -0.116 1.00 0.00 C ATOM 1573 CG ASN A 102 13.014 2.708 -0.059 1.00 0.00 C ATOM 1574 OD1 ASN A 102 12.306 3.667 -0.293 1.00 0.00 O ATOM 1575 ND2 ASN A 102 14.272 2.883 0.242 1.00 0.00 N ATOM 0 H ASN A 102 11.477 -0.945 -0.777 1.00 0.00 H new ATOM 0 HA ASN A 102 11.820 1.575 -2.149 1.00 0.00 H new ATOM 0 HB2 ASN A 102 11.456 1.261 0.337 1.00 0.00 H new ATOM 0 HB3 ASN A 102 13.078 0.609 0.457 1.00 0.00 H new ATOM 0 HD21 ASN A 102 14.661 3.825 0.281 1.00 0.00 H new ATOM 0 HD22 ASN A 102 14.866 2.078 0.438 1.00 0.00 H new ATOM 1582 N ASN A 103 13.934 -0.060 -3.208 1.00 0.00 N ATOM 1583 CA ASN A 103 15.281 -0.274 -3.823 1.00 0.00 C ATOM 1584 C ASN A 103 15.276 0.282 -5.263 1.00 0.00 C ATOM 1585 O ASN A 103 14.786 -0.384 -6.154 1.00 0.00 O ATOM 1586 CB ASN A 103 15.556 -1.779 -3.884 1.00 0.00 C ATOM 1587 CG ASN A 103 16.967 -2.017 -4.426 1.00 0.00 C ATOM 1588 OD1 ASN A 103 17.575 -1.124 -4.981 1.00 0.00 O ATOM 1589 ND2 ASN A 103 17.516 -3.192 -4.287 1.00 0.00 N ATOM 0 H ASN A 103 13.167 -0.526 -3.692 1.00 0.00 H new ATOM 0 HA ASN A 103 16.044 0.232 -3.231 1.00 0.00 H new ATOM 0 HB2 ASN A 103 15.457 -2.218 -2.891 1.00 0.00 H new ATOM 0 HB3 ASN A 103 14.822 -2.268 -4.524 1.00 0.00 H new ATOM 0 HD21 ASN A 103 18.456 -3.361 -4.644 1.00 0.00 H new ATOM 0 HD22 ASN A 103 17.005 -3.942 -3.821 1.00 0.00 H new ATOM 1596 N PRO A 104 15.804 1.477 -5.479 1.00 0.00 N ATOM 1597 CA PRO A 104 15.822 2.065 -6.834 1.00 0.00 C ATOM 1598 C PRO A 104 16.537 1.122 -7.812 1.00 0.00 C ATOM 1599 O PRO A 104 16.281 1.140 -8.999 1.00 0.00 O ATOM 1600 CB PRO A 104 16.573 3.408 -6.676 1.00 0.00 C ATOM 1601 CG PRO A 104 16.782 3.642 -5.153 1.00 0.00 C ATOM 1602 CD PRO A 104 16.416 2.327 -4.432 1.00 0.00 C ATOM 0 HA PRO A 104 14.823 2.218 -7.241 1.00 0.00 H new ATOM 0 HB2 PRO A 104 17.531 3.377 -7.195 1.00 0.00 H new ATOM 0 HB3 PRO A 104 15.999 4.224 -7.115 1.00 0.00 H new ATOM 0 HG2 PRO A 104 17.815 3.919 -4.945 1.00 0.00 H new ATOM 0 HG3 PRO A 104 16.155 4.461 -4.800 1.00 0.00 H new ATOM 0 HD2 PRO A 104 17.299 1.852 -4.004 1.00 0.00 H new ATOM 0 HD3 PRO A 104 15.721 2.506 -3.612 1.00 0.00 H new ATOM 1610 N GLN A 105 17.426 0.298 -7.328 1.00 0.00 N ATOM 1611 CA GLN A 105 18.140 -0.637 -8.242 1.00 0.00 C ATOM 1612 C GLN A 105 17.225 -1.818 -8.581 1.00 0.00 C ATOM 1613 O GLN A 105 16.882 -2.039 -9.725 1.00 0.00 O ATOM 1614 CB GLN A 105 19.412 -1.149 -7.562 1.00 0.00 C ATOM 1615 CG GLN A 105 20.246 0.039 -7.079 1.00 0.00 C ATOM 1616 CD GLN A 105 20.677 0.882 -8.281 1.00 0.00 C ATOM 1617 OE1 GLN A 105 20.024 1.847 -8.626 1.00 0.00 O ATOM 1618 NE2 GLN A 105 21.757 0.557 -8.937 1.00 0.00 N ATOM 0 H GLN A 105 17.688 0.232 -6.344 1.00 0.00 H new ATOM 0 HA GLN A 105 18.409 -0.113 -9.159 1.00 0.00 H new ATOM 0 HB2 GLN A 105 19.154 -1.792 -6.720 1.00 0.00 H new ATOM 0 HB3 GLN A 105 19.991 -1.754 -8.259 1.00 0.00 H new ATOM 0 HG2 GLN A 105 19.665 0.646 -6.385 1.00 0.00 H new ATOM 0 HG3 GLN A 105 21.123 -0.315 -6.536 1.00 0.00 H new ATOM 0 HE21 GLN A 105 22.305 -0.253 -8.648 1.00 0.00 H new ATOM 0 HE22 GLN A 105 22.053 1.113 -9.739 1.00 0.00 H new ATOM 1627 N GLN A 106 16.825 -2.578 -7.595 1.00 0.00 N ATOM 1628 CA GLN A 106 15.929 -3.746 -7.860 1.00 0.00 C ATOM 1629 C GLN A 106 14.467 -3.310 -7.721 1.00 0.00 C ATOM 1630 O GLN A 106 13.865 -3.447 -6.675 1.00 0.00 O ATOM 1631 CB GLN A 106 16.227 -4.854 -6.848 1.00 0.00 C ATOM 1632 CG GLN A 106 17.725 -5.164 -6.857 1.00 0.00 C ATOM 1633 CD GLN A 106 18.124 -5.721 -8.225 1.00 0.00 C ATOM 1634 OE1 GLN A 106 19.124 -5.322 -8.788 1.00 0.00 O ATOM 1635 NE2 GLN A 106 17.378 -6.632 -8.788 1.00 0.00 N ATOM 0 H GLN A 106 17.079 -2.441 -6.617 1.00 0.00 H new ATOM 0 HA GLN A 106 16.103 -4.117 -8.870 1.00 0.00 H new ATOM 0 HB2 GLN A 106 15.915 -4.544 -5.851 1.00 0.00 H new ATOM 0 HB3 GLN A 106 15.658 -5.750 -7.096 1.00 0.00 H new ATOM 0 HG2 GLN A 106 18.295 -4.261 -6.640 1.00 0.00 H new ATOM 0 HG3 GLN A 106 17.962 -5.886 -6.076 1.00 0.00 H new ATOM 0 HE21 GLN A 106 16.538 -6.967 -8.316 1.00 0.00 H new ATOM 0 HE22 GLN A 106 17.635 -7.009 -9.700 1.00 0.00 H new ATOM 1644 N GLN A 107 13.894 -2.778 -8.769 1.00 0.00 N ATOM 1645 CA GLN A 107 12.471 -2.321 -8.704 1.00 0.00 C ATOM 1646 C GLN A 107 11.536 -3.472 -9.108 1.00 0.00 C ATOM 1647 O GLN A 107 10.333 -3.360 -9.007 1.00 0.00 O ATOM 1648 CB GLN A 107 12.279 -1.130 -9.669 1.00 0.00 C ATOM 1649 CG GLN A 107 12.443 0.193 -8.914 1.00 0.00 C ATOM 1650 CD GLN A 107 12.542 1.345 -9.915 1.00 0.00 C ATOM 1651 OE1 GLN A 107 11.995 1.274 -10.997 1.00 0.00 O ATOM 1652 NE2 GLN A 107 13.222 2.413 -9.597 1.00 0.00 N ATOM 0 H GLN A 107 14.350 -2.639 -9.671 1.00 0.00 H new ATOM 0 HA GLN A 107 12.232 -2.011 -7.687 1.00 0.00 H new ATOM 0 HB2 GLN A 107 13.006 -1.188 -10.479 1.00 0.00 H new ATOM 0 HB3 GLN A 107 11.290 -1.177 -10.125 1.00 0.00 H new ATOM 0 HG2 GLN A 107 11.596 0.350 -8.246 1.00 0.00 H new ATOM 0 HG3 GLN A 107 13.338 0.160 -8.292 1.00 0.00 H new ATOM 0 HE21 GLN A 107 13.682 2.473 -8.688 1.00 0.00 H new ATOM 0 HE22 GLN A 107 13.294 3.187 -10.257 1.00 0.00 H new ATOM 1661 N GLY A 108 12.069 -4.571 -9.569 1.00 0.00 N ATOM 1662 CA GLY A 108 11.186 -5.708 -9.976 1.00 0.00 C ATOM 1663 C GLY A 108 10.147 -5.961 -8.889 1.00 0.00 C ATOM 1664 O GLY A 108 8.960 -5.917 -9.114 1.00 0.00 O ATOM 0 H GLY A 108 13.070 -4.733 -9.682 1.00 0.00 H new ATOM 0 HA2 GLY A 108 10.692 -5.478 -10.920 1.00 0.00 H new ATOM 0 HA3 GLY A 108 11.783 -6.605 -10.139 1.00 0.00 H new ATOM 1668 N LEU A 109 10.592 -6.210 -7.708 1.00 0.00 N ATOM 1669 CA LEU A 109 9.625 -6.437 -6.614 1.00 0.00 C ATOM 1670 C LEU A 109 8.737 -5.199 -6.500 1.00 0.00 C ATOM 1671 O LEU A 109 7.540 -5.312 -6.445 1.00 0.00 O ATOM 1672 CB LEU A 109 10.363 -6.718 -5.300 1.00 0.00 C ATOM 1673 CG LEU A 109 10.894 -8.168 -5.272 1.00 0.00 C ATOM 1674 CD1 LEU A 109 9.776 -9.147 -4.884 1.00 0.00 C ATOM 1675 CD2 LEU A 109 11.488 -8.570 -6.635 1.00 0.00 C ATOM 0 H LEU A 109 11.577 -6.267 -7.448 1.00 0.00 H new ATOM 0 HA LEU A 109 9.006 -7.308 -6.828 1.00 0.00 H new ATOM 0 HB2 LEU A 109 11.192 -6.020 -5.186 1.00 0.00 H new ATOM 0 HB3 LEU A 109 9.691 -6.555 -4.457 1.00 0.00 H new ATOM 0 HG LEU A 109 11.684 -8.215 -4.523 1.00 0.00 H new ATOM 0 HD11 LEU A 109 10.171 -10.163 -4.870 1.00 0.00 H new ATOM 0 HD12 LEU A 109 9.396 -8.892 -3.895 1.00 0.00 H new ATOM 0 HD13 LEU A 109 8.967 -9.082 -5.611 1.00 0.00 H new ATOM 0 HD21 LEU A 109 11.854 -9.596 -6.584 1.00 0.00 H new ATOM 0 HD22 LEU A 109 10.718 -8.497 -7.403 1.00 0.00 H new ATOM 0 HD23 LEU A 109 12.313 -7.903 -6.883 1.00 0.00 H new ATOM 1687 N ARG A 110 9.301 -4.026 -6.445 1.00 0.00 N ATOM 1688 CA ARG A 110 8.449 -2.793 -6.315 1.00 0.00 C ATOM 1689 C ARG A 110 7.217 -2.878 -7.237 1.00 0.00 C ATOM 1690 O ARG A 110 6.105 -2.619 -6.816 1.00 0.00 O ATOM 1691 CB ARG A 110 9.269 -1.547 -6.668 1.00 0.00 C ATOM 1692 CG ARG A 110 8.415 -0.292 -6.456 1.00 0.00 C ATOM 1693 CD ARG A 110 9.265 0.955 -6.704 1.00 0.00 C ATOM 1694 NE ARG A 110 8.562 2.151 -6.161 1.00 0.00 N ATOM 1695 CZ ARG A 110 9.212 3.270 -5.992 1.00 0.00 C ATOM 1696 NH1 ARG A 110 10.478 3.343 -6.300 1.00 0.00 N ATOM 1697 NH2 ARG A 110 8.596 4.317 -5.515 1.00 0.00 N ATOM 0 H ARG A 110 10.307 -3.859 -6.483 1.00 0.00 H new ATOM 0 HA ARG A 110 8.108 -2.723 -5.282 1.00 0.00 H new ATOM 0 HB2 ARG A 110 10.163 -1.500 -6.047 1.00 0.00 H new ATOM 0 HB3 ARG A 110 9.603 -1.601 -7.704 1.00 0.00 H new ATOM 0 HG2 ARG A 110 7.561 -0.303 -7.133 1.00 0.00 H new ATOM 0 HG3 ARG A 110 8.017 -0.278 -5.441 1.00 0.00 H new ATOM 0 HD2 ARG A 110 10.239 0.845 -6.227 1.00 0.00 H new ATOM 0 HD3 ARG A 110 9.445 1.079 -7.772 1.00 0.00 H new ATOM 0 HE ARG A 110 7.572 2.095 -5.921 1.00 0.00 H new ATOM 0 HH11 ARG A 110 10.960 2.525 -6.673 1.00 0.00 H new ATOM 0 HH12 ARG A 110 10.985 4.218 -6.168 1.00 0.00 H new ATOM 0 HH21 ARG A 110 7.606 4.261 -5.274 1.00 0.00 H new ATOM 0 HH22 ARG A 110 9.104 5.191 -5.383 1.00 0.00 H new ATOM 1711 N ARG A 111 7.383 -3.276 -8.469 1.00 0.00 N ATOM 1712 CA ARG A 111 6.191 -3.393 -9.370 1.00 0.00 C ATOM 1713 C ARG A 111 5.430 -4.678 -9.027 1.00 0.00 C ATOM 1714 O ARG A 111 4.211 -4.696 -9.032 1.00 0.00 O ATOM 1715 CB ARG A 111 6.609 -3.382 -10.839 1.00 0.00 C ATOM 1716 CG ARG A 111 7.764 -4.358 -11.033 1.00 0.00 C ATOM 1717 CD ARG A 111 8.191 -4.375 -12.492 1.00 0.00 C ATOM 1718 NE ARG A 111 7.179 -5.114 -13.300 1.00 0.00 N ATOM 1719 CZ ARG A 111 7.184 -5.015 -14.601 1.00 0.00 C ATOM 1720 NH1 ARG A 111 8.079 -4.275 -15.196 1.00 0.00 N ATOM 1721 NH2 ARG A 111 6.295 -5.659 -15.307 1.00 0.00 N ATOM 0 H ARG A 111 8.278 -3.523 -8.891 1.00 0.00 H new ATOM 0 HA ARG A 111 5.538 -2.534 -9.214 1.00 0.00 H new ATOM 0 HB2 ARG A 111 5.768 -3.664 -11.472 1.00 0.00 H new ATOM 0 HB3 ARG A 111 6.910 -2.378 -11.137 1.00 0.00 H new ATOM 0 HG2 ARG A 111 8.605 -4.069 -10.403 1.00 0.00 H new ATOM 0 HG3 ARG A 111 7.462 -5.358 -10.722 1.00 0.00 H new ATOM 0 HD2 ARG A 111 8.294 -3.355 -12.863 1.00 0.00 H new ATOM 0 HD3 ARG A 111 9.167 -4.850 -12.590 1.00 0.00 H new ATOM 0 HE ARG A 111 6.483 -5.697 -12.836 1.00 0.00 H new ATOM 0 HH11 ARG A 111 8.775 -3.774 -14.644 1.00 0.00 H new ATOM 0 HH12 ARG A 111 8.083 -4.198 -16.213 1.00 0.00 H new ATOM 0 HH21 ARG A 111 5.597 -6.239 -14.842 1.00 0.00 H new ATOM 0 HH22 ARG A 111 6.298 -5.582 -16.324 1.00 0.00 H new ATOM 1735 N GLU A 112 6.097 -5.734 -8.671 1.00 0.00 N ATOM 1736 CA GLU A 112 5.334 -6.951 -8.280 1.00 0.00 C ATOM 1737 C GLU A 112 4.636 -6.633 -6.953 1.00 0.00 C ATOM 1738 O GLU A 112 3.589 -7.158 -6.632 1.00 0.00 O ATOM 1739 CB GLU A 112 6.290 -8.136 -8.102 1.00 0.00 C ATOM 1740 CG GLU A 112 5.495 -9.444 -8.119 1.00 0.00 C ATOM 1741 CD GLU A 112 4.996 -9.720 -9.538 1.00 0.00 C ATOM 1742 OE1 GLU A 112 5.810 -9.695 -10.446 1.00 0.00 O ATOM 1743 OE2 GLU A 112 3.809 -9.953 -9.693 1.00 0.00 O ATOM 0 H GLU A 112 7.113 -5.811 -8.633 1.00 0.00 H new ATOM 0 HA GLU A 112 4.608 -7.220 -9.047 1.00 0.00 H new ATOM 0 HB2 GLU A 112 7.033 -8.140 -8.900 1.00 0.00 H new ATOM 0 HB3 GLU A 112 6.832 -8.041 -7.161 1.00 0.00 H new ATOM 0 HG2 GLU A 112 6.122 -10.267 -7.776 1.00 0.00 H new ATOM 0 HG3 GLU A 112 4.651 -9.378 -7.432 1.00 0.00 H new ATOM 1750 N TYR A 113 5.241 -5.763 -6.188 1.00 0.00 N ATOM 1751 CA TYR A 113 4.676 -5.365 -4.870 1.00 0.00 C ATOM 1752 C TYR A 113 3.326 -4.684 -5.071 1.00 0.00 C ATOM 1753 O TYR A 113 2.459 -4.766 -4.225 1.00 0.00 O ATOM 1754 CB TYR A 113 5.632 -4.402 -4.166 1.00 0.00 C ATOM 1755 CG TYR A 113 5.189 -4.216 -2.732 1.00 0.00 C ATOM 1756 CD1 TYR A 113 5.391 -5.243 -1.801 1.00 0.00 C ATOM 1757 CD2 TYR A 113 4.576 -3.021 -2.334 1.00 0.00 C ATOM 1758 CE1 TYR A 113 4.979 -5.075 -0.473 1.00 0.00 C ATOM 1759 CE2 TYR A 113 4.165 -2.854 -1.006 1.00 0.00 C ATOM 1760 CZ TYR A 113 4.366 -3.880 -0.076 1.00 0.00 C ATOM 1761 OH TYR A 113 3.961 -3.715 1.233 1.00 0.00 O ATOM 0 H TYR A 113 6.120 -5.304 -6.428 1.00 0.00 H new ATOM 0 HA TYR A 113 4.544 -6.256 -4.257 1.00 0.00 H new ATOM 0 HB2 TYR A 113 6.649 -4.794 -4.197 1.00 0.00 H new ATOM 0 HB3 TYR A 113 5.645 -3.442 -4.682 1.00 0.00 H new ATOM 0 HD1 TYR A 113 5.864 -6.164 -2.107 1.00 0.00 H new ATOM 0 HD2 TYR A 113 4.420 -2.229 -3.051 1.00 0.00 H new ATOM 0 HE1 TYR A 113 5.134 -5.867 0.245 1.00 0.00 H new ATOM 0 HE2 TYR A 113 3.692 -1.933 -0.699 1.00 0.00 H new ATOM 0 HH TYR A 113 3.082 -3.282 1.251 1.00 0.00 H new ATOM 1771 N GLN A 114 3.107 -4.048 -6.195 1.00 0.00 N ATOM 1772 CA GLN A 114 1.776 -3.421 -6.425 1.00 0.00 C ATOM 1773 C GLN A 114 0.793 -4.536 -6.786 1.00 0.00 C ATOM 1774 O GLN A 114 -0.389 -4.456 -6.528 1.00 0.00 O ATOM 1775 CB GLN A 114 1.845 -2.413 -7.582 1.00 0.00 C ATOM 1776 CG GLN A 114 3.117 -1.575 -7.468 1.00 0.00 C ATOM 1777 CD GLN A 114 3.123 -0.797 -6.151 1.00 0.00 C ATOM 1778 OE1 GLN A 114 3.015 0.412 -6.148 1.00 0.00 O ATOM 1779 NE2 GLN A 114 3.258 -1.441 -5.024 1.00 0.00 N ATOM 0 H GLN A 114 3.783 -3.938 -6.951 1.00 0.00 H new ATOM 0 HA GLN A 114 1.458 -2.890 -5.528 1.00 0.00 H new ATOM 0 HB2 GLN A 114 1.831 -2.940 -8.536 1.00 0.00 H new ATOM 0 HB3 GLN A 114 0.969 -1.764 -7.563 1.00 0.00 H new ATOM 0 HG2 GLN A 114 3.993 -2.222 -7.520 1.00 0.00 H new ATOM 0 HG3 GLN A 114 3.181 -0.883 -8.308 1.00 0.00 H new ATOM 0 HE21 GLN A 114 3.349 -2.457 -5.025 1.00 0.00 H new ATOM 0 HE22 GLN A 114 3.273 -0.928 -4.142 1.00 0.00 H new ATOM 1788 N GLN A 115 1.288 -5.579 -7.393 1.00 0.00 N ATOM 1789 CA GLN A 115 0.402 -6.711 -7.792 1.00 0.00 C ATOM 1790 C GLN A 115 -0.069 -7.488 -6.557 1.00 0.00 C ATOM 1791 O GLN A 115 -1.220 -7.871 -6.459 1.00 0.00 O ATOM 1792 CB GLN A 115 1.174 -7.654 -8.717 1.00 0.00 C ATOM 1793 CG GLN A 115 1.677 -6.877 -9.935 1.00 0.00 C ATOM 1794 CD GLN A 115 0.489 -6.484 -10.816 1.00 0.00 C ATOM 1795 OE1 GLN A 115 -0.482 -7.209 -10.906 1.00 0.00 O ATOM 1796 NE2 GLN A 115 0.526 -5.357 -11.473 1.00 0.00 N ATOM 0 H GLN A 115 2.273 -5.697 -7.631 1.00 0.00 H new ATOM 0 HA GLN A 115 -0.470 -6.309 -8.308 1.00 0.00 H new ATOM 0 HB2 GLN A 115 2.014 -8.097 -8.183 1.00 0.00 H new ATOM 0 HB3 GLN A 115 0.531 -8.474 -9.036 1.00 0.00 H new ATOM 0 HG2 GLN A 115 2.216 -5.986 -9.614 1.00 0.00 H new ATOM 0 HG3 GLN A 115 2.379 -7.486 -10.504 1.00 0.00 H new ATOM 0 HE21 GLN A 115 1.341 -4.749 -11.397 1.00 0.00 H new ATOM 0 HE22 GLN A 115 -0.260 -5.084 -12.062 1.00 0.00 H new ATOM 1805 N LEU A 116 0.799 -7.723 -5.607 1.00 0.00 N ATOM 1806 CA LEU A 116 0.379 -8.476 -4.387 1.00 0.00 C ATOM 1807 C LEU A 116 -0.250 -7.504 -3.389 1.00 0.00 C ATOM 1808 O LEU A 116 -0.970 -7.891 -2.489 1.00 0.00 O ATOM 1809 CB LEU A 116 1.603 -9.139 -3.748 1.00 0.00 C ATOM 1810 CG LEU A 116 2.445 -9.825 -4.828 1.00 0.00 C ATOM 1811 CD1 LEU A 116 3.652 -10.502 -4.175 1.00 0.00 C ATOM 1812 CD2 LEU A 116 1.597 -10.878 -5.551 1.00 0.00 C ATOM 0 H LEU A 116 1.775 -7.428 -5.622 1.00 0.00 H new ATOM 0 HA LEU A 116 -0.346 -9.242 -4.662 1.00 0.00 H new ATOM 0 HB2 LEU A 116 2.202 -8.392 -3.227 1.00 0.00 H new ATOM 0 HB3 LEU A 116 1.285 -9.869 -3.003 1.00 0.00 H new ATOM 0 HG LEU A 116 2.788 -9.082 -5.548 1.00 0.00 H new ATOM 0 HD11 LEU A 116 4.253 -10.991 -4.941 1.00 0.00 H new ATOM 0 HD12 LEU A 116 4.256 -9.753 -3.663 1.00 0.00 H new ATOM 0 HD13 LEU A 116 3.307 -11.244 -3.455 1.00 0.00 H new ATOM 0 HD21 LEU A 116 2.198 -11.365 -6.319 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.252 -11.623 -4.834 1.00 0.00 H new ATOM 0 HD23 LEU A 116 0.737 -10.396 -6.015 1.00 0.00 H new ATOM 1824 N TRP A 117 0.017 -6.238 -3.555 1.00 0.00 N ATOM 1825 CA TRP A 117 -0.555 -5.216 -2.639 1.00 0.00 C ATOM 1826 C TRP A 117 -1.951 -4.829 -3.126 1.00 0.00 C ATOM 1827 O TRP A 117 -2.853 -4.617 -2.337 1.00 0.00 O ATOM 1828 CB TRP A 117 0.347 -3.981 -2.642 1.00 0.00 C ATOM 1829 CG TRP A 117 -0.285 -2.891 -1.833 1.00 0.00 C ATOM 1830 CD1 TRP A 117 -1.339 -2.140 -2.231 1.00 0.00 C ATOM 1831 CD2 TRP A 117 0.077 -2.416 -0.504 1.00 0.00 C ATOM 1832 NE1 TRP A 117 -1.650 -1.240 -1.229 1.00 0.00 N ATOM 1833 CE2 TRP A 117 -0.806 -1.370 -0.144 1.00 0.00 C ATOM 1834 CE3 TRP A 117 1.074 -2.787 0.417 1.00 0.00 C ATOM 1835 CZ2 TRP A 117 -0.704 -0.717 1.083 1.00 0.00 C ATOM 1836 CZ3 TRP A 117 1.179 -2.130 1.654 1.00 0.00 C ATOM 1837 CH2 TRP A 117 0.291 -1.098 1.987 1.00 0.00 C ATOM 0 H TRP A 117 0.613 -5.866 -4.294 1.00 0.00 H new ATOM 0 HA TRP A 117 -0.621 -5.619 -1.628 1.00 0.00 H new ATOM 0 HB2 TRP A 117 1.325 -4.232 -2.230 1.00 0.00 H new ATOM 0 HB3 TRP A 117 0.510 -3.640 -3.665 1.00 0.00 H new ATOM 0 HD1 TRP A 117 -1.853 -2.230 -3.177 1.00 0.00 H new ATOM 0 HE1 TRP A 117 -2.410 -0.562 -1.284 1.00 0.00 H new ATOM 0 HE3 TRP A 117 1.763 -3.582 0.171 1.00 0.00 H new ATOM 0 HZ2 TRP A 117 -1.390 0.079 1.334 1.00 0.00 H new ATOM 0 HZ3 TRP A 117 1.949 -2.422 2.353 1.00 0.00 H new ATOM 0 HH2 TRP A 117 0.376 -0.598 2.941 1.00 0.00 H new ATOM 1848 N LEU A 118 -2.164 -4.789 -4.417 1.00 0.00 N ATOM 1849 CA LEU A 118 -3.522 -4.462 -4.923 1.00 0.00 C ATOM 1850 C LEU A 118 -4.424 -5.653 -4.630 1.00 0.00 C ATOM 1851 O LEU A 118 -5.580 -5.484 -4.342 1.00 0.00 O ATOM 1852 CB LEU A 118 -3.482 -4.130 -6.418 1.00 0.00 C ATOM 1853 CG LEU A 118 -2.834 -2.744 -6.622 1.00 0.00 C ATOM 1854 CD1 LEU A 118 -2.637 -2.496 -8.121 1.00 0.00 C ATOM 1855 CD2 LEU A 118 -3.724 -1.631 -6.024 1.00 0.00 C ATOM 0 H LEU A 118 -1.460 -4.968 -5.133 1.00 0.00 H new ATOM 0 HA LEU A 118 -3.914 -3.576 -4.424 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -2.915 -4.891 -6.955 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -4.491 -4.135 -6.829 1.00 0.00 H new ATOM 0 HG LEU A 118 -1.871 -2.726 -6.112 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -2.179 -1.518 -8.271 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -1.988 -3.268 -8.535 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -3.603 -2.526 -8.625 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -3.249 -0.662 -6.179 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -4.697 -1.640 -6.515 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -3.855 -1.804 -4.956 1.00 0.00 H new ATOM 1867 N ALA A 119 -3.909 -6.846 -4.618 1.00 0.00 N ATOM 1868 CA ALA A 119 -4.781 -7.988 -4.228 1.00 0.00 C ATOM 1869 C ALA A 119 -5.196 -7.730 -2.774 1.00 0.00 C ATOM 1870 O ALA A 119 -6.329 -7.374 -2.520 1.00 0.00 O ATOM 1871 CB ALA A 119 -4.030 -9.316 -4.350 1.00 0.00 C ATOM 0 H ALA A 119 -2.945 -7.080 -4.855 1.00 0.00 H new ATOM 0 HA ALA A 119 -5.650 -8.061 -4.882 1.00 0.00 H new ATOM 0 HB1 ALA A 119 -4.689 -10.134 -4.059 1.00 0.00 H new ATOM 0 HB2 ALA A 119 -3.708 -9.458 -5.381 1.00 0.00 H new ATOM 0 HB3 ALA A 119 -3.158 -9.302 -3.696 1.00 0.00 H new ATOM 1877 N ALA A 120 -4.329 -7.918 -1.816 1.00 0.00 N ATOM 1878 CA ALA A 120 -4.724 -7.677 -0.389 1.00 0.00 C ATOM 1879 C ALA A 120 -5.512 -6.367 -0.228 1.00 0.00 C ATOM 1880 O ALA A 120 -6.043 -6.111 0.834 1.00 0.00 O ATOM 1881 CB ALA A 120 -3.466 -7.581 0.476 1.00 0.00 C ATOM 0 H ALA A 120 -3.367 -8.227 -1.954 1.00 0.00 H new ATOM 0 HA ALA A 120 -5.356 -8.509 -0.079 1.00 0.00 H new ATOM 0 HB1 ALA A 120 -3.750 -7.406 1.514 1.00 0.00 H new ATOM 0 HB2 ALA A 120 -2.904 -8.513 0.406 1.00 0.00 H new ATOM 0 HB3 ALA A 120 -2.846 -6.756 0.126 1.00 0.00 H new ATOM 1887 N PHE A 121 -5.615 -5.544 -1.248 1.00 0.00 N ATOM 1888 CA PHE A 121 -6.399 -4.269 -1.115 1.00 0.00 C ATOM 1889 C PHE A 121 -7.608 -4.313 -2.060 1.00 0.00 C ATOM 1890 O PHE A 121 -8.542 -3.545 -1.954 1.00 0.00 O ATOM 1891 CB PHE A 121 -5.494 -3.088 -1.525 1.00 0.00 C ATOM 1892 CG PHE A 121 -4.696 -2.613 -0.324 1.00 0.00 C ATOM 1893 CD1 PHE A 121 -3.812 -3.490 0.315 1.00 0.00 C ATOM 1894 CD2 PHE A 121 -4.854 -1.305 0.156 1.00 0.00 C ATOM 1895 CE1 PHE A 121 -3.084 -3.060 1.431 1.00 0.00 C ATOM 1896 CE2 PHE A 121 -4.128 -0.877 1.273 1.00 0.00 C ATOM 1897 CZ PHE A 121 -3.243 -1.755 1.910 1.00 0.00 C ATOM 0 H PHE A 121 -5.192 -5.698 -2.163 1.00 0.00 H new ATOM 0 HA PHE A 121 -6.739 -4.150 -0.086 1.00 0.00 H new ATOM 0 HB2 PHE A 121 -4.819 -3.395 -2.324 1.00 0.00 H new ATOM 0 HB3 PHE A 121 -6.101 -2.271 -1.917 1.00 0.00 H new ATOM 0 HD1 PHE A 121 -3.691 -4.498 -0.053 1.00 0.00 H new ATOM 0 HD2 PHE A 121 -5.536 -0.628 -0.336 1.00 0.00 H new ATOM 0 HE1 PHE A 121 -2.400 -3.736 1.922 1.00 0.00 H new ATOM 0 HE2 PHE A 121 -4.250 0.130 1.643 1.00 0.00 H new ATOM 0 HZ PHE A 121 -2.682 -1.425 2.772 1.00 0.00 H new ATOM 1907 N ALA A 122 -7.497 -5.140 -3.061 1.00 0.00 N ATOM 1908 CA ALA A 122 -8.507 -5.207 -4.149 1.00 0.00 C ATOM 1909 C ALA A 122 -9.938 -5.303 -3.597 1.00 0.00 C ATOM 1910 O ALA A 122 -10.676 -4.352 -3.435 1.00 0.00 O ATOM 1911 CB ALA A 122 -8.216 -6.497 -4.940 1.00 0.00 C ATOM 0 H ALA A 122 -6.721 -5.793 -3.171 1.00 0.00 H new ATOM 0 HA ALA A 122 -8.441 -4.306 -4.759 1.00 0.00 H new ATOM 0 HB1 ALA A 122 -8.934 -6.594 -5.755 1.00 0.00 H new ATOM 0 HB2 ALA A 122 -7.207 -6.453 -5.349 1.00 0.00 H new ATOM 0 HB3 ALA A 122 -8.302 -7.358 -4.277 1.00 0.00 H new ATOM 1917 N ALA A 123 -10.252 -6.542 -3.306 1.00 0.00 N ATOM 1918 CA ALA A 123 -11.560 -6.957 -2.736 1.00 0.00 C ATOM 1919 C ALA A 123 -11.441 -6.907 -1.228 1.00 0.00 C ATOM 1920 O ALA A 123 -11.821 -7.821 -0.523 1.00 0.00 O ATOM 1921 CB ALA A 123 -11.876 -8.389 -3.160 1.00 0.00 C ATOM 0 H ALA A 123 -9.611 -7.322 -3.452 1.00 0.00 H new ATOM 0 HA ALA A 123 -12.353 -6.297 -3.089 1.00 0.00 H new ATOM 0 HB1 ALA A 123 -12.836 -8.689 -2.740 1.00 0.00 H new ATOM 0 HB2 ALA A 123 -11.922 -8.445 -4.248 1.00 0.00 H new ATOM 0 HB3 ALA A 123 -11.096 -9.057 -2.796 1.00 0.00 H new ATOM 1927 N LEU A 124 -10.900 -5.840 -0.732 1.00 0.00 N ATOM 1928 CA LEU A 124 -10.731 -5.709 0.720 1.00 0.00 C ATOM 1929 C LEU A 124 -12.081 -5.788 1.435 1.00 0.00 C ATOM 1930 O LEU A 124 -12.206 -6.486 2.421 1.00 0.00 O ATOM 1931 CB LEU A 124 -10.097 -4.339 1.030 1.00 0.00 C ATOM 1932 CG LEU A 124 -8.777 -4.502 1.785 1.00 0.00 C ATOM 1933 CD1 LEU A 124 -8.050 -3.149 1.854 1.00 0.00 C ATOM 1934 CD2 LEU A 124 -9.067 -4.981 3.208 1.00 0.00 C ATOM 0 H LEU A 124 -10.566 -5.048 -1.281 1.00 0.00 H new ATOM 0 HA LEU A 124 -10.094 -6.522 1.069 1.00 0.00 H new ATOM 0 HB2 LEU A 124 -9.924 -3.796 0.101 1.00 0.00 H new ATOM 0 HB3 LEU A 124 -10.788 -3.741 1.624 1.00 0.00 H new ATOM 0 HG LEU A 124 -8.152 -5.228 1.266 1.00 0.00 H new ATOM 0 HD11 LEU A 124 -7.110 -3.268 2.393 1.00 0.00 H new ATOM 0 HD12 LEU A 124 -7.847 -2.793 0.844 1.00 0.00 H new ATOM 0 HD13 LEU A 124 -8.677 -2.425 2.375 1.00 0.00 H new ATOM 0 HD21 LEU A 124 -8.129 -5.099 3.751 1.00 0.00 H new ATOM 0 HD22 LEU A 124 -9.692 -4.248 3.718 1.00 0.00 H new ATOM 0 HD23 LEU A 124 -9.587 -5.938 3.171 1.00 0.00 H new ATOM 1946 N PRO A 125 -13.052 -5.013 0.963 1.00 0.00 N ATOM 1947 CA PRO A 125 -14.350 -4.965 1.631 1.00 0.00 C ATOM 1948 C PRO A 125 -14.813 -6.378 1.920 1.00 0.00 C ATOM 1949 O PRO A 125 -15.095 -6.729 3.049 1.00 0.00 O ATOM 1950 CB PRO A 125 -15.270 -4.179 0.686 1.00 0.00 C ATOM 1951 CG PRO A 125 -14.360 -3.530 -0.393 1.00 0.00 C ATOM 1952 CD PRO A 125 -12.961 -4.163 -0.257 1.00 0.00 C ATOM 0 HA PRO A 125 -14.332 -4.466 2.600 1.00 0.00 H new ATOM 0 HB2 PRO A 125 -16.005 -4.839 0.225 1.00 0.00 H new ATOM 0 HB3 PRO A 125 -15.825 -3.417 1.233 1.00 0.00 H new ATOM 0 HG2 PRO A 125 -14.764 -3.703 -1.390 1.00 0.00 H new ATOM 0 HG3 PRO A 125 -14.308 -2.450 -0.253 1.00 0.00 H new ATOM 0 HD2 PRO A 125 -12.707 -4.756 -1.136 1.00 0.00 H new ATOM 0 HD3 PRO A 125 -12.189 -3.401 -0.153 1.00 0.00 H new ATOM 1960 N GLY A 126 -14.853 -7.208 0.929 1.00 0.00 N ATOM 1961 CA GLY A 126 -15.251 -8.611 1.176 1.00 0.00 C ATOM 1962 C GLY A 126 -13.997 -9.411 1.544 1.00 0.00 C ATOM 1963 O GLY A 126 -13.570 -10.281 0.814 1.00 0.00 O ATOM 0 H GLY A 126 -14.628 -6.978 -0.039 1.00 0.00 H new ATOM 0 HA2 GLY A 126 -15.983 -8.661 1.982 1.00 0.00 H new ATOM 0 HA3 GLY A 126 -15.724 -9.033 0.289 1.00 0.00 H new ATOM 1967 N SER A 127 -13.455 -9.171 2.720 1.00 0.00 N ATOM 1968 CA SER A 127 -12.278 -9.991 3.169 1.00 0.00 C ATOM 1969 C SER A 127 -11.599 -9.420 4.430 1.00 0.00 C ATOM 1970 O SER A 127 -11.724 -9.967 5.508 1.00 0.00 O ATOM 1971 CB SER A 127 -11.261 -10.115 2.022 1.00 0.00 C ATOM 1972 OG SER A 127 -11.511 -11.317 1.305 1.00 0.00 O ATOM 0 H SER A 127 -13.769 -8.457 3.377 1.00 0.00 H new ATOM 0 HA SER A 127 -12.655 -10.978 3.437 1.00 0.00 H new ATOM 0 HB2 SER A 127 -11.340 -9.256 1.355 1.00 0.00 H new ATOM 0 HB3 SER A 127 -10.246 -10.118 2.419 1.00 0.00 H new ATOM 0 HG SER A 127 -12.314 -11.208 0.754 1.00 0.00 H new ATOM 1978 N ALA A 128 -10.855 -8.358 4.290 1.00 0.00 N ATOM 1979 CA ALA A 128 -10.118 -7.766 5.463 1.00 0.00 C ATOM 1980 C ALA A 128 -10.604 -6.336 5.727 1.00 0.00 C ATOM 1981 O ALA A 128 -9.838 -5.397 5.702 1.00 0.00 O ATOM 1982 CB ALA A 128 -8.620 -7.754 5.122 1.00 0.00 C ATOM 0 H ALA A 128 -10.719 -7.864 3.408 1.00 0.00 H new ATOM 0 HA ALA A 128 -10.301 -8.359 6.359 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -8.060 -7.329 5.956 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -8.280 -8.773 4.939 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -8.455 -7.151 4.229 1.00 0.00 H new ATOM 1988 N LYS A 129 -11.880 -6.162 5.935 1.00 0.00 N ATOM 1989 CA LYS A 129 -12.423 -4.793 6.143 1.00 0.00 C ATOM 1990 C LYS A 129 -13.632 -4.814 7.089 1.00 0.00 C ATOM 1991 O LYS A 129 -13.779 -5.650 7.959 1.00 0.00 O ATOM 1992 CB LYS A 129 -12.898 -4.294 4.764 1.00 0.00 C ATOM 1993 CG LYS A 129 -12.941 -2.735 4.686 1.00 0.00 C ATOM 1994 CD LYS A 129 -14.260 -2.225 4.066 1.00 0.00 C ATOM 1995 CE LYS A 129 -14.513 -0.778 4.498 1.00 0.00 C ATOM 1996 NZ LYS A 129 -14.811 -0.740 5.957 1.00 0.00 N ATOM 0 H LYS A 129 -12.571 -6.912 5.970 1.00 0.00 H new ATOM 0 HA LYS A 129 -11.657 -4.153 6.581 1.00 0.00 H new ATOM 0 HB2 LYS A 129 -12.231 -4.677 3.991 1.00 0.00 H new ATOM 0 HB3 LYS A 129 -13.890 -4.694 4.556 1.00 0.00 H new ATOM 0 HG2 LYS A 129 -12.825 -2.318 5.687 1.00 0.00 H new ATOM 0 HG3 LYS A 129 -12.099 -2.378 4.093 1.00 0.00 H new ATOM 0 HD2 LYS A 129 -14.208 -2.286 2.979 1.00 0.00 H new ATOM 0 HD3 LYS A 129 -15.089 -2.858 4.381 1.00 0.00 H new ATOM 0 HE2 LYS A 129 -13.640 -0.164 4.278 1.00 0.00 H new ATOM 0 HE3 LYS A 129 -15.347 -0.360 3.935 1.00 0.00 H new ATOM 0 HZ1 LYS A 129 -14.476 0.160 6.356 1.00 0.00 H new ATOM 0 HZ2 LYS A 129 -15.837 -0.824 6.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 129 -14.328 -1.530 6.431 1.00 0.00 H new ATOM 2010 N ASP A 130 -14.491 -3.873 6.861 1.00 0.00 N ATOM 2011 CA ASP A 130 -15.747 -3.714 7.638 1.00 0.00 C ATOM 2012 C ASP A 130 -16.546 -2.605 6.939 1.00 0.00 C ATOM 2013 O ASP A 130 -16.591 -1.489 7.417 1.00 0.00 O ATOM 2014 CB ASP A 130 -15.422 -3.297 9.075 1.00 0.00 C ATOM 2015 CG ASP A 130 -14.366 -2.191 9.058 1.00 0.00 C ATOM 2016 OD1 ASP A 130 -13.196 -2.518 8.939 1.00 0.00 O ATOM 2017 OD2 ASP A 130 -14.744 -1.036 9.166 1.00 0.00 O ATOM 0 H ASP A 130 -14.369 -3.171 6.131 1.00 0.00 H new ATOM 0 HA ASP A 130 -16.311 -4.646 7.680 1.00 0.00 H new ATOM 0 HB2 ASP A 130 -16.324 -2.946 9.576 1.00 0.00 H new ATOM 0 HB3 ASP A 130 -15.057 -4.155 9.640 1.00 0.00 H new ATOM 2022 N PRO A 131 -17.094 -2.927 5.784 1.00 0.00 N ATOM 2023 CA PRO A 131 -17.819 -1.949 4.952 1.00 0.00 C ATOM 2024 C PRO A 131 -19.304 -1.926 5.329 1.00 0.00 C ATOM 2025 O PRO A 131 -19.920 -0.890 5.477 1.00 0.00 O ATOM 2026 CB PRO A 131 -17.662 -2.537 3.534 1.00 0.00 C ATOM 2027 CG PRO A 131 -17.444 -4.068 3.719 1.00 0.00 C ATOM 2028 CD PRO A 131 -17.056 -4.288 5.198 1.00 0.00 C ATOM 0 HA PRO A 131 -17.447 -0.930 5.060 1.00 0.00 H new ATOM 0 HB2 PRO A 131 -18.548 -2.340 2.931 1.00 0.00 H new ATOM 0 HB3 PRO A 131 -16.817 -2.083 3.016 1.00 0.00 H new ATOM 0 HG2 PRO A 131 -18.350 -4.620 3.471 1.00 0.00 H new ATOM 0 HG3 PRO A 131 -16.659 -4.430 3.055 1.00 0.00 H new ATOM 0 HD2 PRO A 131 -17.755 -4.958 5.699 1.00 0.00 H new ATOM 0 HD3 PRO A 131 -16.066 -4.734 5.289 1.00 0.00 H new ATOM 2036 N SER A 132 -19.871 -3.097 5.422 1.00 0.00 N ATOM 2037 CA SER A 132 -21.325 -3.253 5.719 1.00 0.00 C ATOM 2038 C SER A 132 -21.673 -4.741 5.612 1.00 0.00 C ATOM 2039 O SER A 132 -22.769 -5.104 5.241 1.00 0.00 O ATOM 2040 CB SER A 132 -22.132 -2.480 4.670 1.00 0.00 C ATOM 2041 OG SER A 132 -23.478 -2.937 4.678 1.00 0.00 O ATOM 0 H SER A 132 -19.372 -3.979 5.301 1.00 0.00 H new ATOM 0 HA SER A 132 -21.556 -2.874 6.715 1.00 0.00 H new ATOM 0 HB2 SER A 132 -22.098 -1.412 4.884 1.00 0.00 H new ATOM 0 HB3 SER A 132 -21.694 -2.621 3.682 1.00 0.00 H new ATOM 0 HG SER A 132 -23.507 -3.874 4.391 1.00 0.00 H new ATOM 2047 N TRP A 133 -20.744 -5.593 5.976 1.00 0.00 N ATOM 2048 CA TRP A 133 -20.973 -7.074 5.935 1.00 0.00 C ATOM 2049 C TRP A 133 -21.362 -7.538 4.521 1.00 0.00 C ATOM 2050 O TRP A 133 -20.842 -8.517 4.023 1.00 0.00 O ATOM 2051 CB TRP A 133 -22.067 -7.457 6.932 1.00 0.00 C ATOM 2052 CG TRP A 133 -21.832 -6.744 8.226 1.00 0.00 C ATOM 2053 CD1 TRP A 133 -20.660 -6.730 8.902 1.00 0.00 C ATOM 2054 CD2 TRP A 133 -22.765 -5.944 9.008 1.00 0.00 C ATOM 2055 NE1 TRP A 133 -20.814 -5.973 10.049 1.00 0.00 N ATOM 2056 CE2 TRP A 133 -22.094 -5.467 10.159 1.00 0.00 C ATOM 2057 CE3 TRP A 133 -24.115 -5.589 8.832 1.00 0.00 C ATOM 2058 CZ2 TRP A 133 -22.740 -4.666 11.102 1.00 0.00 C ATOM 2059 CZ3 TRP A 133 -24.767 -4.784 9.780 1.00 0.00 C ATOM 2060 CH2 TRP A 133 -24.081 -4.323 10.913 1.00 0.00 C ATOM 0 H TRP A 133 -19.819 -5.319 6.306 1.00 0.00 H new ATOM 0 HA TRP A 133 -20.042 -7.571 6.209 1.00 0.00 H new ATOM 0 HB2 TRP A 133 -23.047 -7.195 6.532 1.00 0.00 H new ATOM 0 HB3 TRP A 133 -22.067 -8.535 7.093 1.00 0.00 H new ATOM 0 HD1 TRP A 133 -19.752 -7.229 8.596 1.00 0.00 H new ATOM 0 HE1 TRP A 133 -20.073 -5.809 10.730 1.00 0.00 H new ATOM 0 HE3 TRP A 133 -24.653 -5.938 7.963 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 -22.206 -4.314 11.972 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 -25.804 -4.518 9.636 1.00 0.00 H new ATOM 0 HH2 TRP A 133 -24.588 -3.704 11.638 1.00 0.00 H new ATOM 2071 N ALA A 134 -22.263 -6.860 3.869 1.00 0.00 N ATOM 2072 CA ALA A 134 -22.667 -7.280 2.498 1.00 0.00 C ATOM 2073 C ALA A 134 -23.015 -8.770 2.504 1.00 0.00 C ATOM 2074 O ALA A 134 -24.178 -9.085 2.695 1.00 0.00 O ATOM 2075 CB ALA A 134 -21.512 -7.029 1.527 1.00 0.00 C ATOM 2076 OXT ALA A 134 -22.113 -9.569 2.316 1.00 0.00 O ATOM 0 H ALA A 134 -22.739 -6.031 4.226 1.00 0.00 H new ATOM 0 HA ALA A 134 -23.538 -6.705 2.183 1.00 0.00 H new ATOM 0 HB1 ALA A 134 -21.807 -7.336 0.524 1.00 0.00 H new ATOM 0 HB2 ALA A 134 -21.264 -5.968 1.523 1.00 0.00 H new ATOM 0 HB3 ALA A 134 -20.641 -7.604 1.841 1.00 0.00 H new TER 2082 ALA A 134