USER MOD reduce.3.24.130724 H: found=0, std=0, add=791, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 789 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 Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 70 ASN : amide:sc= -0.24 K(o=-0.24,f=-1) USER MOD Single : A 72 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 74 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 ASN : amide:sc= -1.3 K(o=-1.3,f=-4.6!) USER MOD Single : A 81 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : B 542 GLN : amide:sc= 0 X(o=0,f=-0.036) USER MOD Single : B 546 THR OG1 : rot -43:sc= -0.303 USER MOD Single : B 548 SER OG : rot 180:sc= 0 USER MOD Single : B 549 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 552 SER OG : rot 180:sc= 0 USER MOD Single : B 556 GLN : amide:sc= -0.0151 X(o=-0.015,f=0) USER MOD Single : B 558 GLN : amide:sc= -1.85 K(o=-1.9,f=-2.7) USER MOD Single : B 559 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 560 GLN : amide:sc= -1.86 K(o=-1.9,f=-2.4) USER MOD Single : B 561 MET CE :methyl -119:sc= -2.38! (180deg=-2.86) USER MOD Single : B 571 GLN : amide:sc= -1.26 K(o=-1.3,f=-0.044) USER MOD Single : B 573 MET CE :methyl -136:sc= -1.92 (180deg=-7.73!) USER MOD Single : B 574 HIS : no HD1:sc= -7.25! C(o=-7.3!,f=-7.6!) USER MOD Single : B 576 THR OG1 : rot 180:sc= -0.849 USER MOD Single : B 580 LYS NZ :NH3+ 164:sc= -0.197 (180deg=-0.4) USER MOD Single : B 582 THR OG1 : rot 170:sc= 0 USER MOD Single : B 584 MET CE :methyl 166:sc= -8.93! (180deg=-10.1!) USER MOD Single : B 590 ASN : amide:sc= -4.48! C(o=-4.5!,f=-9.8!) USER MOD Single : B 591 SER OG : rot 180:sc= 0 USER MOD Single : B 595 HIS : no HD1:sc=-0.00403 X(o=-0.004,f=0) USER MOD Single : B 596 MET CE :methyl -169:sc= -1.96 (180deg=-2.92) USER MOD Single : B 599 SER OG : rot 180:sc= -0.793 USER MOD Single : B 602 SER OG : rot 90:sc= -0.713 USER MOD Single : B 605 SER OG : rot 180:sc= 0 USER MOD Single : B 606 LYS NZ :NH3+ -170:sc= -0.845 (180deg=-1.04) USER MOD Single : B 615 GLN : amide:sc= 0 X(o=0,f=-0.032) USER MOD Single : B 617 HIS : no HD1:sc= -0.137 X(o=-0.14,f=-0.059) USER MOD Single : B 618 GLN : amide:sc= 0 X(o=0,f=-0.015) USER MOD Single : B 620 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.0808) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 64 0.924 -1.329 -1.505 1.00 0.00 N ATOM 2 CA ALA A 64 1.157 -0.225 -2.427 1.00 0.00 C ATOM 3 C ALA A 64 1.752 -0.722 -3.740 1.00 0.00 C ATOM 4 O ALA A 64 1.065 -0.787 -4.759 1.00 0.00 O ATOM 5 CB ALA A 64 2.072 0.810 -1.789 1.00 0.00 C ATOM 0 HA ALA A 64 0.197 0.241 -2.648 1.00 0.00 H new ATOM 0 HB1 ALA A 64 2.238 1.629 -2.488 1.00 0.00 H new ATOM 0 HB2 ALA A 64 1.608 1.196 -0.881 1.00 0.00 H new ATOM 0 HB3 ALA A 64 3.027 0.347 -1.539 1.00 0.00 H new ATOM 11 N PHE A 65 3.034 -1.072 -3.709 1.00 0.00 N ATOM 12 CA PHE A 65 3.722 -1.562 -4.897 1.00 0.00 C ATOM 13 C PHE A 65 4.826 -2.546 -4.520 1.00 0.00 C ATOM 14 O PHE A 65 5.591 -2.309 -3.586 1.00 0.00 O ATOM 15 CB PHE A 65 4.314 -0.394 -5.688 1.00 0.00 C ATOM 16 CG PHE A 65 3.384 0.156 -6.731 1.00 0.00 C ATOM 17 CD1 PHE A 65 3.203 -0.505 -7.935 1.00 0.00 C ATOM 18 CD2 PHE A 65 2.690 1.335 -6.508 1.00 0.00 C ATOM 19 CE1 PHE A 65 2.348 -0.002 -8.898 1.00 0.00 C ATOM 20 CE2 PHE A 65 1.833 1.842 -7.466 1.00 0.00 C ATOM 21 CZ PHE A 65 1.663 1.174 -8.663 1.00 0.00 C ATOM 0 H PHE A 65 3.617 -1.025 -2.873 1.00 0.00 H new ATOM 0 HA PHE A 65 2.993 -2.081 -5.519 1.00 0.00 H new ATOM 0 HB2 PHE A 65 4.583 0.404 -4.996 1.00 0.00 H new ATOM 0 HB3 PHE A 65 5.235 -0.722 -6.170 1.00 0.00 H new ATOM 0 HD1 PHE A 65 3.737 -1.425 -8.124 1.00 0.00 H new ATOM 0 HD2 PHE A 65 2.821 1.863 -5.575 1.00 0.00 H new ATOM 0 HE1 PHE A 65 2.216 -0.528 -9.832 1.00 0.00 H new ATOM 0 HE2 PHE A 65 1.296 2.760 -7.279 1.00 0.00 H new ATOM 0 HZ PHE A 65 0.996 1.571 -9.414 1.00 0.00 H new ATOM 31 N SER A 66 4.900 -3.652 -5.253 1.00 0.00 N ATOM 32 CA SER A 66 5.906 -4.676 -4.994 1.00 0.00 C ATOM 33 C SER A 66 6.711 -4.977 -6.254 1.00 0.00 C ATOM 34 O SER A 66 7.095 -6.121 -6.499 1.00 0.00 O ATOM 35 CB SER A 66 5.242 -5.955 -4.480 1.00 0.00 C ATOM 36 OG SER A 66 4.207 -6.377 -5.351 1.00 0.00 O ATOM 0 H SER A 66 4.275 -3.862 -6.031 1.00 0.00 H new ATOM 0 HA SER A 66 6.587 -4.298 -4.231 1.00 0.00 H new ATOM 0 HB2 SER A 66 5.988 -6.744 -4.387 1.00 0.00 H new ATOM 0 HB3 SER A 66 4.835 -5.782 -3.484 1.00 0.00 H new ATOM 0 HG SER A 66 3.799 -7.197 -5.002 1.00 0.00 H new ATOM 42 N ARG A 67 6.963 -3.943 -7.049 1.00 0.00 N ATOM 43 CA ARG A 67 7.722 -4.096 -8.285 1.00 0.00 C ATOM 44 C ARG A 67 8.062 -2.736 -8.886 1.00 0.00 C ATOM 45 O ARG A 67 9.204 -2.282 -8.812 1.00 0.00 O ATOM 46 CB ARG A 67 6.930 -4.929 -9.295 1.00 0.00 C ATOM 47 CG ARG A 67 5.426 -4.887 -9.072 1.00 0.00 C ATOM 48 CD ARG A 67 4.665 -5.124 -10.367 1.00 0.00 C ATOM 49 NE ARG A 67 3.222 -4.985 -10.187 1.00 0.00 N ATOM 50 CZ ARG A 67 2.452 -5.931 -9.661 1.00 0.00 C ATOM 51 NH1 ARG A 67 2.984 -7.080 -9.266 1.00 0.00 N ATOM 52 NH2 ARG A 67 1.147 -5.730 -9.530 1.00 0.00 N ATOM 0 H ARG A 67 6.653 -2.990 -6.860 1.00 0.00 H new ATOM 0 HA ARG A 67 8.653 -4.612 -8.049 1.00 0.00 H new ATOM 0 HB2 ARG A 67 7.150 -4.571 -10.301 1.00 0.00 H new ATOM 0 HB3 ARG A 67 7.268 -5.964 -9.244 1.00 0.00 H new ATOM 0 HG2 ARG A 67 5.144 -5.643 -8.339 1.00 0.00 H new ATOM 0 HG3 ARG A 67 5.146 -3.920 -8.655 1.00 0.00 H new ATOM 0 HD2 ARG A 67 5.006 -4.416 -11.123 1.00 0.00 H new ATOM 0 HD3 ARG A 67 4.889 -6.123 -10.742 1.00 0.00 H new ATOM 0 HE ARG A 67 2.781 -4.113 -10.481 1.00 0.00 H new ATOM 0 HH11 ARG A 67 3.987 -7.239 -9.366 1.00 0.00 H new ATOM 0 HH12 ARG A 67 2.391 -7.805 -8.862 1.00 0.00 H new ATOM 0 HH21 ARG A 67 0.734 -4.848 -9.833 1.00 0.00 H new ATOM 0 HH22 ARG A 67 0.557 -6.457 -9.126 1.00 0.00 H new ATOM 66 N GLN A 68 7.064 -2.092 -9.482 1.00 0.00 N ATOM 67 CA GLN A 68 7.258 -0.784 -10.097 1.00 0.00 C ATOM 68 C GLN A 68 5.921 -0.089 -10.333 1.00 0.00 C ATOM 69 O GLN A 68 4.905 -0.741 -10.578 1.00 0.00 O ATOM 70 CB GLN A 68 8.013 -0.926 -11.420 1.00 0.00 C ATOM 71 CG GLN A 68 8.077 0.361 -12.225 1.00 0.00 C ATOM 72 CD GLN A 68 9.197 0.355 -13.248 1.00 0.00 C ATOM 73 OE1 GLN A 68 10.376 0.367 -12.894 1.00 0.00 O ATOM 74 NE2 GLN A 68 8.832 0.336 -14.525 1.00 0.00 N ATOM 0 H GLN A 68 6.113 -2.454 -9.552 1.00 0.00 H new ATOM 0 HA GLN A 68 7.848 -0.173 -9.414 1.00 0.00 H new ATOM 0 HB2 GLN A 68 9.028 -1.267 -11.215 1.00 0.00 H new ATOM 0 HB3 GLN A 68 7.533 -1.698 -12.022 1.00 0.00 H new ATOM 0 HG2 GLN A 68 7.126 0.514 -12.734 1.00 0.00 H new ATOM 0 HG3 GLN A 68 8.214 1.203 -11.547 1.00 0.00 H new ATOM 0 HE21 GLN A 68 7.843 0.327 -14.773 1.00 0.00 H new ATOM 0 HE22 GLN A 68 9.541 0.331 -15.258 1.00 0.00 H new ATOM 83 N LEU A 69 5.928 1.237 -10.257 1.00 0.00 N ATOM 84 CA LEU A 69 4.716 2.022 -10.462 1.00 0.00 C ATOM 85 C LEU A 69 4.790 2.808 -11.767 1.00 0.00 C ATOM 86 O LEU A 69 5.737 2.662 -12.539 1.00 0.00 O ATOM 87 CB LEU A 69 4.499 2.978 -9.289 1.00 0.00 C ATOM 88 CG LEU A 69 5.667 3.906 -8.955 1.00 0.00 C ATOM 89 CD1 LEU A 69 5.656 5.126 -9.863 1.00 0.00 C ATOM 90 CD2 LEU A 69 5.613 4.327 -7.493 1.00 0.00 C ATOM 0 H LEU A 69 6.760 1.791 -10.055 1.00 0.00 H new ATOM 0 HA LEU A 69 3.873 1.333 -10.522 1.00 0.00 H new ATOM 0 HB2 LEU A 69 3.624 3.591 -9.503 1.00 0.00 H new ATOM 0 HB3 LEU A 69 4.266 2.387 -8.403 1.00 0.00 H new ATOM 0 HG LEU A 69 6.597 3.362 -9.122 1.00 0.00 H new ATOM 0 HD11 LEU A 69 6.495 5.775 -9.611 1.00 0.00 H new ATOM 0 HD12 LEU A 69 5.744 4.807 -10.902 1.00 0.00 H new ATOM 0 HD13 LEU A 69 4.722 5.671 -9.728 1.00 0.00 H new ATOM 0 HD21 LEU A 69 6.452 4.987 -7.273 1.00 0.00 H new ATOM 0 HD22 LEU A 69 4.678 4.852 -7.300 1.00 0.00 H new ATOM 0 HD23 LEU A 69 5.671 3.443 -6.858 1.00 0.00 H new ATOM 102 N ASN A 70 3.785 3.645 -12.006 1.00 0.00 N ATOM 103 CA ASN A 70 3.737 4.456 -13.217 1.00 0.00 C ATOM 104 C ASN A 70 3.935 5.933 -12.890 1.00 0.00 C ATOM 105 O ASN A 70 3.350 6.453 -11.939 1.00 0.00 O ATOM 106 CB ASN A 70 2.403 4.256 -13.938 1.00 0.00 C ATOM 107 CG ASN A 70 1.215 4.416 -13.010 1.00 0.00 C ATOM 108 OD1 ASN A 70 0.941 3.551 -12.178 1.00 0.00 O ATOM 109 ND2 ASN A 70 0.501 5.527 -13.150 1.00 0.00 N ATOM 0 H ASN A 70 2.993 3.779 -11.377 1.00 0.00 H new ATOM 0 HA ASN A 70 4.547 4.135 -13.872 1.00 0.00 H new ATOM 0 HB2 ASN A 70 2.323 4.974 -14.754 1.00 0.00 H new ATOM 0 HB3 ASN A 70 2.380 3.262 -14.385 1.00 0.00 H new ATOM 0 HD21 ASN A 70 -0.311 5.690 -12.554 1.00 0.00 H new ATOM 0 HD22 ASN A 70 0.765 6.217 -13.853 1.00 0.00 H new ATOM 116 N VAL A 71 4.762 6.605 -13.685 1.00 0.00 N ATOM 117 CA VAL A 71 5.035 8.022 -13.482 1.00 0.00 C ATOM 118 C VAL A 71 3.934 8.886 -14.087 1.00 0.00 C ATOM 119 O VAL A 71 3.884 10.094 -13.859 1.00 0.00 O ATOM 120 CB VAL A 71 6.387 8.427 -14.098 1.00 0.00 C ATOM 121 CG1 VAL A 71 6.335 8.327 -15.615 1.00 0.00 C ATOM 122 CG2 VAL A 71 6.772 9.832 -13.661 1.00 0.00 C ATOM 0 H VAL A 71 5.255 6.190 -14.476 1.00 0.00 H new ATOM 0 HA VAL A 71 5.071 8.186 -12.405 1.00 0.00 H new ATOM 0 HB VAL A 71 7.151 7.737 -13.739 1.00 0.00 H new ATOM 0 HG11 VAL A 71 7.299 8.617 -16.032 1.00 0.00 H new ATOM 0 HG12 VAL A 71 6.108 7.301 -15.904 1.00 0.00 H new ATOM 0 HG13 VAL A 71 5.560 8.991 -15.997 1.00 0.00 H new ATOM 0 HG21 VAL A 71 7.730 10.102 -14.106 1.00 0.00 H new ATOM 0 HG22 VAL A 71 6.008 10.537 -13.989 1.00 0.00 H new ATOM 0 HG23 VAL A 71 6.854 9.865 -12.575 1.00 0.00 H new ATOM 132 N ASN A 72 3.054 8.258 -14.860 1.00 0.00 N ATOM 133 CA ASN A 72 1.953 8.970 -15.499 1.00 0.00 C ATOM 134 C ASN A 72 0.923 9.418 -14.467 1.00 0.00 C ATOM 135 O ASN A 72 0.119 10.313 -14.725 1.00 0.00 O ATOM 136 CB ASN A 72 1.286 8.081 -16.550 1.00 0.00 C ATOM 137 CG ASN A 72 1.873 8.282 -17.934 1.00 0.00 C ATOM 138 OD1 ASN A 72 1.285 8.961 -18.777 1.00 0.00 O ATOM 139 ND2 ASN A 72 3.037 7.691 -18.174 1.00 0.00 N ATOM 0 H ASN A 72 3.082 7.258 -15.059 1.00 0.00 H new ATOM 0 HA ASN A 72 2.360 9.856 -15.987 1.00 0.00 H new ATOM 0 HB2 ASN A 72 1.395 7.036 -16.260 1.00 0.00 H new ATOM 0 HB3 ASN A 72 0.217 8.294 -16.577 1.00 0.00 H new ATOM 0 HD21 ASN A 72 3.481 7.790 -19.087 1.00 0.00 H new ATOM 0 HD22 ASN A 72 3.488 7.138 -17.445 1.00 0.00 H new ATOM 146 N ALA A 73 0.954 8.788 -13.297 1.00 0.00 N ATOM 147 CA ALA A 73 0.025 9.123 -12.224 1.00 0.00 C ATOM 148 C ALA A 73 0.084 10.610 -11.891 1.00 0.00 C ATOM 149 O ALA A 73 1.154 11.152 -11.611 1.00 0.00 O ATOM 150 CB ALA A 73 0.325 8.290 -10.987 1.00 0.00 C ATOM 0 H ALA A 73 1.612 8.043 -13.068 1.00 0.00 H new ATOM 0 HA ALA A 73 -0.984 8.894 -12.566 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -0.376 8.551 -10.194 1.00 0.00 H new ATOM 0 HB2 ALA A 73 0.224 7.232 -11.228 1.00 0.00 H new ATOM 0 HB3 ALA A 73 1.343 8.490 -10.652 1.00 0.00 H new ATOM 156 N LYS A 74 -1.071 11.265 -11.923 1.00 0.00 N ATOM 157 CA LYS A 74 -1.152 12.690 -11.623 1.00 0.00 C ATOM 158 C LYS A 74 -0.460 13.008 -10.301 1.00 0.00 C ATOM 159 O LYS A 74 -0.293 12.147 -9.437 1.00 0.00 O ATOM 160 CB LYS A 74 -2.614 13.138 -11.567 1.00 0.00 C ATOM 161 CG LYS A 74 -3.514 12.182 -10.805 1.00 0.00 C ATOM 162 CD LYS A 74 -4.782 12.871 -10.327 1.00 0.00 C ATOM 163 CE LYS A 74 -5.919 11.879 -10.142 1.00 0.00 C ATOM 164 NZ LYS A 74 -6.993 12.423 -9.265 1.00 0.00 N ATOM 0 H LYS A 74 -1.965 10.832 -12.154 1.00 0.00 H new ATOM 0 HA LYS A 74 -0.643 13.233 -12.419 1.00 0.00 H new ATOM 0 HB2 LYS A 74 -2.666 14.122 -11.101 1.00 0.00 H new ATOM 0 HB3 LYS A 74 -2.991 13.246 -12.584 1.00 0.00 H new ATOM 0 HG2 LYS A 74 -3.776 11.339 -11.445 1.00 0.00 H new ATOM 0 HG3 LYS A 74 -2.974 11.777 -9.949 1.00 0.00 H new ATOM 0 HD2 LYS A 74 -4.586 13.382 -9.384 1.00 0.00 H new ATOM 0 HD3 LYS A 74 -5.077 13.634 -11.048 1.00 0.00 H new ATOM 0 HE2 LYS A 74 -6.339 11.623 -11.115 1.00 0.00 H new ATOM 0 HE3 LYS A 74 -5.530 10.957 -9.710 1.00 0.00 H new ATOM 0 HZ1 LYS A 74 -7.750 11.717 -9.164 1.00 0.00 H new ATOM 0 HZ2 LYS A 74 -6.598 12.644 -8.329 1.00 0.00 H new ATOM 0 HZ3 LYS A 74 -7.382 13.289 -9.689 1.00 0.00 H new ATOM 178 N PRO A 75 -0.049 14.274 -10.137 1.00 0.00 N ATOM 179 CA PRO A 75 0.629 14.735 -8.922 1.00 0.00 C ATOM 180 C PRO A 75 -0.306 14.779 -7.718 1.00 0.00 C ATOM 181 O PRO A 75 -0.430 13.801 -6.979 1.00 0.00 O ATOM 182 CB PRO A 75 1.094 16.146 -9.289 1.00 0.00 C ATOM 183 CG PRO A 75 0.152 16.591 -10.354 1.00 0.00 C ATOM 184 CD PRO A 75 -0.215 15.353 -11.125 1.00 0.00 C ATOM 0 HA PRO A 75 1.439 14.067 -8.629 1.00 0.00 H new ATOM 0 HB2 PRO A 75 1.059 16.811 -8.426 1.00 0.00 H new ATOM 0 HB3 PRO A 75 2.123 16.143 -9.647 1.00 0.00 H new ATOM 0 HG2 PRO A 75 -0.733 17.059 -9.922 1.00 0.00 H new ATOM 0 HG3 PRO A 75 0.619 17.331 -11.004 1.00 0.00 H new ATOM 0 HD2 PRO A 75 -1.238 15.401 -11.499 1.00 0.00 H new ATOM 0 HD3 PRO A 75 0.434 15.210 -11.989 1.00 0.00 H new ATOM 192 N PHE A 76 -0.962 15.918 -7.525 1.00 0.00 N ATOM 193 CA PHE A 76 -1.886 16.089 -6.410 1.00 0.00 C ATOM 194 C PHE A 76 -2.640 17.411 -6.525 1.00 0.00 C ATOM 195 O PHE A 76 -2.571 18.090 -7.550 1.00 0.00 O ATOM 196 CB PHE A 76 -1.130 16.035 -5.081 1.00 0.00 C ATOM 197 CG PHE A 76 -0.198 17.194 -4.873 1.00 0.00 C ATOM 198 CD1 PHE A 76 0.928 17.346 -5.666 1.00 0.00 C ATOM 199 CD2 PHE A 76 -0.448 18.133 -3.885 1.00 0.00 C ATOM 200 CE1 PHE A 76 1.788 18.412 -5.479 1.00 0.00 C ATOM 201 CE2 PHE A 76 0.408 19.201 -3.693 1.00 0.00 C ATOM 202 CZ PHE A 76 1.528 19.340 -4.490 1.00 0.00 C ATOM 0 H PHE A 76 -0.871 16.737 -8.126 1.00 0.00 H new ATOM 0 HA PHE A 76 -2.609 15.274 -6.443 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -1.850 16.007 -4.263 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -0.559 15.108 -5.034 1.00 0.00 H new ATOM 0 HD1 PHE A 76 1.136 16.622 -6.440 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -1.321 18.029 -3.258 1.00 0.00 H new ATOM 0 HE1 PHE A 76 2.661 18.519 -6.105 1.00 0.00 H new ATOM 0 HE2 PHE A 76 0.201 19.927 -2.920 1.00 0.00 H new ATOM 0 HZ PHE A 76 2.199 20.173 -4.340 1.00 0.00 H new ATOM 212 N VAL A 77 -3.360 17.770 -5.467 1.00 0.00 N ATOM 213 CA VAL A 77 -4.126 19.010 -5.448 1.00 0.00 C ATOM 214 C VAL A 77 -3.508 20.023 -4.492 1.00 0.00 C ATOM 215 O VAL A 77 -3.922 20.160 -3.341 1.00 0.00 O ATOM 216 CB VAL A 77 -5.589 18.759 -5.038 1.00 0.00 C ATOM 217 CG1 VAL A 77 -6.352 20.072 -4.952 1.00 0.00 C ATOM 218 CG2 VAL A 77 -6.261 17.806 -6.016 1.00 0.00 C ATOM 0 H VAL A 77 -3.429 17.219 -4.611 1.00 0.00 H new ATOM 0 HA VAL A 77 -4.104 19.411 -6.461 1.00 0.00 H new ATOM 0 HB VAL A 77 -5.597 18.296 -4.051 1.00 0.00 H new ATOM 0 HG11 VAL A 77 -7.384 19.875 -4.661 1.00 0.00 H new ATOM 0 HG12 VAL A 77 -5.883 20.718 -4.210 1.00 0.00 H new ATOM 0 HG13 VAL A 77 -6.337 20.566 -5.924 1.00 0.00 H new ATOM 0 HG21 VAL A 77 -7.294 17.640 -5.711 1.00 0.00 H new ATOM 0 HG22 VAL A 77 -6.243 18.239 -7.016 1.00 0.00 H new ATOM 0 HG23 VAL A 77 -5.728 16.855 -6.023 1.00 0.00 H new ATOM 228 N PRO A 78 -2.492 20.752 -4.978 1.00 0.00 N ATOM 229 CA PRO A 78 -1.796 21.768 -4.182 1.00 0.00 C ATOM 230 C PRO A 78 -2.668 22.988 -3.907 1.00 0.00 C ATOM 231 O PRO A 78 -3.804 23.068 -4.372 1.00 0.00 O ATOM 232 CB PRO A 78 -0.604 22.151 -5.063 1.00 0.00 C ATOM 233 CG PRO A 78 -1.042 21.838 -6.452 1.00 0.00 C ATOM 234 CD PRO A 78 -1.947 20.642 -6.341 1.00 0.00 C ATOM 0 HA PRO A 78 -1.515 21.393 -3.198 1.00 0.00 H new ATOM 0 HB2 PRO A 78 -0.355 23.207 -4.955 1.00 0.00 H new ATOM 0 HB3 PRO A 78 0.287 21.584 -4.792 1.00 0.00 H new ATOM 0 HG2 PRO A 78 -1.566 22.684 -6.896 1.00 0.00 H new ATOM 0 HG3 PRO A 78 -0.186 21.622 -7.092 1.00 0.00 H new ATOM 0 HD2 PRO A 78 -2.736 20.664 -7.092 1.00 0.00 H new ATOM 0 HD3 PRO A 78 -1.400 19.710 -6.481 1.00 0.00 H new ATOM 242 N ASN A 79 -2.129 23.936 -3.147 1.00 0.00 N ATOM 243 CA ASN A 79 -2.860 25.152 -2.809 1.00 0.00 C ATOM 244 C ASN A 79 -2.060 26.392 -3.197 1.00 0.00 C ATOM 245 O ASN A 79 -2.167 27.438 -2.557 1.00 0.00 O ATOM 246 CB ASN A 79 -3.176 25.183 -1.313 1.00 0.00 C ATOM 247 CG ASN A 79 -1.957 25.503 -0.470 1.00 0.00 C ATOM 248 OD1 ASN A 79 -0.880 24.944 -0.679 1.00 0.00 O ATOM 249 ND2 ASN A 79 -2.121 26.408 0.488 1.00 0.00 N ATOM 0 H ASN A 79 -1.189 23.886 -2.754 1.00 0.00 H new ATOM 0 HA ASN A 79 -3.794 25.153 -3.371 1.00 0.00 H new ATOM 0 HB2 ASN A 79 -3.950 25.926 -1.124 1.00 0.00 H new ATOM 0 HB3 ASN A 79 -3.580 24.217 -1.010 1.00 0.00 H new ATOM 0 HD21 ASN A 79 -1.336 26.665 1.086 1.00 0.00 H new ATOM 0 HD22 ASN A 79 -3.032 26.846 0.625 1.00 0.00 H new ATOM 256 N VAL A 80 -1.258 26.267 -4.250 1.00 0.00 N ATOM 257 CA VAL A 80 -0.441 27.378 -4.724 1.00 0.00 C ATOM 258 C VAL A 80 -1.028 27.989 -5.992 1.00 0.00 C ATOM 259 O VAL A 80 -0.600 27.673 -7.102 1.00 0.00 O ATOM 260 CB VAL A 80 1.005 26.930 -5.006 1.00 0.00 C ATOM 261 CG1 VAL A 80 1.845 28.106 -5.483 1.00 0.00 C ATOM 262 CG2 VAL A 80 1.617 26.296 -3.766 1.00 0.00 C ATOM 0 H VAL A 80 -1.157 25.408 -4.791 1.00 0.00 H new ATOM 0 HA VAL A 80 -0.434 28.127 -3.932 1.00 0.00 H new ATOM 0 HB VAL A 80 0.987 26.182 -5.798 1.00 0.00 H new ATOM 0 HG11 VAL A 80 2.864 27.770 -5.677 1.00 0.00 H new ATOM 0 HG12 VAL A 80 1.416 28.512 -6.399 1.00 0.00 H new ATOM 0 HG13 VAL A 80 1.858 28.879 -4.715 1.00 0.00 H new ATOM 0 HG21 VAL A 80 2.639 25.985 -3.983 1.00 0.00 H new ATOM 0 HG22 VAL A 80 1.623 27.021 -2.952 1.00 0.00 H new ATOM 0 HG23 VAL A 80 1.028 25.427 -3.473 1.00 0.00 H new ATOM 272 N HIS A 81 -2.012 28.866 -5.819 1.00 0.00 N ATOM 273 CA HIS A 81 -2.658 29.524 -6.949 1.00 0.00 C ATOM 274 C HIS A 81 -1.643 30.312 -7.772 1.00 0.00 C ATOM 275 O HIS A 81 -1.611 30.212 -8.998 1.00 0.00 O ATOM 276 CB HIS A 81 -3.767 30.455 -6.459 1.00 0.00 C ATOM 277 CG HIS A 81 -4.725 30.863 -7.536 1.00 0.00 C ATOM 278 ND1 HIS A 81 -5.935 30.236 -7.744 1.00 0.00 N ATOM 279 CD2 HIS A 81 -4.646 31.844 -8.465 1.00 0.00 C ATOM 280 CE1 HIS A 81 -6.558 30.812 -8.757 1.00 0.00 C ATOM 281 NE2 HIS A 81 -5.798 31.791 -9.211 1.00 0.00 N ATOM 0 H HIS A 81 -2.379 29.137 -4.907 1.00 0.00 H new ATOM 0 HA HIS A 81 -3.095 28.754 -7.584 1.00 0.00 H new ATOM 0 HB2 HIS A 81 -4.320 29.960 -5.661 1.00 0.00 H new ATOM 0 HB3 HIS A 81 -3.316 31.349 -6.027 1.00 0.00 H new ATOM 0 HD2 HIS A 81 -3.830 32.539 -8.595 1.00 0.00 H new ATOM 0 HE1 HIS A 81 -7.525 30.530 -9.147 1.00 0.00 H new ATOM 0 HE2 HIS A 81 -6.029 32.408 -9.990 1.00 0.00 H new ATOM 289 N ALA A 82 -0.815 31.096 -7.088 1.00 0.00 N ATOM 290 CA ALA A 82 0.202 31.900 -7.755 1.00 0.00 C ATOM 291 C ALA A 82 1.289 31.018 -8.360 1.00 0.00 C ATOM 292 O ALA A 82 2.423 31.474 -8.503 1.00 0.00 O ATOM 293 CB ALA A 82 0.809 32.897 -6.780 1.00 0.00 C ATOM 0 H ALA A 82 -0.829 31.191 -6.073 1.00 0.00 H new ATOM 0 HA ALA A 82 -0.277 32.448 -8.566 1.00 0.00 H new ATOM 0 HB1 ALA A 82 1.567 33.491 -7.291 1.00 0.00 H new ATOM 0 HB2 ALA A 82 0.028 33.555 -6.399 1.00 0.00 H new ATOM 0 HB3 ALA A 82 1.268 32.361 -5.949 1.00 0.00 H new TER 299 ALA A 82 ATOM 300 N GLY B 541 12.364 19.153 13.562 1.00 0.00 N ATOM 301 CA GLY B 541 11.035 19.242 12.987 1.00 0.00 C ATOM 302 C GLY B 541 9.973 19.543 14.026 1.00 0.00 C ATOM 303 O GLY B 541 9.667 18.702 14.871 1.00 0.00 O ATOM 0 HA2 GLY B 541 11.024 20.021 12.224 1.00 0.00 H new ATOM 0 HA3 GLY B 541 10.795 18.303 12.488 1.00 0.00 H new ATOM 307 N GLN B 542 9.411 20.746 13.964 1.00 0.00 N ATOM 308 CA GLN B 542 8.379 21.156 14.909 1.00 0.00 C ATOM 309 C GLN B 542 6.988 20.929 14.327 1.00 0.00 C ATOM 310 O GLN B 542 6.798 20.972 13.112 1.00 0.00 O ATOM 311 CB GLN B 542 8.555 22.629 15.281 1.00 0.00 C ATOM 312 CG GLN B 542 8.245 23.586 14.141 1.00 0.00 C ATOM 313 CD GLN B 542 9.036 24.876 14.231 1.00 0.00 C ATOM 314 OE1 GLN B 542 10.264 24.873 14.133 1.00 0.00 O ATOM 315 NE2 GLN B 542 8.336 25.989 14.419 1.00 0.00 N ATOM 0 H GLN B 542 9.653 21.453 13.270 1.00 0.00 H new ATOM 0 HA GLN B 542 8.481 20.547 15.807 1.00 0.00 H new ATOM 0 HB2 GLN B 542 7.907 22.862 16.126 1.00 0.00 H new ATOM 0 HB3 GLN B 542 9.581 22.791 15.612 1.00 0.00 H new ATOM 0 HG2 GLN B 542 8.462 23.097 13.192 1.00 0.00 H new ATOM 0 HG3 GLN B 542 7.180 23.816 14.145 1.00 0.00 H new ATOM 0 HE21 GLN B 542 7.320 25.946 14.495 1.00 0.00 H new ATOM 0 HE22 GLN B 542 8.815 26.887 14.488 1.00 0.00 H new ATOM 324 N GLU B 543 6.017 20.688 15.204 1.00 0.00 N ATOM 325 CA GLU B 543 4.643 20.453 14.776 1.00 0.00 C ATOM 326 C GLU B 543 4.576 19.315 13.762 1.00 0.00 C ATOM 327 O GLU B 543 4.329 19.522 12.573 1.00 0.00 O ATOM 328 CB GLU B 543 4.050 21.727 14.169 1.00 0.00 C ATOM 329 CG GLU B 543 2.532 21.770 14.210 1.00 0.00 C ATOM 330 CD GLU B 543 1.998 22.267 15.540 1.00 0.00 C ATOM 331 OE1 GLU B 543 1.785 21.430 16.443 1.00 0.00 O ATOM 332 OE2 GLU B 543 1.794 23.491 15.678 1.00 0.00 O ATOM 0 H GLU B 543 6.157 20.651 16.214 1.00 0.00 H new ATOM 0 HA GLU B 543 4.060 20.170 15.652 1.00 0.00 H new ATOM 0 HB2 GLU B 543 4.444 22.592 14.703 1.00 0.00 H new ATOM 0 HB3 GLU B 543 4.380 21.814 13.134 1.00 0.00 H new ATOM 0 HG2 GLU B 543 2.169 22.418 13.412 1.00 0.00 H new ATOM 0 HG3 GLU B 543 2.139 20.772 14.015 1.00 0.00 H new ATOM 339 N PRO B 544 4.802 18.082 14.241 1.00 0.00 N ATOM 340 CA PRO B 544 4.772 16.886 13.394 1.00 0.00 C ATOM 341 C PRO B 544 3.364 16.549 12.916 1.00 0.00 C ATOM 342 O PRO B 544 2.378 16.875 13.578 1.00 0.00 O ATOM 343 CB PRO B 544 5.302 15.786 14.317 1.00 0.00 C ATOM 344 CG PRO B 544 4.991 16.263 15.693 1.00 0.00 C ATOM 345 CD PRO B 544 5.102 17.762 15.646 1.00 0.00 C ATOM 0 HA PRO B 544 5.357 17.016 12.483 1.00 0.00 H new ATOM 0 HB2 PRO B 544 4.820 14.830 14.111 1.00 0.00 H new ATOM 0 HB3 PRO B 544 6.373 15.638 14.182 1.00 0.00 H new ATOM 0 HG2 PRO B 544 3.990 15.955 15.996 1.00 0.00 H new ATOM 0 HG3 PRO B 544 5.687 15.843 16.419 1.00 0.00 H new ATOM 0 HD2 PRO B 544 4.396 18.239 16.326 1.00 0.00 H new ATOM 0 HD3 PRO B 544 6.098 18.100 15.931 1.00 0.00 H new ATOM 353 N LEU B 545 3.277 15.894 11.763 1.00 0.00 N ATOM 354 CA LEU B 545 1.989 15.512 11.196 1.00 0.00 C ATOM 355 C LEU B 545 1.321 14.431 12.041 1.00 0.00 C ATOM 356 O LEU B 545 1.967 13.786 12.867 1.00 0.00 O ATOM 357 CB LEU B 545 2.169 15.014 9.761 1.00 0.00 C ATOM 358 CG LEU B 545 0.898 14.937 8.913 1.00 0.00 C ATOM 359 CD1 LEU B 545 0.220 16.297 8.842 1.00 0.00 C ATOM 360 CD2 LEU B 545 1.219 14.426 7.516 1.00 0.00 C ATOM 0 H LEU B 545 4.083 15.617 11.203 1.00 0.00 H new ATOM 0 HA LEU B 545 1.347 16.393 11.191 1.00 0.00 H new ATOM 0 HB2 LEU B 545 2.879 15.669 9.257 1.00 0.00 H new ATOM 0 HB3 LEU B 545 2.619 14.022 9.796 1.00 0.00 H new ATOM 0 HG LEU B 545 0.211 14.235 9.386 1.00 0.00 H new ATOM 0 HD11 LEU B 545 -0.682 16.223 8.235 1.00 0.00 H new ATOM 0 HD12 LEU B 545 -0.045 16.624 9.847 1.00 0.00 H new ATOM 0 HD13 LEU B 545 0.901 17.020 8.393 1.00 0.00 H new ATOM 0 HD21 LEU B 545 0.303 14.378 6.927 1.00 0.00 H new ATOM 0 HD22 LEU B 545 1.925 15.103 7.034 1.00 0.00 H new ATOM 0 HD23 LEU B 545 1.659 13.431 7.585 1.00 0.00 H new ATOM 372 N THR B 546 0.023 14.237 11.827 1.00 0.00 N ATOM 373 CA THR B 546 -0.732 13.235 12.567 1.00 0.00 C ATOM 374 C THR B 546 -2.016 12.863 11.835 1.00 0.00 C ATOM 375 O THR B 546 -2.597 13.683 11.126 1.00 0.00 O ATOM 376 CB THR B 546 -1.086 13.730 13.982 1.00 0.00 C ATOM 377 OG1 THR B 546 -0.037 14.563 14.487 1.00 0.00 O ATOM 378 CG2 THR B 546 -1.307 12.557 14.926 1.00 0.00 C ATOM 0 H THR B 546 -0.527 14.762 11.147 1.00 0.00 H new ATOM 0 HA THR B 546 -0.095 12.354 12.647 1.00 0.00 H new ATOM 0 HB THR B 546 -2.009 14.306 13.921 1.00 0.00 H new ATOM 0 HG1 THR B 546 0.831 14.155 14.284 1.00 0.00 H new ATOM 0 HG21 THR B 546 -1.556 12.931 15.919 1.00 0.00 H new ATOM 0 HG22 THR B 546 -2.126 11.941 14.555 1.00 0.00 H new ATOM 0 HG23 THR B 546 -0.398 11.958 14.981 1.00 0.00 H new ATOM 386 N ALA B 547 -2.454 11.620 12.013 1.00 0.00 N ATOM 387 CA ALA B 547 -3.672 11.141 11.371 1.00 0.00 C ATOM 388 C ALA B 547 -4.841 12.082 11.639 1.00 0.00 C ATOM 389 O ALA B 547 -5.756 12.199 10.823 1.00 0.00 O ATOM 390 CB ALA B 547 -4.003 9.735 11.851 1.00 0.00 C ATOM 0 H ALA B 547 -1.984 10.928 12.596 1.00 0.00 H new ATOM 0 HA ALA B 547 -3.500 11.115 10.295 1.00 0.00 H new ATOM 0 HB1 ALA B 547 -4.915 9.389 11.364 1.00 0.00 H new ATOM 0 HB2 ALA B 547 -3.182 9.063 11.602 1.00 0.00 H new ATOM 0 HB3 ALA B 547 -4.150 9.744 12.931 1.00 0.00 H new ATOM 396 N SER B 548 -4.805 12.751 12.787 1.00 0.00 N ATOM 397 CA SER B 548 -5.865 13.679 13.164 1.00 0.00 C ATOM 398 C SER B 548 -6.103 14.709 12.063 1.00 0.00 C ATOM 399 O SER B 548 -7.241 15.087 11.788 1.00 0.00 O ATOM 400 CB SER B 548 -5.509 14.388 14.473 1.00 0.00 C ATOM 401 OG SER B 548 -6.456 15.396 14.781 1.00 0.00 O ATOM 0 H SER B 548 -4.054 12.668 13.472 1.00 0.00 H new ATOM 0 HA SER B 548 -6.782 13.107 13.306 1.00 0.00 H new ATOM 0 HB2 SER B 548 -5.470 13.661 15.285 1.00 0.00 H new ATOM 0 HB3 SER B 548 -4.516 14.830 14.392 1.00 0.00 H new ATOM 0 HG SER B 548 -6.207 15.833 15.622 1.00 0.00 H new ATOM 407 N MET B 549 -5.020 15.157 11.437 1.00 0.00 N ATOM 408 CA MET B 549 -5.110 16.142 10.365 1.00 0.00 C ATOM 409 C MET B 549 -6.097 15.690 9.294 1.00 0.00 C ATOM 410 O MET B 549 -7.012 16.429 8.926 1.00 0.00 O ATOM 411 CB MET B 549 -3.733 16.375 9.741 1.00 0.00 C ATOM 412 CG MET B 549 -2.892 17.396 10.490 1.00 0.00 C ATOM 413 SD MET B 549 -2.267 16.765 12.059 1.00 0.00 S ATOM 414 CE MET B 549 -1.212 18.118 12.572 1.00 0.00 C ATOM 0 H MET B 549 -4.070 14.854 11.653 1.00 0.00 H new ATOM 0 HA MET B 549 -5.469 17.078 10.794 1.00 0.00 H new ATOM 0 HB2 MET B 549 -3.194 15.428 9.706 1.00 0.00 H new ATOM 0 HB3 MET B 549 -3.861 16.707 8.711 1.00 0.00 H new ATOM 0 HG2 MET B 549 -2.052 17.698 9.864 1.00 0.00 H new ATOM 0 HG3 MET B 549 -3.490 18.289 10.674 1.00 0.00 H new ATOM 0 HE1 MET B 549 -0.751 17.877 13.530 1.00 0.00 H new ATOM 0 HE2 MET B 549 -0.434 18.276 11.825 1.00 0.00 H new ATOM 0 HE3 MET B 549 -1.807 19.025 12.673 1.00 0.00 H new ATOM 424 N LEU B 550 -5.908 14.473 8.796 1.00 0.00 N ATOM 425 CA LEU B 550 -6.782 13.923 7.766 1.00 0.00 C ATOM 426 C LEU B 550 -7.878 13.062 8.385 1.00 0.00 C ATOM 427 O LEU B 550 -8.340 12.097 7.778 1.00 0.00 O ATOM 428 CB LEU B 550 -5.969 13.095 6.769 1.00 0.00 C ATOM 429 CG LEU B 550 -5.136 13.887 5.760 1.00 0.00 C ATOM 430 CD1 LEU B 550 -3.951 14.547 6.448 1.00 0.00 C ATOM 431 CD2 LEU B 550 -4.665 12.982 4.631 1.00 0.00 C ATOM 0 H LEU B 550 -5.157 13.848 9.089 1.00 0.00 H new ATOM 0 HA LEU B 550 -7.252 14.754 7.241 1.00 0.00 H new ATOM 0 HB2 LEU B 550 -5.300 12.443 7.330 1.00 0.00 H new ATOM 0 HB3 LEU B 550 -6.654 12.451 6.218 1.00 0.00 H new ATOM 0 HG LEU B 550 -5.763 14.670 5.333 1.00 0.00 H new ATOM 0 HD11 LEU B 550 -3.370 15.106 5.715 1.00 0.00 H new ATOM 0 HD12 LEU B 550 -4.311 15.227 7.220 1.00 0.00 H new ATOM 0 HD13 LEU B 550 -3.322 13.782 6.903 1.00 0.00 H new ATOM 0 HD21 LEU B 550 -4.074 13.562 3.922 1.00 0.00 H new ATOM 0 HD22 LEU B 550 -4.054 12.178 5.040 1.00 0.00 H new ATOM 0 HD23 LEU B 550 -5.529 12.557 4.120 1.00 0.00 H new ATOM 443 N ALA B 551 -8.291 13.419 9.597 1.00 0.00 N ATOM 444 CA ALA B 551 -9.335 12.682 10.297 1.00 0.00 C ATOM 445 C ALA B 551 -10.669 13.417 10.222 1.00 0.00 C ATOM 446 O ALA B 551 -11.697 12.826 9.891 1.00 0.00 O ATOM 447 CB ALA B 551 -8.938 12.451 11.747 1.00 0.00 C ATOM 0 H ALA B 551 -7.918 14.215 10.114 1.00 0.00 H new ATOM 0 HA ALA B 551 -9.454 11.716 9.807 1.00 0.00 H new ATOM 0 HB1 ALA B 551 -9.728 11.899 12.257 1.00 0.00 H new ATOM 0 HB2 ALA B 551 -8.012 11.877 11.784 1.00 0.00 H new ATOM 0 HB3 ALA B 551 -8.789 13.411 12.241 1.00 0.00 H new ATOM 453 N SER B 552 -10.646 14.709 10.534 1.00 0.00 N ATOM 454 CA SER B 552 -11.855 15.524 10.506 1.00 0.00 C ATOM 455 C SER B 552 -11.864 16.442 9.288 1.00 0.00 C ATOM 456 O SER B 552 -12.389 17.554 9.339 1.00 0.00 O ATOM 457 CB SER B 552 -11.965 16.354 11.786 1.00 0.00 C ATOM 458 OG SER B 552 -12.340 15.546 12.888 1.00 0.00 O ATOM 0 H SER B 552 -9.803 15.214 10.809 1.00 0.00 H new ATOM 0 HA SER B 552 -12.713 14.855 10.440 1.00 0.00 H new ATOM 0 HB2 SER B 552 -11.010 16.836 11.993 1.00 0.00 H new ATOM 0 HB3 SER B 552 -12.699 17.147 11.646 1.00 0.00 H new ATOM 0 HG SER B 552 -12.402 16.100 13.694 1.00 0.00 H new ATOM 464 N ALA B 553 -11.278 15.968 8.193 1.00 0.00 N ATOM 465 CA ALA B 553 -11.220 16.745 6.961 1.00 0.00 C ATOM 466 C ALA B 553 -11.824 15.971 5.795 1.00 0.00 C ATOM 467 O ALA B 553 -11.957 14.747 5.833 1.00 0.00 O ATOM 468 CB ALA B 553 -9.782 17.134 6.651 1.00 0.00 C ATOM 0 H ALA B 553 -10.837 15.050 8.134 1.00 0.00 H new ATOM 0 HA ALA B 553 -11.808 17.652 7.104 1.00 0.00 H new ATOM 0 HB1 ALA B 553 -9.753 17.714 5.728 1.00 0.00 H new ATOM 0 HB2 ALA B 553 -9.383 17.733 7.469 1.00 0.00 H new ATOM 0 HB3 ALA B 553 -9.179 16.234 6.533 1.00 0.00 H new ATOM 474 N PRO B 554 -12.199 16.697 4.732 1.00 0.00 N ATOM 475 CA PRO B 554 -12.795 16.099 3.534 1.00 0.00 C ATOM 476 C PRO B 554 -11.791 15.273 2.738 1.00 0.00 C ATOM 477 O PRO B 554 -10.583 15.329 2.968 1.00 0.00 O ATOM 478 CB PRO B 554 -13.254 17.312 2.721 1.00 0.00 C ATOM 479 CG PRO B 554 -12.367 18.423 3.167 1.00 0.00 C ATOM 480 CD PRO B 554 -12.070 18.160 4.617 1.00 0.00 C ATOM 0 HA PRO B 554 -13.600 15.407 3.782 1.00 0.00 H new ATOM 0 HB2 PRO B 554 -13.155 17.132 1.651 1.00 0.00 H new ATOM 0 HB3 PRO B 554 -14.303 17.542 2.910 1.00 0.00 H new ATOM 0 HG2 PRO B 554 -11.449 18.449 2.579 1.00 0.00 H new ATOM 0 HG3 PRO B 554 -12.856 19.389 3.038 1.00 0.00 H new ATOM 0 HD2 PRO B 554 -11.070 18.498 4.890 1.00 0.00 H new ATOM 0 HD3 PRO B 554 -12.771 18.678 5.271 1.00 0.00 H new ATOM 488 N PRO B 555 -12.300 14.487 1.777 1.00 0.00 N ATOM 489 CA PRO B 555 -11.464 13.635 0.926 1.00 0.00 C ATOM 490 C PRO B 555 -10.615 14.444 -0.049 1.00 0.00 C ATOM 491 O PRO B 555 -9.729 13.903 -0.709 1.00 0.00 O ATOM 492 CB PRO B 555 -12.484 12.782 0.167 1.00 0.00 C ATOM 493 CG PRO B 555 -13.728 13.601 0.155 1.00 0.00 C ATOM 494 CD PRO B 555 -13.730 14.370 1.447 1.00 0.00 C ATOM 0 HA PRO B 555 -10.750 13.053 1.508 1.00 0.00 H new ATOM 0 HB2 PRO B 555 -12.143 12.565 -0.845 1.00 0.00 H new ATOM 0 HB3 PRO B 555 -12.645 11.824 0.662 1.00 0.00 H new ATOM 0 HG2 PRO B 555 -13.743 14.276 -0.701 1.00 0.00 H new ATOM 0 HG3 PRO B 555 -14.612 12.968 0.077 1.00 0.00 H new ATOM 0 HD2 PRO B 555 -14.197 15.348 1.332 1.00 0.00 H new ATOM 0 HD3 PRO B 555 -14.281 13.844 2.227 1.00 0.00 H new ATOM 502 N GLN B 556 -10.893 15.741 -0.133 1.00 0.00 N ATOM 503 CA GLN B 556 -10.154 16.623 -1.028 1.00 0.00 C ATOM 504 C GLN B 556 -9.024 17.329 -0.286 1.00 0.00 C ATOM 505 O GLN B 556 -7.915 17.459 -0.803 1.00 0.00 O ATOM 506 CB GLN B 556 -11.094 17.656 -1.651 1.00 0.00 C ATOM 507 CG GLN B 556 -10.615 18.184 -2.994 1.00 0.00 C ATOM 508 CD GLN B 556 -11.741 18.758 -3.831 1.00 0.00 C ATOM 509 OE1 GLN B 556 -11.810 19.966 -4.055 1.00 0.00 O ATOM 510 NE2 GLN B 556 -12.632 17.892 -4.299 1.00 0.00 N ATOM 0 H GLN B 556 -11.624 16.204 0.407 1.00 0.00 H new ATOM 0 HA GLN B 556 -9.719 16.013 -1.820 1.00 0.00 H new ATOM 0 HB2 GLN B 556 -12.080 17.208 -1.777 1.00 0.00 H new ATOM 0 HB3 GLN B 556 -11.209 18.492 -0.962 1.00 0.00 H new ATOM 0 HG2 GLN B 556 -9.861 18.954 -2.829 1.00 0.00 H new ATOM 0 HG3 GLN B 556 -10.132 17.378 -3.546 1.00 0.00 H new ATOM 0 HE21 GLN B 556 -12.537 16.898 -4.089 1.00 0.00 H new ATOM 0 HE22 GLN B 556 -13.412 18.220 -4.869 1.00 0.00 H new ATOM 519 N GLU B 557 -9.313 17.783 0.930 1.00 0.00 N ATOM 520 CA GLU B 557 -8.321 18.477 1.742 1.00 0.00 C ATOM 521 C GLU B 557 -7.198 17.530 2.155 1.00 0.00 C ATOM 522 O GLU B 557 -6.108 17.967 2.522 1.00 0.00 O ATOM 523 CB GLU B 557 -8.978 19.080 2.985 1.00 0.00 C ATOM 524 CG GLU B 557 -8.035 19.928 3.821 1.00 0.00 C ATOM 525 CD GLU B 557 -8.458 21.383 3.882 1.00 0.00 C ATOM 526 OE1 GLU B 557 -9.672 21.642 4.021 1.00 0.00 O ATOM 527 OE2 GLU B 557 -7.576 22.263 3.792 1.00 0.00 O ATOM 0 H GLU B 557 -10.226 17.682 1.374 1.00 0.00 H new ATOM 0 HA GLU B 557 -7.894 19.280 1.141 1.00 0.00 H new ATOM 0 HB2 GLU B 557 -9.826 19.691 2.677 1.00 0.00 H new ATOM 0 HB3 GLU B 557 -9.374 18.274 3.604 1.00 0.00 H new ATOM 0 HG2 GLU B 557 -7.989 19.524 4.832 1.00 0.00 H new ATOM 0 HG3 GLU B 557 -7.029 19.863 3.406 1.00 0.00 H new ATOM 534 N GLN B 558 -7.474 16.231 2.093 1.00 0.00 N ATOM 535 CA GLN B 558 -6.488 15.223 2.462 1.00 0.00 C ATOM 536 C GLN B 558 -5.230 15.354 1.609 1.00 0.00 C ATOM 537 O GLN B 558 -4.158 15.689 2.113 1.00 0.00 O ATOM 538 CB GLN B 558 -7.079 13.820 2.307 1.00 0.00 C ATOM 539 CG GLN B 558 -8.267 13.557 3.219 1.00 0.00 C ATOM 540 CD GLN B 558 -8.160 12.233 3.949 1.00 0.00 C ATOM 541 OE1 GLN B 558 -7.466 11.319 3.502 1.00 0.00 O ATOM 542 NE2 GLN B 558 -8.849 12.122 5.078 1.00 0.00 N ATOM 0 H GLN B 558 -8.372 15.853 1.791 1.00 0.00 H new ATOM 0 HA GLN B 558 -6.216 15.382 3.505 1.00 0.00 H new ATOM 0 HB2 GLN B 558 -7.388 13.677 1.271 1.00 0.00 H new ATOM 0 HB3 GLN B 558 -6.303 13.083 2.513 1.00 0.00 H new ATOM 0 HG2 GLN B 558 -8.347 14.364 3.948 1.00 0.00 H new ATOM 0 HG3 GLN B 558 -9.183 13.569 2.629 1.00 0.00 H new ATOM 0 HE21 GLN B 558 -9.411 12.905 5.411 1.00 0.00 H new ATOM 0 HE22 GLN B 558 -8.816 11.254 5.612 1.00 0.00 H new ATOM 551 N LYS B 559 -5.368 15.086 0.315 1.00 0.00 N ATOM 552 CA LYS B 559 -4.244 15.174 -0.609 1.00 0.00 C ATOM 553 C LYS B 559 -3.563 16.536 -0.510 1.00 0.00 C ATOM 554 O LYS B 559 -2.356 16.653 -0.718 1.00 0.00 O ATOM 555 CB LYS B 559 -4.717 14.933 -2.045 1.00 0.00 C ATOM 556 CG LYS B 559 -5.918 15.774 -2.439 1.00 0.00 C ATOM 557 CD LYS B 559 -6.379 15.459 -3.852 1.00 0.00 C ATOM 558 CE LYS B 559 -6.947 14.052 -3.953 1.00 0.00 C ATOM 559 NZ LYS B 559 -7.367 13.722 -5.343 1.00 0.00 N ATOM 0 H LYS B 559 -6.248 14.806 -0.118 1.00 0.00 H new ATOM 0 HA LYS B 559 -3.522 14.405 -0.336 1.00 0.00 H new ATOM 0 HB2 LYS B 559 -3.896 15.145 -2.729 1.00 0.00 H new ATOM 0 HB3 LYS B 559 -4.967 13.879 -2.164 1.00 0.00 H new ATOM 0 HG2 LYS B 559 -6.735 15.594 -1.740 1.00 0.00 H new ATOM 0 HG3 LYS B 559 -5.663 16.831 -2.366 1.00 0.00 H new ATOM 0 HD2 LYS B 559 -7.136 16.181 -4.158 1.00 0.00 H new ATOM 0 HD3 LYS B 559 -5.541 15.564 -4.541 1.00 0.00 H new ATOM 0 HE2 LYS B 559 -6.198 13.333 -3.620 1.00 0.00 H new ATOM 0 HE3 LYS B 559 -7.801 13.956 -3.283 1.00 0.00 H new ATOM 0 HZ1 LYS B 559 -7.749 12.755 -5.370 1.00 0.00 H new ATOM 0 HZ2 LYS B 559 -8.100 14.392 -5.653 1.00 0.00 H new ATOM 0 HZ3 LYS B 559 -6.546 13.788 -5.979 1.00 0.00 H new ATOM 573 N GLN B 560 -4.346 17.561 -0.189 1.00 0.00 N ATOM 574 CA GLN B 560 -3.817 18.914 -0.061 1.00 0.00 C ATOM 575 C GLN B 560 -2.821 19.003 1.091 1.00 0.00 C ATOM 576 O GLN B 560 -1.629 19.223 0.878 1.00 0.00 O ATOM 577 CB GLN B 560 -4.956 19.911 0.156 1.00 0.00 C ATOM 578 CG GLN B 560 -5.755 20.206 -1.103 1.00 0.00 C ATOM 579 CD GLN B 560 -7.170 20.663 -0.803 1.00 0.00 C ATOM 580 OE1 GLN B 560 -8.140 20.020 -1.204 1.00 0.00 O ATOM 581 NE2 GLN B 560 -7.294 21.779 -0.094 1.00 0.00 N ATOM 0 H GLN B 560 -5.347 17.481 -0.013 1.00 0.00 H new ATOM 0 HA GLN B 560 -3.297 19.163 -0.986 1.00 0.00 H new ATOM 0 HB2 GLN B 560 -5.629 19.521 0.920 1.00 0.00 H new ATOM 0 HB3 GLN B 560 -4.543 20.843 0.541 1.00 0.00 H new ATOM 0 HG2 GLN B 560 -5.244 20.976 -1.681 1.00 0.00 H new ATOM 0 HG3 GLN B 560 -5.790 19.311 -1.724 1.00 0.00 H new ATOM 0 HE21 GLN B 560 -6.462 22.280 0.218 1.00 0.00 H new ATOM 0 HE22 GLN B 560 -8.221 22.135 0.139 1.00 0.00 H new ATOM 590 N MET B 561 -3.318 18.830 2.311 1.00 0.00 N ATOM 591 CA MET B 561 -2.471 18.890 3.497 1.00 0.00 C ATOM 592 C MET B 561 -1.406 17.799 3.459 1.00 0.00 C ATOM 593 O MET B 561 -0.212 18.078 3.581 1.00 0.00 O ATOM 594 CB MET B 561 -3.319 18.749 4.763 1.00 0.00 C ATOM 595 CG MET B 561 -4.485 19.722 4.825 1.00 0.00 C ATOM 596 SD MET B 561 -5.589 19.394 6.213 1.00 0.00 S ATOM 597 CE MET B 561 -6.260 17.802 5.743 1.00 0.00 C ATOM 0 H MET B 561 -4.303 18.647 2.505 1.00 0.00 H new ATOM 0 HA MET B 561 -1.972 19.859 3.509 1.00 0.00 H new ATOM 0 HB2 MET B 561 -3.703 17.731 4.822 1.00 0.00 H new ATOM 0 HB3 MET B 561 -2.683 18.901 5.635 1.00 0.00 H new ATOM 0 HG2 MET B 561 -4.101 20.739 4.904 1.00 0.00 H new ATOM 0 HG3 MET B 561 -5.050 19.666 3.895 1.00 0.00 H new ATOM 0 HE1 MET B 561 -7.341 17.883 5.627 1.00 0.00 H new ATOM 0 HE2 MET B 561 -5.817 17.485 4.799 1.00 0.00 H new ATOM 0 HE3 MET B 561 -6.032 17.068 6.516 1.00 0.00 H new ATOM 607 N LEU B 562 -1.844 16.556 3.291 1.00 0.00 N ATOM 608 CA LEU B 562 -0.927 15.423 3.238 1.00 0.00 C ATOM 609 C LEU B 562 0.157 15.647 2.189 1.00 0.00 C ATOM 610 O LEU B 562 1.348 15.605 2.494 1.00 0.00 O ATOM 611 CB LEU B 562 -1.694 14.136 2.928 1.00 0.00 C ATOM 612 CG LEU B 562 -0.869 12.849 2.917 1.00 0.00 C ATOM 613 CD1 LEU B 562 -1.702 11.676 3.409 1.00 0.00 C ATOM 614 CD2 LEU B 562 -0.329 12.574 1.521 1.00 0.00 C ATOM 0 H LEU B 562 -2.828 16.307 3.189 1.00 0.00 H new ATOM 0 HA LEU B 562 -0.449 15.329 4.213 1.00 0.00 H new ATOM 0 HB2 LEU B 562 -2.492 14.026 3.663 1.00 0.00 H new ATOM 0 HB3 LEU B 562 -2.171 14.247 1.954 1.00 0.00 H new ATOM 0 HG LEU B 562 -0.024 12.976 3.594 1.00 0.00 H new ATOM 0 HD11 LEU B 562 -1.098 10.769 3.394 1.00 0.00 H new ATOM 0 HD12 LEU B 562 -2.039 11.871 4.427 1.00 0.00 H new ATOM 0 HD13 LEU B 562 -2.567 11.546 2.759 1.00 0.00 H new ATOM 0 HD21 LEU B 562 0.256 11.654 1.532 1.00 0.00 H new ATOM 0 HD22 LEU B 562 -1.160 12.467 0.824 1.00 0.00 H new ATOM 0 HD23 LEU B 562 0.305 13.403 1.206 1.00 0.00 H new ATOM 626 N GLY B 563 -0.265 15.889 0.952 1.00 0.00 N ATOM 627 CA GLY B 563 0.682 16.120 -0.123 1.00 0.00 C ATOM 628 C GLY B 563 1.581 17.311 0.142 1.00 0.00 C ATOM 629 O GLY B 563 2.791 17.242 -0.071 1.00 0.00 O ATOM 0 H GLY B 563 -1.246 15.929 0.675 1.00 0.00 H new ATOM 0 HA2 GLY B 563 1.295 15.229 -0.260 1.00 0.00 H new ATOM 0 HA3 GLY B 563 0.138 16.279 -1.054 1.00 0.00 H new ATOM 633 N GLU B 564 0.988 18.407 0.606 1.00 0.00 N ATOM 634 CA GLU B 564 1.745 19.619 0.897 1.00 0.00 C ATOM 635 C GLU B 564 2.782 19.364 1.987 1.00 0.00 C ATOM 636 O GLU B 564 3.895 19.887 1.933 1.00 0.00 O ATOM 637 CB GLU B 564 0.801 20.744 1.328 1.00 0.00 C ATOM 638 CG GLU B 564 0.102 21.430 0.167 1.00 0.00 C ATOM 639 CD GLU B 564 0.776 22.727 -0.236 1.00 0.00 C ATOM 640 OE1 GLU B 564 1.287 23.432 0.658 1.00 0.00 O ATOM 641 OE2 GLU B 564 0.794 23.036 -1.446 1.00 0.00 O ATOM 0 H GLU B 564 -0.013 18.480 0.788 1.00 0.00 H new ATOM 0 HA GLU B 564 2.266 19.919 -0.012 1.00 0.00 H new ATOM 0 HB2 GLU B 564 0.049 20.337 2.004 1.00 0.00 H new ATOM 0 HB3 GLU B 564 1.367 21.487 1.890 1.00 0.00 H new ATOM 0 HG2 GLU B 564 0.080 20.755 -0.689 1.00 0.00 H new ATOM 0 HG3 GLU B 564 -0.934 21.633 0.440 1.00 0.00 H new ATOM 648 N ARG B 565 2.408 18.557 2.975 1.00 0.00 N ATOM 649 CA ARG B 565 3.304 18.234 4.078 1.00 0.00 C ATOM 650 C ARG B 565 4.355 17.216 3.645 1.00 0.00 C ATOM 651 O ARG B 565 5.490 17.237 4.123 1.00 0.00 O ATOM 652 CB ARG B 565 2.509 17.688 5.266 1.00 0.00 C ATOM 653 CG ARG B 565 3.185 17.917 6.608 1.00 0.00 C ATOM 654 CD ARG B 565 4.022 16.717 7.022 1.00 0.00 C ATOM 655 NE ARG B 565 4.885 17.019 8.161 1.00 0.00 N ATOM 656 CZ ARG B 565 5.580 16.098 8.820 1.00 0.00 C ATOM 657 NH1 ARG B 565 5.513 14.825 8.456 1.00 0.00 N ATOM 658 NH2 ARG B 565 6.344 16.451 9.846 1.00 0.00 N ATOM 0 H ARG B 565 1.491 18.115 3.034 1.00 0.00 H new ATOM 0 HA ARG B 565 3.813 19.150 4.380 1.00 0.00 H new ATOM 0 HB2 ARG B 565 1.525 18.156 5.280 1.00 0.00 H new ATOM 0 HB3 ARG B 565 2.351 16.619 5.126 1.00 0.00 H new ATOM 0 HG2 ARG B 565 3.819 18.802 6.551 1.00 0.00 H new ATOM 0 HG3 ARG B 565 2.429 18.115 7.368 1.00 0.00 H new ATOM 0 HD2 ARG B 565 3.364 15.886 7.276 1.00 0.00 H new ATOM 0 HD3 ARG B 565 4.633 16.393 6.180 1.00 0.00 H new ATOM 0 HE ARG B 565 4.958 17.989 8.467 1.00 0.00 H new ATOM 0 HH11 ARG B 565 4.927 14.550 7.668 1.00 0.00 H new ATOM 0 HH12 ARG B 565 6.048 14.120 8.964 1.00 0.00 H new ATOM 0 HH21 ARG B 565 6.398 17.430 10.129 1.00 0.00 H new ATOM 0 HH22 ARG B 565 6.877 15.744 10.352 1.00 0.00 H new ATOM 672 N LEU B 566 3.970 16.326 2.737 1.00 0.00 N ATOM 673 CA LEU B 566 4.878 15.299 2.239 1.00 0.00 C ATOM 674 C LEU B 566 5.876 15.889 1.246 1.00 0.00 C ATOM 675 O LEU B 566 6.975 15.364 1.070 1.00 0.00 O ATOM 676 CB LEU B 566 4.088 14.170 1.575 1.00 0.00 C ATOM 677 CG LEU B 566 4.062 12.838 2.325 1.00 0.00 C ATOM 678 CD1 LEU B 566 2.828 12.748 3.210 1.00 0.00 C ATOM 679 CD2 LEU B 566 4.104 11.673 1.347 1.00 0.00 C ATOM 0 H LEU B 566 3.035 16.295 2.331 1.00 0.00 H new ATOM 0 HA LEU B 566 5.432 14.897 3.087 1.00 0.00 H new ATOM 0 HB2 LEU B 566 3.060 14.506 1.436 1.00 0.00 H new ATOM 0 HB3 LEU B 566 4.504 13.997 0.583 1.00 0.00 H new ATOM 0 HG LEU B 566 4.946 12.784 2.961 1.00 0.00 H new ATOM 0 HD11 LEU B 566 2.826 11.793 3.736 1.00 0.00 H new ATOM 0 HD12 LEU B 566 2.840 13.562 3.935 1.00 0.00 H new ATOM 0 HD13 LEU B 566 1.932 12.824 2.594 1.00 0.00 H new ATOM 0 HD21 LEU B 566 4.085 10.733 1.899 1.00 0.00 H new ATOM 0 HD22 LEU B 566 3.240 11.722 0.685 1.00 0.00 H new ATOM 0 HD23 LEU B 566 5.018 11.727 0.755 1.00 0.00 H new ATOM 691 N PHE B 567 5.485 16.984 0.603 1.00 0.00 N ATOM 692 CA PHE B 567 6.345 17.647 -0.371 1.00 0.00 C ATOM 693 C PHE B 567 7.741 17.873 0.202 1.00 0.00 C ATOM 694 O PHE B 567 8.745 17.416 -0.345 1.00 0.00 O ATOM 695 CB PHE B 567 5.734 18.983 -0.797 1.00 0.00 C ATOM 696 CG PHE B 567 6.751 19.989 -1.253 1.00 0.00 C ATOM 697 CD1 PHE B 567 7.646 19.679 -2.264 1.00 0.00 C ATOM 698 CD2 PHE B 567 6.813 21.245 -0.671 1.00 0.00 C ATOM 699 CE1 PHE B 567 8.583 20.603 -2.687 1.00 0.00 C ATOM 700 CE2 PHE B 567 7.747 22.173 -1.089 1.00 0.00 C ATOM 701 CZ PHE B 567 8.635 21.851 -2.098 1.00 0.00 C ATOM 0 H PHE B 567 4.578 17.431 0.739 1.00 0.00 H new ATOM 0 HA PHE B 567 6.430 17.000 -1.244 1.00 0.00 H new ATOM 0 HB2 PHE B 567 5.022 18.807 -1.603 1.00 0.00 H new ATOM 0 HB3 PHE B 567 5.172 19.400 0.039 1.00 0.00 H new ATOM 0 HD1 PHE B 567 7.611 18.704 -2.727 1.00 0.00 H new ATOM 0 HD2 PHE B 567 6.123 21.502 0.119 1.00 0.00 H new ATOM 0 HE1 PHE B 567 9.274 20.349 -3.477 1.00 0.00 H new ATOM 0 HE2 PHE B 567 7.783 23.149 -0.628 1.00 0.00 H new ATOM 0 HZ PHE B 567 9.368 22.574 -2.425 1.00 0.00 H new ATOM 711 N PRO B 568 7.808 18.595 1.330 1.00 0.00 N ATOM 712 CA PRO B 568 9.074 18.899 2.002 1.00 0.00 C ATOM 713 C PRO B 568 9.703 17.665 2.640 1.00 0.00 C ATOM 714 O PRO B 568 10.904 17.428 2.506 1.00 0.00 O ATOM 715 CB PRO B 568 8.672 19.910 3.078 1.00 0.00 C ATOM 716 CG PRO B 568 7.234 19.626 3.346 1.00 0.00 C ATOM 717 CD PRO B 568 6.651 19.171 2.037 1.00 0.00 C ATOM 0 HA PRO B 568 9.824 19.273 1.306 1.00 0.00 H new ATOM 0 HB2 PRO B 568 9.274 19.790 3.979 1.00 0.00 H new ATOM 0 HB3 PRO B 568 8.816 20.934 2.733 1.00 0.00 H new ATOM 0 HG2 PRO B 568 7.124 18.857 4.111 1.00 0.00 H new ATOM 0 HG3 PRO B 568 6.722 20.516 3.713 1.00 0.00 H new ATOM 0 HD2 PRO B 568 5.862 18.434 2.183 1.00 0.00 H new ATOM 0 HD3 PRO B 568 6.213 20.001 1.482 1.00 0.00 H new ATOM 725 N LEU B 569 8.884 16.881 3.332 1.00 0.00 N ATOM 726 CA LEU B 569 9.360 15.669 3.991 1.00 0.00 C ATOM 727 C LEU B 569 10.138 14.790 3.017 1.00 0.00 C ATOM 728 O LEU B 569 11.099 14.122 3.401 1.00 0.00 O ATOM 729 CB LEU B 569 8.183 14.886 4.574 1.00 0.00 C ATOM 730 CG LEU B 569 8.481 14.059 5.825 1.00 0.00 C ATOM 731 CD1 LEU B 569 9.488 12.963 5.513 1.00 0.00 C ATOM 732 CD2 LEU B 569 8.991 14.952 6.946 1.00 0.00 C ATOM 0 H LEU B 569 7.887 17.062 3.452 1.00 0.00 H new ATOM 0 HA LEU B 569 10.029 15.963 4.800 1.00 0.00 H new ATOM 0 HB2 LEU B 569 7.385 15.590 4.810 1.00 0.00 H new ATOM 0 HB3 LEU B 569 7.800 14.217 3.803 1.00 0.00 H new ATOM 0 HG LEU B 569 7.555 13.589 6.156 1.00 0.00 H new ATOM 0 HD11 LEU B 569 9.688 12.385 6.415 1.00 0.00 H new ATOM 0 HD12 LEU B 569 9.084 12.306 4.743 1.00 0.00 H new ATOM 0 HD13 LEU B 569 10.415 13.412 5.157 1.00 0.00 H new ATOM 0 HD21 LEU B 569 9.198 14.346 7.828 1.00 0.00 H new ATOM 0 HD22 LEU B 569 9.906 15.451 6.626 1.00 0.00 H new ATOM 0 HD23 LEU B 569 8.235 15.699 7.188 1.00 0.00 H new ATOM 744 N ILE B 570 9.718 14.797 1.757 1.00 0.00 N ATOM 745 CA ILE B 570 10.378 14.002 0.728 1.00 0.00 C ATOM 746 C ILE B 570 11.687 14.650 0.289 1.00 0.00 C ATOM 747 O ILE B 570 12.639 13.961 -0.076 1.00 0.00 O ATOM 748 CB ILE B 570 9.473 13.813 -0.504 1.00 0.00 C ATOM 749 CG1 ILE B 570 8.288 12.909 -0.159 1.00 0.00 C ATOM 750 CG2 ILE B 570 10.270 13.233 -1.662 1.00 0.00 C ATOM 751 CD1 ILE B 570 7.225 12.869 -1.235 1.00 0.00 C ATOM 0 H ILE B 570 8.924 15.344 1.424 1.00 0.00 H new ATOM 0 HA ILE B 570 10.587 13.027 1.168 1.00 0.00 H new ATOM 0 HB ILE B 570 9.087 14.786 -0.806 1.00 0.00 H new ATOM 0 HG12 ILE B 570 8.653 11.897 0.018 1.00 0.00 H new ATOM 0 HG13 ILE B 570 7.838 13.253 0.772 1.00 0.00 H new ATOM 0 HG21 ILE B 570 9.617 13.105 -2.525 1.00 0.00 H new ATOM 0 HG22 ILE B 570 11.083 13.911 -1.920 1.00 0.00 H new ATOM 0 HG23 ILE B 570 10.682 12.266 -1.372 1.00 0.00 H new ATOM 0 HD11 ILE B 570 6.416 12.209 -0.923 1.00 0.00 H new ATOM 0 HD12 ILE B 570 6.833 13.873 -1.396 1.00 0.00 H new ATOM 0 HD13 ILE B 570 7.660 12.496 -2.162 1.00 0.00 H new ATOM 763 N GLN B 571 11.726 15.978 0.328 1.00 0.00 N ATOM 764 CA GLN B 571 12.919 16.718 -0.065 1.00 0.00 C ATOM 765 C GLN B 571 14.113 16.325 0.799 1.00 0.00 C ATOM 766 O GLN B 571 15.264 16.548 0.424 1.00 0.00 O ATOM 767 CB GLN B 571 12.670 18.223 0.043 1.00 0.00 C ATOM 768 CG GLN B 571 11.630 18.739 -0.939 1.00 0.00 C ATOM 769 CD GLN B 571 11.801 20.213 -1.250 1.00 0.00 C ATOM 770 OE1 GLN B 571 12.549 20.586 -2.154 1.00 0.00 O ATOM 771 NE2 GLN B 571 11.107 21.061 -0.499 1.00 0.00 N ATOM 0 H GLN B 571 10.946 16.563 0.627 1.00 0.00 H new ATOM 0 HA GLN B 571 13.146 16.468 -1.101 1.00 0.00 H new ATOM 0 HB2 GLN B 571 12.348 18.458 1.057 1.00 0.00 H new ATOM 0 HB3 GLN B 571 13.609 18.751 -0.124 1.00 0.00 H new ATOM 0 HG2 GLN B 571 11.694 18.167 -1.864 1.00 0.00 H new ATOM 0 HG3 GLN B 571 10.634 18.571 -0.529 1.00 0.00 H new ATOM 0 HE21 GLN B 571 10.499 20.708 0.240 1.00 0.00 H new ATOM 0 HE22 GLN B 571 11.182 22.065 -0.661 1.00 0.00 H new ATOM 780 N ALA B 572 13.831 15.740 1.959 1.00 0.00 N ATOM 781 CA ALA B 572 14.881 15.315 2.876 1.00 0.00 C ATOM 782 C ALA B 572 15.916 14.452 2.163 1.00 0.00 C ATOM 783 O ALA B 572 17.081 14.411 2.557 1.00 0.00 O ATOM 784 CB ALA B 572 14.281 14.559 4.052 1.00 0.00 C ATOM 0 H ALA B 572 12.884 15.550 2.286 1.00 0.00 H new ATOM 0 HA ALA B 572 15.385 16.206 3.250 1.00 0.00 H new ATOM 0 HB1 ALA B 572 15.077 14.248 4.729 1.00 0.00 H new ATOM 0 HB2 ALA B 572 13.585 15.207 4.584 1.00 0.00 H new ATOM 0 HB3 ALA B 572 13.751 13.680 3.687 1.00 0.00 H new ATOM 790 N MET B 573 15.483 13.763 1.112 1.00 0.00 N ATOM 791 CA MET B 573 16.373 12.900 0.344 1.00 0.00 C ATOM 792 C MET B 573 16.343 13.268 -1.136 1.00 0.00 C ATOM 793 O MET B 573 17.367 13.220 -1.819 1.00 0.00 O ATOM 794 CB MET B 573 15.978 11.433 0.525 1.00 0.00 C ATOM 795 CG MET B 573 14.500 11.169 0.294 1.00 0.00 C ATOM 796 SD MET B 573 13.719 10.324 1.682 1.00 0.00 S ATOM 797 CE MET B 573 12.640 11.613 2.300 1.00 0.00 C ATOM 0 H MET B 573 14.521 13.786 0.773 1.00 0.00 H new ATOM 0 HA MET B 573 17.388 13.044 0.716 1.00 0.00 H new ATOM 0 HB2 MET B 573 16.560 10.821 -0.164 1.00 0.00 H new ATOM 0 HB3 MET B 573 16.242 11.116 1.534 1.00 0.00 H new ATOM 0 HG2 MET B 573 13.989 12.116 0.116 1.00 0.00 H new ATOM 0 HG3 MET B 573 14.379 10.568 -0.607 1.00 0.00 H new ATOM 0 HE1 MET B 573 12.701 11.648 3.388 1.00 0.00 H new ATOM 0 HE2 MET B 573 12.948 12.574 1.888 1.00 0.00 H new ATOM 0 HE3 MET B 573 11.613 11.403 2.001 1.00 0.00 H new ATOM 807 N HIS B 574 15.164 13.637 -1.626 1.00 0.00 N ATOM 808 CA HIS B 574 15.001 14.013 -3.026 1.00 0.00 C ATOM 809 C HIS B 574 14.305 15.365 -3.147 1.00 0.00 C ATOM 810 O HIS B 574 13.122 15.454 -3.479 1.00 0.00 O ATOM 811 CB HIS B 574 14.202 12.946 -3.774 1.00 0.00 C ATOM 812 CG HIS B 574 15.040 11.806 -4.266 1.00 0.00 C ATOM 813 ND1 HIS B 574 15.187 10.624 -3.571 1.00 0.00 N ATOM 814 CD2 HIS B 574 15.776 11.671 -5.394 1.00 0.00 C ATOM 815 CE1 HIS B 574 15.979 9.813 -4.248 1.00 0.00 C ATOM 816 NE2 HIS B 574 16.349 10.424 -5.359 1.00 0.00 N ATOM 0 H HIS B 574 14.307 13.684 -1.074 1.00 0.00 H new ATOM 0 HA HIS B 574 15.992 14.092 -3.473 1.00 0.00 H new ATOM 0 HB2 HIS B 574 13.425 12.557 -3.116 1.00 0.00 H new ATOM 0 HB3 HIS B 574 13.699 13.409 -4.623 1.00 0.00 H new ATOM 0 HD2 HIS B 574 15.891 12.407 -6.176 1.00 0.00 H new ATOM 0 HE1 HIS B 574 16.274 8.819 -3.945 1.00 0.00 H new ATOM 0 HE2 HIS B 574 16.961 10.033 -6.075 1.00 0.00 H new ATOM 824 N PRO B 575 15.053 16.444 -2.872 1.00 0.00 N ATOM 825 CA PRO B 575 14.528 17.811 -2.943 1.00 0.00 C ATOM 826 C PRO B 575 14.247 18.250 -4.376 1.00 0.00 C ATOM 827 O PRO B 575 13.671 19.313 -4.610 1.00 0.00 O ATOM 828 CB PRO B 575 15.651 18.654 -2.336 1.00 0.00 C ATOM 829 CG PRO B 575 16.888 17.854 -2.556 1.00 0.00 C ATOM 830 CD PRO B 575 16.469 16.412 -2.470 1.00 0.00 C ATOM 0 HA PRO B 575 13.575 17.909 -2.424 1.00 0.00 H new ATOM 0 HB2 PRO B 575 15.719 19.629 -2.819 1.00 0.00 H new ATOM 0 HB3 PRO B 575 15.480 18.835 -1.275 1.00 0.00 H new ATOM 0 HG2 PRO B 575 17.328 18.075 -3.528 1.00 0.00 H new ATOM 0 HG3 PRO B 575 17.642 18.087 -1.804 1.00 0.00 H new ATOM 0 HD2 PRO B 575 17.061 15.781 -3.133 1.00 0.00 H new ATOM 0 HD3 PRO B 575 16.592 16.017 -1.461 1.00 0.00 H new ATOM 838 N THR B 576 14.658 17.425 -5.335 1.00 0.00 N ATOM 839 CA THR B 576 14.452 17.728 -6.745 1.00 0.00 C ATOM 840 C THR B 576 13.260 16.959 -7.304 1.00 0.00 C ATOM 841 O THR B 576 12.415 17.524 -8.000 1.00 0.00 O ATOM 842 CB THR B 576 15.702 17.394 -7.580 1.00 0.00 C ATOM 843 OG1 THR B 576 16.337 16.219 -7.063 1.00 0.00 O ATOM 844 CG2 THR B 576 16.685 18.554 -7.571 1.00 0.00 C ATOM 0 H THR B 576 15.136 16.541 -5.160 1.00 0.00 H new ATOM 0 HA THR B 576 14.255 18.798 -6.813 1.00 0.00 H new ATOM 0 HB THR B 576 15.388 17.214 -8.608 1.00 0.00 H new ATOM 0 HG1 THR B 576 17.130 16.012 -7.600 1.00 0.00 H new ATOM 0 HG21 THR B 576 17.560 18.294 -8.167 1.00 0.00 H new ATOM 0 HG22 THR B 576 16.208 19.439 -7.993 1.00 0.00 H new ATOM 0 HG23 THR B 576 16.993 18.762 -6.546 1.00 0.00 H new ATOM 852 N LEU B 577 13.197 15.669 -6.995 1.00 0.00 N ATOM 853 CA LEU B 577 12.107 14.822 -7.467 1.00 0.00 C ATOM 854 C LEU B 577 10.979 14.765 -6.442 1.00 0.00 C ATOM 855 O LEU B 577 10.105 13.901 -6.513 1.00 0.00 O ATOM 856 CB LEU B 577 12.620 13.410 -7.757 1.00 0.00 C ATOM 857 CG LEU B 577 13.636 13.286 -8.893 1.00 0.00 C ATOM 858 CD1 LEU B 577 13.171 14.066 -10.113 1.00 0.00 C ATOM 859 CD2 LEU B 577 15.006 13.768 -8.439 1.00 0.00 C ATOM 0 H LEU B 577 13.887 15.186 -6.420 1.00 0.00 H new ATOM 0 HA LEU B 577 11.716 15.255 -8.387 1.00 0.00 H new ATOM 0 HB2 LEU B 577 13.072 13.015 -6.847 1.00 0.00 H new ATOM 0 HB3 LEU B 577 11.765 12.775 -7.990 1.00 0.00 H new ATOM 0 HG LEU B 577 13.717 12.235 -9.169 1.00 0.00 H new ATOM 0 HD11 LEU B 577 13.907 13.966 -10.911 1.00 0.00 H new ATOM 0 HD12 LEU B 577 12.212 13.674 -10.452 1.00 0.00 H new ATOM 0 HD13 LEU B 577 13.060 15.118 -9.852 1.00 0.00 H new ATOM 0 HD21 LEU B 577 15.716 13.672 -9.260 1.00 0.00 H new ATOM 0 HD22 LEU B 577 14.942 14.813 -8.135 1.00 0.00 H new ATOM 0 HD23 LEU B 577 15.343 13.165 -7.596 1.00 0.00 H new ATOM 871 N ALA B 578 11.005 15.691 -5.489 1.00 0.00 N ATOM 872 CA ALA B 578 9.982 15.749 -4.452 1.00 0.00 C ATOM 873 C ALA B 578 8.585 15.808 -5.060 1.00 0.00 C ATOM 874 O ALA B 578 7.731 14.975 -4.760 1.00 0.00 O ATOM 875 CB ALA B 578 10.217 16.948 -3.546 1.00 0.00 C ATOM 0 H ALA B 578 11.723 16.411 -5.414 1.00 0.00 H new ATOM 0 HA ALA B 578 10.051 14.838 -3.857 1.00 0.00 H new ATOM 0 HB1 ALA B 578 9.446 16.979 -2.776 1.00 0.00 H new ATOM 0 HB2 ALA B 578 11.196 16.862 -3.075 1.00 0.00 H new ATOM 0 HB3 ALA B 578 10.177 17.863 -4.136 1.00 0.00 H new ATOM 881 N GLY B 579 8.360 16.799 -5.918 1.00 0.00 N ATOM 882 CA GLY B 579 7.064 16.948 -6.554 1.00 0.00 C ATOM 883 C GLY B 579 6.571 15.657 -7.176 1.00 0.00 C ATOM 884 O GLY B 579 5.441 15.232 -6.932 1.00 0.00 O ATOM 0 H GLY B 579 9.051 17.500 -6.184 1.00 0.00 H new ATOM 0 HA2 GLY B 579 6.339 17.293 -5.817 1.00 0.00 H new ATOM 0 HA3 GLY B 579 7.127 17.717 -7.323 1.00 0.00 H new ATOM 888 N LYS B 580 7.419 15.030 -7.984 1.00 0.00 N ATOM 889 CA LYS B 580 7.065 13.779 -8.645 1.00 0.00 C ATOM 890 C LYS B 580 6.798 12.680 -7.621 1.00 0.00 C ATOM 891 O LYS B 580 5.782 11.988 -7.689 1.00 0.00 O ATOM 892 CB LYS B 580 8.183 13.345 -9.595 1.00 0.00 C ATOM 893 CG LYS B 580 8.425 14.320 -10.734 1.00 0.00 C ATOM 894 CD LYS B 580 9.313 13.713 -11.808 1.00 0.00 C ATOM 895 CE LYS B 580 8.744 13.948 -13.199 1.00 0.00 C ATOM 896 NZ LYS B 580 8.501 15.393 -13.462 1.00 0.00 N ATOM 0 H LYS B 580 8.357 15.368 -8.197 1.00 0.00 H new ATOM 0 HA LYS B 580 6.154 13.946 -9.220 1.00 0.00 H new ATOM 0 HB2 LYS B 580 9.106 13.227 -9.027 1.00 0.00 H new ATOM 0 HB3 LYS B 580 7.937 12.368 -10.010 1.00 0.00 H new ATOM 0 HG2 LYS B 580 7.471 14.613 -11.172 1.00 0.00 H new ATOM 0 HG3 LYS B 580 8.890 15.226 -10.346 1.00 0.00 H new ATOM 0 HD2 LYS B 580 10.311 14.146 -11.744 1.00 0.00 H new ATOM 0 HD3 LYS B 580 9.418 12.642 -11.633 1.00 0.00 H new ATOM 0 HE2 LYS B 580 9.434 13.554 -13.945 1.00 0.00 H new ATOM 0 HE3 LYS B 580 7.810 13.397 -13.307 1.00 0.00 H new ATOM 0 HZ1 LYS B 580 8.377 15.544 -14.483 1.00 0.00 H new ATOM 0 HZ2 LYS B 580 7.643 15.698 -12.960 1.00 0.00 H new ATOM 0 HZ3 LYS B 580 9.314 15.948 -13.126 1.00 0.00 H new ATOM 910 N ILE B 581 7.716 12.525 -6.673 1.00 0.00 N ATOM 911 CA ILE B 581 7.578 11.512 -5.634 1.00 0.00 C ATOM 912 C ILE B 581 6.261 11.672 -4.882 1.00 0.00 C ATOM 913 O ILE B 581 5.426 10.767 -4.871 1.00 0.00 O ATOM 914 CB ILE B 581 8.742 11.575 -4.628 1.00 0.00 C ATOM 915 CG1 ILE B 581 10.068 11.274 -5.328 1.00 0.00 C ATOM 916 CG2 ILE B 581 8.507 10.600 -3.484 1.00 0.00 C ATOM 917 CD1 ILE B 581 11.260 11.942 -4.680 1.00 0.00 C ATOM 0 H ILE B 581 8.564 13.088 -6.603 1.00 0.00 H new ATOM 0 HA ILE B 581 7.593 10.543 -6.134 1.00 0.00 H new ATOM 0 HB ILE B 581 8.792 12.583 -4.216 1.00 0.00 H new ATOM 0 HG12 ILE B 581 10.227 10.196 -5.338 1.00 0.00 H new ATOM 0 HG13 ILE B 581 10.002 11.596 -6.367 1.00 0.00 H new ATOM 0 HG21 ILE B 581 9.338 10.656 -2.781 1.00 0.00 H new ATOM 0 HG22 ILE B 581 7.580 10.857 -2.971 1.00 0.00 H new ATOM 0 HG23 ILE B 581 8.434 9.587 -3.879 1.00 0.00 H new ATOM 0 HD11 ILE B 581 12.165 11.684 -5.230 1.00 0.00 H new ATOM 0 HD12 ILE B 581 11.123 13.023 -4.694 1.00 0.00 H new ATOM 0 HD13 ILE B 581 11.352 11.601 -3.649 1.00 0.00 H new ATOM 929 N THR B 582 6.081 12.830 -4.255 1.00 0.00 N ATOM 930 CA THR B 582 4.865 13.110 -3.501 1.00 0.00 C ATOM 931 C THR B 582 3.627 12.959 -4.378 1.00 0.00 C ATOM 932 O THR B 582 2.563 12.562 -3.904 1.00 0.00 O ATOM 933 CB THR B 582 4.888 14.530 -2.905 1.00 0.00 C ATOM 934 OG1 THR B 582 3.843 14.672 -1.936 1.00 0.00 O ATOM 935 CG2 THR B 582 4.720 15.577 -3.996 1.00 0.00 C ATOM 0 H THR B 582 6.762 13.589 -4.254 1.00 0.00 H new ATOM 0 HA THR B 582 4.822 12.384 -2.689 1.00 0.00 H new ATOM 0 HB THR B 582 5.853 14.682 -2.422 1.00 0.00 H new ATOM 0 HG1 THR B 582 3.961 15.514 -1.448 1.00 0.00 H new ATOM 0 HG21 THR B 582 4.739 16.572 -3.551 1.00 0.00 H new ATOM 0 HG22 THR B 582 5.533 15.486 -4.716 1.00 0.00 H new ATOM 0 HG23 THR B 582 3.767 15.425 -4.503 1.00 0.00 H new ATOM 943 N GLY B 583 3.774 13.276 -5.661 1.00 0.00 N ATOM 944 CA GLY B 583 2.659 13.168 -6.583 1.00 0.00 C ATOM 945 C GLY B 583 2.141 11.749 -6.704 1.00 0.00 C ATOM 946 O GLY B 583 0.979 11.478 -6.406 1.00 0.00 O ATOM 0 H GLY B 583 4.645 13.605 -6.078 1.00 0.00 H new ATOM 0 HA2 GLY B 583 1.851 13.819 -6.249 1.00 0.00 H new ATOM 0 HA3 GLY B 583 2.969 13.523 -7.566 1.00 0.00 H new ATOM 950 N MET B 584 3.006 10.841 -7.144 1.00 0.00 N ATOM 951 CA MET B 584 2.629 9.441 -7.304 1.00 0.00 C ATOM 952 C MET B 584 2.262 8.820 -5.960 1.00 0.00 C ATOM 953 O MET B 584 1.256 8.120 -5.843 1.00 0.00 O ATOM 954 CB MET B 584 3.772 8.653 -7.948 1.00 0.00 C ATOM 955 CG MET B 584 4.258 9.250 -9.259 1.00 0.00 C ATOM 956 SD MET B 584 5.857 8.591 -9.771 1.00 0.00 S ATOM 957 CE MET B 584 6.932 9.307 -8.530 1.00 0.00 C ATOM 0 H MET B 584 3.972 11.049 -7.396 1.00 0.00 H new ATOM 0 HA MET B 584 1.756 9.398 -7.955 1.00 0.00 H new ATOM 0 HB2 MET B 584 4.607 8.603 -7.249 1.00 0.00 H new ATOM 0 HB3 MET B 584 3.442 7.629 -8.124 1.00 0.00 H new ATOM 0 HG2 MET B 584 3.522 9.053 -10.038 1.00 0.00 H new ATOM 0 HG3 MET B 584 4.332 10.333 -9.156 1.00 0.00 H new ATOM 0 HE1 MET B 584 7.900 8.806 -8.554 1.00 0.00 H new ATOM 0 HE2 MET B 584 7.068 10.369 -8.735 1.00 0.00 H new ATOM 0 HE3 MET B 584 6.483 9.182 -7.544 1.00 0.00 H new ATOM 967 N LEU B 585 3.084 9.080 -4.949 1.00 0.00 N ATOM 968 CA LEU B 585 2.845 8.546 -3.613 1.00 0.00 C ATOM 969 C LEU B 585 1.493 9.004 -3.077 1.00 0.00 C ATOM 970 O LEU B 585 0.841 8.290 -2.314 1.00 0.00 O ATOM 971 CB LEU B 585 3.959 8.985 -2.660 1.00 0.00 C ATOM 972 CG LEU B 585 5.160 8.046 -2.554 1.00 0.00 C ATOM 973 CD1 LEU B 585 5.697 7.708 -3.936 1.00 0.00 C ATOM 974 CD2 LEU B 585 6.250 8.669 -1.694 1.00 0.00 C ATOM 0 H LEU B 585 3.921 9.657 -5.029 1.00 0.00 H new ATOM 0 HA LEU B 585 2.839 7.458 -3.679 1.00 0.00 H new ATOM 0 HB2 LEU B 585 4.316 9.965 -2.977 1.00 0.00 H new ATOM 0 HB3 LEU B 585 3.531 9.109 -1.665 1.00 0.00 H new ATOM 0 HG LEU B 585 4.833 7.122 -2.078 1.00 0.00 H new ATOM 0 HD11 LEU B 585 6.552 7.039 -3.840 1.00 0.00 H new ATOM 0 HD12 LEU B 585 4.917 7.219 -4.520 1.00 0.00 H new ATOM 0 HD13 LEU B 585 6.008 8.623 -4.440 1.00 0.00 H new ATOM 0 HD21 LEU B 585 7.097 7.986 -1.630 1.00 0.00 H new ATOM 0 HD22 LEU B 585 6.574 9.609 -2.142 1.00 0.00 H new ATOM 0 HD23 LEU B 585 5.860 8.859 -0.694 1.00 0.00 H new ATOM 986 N LEU B 586 1.075 10.198 -3.482 1.00 0.00 N ATOM 987 CA LEU B 586 -0.202 10.752 -3.045 1.00 0.00 C ATOM 988 C LEU B 586 -1.355 10.167 -3.854 1.00 0.00 C ATOM 989 O LEU B 586 -2.508 10.208 -3.428 1.00 0.00 O ATOM 990 CB LEU B 586 -0.192 12.275 -3.177 1.00 0.00 C ATOM 991 CG LEU B 586 -1.509 12.985 -2.858 1.00 0.00 C ATOM 992 CD1 LEU B 586 -1.246 14.303 -2.147 1.00 0.00 C ATOM 993 CD2 LEU B 586 -2.313 13.215 -4.130 1.00 0.00 C ATOM 0 H LEU B 586 1.602 10.802 -4.113 1.00 0.00 H new ATOM 0 HA LEU B 586 -0.346 10.486 -1.998 1.00 0.00 H new ATOM 0 HB2 LEU B 586 0.580 12.672 -2.518 1.00 0.00 H new ATOM 0 HB3 LEU B 586 0.097 12.529 -4.197 1.00 0.00 H new ATOM 0 HG LEU B 586 -2.092 12.347 -2.194 1.00 0.00 H new ATOM 0 HD11 LEU B 586 -2.194 14.794 -1.928 1.00 0.00 H new ATOM 0 HD12 LEU B 586 -0.712 14.114 -1.216 1.00 0.00 H new ATOM 0 HD13 LEU B 586 -0.643 14.947 -2.787 1.00 0.00 H new ATOM 0 HD21 LEU B 586 -3.247 13.721 -3.884 1.00 0.00 H new ATOM 0 HD22 LEU B 586 -1.736 13.833 -4.818 1.00 0.00 H new ATOM 0 HD23 LEU B 586 -2.533 12.256 -4.600 1.00 0.00 H new ATOM 1005 N GLU B 587 -1.033 9.621 -5.023 1.00 0.00 N ATOM 1006 CA GLU B 587 -2.043 9.026 -5.891 1.00 0.00 C ATOM 1007 C GLU B 587 -2.460 7.651 -5.378 1.00 0.00 C ATOM 1008 O GLU B 587 -3.635 7.413 -5.095 1.00 0.00 O ATOM 1009 CB GLU B 587 -1.512 8.909 -7.322 1.00 0.00 C ATOM 1010 CG GLU B 587 -2.502 8.280 -8.288 1.00 0.00 C ATOM 1011 CD GLU B 587 -3.897 8.857 -8.153 1.00 0.00 C ATOM 1012 OE1 GLU B 587 -4.013 10.084 -7.947 1.00 0.00 O ATOM 1013 OE2 GLU B 587 -4.872 8.084 -8.252 1.00 0.00 O ATOM 0 H GLU B 587 -0.082 9.578 -5.390 1.00 0.00 H new ATOM 0 HA GLU B 587 -2.918 9.677 -5.887 1.00 0.00 H new ATOM 0 HB2 GLU B 587 -1.245 9.902 -7.684 1.00 0.00 H new ATOM 0 HB3 GLU B 587 -0.598 8.316 -7.314 1.00 0.00 H new ATOM 0 HG2 GLU B 587 -2.150 8.426 -9.309 1.00 0.00 H new ATOM 0 HG3 GLU B 587 -2.540 7.205 -8.115 1.00 0.00 H new ATOM 1020 N ILE B 588 -1.490 6.751 -5.260 1.00 0.00 N ATOM 1021 CA ILE B 588 -1.757 5.400 -4.780 1.00 0.00 C ATOM 1022 C ILE B 588 -2.860 5.398 -3.728 1.00 0.00 C ATOM 1023 O ILE B 588 -3.919 4.803 -3.925 1.00 0.00 O ATOM 1024 CB ILE B 588 -0.492 4.755 -4.184 1.00 0.00 C ATOM 1025 CG1 ILE B 588 0.479 5.835 -3.702 1.00 0.00 C ATOM 1026 CG2 ILE B 588 0.177 3.853 -5.210 1.00 0.00 C ATOM 1027 CD1 ILE B 588 1.444 5.351 -2.642 1.00 0.00 C ATOM 0 H ILE B 588 -0.513 6.932 -5.490 1.00 0.00 H new ATOM 0 HA ILE B 588 -2.081 4.817 -5.642 1.00 0.00 H new ATOM 0 HB ILE B 588 -0.782 4.145 -3.328 1.00 0.00 H new ATOM 0 HG12 ILE B 588 1.046 6.209 -4.554 1.00 0.00 H new ATOM 0 HG13 ILE B 588 -0.092 6.675 -3.306 1.00 0.00 H new ATOM 0 HG21 ILE B 588 1.069 3.405 -4.773 1.00 0.00 H new ATOM 0 HG22 ILE B 588 -0.515 3.066 -5.509 1.00 0.00 H new ATOM 0 HG23 ILE B 588 0.457 4.441 -6.084 1.00 0.00 H new ATOM 0 HD11 ILE B 588 2.102 6.169 -2.348 1.00 0.00 H new ATOM 0 HD12 ILE B 588 0.885 5.004 -1.773 1.00 0.00 H new ATOM 0 HD13 ILE B 588 2.041 4.531 -3.041 1.00 0.00 H new ATOM 1039 N ASP B 589 -2.605 6.069 -2.610 1.00 0.00 N ATOM 1040 CA ASP B 589 -3.577 6.148 -1.527 1.00 0.00 C ATOM 1041 C ASP B 589 -2.989 6.873 -0.320 1.00 0.00 C ATOM 1042 O ASP B 589 -2.071 6.374 0.329 1.00 0.00 O ATOM 1043 CB ASP B 589 -4.036 4.747 -1.121 1.00 0.00 C ATOM 1044 CG ASP B 589 -5.529 4.552 -1.299 1.00 0.00 C ATOM 1045 OD1 ASP B 589 -6.097 5.145 -2.239 1.00 0.00 O ATOM 1046 OD2 ASP B 589 -6.130 3.807 -0.496 1.00 0.00 O ATOM 0 H ASP B 589 -1.733 6.566 -2.431 1.00 0.00 H new ATOM 0 HA ASP B 589 -4.437 6.714 -1.885 1.00 0.00 H new ATOM 0 HB2 ASP B 589 -3.502 4.006 -1.717 1.00 0.00 H new ATOM 0 HB3 ASP B 589 -3.771 4.569 -0.079 1.00 0.00 H new ATOM 1051 N ASN B 590 -3.524 8.054 -0.027 1.00 0.00 N ATOM 1052 CA ASN B 590 -3.051 8.849 1.101 1.00 0.00 C ATOM 1053 C ASN B 590 -3.045 8.023 2.384 1.00 0.00 C ATOM 1054 O ASN B 590 -2.072 8.035 3.137 1.00 0.00 O ATOM 1055 CB ASN B 590 -3.929 10.088 1.282 1.00 0.00 C ATOM 1056 CG ASN B 590 -3.616 11.172 0.269 1.00 0.00 C ATOM 1057 OD1 ASN B 590 -2.473 11.322 -0.163 1.00 0.00 O ATOM 1058 ND2 ASN B 590 -4.634 11.935 -0.114 1.00 0.00 N ATOM 0 H ASN B 590 -4.285 8.482 -0.555 1.00 0.00 H new ATOM 0 HA ASN B 590 -2.029 9.164 0.889 1.00 0.00 H new ATOM 0 HB2 ASN B 590 -4.977 9.803 1.193 1.00 0.00 H new ATOM 0 HB3 ASN B 590 -3.791 10.484 2.288 1.00 0.00 H new ATOM 0 HD21 ASN B 590 -4.485 12.681 -0.793 1.00 0.00 H new ATOM 0 HD22 ASN B 590 -5.565 11.774 0.271 1.00 0.00 H new ATOM 1065 N SER B 591 -4.138 7.306 2.625 1.00 0.00 N ATOM 1066 CA SER B 591 -4.261 6.477 3.818 1.00 0.00 C ATOM 1067 C SER B 591 -3.050 5.563 3.971 1.00 0.00 C ATOM 1068 O SER B 591 -2.514 5.403 5.067 1.00 0.00 O ATOM 1069 CB SER B 591 -5.541 5.641 3.754 1.00 0.00 C ATOM 1070 OG SER B 591 -6.572 6.227 4.529 1.00 0.00 O ATOM 0 H SER B 591 -4.951 7.283 2.010 1.00 0.00 H new ATOM 0 HA SER B 591 -4.309 7.136 4.685 1.00 0.00 H new ATOM 0 HB2 SER B 591 -5.868 5.549 2.718 1.00 0.00 H new ATOM 0 HB3 SER B 591 -5.339 4.633 4.115 1.00 0.00 H new ATOM 0 HG SER B 591 -7.380 5.675 4.470 1.00 0.00 H new ATOM 1076 N GLU B 592 -2.623 4.965 2.863 1.00 0.00 N ATOM 1077 CA GLU B 592 -1.475 4.066 2.873 1.00 0.00 C ATOM 1078 C GLU B 592 -0.212 4.802 3.309 1.00 0.00 C ATOM 1079 O GLU B 592 0.628 4.250 4.021 1.00 0.00 O ATOM 1080 CB GLU B 592 -1.269 3.450 1.488 1.00 0.00 C ATOM 1081 CG GLU B 592 -0.278 2.298 1.476 1.00 0.00 C ATOM 1082 CD GLU B 592 -0.931 0.964 1.781 1.00 0.00 C ATOM 1083 OE1 GLU B 592 -2.018 0.963 2.396 1.00 0.00 O ATOM 1084 OE2 GLU B 592 -0.355 -0.079 1.405 1.00 0.00 O ATOM 0 H GLU B 592 -3.055 5.087 1.947 1.00 0.00 H new ATOM 0 HA GLU B 592 -1.676 3.269 3.590 1.00 0.00 H new ATOM 0 HB2 GLU B 592 -2.229 3.097 1.110 1.00 0.00 H new ATOM 0 HB3 GLU B 592 -0.922 4.224 0.803 1.00 0.00 H new ATOM 0 HG2 GLU B 592 0.203 2.248 0.499 1.00 0.00 H new ATOM 0 HG3 GLU B 592 0.506 2.490 2.208 1.00 0.00 H new ATOM 1091 N LEU B 593 -0.083 6.051 2.874 1.00 0.00 N ATOM 1092 CA LEU B 593 1.079 6.864 3.218 1.00 0.00 C ATOM 1093 C LEU B 593 1.113 7.161 4.714 1.00 0.00 C ATOM 1094 O LEU B 593 2.173 7.130 5.340 1.00 0.00 O ATOM 1095 CB LEU B 593 1.061 8.173 2.427 1.00 0.00 C ATOM 1096 CG LEU B 593 0.481 8.096 1.014 1.00 0.00 C ATOM 1097 CD1 LEU B 593 0.626 9.433 0.304 1.00 0.00 C ATOM 1098 CD2 LEU B 593 1.161 6.992 0.219 1.00 0.00 C ATOM 0 H LEU B 593 -0.768 6.522 2.283 1.00 0.00 H new ATOM 0 HA LEU B 593 1.976 6.301 2.958 1.00 0.00 H new ATOM 0 HB2 LEU B 593 0.489 8.908 2.993 1.00 0.00 H new ATOM 0 HB3 LEU B 593 2.083 8.547 2.359 1.00 0.00 H new ATOM 0 HG LEU B 593 -0.581 7.861 1.090 1.00 0.00 H new ATOM 0 HD11 LEU B 593 0.208 9.359 -0.700 1.00 0.00 H new ATOM 0 HD12 LEU B 593 0.093 10.202 0.863 1.00 0.00 H new ATOM 0 HD13 LEU B 593 1.681 9.698 0.239 1.00 0.00 H new ATOM 0 HD21 LEU B 593 0.736 6.951 -0.784 1.00 0.00 H new ATOM 0 HD22 LEU B 593 2.229 7.197 0.152 1.00 0.00 H new ATOM 0 HD23 LEU B 593 1.005 6.036 0.718 1.00 0.00 H new ATOM 1110 N LEU B 594 -0.054 7.445 5.282 1.00 0.00 N ATOM 1111 CA LEU B 594 -0.159 7.744 6.706 1.00 0.00 C ATOM 1112 C LEU B 594 0.266 6.545 7.547 1.00 0.00 C ATOM 1113 O LEU B 594 0.545 6.678 8.739 1.00 0.00 O ATOM 1114 CB LEU B 594 -1.592 8.148 7.058 1.00 0.00 C ATOM 1115 CG LEU B 594 -1.903 9.643 6.994 1.00 0.00 C ATOM 1116 CD1 LEU B 594 -3.386 9.890 7.225 1.00 0.00 C ATOM 1117 CD2 LEU B 594 -1.069 10.406 8.013 1.00 0.00 C ATOM 0 H LEU B 594 -0.941 7.475 4.778 1.00 0.00 H new ATOM 0 HA LEU B 594 0.511 8.575 6.928 1.00 0.00 H new ATOM 0 HB2 LEU B 594 -2.271 7.627 6.383 1.00 0.00 H new ATOM 0 HB3 LEU B 594 -1.811 7.795 8.066 1.00 0.00 H new ATOM 0 HG LEU B 594 -1.645 10.005 5.999 1.00 0.00 H new ATOM 0 HD11 LEU B 594 -3.589 10.960 7.176 1.00 0.00 H new ATOM 0 HD12 LEU B 594 -3.964 9.375 6.458 1.00 0.00 H new ATOM 0 HD13 LEU B 594 -3.669 9.512 8.207 1.00 0.00 H new ATOM 0 HD21 LEU B 594 -1.304 11.469 7.953 1.00 0.00 H new ATOM 0 HD22 LEU B 594 -1.295 10.041 9.015 1.00 0.00 H new ATOM 0 HD23 LEU B 594 -0.010 10.256 7.802 1.00 0.00 H new ATOM 1129 N HIS B 595 0.314 5.375 6.919 1.00 0.00 N ATOM 1130 CA HIS B 595 0.708 4.152 7.609 1.00 0.00 C ATOM 1131 C HIS B 595 2.104 3.711 7.180 1.00 0.00 C ATOM 1132 O HIS B 595 2.767 2.948 7.881 1.00 0.00 O ATOM 1133 CB HIS B 595 -0.300 3.037 7.330 1.00 0.00 C ATOM 1134 CG HIS B 595 -0.465 2.079 8.470 1.00 0.00 C ATOM 1135 ND1 HIS B 595 -1.450 2.209 9.426 1.00 0.00 N ATOM 1136 CD2 HIS B 595 0.237 0.971 8.803 1.00 0.00 C ATOM 1137 CE1 HIS B 595 -1.346 1.222 10.299 1.00 0.00 C ATOM 1138 NE2 HIS B 595 -0.330 0.457 9.943 1.00 0.00 N ATOM 0 H HIS B 595 0.085 5.248 5.933 1.00 0.00 H new ATOM 0 HA HIS B 595 0.724 4.357 8.679 1.00 0.00 H new ATOM 0 HB2 HIS B 595 -1.267 3.483 7.098 1.00 0.00 H new ATOM 0 HB3 HIS B 595 0.017 2.485 6.445 1.00 0.00 H new ATOM 0 HD2 HIS B 595 1.085 0.566 8.271 1.00 0.00 H new ATOM 0 HE1 HIS B 595 -1.983 1.067 11.157 1.00 0.00 H new ATOM 0 HE2 HIS B 595 -0.017 -0.380 10.435 1.00 0.00 H new ATOM 1146 N MET B 596 2.543 4.196 6.023 1.00 0.00 N ATOM 1147 CA MET B 596 3.860 3.852 5.501 1.00 0.00 C ATOM 1148 C MET B 596 4.933 4.763 6.090 1.00 0.00 C ATOM 1149 O MET B 596 6.020 4.307 6.449 1.00 0.00 O ATOM 1150 CB MET B 596 3.870 3.953 3.975 1.00 0.00 C ATOM 1151 CG MET B 596 3.356 2.703 3.280 1.00 0.00 C ATOM 1152 SD MET B 596 3.653 2.725 1.501 1.00 0.00 S ATOM 1153 CE MET B 596 3.186 4.407 1.101 1.00 0.00 C ATOM 0 H MET B 596 2.006 4.828 5.429 1.00 0.00 H new ATOM 0 HA MET B 596 4.081 2.825 5.791 1.00 0.00 H new ATOM 0 HB2 MET B 596 3.261 4.804 3.671 1.00 0.00 H new ATOM 0 HB3 MET B 596 4.887 4.153 3.639 1.00 0.00 H new ATOM 0 HG2 MET B 596 3.838 1.827 3.714 1.00 0.00 H new ATOM 0 HG3 MET B 596 2.286 2.603 3.465 1.00 0.00 H new ATOM 0 HE1 MET B 596 3.126 4.520 0.019 1.00 0.00 H new ATOM 0 HE2 MET B 596 2.215 4.630 1.543 1.00 0.00 H new ATOM 0 HE3 MET B 596 3.932 5.096 1.497 1.00 0.00 H new ATOM 1163 N LEU B 597 4.622 6.051 6.185 1.00 0.00 N ATOM 1164 CA LEU B 597 5.560 7.026 6.730 1.00 0.00 C ATOM 1165 C LEU B 597 5.875 6.721 8.191 1.00 0.00 C ATOM 1166 O LEU B 597 6.829 7.256 8.755 1.00 0.00 O ATOM 1167 CB LEU B 597 4.988 8.439 6.604 1.00 0.00 C ATOM 1168 CG LEU B 597 4.143 8.929 7.781 1.00 0.00 C ATOM 1169 CD1 LEU B 597 3.115 7.879 8.173 1.00 0.00 C ATOM 1170 CD2 LEU B 597 5.031 9.278 8.966 1.00 0.00 C ATOM 0 H LEU B 597 3.728 6.444 5.892 1.00 0.00 H new ATOM 0 HA LEU B 597 6.485 6.963 6.157 1.00 0.00 H new ATOM 0 HB2 LEU B 597 5.816 9.133 6.463 1.00 0.00 H new ATOM 0 HB3 LEU B 597 4.378 8.483 5.702 1.00 0.00 H new ATOM 0 HG LEU B 597 3.612 9.830 7.473 1.00 0.00 H new ATOM 0 HD11 LEU B 597 2.523 8.245 9.012 1.00 0.00 H new ATOM 0 HD12 LEU B 597 2.459 7.678 7.326 1.00 0.00 H new ATOM 0 HD13 LEU B 597 3.625 6.960 8.462 1.00 0.00 H new ATOM 0 HD21 LEU B 597 4.413 9.625 9.794 1.00 0.00 H new ATOM 0 HD22 LEU B 597 5.589 8.394 9.275 1.00 0.00 H new ATOM 0 HD23 LEU B 597 5.728 10.065 8.679 1.00 0.00 H new ATOM 1182 N GLU B 598 5.067 5.857 8.798 1.00 0.00 N ATOM 1183 CA GLU B 598 5.261 5.480 10.193 1.00 0.00 C ATOM 1184 C GLU B 598 6.538 4.662 10.363 1.00 0.00 C ATOM 1185 O GLU B 598 7.041 4.500 11.475 1.00 0.00 O ATOM 1186 CB GLU B 598 4.059 4.682 10.701 1.00 0.00 C ATOM 1187 CG GLU B 598 4.157 3.191 10.423 1.00 0.00 C ATOM 1188 CD GLU B 598 2.838 2.472 10.628 1.00 0.00 C ATOM 1189 OE1 GLU B 598 1.835 3.149 10.937 1.00 0.00 O ATOM 1190 OE2 GLU B 598 2.808 1.232 10.479 1.00 0.00 O ATOM 0 H GLU B 598 4.272 5.405 8.346 1.00 0.00 H new ATOM 0 HA GLU B 598 5.355 6.394 10.780 1.00 0.00 H new ATOM 0 HB2 GLU B 598 3.958 4.837 11.775 1.00 0.00 H new ATOM 0 HB3 GLU B 598 3.153 5.071 10.237 1.00 0.00 H new ATOM 0 HG2 GLU B 598 4.495 3.038 9.398 1.00 0.00 H new ATOM 0 HG3 GLU B 598 4.911 2.752 11.076 1.00 0.00 H new ATOM 1197 N SER B 599 7.056 4.147 9.253 1.00 0.00 N ATOM 1198 CA SER B 599 8.271 3.341 9.278 1.00 0.00 C ATOM 1199 C SER B 599 9.321 3.911 8.328 1.00 0.00 C ATOM 1200 O SER B 599 9.009 4.426 7.254 1.00 0.00 O ATOM 1201 CB SER B 599 7.956 1.893 8.899 1.00 0.00 C ATOM 1202 OG SER B 599 8.771 0.988 9.624 1.00 0.00 O ATOM 0 H SER B 599 6.653 4.274 8.324 1.00 0.00 H new ATOM 0 HA SER B 599 8.672 3.364 10.291 1.00 0.00 H new ATOM 0 HB2 SER B 599 6.906 1.682 9.099 1.00 0.00 H new ATOM 0 HB3 SER B 599 8.112 1.751 7.830 1.00 0.00 H new ATOM 0 HG SER B 599 8.550 0.069 9.365 1.00 0.00 H new ATOM 1208 N PRO B 600 10.596 3.816 8.732 1.00 0.00 N ATOM 1209 CA PRO B 600 11.719 4.316 7.932 1.00 0.00 C ATOM 1210 C PRO B 600 11.952 3.482 6.676 1.00 0.00 C ATOM 1211 O PRO B 600 12.084 4.022 5.578 1.00 0.00 O ATOM 1212 CB PRO B 600 12.913 4.196 8.882 1.00 0.00 C ATOM 1213 CG PRO B 600 12.532 3.115 9.834 1.00 0.00 C ATOM 1214 CD PRO B 600 11.041 3.214 10.000 1.00 0.00 C ATOM 0 HA PRO B 600 11.544 5.330 7.572 1.00 0.00 H new ATOM 0 HB2 PRO B 600 13.825 3.944 8.341 1.00 0.00 H new ATOM 0 HB3 PRO B 600 13.100 5.135 9.403 1.00 0.00 H new ATOM 0 HG2 PRO B 600 12.817 2.137 9.447 1.00 0.00 H new ATOM 0 HG3 PRO B 600 13.040 3.240 10.790 1.00 0.00 H new ATOM 0 HD2 PRO B 600 10.589 2.235 10.161 1.00 0.00 H new ATOM 0 HD3 PRO B 600 10.772 3.834 10.855 1.00 0.00 H new ATOM 1222 N GLU B 601 12.001 2.165 6.847 1.00 0.00 N ATOM 1223 CA GLU B 601 12.218 1.258 5.726 1.00 0.00 C ATOM 1224 C GLU B 601 11.140 1.439 4.662 1.00 0.00 C ATOM 1225 O GLU B 601 11.348 1.123 3.491 1.00 0.00 O ATOM 1226 CB GLU B 601 12.233 -0.194 6.211 1.00 0.00 C ATOM 1227 CG GLU B 601 12.914 -1.150 5.247 1.00 0.00 C ATOM 1228 CD GLU B 601 13.264 -2.477 5.892 1.00 0.00 C ATOM 1229 OE1 GLU B 601 14.230 -2.515 6.683 1.00 0.00 O ATOM 1230 OE2 GLU B 601 12.574 -3.477 5.606 1.00 0.00 O ATOM 0 H GLU B 601 11.894 1.703 7.750 1.00 0.00 H new ATOM 0 HA GLU B 601 13.185 1.496 5.282 1.00 0.00 H new ATOM 0 HB2 GLU B 601 12.740 -0.241 7.175 1.00 0.00 H new ATOM 0 HB3 GLU B 601 11.207 -0.525 6.374 1.00 0.00 H new ATOM 0 HG2 GLU B 601 12.260 -1.327 4.393 1.00 0.00 H new ATOM 0 HG3 GLU B 601 13.822 -0.686 4.862 1.00 0.00 H new ATOM 1237 N SER B 602 9.986 1.950 5.079 1.00 0.00 N ATOM 1238 CA SER B 602 8.872 2.170 4.163 1.00 0.00 C ATOM 1239 C SER B 602 9.013 3.510 3.448 1.00 0.00 C ATOM 1240 O SER B 602 8.903 3.589 2.223 1.00 0.00 O ATOM 1241 CB SER B 602 7.544 2.122 4.921 1.00 0.00 C ATOM 1242 OG SER B 602 6.470 2.536 4.095 1.00 0.00 O ATOM 0 H SER B 602 9.798 2.219 6.045 1.00 0.00 H new ATOM 0 HA SER B 602 8.886 1.376 3.416 1.00 0.00 H new ATOM 0 HB2 SER B 602 7.362 1.108 5.278 1.00 0.00 H new ATOM 0 HB3 SER B 602 7.600 2.765 5.800 1.00 0.00 H new ATOM 0 HG SER B 602 6.098 1.759 3.629 1.00 0.00 H new ATOM 1248 N LEU B 603 9.258 4.563 4.220 1.00 0.00 N ATOM 1249 CA LEU B 603 9.415 5.902 3.662 1.00 0.00 C ATOM 1250 C LEU B 603 10.443 5.905 2.535 1.00 0.00 C ATOM 1251 O LEU B 603 10.113 6.178 1.381 1.00 0.00 O ATOM 1252 CB LEU B 603 9.837 6.885 4.755 1.00 0.00 C ATOM 1253 CG LEU B 603 10.068 8.329 4.306 1.00 0.00 C ATOM 1254 CD1 LEU B 603 11.481 8.501 3.771 1.00 0.00 C ATOM 1255 CD2 LEU B 603 9.045 8.731 3.254 1.00 0.00 C ATOM 0 H LEU B 603 9.352 4.516 5.235 1.00 0.00 H new ATOM 0 HA LEU B 603 8.454 6.214 3.253 1.00 0.00 H new ATOM 0 HB2 LEU B 603 9.072 6.885 5.531 1.00 0.00 H new ATOM 0 HB3 LEU B 603 10.755 6.517 5.213 1.00 0.00 H new ATOM 0 HG LEU B 603 9.946 8.982 5.170 1.00 0.00 H new ATOM 0 HD11 LEU B 603 11.628 9.534 3.456 1.00 0.00 H new ATOM 0 HD12 LEU B 603 12.199 8.255 4.553 1.00 0.00 H new ATOM 0 HD13 LEU B 603 11.631 7.837 2.919 1.00 0.00 H new ATOM 0 HD21 LEU B 603 9.225 9.761 2.947 1.00 0.00 H new ATOM 0 HD22 LEU B 603 9.135 8.073 2.389 1.00 0.00 H new ATOM 0 HD23 LEU B 603 8.042 8.647 3.671 1.00 0.00 H new ATOM 1267 N ARG B 604 11.690 5.596 2.877 1.00 0.00 N ATOM 1268 CA ARG B 604 12.766 5.563 1.894 1.00 0.00 C ATOM 1269 C ARG B 604 12.407 4.649 0.726 1.00 0.00 C ATOM 1270 O ARG B 604 12.623 4.996 -0.435 1.00 0.00 O ATOM 1271 CB ARG B 604 14.066 5.087 2.546 1.00 0.00 C ATOM 1272 CG ARG B 604 13.942 3.742 3.243 1.00 0.00 C ATOM 1273 CD ARG B 604 14.765 3.698 4.520 1.00 0.00 C ATOM 1274 NE ARG B 604 16.158 4.069 4.287 1.00 0.00 N ATOM 1275 CZ ARG B 604 17.042 4.256 5.260 1.00 0.00 C ATOM 1276 NH1 ARG B 604 16.680 4.107 6.527 1.00 0.00 N ATOM 1277 NH2 ARG B 604 18.292 4.592 4.968 1.00 0.00 N ATOM 0 H ARG B 604 11.980 5.365 3.827 1.00 0.00 H new ATOM 0 HA ARG B 604 12.907 6.574 1.512 1.00 0.00 H new ATOM 0 HB2 ARG B 604 14.842 5.021 1.783 1.00 0.00 H new ATOM 0 HB3 ARG B 604 14.393 5.833 3.270 1.00 0.00 H new ATOM 0 HG2 ARG B 604 12.895 3.547 3.477 1.00 0.00 H new ATOM 0 HG3 ARG B 604 14.271 2.950 2.570 1.00 0.00 H new ATOM 0 HD2 ARG B 604 14.328 4.373 5.256 1.00 0.00 H new ATOM 0 HD3 ARG B 604 14.723 2.695 4.944 1.00 0.00 H new ATOM 0 HE ARG B 604 16.469 4.191 3.323 1.00 0.00 H new ATOM 0 HH11 ARG B 604 15.720 3.848 6.756 1.00 0.00 H new ATOM 0 HH12 ARG B 604 17.361 4.251 7.272 1.00 0.00 H new ATOM 0 HH21 ARG B 604 18.575 4.707 3.995 1.00 0.00 H new ATOM 0 HH22 ARG B 604 18.970 4.735 5.717 1.00 0.00 H new ATOM 1291 N SER B 605 11.858 3.481 1.042 1.00 0.00 N ATOM 1292 CA SER B 605 11.472 2.515 0.020 1.00 0.00 C ATOM 1293 C SER B 605 10.605 3.173 -1.049 1.00 0.00 C ATOM 1294 O SER B 605 10.878 3.059 -2.244 1.00 0.00 O ATOM 1295 CB SER B 605 10.720 1.343 0.652 1.00 0.00 C ATOM 1296 OG SER B 605 10.073 0.560 -0.335 1.00 0.00 O ATOM 0 H SER B 605 11.670 3.180 1.998 1.00 0.00 H new ATOM 0 HA SER B 605 12.380 2.141 -0.452 1.00 0.00 H new ATOM 0 HB2 SER B 605 11.416 0.721 1.215 1.00 0.00 H new ATOM 0 HB3 SER B 605 9.984 1.720 1.362 1.00 0.00 H new ATOM 0 HG SER B 605 9.601 -0.183 0.095 1.00 0.00 H new ATOM 1302 N LYS B 606 9.558 3.863 -0.610 1.00 0.00 N ATOM 1303 CA LYS B 606 8.649 4.542 -1.526 1.00 0.00 C ATOM 1304 C LYS B 606 9.386 5.602 -2.338 1.00 0.00 C ATOM 1305 O LYS B 606 9.339 5.600 -3.569 1.00 0.00 O ATOM 1306 CB LYS B 606 7.498 5.187 -0.751 1.00 0.00 C ATOM 1307 CG LYS B 606 6.499 4.185 -0.199 1.00 0.00 C ATOM 1308 CD LYS B 606 5.815 3.408 -1.311 1.00 0.00 C ATOM 1309 CE LYS B 606 5.070 4.335 -2.261 1.00 0.00 C ATOM 1310 NZ LYS B 606 4.313 3.576 -3.295 1.00 0.00 N ATOM 0 H LYS B 606 9.318 3.967 0.376 1.00 0.00 H new ATOM 0 HA LYS B 606 8.244 3.799 -2.213 1.00 0.00 H new ATOM 0 HB2 LYS B 606 7.908 5.770 0.073 1.00 0.00 H new ATOM 0 HB3 LYS B 606 6.976 5.885 -1.406 1.00 0.00 H new ATOM 0 HG2 LYS B 606 7.009 3.492 0.470 1.00 0.00 H new ATOM 0 HG3 LYS B 606 5.749 4.707 0.395 1.00 0.00 H new ATOM 0 HD2 LYS B 606 6.558 2.836 -1.867 1.00 0.00 H new ATOM 0 HD3 LYS B 606 5.117 2.690 -0.879 1.00 0.00 H new ATOM 0 HE2 LYS B 606 4.382 4.961 -1.693 1.00 0.00 H new ATOM 0 HE3 LYS B 606 5.780 5.003 -2.748 1.00 0.00 H new ATOM 0 HZ1 LYS B 606 3.960 4.234 -4.019 1.00 0.00 H new ATOM 0 HZ2 LYS B 606 4.940 2.875 -3.740 1.00 0.00 H new ATOM 0 HZ3 LYS B 606 3.510 3.088 -2.849 1.00 0.00 H new ATOM 1324 N VAL B 607 10.069 6.506 -1.642 1.00 0.00 N ATOM 1325 CA VAL B 607 10.818 7.570 -2.299 1.00 0.00 C ATOM 1326 C VAL B 607 11.741 7.008 -3.376 1.00 0.00 C ATOM 1327 O VAL B 607 11.762 7.497 -4.506 1.00 0.00 O ATOM 1328 CB VAL B 607 11.657 8.372 -1.287 1.00 0.00 C ATOM 1329 CG1 VAL B 607 12.496 9.421 -2.001 1.00 0.00 C ATOM 1330 CG2 VAL B 607 10.758 9.017 -0.243 1.00 0.00 C ATOM 0 H VAL B 607 10.119 6.522 -0.623 1.00 0.00 H new ATOM 0 HA VAL B 607 10.087 8.234 -2.761 1.00 0.00 H new ATOM 0 HB VAL B 607 12.333 7.686 -0.777 1.00 0.00 H new ATOM 0 HG11 VAL B 607 13.082 9.978 -1.270 1.00 0.00 H new ATOM 0 HG12 VAL B 607 13.167 8.932 -2.707 1.00 0.00 H new ATOM 0 HG13 VAL B 607 11.841 10.107 -2.539 1.00 0.00 H new ATOM 0 HG21 VAL B 607 11.367 9.580 0.464 1.00 0.00 H new ATOM 0 HG22 VAL B 607 10.056 9.691 -0.734 1.00 0.00 H new ATOM 0 HG23 VAL B 607 10.206 8.243 0.290 1.00 0.00 H new ATOM 1340 N ASP B 608 12.501 5.980 -3.018 1.00 0.00 N ATOM 1341 CA ASP B 608 13.426 5.350 -3.953 1.00 0.00 C ATOM 1342 C ASP B 608 12.686 4.833 -5.183 1.00 0.00 C ATOM 1343 O ASP B 608 13.050 5.148 -6.316 1.00 0.00 O ATOM 1344 CB ASP B 608 14.171 4.202 -3.272 1.00 0.00 C ATOM 1345 CG ASP B 608 15.268 3.625 -4.145 1.00 0.00 C ATOM 1346 OD1 ASP B 608 16.352 4.242 -4.222 1.00 0.00 O ATOM 1347 OD2 ASP B 608 15.044 2.556 -4.750 1.00 0.00 O ATOM 0 H ASP B 608 12.495 5.565 -2.086 1.00 0.00 H new ATOM 0 HA ASP B 608 14.148 6.101 -4.273 1.00 0.00 H new ATOM 0 HB2 ASP B 608 14.604 4.558 -2.337 1.00 0.00 H new ATOM 0 HB3 ASP B 608 13.463 3.414 -3.016 1.00 0.00 H new ATOM 1352 N GLU B 609 11.646 4.038 -4.952 1.00 0.00 N ATOM 1353 CA GLU B 609 10.857 3.476 -6.042 1.00 0.00 C ATOM 1354 C GLU B 609 10.371 4.574 -6.983 1.00 0.00 C ATOM 1355 O GLU B 609 10.592 4.512 -8.192 1.00 0.00 O ATOM 1356 CB GLU B 609 9.661 2.699 -5.487 1.00 0.00 C ATOM 1357 CG GLU B 609 10.002 1.281 -5.061 1.00 0.00 C ATOM 1358 CD GLU B 609 10.115 0.330 -6.236 1.00 0.00 C ATOM 1359 OE1 GLU B 609 9.223 0.358 -7.110 1.00 0.00 O ATOM 1360 OE2 GLU B 609 11.095 -0.443 -6.283 1.00 0.00 O ATOM 0 H GLU B 609 11.330 3.769 -4.020 1.00 0.00 H new ATOM 0 HA GLU B 609 11.495 2.794 -6.605 1.00 0.00 H new ATOM 0 HB2 GLU B 609 9.253 3.238 -4.632 1.00 0.00 H new ATOM 0 HB3 GLU B 609 8.878 2.664 -6.245 1.00 0.00 H new ATOM 0 HG2 GLU B 609 10.943 1.287 -4.512 1.00 0.00 H new ATOM 0 HG3 GLU B 609 9.236 0.917 -4.376 1.00 0.00 H new ATOM 1367 N ALA B 610 9.708 5.578 -6.420 1.00 0.00 N ATOM 1368 CA ALA B 610 9.192 6.691 -7.208 1.00 0.00 C ATOM 1369 C ALA B 610 10.281 7.288 -8.093 1.00 0.00 C ATOM 1370 O ALA B 610 10.162 7.299 -9.318 1.00 0.00 O ATOM 1371 CB ALA B 610 8.607 7.758 -6.294 1.00 0.00 C ATOM 0 H ALA B 610 9.515 5.644 -5.421 1.00 0.00 H new ATOM 0 HA ALA B 610 8.402 6.311 -7.856 1.00 0.00 H new ATOM 0 HB1 ALA B 610 8.225 8.583 -6.896 1.00 0.00 H new ATOM 0 HB2 ALA B 610 7.794 7.329 -5.708 1.00 0.00 H new ATOM 0 HB3 ALA B 610 9.382 8.127 -5.622 1.00 0.00 H new ATOM 1377 N VAL B 611 11.341 7.785 -7.465 1.00 0.00 N ATOM 1378 CA VAL B 611 12.452 8.384 -8.196 1.00 0.00 C ATOM 1379 C VAL B 611 12.933 7.466 -9.314 1.00 0.00 C ATOM 1380 O VAL B 611 13.211 7.916 -10.424 1.00 0.00 O ATOM 1381 CB VAL B 611 13.635 8.699 -7.260 1.00 0.00 C ATOM 1382 CG1 VAL B 611 14.774 9.339 -8.038 1.00 0.00 C ATOM 1383 CG2 VAL B 611 13.186 9.598 -6.119 1.00 0.00 C ATOM 0 H VAL B 611 11.454 7.785 -6.451 1.00 0.00 H new ATOM 0 HA VAL B 611 12.082 9.314 -8.628 1.00 0.00 H new ATOM 0 HB VAL B 611 13.998 7.764 -6.833 1.00 0.00 H new ATOM 0 HG11 VAL B 611 15.601 9.555 -7.361 1.00 0.00 H new ATOM 0 HG12 VAL B 611 15.112 8.656 -8.817 1.00 0.00 H new ATOM 0 HG13 VAL B 611 14.427 10.266 -8.494 1.00 0.00 H new ATOM 0 HG21 VAL B 611 14.034 9.810 -5.468 1.00 0.00 H new ATOM 0 HG22 VAL B 611 12.796 10.532 -6.524 1.00 0.00 H new ATOM 0 HG23 VAL B 611 12.405 9.097 -5.547 1.00 0.00 H new ATOM 1393 N ALA B 612 13.027 6.175 -9.012 1.00 0.00 N ATOM 1394 CA ALA B 612 13.471 5.192 -9.993 1.00 0.00 C ATOM 1395 C ALA B 612 12.547 5.168 -11.205 1.00 0.00 C ATOM 1396 O ALA B 612 13.002 5.055 -12.343 1.00 0.00 O ATOM 1397 CB ALA B 612 13.548 3.811 -9.358 1.00 0.00 C ATOM 0 H ALA B 612 12.802 5.786 -8.097 1.00 0.00 H new ATOM 0 HA ALA B 612 14.465 5.480 -10.334 1.00 0.00 H new ATOM 0 HB1 ALA B 612 13.881 3.087 -10.101 1.00 0.00 H new ATOM 0 HB2 ALA B 612 14.255 3.831 -8.529 1.00 0.00 H new ATOM 0 HB3 ALA B 612 12.563 3.525 -8.988 1.00 0.00 H new ATOM 1403 N VAL B 613 11.246 5.276 -10.953 1.00 0.00 N ATOM 1404 CA VAL B 613 10.257 5.267 -12.025 1.00 0.00 C ATOM 1405 C VAL B 613 10.403 6.495 -12.917 1.00 0.00 C ATOM 1406 O VAL B 613 10.264 6.408 -14.138 1.00 0.00 O ATOM 1407 CB VAL B 613 8.823 5.221 -11.464 1.00 0.00 C ATOM 1408 CG1 VAL B 613 7.806 5.307 -12.592 1.00 0.00 C ATOM 1409 CG2 VAL B 613 8.613 3.959 -10.641 1.00 0.00 C ATOM 0 H VAL B 613 10.853 5.371 -10.017 1.00 0.00 H new ATOM 0 HA VAL B 613 10.437 4.369 -12.616 1.00 0.00 H new ATOM 0 HB VAL B 613 8.679 6.081 -10.810 1.00 0.00 H new ATOM 0 HG11 VAL B 613 6.799 5.273 -12.177 1.00 0.00 H new ATOM 0 HG12 VAL B 613 7.943 6.242 -13.135 1.00 0.00 H new ATOM 0 HG13 VAL B 613 7.946 4.468 -13.273 1.00 0.00 H new ATOM 0 HG21 VAL B 613 7.595 3.943 -10.253 1.00 0.00 H new ATOM 0 HG22 VAL B 613 8.775 3.083 -11.270 1.00 0.00 H new ATOM 0 HG23 VAL B 613 9.318 3.945 -9.810 1.00 0.00 H new ATOM 1419 N LEU B 614 10.684 7.637 -12.300 1.00 0.00 N ATOM 1420 CA LEU B 614 10.849 8.884 -13.039 1.00 0.00 C ATOM 1421 C LEU B 614 11.841 8.711 -14.184 1.00 0.00 C ATOM 1422 O LEU B 614 11.742 9.384 -15.210 1.00 0.00 O ATOM 1423 CB LEU B 614 11.324 9.996 -12.101 1.00 0.00 C ATOM 1424 CG LEU B 614 10.574 10.121 -10.775 1.00 0.00 C ATOM 1425 CD1 LEU B 614 11.002 11.380 -10.037 1.00 0.00 C ATOM 1426 CD2 LEU B 614 9.071 10.124 -11.010 1.00 0.00 C ATOM 0 H LEU B 614 10.802 7.726 -11.291 1.00 0.00 H new ATOM 0 HA LEU B 614 9.882 9.160 -13.459 1.00 0.00 H new ATOM 0 HB2 LEU B 614 12.380 9.835 -11.884 1.00 0.00 H new ATOM 0 HB3 LEU B 614 11.248 10.946 -12.629 1.00 0.00 H new ATOM 0 HG LEU B 614 10.823 9.259 -10.156 1.00 0.00 H new ATOM 0 HD11 LEU B 614 10.458 11.453 -9.095 1.00 0.00 H new ATOM 0 HD12 LEU B 614 12.072 11.337 -9.835 1.00 0.00 H new ATOM 0 HD13 LEU B 614 10.783 12.254 -10.651 1.00 0.00 H new ATOM 0 HD21 LEU B 614 8.554 10.214 -10.055 1.00 0.00 H new ATOM 0 HD22 LEU B 614 8.804 10.967 -11.648 1.00 0.00 H new ATOM 0 HD23 LEU B 614 8.777 9.194 -11.496 1.00 0.00 H new ATOM 1438 N GLN B 615 12.795 7.804 -14.002 1.00 0.00 N ATOM 1439 CA GLN B 615 13.804 7.541 -15.022 1.00 0.00 C ATOM 1440 C GLN B 615 13.154 7.273 -16.375 1.00 0.00 C ATOM 1441 O GLN B 615 13.735 7.558 -17.421 1.00 0.00 O ATOM 1442 CB GLN B 615 14.673 6.350 -14.615 1.00 0.00 C ATOM 1443 CG GLN B 615 15.672 5.932 -15.682 1.00 0.00 C ATOM 1444 CD GLN B 615 16.468 4.704 -15.288 1.00 0.00 C ATOM 1445 OE1 GLN B 615 15.902 3.672 -14.928 1.00 0.00 O ATOM 1446 NE2 GLN B 615 17.790 4.810 -15.354 1.00 0.00 N ATOM 0 H GLN B 615 12.891 7.239 -13.158 1.00 0.00 H new ATOM 0 HA GLN B 615 14.433 8.427 -15.111 1.00 0.00 H new ATOM 0 HB2 GLN B 615 15.213 6.600 -13.702 1.00 0.00 H new ATOM 0 HB3 GLN B 615 14.028 5.503 -14.382 1.00 0.00 H new ATOM 0 HG2 GLN B 615 15.141 5.733 -16.613 1.00 0.00 H new ATOM 0 HG3 GLN B 615 16.357 6.757 -15.876 1.00 0.00 H new ATOM 0 HE21 GLN B 615 18.217 5.685 -15.658 1.00 0.00 H new ATOM 0 HE22 GLN B 615 18.379 4.016 -15.101 1.00 0.00 H new ATOM 1455 N ALA B 616 11.944 6.723 -16.346 1.00 0.00 N ATOM 1456 CA ALA B 616 11.214 6.419 -17.570 1.00 0.00 C ATOM 1457 C ALA B 616 10.761 7.695 -18.272 1.00 0.00 C ATOM 1458 O ALA B 616 10.768 7.775 -19.501 1.00 0.00 O ATOM 1459 CB ALA B 616 10.017 5.530 -17.264 1.00 0.00 C ATOM 0 H ALA B 616 11.449 6.479 -15.488 1.00 0.00 H new ATOM 0 HA ALA B 616 11.887 5.886 -18.241 1.00 0.00 H new ATOM 0 HB1 ALA B 616 9.481 5.311 -18.187 1.00 0.00 H new ATOM 0 HB2 ALA B 616 10.361 4.599 -16.814 1.00 0.00 H new ATOM 0 HB3 ALA B 616 9.351 6.043 -16.571 1.00 0.00 H new ATOM 1465 N HIS B 617 10.368 8.690 -17.484 1.00 0.00 N ATOM 1466 CA HIS B 617 9.912 9.963 -18.030 1.00 0.00 C ATOM 1467 C HIS B 617 11.095 10.868 -18.361 1.00 0.00 C ATOM 1468 O HIS B 617 11.068 11.604 -19.347 1.00 0.00 O ATOM 1469 CB HIS B 617 8.981 10.663 -17.040 1.00 0.00 C ATOM 1470 CG HIS B 617 7.997 11.586 -17.692 1.00 0.00 C ATOM 1471 ND1 HIS B 617 7.439 12.669 -17.046 1.00 0.00 N ATOM 1472 CD2 HIS B 617 7.474 11.584 -18.940 1.00 0.00 C ATOM 1473 CE1 HIS B 617 6.614 13.292 -17.868 1.00 0.00 C ATOM 1474 NE2 HIS B 617 6.618 12.654 -19.024 1.00 0.00 N ATOM 0 H HIS B 617 10.356 8.639 -16.465 1.00 0.00 H new ATOM 0 HA HIS B 617 9.364 9.759 -18.950 1.00 0.00 H new ATOM 0 HB2 HIS B 617 8.437 9.909 -16.470 1.00 0.00 H new ATOM 0 HB3 HIS B 617 9.581 11.229 -16.328 1.00 0.00 H new ATOM 0 HD2 HIS B 617 7.690 10.873 -19.724 1.00 0.00 H new ATOM 0 HE1 HIS B 617 6.035 14.173 -17.634 1.00 0.00 H new ATOM 0 HE2 HIS B 617 6.073 12.914 -19.846 1.00 0.00 H new ATOM 1482 N GLN B 618 12.130 10.807 -17.530 1.00 0.00 N ATOM 1483 CA GLN B 618 13.322 11.622 -17.734 1.00 0.00 C ATOM 1484 C GLN B 618 12.971 13.106 -17.747 1.00 0.00 C ATOM 1485 O GLN B 618 13.275 13.817 -18.704 1.00 0.00 O ATOM 1486 CB GLN B 618 14.011 11.237 -19.044 1.00 0.00 C ATOM 1487 CG GLN B 618 14.834 9.963 -18.948 1.00 0.00 C ATOM 1488 CD GLN B 618 15.918 9.887 -20.004 1.00 0.00 C ATOM 1489 OE1 GLN B 618 16.850 10.691 -20.012 1.00 0.00 O ATOM 1490 NE2 GLN B 618 15.802 8.916 -20.903 1.00 0.00 N ATOM 0 H GLN B 618 12.168 10.202 -16.710 1.00 0.00 H new ATOM 0 HA GLN B 618 14.005 11.436 -16.905 1.00 0.00 H new ATOM 0 HB2 GLN B 618 13.255 11.114 -19.820 1.00 0.00 H new ATOM 0 HB3 GLN B 618 14.659 12.055 -19.358 1.00 0.00 H new ATOM 0 HG2 GLN B 618 15.290 9.903 -17.960 1.00 0.00 H new ATOM 0 HG3 GLN B 618 14.175 9.101 -19.047 1.00 0.00 H new ATOM 0 HE21 GLN B 618 15.013 8.271 -20.859 1.00 0.00 H new ATOM 0 HE22 GLN B 618 16.502 8.815 -21.638 1.00 0.00 H new ATOM 1499 N ALA B 619 12.328 13.567 -16.679 1.00 0.00 N ATOM 1500 CA ALA B 619 11.937 14.966 -16.568 1.00 0.00 C ATOM 1501 C ALA B 619 13.086 15.817 -16.038 1.00 0.00 C ATOM 1502 O ALA B 619 13.672 16.614 -16.770 1.00 0.00 O ATOM 1503 CB ALA B 619 10.717 15.103 -15.668 1.00 0.00 C ATOM 0 H ALA B 619 12.067 12.991 -15.878 1.00 0.00 H new ATOM 0 HA ALA B 619 11.682 15.327 -17.565 1.00 0.00 H new ATOM 0 HB1 ALA B 619 10.436 16.153 -15.594 1.00 0.00 H new ATOM 0 HB2 ALA B 619 9.888 14.534 -16.090 1.00 0.00 H new ATOM 0 HB3 ALA B 619 10.952 14.720 -14.675 1.00 0.00 H new ATOM 1509 N LYS B 620 13.404 15.643 -14.759 1.00 0.00 N ATOM 1510 CA LYS B 620 14.484 16.394 -14.130 1.00 0.00 C ATOM 1511 C LYS B 620 15.843 15.815 -14.510 1.00 0.00 C ATOM 1512 O LYS B 620 16.852 16.519 -14.500 1.00 0.00 O ATOM 1513 CB LYS B 620 14.320 16.384 -12.608 1.00 0.00 C ATOM 1514 CG LYS B 620 14.979 17.566 -11.918 1.00 0.00 C ATOM 1515 CD LYS B 620 14.164 18.837 -12.089 1.00 0.00 C ATOM 1516 CE LYS B 620 14.961 20.068 -11.685 1.00 0.00 C ATOM 1517 NZ LYS B 620 16.005 20.408 -12.691 1.00 0.00 N ATOM 0 H LYS B 620 12.929 14.988 -14.138 1.00 0.00 H new ATOM 0 HA LYS B 620 14.435 17.422 -14.488 1.00 0.00 H new ATOM 0 HB2 LYS B 620 13.257 16.379 -12.365 1.00 0.00 H new ATOM 0 HB3 LYS B 620 14.742 15.461 -12.211 1.00 0.00 H new ATOM 0 HG2 LYS B 620 15.098 17.349 -10.856 1.00 0.00 H new ATOM 0 HG3 LYS B 620 15.978 17.716 -12.326 1.00 0.00 H new ATOM 0 HD2 LYS B 620 13.848 18.931 -13.128 1.00 0.00 H new ATOM 0 HD3 LYS B 620 13.259 18.774 -11.485 1.00 0.00 H new ATOM 0 HE2 LYS B 620 14.285 20.914 -11.563 1.00 0.00 H new ATOM 0 HE3 LYS B 620 15.432 19.894 -10.717 1.00 0.00 H new ATOM 0 HZ1 LYS B 620 16.398 21.347 -12.479 1.00 0.00 H new ATOM 0 HZ2 LYS B 620 16.765 19.699 -12.656 1.00 0.00 H new ATOM 0 HZ3 LYS B 620 15.582 20.416 -13.641 1.00 0.00 H new ATOM 1531 N GLU B 621 15.860 14.529 -14.845 1.00 0.00 N ATOM 1532 CA GLU B 621 17.096 13.857 -15.229 1.00 0.00 C ATOM 1533 C GLU B 621 17.412 14.099 -16.702 1.00 0.00 C ATOM 1534 O GLU B 621 17.578 13.156 -17.476 1.00 0.00 O ATOM 1535 CB GLU B 621 16.991 12.354 -14.959 1.00 0.00 C ATOM 1536 CG GLU B 621 16.778 12.012 -13.494 1.00 0.00 C ATOM 1537 CD GLU B 621 18.038 12.178 -12.668 1.00 0.00 C ATOM 1538 OE1 GLU B 621 19.139 12.180 -13.259 1.00 0.00 O ATOM 1539 OE2 GLU B 621 17.925 12.305 -11.431 1.00 0.00 O ATOM 0 H GLU B 621 15.033 13.932 -14.858 1.00 0.00 H new ATOM 0 HA GLU B 621 17.906 14.271 -14.629 1.00 0.00 H new ATOM 0 HB2 GLU B 621 16.166 11.945 -15.542 1.00 0.00 H new ATOM 0 HB3 GLU B 621 17.901 11.866 -15.309 1.00 0.00 H new ATOM 0 HG2 GLU B 621 15.994 12.650 -13.086 1.00 0.00 H new ATOM 0 HG3 GLU B 621 16.427 10.983 -13.412 1.00 0.00 H new ATOM 1546 N ALA B 622 17.494 15.370 -17.082 1.00 0.00 N ATOM 1547 CA ALA B 622 17.791 15.737 -18.461 1.00 0.00 C ATOM 1548 C ALA B 622 19.221 16.250 -18.597 1.00 0.00 C ATOM 1549 O ALA B 622 19.490 17.431 -18.382 1.00 0.00 O ATOM 1550 CB ALA B 622 16.804 16.785 -18.953 1.00 0.00 C ATOM 0 H ALA B 622 17.359 16.162 -16.454 1.00 0.00 H new ATOM 0 HA ALA B 622 17.693 14.843 -19.077 1.00 0.00 H new ATOM 0 HB1 ALA B 622 17.038 17.049 -19.984 1.00 0.00 H new ATOM 0 HB2 ALA B 622 15.792 16.384 -18.902 1.00 0.00 H new ATOM 0 HB3 ALA B 622 16.874 17.674 -18.326 1.00 0.00 H new ATOM 1556 N ALA B 623 20.135 15.353 -18.953 1.00 0.00 N ATOM 1557 CA ALA B 623 21.537 15.716 -19.118 1.00 0.00 C ATOM 1558 C ALA B 623 21.810 16.227 -20.528 1.00 0.00 C ATOM 1559 O ALA B 623 22.834 16.863 -20.781 1.00 0.00 O ATOM 1560 CB ALA B 623 22.431 14.525 -18.804 1.00 0.00 C ATOM 0 H ALA B 623 19.930 14.370 -19.133 1.00 0.00 H new ATOM 0 HA ALA B 623 21.763 16.521 -18.418 1.00 0.00 H new ATOM 0 HB1 ALA B 623 23.475 14.810 -18.931 1.00 0.00 H new ATOM 0 HB2 ALA B 623 22.265 14.207 -17.775 1.00 0.00 H new ATOM 0 HB3 ALA B 623 22.194 13.704 -19.481 1.00 0.00 H new TER 1566 ALA B 623