USER MOD reduce.3.24.130724 H: found=0, std=0, add=960, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 958 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 8 ASN : amide:sc= -1.53! C(o=-2.6!,f=-11!) USER MOD Set 1.2: B 10 ASN : amide:sc= -1.03 K(o=-2.6,f=-9.7!) USER MOD Set 2.1: B 1 MET CE :methyl 143:sc= -3.2 (180deg=-6.33!) USER MOD Set 2.2: B 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 8 ASN : amide:sc= -1.36! C(o=-2.3!,f=-11!) USER MOD Set 3.2: A 10 ASN : amide:sc= -0.915 K(o=-2.3,f=-9.4!) USER MOD Set 4.1: A 1 MET CE :methyl 145:sc= -3.23 (180deg=-6.37!) USER MOD Set 4.2: A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 175:sc= 0.104 (180deg=0.0975) USER MOD Single : A 9 HIS : no HD1:sc= -0.64 X(o=-0.64,f=-0.19) USER MOD Single : A 15 LYS NZ :NH3+ 154:sc= -0.0713 (180deg=-0.404) USER MOD Single : A 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 31 ASN : amide:sc= -0.0053 X(o=-0.0053,f=-0.0053) USER MOD Single : A 32 LYS NZ :NH3+ 166:sc= -1.15 (180deg=-1.43) USER MOD Single : A 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 34 LYS NZ :NH3+ 147:sc= 0.375 (180deg=-1.25) USER MOD Single : A 35 ASN : amide:sc= -0.279 X(o=-0.28,f=-0.0077) USER MOD Single : A 41 SER OG : rot 180:sc= 0 USER MOD Single : A 42 LYS NZ :NH3+ -177:sc= 0.171 (180deg=0.169) USER MOD Single : A 45 LYS NZ :NH3+ 161:sc= 0.138 (180deg=0.0503) USER MOD Single : A 46 THR OG1 : rot 180:sc= 0 USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 THR OG1 : rot -83:sc= 0.0617 USER MOD Single : A 55 TYR OH : rot 180:sc= 0 USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 4 LYS NZ :NH3+ 175:sc= 0.0934 (180deg=0.0892) USER MOD Single : B 9 HIS :FLIP no HE2:sc= -0.145 F(o=-0.78,f=-0.15) USER MOD Single : B 15 LYS NZ :NH3+ 152:sc= -0.0733 (180deg=-0.406) USER MOD Single : B 17 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 18 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 31 ASN : amide:sc= -0.0116 X(o=-0.012,f=-0.013) USER MOD Single : B 32 LYS NZ :NH3+ 167:sc= -1.12 (180deg=-1.42) USER MOD Single : B 33 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 34 LYS NZ :NH3+ 146:sc= 0.391 (180deg=-1.21) USER MOD Single : B 35 ASN : amide:sc= -0.269 X(o=-0.27,f=-0.009) USER MOD Single : B 41 SER OG : rot 180:sc= 0 USER MOD Single : B 42 LYS NZ :NH3+ -174:sc= 0.174 (180deg=0.163) USER MOD Single : B 45 LYS NZ :NH3+ 160:sc= 0.133 (180deg=0.0475) USER MOD Single : B 46 THR OG1 : rot 180:sc= 0 USER MOD Single : B 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 THR OG1 : rot -80:sc= 0.0483 USER MOD Single : B 55 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -9.318 16.137 7.712 1.00 0.00 N ATOM 2 CA MET A 1 -9.658 14.687 7.611 1.00 0.00 C ATOM 3 C MET A 1 -10.220 14.390 6.215 1.00 0.00 C ATOM 4 O MET A 1 -11.392 14.102 6.047 1.00 0.00 O ATOM 5 CB MET A 1 -10.691 14.329 8.686 1.00 0.00 C ATOM 6 CG MET A 1 -9.978 13.734 9.900 1.00 0.00 C ATOM 7 SD MET A 1 -11.050 13.857 11.354 1.00 0.00 S ATOM 8 CE MET A 1 -12.178 12.505 10.933 1.00 0.00 C ATOM 0 H1 MET A 1 -8.937 16.339 8.658 1.00 0.00 H new ATOM 0 H2 MET A 1 -8.606 16.377 6.993 1.00 0.00 H new ATOM 0 H3 MET A 1 -10.174 16.706 7.555 1.00 0.00 H new ATOM 0 HA MET A 1 -8.762 14.087 7.767 1.00 0.00 H new ATOM 0 HB2 MET A 1 -11.250 15.218 8.979 1.00 0.00 H new ATOM 0 HB3 MET A 1 -11.413 13.615 8.289 1.00 0.00 H new ATOM 0 HG2 MET A 1 -9.724 12.691 9.710 1.00 0.00 H new ATOM 0 HG3 MET A 1 -9.042 14.263 10.080 1.00 0.00 H new ATOM 0 HE1 MET A 1 -12.491 11.995 11.844 1.00 0.00 H new ATOM 0 HE2 MET A 1 -13.054 12.907 10.423 1.00 0.00 H new ATOM 0 HE3 MET A 1 -11.670 11.798 10.278 1.00 0.00 H new ATOM 20 N LYS A 2 -9.379 14.463 5.215 1.00 0.00 N ATOM 21 CA LYS A 2 -9.822 14.196 3.820 1.00 0.00 C ATOM 22 C LYS A 2 -9.502 12.751 3.437 1.00 0.00 C ATOM 23 O LYS A 2 -8.755 12.064 4.111 1.00 0.00 O ATOM 24 CB LYS A 2 -9.093 15.146 2.870 1.00 0.00 C ATOM 25 CG LYS A 2 -9.647 16.560 3.046 1.00 0.00 C ATOM 26 CD LYS A 2 -8.596 17.581 2.604 1.00 0.00 C ATOM 27 CE LYS A 2 -9.250 18.957 2.457 1.00 0.00 C ATOM 28 NZ LYS A 2 -8.210 19.974 2.132 1.00 0.00 N ATOM 0 H LYS A 2 -8.392 14.700 5.311 1.00 0.00 H new ATOM 0 HA LYS A 2 -10.898 14.354 3.748 1.00 0.00 H new ATOM 0 HB2 LYS A 2 -8.023 15.134 3.076 1.00 0.00 H new ATOM 0 HB3 LYS A 2 -9.223 14.818 1.839 1.00 0.00 H new ATOM 0 HG2 LYS A 2 -10.557 16.681 2.458 1.00 0.00 H new ATOM 0 HG3 LYS A 2 -9.917 16.729 4.088 1.00 0.00 H new ATOM 0 HD2 LYS A 2 -7.788 17.627 3.335 1.00 0.00 H new ATOM 0 HD3 LYS A 2 -8.152 17.275 1.657 1.00 0.00 H new ATOM 0 HE2 LYS A 2 -10.004 18.930 1.671 1.00 0.00 H new ATOM 0 HE3 LYS A 2 -9.762 19.228 3.381 1.00 0.00 H new ATOM 0 HZ1 LYS A 2 -8.657 20.908 2.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 2 -7.506 20.007 2.896 1.00 0.00 H new ATOM 0 HZ3 LYS A 2 -7.741 19.718 1.240 1.00 0.00 H new ATOM 42 N ILE A 3 -10.065 12.293 2.352 1.00 0.00 N ATOM 43 CA ILE A 3 -9.813 10.893 1.896 1.00 0.00 C ATOM 44 C ILE A 3 -8.478 10.832 1.144 1.00 0.00 C ATOM 45 O ILE A 3 -8.382 11.191 -0.017 1.00 0.00 O ATOM 46 CB ILE A 3 -10.968 10.426 0.992 1.00 0.00 C ATOM 47 CG1 ILE A 3 -12.176 10.060 1.863 1.00 0.00 C ATOM 48 CG2 ILE A 3 -10.542 9.194 0.184 1.00 0.00 C ATOM 49 CD1 ILE A 3 -13.268 11.120 1.709 1.00 0.00 C ATOM 0 H ILE A 3 -10.694 12.832 1.756 1.00 0.00 H new ATOM 0 HA ILE A 3 -9.759 10.229 2.759 1.00 0.00 H new ATOM 0 HB ILE A 3 -11.230 11.232 0.306 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -12.562 9.083 1.573 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -11.873 9.986 2.908 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -11.367 8.873 -0.452 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -9.682 9.446 -0.437 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -10.274 8.387 0.866 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -14.123 10.854 2.330 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -12.880 12.090 2.021 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -13.580 11.172 0.666 1.00 0.00 H new ATOM 61 N LYS A 4 -7.454 10.360 1.811 1.00 0.00 N ATOM 62 CA LYS A 4 -6.111 10.237 1.176 1.00 0.00 C ATOM 63 C LYS A 4 -6.100 8.993 0.283 1.00 0.00 C ATOM 64 O LYS A 4 -5.516 8.988 -0.785 1.00 0.00 O ATOM 65 CB LYS A 4 -5.047 10.091 2.269 1.00 0.00 C ATOM 66 CG LYS A 4 -3.655 10.329 1.676 1.00 0.00 C ATOM 67 CD LYS A 4 -2.840 9.035 1.751 1.00 0.00 C ATOM 68 CE LYS A 4 -1.458 9.262 1.136 1.00 0.00 C ATOM 69 NZ LYS A 4 -0.733 7.963 1.045 1.00 0.00 N ATOM 0 H LYS A 4 -7.495 10.051 2.782 1.00 0.00 H new ATOM 0 HA LYS A 4 -5.897 11.123 0.579 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -5.237 10.804 3.071 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -5.099 9.095 2.709 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -3.741 10.658 0.640 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -3.147 11.124 2.222 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -2.739 8.716 2.789 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -3.358 8.236 1.221 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -1.558 9.705 0.145 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -0.889 9.966 1.744 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 0.171 8.104 0.550 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -0.551 7.599 2.002 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -1.312 7.278 0.519 1.00 0.00 H new ATOM 83 N ARG A 5 -6.753 7.943 0.722 1.00 0.00 N ATOM 84 CA ARG A 5 -6.807 6.684 -0.080 1.00 0.00 C ATOM 85 C ARG A 5 -8.129 5.957 0.189 1.00 0.00 C ATOM 86 O ARG A 5 -8.920 6.364 1.021 1.00 0.00 O ATOM 87 CB ARG A 5 -5.638 5.775 0.310 1.00 0.00 C ATOM 88 CG ARG A 5 -4.585 5.788 -0.797 1.00 0.00 C ATOM 89 CD ARG A 5 -3.694 4.548 -0.669 1.00 0.00 C ATOM 90 NE ARG A 5 -4.146 3.502 -1.635 1.00 0.00 N ATOM 91 CZ ARG A 5 -5.310 2.922 -1.483 1.00 0.00 C ATOM 92 NH1 ARG A 5 -5.574 2.258 -0.386 1.00 0.00 N ATOM 93 NH2 ARG A 5 -6.208 3.007 -2.430 1.00 0.00 N ATOM 0 H ARG A 5 -7.254 7.907 1.610 1.00 0.00 H new ATOM 0 HA ARG A 5 -6.738 6.931 -1.139 1.00 0.00 H new ATOM 0 HB2 ARG A 5 -5.198 6.114 1.248 1.00 0.00 H new ATOM 0 HB3 ARG A 5 -5.994 4.758 0.474 1.00 0.00 H new ATOM 0 HG2 ARG A 5 -5.069 5.802 -1.774 1.00 0.00 H new ATOM 0 HG3 ARG A 5 -3.980 6.692 -0.728 1.00 0.00 H new ATOM 0 HD2 ARG A 5 -2.655 4.813 -0.865 1.00 0.00 H new ATOM 0 HD3 ARG A 5 -3.738 4.160 0.349 1.00 0.00 H new ATOM 0 HE ARG A 5 -3.545 3.239 -2.416 1.00 0.00 H new ATOM 0 HH11 ARG A 5 -4.873 2.192 0.352 1.00 0.00 H new ATOM 0 HH12 ARG A 5 -6.481 1.807 -0.269 1.00 0.00 H new ATOM 0 HH21 ARG A 5 -6.001 3.524 -3.284 1.00 0.00 H new ATOM 0 HH22 ARG A 5 -7.116 2.556 -2.314 1.00 0.00 H new ATOM 107 N ILE A 6 -8.368 4.879 -0.514 1.00 0.00 N ATOM 108 CA ILE A 6 -9.630 4.104 -0.321 1.00 0.00 C ATOM 109 C ILE A 6 -9.292 2.629 -0.096 1.00 0.00 C ATOM 110 O ILE A 6 -8.607 2.009 -0.891 1.00 0.00 O ATOM 111 CB ILE A 6 -10.524 4.242 -1.560 1.00 0.00 C ATOM 112 CG1 ILE A 6 -10.706 5.724 -1.912 1.00 0.00 C ATOM 113 CG2 ILE A 6 -11.894 3.620 -1.274 1.00 0.00 C ATOM 114 CD1 ILE A 6 -9.788 6.092 -3.081 1.00 0.00 C ATOM 0 H ILE A 6 -7.737 4.500 -1.220 1.00 0.00 H new ATOM 0 HA ILE A 6 -10.161 4.494 0.547 1.00 0.00 H new ATOM 0 HB ILE A 6 -10.053 3.727 -2.397 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -11.745 5.920 -2.177 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -10.475 6.345 -1.046 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -12.529 3.718 -2.154 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -11.771 2.565 -1.031 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -12.358 4.134 -0.432 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -9.919 7.145 -3.329 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -8.750 5.912 -2.799 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -10.040 5.481 -3.948 1.00 0.00 H new ATOM 126 N LEU A 7 -9.778 2.070 0.982 1.00 0.00 N ATOM 127 CA LEU A 7 -9.509 0.639 1.285 1.00 0.00 C ATOM 128 C LEU A 7 -10.670 -0.201 0.749 1.00 0.00 C ATOM 129 O LEU A 7 -10.473 -1.182 0.055 1.00 0.00 O ATOM 130 CB LEU A 7 -9.381 0.468 2.797 1.00 0.00 C ATOM 131 CG LEU A 7 -8.223 1.335 3.296 1.00 0.00 C ATOM 132 CD1 LEU A 7 -8.480 1.764 4.742 1.00 0.00 C ATOM 133 CD2 LEU A 7 -6.920 0.543 3.225 1.00 0.00 C ATOM 0 H LEU A 7 -10.356 2.552 1.671 1.00 0.00 H new ATOM 0 HA LEU A 7 -8.582 0.313 0.813 1.00 0.00 H new ATOM 0 HB2 LEU A 7 -10.309 0.758 3.289 1.00 0.00 H new ATOM 0 HB3 LEU A 7 -9.203 -0.578 3.045 1.00 0.00 H new ATOM 0 HG LEU A 7 -8.145 2.221 2.666 1.00 0.00 H new ATOM 0 HD11 LEU A 7 -7.652 2.381 5.091 1.00 0.00 H new ATOM 0 HD12 LEU A 7 -9.406 2.337 4.792 1.00 0.00 H new ATOM 0 HD13 LEU A 7 -8.566 0.880 5.374 1.00 0.00 H new ATOM 0 HD21 LEU A 7 -6.097 1.163 3.581 1.00 0.00 H new ATOM 0 HD22 LEU A 7 -7.000 -0.347 3.850 1.00 0.00 H new ATOM 0 HD23 LEU A 7 -6.730 0.246 2.193 1.00 0.00 H new ATOM 145 N ASN A 8 -11.880 0.209 1.044 1.00 0.00 N ATOM 146 CA ASN A 8 -13.086 -0.517 0.537 1.00 0.00 C ATOM 147 C ASN A 8 -14.338 0.354 0.773 1.00 0.00 C ATOM 148 O ASN A 8 -14.232 1.554 0.959 1.00 0.00 O ATOM 149 CB ASN A 8 -13.215 -1.904 1.204 1.00 0.00 C ATOM 150 CG ASN A 8 -13.531 -1.779 2.694 1.00 0.00 C ATOM 151 OD1 ASN A 8 -14.647 -1.496 3.067 1.00 0.00 O ATOM 152 ND2 ASN A 8 -12.601 -2.015 3.570 1.00 0.00 N ATOM 0 H ASN A 8 -12.085 1.025 1.621 1.00 0.00 H new ATOM 0 HA ASN A 8 -12.983 -0.693 -0.534 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -14.001 -2.475 0.710 1.00 0.00 H new ATOM 0 HB3 ASN A 8 -12.287 -2.460 1.073 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -12.813 -1.961 4.566 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -11.659 -2.254 3.262 1.00 0.00 H new ATOM 159 N HIS A 9 -15.516 -0.226 0.739 1.00 0.00 N ATOM 160 CA HIS A 9 -16.769 0.580 0.932 1.00 0.00 C ATOM 161 C HIS A 9 -16.881 1.120 2.370 1.00 0.00 C ATOM 162 O HIS A 9 -17.649 2.028 2.632 1.00 0.00 O ATOM 163 CB HIS A 9 -17.990 -0.296 0.627 1.00 0.00 C ATOM 164 CG HIS A 9 -18.886 0.415 -0.349 1.00 0.00 C ATOM 165 ND1 HIS A 9 -19.380 1.689 -0.109 1.00 0.00 N ATOM 166 CD2 HIS A 9 -19.386 0.046 -1.573 1.00 0.00 C ATOM 167 CE1 HIS A 9 -20.137 2.036 -1.166 1.00 0.00 C ATOM 168 NE2 HIS A 9 -20.174 1.070 -2.088 1.00 0.00 N ATOM 0 H HIS A 9 -15.665 -1.223 0.586 1.00 0.00 H new ATOM 0 HA HIS A 9 -16.730 1.430 0.251 1.00 0.00 H new ATOM 0 HB2 HIS A 9 -17.670 -1.253 0.213 1.00 0.00 H new ATOM 0 HB3 HIS A 9 -18.535 -0.512 1.546 1.00 0.00 H new ATOM 0 HD2 HIS A 9 -19.196 -0.898 -2.063 1.00 0.00 H new ATOM 0 HE1 HIS A 9 -20.652 2.981 -1.258 1.00 0.00 H new ATOM 0 HE2 HIS A 9 -20.673 1.081 -2.978 1.00 0.00 H new ATOM 176 N ASN A 10 -16.147 0.559 3.302 1.00 0.00 N ATOM 177 CA ASN A 10 -16.228 1.017 4.717 1.00 0.00 C ATOM 178 C ASN A 10 -14.877 1.547 5.203 1.00 0.00 C ATOM 179 O ASN A 10 -14.824 2.425 6.043 1.00 0.00 O ATOM 180 CB ASN A 10 -16.641 -0.159 5.607 1.00 0.00 C ATOM 181 CG ASN A 10 -17.622 -1.074 4.860 1.00 0.00 C ATOM 182 OD1 ASN A 10 -18.743 -0.693 4.587 1.00 0.00 O ATOM 183 ND2 ASN A 10 -17.240 -2.273 4.512 1.00 0.00 N ATOM 0 H ASN A 10 -15.490 -0.204 3.136 1.00 0.00 H new ATOM 0 HA ASN A 10 -16.963 1.820 4.774 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -15.759 -0.726 5.904 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -17.104 0.213 6.521 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -17.882 -2.888 4.012 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -16.299 -2.595 4.740 1.00 0.00 H new ATOM 190 N ALA A 11 -13.790 1.014 4.706 1.00 0.00 N ATOM 191 CA ALA A 11 -12.456 1.478 5.167 1.00 0.00 C ATOM 192 C ALA A 11 -11.858 2.461 4.162 1.00 0.00 C ATOM 193 O ALA A 11 -11.935 2.270 2.961 1.00 0.00 O ATOM 194 CB ALA A 11 -11.525 0.274 5.327 1.00 0.00 C ATOM 0 H ALA A 11 -13.773 0.277 4.001 1.00 0.00 H new ATOM 0 HA ALA A 11 -12.569 1.984 6.126 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.546 0.614 5.665 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -11.944 -0.415 6.061 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -11.421 -0.236 4.369 1.00 0.00 H new ATOM 200 N ILE A 12 -11.255 3.511 4.658 1.00 0.00 N ATOM 201 CA ILE A 12 -10.628 4.528 3.768 1.00 0.00 C ATOM 202 C ILE A 12 -9.454 5.177 4.506 1.00 0.00 C ATOM 203 O ILE A 12 -9.505 5.400 5.702 1.00 0.00 O ATOM 204 CB ILE A 12 -11.677 5.589 3.380 1.00 0.00 C ATOM 205 CG1 ILE A 12 -12.322 5.200 2.047 1.00 0.00 C ATOM 206 CG2 ILE A 12 -11.031 6.972 3.237 1.00 0.00 C ATOM 207 CD1 ILE A 12 -13.691 4.572 2.298 1.00 0.00 C ATOM 0 H ILE A 12 -11.171 3.707 5.655 1.00 0.00 H new ATOM 0 HA ILE A 12 -10.260 4.055 2.857 1.00 0.00 H new ATOM 0 HB ILE A 12 -12.429 5.633 4.167 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -12.426 6.080 1.413 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -11.682 4.497 1.514 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -11.792 7.703 2.963 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -10.576 7.261 4.184 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -10.265 6.938 2.462 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -14.145 4.297 1.346 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -13.575 3.681 2.915 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -14.331 5.289 2.812 1.00 0.00 H new ATOM 219 N VAL A 13 -8.403 5.489 3.794 1.00 0.00 N ATOM 220 CA VAL A 13 -7.222 6.131 4.435 1.00 0.00 C ATOM 221 C VAL A 13 -7.439 7.644 4.444 1.00 0.00 C ATOM 222 O VAL A 13 -7.559 8.263 3.405 1.00 0.00 O ATOM 223 CB VAL A 13 -5.949 5.797 3.646 1.00 0.00 C ATOM 224 CG1 VAL A 13 -4.717 6.197 4.464 1.00 0.00 C ATOM 225 CG2 VAL A 13 -5.896 4.293 3.355 1.00 0.00 C ATOM 0 H VAL A 13 -8.313 5.325 2.791 1.00 0.00 H new ATOM 0 HA VAL A 13 -7.108 5.761 5.454 1.00 0.00 H new ATOM 0 HB VAL A 13 -5.959 6.348 2.705 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.814 5.959 3.902 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -4.747 7.268 4.667 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -4.713 5.649 5.406 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -4.990 4.063 2.795 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -5.892 3.741 4.295 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -6.768 4.005 2.768 1.00 0.00 H new ATOM 235 N VAL A 14 -7.500 8.239 5.607 1.00 0.00 N ATOM 236 CA VAL A 14 -7.716 9.714 5.689 1.00 0.00 C ATOM 237 C VAL A 14 -6.498 10.371 6.344 1.00 0.00 C ATOM 238 O VAL A 14 -5.851 9.792 7.189 1.00 0.00 O ATOM 239 CB VAL A 14 -8.996 10.023 6.495 1.00 0.00 C ATOM 240 CG1 VAL A 14 -9.205 8.973 7.592 1.00 0.00 C ATOM 241 CG2 VAL A 14 -8.898 11.410 7.145 1.00 0.00 C ATOM 0 H VAL A 14 -7.409 7.765 6.506 1.00 0.00 H new ATOM 0 HA VAL A 14 -7.841 10.117 4.684 1.00 0.00 H new ATOM 0 HB VAL A 14 -9.841 10.002 5.806 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -10.112 9.206 8.151 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -9.302 7.987 7.138 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -8.350 8.979 8.269 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -9.808 11.612 7.709 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -8.041 11.437 7.817 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -8.776 12.167 6.370 1.00 0.00 H new ATOM 251 N LYS A 15 -6.194 11.579 5.951 1.00 0.00 N ATOM 252 CA LYS A 15 -5.021 12.298 6.537 1.00 0.00 C ATOM 253 C LYS A 15 -5.503 13.367 7.516 1.00 0.00 C ATOM 254 O LYS A 15 -6.519 14.010 7.311 1.00 0.00 O ATOM 255 CB LYS A 15 -4.194 12.955 5.424 1.00 0.00 C ATOM 256 CG LYS A 15 -5.100 13.787 4.506 1.00 0.00 C ATOM 257 CD LYS A 15 -4.469 15.161 4.265 1.00 0.00 C ATOM 258 CE LYS A 15 -4.817 16.101 5.424 1.00 0.00 C ATOM 259 NZ LYS A 15 -6.157 16.714 5.189 1.00 0.00 N ATOM 0 H LYS A 15 -6.710 12.103 5.245 1.00 0.00 H new ATOM 0 HA LYS A 15 -4.397 11.578 7.067 1.00 0.00 H new ATOM 0 HB2 LYS A 15 -3.425 13.592 5.861 1.00 0.00 H new ATOM 0 HB3 LYS A 15 -3.681 12.189 4.842 1.00 0.00 H new ATOM 0 HG2 LYS A 15 -5.244 13.271 3.557 1.00 0.00 H new ATOM 0 HG3 LYS A 15 -6.085 13.903 4.959 1.00 0.00 H new ATOM 0 HD2 LYS A 15 -3.387 15.064 4.175 1.00 0.00 H new ATOM 0 HD3 LYS A 15 -4.831 15.578 3.325 1.00 0.00 H new ATOM 0 HE2 LYS A 15 -4.818 15.550 6.364 1.00 0.00 H new ATOM 0 HE3 LYS A 15 -4.060 16.880 5.513 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 -6.584 16.975 6.101 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 -6.051 17.565 4.600 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 -6.771 16.030 4.702 1.00 0.00 H new ATOM 273 N ASP A 16 -4.767 13.556 8.578 1.00 0.00 N ATOM 274 CA ASP A 16 -5.138 14.575 9.598 1.00 0.00 C ATOM 275 C ASP A 16 -3.923 15.464 9.906 1.00 0.00 C ATOM 276 O ASP A 16 -2.875 15.336 9.295 1.00 0.00 O ATOM 277 CB ASP A 16 -5.614 13.871 10.879 1.00 0.00 C ATOM 278 CG ASP A 16 -4.603 12.801 11.309 1.00 0.00 C ATOM 279 OD1 ASP A 16 -3.690 13.136 12.043 1.00 0.00 O ATOM 280 OD2 ASP A 16 -4.762 11.662 10.900 1.00 0.00 O ATOM 0 H ASP A 16 -3.912 13.039 8.784 1.00 0.00 H new ATOM 0 HA ASP A 16 -5.945 15.198 9.213 1.00 0.00 H new ATOM 0 HB2 ASP A 16 -5.741 14.602 11.677 1.00 0.00 H new ATOM 0 HB3 ASP A 16 -6.588 13.412 10.709 1.00 0.00 H new ATOM 285 N GLN A 17 -4.066 16.366 10.846 1.00 0.00 N ATOM 286 CA GLN A 17 -2.943 17.284 11.210 1.00 0.00 C ATOM 287 C GLN A 17 -1.731 16.484 11.680 1.00 0.00 C ATOM 288 O GLN A 17 -0.609 16.762 11.295 1.00 0.00 O ATOM 289 CB GLN A 17 -3.396 18.215 12.338 1.00 0.00 C ATOM 290 CG GLN A 17 -3.630 19.623 11.784 1.00 0.00 C ATOM 291 CD GLN A 17 -4.983 19.676 11.069 1.00 0.00 C ATOM 292 OE1 GLN A 17 -5.062 19.457 9.876 1.00 0.00 O ATOM 293 NE2 GLN A 17 -6.060 19.959 11.752 1.00 0.00 N ATOM 0 H GLN A 17 -4.922 16.506 11.382 1.00 0.00 H new ATOM 0 HA GLN A 17 -2.666 17.866 10.331 1.00 0.00 H new ATOM 0 HB2 GLN A 17 -4.312 17.835 12.790 1.00 0.00 H new ATOM 0 HB3 GLN A 17 -2.641 18.244 13.124 1.00 0.00 H new ATOM 0 HG2 GLN A 17 -3.607 20.352 12.594 1.00 0.00 H new ATOM 0 HG3 GLN A 17 -2.831 19.890 11.092 1.00 0.00 H new ATOM 0 HE21 GLN A 17 -5.995 20.143 12.753 1.00 0.00 H new ATOM 0 HE22 GLN A 17 -6.966 19.996 11.284 1.00 0.00 H new ATOM 302 N ASN A 18 -1.949 15.509 12.521 1.00 0.00 N ATOM 303 CA ASN A 18 -0.815 14.694 13.043 1.00 0.00 C ATOM 304 C ASN A 18 -0.129 13.925 11.904 1.00 0.00 C ATOM 305 O ASN A 18 1.078 13.996 11.754 1.00 0.00 O ATOM 306 CB ASN A 18 -1.332 13.705 14.094 1.00 0.00 C ATOM 307 CG ASN A 18 -0.919 14.179 15.491 1.00 0.00 C ATOM 308 OD1 ASN A 18 0.020 13.667 16.065 1.00 0.00 O ATOM 309 ND2 ASN A 18 -1.589 15.143 16.064 1.00 0.00 N ATOM 0 H ASN A 18 -2.869 15.241 12.871 1.00 0.00 H new ATOM 0 HA ASN A 18 -0.086 15.365 13.498 1.00 0.00 H new ATOM 0 HB2 ASN A 18 -2.417 13.626 14.032 1.00 0.00 H new ATOM 0 HB3 ASN A 18 -0.929 12.711 13.902 1.00 0.00 H new ATOM 0 HD21 ASN A 18 -1.323 15.466 16.994 1.00 0.00 H new ATOM 0 HD22 ASN A 18 -2.378 15.573 15.581 1.00 0.00 H new ATOM 316 N GLU A 19 -0.880 13.188 11.110 1.00 0.00 N ATOM 317 CA GLU A 19 -0.263 12.407 9.992 1.00 0.00 C ATOM 318 C GLU A 19 -1.353 11.603 9.262 1.00 0.00 C ATOM 319 O GLU A 19 -2.490 12.028 9.174 1.00 0.00 O ATOM 320 CB GLU A 19 0.799 11.455 10.569 1.00 0.00 C ATOM 321 CG GLU A 19 2.058 11.501 9.699 1.00 0.00 C ATOM 322 CD GLU A 19 3.191 10.736 10.392 1.00 0.00 C ATOM 323 OE1 GLU A 19 3.912 11.353 11.162 1.00 0.00 O ATOM 324 OE2 GLU A 19 3.321 9.549 10.141 1.00 0.00 O ATOM 0 H GLU A 19 -1.893 13.097 11.192 1.00 0.00 H new ATOM 0 HA GLU A 19 0.209 13.086 9.282 1.00 0.00 H new ATOM 0 HB2 GLU A 19 1.041 11.742 11.592 1.00 0.00 H new ATOM 0 HB3 GLU A 19 0.408 10.438 10.607 1.00 0.00 H new ATOM 0 HG2 GLU A 19 1.854 11.062 8.722 1.00 0.00 H new ATOM 0 HG3 GLU A 19 2.356 12.535 9.527 1.00 0.00 H new ATOM 331 N GLU A 20 -1.015 10.445 8.737 1.00 0.00 N ATOM 332 CA GLU A 20 -2.022 9.610 8.017 1.00 0.00 C ATOM 333 C GLU A 20 -2.968 8.943 9.023 1.00 0.00 C ATOM 334 O GLU A 20 -2.668 8.825 10.198 1.00 0.00 O ATOM 335 CB GLU A 20 -1.302 8.535 7.200 1.00 0.00 C ATOM 336 CG GLU A 20 -2.176 8.117 6.012 1.00 0.00 C ATOM 337 CD GLU A 20 -1.371 7.215 5.071 1.00 0.00 C ATOM 338 OE1 GLU A 20 -0.673 7.748 4.222 1.00 0.00 O ATOM 339 OE2 GLU A 20 -1.468 6.007 5.212 1.00 0.00 O ATOM 0 H GLU A 20 -0.078 10.044 8.779 1.00 0.00 H new ATOM 0 HA GLU A 20 -2.604 10.247 7.351 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -0.345 8.916 6.844 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -1.087 7.670 7.828 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -3.062 7.590 6.367 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -2.524 9.000 5.476 1.00 0.00 H new ATOM 346 N LYS A 21 -4.115 8.514 8.558 1.00 0.00 N ATOM 347 CA LYS A 21 -5.115 7.860 9.452 1.00 0.00 C ATOM 348 C LYS A 21 -5.892 6.794 8.672 1.00 0.00 C ATOM 349 O LYS A 21 -5.684 6.588 7.489 1.00 0.00 O ATOM 350 CB LYS A 21 -6.098 8.914 9.968 1.00 0.00 C ATOM 351 CG LYS A 21 -6.343 8.716 11.467 1.00 0.00 C ATOM 352 CD LYS A 21 -7.344 9.763 11.966 1.00 0.00 C ATOM 353 CE LYS A 21 -8.704 9.535 11.299 1.00 0.00 C ATOM 354 NZ LYS A 21 -9.715 10.454 11.896 1.00 0.00 N ATOM 0 H LYS A 21 -4.403 8.591 7.583 1.00 0.00 H new ATOM 0 HA LYS A 21 -4.595 7.392 10.288 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -5.701 9.913 9.785 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -7.040 8.841 9.425 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -6.727 7.713 11.654 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -5.405 8.805 12.014 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -7.444 9.698 13.049 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -6.980 10.765 11.739 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -8.628 9.710 10.226 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -9.016 8.499 11.432 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -10.637 10.298 11.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -9.795 10.267 12.916 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -9.419 11.440 11.747 1.00 0.00 H new ATOM 368 N ILE A 22 -6.791 6.124 9.341 1.00 0.00 N ATOM 369 CA ILE A 22 -7.615 5.068 8.688 1.00 0.00 C ATOM 370 C ILE A 22 -9.044 5.153 9.233 1.00 0.00 C ATOM 371 O ILE A 22 -9.274 4.989 10.420 1.00 0.00 O ATOM 372 CB ILE A 22 -7.022 3.685 8.993 1.00 0.00 C ATOM 373 CG1 ILE A 22 -5.726 3.485 8.191 1.00 0.00 C ATOM 374 CG2 ILE A 22 -8.032 2.594 8.619 1.00 0.00 C ATOM 375 CD1 ILE A 22 -6.037 3.414 6.693 1.00 0.00 C ATOM 0 H ILE A 22 -6.992 6.267 10.331 1.00 0.00 H new ATOM 0 HA ILE A 22 -7.622 5.217 7.608 1.00 0.00 H new ATOM 0 HB ILE A 22 -6.799 3.620 10.058 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -5.037 4.306 8.388 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -5.230 2.569 8.511 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -7.607 1.614 8.837 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -8.946 2.730 9.198 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -8.263 2.661 7.556 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -5.111 3.272 6.136 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -6.709 2.577 6.500 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -6.513 4.342 6.376 1.00 0.00 H new ATOM 387 N LEU A 23 -10.000 5.411 8.377 1.00 0.00 N ATOM 388 CA LEU A 23 -11.412 5.513 8.837 1.00 0.00 C ATOM 389 C LEU A 23 -12.173 4.239 8.453 1.00 0.00 C ATOM 390 O LEU A 23 -12.406 3.974 7.287 1.00 0.00 O ATOM 391 CB LEU A 23 -12.080 6.730 8.173 1.00 0.00 C ATOM 392 CG LEU A 23 -13.000 7.476 9.159 1.00 0.00 C ATOM 393 CD1 LEU A 23 -13.371 6.587 10.354 1.00 0.00 C ATOM 394 CD2 LEU A 23 -12.290 8.736 9.660 1.00 0.00 C ATOM 0 H LEU A 23 -9.860 5.555 7.377 1.00 0.00 H new ATOM 0 HA LEU A 23 -11.432 5.632 9.920 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -11.313 7.411 7.803 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -12.659 6.403 7.310 1.00 0.00 H new ATOM 0 HG LEU A 23 -13.918 7.745 8.637 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -14.020 7.141 11.032 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -13.892 5.698 9.998 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -12.465 6.290 10.882 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -12.938 9.266 10.358 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -11.365 8.456 10.165 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -12.060 9.384 8.815 1.00 0.00 H new ATOM 406 N LEU A 24 -12.568 3.457 9.430 1.00 0.00 N ATOM 407 CA LEU A 24 -13.323 2.202 9.138 1.00 0.00 C ATOM 408 C LEU A 24 -14.784 2.392 9.559 1.00 0.00 C ATOM 409 O LEU A 24 -15.146 2.176 10.701 1.00 0.00 O ATOM 410 CB LEU A 24 -12.708 1.021 9.906 1.00 0.00 C ATOM 411 CG LEU A 24 -11.178 1.069 9.823 1.00 0.00 C ATOM 412 CD1 LEU A 24 -10.582 0.046 10.794 1.00 0.00 C ATOM 413 CD2 LEU A 24 -10.731 0.736 8.396 1.00 0.00 C ATOM 0 H LEU A 24 -12.398 3.637 10.420 1.00 0.00 H new ATOM 0 HA LEU A 24 -13.270 1.986 8.071 1.00 0.00 H new ATOM 0 HB2 LEU A 24 -13.023 1.053 10.949 1.00 0.00 H new ATOM 0 HB3 LEU A 24 -13.072 0.081 9.492 1.00 0.00 H new ATOM 0 HG LEU A 24 -10.832 2.068 10.088 1.00 0.00 H new ATOM 0 HD11 LEU A 24 -9.494 0.080 10.735 1.00 0.00 H new ATOM 0 HD12 LEU A 24 -10.898 0.282 11.810 1.00 0.00 H new ATOM 0 HD13 LEU A 24 -10.929 -0.953 10.529 1.00 0.00 H new ATOM 0 HD21 LEU A 24 -9.643 0.770 8.338 1.00 0.00 H new ATOM 0 HD22 LEU A 24 -11.077 -0.263 8.130 1.00 0.00 H new ATOM 0 HD23 LEU A 24 -11.154 1.463 7.703 1.00 0.00 H new ATOM 425 N GLY A 25 -15.622 2.797 8.635 1.00 0.00 N ATOM 426 CA GLY A 25 -17.065 3.008 8.950 1.00 0.00 C ATOM 427 C GLY A 25 -17.912 2.321 7.880 1.00 0.00 C ATOM 428 O GLY A 25 -17.750 2.571 6.705 1.00 0.00 O ATOM 0 H GLY A 25 -15.363 2.991 7.668 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -17.299 2.602 9.934 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -17.291 4.074 8.983 1.00 0.00 H new ATOM 432 N ALA A 26 -18.800 1.448 8.287 1.00 0.00 N ATOM 433 CA ALA A 26 -19.665 0.713 7.313 1.00 0.00 C ATOM 434 C ALA A 26 -20.395 1.697 6.392 1.00 0.00 C ATOM 435 O ALA A 26 -21.400 2.287 6.751 1.00 0.00 O ATOM 436 CB ALA A 26 -20.688 -0.133 8.068 1.00 0.00 C ATOM 0 H ALA A 26 -18.964 1.211 9.265 1.00 0.00 H new ATOM 0 HA ALA A 26 -19.032 0.067 6.705 1.00 0.00 H new ATOM 0 HB1 ALA A 26 -21.316 -0.667 7.355 1.00 0.00 H new ATOM 0 HB2 ALA A 26 -20.169 -0.851 8.703 1.00 0.00 H new ATOM 0 HB3 ALA A 26 -21.310 0.514 8.686 1.00 0.00 H new ATOM 442 N GLY A 27 -19.886 1.859 5.199 1.00 0.00 N ATOM 443 CA GLY A 27 -20.514 2.778 4.206 1.00 0.00 C ATOM 444 C GLY A 27 -19.809 4.143 4.188 1.00 0.00 C ATOM 445 O GLY A 27 -20.289 5.072 3.563 1.00 0.00 O ATOM 0 H GLY A 27 -19.047 1.384 4.866 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -20.470 2.330 3.213 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -21.568 2.913 4.448 1.00 0.00 H new ATOM 449 N ILE A 28 -18.680 4.279 4.852 1.00 0.00 N ATOM 450 CA ILE A 28 -17.960 5.579 4.857 1.00 0.00 C ATOM 451 C ILE A 28 -17.529 5.925 3.424 1.00 0.00 C ATOM 452 O ILE A 28 -17.602 7.068 3.012 1.00 0.00 O ATOM 453 CB ILE A 28 -16.749 5.472 5.800 1.00 0.00 C ATOM 454 CG1 ILE A 28 -16.611 6.775 6.575 1.00 0.00 C ATOM 455 CG2 ILE A 28 -15.457 5.205 5.017 1.00 0.00 C ATOM 456 CD1 ILE A 28 -16.140 6.473 7.996 1.00 0.00 C ATOM 0 H ILE A 28 -18.232 3.537 5.390 1.00 0.00 H new ATOM 0 HA ILE A 28 -18.608 6.378 5.217 1.00 0.00 H new ATOM 0 HB ILE A 28 -16.911 4.637 6.482 1.00 0.00 H new ATOM 0 HG12 ILE A 28 -15.900 7.434 6.077 1.00 0.00 H new ATOM 0 HG13 ILE A 28 -17.567 7.299 6.600 1.00 0.00 H new ATOM 0 HG21 ILE A 28 -14.619 5.135 5.711 1.00 0.00 H new ATOM 0 HG22 ILE A 28 -15.552 4.269 4.466 1.00 0.00 H new ATOM 0 HG23 ILE A 28 -15.281 6.021 4.317 1.00 0.00 H new ATOM 0 HD11 ILE A 28 -16.041 7.405 8.552 1.00 0.00 H new ATOM 0 HD12 ILE A 28 -16.868 5.830 8.492 1.00 0.00 H new ATOM 0 HD13 ILE A 28 -15.175 5.968 7.960 1.00 0.00 H new ATOM 468 N ALA A 29 -17.109 4.938 2.657 1.00 0.00 N ATOM 469 CA ALA A 29 -16.706 5.199 1.240 1.00 0.00 C ATOM 470 C ALA A 29 -17.901 5.801 0.501 1.00 0.00 C ATOM 471 O ALA A 29 -17.755 6.718 -0.287 1.00 0.00 O ATOM 472 CB ALA A 29 -16.293 3.889 0.565 1.00 0.00 C ATOM 0 H ALA A 29 -17.030 3.966 2.956 1.00 0.00 H new ATOM 0 HA ALA A 29 -15.861 5.887 1.216 1.00 0.00 H new ATOM 0 HB1 ALA A 29 -16.001 4.087 -0.466 1.00 0.00 H new ATOM 0 HB2 ALA A 29 -15.452 3.452 1.103 1.00 0.00 H new ATOM 0 HB3 ALA A 29 -17.132 3.193 0.577 1.00 0.00 H new ATOM 478 N PHE A 30 -19.089 5.306 0.778 1.00 0.00 N ATOM 479 CA PHE A 30 -20.307 5.860 0.127 1.00 0.00 C ATOM 480 C PHE A 30 -20.536 7.276 0.661 1.00 0.00 C ATOM 481 O PHE A 30 -20.363 7.536 1.840 1.00 0.00 O ATOM 482 CB PHE A 30 -21.517 4.979 0.459 1.00 0.00 C ATOM 483 CG PHE A 30 -22.673 5.349 -0.440 1.00 0.00 C ATOM 484 CD1 PHE A 30 -22.749 4.823 -1.737 1.00 0.00 C ATOM 485 CD2 PHE A 30 -23.669 6.218 0.021 1.00 0.00 C ATOM 486 CE1 PHE A 30 -23.820 5.167 -2.569 1.00 0.00 C ATOM 487 CE2 PHE A 30 -24.740 6.562 -0.812 1.00 0.00 C ATOM 488 CZ PHE A 30 -24.816 6.037 -2.107 1.00 0.00 C ATOM 0 H PHE A 30 -19.259 4.540 1.430 1.00 0.00 H new ATOM 0 HA PHE A 30 -20.177 5.884 -0.955 1.00 0.00 H new ATOM 0 HB2 PHE A 30 -21.262 3.928 0.326 1.00 0.00 H new ATOM 0 HB3 PHE A 30 -21.799 5.109 1.504 1.00 0.00 H new ATOM 0 HD1 PHE A 30 -21.981 4.153 -2.094 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -23.611 6.623 1.020 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -23.879 4.761 -3.568 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -25.508 7.233 -0.455 1.00 0.00 H new ATOM 0 HZ PHE A 30 -25.642 6.302 -2.750 1.00 0.00 H new ATOM 498 N ASN A 31 -20.911 8.188 -0.202 1.00 0.00 N ATOM 499 CA ASN A 31 -21.147 9.605 0.227 1.00 0.00 C ATOM 500 C ASN A 31 -19.804 10.290 0.528 1.00 0.00 C ATOM 501 O ASN A 31 -19.714 11.164 1.372 1.00 0.00 O ATOM 502 CB ASN A 31 -22.042 9.622 1.475 1.00 0.00 C ATOM 503 CG ASN A 31 -22.768 10.966 1.576 1.00 0.00 C ATOM 504 OD1 ASN A 31 -22.410 11.804 2.380 1.00 0.00 O ATOM 505 ND2 ASN A 31 -23.783 11.209 0.790 1.00 0.00 N ATOM 0 H ASN A 31 -21.065 8.011 -1.195 1.00 0.00 H new ATOM 0 HA ASN A 31 -21.645 10.148 -0.576 1.00 0.00 H new ATOM 0 HB2 ASN A 31 -22.767 8.810 1.424 1.00 0.00 H new ATOM 0 HB3 ASN A 31 -21.439 9.456 2.368 1.00 0.00 H new ATOM 0 HD21 ASN A 31 -24.274 12.101 0.852 1.00 0.00 H new ATOM 0 HD22 ASN A 31 -24.085 10.507 0.115 1.00 0.00 H new ATOM 512 N LYS A 32 -18.765 9.898 -0.169 1.00 0.00 N ATOM 513 CA LYS A 32 -17.419 10.512 0.053 1.00 0.00 C ATOM 514 C LYS A 32 -16.548 10.343 -1.201 1.00 0.00 C ATOM 515 O LYS A 32 -16.815 9.508 -2.048 1.00 0.00 O ATOM 516 CB LYS A 32 -16.736 9.831 1.243 1.00 0.00 C ATOM 517 CG LYS A 32 -16.670 10.803 2.423 1.00 0.00 C ATOM 518 CD LYS A 32 -16.992 10.060 3.720 1.00 0.00 C ATOM 519 CE LYS A 32 -18.504 10.081 3.961 1.00 0.00 C ATOM 520 NZ LYS A 32 -18.851 9.124 5.048 1.00 0.00 N ATOM 0 H LYS A 32 -18.792 9.174 -0.887 1.00 0.00 H new ATOM 0 HA LYS A 32 -17.544 11.575 0.260 1.00 0.00 H new ATOM 0 HB2 LYS A 32 -17.287 8.935 1.528 1.00 0.00 H new ATOM 0 HB3 LYS A 32 -15.731 9.512 0.965 1.00 0.00 H new ATOM 0 HG2 LYS A 32 -15.677 11.249 2.485 1.00 0.00 H new ATOM 0 HG3 LYS A 32 -17.377 11.619 2.275 1.00 0.00 H new ATOM 0 HD2 LYS A 32 -16.637 9.031 3.659 1.00 0.00 H new ATOM 0 HD3 LYS A 32 -16.473 10.527 4.557 1.00 0.00 H new ATOM 0 HE2 LYS A 32 -18.825 11.087 4.232 1.00 0.00 H new ATOM 0 HE3 LYS A 32 -19.032 9.814 3.046 1.00 0.00 H new ATOM 0 HZ1 LYS A 32 -19.822 9.305 5.373 1.00 0.00 H new ATOM 0 HZ2 LYS A 32 -18.782 8.151 4.689 1.00 0.00 H new ATOM 0 HZ3 LYS A 32 -18.191 9.247 5.843 1.00 0.00 H new ATOM 534 N LYS A 33 -15.505 11.133 -1.317 1.00 0.00 N ATOM 535 CA LYS A 33 -14.602 11.034 -2.504 1.00 0.00 C ATOM 536 C LYS A 33 -13.196 11.532 -2.134 1.00 0.00 C ATOM 537 O LYS A 33 -12.957 11.982 -1.029 1.00 0.00 O ATOM 538 CB LYS A 33 -15.168 11.887 -3.647 1.00 0.00 C ATOM 539 CG LYS A 33 -15.281 11.037 -4.916 1.00 0.00 C ATOM 540 CD LYS A 33 -14.500 11.705 -6.050 1.00 0.00 C ATOM 541 CE LYS A 33 -14.350 10.722 -7.215 1.00 0.00 C ATOM 542 NZ LYS A 33 -13.612 11.381 -8.332 1.00 0.00 N ATOM 0 H LYS A 33 -15.242 11.845 -0.636 1.00 0.00 H new ATOM 0 HA LYS A 33 -14.538 9.994 -2.823 1.00 0.00 H new ATOM 0 HB2 LYS A 33 -16.147 12.279 -3.371 1.00 0.00 H new ATOM 0 HB3 LYS A 33 -14.521 12.745 -3.829 1.00 0.00 H new ATOM 0 HG2 LYS A 33 -14.891 10.036 -4.732 1.00 0.00 H new ATOM 0 HG3 LYS A 33 -16.328 10.924 -5.199 1.00 0.00 H new ATOM 0 HD2 LYS A 33 -15.019 12.604 -6.383 1.00 0.00 H new ATOM 0 HD3 LYS A 33 -13.518 12.017 -5.695 1.00 0.00 H new ATOM 0 HE2 LYS A 33 -13.814 9.832 -6.886 1.00 0.00 H new ATOM 0 HE3 LYS A 33 -15.332 10.395 -7.557 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 -13.510 10.713 -9.123 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 -14.141 12.218 -8.651 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 -12.670 11.672 -8.002 1.00 0.00 H new ATOM 556 N LYS A 34 -12.266 11.448 -3.056 1.00 0.00 N ATOM 557 CA LYS A 34 -10.869 11.906 -2.782 1.00 0.00 C ATOM 558 C LYS A 34 -10.859 13.392 -2.421 1.00 0.00 C ATOM 559 O LYS A 34 -11.461 14.214 -3.090 1.00 0.00 O ATOM 560 CB LYS A 34 -10.004 11.671 -4.027 1.00 0.00 C ATOM 561 CG LYS A 34 -8.535 11.963 -3.702 1.00 0.00 C ATOM 562 CD LYS A 34 -7.835 10.670 -3.276 1.00 0.00 C ATOM 563 CE LYS A 34 -6.333 10.928 -3.118 1.00 0.00 C ATOM 564 NZ LYS A 34 -6.094 11.811 -1.938 1.00 0.00 N ATOM 0 H LYS A 34 -12.418 11.078 -3.994 1.00 0.00 H new ATOM 0 HA LYS A 34 -10.466 11.339 -1.942 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -10.113 10.641 -4.367 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -10.340 12.313 -4.841 1.00 0.00 H new ATOM 0 HG2 LYS A 34 -8.037 12.388 -4.574 1.00 0.00 H new ATOM 0 HG3 LYS A 34 -8.469 12.704 -2.905 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -8.254 10.310 -2.336 1.00 0.00 H new ATOM 0 HD3 LYS A 34 -8.004 9.891 -4.019 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -5.804 9.984 -2.991 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -5.938 11.396 -4.020 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -5.188 11.559 -1.493 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -6.063 12.803 -2.248 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -6.864 11.687 -1.250 1.00 0.00 H new ATOM 578 N ASN A 35 -10.162 13.724 -1.358 1.00 0.00 N ATOM 579 CA ASN A 35 -10.052 15.141 -0.892 1.00 0.00 C ATOM 580 C ASN A 35 -11.327 15.588 -0.153 1.00 0.00 C ATOM 581 O ASN A 35 -11.437 16.732 0.253 1.00 0.00 O ATOM 582 CB ASN A 35 -9.791 16.069 -2.087 1.00 0.00 C ATOM 583 CG ASN A 35 -8.592 16.973 -1.784 1.00 0.00 C ATOM 584 OD1 ASN A 35 -7.593 16.926 -2.474 1.00 0.00 O ATOM 585 ND2 ASN A 35 -8.649 17.799 -0.775 1.00 0.00 N ATOM 0 H ASN A 35 -9.653 13.053 -0.782 1.00 0.00 H new ATOM 0 HA ASN A 35 -9.216 15.201 -0.195 1.00 0.00 H new ATOM 0 HB2 ASN A 35 -9.597 15.479 -2.983 1.00 0.00 H new ATOM 0 HB3 ASN A 35 -10.674 16.675 -2.289 1.00 0.00 H new ATOM 0 HD21 ASN A 35 -7.855 18.405 -0.566 1.00 0.00 H new ATOM 0 HD22 ASN A 35 -9.487 17.839 -0.195 1.00 0.00 H new ATOM 592 N ASP A 36 -12.283 14.705 0.038 1.00 0.00 N ATOM 593 CA ASP A 36 -13.530 15.089 0.759 1.00 0.00 C ATOM 594 C ASP A 36 -13.372 14.765 2.247 1.00 0.00 C ATOM 595 O ASP A 36 -12.694 13.823 2.618 1.00 0.00 O ATOM 596 CB ASP A 36 -14.710 14.302 0.186 1.00 0.00 C ATOM 597 CG ASP A 36 -15.086 14.856 -1.192 1.00 0.00 C ATOM 598 OD1 ASP A 36 -14.392 14.543 -2.146 1.00 0.00 O ATOM 599 OD2 ASP A 36 -16.062 15.584 -1.270 1.00 0.00 O ATOM 0 H ASP A 36 -12.248 13.735 -0.277 1.00 0.00 H new ATOM 0 HA ASP A 36 -13.713 16.156 0.636 1.00 0.00 H new ATOM 0 HB2 ASP A 36 -14.449 13.247 0.105 1.00 0.00 H new ATOM 0 HB3 ASP A 36 -15.564 14.368 0.860 1.00 0.00 H new ATOM 604 N ILE A 37 -13.995 15.537 3.100 1.00 0.00 N ATOM 605 CA ILE A 37 -13.889 15.281 4.567 1.00 0.00 C ATOM 606 C ILE A 37 -14.695 14.029 4.923 1.00 0.00 C ATOM 607 O ILE A 37 -15.742 13.766 4.354 1.00 0.00 O ATOM 608 CB ILE A 37 -14.431 16.479 5.358 1.00 0.00 C ATOM 609 CG1 ILE A 37 -13.848 17.788 4.802 1.00 0.00 C ATOM 610 CG2 ILE A 37 -14.049 16.336 6.835 1.00 0.00 C ATOM 611 CD1 ILE A 37 -12.322 17.796 4.959 1.00 0.00 C ATOM 0 H ILE A 37 -14.574 16.336 2.842 1.00 0.00 H new ATOM 0 HA ILE A 37 -12.841 15.133 4.826 1.00 0.00 H new ATOM 0 HB ILE A 37 -15.516 16.504 5.262 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -14.113 17.895 3.750 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -14.280 18.639 5.328 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -14.435 17.188 7.395 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -14.476 15.416 7.234 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -12.964 16.302 6.928 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -11.920 18.728 4.562 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -12.064 17.711 6.015 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -11.896 16.955 4.412 1.00 0.00 H new ATOM 623 N VAL A 38 -14.211 13.259 5.863 1.00 0.00 N ATOM 624 CA VAL A 38 -14.931 12.017 6.272 1.00 0.00 C ATOM 625 C VAL A 38 -16.099 12.374 7.197 1.00 0.00 C ATOM 626 O VAL A 38 -15.944 13.099 8.165 1.00 0.00 O ATOM 627 CB VAL A 38 -13.973 11.055 6.995 1.00 0.00 C ATOM 628 CG1 VAL A 38 -13.507 11.663 8.319 1.00 0.00 C ATOM 629 CG2 VAL A 38 -14.700 9.738 7.285 1.00 0.00 C ATOM 0 H VAL A 38 -13.343 13.439 6.367 1.00 0.00 H new ATOM 0 HA VAL A 38 -15.314 11.525 5.378 1.00 0.00 H new ATOM 0 HB VAL A 38 -13.108 10.877 6.357 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -12.830 10.971 8.819 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -12.988 12.602 8.126 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -14.371 11.850 8.957 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -14.023 9.054 7.797 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -15.567 9.932 7.917 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -15.028 9.289 6.347 1.00 0.00 H new ATOM 639 N ASP A 39 -17.261 11.850 6.906 1.00 0.00 N ATOM 640 CA ASP A 39 -18.451 12.122 7.760 1.00 0.00 C ATOM 641 C ASP A 39 -18.239 11.425 9.110 1.00 0.00 C ATOM 642 O ASP A 39 -17.901 10.256 9.145 1.00 0.00 O ATOM 643 CB ASP A 39 -19.709 11.568 7.076 1.00 0.00 C ATOM 644 CG ASP A 39 -20.958 11.999 7.852 1.00 0.00 C ATOM 645 OD1 ASP A 39 -21.361 13.142 7.706 1.00 0.00 O ATOM 646 OD2 ASP A 39 -21.492 11.175 8.576 1.00 0.00 O ATOM 0 H ASP A 39 -17.436 11.241 6.107 1.00 0.00 H new ATOM 0 HA ASP A 39 -18.577 13.194 7.909 1.00 0.00 H new ATOM 0 HB2 ASP A 39 -19.765 11.931 6.050 1.00 0.00 H new ATOM 0 HB3 ASP A 39 -19.658 10.480 7.027 1.00 0.00 H new ATOM 651 N PRO A 40 -18.429 12.162 10.181 1.00 0.00 N ATOM 652 CA PRO A 40 -18.242 11.635 11.547 1.00 0.00 C ATOM 653 C PRO A 40 -19.353 10.645 11.910 1.00 0.00 C ATOM 654 O PRO A 40 -19.106 9.661 12.584 1.00 0.00 O ATOM 655 CB PRO A 40 -18.280 12.885 12.429 1.00 0.00 C ATOM 656 CG PRO A 40 -19.020 13.969 11.613 1.00 0.00 C ATOM 657 CD PRO A 40 -18.866 13.574 10.132 1.00 0.00 C ATOM 0 HA PRO A 40 -17.314 11.076 11.666 1.00 0.00 H new ATOM 0 HB2 PRO A 40 -18.797 12.683 13.367 1.00 0.00 H new ATOM 0 HB3 PRO A 40 -17.272 13.211 12.685 1.00 0.00 H new ATOM 0 HG2 PRO A 40 -20.072 14.018 11.895 1.00 0.00 H new ATOM 0 HG3 PRO A 40 -18.594 14.955 11.799 1.00 0.00 H new ATOM 0 HD2 PRO A 40 -19.806 13.682 9.590 1.00 0.00 H new ATOM 0 HD3 PRO A 40 -18.132 14.201 9.626 1.00 0.00 H new ATOM 665 N SER A 41 -20.564 10.876 11.450 1.00 0.00 N ATOM 666 CA SER A 41 -21.672 9.918 11.748 1.00 0.00 C ATOM 667 C SER A 41 -21.300 8.550 11.159 1.00 0.00 C ATOM 668 O SER A 41 -21.659 7.515 11.692 1.00 0.00 O ATOM 669 CB SER A 41 -22.977 10.416 11.119 1.00 0.00 C ATOM 670 OG SER A 41 -24.071 10.037 11.942 1.00 0.00 O ATOM 0 H SER A 41 -20.828 11.683 10.885 1.00 0.00 H new ATOM 0 HA SER A 41 -21.815 9.837 12.826 1.00 0.00 H new ATOM 0 HB2 SER A 41 -22.950 11.500 11.008 1.00 0.00 H new ATOM 0 HB3 SER A 41 -23.096 9.996 10.120 1.00 0.00 H new ATOM 0 HG SER A 41 -24.907 10.356 11.542 1.00 0.00 H new ATOM 676 N LYS A 42 -20.559 8.551 10.071 1.00 0.00 N ATOM 677 CA LYS A 42 -20.123 7.274 9.434 1.00 0.00 C ATOM 678 C LYS A 42 -18.850 6.762 10.127 1.00 0.00 C ATOM 679 O LYS A 42 -18.591 5.573 10.144 1.00 0.00 O ATOM 680 CB LYS A 42 -19.836 7.516 7.950 1.00 0.00 C ATOM 681 CG LYS A 42 -21.157 7.680 7.192 1.00 0.00 C ATOM 682 CD LYS A 42 -21.152 6.784 5.950 1.00 0.00 C ATOM 683 CE LYS A 42 -22.561 6.244 5.698 1.00 0.00 C ATOM 684 NZ LYS A 42 -22.758 4.979 6.462 1.00 0.00 N ATOM 0 H LYS A 42 -20.237 9.395 9.597 1.00 0.00 H new ATOM 0 HA LYS A 42 -20.913 6.530 9.534 1.00 0.00 H new ATOM 0 HB2 LYS A 42 -19.222 8.408 7.829 1.00 0.00 H new ATOM 0 HB3 LYS A 42 -19.270 6.681 7.538 1.00 0.00 H new ATOM 0 HG2 LYS A 42 -21.994 7.417 7.839 1.00 0.00 H new ATOM 0 HG3 LYS A 42 -21.294 8.721 6.901 1.00 0.00 H new ATOM 0 HD2 LYS A 42 -20.808 7.349 5.084 1.00 0.00 H new ATOM 0 HD3 LYS A 42 -20.455 5.958 6.089 1.00 0.00 H new ATOM 0 HE2 LYS A 42 -23.303 6.982 6.001 1.00 0.00 H new ATOM 0 HE3 LYS A 42 -22.707 6.063 4.633 1.00 0.00 H new ATOM 0 HZ1 LYS A 42 -23.698 4.588 6.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 42 -22.027 4.291 6.190 1.00 0.00 H new ATOM 0 HZ3 LYS A 42 -22.687 5.174 7.481 1.00 0.00 H new ATOM 698 N ILE A 43 -18.058 7.651 10.700 1.00 0.00 N ATOM 699 CA ILE A 43 -16.801 7.225 11.399 1.00 0.00 C ATOM 700 C ILE A 43 -17.144 6.206 12.489 1.00 0.00 C ATOM 701 O ILE A 43 -17.724 6.538 13.509 1.00 0.00 O ATOM 702 CB ILE A 43 -16.115 8.445 12.035 1.00 0.00 C ATOM 703 CG1 ILE A 43 -15.494 9.315 10.935 1.00 0.00 C ATOM 704 CG2 ILE A 43 -15.014 7.977 12.994 1.00 0.00 C ATOM 705 CD1 ILE A 43 -14.977 10.623 11.541 1.00 0.00 C ATOM 0 H ILE A 43 -18.234 8.656 10.711 1.00 0.00 H new ATOM 0 HA ILE A 43 -16.124 6.772 10.674 1.00 0.00 H new ATOM 0 HB ILE A 43 -16.854 9.026 12.587 1.00 0.00 H new ATOM 0 HG12 ILE A 43 -14.677 8.779 10.452 1.00 0.00 H new ATOM 0 HG13 ILE A 43 -16.235 9.528 10.165 1.00 0.00 H new ATOM 0 HG21 ILE A 43 -14.530 8.844 13.443 1.00 0.00 H new ATOM 0 HG22 ILE A 43 -15.453 7.360 13.778 1.00 0.00 H new ATOM 0 HG23 ILE A 43 -14.276 7.394 12.444 1.00 0.00 H new ATOM 0 HD11 ILE A 43 -14.537 11.238 10.757 1.00 0.00 H new ATOM 0 HD12 ILE A 43 -15.804 11.162 12.003 1.00 0.00 H new ATOM 0 HD13 ILE A 43 -14.222 10.401 12.295 1.00 0.00 H new ATOM 717 N GLU A 44 -16.781 4.970 12.273 1.00 0.00 N ATOM 718 CA GLU A 44 -17.062 3.904 13.275 1.00 0.00 C ATOM 719 C GLU A 44 -15.755 3.507 13.969 1.00 0.00 C ATOM 720 O GLU A 44 -15.751 3.128 15.126 1.00 0.00 O ATOM 721 CB GLU A 44 -17.654 2.683 12.569 1.00 0.00 C ATOM 722 CG GLU A 44 -19.103 2.973 12.172 1.00 0.00 C ATOM 723 CD GLU A 44 -19.908 1.669 12.159 1.00 0.00 C ATOM 724 OE1 GLU A 44 -19.950 1.031 11.120 1.00 0.00 O ATOM 725 OE2 GLU A 44 -20.470 1.331 13.189 1.00 0.00 O ATOM 0 H GLU A 44 -16.296 4.651 11.434 1.00 0.00 H new ATOM 0 HA GLU A 44 -17.772 4.275 14.014 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -17.065 2.441 11.684 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -17.613 1.815 13.227 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -19.548 3.679 12.874 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -19.134 3.440 11.188 1.00 0.00 H new ATOM 732 N LYS A 45 -14.647 3.590 13.265 1.00 0.00 N ATOM 733 CA LYS A 45 -13.331 3.218 13.870 1.00 0.00 C ATOM 734 C LYS A 45 -12.230 4.136 13.326 1.00 0.00 C ATOM 735 O LYS A 45 -12.077 4.295 12.127 1.00 0.00 O ATOM 736 CB LYS A 45 -12.999 1.762 13.519 1.00 0.00 C ATOM 737 CG LYS A 45 -13.687 0.817 14.509 1.00 0.00 C ATOM 738 CD LYS A 45 -12.902 0.787 15.823 1.00 0.00 C ATOM 739 CE LYS A 45 -13.770 0.177 16.927 1.00 0.00 C ATOM 740 NZ LYS A 45 -14.652 1.229 17.510 1.00 0.00 N ATOM 0 H LYS A 45 -14.601 3.901 12.295 1.00 0.00 H new ATOM 0 HA LYS A 45 -13.391 3.329 14.953 1.00 0.00 H new ATOM 0 HB2 LYS A 45 -13.326 1.540 12.503 1.00 0.00 H new ATOM 0 HB3 LYS A 45 -11.920 1.609 13.547 1.00 0.00 H new ATOM 0 HG2 LYS A 45 -14.709 1.148 14.692 1.00 0.00 H new ATOM 0 HG3 LYS A 45 -13.747 -0.186 14.087 1.00 0.00 H new ATOM 0 HD2 LYS A 45 -11.990 0.203 15.700 1.00 0.00 H new ATOM 0 HD3 LYS A 45 -12.600 1.797 16.101 1.00 0.00 H new ATOM 0 HE2 LYS A 45 -14.374 -0.635 16.522 1.00 0.00 H new ATOM 0 HE3 LYS A 45 -13.138 -0.253 17.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 -15.445 0.779 18.011 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 -14.105 1.809 18.178 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 -15.022 1.833 16.749 1.00 0.00 H new ATOM 754 N THR A 46 -11.458 4.734 14.203 1.00 0.00 N ATOM 755 CA THR A 46 -10.357 5.641 13.758 1.00 0.00 C ATOM 756 C THR A 46 -9.006 4.988 14.072 1.00 0.00 C ATOM 757 O THR A 46 -8.710 4.672 15.212 1.00 0.00 O ATOM 758 CB THR A 46 -10.471 6.986 14.492 1.00 0.00 C ATOM 759 OG1 THR A 46 -11.649 7.661 14.066 1.00 0.00 O ATOM 760 CG2 THR A 46 -9.245 7.851 14.182 1.00 0.00 C ATOM 0 H THR A 46 -11.546 4.630 15.214 1.00 0.00 H new ATOM 0 HA THR A 46 -10.434 5.814 12.684 1.00 0.00 H new ATOM 0 HB THR A 46 -10.522 6.807 15.566 1.00 0.00 H new ATOM 0 HG1 THR A 46 -11.723 8.518 14.535 1.00 0.00 H new ATOM 0 HG21 THR A 46 -9.330 8.804 14.705 1.00 0.00 H new ATOM 0 HG22 THR A 46 -8.343 7.336 14.512 1.00 0.00 H new ATOM 0 HG23 THR A 46 -9.188 8.030 13.108 1.00 0.00 H new ATOM 768 N PHE A 47 -8.189 4.779 13.065 1.00 0.00 N ATOM 769 CA PHE A 47 -6.858 4.141 13.282 1.00 0.00 C ATOM 770 C PHE A 47 -5.745 5.045 12.749 1.00 0.00 C ATOM 771 O PHE A 47 -5.802 5.529 11.638 1.00 0.00 O ATOM 772 CB PHE A 47 -6.805 2.807 12.545 1.00 0.00 C ATOM 773 CG PHE A 47 -7.391 1.719 13.409 1.00 0.00 C ATOM 774 CD1 PHE A 47 -8.773 1.657 13.626 1.00 0.00 C ATOM 775 CD2 PHE A 47 -6.548 0.771 13.995 1.00 0.00 C ATOM 776 CE1 PHE A 47 -9.307 0.645 14.430 1.00 0.00 C ATOM 777 CE2 PHE A 47 -7.081 -0.239 14.798 1.00 0.00 C ATOM 778 CZ PHE A 47 -8.460 -0.304 15.016 1.00 0.00 C ATOM 0 H PHE A 47 -8.393 5.026 12.097 1.00 0.00 H new ATOM 0 HA PHE A 47 -6.716 3.984 14.351 1.00 0.00 H new ATOM 0 HB2 PHE A 47 -7.358 2.877 11.608 1.00 0.00 H new ATOM 0 HB3 PHE A 47 -5.774 2.564 12.289 1.00 0.00 H new ATOM 0 HD1 PHE A 47 -9.425 2.389 13.173 1.00 0.00 H new ATOM 0 HD2 PHE A 47 -5.482 0.820 13.826 1.00 0.00 H new ATOM 0 HE1 PHE A 47 -10.373 0.595 14.599 1.00 0.00 H new ATOM 0 HE2 PHE A 47 -6.428 -0.970 15.251 1.00 0.00 H new ATOM 0 HZ PHE A 47 -8.872 -1.086 15.636 1.00 0.00 H new ATOM 788 N ILE A 48 -4.733 5.264 13.543 1.00 0.00 N ATOM 789 CA ILE A 48 -3.589 6.123 13.116 1.00 0.00 C ATOM 790 C ILE A 48 -2.290 5.315 13.223 1.00 0.00 C ATOM 791 O ILE A 48 -2.141 4.483 14.101 1.00 0.00 O ATOM 792 CB ILE A 48 -3.497 7.358 14.023 1.00 0.00 C ATOM 793 CG1 ILE A 48 -4.891 7.685 14.583 1.00 0.00 C ATOM 794 CG2 ILE A 48 -2.966 8.545 13.212 1.00 0.00 C ATOM 795 CD1 ILE A 48 -4.898 9.087 15.194 1.00 0.00 C ATOM 0 H ILE A 48 -4.648 4.879 14.484 1.00 0.00 H new ATOM 0 HA ILE A 48 -3.742 6.447 12.087 1.00 0.00 H new ATOM 0 HB ILE A 48 -2.817 7.158 14.851 1.00 0.00 H new ATOM 0 HG12 ILE A 48 -5.634 7.623 13.788 1.00 0.00 H new ATOM 0 HG13 ILE A 48 -5.170 6.950 15.338 1.00 0.00 H new ATOM 0 HG21 ILE A 48 -2.900 9.424 13.854 1.00 0.00 H new ATOM 0 HG22 ILE A 48 -1.977 8.305 12.821 1.00 0.00 H new ATOM 0 HG23 ILE A 48 -3.643 8.751 12.383 1.00 0.00 H new ATOM 0 HD11 ILE A 48 -5.890 9.308 15.587 1.00 0.00 H new ATOM 0 HD12 ILE A 48 -4.168 9.135 16.002 1.00 0.00 H new ATOM 0 HD13 ILE A 48 -4.640 9.819 14.428 1.00 0.00 H new ATOM 807 N ARG A 49 -1.355 5.553 12.334 1.00 0.00 N ATOM 808 CA ARG A 49 -0.060 4.802 12.370 1.00 0.00 C ATOM 809 C ARG A 49 0.622 5.015 13.730 1.00 0.00 C ATOM 810 O ARG A 49 1.107 6.092 14.034 1.00 0.00 O ATOM 811 CB ARG A 49 0.859 5.289 11.238 1.00 0.00 C ATOM 812 CG ARG A 49 1.012 6.815 11.295 1.00 0.00 C ATOM 813 CD ARG A 49 0.713 7.415 9.919 1.00 0.00 C ATOM 814 NE ARG A 49 1.861 7.157 9.002 1.00 0.00 N ATOM 815 CZ ARG A 49 1.734 7.372 7.719 1.00 0.00 C ATOM 816 NH1 ARG A 49 1.243 6.438 6.948 1.00 0.00 N ATOM 817 NH2 ARG A 49 2.098 8.519 7.211 1.00 0.00 N ATOM 0 H ARG A 49 -1.434 6.238 11.582 1.00 0.00 H new ATOM 0 HA ARG A 49 -0.257 3.739 12.231 1.00 0.00 H new ATOM 0 HB2 ARG A 49 1.837 4.815 11.325 1.00 0.00 H new ATOM 0 HB3 ARG A 49 0.447 4.994 10.273 1.00 0.00 H new ATOM 0 HG2 ARG A 49 0.333 7.231 12.039 1.00 0.00 H new ATOM 0 HG3 ARG A 49 2.024 7.077 11.605 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -0.198 6.978 9.510 1.00 0.00 H new ATOM 0 HD3 ARG A 49 0.539 8.487 10.008 1.00 0.00 H new ATOM 0 HE ARG A 49 2.745 6.813 9.376 1.00 0.00 H new ATOM 0 HH11 ARG A 49 0.960 5.543 7.348 1.00 0.00 H new ATOM 0 HH12 ARG A 49 1.143 6.604 5.947 1.00 0.00 H new ATOM 0 HH21 ARG A 49 2.481 9.246 7.815 1.00 0.00 H new ATOM 0 HH22 ARG A 49 1.999 8.688 6.210 1.00 0.00 H new ATOM 831 N LYS A 50 0.647 3.993 14.553 1.00 0.00 N ATOM 832 CA LYS A 50 1.280 4.116 15.899 1.00 0.00 C ATOM 833 C LYS A 50 2.452 3.134 16.012 1.00 0.00 C ATOM 834 O LYS A 50 2.318 1.956 15.731 1.00 0.00 O ATOM 835 CB LYS A 50 0.239 3.803 16.979 1.00 0.00 C ATOM 836 CG LYS A 50 0.599 4.540 18.271 1.00 0.00 C ATOM 837 CD LYS A 50 0.289 3.646 19.475 1.00 0.00 C ATOM 838 CE LYS A 50 1.596 3.118 20.074 1.00 0.00 C ATOM 839 NZ LYS A 50 1.950 1.816 19.438 1.00 0.00 N ATOM 0 H LYS A 50 0.253 3.075 14.346 1.00 0.00 H new ATOM 0 HA LYS A 50 1.651 5.132 16.034 1.00 0.00 H new ATOM 0 HB2 LYS A 50 -0.752 4.105 16.641 1.00 0.00 H new ATOM 0 HB3 LYS A 50 0.200 2.729 17.160 1.00 0.00 H new ATOM 0 HG2 LYS A 50 1.656 4.808 18.267 1.00 0.00 H new ATOM 0 HG3 LYS A 50 0.035 5.470 18.341 1.00 0.00 H new ATOM 0 HD2 LYS A 50 -0.265 4.209 20.226 1.00 0.00 H new ATOM 0 HD3 LYS A 50 -0.345 2.814 19.169 1.00 0.00 H new ATOM 0 HE2 LYS A 50 2.397 3.840 19.917 1.00 0.00 H new ATOM 0 HE3 LYS A 50 1.488 2.990 21.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 50 2.838 1.460 19.847 1.00 0.00 H new ATOM 0 HZ2 LYS A 50 1.189 1.128 19.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 50 2.070 1.951 18.414 1.00 0.00 H new ATOM 853 N ASP A 51 3.600 3.618 16.426 1.00 0.00 N ATOM 854 CA ASP A 51 4.794 2.732 16.568 1.00 0.00 C ATOM 855 C ASP A 51 5.850 3.432 17.431 1.00 0.00 C ATOM 856 O ASP A 51 6.199 2.963 18.499 1.00 0.00 O ATOM 857 CB ASP A 51 5.378 2.428 15.181 1.00 0.00 C ATOM 858 CG ASP A 51 6.487 1.376 15.304 1.00 0.00 C ATOM 859 OD1 ASP A 51 6.163 0.199 15.310 1.00 0.00 O ATOM 860 OD2 ASP A 51 7.640 1.766 15.387 1.00 0.00 O ATOM 0 H ASP A 51 3.759 4.595 16.672 1.00 0.00 H new ATOM 0 HA ASP A 51 4.498 1.798 17.046 1.00 0.00 H new ATOM 0 HB2 ASP A 51 4.593 2.066 14.517 1.00 0.00 H new ATOM 0 HB3 ASP A 51 5.777 3.340 14.736 1.00 0.00 H new ATOM 865 N THR A 52 6.355 4.552 16.971 1.00 0.00 N ATOM 866 CA THR A 52 7.392 5.301 17.750 1.00 0.00 C ATOM 867 C THR A 52 7.200 6.813 17.543 1.00 0.00 C ATOM 868 O THR A 52 6.915 7.254 16.444 1.00 0.00 O ATOM 869 CB THR A 52 8.798 4.899 17.279 1.00 0.00 C ATOM 870 OG1 THR A 52 8.813 4.749 15.863 1.00 0.00 O ATOM 871 CG2 THR A 52 9.204 3.578 17.938 1.00 0.00 C ATOM 0 H THR A 52 6.092 4.982 16.084 1.00 0.00 H new ATOM 0 HA THR A 52 7.284 5.058 18.807 1.00 0.00 H new ATOM 0 HB THR A 52 9.504 5.679 17.563 1.00 0.00 H new ATOM 0 HG1 THR A 52 8.486 3.856 15.625 1.00 0.00 H new ATOM 0 HG21 THR A 52 10.202 3.295 17.602 1.00 0.00 H new ATOM 0 HG22 THR A 52 9.206 3.697 19.021 1.00 0.00 H new ATOM 0 HG23 THR A 52 8.494 2.799 17.660 1.00 0.00 H new ATOM 879 N PRO A 53 7.364 7.561 18.614 1.00 0.00 N ATOM 880 CA PRO A 53 7.219 9.031 18.592 1.00 0.00 C ATOM 881 C PRO A 53 8.459 9.693 17.976 1.00 0.00 C ATOM 882 O PRO A 53 8.387 10.287 16.915 1.00 0.00 O ATOM 883 CB PRO A 53 7.068 9.399 20.073 1.00 0.00 C ATOM 884 CG PRO A 53 7.688 8.233 20.880 1.00 0.00 C ATOM 885 CD PRO A 53 7.711 7.011 19.942 1.00 0.00 C ATOM 0 HA PRO A 53 6.377 9.369 17.988 1.00 0.00 H new ATOM 0 HB2 PRO A 53 7.577 10.337 20.294 1.00 0.00 H new ATOM 0 HB3 PRO A 53 6.019 9.537 20.334 1.00 0.00 H new ATOM 0 HG2 PRO A 53 8.695 8.485 21.213 1.00 0.00 H new ATOM 0 HG3 PRO A 53 7.100 8.024 21.774 1.00 0.00 H new ATOM 0 HD2 PRO A 53 8.692 6.536 19.932 1.00 0.00 H new ATOM 0 HD3 PRO A 53 6.994 6.254 20.258 1.00 0.00 H new ATOM 893 N ASP A 54 9.589 9.595 18.634 1.00 0.00 N ATOM 894 CA ASP A 54 10.841 10.218 18.099 1.00 0.00 C ATOM 895 C ASP A 54 11.948 9.162 18.012 1.00 0.00 C ATOM 896 O ASP A 54 12.547 8.967 16.970 1.00 0.00 O ATOM 897 CB ASP A 54 11.284 11.352 19.030 1.00 0.00 C ATOM 898 CG ASP A 54 12.345 12.211 18.333 1.00 0.00 C ATOM 899 OD1 ASP A 54 11.966 13.147 17.646 1.00 0.00 O ATOM 900 OD2 ASP A 54 13.519 11.918 18.497 1.00 0.00 O ATOM 0 H ASP A 54 9.698 9.108 19.523 1.00 0.00 H new ATOM 0 HA ASP A 54 10.649 10.618 17.104 1.00 0.00 H new ATOM 0 HB2 ASP A 54 10.426 11.967 19.303 1.00 0.00 H new ATOM 0 HB3 ASP A 54 11.687 10.939 19.955 1.00 0.00 H new ATOM 905 N TYR A 55 12.224 8.486 19.103 1.00 0.00 N ATOM 906 CA TYR A 55 13.295 7.439 19.106 1.00 0.00 C ATOM 907 C TYR A 55 12.932 6.288 18.145 1.00 0.00 C ATOM 908 O TYR A 55 11.752 6.018 17.972 1.00 0.00 O ATOM 909 CB TYR A 55 13.480 6.898 20.536 1.00 0.00 C ATOM 910 CG TYR A 55 12.241 6.152 20.990 1.00 0.00 C ATOM 911 CD1 TYR A 55 12.117 4.779 20.738 1.00 0.00 C ATOM 912 CD2 TYR A 55 11.220 6.832 21.666 1.00 0.00 C ATOM 913 CE1 TYR A 55 10.975 4.090 21.159 1.00 0.00 C ATOM 914 CE2 TYR A 55 10.078 6.142 22.087 1.00 0.00 C ATOM 915 CZ TYR A 55 9.955 4.772 21.834 1.00 0.00 C ATOM 916 OH TYR A 55 8.828 4.091 22.248 1.00 0.00 O ATOM 917 OXT TYR A 55 13.848 5.696 17.598 1.00 0.00 O ATOM 0 H TYR A 55 11.750 8.616 19.997 1.00 0.00 H new ATOM 0 HA TYR A 55 14.228 7.887 18.765 1.00 0.00 H new ATOM 0 HB2 TYR A 55 14.344 6.234 20.570 1.00 0.00 H new ATOM 0 HB3 TYR A 55 13.685 7.723 21.219 1.00 0.00 H new ATOM 0 HD1 TYR A 55 12.904 4.253 20.218 1.00 0.00 H new ATOM 0 HD2 TYR A 55 11.314 7.890 21.862 1.00 0.00 H new ATOM 0 HE1 TYR A 55 10.880 3.032 20.964 1.00 0.00 H new ATOM 0 HE2 TYR A 55 9.291 6.668 22.608 1.00 0.00 H new ATOM 0 HH TYR A 55 8.219 4.711 22.701 1.00 0.00 H new TER 927 TYR A 55 ATOM 928 N MET B 1 -0.488 -11.004 16.400 1.00 0.00 N ATOM 929 CA MET B 1 -0.899 -10.216 15.201 1.00 0.00 C ATOM 930 C MET B 1 -1.702 -11.115 14.251 1.00 0.00 C ATOM 931 O MET B 1 -1.254 -11.468 13.174 1.00 0.00 O ATOM 932 CB MET B 1 0.349 -9.679 14.492 1.00 0.00 C ATOM 933 CG MET B 1 0.606 -8.238 14.936 1.00 0.00 C ATOM 934 SD MET B 1 2.331 -7.799 14.600 1.00 0.00 S ATOM 935 CE MET B 1 2.174 -7.572 12.811 1.00 0.00 C ATOM 0 H1 MET B 1 0.056 -10.396 17.045 1.00 0.00 H new ATOM 0 H2 MET B 1 -1.334 -11.358 16.890 1.00 0.00 H new ATOM 0 H3 MET B 1 0.101 -11.808 16.102 1.00 0.00 H new ATOM 0 HA MET B 1 -1.522 -9.376 15.507 1.00 0.00 H new ATOM 0 HB2 MET B 1 1.211 -10.303 14.728 1.00 0.00 H new ATOM 0 HB3 MET B 1 0.212 -9.719 13.411 1.00 0.00 H new ATOM 0 HG2 MET B 1 -0.063 -7.559 14.407 1.00 0.00 H new ATOM 0 HG3 MET B 1 0.393 -8.131 16.000 1.00 0.00 H new ATOM 0 HE1 MET B 1 2.805 -6.742 12.493 1.00 0.00 H new ATOM 0 HE2 MET B 1 2.487 -8.483 12.300 1.00 0.00 H new ATOM 0 HE3 MET B 1 1.136 -7.354 12.562 1.00 0.00 H new ATOM 947 N LYS B 2 -2.890 -11.484 14.655 1.00 0.00 N ATOM 948 CA LYS B 2 -3.750 -12.357 13.813 1.00 0.00 C ATOM 949 C LYS B 2 -4.748 -11.507 13.026 1.00 0.00 C ATOM 950 O LYS B 2 -4.940 -10.336 13.299 1.00 0.00 O ATOM 951 CB LYS B 2 -4.511 -13.332 14.711 1.00 0.00 C ATOM 952 CG LYS B 2 -3.542 -14.380 15.257 1.00 0.00 C ATOM 953 CD LYS B 2 -4.093 -14.961 16.560 1.00 0.00 C ATOM 954 CE LYS B 2 -3.315 -16.228 16.925 1.00 0.00 C ATOM 955 NZ LYS B 2 -3.777 -16.734 18.249 1.00 0.00 N ATOM 0 H LYS B 2 -3.303 -11.211 15.547 1.00 0.00 H new ATOM 0 HA LYS B 2 -3.124 -12.910 13.113 1.00 0.00 H new ATOM 0 HB2 LYS B 2 -4.983 -12.794 15.533 1.00 0.00 H new ATOM 0 HB3 LYS B 2 -5.308 -13.816 14.147 1.00 0.00 H new ATOM 0 HG2 LYS B 2 -3.400 -15.175 14.525 1.00 0.00 H new ATOM 0 HG3 LYS B 2 -2.565 -13.930 15.433 1.00 0.00 H new ATOM 0 HD2 LYS B 2 -4.010 -14.227 17.362 1.00 0.00 H new ATOM 0 HD3 LYS B 2 -5.152 -15.192 16.448 1.00 0.00 H new ATOM 0 HE2 LYS B 2 -3.463 -16.991 16.161 1.00 0.00 H new ATOM 0 HE3 LYS B 2 -2.247 -16.014 16.959 1.00 0.00 H new ATOM 0 HZ1 LYS B 2 -3.248 -17.595 18.496 1.00 0.00 H new ATOM 0 HZ2 LYS B 2 -3.614 -16.007 18.975 1.00 0.00 H new ATOM 0 HZ3 LYS B 2 -4.792 -16.954 18.202 1.00 0.00 H new ATOM 969 N ILE B 3 -5.385 -12.099 12.051 1.00 0.00 N ATOM 970 CA ILE B 3 -6.379 -11.352 11.226 1.00 0.00 C ATOM 971 C ILE B 3 -7.719 -11.289 11.970 1.00 0.00 C ATOM 972 O ILE B 3 -8.490 -12.234 11.980 1.00 0.00 O ATOM 973 CB ILE B 3 -6.548 -12.048 9.862 1.00 0.00 C ATOM 974 CG1 ILE B 3 -5.354 -11.697 8.966 1.00 0.00 C ATOM 975 CG2 ILE B 3 -7.840 -11.574 9.184 1.00 0.00 C ATOM 976 CD1 ILE B 3 -4.436 -12.912 8.825 1.00 0.00 C ATOM 0 H ILE B 3 -5.258 -13.076 11.789 1.00 0.00 H new ATOM 0 HA ILE B 3 -6.025 -10.335 11.056 1.00 0.00 H new ATOM 0 HB ILE B 3 -6.598 -13.126 10.015 1.00 0.00 H new ATOM 0 HG12 ILE B 3 -5.705 -11.380 7.984 1.00 0.00 H new ATOM 0 HG13 ILE B 3 -4.801 -10.860 9.393 1.00 0.00 H new ATOM 0 HG21 ILE B 3 -7.949 -12.072 8.221 1.00 0.00 H new ATOM 0 HG22 ILE B 3 -8.693 -11.817 9.817 1.00 0.00 H new ATOM 0 HG23 ILE B 3 -7.796 -10.496 9.032 1.00 0.00 H new ATOM 0 HD11 ILE B 3 -3.590 -12.657 8.187 1.00 0.00 H new ATOM 0 HD12 ILE B 3 -4.073 -13.209 9.809 1.00 0.00 H new ATOM 0 HD13 ILE B 3 -4.991 -13.737 8.378 1.00 0.00 H new ATOM 988 N LYS B 4 -7.995 -10.164 12.581 1.00 0.00 N ATOM 989 CA LYS B 4 -9.277 -9.981 13.321 1.00 0.00 C ATOM 990 C LYS B 4 -10.394 -9.704 12.311 1.00 0.00 C ATOM 991 O LYS B 4 -11.511 -10.165 12.463 1.00 0.00 O ATOM 992 CB LYS B 4 -9.144 -8.790 14.276 1.00 0.00 C ATOM 993 CG LYS B 4 -10.289 -8.808 15.293 1.00 0.00 C ATOM 994 CD LYS B 4 -11.182 -7.584 15.074 1.00 0.00 C ATOM 995 CE LYS B 4 -12.344 -7.614 16.070 1.00 0.00 C ATOM 996 NZ LYS B 4 -13.308 -6.523 15.744 1.00 0.00 N ATOM 0 H LYS B 4 -7.376 -9.354 12.597 1.00 0.00 H new ATOM 0 HA LYS B 4 -9.510 -10.879 13.893 1.00 0.00 H new ATOM 0 HB2 LYS B 4 -8.186 -8.833 14.793 1.00 0.00 H new ATOM 0 HB3 LYS B 4 -9.161 -7.857 13.713 1.00 0.00 H new ATOM 0 HG2 LYS B 4 -10.873 -9.722 15.184 1.00 0.00 H new ATOM 0 HG3 LYS B 4 -9.890 -8.804 16.307 1.00 0.00 H new ATOM 0 HD2 LYS B 4 -10.602 -6.670 15.203 1.00 0.00 H new ATOM 0 HD3 LYS B 4 -11.564 -7.578 14.053 1.00 0.00 H new ATOM 0 HE2 LYS B 4 -12.846 -8.581 16.030 1.00 0.00 H new ATOM 0 HE3 LYS B 4 -11.969 -7.491 17.086 1.00 0.00 H new ATOM 0 HZ1 LYS B 4 -14.138 -6.596 16.366 1.00 0.00 H new ATOM 0 HZ2 LYS B 4 -12.849 -5.601 15.885 1.00 0.00 H new ATOM 0 HZ3 LYS B 4 -13.610 -6.611 14.753 1.00 0.00 H new ATOM 1010 N ARG B 5 -10.087 -8.956 11.278 1.00 0.00 N ATOM 1011 CA ARG B 5 -11.105 -8.634 10.233 1.00 0.00 C ATOM 1012 C ARG B 5 -10.415 -8.463 8.877 1.00 0.00 C ATOM 1013 O ARG B 5 -9.202 -8.485 8.776 1.00 0.00 O ATOM 1014 CB ARG B 5 -11.831 -7.338 10.603 1.00 0.00 C ATOM 1015 CG ARG B 5 -13.241 -7.660 11.096 1.00 0.00 C ATOM 1016 CD ARG B 5 -14.120 -6.410 10.980 1.00 0.00 C ATOM 1017 NE ARG B 5 -14.944 -6.487 9.738 1.00 0.00 N ATOM 1018 CZ ARG B 5 -14.372 -6.433 8.562 1.00 0.00 C ATOM 1019 NH1 ARG B 5 -13.664 -5.385 8.224 1.00 0.00 N ATOM 1020 NH2 ARG B 5 -14.511 -7.427 7.724 1.00 0.00 N ATOM 0 H ARG B 5 -9.165 -8.552 11.115 1.00 0.00 H new ATOM 0 HA ARG B 5 -11.827 -9.449 10.172 1.00 0.00 H new ATOM 0 HB2 ARG B 5 -11.277 -6.808 11.378 1.00 0.00 H new ATOM 0 HB3 ARG B 5 -11.880 -6.677 9.737 1.00 0.00 H new ATOM 0 HG2 ARG B 5 -13.667 -8.473 10.508 1.00 0.00 H new ATOM 0 HG3 ARG B 5 -13.207 -7.999 12.131 1.00 0.00 H new ATOM 0 HD2 ARG B 5 -14.768 -6.327 11.853 1.00 0.00 H new ATOM 0 HD3 ARG B 5 -13.497 -5.516 10.959 1.00 0.00 H new ATOM 0 HE ARG B 5 -15.957 -6.582 9.806 1.00 0.00 H new ATOM 0 HH11 ARG B 5 -13.558 -4.609 8.877 1.00 0.00 H new ATOM 0 HH12 ARG B 5 -13.219 -5.344 7.307 1.00 0.00 H new ATOM 0 HH21 ARG B 5 -15.064 -8.242 7.987 1.00 0.00 H new ATOM 0 HH22 ARG B 5 -14.066 -7.387 6.807 1.00 0.00 H new ATOM 1034 N ILE B 6 -11.187 -8.292 7.835 1.00 0.00 N ATOM 1035 CA ILE B 6 -10.604 -8.117 6.468 1.00 0.00 C ATOM 1036 C ILE B 6 -11.174 -6.849 5.831 1.00 0.00 C ATOM 1037 O ILE B 6 -12.376 -6.674 5.733 1.00 0.00 O ATOM 1038 CB ILE B 6 -10.951 -9.330 5.595 1.00 0.00 C ATOM 1039 CG1 ILE B 6 -10.554 -10.624 6.318 1.00 0.00 C ATOM 1040 CG2 ILE B 6 -10.194 -9.242 4.266 1.00 0.00 C ATOM 1041 CD1 ILE B 6 -11.798 -11.273 6.931 1.00 0.00 C ATOM 0 H ILE B 6 -12.206 -8.266 7.872 1.00 0.00 H new ATOM 0 HA ILE B 6 -9.520 -8.031 6.547 1.00 0.00 H new ATOM 0 HB ILE B 6 -12.024 -9.335 5.406 1.00 0.00 H new ATOM 0 HG12 ILE B 6 -10.080 -11.312 5.618 1.00 0.00 H new ATOM 0 HG13 ILE B 6 -9.823 -10.407 7.097 1.00 0.00 H new ATOM 0 HG21 ILE B 6 -10.442 -10.105 3.648 1.00 0.00 H new ATOM 0 HG22 ILE B 6 -10.479 -8.328 3.745 1.00 0.00 H new ATOM 0 HG23 ILE B 6 -9.121 -9.230 4.458 1.00 0.00 H new ATOM 0 HD11 ILE B 6 -11.514 -12.192 7.444 1.00 0.00 H new ATOM 0 HD12 ILE B 6 -12.253 -10.585 7.644 1.00 0.00 H new ATOM 0 HD13 ILE B 6 -12.514 -11.504 6.142 1.00 0.00 H new ATOM 1053 N LEU B 7 -10.311 -5.968 5.393 1.00 0.00 N ATOM 1054 CA LEU B 7 -10.769 -4.706 4.754 1.00 0.00 C ATOM 1055 C LEU B 7 -10.805 -4.912 3.238 1.00 0.00 C ATOM 1056 O LEU B 7 -11.789 -4.619 2.584 1.00 0.00 O ATOM 1057 CB LEU B 7 -9.798 -3.586 5.116 1.00 0.00 C ATOM 1058 CG LEU B 7 -9.751 -3.450 6.638 1.00 0.00 C ATOM 1059 CD1 LEU B 7 -8.394 -2.894 7.073 1.00 0.00 C ATOM 1060 CD2 LEU B 7 -10.857 -2.505 7.102 1.00 0.00 C ATOM 0 H LEU B 7 -9.298 -6.074 5.453 1.00 0.00 H new ATOM 0 HA LEU B 7 -11.765 -4.436 5.104 1.00 0.00 H new ATOM 0 HB2 LEU B 7 -8.804 -3.807 4.726 1.00 0.00 H new ATOM 0 HB3 LEU B 7 -10.118 -2.648 4.663 1.00 0.00 H new ATOM 0 HG LEU B 7 -9.896 -4.433 7.086 1.00 0.00 H new ATOM 0 HD11 LEU B 7 -8.370 -2.801 8.159 1.00 0.00 H new ATOM 0 HD12 LEU B 7 -7.603 -3.571 6.749 1.00 0.00 H new ATOM 0 HD13 LEU B 7 -8.241 -1.914 6.621 1.00 0.00 H new ATOM 0 HD21 LEU B 7 -10.822 -2.409 8.187 1.00 0.00 H new ATOM 0 HD22 LEU B 7 -10.713 -1.525 6.646 1.00 0.00 H new ATOM 0 HD23 LEU B 7 -11.826 -2.905 6.804 1.00 0.00 H new ATOM 1072 N ASN B 8 -9.741 -5.448 2.692 1.00 0.00 N ATOM 1073 CA ASN B 8 -9.686 -5.730 1.224 1.00 0.00 C ATOM 1074 C ASN B 8 -8.469 -6.629 0.927 1.00 0.00 C ATOM 1075 O ASN B 8 -7.946 -7.277 1.817 1.00 0.00 O ATOM 1076 CB ASN B 8 -9.643 -4.416 0.411 1.00 0.00 C ATOM 1077 CG ASN B 8 -8.326 -3.670 0.625 1.00 0.00 C ATOM 1078 OD1 ASN B 8 -7.311 -4.039 0.081 1.00 0.00 O ATOM 1079 ND2 ASN B 8 -8.305 -2.606 1.372 1.00 0.00 N ATOM 0 H ASN B 8 -8.899 -5.705 3.207 1.00 0.00 H new ATOM 0 HA ASN B 8 -10.590 -6.258 0.920 1.00 0.00 H new ATOM 0 HB2 ASN B 8 -9.769 -4.638 -0.649 1.00 0.00 H new ATOM 0 HB3 ASN B 8 -10.476 -3.778 0.704 1.00 0.00 H new ATOM 0 HD21 ASN B 8 -7.436 -2.087 1.497 1.00 0.00 H new ATOM 0 HD22 ASN B 8 -9.158 -2.290 1.833 1.00 0.00 H new ATOM 1086 N HIS B 9 -8.032 -6.701 -0.309 1.00 0.00 N ATOM 1087 CA HIS B 9 -6.870 -7.587 -0.658 1.00 0.00 C ATOM 1088 C HIS B 9 -5.559 -7.076 -0.030 1.00 0.00 C ATOM 1089 O HIS B 9 -4.590 -7.809 0.061 1.00 0.00 O ATOM 1090 CB HIS B 9 -6.711 -7.642 -2.181 1.00 0.00 C ATOM 1091 CG HIS B 9 -6.646 -9.078 -2.627 1.00 0.00 C ATOM 1092 ND1 HIS B 9 -7.390 -9.789 -3.535 1.00 0.00 N flip ATOM 1093 CD2 HIS B 9 -5.720 -9.973 -2.113 1.00 0.00 C flip ATOM 1094 CE1 HIS B 9 -6.936 -11.104 -3.586 1.00 0.00 C flip ATOM 1095 NE2 HIS B 9 -5.929 -11.161 -2.709 1.00 0.00 N flip ATOM 0 H HIS B 9 -8.429 -6.184 -1.093 1.00 0.00 H new ATOM 0 HA HIS B 9 -7.073 -8.581 -0.260 1.00 0.00 H new ATOM 0 HB2 HIS B 9 -7.548 -7.138 -2.663 1.00 0.00 H new ATOM 0 HB3 HIS B 9 -5.806 -7.115 -2.482 1.00 0.00 H new ATOM 0 HD1 HIS B 9 -8.159 -9.411 -4.089 1.00 0.00 H new ATOM 0 HD2 HIS B 9 -4.968 -9.756 -1.369 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -7.316 -11.906 -4.202 1.00 0.00 H new ATOM 1103 N ASN B 10 -5.511 -5.831 0.379 1.00 0.00 N ATOM 1104 CA ASN B 10 -4.264 -5.268 0.972 1.00 0.00 C ATOM 1105 C ASN B 10 -4.497 -4.811 2.415 1.00 0.00 C ATOM 1106 O ASN B 10 -3.594 -4.854 3.230 1.00 0.00 O ATOM 1107 CB ASN B 10 -3.810 -4.064 0.143 1.00 0.00 C ATOM 1108 CG ASN B 10 -4.126 -4.287 -1.341 1.00 0.00 C ATOM 1109 OD1 ASN B 10 -3.538 -5.137 -1.981 1.00 0.00 O ATOM 1110 ND2 ASN B 10 -5.040 -3.556 -1.919 1.00 0.00 N ATOM 0 H ASN B 10 -6.292 -5.177 0.325 1.00 0.00 H new ATOM 0 HA ASN B 10 -3.502 -6.047 0.969 1.00 0.00 H new ATOM 0 HB2 ASN B 10 -4.310 -3.162 0.496 1.00 0.00 H new ATOM 0 HB3 ASN B 10 -2.739 -3.907 0.274 1.00 0.00 H new ATOM 0 HD21 ASN B 10 -5.259 -3.699 -2.905 1.00 0.00 H new ATOM 0 HD22 ASN B 10 -5.535 -2.842 -1.385 1.00 0.00 H new ATOM 1117 N ALA B 11 -5.683 -4.359 2.736 1.00 0.00 N ATOM 1118 CA ALA B 11 -5.949 -3.880 4.119 1.00 0.00 C ATOM 1119 C ALA B 11 -6.630 -4.978 4.935 1.00 0.00 C ATOM 1120 O ALA B 11 -7.555 -5.626 4.479 1.00 0.00 O ATOM 1121 CB ALA B 11 -6.841 -2.640 4.066 1.00 0.00 C ATOM 0 H ALA B 11 -6.476 -4.302 2.097 1.00 0.00 H new ATOM 0 HA ALA B 11 -5.003 -3.625 4.598 1.00 0.00 H new ATOM 0 HB1 ALA B 11 -7.036 -2.289 5.079 1.00 0.00 H new ATOM 0 HB2 ALA B 11 -6.340 -1.855 3.500 1.00 0.00 H new ATOM 0 HB3 ALA B 11 -7.784 -2.891 3.581 1.00 0.00 H new ATOM 1127 N ILE B 12 -6.169 -5.182 6.142 1.00 0.00 N ATOM 1128 CA ILE B 12 -6.758 -6.227 7.029 1.00 0.00 C ATOM 1129 C ILE B 12 -6.722 -5.732 8.480 1.00 0.00 C ATOM 1130 O ILE B 12 -5.755 -5.131 8.911 1.00 0.00 O ATOM 1131 CB ILE B 12 -5.924 -7.518 6.920 1.00 0.00 C ATOM 1132 CG1 ILE B 12 -5.850 -7.988 5.458 1.00 0.00 C ATOM 1133 CG2 ILE B 12 -6.545 -8.620 7.783 1.00 0.00 C ATOM 1134 CD1 ILE B 12 -7.231 -8.417 4.963 1.00 0.00 C ATOM 0 H ILE B 12 -5.397 -4.660 6.556 1.00 0.00 H new ATOM 0 HA ILE B 12 -7.787 -6.426 6.728 1.00 0.00 H new ATOM 0 HB ILE B 12 -4.915 -7.308 7.275 1.00 0.00 H new ATOM 0 HG12 ILE B 12 -5.466 -7.184 4.830 1.00 0.00 H new ATOM 0 HG13 ILE B 12 -5.152 -8.821 5.372 1.00 0.00 H new ATOM 0 HG21 ILE B 12 -5.948 -9.528 7.699 1.00 0.00 H new ATOM 0 HG22 ILE B 12 -6.569 -8.297 8.824 1.00 0.00 H new ATOM 0 HG23 ILE B 12 -7.561 -8.821 7.442 1.00 0.00 H new ATOM 0 HD11 ILE B 12 -7.160 -8.747 3.926 1.00 0.00 H new ATOM 0 HD12 ILE B 12 -7.600 -9.236 5.580 1.00 0.00 H new ATOM 0 HD13 ILE B 12 -7.919 -7.574 5.029 1.00 0.00 H new ATOM 1146 N VAL B 13 -7.756 -5.998 9.242 1.00 0.00 N ATOM 1147 CA VAL B 13 -7.764 -5.562 10.668 1.00 0.00 C ATOM 1148 C VAL B 13 -7.084 -6.649 11.501 1.00 0.00 C ATOM 1149 O VAL B 13 -7.552 -7.769 11.565 1.00 0.00 O ATOM 1150 CB VAL B 13 -9.206 -5.365 11.155 1.00 0.00 C ATOM 1151 CG1 VAL B 13 -9.197 -4.660 12.516 1.00 0.00 C ATOM 1152 CG2 VAL B 13 -9.983 -4.510 10.149 1.00 0.00 C ATOM 0 H VAL B 13 -8.591 -6.497 8.936 1.00 0.00 H new ATOM 0 HA VAL B 13 -7.234 -4.615 10.770 1.00 0.00 H new ATOM 0 HB VAL B 13 -9.686 -6.339 11.249 1.00 0.00 H new ATOM 0 HG11 VAL B 13 -10.222 -4.521 12.860 1.00 0.00 H new ATOM 0 HG12 VAL B 13 -8.651 -5.268 13.237 1.00 0.00 H new ATOM 0 HG13 VAL B 13 -8.712 -3.689 12.419 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -11.006 -4.374 10.501 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -9.501 -3.537 10.049 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -9.996 -5.010 9.180 1.00 0.00 H new ATOM 1162 N VAL B 14 -5.977 -6.334 12.125 1.00 0.00 N ATOM 1163 CA VAL B 14 -5.256 -7.354 12.944 1.00 0.00 C ATOM 1164 C VAL B 14 -5.246 -6.922 14.412 1.00 0.00 C ATOM 1165 O VAL B 14 -5.232 -5.752 14.724 1.00 0.00 O ATOM 1166 CB VAL B 14 -3.813 -7.533 12.423 1.00 0.00 C ATOM 1167 CG1 VAL B 14 -3.272 -6.206 11.881 1.00 0.00 C ATOM 1168 CG2 VAL B 14 -2.892 -8.024 13.548 1.00 0.00 C ATOM 0 H VAL B 14 -5.541 -5.412 12.102 1.00 0.00 H new ATOM 0 HA VAL B 14 -5.772 -8.311 12.861 1.00 0.00 H new ATOM 0 HB VAL B 14 -3.834 -8.273 11.623 1.00 0.00 H new ATOM 0 HG11 VAL B 14 -2.254 -6.349 11.518 1.00 0.00 H new ATOM 0 HG12 VAL B 14 -3.904 -5.862 11.062 1.00 0.00 H new ATOM 0 HG13 VAL B 14 -3.272 -5.461 12.677 1.00 0.00 H new ATOM 0 HG21 VAL B 14 -1.879 -8.145 13.163 1.00 0.00 H new ATOM 0 HG22 VAL B 14 -2.887 -7.295 14.359 1.00 0.00 H new ATOM 0 HG23 VAL B 14 -3.254 -8.981 13.923 1.00 0.00 H new ATOM 1178 N LYS B 15 -5.247 -7.874 15.309 1.00 0.00 N ATOM 1179 CA LYS B 15 -5.232 -7.548 16.769 1.00 0.00 C ATOM 1180 C LYS B 15 -3.847 -7.830 17.350 1.00 0.00 C ATOM 1181 O LYS B 15 -3.175 -8.772 16.970 1.00 0.00 O ATOM 1182 CB LYS B 15 -6.281 -8.389 17.507 1.00 0.00 C ATOM 1183 CG LYS B 15 -6.119 -9.875 17.153 1.00 0.00 C ATOM 1184 CD LYS B 15 -6.154 -10.717 18.431 1.00 0.00 C ATOM 1185 CE LYS B 15 -4.760 -10.751 19.066 1.00 0.00 C ATOM 1186 NZ LYS B 15 -3.941 -11.822 18.427 1.00 0.00 N ATOM 0 H LYS B 15 -5.258 -8.871 15.092 1.00 0.00 H new ATOM 0 HA LYS B 15 -5.468 -6.491 16.896 1.00 0.00 H new ATOM 0 HB2 LYS B 15 -6.176 -8.251 18.583 1.00 0.00 H new ATOM 0 HB3 LYS B 15 -7.282 -8.051 17.239 1.00 0.00 H new ATOM 0 HG2 LYS B 15 -6.916 -10.187 16.479 1.00 0.00 H new ATOM 0 HG3 LYS B 15 -5.177 -10.033 16.628 1.00 0.00 H new ATOM 0 HD2 LYS B 15 -6.874 -10.298 19.134 1.00 0.00 H new ATOM 0 HD3 LYS B 15 -6.484 -11.730 18.202 1.00 0.00 H new ATOM 0 HE2 LYS B 15 -4.271 -9.785 18.944 1.00 0.00 H new ATOM 0 HE3 LYS B 15 -4.842 -10.934 20.137 1.00 0.00 H new ATOM 0 HZ1 LYS B 15 -2.934 -11.567 18.479 1.00 0.00 H new ATOM 0 HZ2 LYS B 15 -4.096 -12.722 18.925 1.00 0.00 H new ATOM 0 HZ3 LYS B 15 -4.221 -11.925 17.431 1.00 0.00 H new ATOM 1200 N ASP B 16 -3.427 -7.010 18.276 1.00 0.00 N ATOM 1201 CA ASP B 16 -2.095 -7.190 18.915 1.00 0.00 C ATOM 1202 C ASP B 16 -2.244 -7.141 20.444 1.00 0.00 C ATOM 1203 O ASP B 16 -3.341 -7.051 20.970 1.00 0.00 O ATOM 1204 CB ASP B 16 -1.144 -6.079 18.443 1.00 0.00 C ATOM 1205 CG ASP B 16 -1.806 -4.704 18.604 1.00 0.00 C ATOM 1206 OD1 ASP B 16 -1.672 -4.124 19.667 1.00 0.00 O ATOM 1207 OD2 ASP B 16 -2.432 -4.253 17.659 1.00 0.00 O ATOM 0 H ASP B 16 -3.960 -6.212 18.620 1.00 0.00 H new ATOM 0 HA ASP B 16 -1.683 -8.158 18.630 1.00 0.00 H new ATOM 0 HB2 ASP B 16 -0.219 -6.114 19.019 1.00 0.00 H new ATOM 0 HB3 ASP B 16 -0.876 -6.240 17.399 1.00 0.00 H new ATOM 1212 N GLN B 17 -1.143 -7.210 21.153 1.00 0.00 N ATOM 1213 CA GLN B 17 -1.186 -7.179 22.647 1.00 0.00 C ATOM 1214 C GLN B 17 -1.837 -5.887 23.137 1.00 0.00 C ATOM 1215 O GLN B 17 -2.661 -5.903 24.033 1.00 0.00 O ATOM 1216 CB GLN B 17 0.241 -7.259 23.196 1.00 0.00 C ATOM 1217 CG GLN B 17 0.491 -8.650 23.786 1.00 0.00 C ATOM 1218 CD GLN B 17 0.770 -9.646 22.656 1.00 0.00 C ATOM 1219 OE1 GLN B 17 -0.134 -10.286 22.157 1.00 0.00 O ATOM 1220 NE2 GLN B 17 1.994 -9.803 22.226 1.00 0.00 N ATOM 0 H GLN B 17 -0.207 -7.287 20.755 1.00 0.00 H new ATOM 0 HA GLN B 17 -1.773 -8.028 22.998 1.00 0.00 H new ATOM 0 HB2 GLN B 17 0.959 -7.057 22.401 1.00 0.00 H new ATOM 0 HB3 GLN B 17 0.390 -6.497 23.961 1.00 0.00 H new ATOM 0 HG2 GLN B 17 1.337 -8.618 24.473 1.00 0.00 H new ATOM 0 HG3 GLN B 17 -0.376 -8.973 24.363 1.00 0.00 H new ATOM 0 HE21 GLN B 17 2.754 -9.266 22.644 1.00 0.00 H new ATOM 0 HE22 GLN B 17 2.189 -10.462 21.472 1.00 0.00 H new ATOM 1229 N ASN B 18 -1.456 -4.775 22.568 1.00 0.00 N ATOM 1230 CA ASN B 18 -2.028 -3.471 23.003 1.00 0.00 C ATOM 1231 C ASN B 18 -3.537 -3.418 22.724 1.00 0.00 C ATOM 1232 O ASN B 18 -4.316 -3.112 23.609 1.00 0.00 O ATOM 1233 CB ASN B 18 -1.327 -2.327 22.262 1.00 0.00 C ATOM 1234 CG ASN B 18 -0.372 -1.607 23.216 1.00 0.00 C ATOM 1235 OD1 ASN B 18 -0.682 -0.544 23.718 1.00 0.00 O ATOM 1236 ND2 ASN B 18 0.788 -2.142 23.489 1.00 0.00 N ATOM 0 H ASN B 18 -0.769 -4.715 21.816 1.00 0.00 H new ATOM 0 HA ASN B 18 -1.870 -3.365 24.076 1.00 0.00 H new ATOM 0 HB2 ASN B 18 -0.776 -2.718 21.406 1.00 0.00 H new ATOM 0 HB3 ASN B 18 -2.065 -1.626 21.873 1.00 0.00 H new ATOM 0 HD21 ASN B 18 1.432 -1.668 24.122 1.00 0.00 H new ATOM 0 HD22 ASN B 18 1.050 -3.034 23.069 1.00 0.00 H new ATOM 1243 N GLU B 19 -3.956 -3.707 21.507 1.00 0.00 N ATOM 1244 CA GLU B 19 -5.416 -3.660 21.176 1.00 0.00 C ATOM 1245 C GLU B 19 -5.615 -3.987 19.686 1.00 0.00 C ATOM 1246 O GLU B 19 -4.867 -4.755 19.109 1.00 0.00 O ATOM 1247 CB GLU B 19 -5.956 -2.254 21.486 1.00 0.00 C ATOM 1248 CG GLU B 19 -7.300 -2.368 22.212 1.00 0.00 C ATOM 1249 CD GLU B 19 -7.727 -0.988 22.724 1.00 0.00 C ATOM 1250 OE1 GLU B 19 -7.353 -0.647 23.835 1.00 0.00 O ATOM 1251 OE2 GLU B 19 -8.423 -0.297 21.998 1.00 0.00 O ATOM 0 H GLU B 19 -3.347 -3.972 20.733 1.00 0.00 H new ATOM 0 HA GLU B 19 -5.957 -4.394 21.774 1.00 0.00 H new ATOM 0 HB2 GLU B 19 -5.243 -1.708 22.103 1.00 0.00 H new ATOM 0 HB3 GLU B 19 -6.077 -1.688 20.562 1.00 0.00 H new ATOM 0 HG2 GLU B 19 -8.057 -2.766 21.536 1.00 0.00 H new ATOM 0 HG3 GLU B 19 -7.217 -3.066 23.045 1.00 0.00 H new ATOM 1258 N GLU B 20 -6.619 -3.412 19.060 1.00 0.00 N ATOM 1259 CA GLU B 20 -6.873 -3.682 17.613 1.00 0.00 C ATOM 1260 C GLU B 20 -5.838 -2.945 16.752 1.00 0.00 C ATOM 1261 O GLU B 20 -5.196 -2.007 17.193 1.00 0.00 O ATOM 1262 CB GLU B 20 -8.280 -3.208 17.244 1.00 0.00 C ATOM 1263 CG GLU B 20 -8.794 -4.006 16.041 1.00 0.00 C ATOM 1264 CD GLU B 20 -10.278 -3.699 15.813 1.00 0.00 C ATOM 1265 OE1 GLU B 20 -11.101 -4.331 16.456 1.00 0.00 O ATOM 1266 OE2 GLU B 20 -10.566 -2.837 14.998 1.00 0.00 O ATOM 0 H GLU B 20 -7.275 -2.764 19.496 1.00 0.00 H new ATOM 0 HA GLU B 20 -6.790 -4.753 17.429 1.00 0.00 H new ATOM 0 HB2 GLU B 20 -8.952 -3.337 18.092 1.00 0.00 H new ATOM 0 HB3 GLU B 20 -8.266 -2.144 17.008 1.00 0.00 H new ATOM 0 HG2 GLU B 20 -8.219 -3.751 15.151 1.00 0.00 H new ATOM 0 HG3 GLU B 20 -8.656 -5.073 16.215 1.00 0.00 H new ATOM 1273 N LYS B 21 -5.675 -3.378 15.527 1.00 0.00 N ATOM 1274 CA LYS B 21 -4.688 -2.740 14.608 1.00 0.00 C ATOM 1275 C LYS B 21 -5.202 -2.805 13.165 1.00 0.00 C ATOM 1276 O LYS B 21 -6.263 -3.339 12.887 1.00 0.00 O ATOM 1277 CB LYS B 21 -3.356 -3.492 14.696 1.00 0.00 C ATOM 1278 CG LYS B 21 -2.195 -2.497 14.769 1.00 0.00 C ATOM 1279 CD LYS B 21 -0.869 -3.260 14.835 1.00 0.00 C ATOM 1280 CE LYS B 21 -0.654 -4.036 13.531 1.00 0.00 C ATOM 1281 NZ LYS B 21 0.702 -4.654 13.535 1.00 0.00 N ATOM 0 H LYS B 21 -6.192 -4.158 15.121 1.00 0.00 H new ATOM 0 HA LYS B 21 -4.550 -1.698 14.898 1.00 0.00 H new ATOM 0 HB2 LYS B 21 -3.350 -4.135 15.576 1.00 0.00 H new ATOM 0 HB3 LYS B 21 -3.237 -4.139 13.827 1.00 0.00 H new ATOM 0 HG2 LYS B 21 -2.207 -1.844 13.897 1.00 0.00 H new ATOM 0 HG3 LYS B 21 -2.304 -1.859 15.646 1.00 0.00 H new ATOM 0 HD2 LYS B 21 -0.046 -2.564 14.995 1.00 0.00 H new ATOM 0 HD3 LYS B 21 -0.875 -3.947 15.681 1.00 0.00 H new ATOM 0 HE2 LYS B 21 -1.416 -4.808 13.425 1.00 0.00 H new ATOM 0 HE3 LYS B 21 -0.757 -3.367 12.677 1.00 0.00 H new ATOM 0 HZ1 LYS B 21 0.846 -5.180 12.650 1.00 0.00 H new ATOM 0 HZ2 LYS B 21 1.423 -3.909 13.616 1.00 0.00 H new ATOM 0 HZ3 LYS B 21 0.784 -5.305 14.342 1.00 0.00 H new ATOM 1295 N ILE B 22 -4.441 -2.263 12.253 1.00 0.00 N ATOM 1296 CA ILE B 22 -4.832 -2.271 10.814 1.00 0.00 C ATOM 1297 C ILE B 22 -3.580 -2.513 9.967 1.00 0.00 C ATOM 1298 O ILE B 22 -2.642 -1.734 9.993 1.00 0.00 O ATOM 1299 CB ILE B 22 -5.460 -0.919 10.441 1.00 0.00 C ATOM 1300 CG1 ILE B 22 -6.866 -0.812 11.051 1.00 0.00 C ATOM 1301 CG2 ILE B 22 -5.549 -0.792 8.915 1.00 0.00 C ATOM 1302 CD1 ILE B 22 -7.805 -1.834 10.402 1.00 0.00 C ATOM 0 H ILE B 22 -3.550 -1.807 12.448 1.00 0.00 H new ATOM 0 HA ILE B 22 -5.561 -3.060 10.631 1.00 0.00 H new ATOM 0 HB ILE B 22 -4.836 -0.116 10.833 1.00 0.00 H new ATOM 0 HG12 ILE B 22 -6.818 -0.984 12.126 1.00 0.00 H new ATOM 0 HG13 ILE B 22 -7.257 0.195 10.906 1.00 0.00 H new ATOM 0 HG21 ILE B 22 -5.995 0.168 8.655 1.00 0.00 H new ATOM 0 HG22 ILE B 22 -4.549 -0.856 8.486 1.00 0.00 H new ATOM 0 HG23 ILE B 22 -6.166 -1.598 8.518 1.00 0.00 H new ATOM 0 HD11 ILE B 22 -8.798 -1.747 10.843 1.00 0.00 H new ATOM 0 HD12 ILE B 22 -7.866 -1.643 9.331 1.00 0.00 H new ATOM 0 HD13 ILE B 22 -7.420 -2.840 10.570 1.00 0.00 H new ATOM 1314 N LEU B 23 -3.557 -3.589 9.222 1.00 0.00 N ATOM 1315 CA LEU B 23 -2.370 -3.893 8.377 1.00 0.00 C ATOM 1316 C LEU B 23 -2.680 -3.561 6.912 1.00 0.00 C ATOM 1317 O LEU B 23 -3.490 -4.214 6.278 1.00 0.00 O ATOM 1318 CB LEU B 23 -2.020 -5.386 8.501 1.00 0.00 C ATOM 1319 CG LEU B 23 -0.495 -5.605 8.557 1.00 0.00 C ATOM 1320 CD1 LEU B 23 0.263 -4.383 8.022 1.00 0.00 C ATOM 1321 CD2 LEU B 23 -0.076 -5.875 10.005 1.00 0.00 C ATOM 0 H LEU B 23 -4.314 -4.271 9.165 1.00 0.00 H new ATOM 0 HA LEU B 23 -1.525 -3.292 8.713 1.00 0.00 H new ATOM 0 HB2 LEU B 23 -2.481 -5.796 9.400 1.00 0.00 H new ATOM 0 HB3 LEU B 23 -2.436 -5.930 7.653 1.00 0.00 H new ATOM 0 HG LEU B 23 -0.246 -6.460 7.928 1.00 0.00 H new ATOM 0 HD11 LEU B 23 1.336 -4.569 8.075 1.00 0.00 H new ATOM 0 HD12 LEU B 23 -0.023 -4.202 6.986 1.00 0.00 H new ATOM 0 HD13 LEU B 23 0.016 -3.509 8.625 1.00 0.00 H new ATOM 0 HD21 LEU B 23 1.002 -6.030 10.049 1.00 0.00 H new ATOM 0 HD22 LEU B 23 -0.345 -5.021 10.627 1.00 0.00 H new ATOM 0 HD23 LEU B 23 -0.586 -6.766 10.371 1.00 0.00 H new ATOM 1333 N LEU B 24 -2.034 -2.555 6.373 1.00 0.00 N ATOM 1334 CA LEU B 24 -2.274 -2.176 4.949 1.00 0.00 C ATOM 1335 C LEU B 24 -1.055 -2.582 4.113 1.00 0.00 C ATOM 1336 O LEU B 24 -0.092 -1.845 4.002 1.00 0.00 O ATOM 1337 CB LEU B 24 -2.504 -0.659 4.835 1.00 0.00 C ATOM 1338 CG LEU B 24 -3.428 -0.173 5.958 1.00 0.00 C ATOM 1339 CD1 LEU B 24 -3.445 1.357 5.976 1.00 0.00 C ATOM 1340 CD2 LEU B 24 -4.847 -0.695 5.716 1.00 0.00 C ATOM 0 H LEU B 24 -1.349 -1.979 6.862 1.00 0.00 H new ATOM 0 HA LEU B 24 -3.162 -2.690 4.581 1.00 0.00 H new ATOM 0 HB2 LEU B 24 -1.550 -0.135 4.888 1.00 0.00 H new ATOM 0 HB3 LEU B 24 -2.944 -0.423 3.866 1.00 0.00 H new ATOM 0 HG LEU B 24 -3.063 -0.546 6.915 1.00 0.00 H new ATOM 0 HD11 LEU B 24 -4.101 1.704 6.774 1.00 0.00 H new ATOM 0 HD12 LEU B 24 -2.435 1.730 6.149 1.00 0.00 H new ATOM 0 HD13 LEU B 24 -3.810 1.728 5.018 1.00 0.00 H new ATOM 0 HD21 LEU B 24 -5.503 -0.349 6.515 1.00 0.00 H new ATOM 0 HD22 LEU B 24 -5.213 -0.323 4.759 1.00 0.00 H new ATOM 0 HD23 LEU B 24 -4.836 -1.785 5.702 1.00 0.00 H new ATOM 1352 N GLY B 25 -1.098 -3.755 3.528 1.00 0.00 N ATOM 1353 CA GLY B 25 0.040 -4.237 2.694 1.00 0.00 C ATOM 1354 C GLY B 25 -0.505 -4.768 1.370 1.00 0.00 C ATOM 1355 O GLY B 25 -1.365 -5.624 1.352 1.00 0.00 O ATOM 0 H GLY B 25 -1.883 -4.403 3.596 1.00 0.00 H new ATOM 0 HA2 GLY B 25 0.744 -3.425 2.513 1.00 0.00 H new ATOM 0 HA3 GLY B 25 0.586 -5.021 3.218 1.00 0.00 H new ATOM 1359 N ALA B 26 -0.017 -4.252 0.268 1.00 0.00 N ATOM 1360 CA ALA B 26 -0.500 -4.699 -1.075 1.00 0.00 C ATOM 1361 C ALA B 26 -0.391 -6.223 -1.208 1.00 0.00 C ATOM 1362 O ALA B 26 0.667 -6.768 -1.471 1.00 0.00 O ATOM 1363 CB ALA B 26 0.329 -4.030 -2.170 1.00 0.00 C ATOM 0 H ALA B 26 0.704 -3.531 0.243 1.00 0.00 H new ATOM 0 HA ALA B 26 -1.546 -4.412 -1.181 1.00 0.00 H new ATOM 0 HB1 ALA B 26 -0.026 -4.358 -3.147 1.00 0.00 H new ATOM 0 HB2 ALA B 26 0.228 -2.947 -2.092 1.00 0.00 H new ATOM 0 HB3 ALA B 26 1.377 -4.306 -2.053 1.00 0.00 H new ATOM 1369 N GLY B 27 -1.495 -6.899 -1.036 1.00 0.00 N ATOM 1370 CA GLY B 27 -1.520 -8.387 -1.155 1.00 0.00 C ATOM 1371 C GLY B 27 -1.431 -9.057 0.224 1.00 0.00 C ATOM 1372 O GLY B 27 -1.264 -10.260 0.311 1.00 0.00 O ATOM 0 H GLY B 27 -2.396 -6.476 -0.814 1.00 0.00 H new ATOM 0 HA2 GLY B 27 -2.437 -8.699 -1.655 1.00 0.00 H new ATOM 0 HA3 GLY B 27 -0.689 -8.719 -1.777 1.00 0.00 H new ATOM 1376 N ILE B 28 -1.543 -8.304 1.300 1.00 0.00 N ATOM 1377 CA ILE B 28 -1.470 -8.908 2.655 1.00 0.00 C ATOM 1378 C ILE B 28 -2.637 -9.889 2.836 1.00 0.00 C ATOM 1379 O ILE B 28 -2.472 -10.952 3.405 1.00 0.00 O ATOM 1380 CB ILE B 28 -1.511 -7.782 3.701 1.00 0.00 C ATOM 1381 CG1 ILE B 28 -0.544 -8.120 4.827 1.00 0.00 C ATOM 1382 CG2 ILE B 28 -2.922 -7.610 4.278 1.00 0.00 C ATOM 1383 CD1 ILE B 28 0.100 -6.835 5.346 1.00 0.00 C ATOM 0 H ILE B 28 -1.682 -7.294 1.286 1.00 0.00 H new ATOM 0 HA ILE B 28 -0.541 -9.464 2.782 1.00 0.00 H new ATOM 0 HB ILE B 28 -1.225 -6.848 3.218 1.00 0.00 H new ATOM 0 HG12 ILE B 28 -1.072 -8.627 5.635 1.00 0.00 H new ATOM 0 HG13 ILE B 28 0.224 -8.805 4.468 1.00 0.00 H new ATOM 0 HG21 ILE B 28 -2.918 -6.807 5.015 1.00 0.00 H new ATOM 0 HG22 ILE B 28 -3.616 -7.363 3.475 1.00 0.00 H new ATOM 0 HG23 ILE B 28 -3.236 -8.538 4.755 1.00 0.00 H new ATOM 0 HD11 ILE B 28 0.793 -7.075 6.152 1.00 0.00 H new ATOM 0 HD12 ILE B 28 0.641 -6.346 4.536 1.00 0.00 H new ATOM 0 HD13 ILE B 28 -0.674 -6.165 5.720 1.00 0.00 H new ATOM 1395 N ALA B 29 -3.806 -9.550 2.332 1.00 0.00 N ATOM 1396 CA ALA B 29 -4.976 -10.473 2.445 1.00 0.00 C ATOM 1397 C ALA B 29 -4.616 -11.796 1.765 1.00 0.00 C ATOM 1398 O ALA B 29 -4.946 -12.862 2.252 1.00 0.00 O ATOM 1399 CB ALA B 29 -6.195 -9.855 1.756 1.00 0.00 C ATOM 0 H ALA B 29 -3.995 -8.672 1.848 1.00 0.00 H new ATOM 0 HA ALA B 29 -5.216 -10.643 3.495 1.00 0.00 H new ATOM 0 HB1 ALA B 29 -7.044 -10.533 1.842 1.00 0.00 H new ATOM 0 HB2 ALA B 29 -6.439 -8.905 2.232 1.00 0.00 H new ATOM 0 HB3 ALA B 29 -5.971 -9.686 0.703 1.00 0.00 H new ATOM 1405 N PHE B 30 -3.908 -11.728 0.656 1.00 0.00 N ATOM 1406 CA PHE B 30 -3.487 -12.971 -0.047 1.00 0.00 C ATOM 1407 C PHE B 30 -2.441 -13.679 0.818 1.00 0.00 C ATOM 1408 O PHE B 30 -1.586 -13.045 1.412 1.00 0.00 O ATOM 1409 CB PHE B 30 -2.877 -12.615 -1.408 1.00 0.00 C ATOM 1410 CG PHE B 30 -2.725 -13.869 -2.239 1.00 0.00 C ATOM 1411 CD1 PHE B 30 -3.817 -14.371 -2.957 1.00 0.00 C ATOM 1412 CD2 PHE B 30 -1.491 -14.530 -2.291 1.00 0.00 C ATOM 1413 CE1 PHE B 30 -3.676 -15.533 -3.726 1.00 0.00 C ATOM 1414 CE2 PHE B 30 -1.350 -15.692 -3.058 1.00 0.00 C ATOM 1415 CZ PHE B 30 -2.442 -16.194 -3.776 1.00 0.00 C ATOM 0 H PHE B 30 -3.607 -10.860 0.213 1.00 0.00 H new ATOM 0 HA PHE B 30 -4.346 -13.622 -0.208 1.00 0.00 H new ATOM 0 HB2 PHE B 30 -3.513 -11.898 -1.927 1.00 0.00 H new ATOM 0 HB3 PHE B 30 -1.907 -12.138 -1.269 1.00 0.00 H new ATOM 0 HD1 PHE B 30 -4.769 -13.862 -2.918 1.00 0.00 H new ATOM 0 HD2 PHE B 30 -0.648 -14.142 -1.739 1.00 0.00 H new ATOM 0 HE1 PHE B 30 -4.519 -15.919 -4.280 1.00 0.00 H new ATOM 0 HE2 PHE B 30 -0.399 -16.202 -3.096 1.00 0.00 H new ATOM 0 HZ PHE B 30 -2.333 -17.091 -4.368 1.00 0.00 H new ATOM 1425 N ASN B 31 -2.517 -14.985 0.901 1.00 0.00 N ATOM 1426 CA ASN B 31 -1.543 -15.762 1.736 1.00 0.00 C ATOM 1427 C ASN B 31 -1.843 -15.538 3.227 1.00 0.00 C ATOM 1428 O ASN B 31 -0.955 -15.566 4.063 1.00 0.00 O ATOM 1429 CB ASN B 31 -0.112 -15.313 1.410 1.00 0.00 C ATOM 1430 CG ASN B 31 0.877 -16.427 1.766 1.00 0.00 C ATOM 1431 OD1 ASN B 31 1.566 -16.347 2.764 1.00 0.00 O ATOM 1432 ND2 ASN B 31 0.977 -17.470 0.987 1.00 0.00 N ATOM 0 H ASN B 31 -3.217 -15.552 0.423 1.00 0.00 H new ATOM 0 HA ASN B 31 -1.641 -16.824 1.513 1.00 0.00 H new ATOM 0 HB2 ASN B 31 -0.031 -15.067 0.351 1.00 0.00 H new ATOM 0 HB3 ASN B 31 0.130 -14.408 1.967 1.00 0.00 H new ATOM 0 HD21 ASN B 31 1.633 -18.217 1.216 1.00 0.00 H new ATOM 0 HD22 ASN B 31 0.399 -17.538 0.149 1.00 0.00 H new ATOM 1439 N LYS B 32 -3.093 -15.323 3.561 1.00 0.00 N ATOM 1440 CA LYS B 32 -3.477 -15.098 4.988 1.00 0.00 C ATOM 1441 C LYS B 32 -4.955 -15.457 5.199 1.00 0.00 C ATOM 1442 O LYS B 32 -5.728 -15.530 4.258 1.00 0.00 O ATOM 1443 CB LYS B 32 -3.254 -13.627 5.352 1.00 0.00 C ATOM 1444 CG LYS B 32 -2.072 -13.511 6.318 1.00 0.00 C ATOM 1445 CD LYS B 32 -1.214 -12.303 5.935 1.00 0.00 C ATOM 1446 CE LYS B 32 -0.159 -12.729 4.909 1.00 0.00 C ATOM 1447 NZ LYS B 32 0.478 -11.520 4.317 1.00 0.00 N ATOM 0 H LYS B 32 -3.869 -15.294 2.900 1.00 0.00 H new ATOM 0 HA LYS B 32 -2.861 -15.732 5.626 1.00 0.00 H new ATOM 0 HB2 LYS B 32 -3.059 -13.044 4.452 1.00 0.00 H new ATOM 0 HB3 LYS B 32 -4.153 -13.215 5.810 1.00 0.00 H new ATOM 0 HG2 LYS B 32 -2.434 -13.403 7.341 1.00 0.00 H new ATOM 0 HG3 LYS B 32 -1.472 -14.421 6.286 1.00 0.00 H new ATOM 0 HD2 LYS B 32 -1.842 -11.514 5.520 1.00 0.00 H new ATOM 0 HD3 LYS B 32 -0.730 -11.892 6.821 1.00 0.00 H new ATOM 0 HE2 LYS B 32 0.596 -13.353 5.386 1.00 0.00 H new ATOM 0 HE3 LYS B 32 -0.621 -13.330 4.126 1.00 0.00 H new ATOM 0 HZ1 LYS B 32 1.332 -11.799 3.794 1.00 0.00 H new ATOM 0 HZ2 LYS B 32 -0.190 -11.058 3.668 1.00 0.00 H new ATOM 0 HZ3 LYS B 32 0.737 -10.858 5.076 1.00 0.00 H new ATOM 1461 N LYS B 33 -5.350 -15.676 6.432 1.00 0.00 N ATOM 1462 CA LYS B 33 -6.772 -16.027 6.728 1.00 0.00 C ATOM 1463 C LYS B 33 -7.128 -15.604 8.160 1.00 0.00 C ATOM 1464 O LYS B 33 -6.295 -15.115 8.900 1.00 0.00 O ATOM 1465 CB LYS B 33 -6.965 -17.541 6.574 1.00 0.00 C ATOM 1466 CG LYS B 33 -8.138 -17.819 5.629 1.00 0.00 C ATOM 1467 CD LYS B 33 -9.170 -18.698 6.337 1.00 0.00 C ATOM 1468 CE LYS B 33 -10.468 -18.720 5.525 1.00 0.00 C ATOM 1469 NZ LYS B 33 -11.465 -19.599 6.200 1.00 0.00 N ATOM 0 H LYS B 33 -4.742 -15.626 7.250 1.00 0.00 H new ATOM 0 HA LYS B 33 -7.425 -15.503 6.030 1.00 0.00 H new ATOM 0 HB2 LYS B 33 -6.055 -17.995 6.183 1.00 0.00 H new ATOM 0 HB3 LYS B 33 -7.154 -17.994 7.547 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -8.597 -16.881 5.317 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -7.781 -18.315 4.726 1.00 0.00 H new ATOM 0 HD2 LYS B 33 -8.783 -19.711 6.451 1.00 0.00 H new ATOM 0 HD3 LYS B 33 -9.362 -18.315 7.339 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -10.865 -17.710 5.428 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -10.272 -19.083 4.516 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -12.346 -19.613 5.647 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -11.085 -20.565 6.270 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -11.660 -19.234 7.154 1.00 0.00 H new ATOM 1483 N LYS B 34 -8.367 -15.788 8.552 1.00 0.00 N ATOM 1484 CA LYS B 34 -8.804 -15.401 9.928 1.00 0.00 C ATOM 1485 C LYS B 34 -7.999 -16.172 10.976 1.00 0.00 C ATOM 1486 O LYS B 34 -7.840 -17.377 10.894 1.00 0.00 O ATOM 1487 CB LYS B 34 -10.297 -15.711 10.093 1.00 0.00 C ATOM 1488 CG LYS B 34 -10.800 -15.155 11.429 1.00 0.00 C ATOM 1489 CD LYS B 34 -11.369 -13.749 11.221 1.00 0.00 C ATOM 1490 CE LYS B 34 -12.025 -13.264 12.517 1.00 0.00 C ATOM 1491 NZ LYS B 34 -10.976 -13.019 13.550 1.00 0.00 N ATOM 0 H LYS B 34 -9.100 -16.194 7.970 1.00 0.00 H new ATOM 0 HA LYS B 34 -8.633 -14.334 10.070 1.00 0.00 H new ATOM 0 HB2 LYS B 34 -10.862 -15.272 9.271 1.00 0.00 H new ATOM 0 HB3 LYS B 34 -10.460 -16.788 10.053 1.00 0.00 H new ATOM 0 HG2 LYS B 34 -11.567 -15.811 11.841 1.00 0.00 H new ATOM 0 HG3 LYS B 34 -9.984 -15.125 12.152 1.00 0.00 H new ATOM 0 HD2 LYS B 34 -10.574 -13.064 10.925 1.00 0.00 H new ATOM 0 HD3 LYS B 34 -12.100 -13.757 10.412 1.00 0.00 H new ATOM 0 HE2 LYS B 34 -12.587 -12.349 12.331 1.00 0.00 H new ATOM 0 HE3 LYS B 34 -12.736 -14.008 12.876 1.00 0.00 H new ATOM 0 HZ1 LYS B 34 -11.259 -12.217 14.149 1.00 0.00 H new ATOM 0 HZ2 LYS B 34 -10.864 -13.869 14.139 1.00 0.00 H new ATOM 0 HZ3 LYS B 34 -10.073 -12.800 13.083 1.00 0.00 H new ATOM 1505 N ASN B 35 -7.502 -15.460 11.962 1.00 0.00 N ATOM 1506 CA ASN B 35 -6.704 -16.082 13.064 1.00 0.00 C ATOM 1507 C ASN B 35 -5.265 -16.389 12.608 1.00 0.00 C ATOM 1508 O ASN B 35 -4.485 -16.945 13.361 1.00 0.00 O ATOM 1509 CB ASN B 35 -7.383 -17.370 13.546 1.00 0.00 C ATOM 1510 CG ASN B 35 -7.521 -17.341 15.071 1.00 0.00 C ATOM 1511 OD1 ASN B 35 -8.617 -17.376 15.594 1.00 0.00 O ATOM 1512 ND2 ASN B 35 -6.447 -17.277 15.811 1.00 0.00 N ATOM 0 H ASN B 35 -7.620 -14.451 12.049 1.00 0.00 H new ATOM 0 HA ASN B 35 -6.656 -15.368 13.886 1.00 0.00 H new ATOM 0 HB2 ASN B 35 -8.365 -17.470 13.084 1.00 0.00 H new ATOM 0 HB3 ASN B 35 -6.798 -18.237 13.241 1.00 0.00 H new ATOM 0 HD21 ASN B 35 -6.529 -17.256 16.828 1.00 0.00 H new ATOM 0 HD22 ASN B 35 -5.527 -17.248 15.372 1.00 0.00 H new ATOM 1519 N ASP B 36 -4.899 -16.028 11.397 1.00 0.00 N ATOM 1520 CA ASP B 36 -3.515 -16.293 10.917 1.00 0.00 C ATOM 1521 C ASP B 36 -2.640 -15.069 11.200 1.00 0.00 C ATOM 1522 O ASP B 36 -3.107 -13.945 11.188 1.00 0.00 O ATOM 1523 CB ASP B 36 -3.542 -16.564 9.411 1.00 0.00 C ATOM 1524 CG ASP B 36 -4.126 -17.956 9.145 1.00 0.00 C ATOM 1525 OD1 ASP B 36 -5.338 -18.093 9.206 1.00 0.00 O ATOM 1526 OD2 ASP B 36 -3.351 -18.862 8.881 1.00 0.00 O ATOM 0 H ASP B 36 -5.506 -15.560 10.724 1.00 0.00 H new ATOM 0 HA ASP B 36 -3.107 -17.161 11.434 1.00 0.00 H new ATOM 0 HB2 ASP B 36 -4.141 -15.806 8.906 1.00 0.00 H new ATOM 0 HB3 ASP B 36 -2.534 -16.498 9.002 1.00 0.00 H new ATOM 1531 N ILE B 37 -1.374 -15.281 11.453 1.00 0.00 N ATOM 1532 CA ILE B 37 -0.459 -14.134 11.737 1.00 0.00 C ATOM 1533 C ILE B 37 -0.197 -13.362 10.441 1.00 0.00 C ATOM 1534 O ILE B 37 -0.110 -13.936 9.368 1.00 0.00 O ATOM 1535 CB ILE B 37 0.873 -14.642 12.305 1.00 0.00 C ATOM 1536 CG1 ILE B 37 0.614 -15.663 13.426 1.00 0.00 C ATOM 1537 CG2 ILE B 37 1.676 -13.462 12.863 1.00 0.00 C ATOM 1538 CD1 ILE B 37 -0.156 -15.002 14.574 1.00 0.00 C ATOM 0 H ILE B 37 -0.933 -16.201 11.475 1.00 0.00 H new ATOM 0 HA ILE B 37 -0.929 -13.479 12.471 1.00 0.00 H new ATOM 0 HB ILE B 37 1.438 -15.124 11.508 1.00 0.00 H new ATOM 0 HG12 ILE B 37 0.046 -16.507 13.035 1.00 0.00 H new ATOM 0 HG13 ILE B 37 1.561 -16.059 13.793 1.00 0.00 H new ATOM 0 HG21 ILE B 37 2.622 -13.824 13.266 1.00 0.00 H new ATOM 0 HG22 ILE B 37 1.872 -12.746 12.065 1.00 0.00 H new ATOM 0 HG23 ILE B 37 1.106 -12.976 13.655 1.00 0.00 H new ATOM 0 HD11 ILE B 37 -0.334 -15.734 15.362 1.00 0.00 H new ATOM 0 HD12 ILE B 37 0.428 -14.173 14.974 1.00 0.00 H new ATOM 0 HD13 ILE B 37 -1.111 -14.628 14.204 1.00 0.00 H new ATOM 1550 N VAL B 38 -0.073 -12.064 10.538 1.00 0.00 N ATOM 1551 CA VAL B 38 0.182 -11.233 9.325 1.00 0.00 C ATOM 1552 C VAL B 38 1.660 -11.321 8.936 1.00 0.00 C ATOM 1553 O VAL B 38 2.546 -11.137 9.755 1.00 0.00 O ATOM 1554 CB VAL B 38 -0.197 -9.765 9.589 1.00 0.00 C ATOM 1555 CG1 VAL B 38 0.724 -9.161 10.649 1.00 0.00 C ATOM 1556 CG2 VAL B 38 -0.052 -8.964 8.292 1.00 0.00 C ATOM 0 H VAL B 38 -0.138 -11.541 11.411 1.00 0.00 H new ATOM 0 HA VAL B 38 -0.431 -11.613 8.508 1.00 0.00 H new ATOM 0 HB VAL B 38 -1.227 -9.726 9.944 1.00 0.00 H new ATOM 0 HG11 VAL B 38 0.444 -8.122 10.825 1.00 0.00 H new ATOM 0 HG12 VAL B 38 0.630 -9.725 11.577 1.00 0.00 H new ATOM 0 HG13 VAL B 38 1.756 -9.204 10.302 1.00 0.00 H new ATOM 0 HG21 VAL B 38 -0.320 -7.923 8.475 1.00 0.00 H new ATOM 0 HG22 VAL B 38 0.980 -9.018 7.945 1.00 0.00 H new ATOM 0 HG23 VAL B 38 -0.713 -9.380 7.532 1.00 0.00 H new ATOM 1566 N ASP B 39 1.926 -11.586 7.682 1.00 0.00 N ATOM 1567 CA ASP B 39 3.334 -11.670 7.205 1.00 0.00 C ATOM 1568 C ASP B 39 3.940 -10.262 7.254 1.00 0.00 C ATOM 1569 O ASP B 39 3.340 -9.323 6.763 1.00 0.00 O ATOM 1570 CB ASP B 39 3.356 -12.200 5.765 1.00 0.00 C ATOM 1571 CG ASP B 39 4.799 -12.462 5.325 1.00 0.00 C ATOM 1572 OD1 ASP B 39 5.346 -13.478 5.724 1.00 0.00 O ATOM 1573 OD2 ASP B 39 5.331 -11.643 4.595 1.00 0.00 O ATOM 0 H ASP B 39 1.220 -11.749 6.964 1.00 0.00 H new ATOM 0 HA ASP B 39 3.911 -12.347 7.835 1.00 0.00 H new ATOM 0 HB2 ASP B 39 2.774 -13.119 5.698 1.00 0.00 H new ATOM 0 HB3 ASP B 39 2.889 -11.478 5.096 1.00 0.00 H new ATOM 1578 N PRO B 40 5.102 -10.151 7.856 1.00 0.00 N ATOM 1579 CA PRO B 40 5.798 -8.856 8.000 1.00 0.00 C ATOM 1580 C PRO B 40 6.338 -8.369 6.651 1.00 0.00 C ATOM 1581 O PRO B 40 6.324 -7.184 6.373 1.00 0.00 O ATOM 1582 CB PRO B 40 6.924 -9.153 8.992 1.00 0.00 C ATOM 1583 CG PRO B 40 7.153 -10.681 8.940 1.00 0.00 C ATOM 1584 CD PRO B 40 5.838 -11.298 8.427 1.00 0.00 C ATOM 0 HA PRO B 40 5.143 -8.057 8.349 1.00 0.00 H new ATOM 0 HB2 PRO B 40 7.832 -8.614 8.723 1.00 0.00 H new ATOM 0 HB3 PRO B 40 6.651 -8.834 9.998 1.00 0.00 H new ATOM 0 HG2 PRO B 40 7.983 -10.927 8.277 1.00 0.00 H new ATOM 0 HG3 PRO B 40 7.406 -11.070 9.926 1.00 0.00 H new ATOM 0 HD2 PRO B 40 6.024 -12.066 7.676 1.00 0.00 H new ATOM 0 HD3 PRO B 40 5.277 -11.770 9.234 1.00 0.00 H new ATOM 1592 N SER B 41 6.784 -9.269 5.802 1.00 0.00 N ATOM 1593 CA SER B 41 7.287 -8.846 4.459 1.00 0.00 C ATOM 1594 C SER B 41 6.140 -8.156 3.708 1.00 0.00 C ATOM 1595 O SER B 41 6.354 -7.253 2.920 1.00 0.00 O ATOM 1596 CB SER B 41 7.763 -10.069 3.670 1.00 0.00 C ATOM 1597 OG SER B 41 8.860 -9.699 2.844 1.00 0.00 O ATOM 0 H SER B 41 6.820 -10.272 5.983 1.00 0.00 H new ATOM 0 HA SER B 41 8.126 -8.160 4.574 1.00 0.00 H new ATOM 0 HB2 SER B 41 8.060 -10.864 4.354 1.00 0.00 H new ATOM 0 HB3 SER B 41 6.950 -10.461 3.060 1.00 0.00 H new ATOM 0 HG SER B 41 9.168 -10.481 2.339 1.00 0.00 H new ATOM 1603 N LYS B 42 4.919 -8.573 3.973 1.00 0.00 N ATOM 1604 CA LYS B 42 3.733 -7.952 3.315 1.00 0.00 C ATOM 1605 C LYS B 42 3.315 -6.691 4.088 1.00 0.00 C ATOM 1606 O LYS B 42 2.739 -5.780 3.522 1.00 0.00 O ATOM 1607 CB LYS B 42 2.573 -8.952 3.303 1.00 0.00 C ATOM 1608 CG LYS B 42 2.844 -10.039 2.257 1.00 0.00 C ATOM 1609 CD LYS B 42 1.604 -10.224 1.378 1.00 0.00 C ATOM 1610 CE LYS B 42 2.033 -10.546 -0.056 1.00 0.00 C ATOM 1611 NZ LYS B 42 2.235 -9.278 -0.815 1.00 0.00 N ATOM 0 H LYS B 42 4.699 -9.326 4.625 1.00 0.00 H new ATOM 0 HA LYS B 42 3.989 -7.680 2.291 1.00 0.00 H new ATOM 0 HB2 LYS B 42 2.457 -9.402 4.289 1.00 0.00 H new ATOM 0 HB3 LYS B 42 1.639 -8.438 3.075 1.00 0.00 H new ATOM 0 HG2 LYS B 42 3.700 -9.761 1.642 1.00 0.00 H new ATOM 0 HG3 LYS B 42 3.097 -10.978 2.750 1.00 0.00 H new ATOM 0 HD2 LYS B 42 0.984 -11.029 1.772 1.00 0.00 H new ATOM 0 HD3 LYS B 42 0.998 -9.318 1.392 1.00 0.00 H new ATOM 0 HE2 LYS B 42 2.955 -11.128 -0.049 1.00 0.00 H new ATOM 0 HE3 LYS B 42 1.274 -11.157 -0.545 1.00 0.00 H new ATOM 0 HZ1 LYS B 42 2.427 -9.498 -1.813 1.00 0.00 H new ATOM 0 HZ2 LYS B 42 1.378 -8.693 -0.748 1.00 0.00 H new ATOM 0 HZ3 LYS B 42 3.042 -8.758 -0.414 1.00 0.00 H new ATOM 1625 N ILE B 43 3.605 -6.632 5.377 1.00 0.00 N ATOM 1626 CA ILE B 43 3.233 -5.433 6.195 1.00 0.00 C ATOM 1627 C ILE B 43 3.850 -4.178 5.570 1.00 0.00 C ATOM 1628 O ILE B 43 5.051 -3.969 5.617 1.00 0.00 O ATOM 1629 CB ILE B 43 3.751 -5.596 7.632 1.00 0.00 C ATOM 1630 CG1 ILE B 43 2.914 -6.651 8.363 1.00 0.00 C ATOM 1631 CG2 ILE B 43 3.644 -4.258 8.376 1.00 0.00 C ATOM 1632 CD1 ILE B 43 3.538 -6.956 9.727 1.00 0.00 C ATOM 0 H ILE B 43 4.085 -7.369 5.893 1.00 0.00 H new ATOM 0 HA ILE B 43 2.147 -5.337 6.215 1.00 0.00 H new ATOM 0 HB ILE B 43 4.794 -5.913 7.603 1.00 0.00 H new ATOM 0 HG12 ILE B 43 1.893 -6.292 8.492 1.00 0.00 H new ATOM 0 HG13 ILE B 43 2.859 -7.562 7.767 1.00 0.00 H new ATOM 0 HG21 ILE B 43 4.012 -4.378 9.395 1.00 0.00 H new ATOM 0 HG22 ILE B 43 4.241 -3.506 7.860 1.00 0.00 H new ATOM 0 HG23 ILE B 43 2.602 -3.938 8.402 1.00 0.00 H new ATOM 0 HD11 ILE B 43 2.938 -7.707 10.242 1.00 0.00 H new ATOM 0 HD12 ILE B 43 4.551 -7.334 9.587 1.00 0.00 H new ATOM 0 HD13 ILE B 43 3.570 -6.045 10.324 1.00 0.00 H new ATOM 1644 N GLU B 44 3.027 -3.345 4.990 1.00 0.00 N ATOM 1645 CA GLU B 44 3.526 -2.091 4.358 1.00 0.00 C ATOM 1646 C GLU B 44 3.133 -0.894 5.229 1.00 0.00 C ATOM 1647 O GLU B 44 3.836 0.099 5.282 1.00 0.00 O ATOM 1648 CB GLU B 44 2.903 -1.937 2.970 1.00 0.00 C ATOM 1649 CG GLU B 44 3.555 -2.926 2.000 1.00 0.00 C ATOM 1650 CD GLU B 44 3.528 -2.353 0.580 1.00 0.00 C ATOM 1651 OE1 GLU B 44 2.559 -2.600 -0.120 1.00 0.00 O ATOM 1652 OE2 GLU B 44 4.478 -1.678 0.215 1.00 0.00 O ATOM 0 H GLU B 44 2.018 -3.483 4.927 1.00 0.00 H new ATOM 0 HA GLU B 44 4.611 -2.135 4.266 1.00 0.00 H new ATOM 0 HB2 GLU B 44 1.829 -2.117 3.021 1.00 0.00 H new ATOM 0 HB3 GLU B 44 3.039 -0.917 2.611 1.00 0.00 H new ATOM 0 HG2 GLU B 44 4.583 -3.123 2.303 1.00 0.00 H new ATOM 0 HG3 GLU B 44 3.027 -3.879 2.028 1.00 0.00 H new ATOM 1659 N LYS B 45 2.012 -0.986 5.910 1.00 0.00 N ATOM 1660 CA LYS B 45 1.557 0.141 6.783 1.00 0.00 C ATOM 1661 C LYS B 45 0.864 -0.415 8.033 1.00 0.00 C ATOM 1662 O LYS B 45 -0.039 -1.229 7.943 1.00 0.00 O ATOM 1663 CB LYS B 45 0.575 1.026 6.006 1.00 0.00 C ATOM 1664 CG LYS B 45 1.343 2.038 5.154 1.00 0.00 C ATOM 1665 CD LYS B 45 1.839 3.186 6.039 1.00 0.00 C ATOM 1666 CE LYS B 45 2.918 3.977 5.294 1.00 0.00 C ATOM 1667 NZ LYS B 45 4.240 3.309 5.468 1.00 0.00 N ATOM 0 H LYS B 45 1.393 -1.796 5.897 1.00 0.00 H new ATOM 0 HA LYS B 45 2.422 0.732 7.085 1.00 0.00 H new ATOM 0 HB2 LYS B 45 -0.058 0.408 5.369 1.00 0.00 H new ATOM 0 HB3 LYS B 45 -0.084 1.548 6.700 1.00 0.00 H new ATOM 0 HG2 LYS B 45 2.187 1.551 4.666 1.00 0.00 H new ATOM 0 HG3 LYS B 45 0.699 2.426 4.365 1.00 0.00 H new ATOM 0 HD2 LYS B 45 1.009 3.842 6.301 1.00 0.00 H new ATOM 0 HD3 LYS B 45 2.241 2.792 6.972 1.00 0.00 H new ATOM 0 HE2 LYS B 45 2.669 4.042 4.235 1.00 0.00 H new ATOM 0 HE3 LYS B 45 2.962 4.998 5.674 1.00 0.00 H new ATOM 0 HZ1 LYS B 45 4.889 3.623 4.719 1.00 0.00 H new ATOM 0 HZ2 LYS B 45 4.636 3.559 6.397 1.00 0.00 H new ATOM 0 HZ3 LYS B 45 4.118 2.278 5.410 1.00 0.00 H new ATOM 1681 N THR B 46 1.280 0.027 9.197 1.00 0.00 N ATOM 1682 CA THR B 46 0.656 -0.457 10.464 1.00 0.00 C ATOM 1683 C THR B 46 -0.135 0.688 11.109 1.00 0.00 C ATOM 1684 O THR B 46 0.409 1.736 11.412 1.00 0.00 O ATOM 1685 CB THR B 46 1.752 -0.941 11.425 1.00 0.00 C ATOM 1686 OG1 THR B 46 2.370 -2.108 10.891 1.00 0.00 O ATOM 1687 CG2 THR B 46 1.140 -1.265 12.791 1.00 0.00 C ATOM 0 H THR B 46 2.030 0.707 9.321 1.00 0.00 H new ATOM 0 HA THR B 46 -0.019 -1.285 10.247 1.00 0.00 H new ATOM 0 HB THR B 46 2.498 -0.155 11.544 1.00 0.00 H new ATOM 0 HG1 THR B 46 3.071 -2.416 11.503 1.00 0.00 H new ATOM 0 HG21 THR B 46 1.922 -1.608 13.468 1.00 0.00 H new ATOM 0 HG22 THR B 46 0.671 -0.370 13.201 1.00 0.00 H new ATOM 0 HG23 THR B 46 0.390 -2.048 12.677 1.00 0.00 H new ATOM 1695 N PHE B 47 -1.418 0.494 11.313 1.00 0.00 N ATOM 1696 CA PHE B 47 -2.262 1.559 11.929 1.00 0.00 C ATOM 1697 C PHE B 47 -2.959 1.024 13.182 1.00 0.00 C ATOM 1698 O PHE B 47 -3.559 -0.030 13.169 1.00 0.00 O ATOM 1699 CB PHE B 47 -3.321 2.011 10.929 1.00 0.00 C ATOM 1700 CG PHE B 47 -2.754 3.079 10.028 1.00 0.00 C ATOM 1701 CD1 PHE B 47 -1.814 2.747 9.045 1.00 0.00 C ATOM 1702 CD2 PHE B 47 -3.169 4.404 10.179 1.00 0.00 C ATOM 1703 CE1 PHE B 47 -1.290 3.744 8.216 1.00 0.00 C ATOM 1704 CE2 PHE B 47 -2.648 5.400 9.350 1.00 0.00 C ATOM 1705 CZ PHE B 47 -1.708 5.071 8.369 1.00 0.00 C ATOM 0 H PHE B 47 -1.916 -0.364 11.076 1.00 0.00 H new ATOM 0 HA PHE B 47 -1.623 2.398 12.202 1.00 0.00 H new ATOM 0 HB2 PHE B 47 -3.658 1.162 10.334 1.00 0.00 H new ATOM 0 HB3 PHE B 47 -4.193 2.395 11.458 1.00 0.00 H new ATOM 0 HD1 PHE B 47 -1.494 1.722 8.927 1.00 0.00 H new ATOM 0 HD2 PHE B 47 -3.894 4.659 10.938 1.00 0.00 H new ATOM 0 HE1 PHE B 47 -0.563 3.490 7.458 1.00 0.00 H new ATOM 0 HE2 PHE B 47 -2.971 6.424 9.467 1.00 0.00 H new ATOM 0 HZ PHE B 47 -1.304 5.841 7.729 1.00 0.00 H new ATOM 1715 N ILE B 48 -2.882 1.758 14.258 1.00 0.00 N ATOM 1716 CA ILE B 48 -3.535 1.332 15.530 1.00 0.00 C ATOM 1717 C ILE B 48 -4.504 2.430 15.986 1.00 0.00 C ATOM 1718 O ILE B 48 -4.255 3.607 15.786 1.00 0.00 O ATOM 1719 CB ILE B 48 -2.471 1.108 16.613 1.00 0.00 C ATOM 1720 CG1 ILE B 48 -1.139 0.724 15.951 1.00 0.00 C ATOM 1721 CG2 ILE B 48 -2.931 -0.011 17.554 1.00 0.00 C ATOM 1722 CD1 ILE B 48 -0.171 0.165 16.993 1.00 0.00 C ATOM 0 H ILE B 48 -2.387 2.648 14.311 1.00 0.00 H new ATOM 0 HA ILE B 48 -4.078 0.401 15.366 1.00 0.00 H new ATOM 0 HB ILE B 48 -2.332 2.024 17.187 1.00 0.00 H new ATOM 0 HG12 ILE B 48 -1.313 -0.018 15.171 1.00 0.00 H new ATOM 0 HG13 ILE B 48 -0.700 1.597 15.468 1.00 0.00 H new ATOM 0 HG21 ILE B 48 -2.177 -0.172 18.324 1.00 0.00 H new ATOM 0 HG22 ILE B 48 -3.873 0.272 18.023 1.00 0.00 H new ATOM 0 HG23 ILE B 48 -3.071 -0.930 16.985 1.00 0.00 H new ATOM 0 HD11 ILE B 48 0.769 -0.103 16.510 1.00 0.00 H new ATOM 0 HD12 ILE B 48 0.016 0.919 17.757 1.00 0.00 H new ATOM 0 HD13 ILE B 48 -0.606 -0.721 17.456 1.00 0.00 H new ATOM 1734 N ARG B 49 -5.603 2.052 16.594 1.00 0.00 N ATOM 1735 CA ARG B 49 -6.599 3.065 17.066 1.00 0.00 C ATOM 1736 C ARG B 49 -5.922 4.041 18.042 1.00 0.00 C ATOM 1737 O ARG B 49 -5.583 3.687 19.158 1.00 0.00 O ATOM 1738 CB ARG B 49 -7.775 2.358 17.760 1.00 0.00 C ATOM 1739 CG ARG B 49 -7.258 1.421 18.861 1.00 0.00 C ATOM 1740 CD ARG B 49 -7.868 0.029 18.681 1.00 0.00 C ATOM 1741 NE ARG B 49 -9.293 0.046 19.123 1.00 0.00 N ATOM 1742 CZ ARG B 49 -10.076 -0.961 18.842 1.00 0.00 C ATOM 1743 NH1 ARG B 49 -10.693 -1.006 17.691 1.00 0.00 N ATOM 1744 NH2 ARG B 49 -10.241 -1.923 19.713 1.00 0.00 N ATOM 0 H ARG B 49 -5.854 1.082 16.784 1.00 0.00 H new ATOM 0 HA ARG B 49 -6.978 3.622 16.209 1.00 0.00 H new ATOM 0 HB2 ARG B 49 -8.450 3.098 18.190 1.00 0.00 H new ATOM 0 HB3 ARG B 49 -8.349 1.789 17.029 1.00 0.00 H new ATOM 0 HG2 ARG B 49 -6.170 1.360 18.819 1.00 0.00 H new ATOM 0 HG3 ARG B 49 -7.518 1.819 19.842 1.00 0.00 H new ATOM 0 HD2 ARG B 49 -7.804 -0.275 17.636 1.00 0.00 H new ATOM 0 HD3 ARG B 49 -7.306 -0.703 19.260 1.00 0.00 H new ATOM 0 HE ARG B 49 -9.656 0.844 19.645 1.00 0.00 H new ATOM 0 HH11 ARG B 49 -10.563 -0.255 17.013 1.00 0.00 H new ATOM 0 HH12 ARG B 49 -11.305 -1.792 17.471 1.00 0.00 H new ATOM 0 HH21 ARG B 49 -9.758 -1.886 20.611 1.00 0.00 H new ATOM 0 HH22 ARG B 49 -10.852 -2.710 19.494 1.00 0.00 H new ATOM 1758 N LYS B 50 -5.713 5.264 17.615 1.00 0.00 N ATOM 1759 CA LYS B 50 -5.051 6.273 18.492 1.00 0.00 C ATOM 1760 C LYS B 50 -6.005 7.446 18.745 1.00 0.00 C ATOM 1761 O LYS B 50 -6.568 8.013 17.825 1.00 0.00 O ATOM 1762 CB LYS B 50 -3.778 6.782 17.807 1.00 0.00 C ATOM 1763 CG LYS B 50 -2.771 7.241 18.865 1.00 0.00 C ATOM 1764 CD LYS B 50 -2.044 8.495 18.371 1.00 0.00 C ATOM 1765 CE LYS B 50 -2.555 9.721 19.135 1.00 0.00 C ATOM 1766 NZ LYS B 50 -3.704 10.327 18.401 1.00 0.00 N ATOM 0 H LYS B 50 -5.975 5.605 16.690 1.00 0.00 H new ATOM 0 HA LYS B 50 -4.793 5.812 19.445 1.00 0.00 H new ATOM 0 HB2 LYS B 50 -3.342 5.992 17.195 1.00 0.00 H new ATOM 0 HB3 LYS B 50 -4.019 7.608 17.138 1.00 0.00 H new ATOM 0 HG2 LYS B 50 -3.284 7.452 19.803 1.00 0.00 H new ATOM 0 HG3 LYS B 50 -2.052 6.447 19.066 1.00 0.00 H new ATOM 0 HD2 LYS B 50 -0.969 8.385 18.516 1.00 0.00 H new ATOM 0 HD3 LYS B 50 -2.209 8.626 17.302 1.00 0.00 H new ATOM 0 HE2 LYS B 50 -2.864 9.433 20.140 1.00 0.00 H new ATOM 0 HE3 LYS B 50 -1.755 10.453 19.245 1.00 0.00 H new ATOM 0 HZ1 LYS B 50 -4.049 11.159 18.922 1.00 0.00 H new ATOM 0 HZ2 LYS B 50 -3.395 10.617 17.451 1.00 0.00 H new ATOM 0 HZ3 LYS B 50 -4.470 9.629 18.318 1.00 0.00 H new ATOM 1780 N ASP B 51 -6.186 7.810 19.993 1.00 0.00 N ATOM 1781 CA ASP B 51 -7.097 8.945 20.333 1.00 0.00 C ATOM 1782 C ASP B 51 -6.818 9.414 21.764 1.00 0.00 C ATOM 1783 O ASP B 51 -6.413 10.541 21.987 1.00 0.00 O ATOM 1784 CB ASP B 51 -8.558 8.486 20.213 1.00 0.00 C ATOM 1785 CG ASP B 51 -9.495 9.688 20.380 1.00 0.00 C ATOM 1786 OD1 ASP B 51 -9.738 10.366 19.395 1.00 0.00 O ATOM 1787 OD2 ASP B 51 -9.953 9.907 21.490 1.00 0.00 O ATOM 0 H ASP B 51 -5.738 7.365 20.794 1.00 0.00 H new ATOM 0 HA ASP B 51 -6.922 9.770 19.643 1.00 0.00 H new ATOM 0 HB2 ASP B 51 -8.723 8.017 19.243 1.00 0.00 H new ATOM 0 HB3 ASP B 51 -8.776 7.735 20.972 1.00 0.00 H new ATOM 1792 N THR B 52 -7.032 8.554 22.731 1.00 0.00 N ATOM 1793 CA THR B 52 -6.785 8.930 24.159 1.00 0.00 C ATOM 1794 C THR B 52 -6.269 7.705 24.933 1.00 0.00 C ATOM 1795 O THR B 52 -6.744 6.603 24.731 1.00 0.00 O ATOM 1796 CB THR B 52 -8.088 9.429 24.808 1.00 0.00 C ATOM 1797 OG1 THR B 52 -9.187 8.629 24.377 1.00 0.00 O ATOM 1798 CG2 THR B 52 -8.328 10.891 24.424 1.00 0.00 C ATOM 0 H THR B 52 -7.369 7.602 22.591 1.00 0.00 H new ATOM 0 HA THR B 52 -6.041 9.726 24.191 1.00 0.00 H new ATOM 0 HB THR B 52 -7.998 9.351 25.892 1.00 0.00 H new ATOM 0 HG1 THR B 52 -9.475 8.921 23.487 1.00 0.00 H new ATOM 0 HG21 THR B 52 -9.251 11.241 24.885 1.00 0.00 H new ATOM 0 HG22 THR B 52 -7.494 11.500 24.773 1.00 0.00 H new ATOM 0 HG23 THR B 52 -8.409 10.974 23.340 1.00 0.00 H new ATOM 1806 N PRO B 53 -5.307 7.941 25.801 1.00 0.00 N ATOM 1807 CA PRO B 53 -4.697 6.880 26.627 1.00 0.00 C ATOM 1808 C PRO B 53 -5.617 6.503 27.797 1.00 0.00 C ATOM 1809 O PRO B 53 -6.131 5.400 27.857 1.00 0.00 O ATOM 1810 CB PRO B 53 -3.395 7.517 27.125 1.00 0.00 C ATOM 1811 CG PRO B 53 -3.592 9.049 27.036 1.00 0.00 C ATOM 1812 CD PRO B 53 -4.739 9.288 26.037 1.00 0.00 C ATOM 0 HA PRO B 53 -4.527 5.954 26.077 1.00 0.00 H new ATOM 0 HB2 PRO B 53 -3.181 7.212 28.150 1.00 0.00 H new ATOM 0 HB3 PRO B 53 -2.550 7.199 26.515 1.00 0.00 H new ATOM 0 HG2 PRO B 53 -3.836 9.466 28.013 1.00 0.00 H new ATOM 0 HG3 PRO B 53 -2.678 9.538 26.700 1.00 0.00 H new ATOM 0 HD2 PRO B 53 -5.486 9.969 26.445 1.00 0.00 H new ATOM 0 HD3 PRO B 53 -4.374 9.733 25.112 1.00 0.00 H new ATOM 1820 N ASP B 54 -5.824 7.409 28.723 1.00 0.00 N ATOM 1821 CA ASP B 54 -6.705 7.116 29.895 1.00 0.00 C ATOM 1822 C ASP B 54 -7.796 8.188 30.005 1.00 0.00 C ATOM 1823 O ASP B 54 -8.973 7.879 30.052 1.00 0.00 O ATOM 1824 CB ASP B 54 -5.863 7.108 31.177 1.00 0.00 C ATOM 1825 CG ASP B 54 -6.666 6.478 32.321 1.00 0.00 C ATOM 1826 OD1 ASP B 54 -6.604 5.269 32.468 1.00 0.00 O ATOM 1827 OD2 ASP B 54 -7.330 7.218 33.031 1.00 0.00 O ATOM 0 H ASP B 54 -5.417 8.344 28.716 1.00 0.00 H new ATOM 0 HA ASP B 54 -7.173 6.141 29.759 1.00 0.00 H new ATOM 0 HB2 ASP B 54 -4.942 6.548 31.015 1.00 0.00 H new ATOM 0 HB3 ASP B 54 -5.575 8.126 31.440 1.00 0.00 H new ATOM 1832 N TYR B 55 -7.408 9.441 30.049 1.00 0.00 N ATOM 1833 CA TYR B 55 -8.409 10.549 30.160 1.00 0.00 C ATOM 1834 C TYR B 55 -9.326 10.581 28.919 1.00 0.00 C ATOM 1835 O TYR B 55 -8.871 10.212 27.845 1.00 0.00 O ATOM 1836 CB TYR B 55 -7.672 11.892 30.309 1.00 0.00 C ATOM 1837 CG TYR B 55 -6.902 12.224 29.046 1.00 0.00 C ATOM 1838 CD1 TYR B 55 -7.521 12.945 28.017 1.00 0.00 C ATOM 1839 CD2 TYR B 55 -5.570 11.813 28.908 1.00 0.00 C ATOM 1840 CE1 TYR B 55 -6.810 13.253 26.851 1.00 0.00 C ATOM 1841 CE2 TYR B 55 -4.859 12.121 27.743 1.00 0.00 C ATOM 1842 CZ TYR B 55 -5.478 12.841 26.714 1.00 0.00 C ATOM 1843 OH TYR B 55 -4.777 13.143 25.565 1.00 0.00 O ATOM 1844 OXT TYR B 55 -10.471 10.974 29.070 1.00 0.00 O ATOM 0 H TYR B 55 -6.435 9.745 30.013 1.00 0.00 H new ATOM 0 HA TYR B 55 -9.031 10.377 31.038 1.00 0.00 H new ATOM 0 HB2 TYR B 55 -8.389 12.684 30.522 1.00 0.00 H new ATOM 0 HB3 TYR B 55 -6.988 11.845 31.156 1.00 0.00 H new ATOM 0 HD1 TYR B 55 -8.547 13.264 28.123 1.00 0.00 H new ATOM 0 HD2 TYR B 55 -5.092 11.258 29.701 1.00 0.00 H new ATOM 0 HE1 TYR B 55 -7.288 13.808 26.057 1.00 0.00 H new ATOM 0 HE2 TYR B 55 -3.832 11.803 27.637 1.00 0.00 H new ATOM 0 HH TYR B 55 -3.867 12.785 25.633 1.00 0.00 H new TER 1854 TYR B 55