USER MOD reduce.3.24.130724 H: found=0, std=0, add=1064, rem=0, adj=33 USER MOD reduce.3.24.130724 removed 1050 hydrogens (25 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 122 SER OG : rot 86:sc= 1.16 USER MOD Set 1.2: A 125 THR OG1 : rot 163:sc= 0.993 USER MOD Set 2.1: A 99 GLN : amide:sc= -0.695 X(o=-0.7,f=-0.71) USER MOD Set 2.2: A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Set 3.1: A 78 CYS SG : rot 170:sc= -0.937 USER MOD Set 3.2: A 111 MET CE :methyl 170:sc= -0.0656 (180deg=-0.00106) USER MOD Set 4.1: A 64 TYR OH : rot 45:sc= 0.671 USER MOD Set 4.2: A 66 GLN : amide:sc= -0.145 X(o=0.62,f=0.13) USER MOD Set 4.3: A 71 CYS SG : rot 74:sc= 0.86 USER MOD Set 4.4: A 93 ASN : amide:sc= -0.77 K(o=0.62,f=-0.22) USER MOD Set 5.1: A 59 CYS SG : rot 60:sc= 0.209 USER MOD Set 5.2: A 117 TYR OH : rot 57:sc=-0.00333 USER MOD Set 6.1: A 26 SER OG : rot -83:sc= 1.19 USER MOD Set 6.2: A 130 MET CE :methyl -116:sc= -3.21 (180deg=-6.34!) USER MOD Set 7.1: A 25 HIS : no HD1:sc= -0.105 K(o=-0.81,f=-1.8) USER MOD Set 7.2: A 29 ASN : amide:sc= -0.703 K(o=-0.81,f=-1.8) USER MOD Set 8.1: A 3 LYS NZ :NH3+ -135:sc= 0 (180deg=-0.0695) USER MOD Set 8.2: A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET CE :methyl -169:sc= 0 (180deg=-0.246) USER MOD Single : A 1 MET N :NH3+ 178:sc= 0 (180deg=-0.00704) USER MOD Single : A 4 LYS NZ :NH3+ 172:sc= 0 (180deg=-0.0626) USER MOD Single : A 5 THR OG1 : rot 158:sc= 0.607 USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 15 CYS SG : rot 180:sc= -0.116 USER MOD Single : A 16 HIS : no HD1:sc= -0.0941 X(o=-0.094,f=-0.13) USER MOD Single : A 20 ASN : amide:sc= -0.0746 X(o=-0.075,f=-0.39) USER MOD Single : A 21 LYS NZ :NH3+ -169:sc= 0.157 (180deg=0.14) USER MOD Single : A 28 THR OG1 : rot 77:sc= -0.0127 USER MOD Single : A 33 ASN : amide:sc= -0.297 K(o=-0.3,f=-2!) USER MOD Single : A 36 ASN : amide:sc= -0.391 X(o=-0.39,f=-0.58) USER MOD Single : A 41 SER OG : rot -49:sc= 0.00243 USER MOD Single : A 42 SER OG : rot 41:sc= 0.16 USER MOD Single : A 43 GLN :FLIP amide:sc= -3.04! C(o=-4.2!,f=-3!) USER MOD Single : A 48 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 53 THR OG1 : rot -120:sc= -0.0404 USER MOD Single : A 61 SER OG : rot 180:sc= -0.205 USER MOD Single : A 62 SER OG : rot -120:sc= -0.0629 USER MOD Single : A 72 LYS NZ :NH3+ -107:sc= -0.0757 (180deg=-0.264) USER MOD Single : A 77 LYS NZ :NH3+ -152:sc= -0.481 (180deg=-2.29!) USER MOD Single : A 84 LYS NZ :NH3+ -126:sc= -0.173 (180deg=-4.27!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 98 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0181) USER MOD Single : A 100 ASN : amide:sc= -0.0469 K(o=-0.047,f=-0.76) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 121 THR OG1 : rot -160:sc= -0.0267 USER MOD Single : A 126 THR OG1 : rot -172:sc= 1.25 USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 138 FOP N4 :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 DBI O2' : rot 180:sc= -0.21 USER MOD Single : A 139 DBI O5' : rot 180:sc= -0.0163 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.959 10.406 13.619 1.00 0.00 N ATOM 2 CA MET A 1 -2.150 9.264 13.978 1.00 0.00 C ATOM 3 C MET A 1 -2.712 8.107 13.147 1.00 0.00 C ATOM 4 O MET A 1 -2.153 7.735 12.121 1.00 0.00 O ATOM 5 CB MET A 1 -2.182 9.037 15.502 1.00 0.00 C ATOM 6 CG MET A 1 -1.314 7.858 15.957 1.00 0.00 C ATOM 7 SD MET A 1 -1.394 7.638 17.744 1.00 0.00 S ATOM 8 CE MET A 1 -2.823 6.543 17.823 1.00 0.00 C ATOM 0 H1 MET A 1 -2.657 11.233 14.173 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.844 10.608 12.605 1.00 0.00 H new ATOM 0 H3 MET A 1 -3.958 10.200 13.820 1.00 0.00 H new ATOM 0 HA MET A 1 -1.090 9.390 13.757 1.00 0.00 H new ATOM 0 HB2 MET A 1 -1.844 9.943 16.005 1.00 0.00 H new ATOM 0 HB3 MET A 1 -3.212 8.864 15.815 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.646 6.946 15.461 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.280 8.027 15.655 1.00 0.00 H new ATOM 0 HE1 MET A 1 -3.152 6.448 18.858 1.00 0.00 H new ATOM 0 HE2 MET A 1 -3.632 6.957 17.222 1.00 0.00 H new ATOM 0 HE3 MET A 1 -2.550 5.561 17.437 1.00 0.00 H new ATOM 20 N GLU A 2 -3.846 7.566 13.651 1.00 0.00 N ATOM 21 CA GLU A 2 -4.527 6.463 12.991 1.00 0.00 C ATOM 22 C GLU A 2 -5.608 7.130 12.139 1.00 0.00 C ATOM 23 O GLU A 2 -6.781 7.185 12.489 1.00 0.00 O ATOM 24 CB GLU A 2 -5.119 5.494 14.032 1.00 0.00 C ATOM 25 CG GLU A 2 -4.031 4.683 14.751 1.00 0.00 C ATOM 26 CD GLU A 2 -4.650 3.737 15.794 1.00 0.00 C ATOM 27 OE1 GLU A 2 -5.004 4.203 16.877 1.00 0.00 O ATOM 28 OE2 GLU A 2 -4.772 2.545 15.515 1.00 0.00 O ATOM 0 H GLU A 2 -4.295 7.884 14.510 1.00 0.00 H new ATOM 0 HA GLU A 2 -3.860 5.857 12.378 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -5.694 6.058 14.766 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -5.812 4.812 13.539 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -3.462 4.105 14.023 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -3.330 5.360 15.239 1.00 0.00 H new ATOM 35 N LYS A 3 -5.109 7.616 10.983 1.00 0.00 N ATOM 36 CA LYS A 3 -5.899 8.318 10.006 1.00 0.00 C ATOM 37 C LYS A 3 -6.675 7.279 9.199 1.00 0.00 C ATOM 38 O LYS A 3 -6.365 6.094 9.170 1.00 0.00 O ATOM 39 CB LYS A 3 -4.983 9.240 9.193 1.00 0.00 C ATOM 40 CG LYS A 3 -4.637 10.485 10.009 1.00 0.00 C ATOM 41 CD LYS A 3 -3.719 11.444 9.251 1.00 0.00 C ATOM 42 CE LYS A 3 -3.395 12.714 10.043 1.00 0.00 C ATOM 43 NZ LYS A 3 -4.574 13.519 10.338 1.00 0.00 N ATOM 0 H LYS A 3 -4.129 7.519 10.718 1.00 0.00 H new ATOM 0 HA LYS A 3 -6.644 8.979 10.449 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -4.071 8.710 8.918 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -5.476 9.529 8.265 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -5.556 11.005 10.280 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -4.155 10.184 10.939 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -2.790 10.930 9.004 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -4.191 11.721 8.308 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -2.908 12.438 10.978 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -2.683 13.316 9.478 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -4.368 14.520 10.145 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -5.366 13.207 9.741 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -4.830 13.405 11.340 1.00 0.00 H new ATOM 56 N LYS A 4 -7.722 7.847 8.561 1.00 0.00 N ATOM 57 CA LYS A 4 -8.662 7.073 7.773 1.00 0.00 C ATOM 58 C LYS A 4 -8.616 7.592 6.330 1.00 0.00 C ATOM 59 O LYS A 4 -9.075 8.681 6.007 1.00 0.00 O ATOM 60 CB LYS A 4 -10.035 7.195 8.460 1.00 0.00 C ATOM 61 CG LYS A 4 -10.691 8.581 8.396 1.00 0.00 C ATOM 62 CD LYS A 4 -11.964 8.644 9.249 1.00 0.00 C ATOM 63 CE LYS A 4 -12.707 9.975 9.101 1.00 0.00 C ATOM 64 NZ LYS A 4 -13.287 10.151 7.774 1.00 0.00 N ATOM 0 H LYS A 4 -7.924 8.846 8.587 1.00 0.00 H new ATOM 0 HA LYS A 4 -8.424 6.011 7.718 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -10.713 6.471 8.007 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -9.923 6.915 9.507 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -9.984 9.335 8.741 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -10.934 8.822 7.361 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -12.628 7.828 8.965 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -11.703 8.492 10.296 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -13.498 10.030 9.849 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -12.019 10.795 9.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -13.889 10.999 7.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -12.526 10.262 7.074 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -13.860 9.317 7.532 1.00 0.00 H new ATOM 77 N THR A 5 -8.028 6.715 5.488 1.00 0.00 N ATOM 78 CA THR A 5 -7.847 6.918 4.053 1.00 0.00 C ATOM 79 C THR A 5 -7.014 5.694 3.660 1.00 0.00 C ATOM 80 O THR A 5 -5.792 5.692 3.597 1.00 0.00 O ATOM 81 CB THR A 5 -7.199 8.303 3.720 1.00 0.00 C ATOM 82 OG1 THR A 5 -6.663 9.065 4.848 1.00 0.00 O ATOM 83 CG2 THR A 5 -8.128 9.140 2.792 1.00 0.00 C ATOM 0 H THR A 5 -7.658 5.820 5.809 1.00 0.00 H new ATOM 0 HA THR A 5 -8.774 6.977 3.483 1.00 0.00 H new ATOM 0 HB THR A 5 -6.289 8.058 3.172 1.00 0.00 H new ATOM 0 HG1 THR A 5 -5.998 9.707 4.523 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.657 10.098 2.574 1.00 0.00 H new ATOM 0 HG22 THR A 5 -8.296 8.598 1.861 1.00 0.00 H new ATOM 0 HG23 THR A 5 -9.082 9.310 3.290 1.00 0.00 H new ATOM 91 N ILE A 6 -7.806 4.642 3.409 1.00 0.00 N ATOM 92 CA ILE A 6 -7.331 3.331 3.092 1.00 0.00 C ATOM 93 C ILE A 6 -7.689 3.162 1.620 1.00 0.00 C ATOM 94 O ILE A 6 -8.844 3.005 1.242 1.00 0.00 O ATOM 95 CB ILE A 6 -7.976 2.349 4.117 1.00 0.00 C ATOM 96 CG1 ILE A 6 -8.421 2.989 5.496 1.00 0.00 C ATOM 97 CG2 ILE A 6 -8.340 0.984 3.455 1.00 0.00 C ATOM 98 CD1 ILE A 6 -7.205 3.438 6.316 1.00 0.00 C ATOM 0 H ILE A 6 -8.824 4.705 3.427 1.00 0.00 H new ATOM 0 HA ILE A 6 -6.262 3.139 3.186 1.00 0.00 H new ATOM 0 HB ILE A 6 -7.588 1.736 4.931 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -9.073 3.842 5.310 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -9.000 2.263 6.067 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -8.787 0.326 4.200 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -9.050 1.150 2.645 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -7.437 0.521 3.057 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -7.541 3.873 7.257 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -6.567 2.578 6.521 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -6.641 4.182 5.753 1.00 0.00 H new ATOM 110 N VAL A 7 -6.592 3.226 0.831 1.00 0.00 N ATOM 111 CA VAL A 7 -6.649 3.146 -0.606 1.00 0.00 C ATOM 112 C VAL A 7 -5.980 1.875 -1.122 1.00 0.00 C ATOM 113 O VAL A 7 -4.838 1.564 -0.813 1.00 0.00 O ATOM 114 CB VAL A 7 -6.078 4.433 -1.273 1.00 0.00 C ATOM 115 CG1 VAL A 7 -4.833 4.980 -0.502 1.00 0.00 C ATOM 116 CG2 VAL A 7 -6.473 4.817 -2.722 1.00 0.00 C ATOM 0 H VAL A 7 -5.647 3.335 1.198 1.00 0.00 H new ATOM 0 HA VAL A 7 -7.699 3.085 -0.894 1.00 0.00 H new ATOM 0 HB VAL A 7 -6.740 5.297 -1.222 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -4.464 5.878 -0.998 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -5.117 5.222 0.522 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -4.049 4.222 -0.492 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -5.972 5.743 -3.002 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -6.173 4.021 -3.404 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -7.552 4.957 -2.780 1.00 0.00 H new ATOM 126 N LEU A 8 -6.792 1.157 -1.930 1.00 0.00 N ATOM 127 CA LEU A 8 -6.329 -0.085 -2.531 1.00 0.00 C ATOM 128 C LEU A 8 -6.536 0.055 -4.049 1.00 0.00 C ATOM 129 O LEU A 8 -7.391 0.787 -4.540 1.00 0.00 O ATOM 130 CB LEU A 8 -7.015 -1.289 -1.867 1.00 0.00 C ATOM 131 CG LEU A 8 -8.555 -1.362 -2.079 1.00 0.00 C ATOM 132 CD1 LEU A 8 -8.876 -2.247 -3.324 1.00 0.00 C ATOM 133 CD2 LEU A 8 -9.534 -0.940 -0.946 1.00 0.00 C ATOM 0 H LEU A 8 -7.748 1.420 -2.169 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.269 -0.275 -2.364 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -6.566 -2.204 -2.253 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -6.811 -1.261 -0.797 1.00 0.00 H new ATOM 0 HG LEU A 8 -9.116 -0.459 -2.322 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -9.955 -2.295 -3.468 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -8.411 -1.813 -4.209 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -8.486 -3.253 -3.166 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -10.561 -1.063 -1.288 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -9.367 -1.565 -0.069 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -9.361 0.104 -0.686 1.00 0.00 H new ATOM 145 N GLY A 9 -5.660 -0.713 -4.733 1.00 0.00 N ATOM 146 CA GLY A 9 -5.607 -0.793 -6.189 1.00 0.00 C ATOM 147 C GLY A 9 -4.428 -1.688 -6.575 1.00 0.00 C ATOM 148 O GLY A 9 -3.688 -2.124 -5.698 1.00 0.00 O ATOM 0 H GLY A 9 -4.964 -1.299 -4.272 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -6.538 -1.201 -6.582 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -5.487 0.201 -6.620 1.00 0.00 H new ATOM 152 N VAL A 10 -4.313 -1.971 -7.912 1.00 0.00 N ATOM 153 CA VAL A 10 -3.235 -2.818 -8.409 1.00 0.00 C ATOM 154 C VAL A 10 -3.409 -3.371 -9.848 1.00 0.00 C ATOM 155 O VAL A 10 -3.539 -2.624 -10.807 1.00 0.00 O ATOM 156 CB VAL A 10 -3.183 -4.055 -7.535 1.00 0.00 C ATOM 157 CG1 VAL A 10 -4.679 -4.647 -7.475 1.00 0.00 C ATOM 158 CG2 VAL A 10 -1.763 -4.689 -7.380 1.00 0.00 C ATOM 0 H VAL A 10 -4.949 -1.623 -8.630 1.00 0.00 H new ATOM 0 HA VAL A 10 -2.352 -2.179 -8.398 1.00 0.00 H new ATOM 0 HB VAL A 10 -3.049 -4.160 -6.458 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -4.691 -5.543 -6.854 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -5.349 -3.900 -7.048 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -5.011 -4.899 -8.482 1.00 0.00 H new ATOM 0 HG21 VAL A 10 -1.825 -5.568 -6.738 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -1.386 -4.981 -8.360 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -1.086 -3.961 -6.933 1.00 0.00 H new ATOM 168 N ILE A 11 -3.359 -4.748 -9.920 1.00 0.00 N ATOM 169 CA ILE A 11 -3.494 -5.409 -11.213 1.00 0.00 C ATOM 170 C ILE A 11 -3.693 -6.898 -10.901 1.00 0.00 C ATOM 171 O ILE A 11 -4.250 -7.255 -9.871 1.00 0.00 O ATOM 172 CB ILE A 11 -2.263 -5.134 -12.141 1.00 0.00 C ATOM 173 CG1 ILE A 11 -2.529 -5.019 -13.663 1.00 0.00 C ATOM 174 CG2 ILE A 11 -0.948 -5.534 -11.403 1.00 0.00 C ATOM 175 CD1 ILE A 11 -3.644 -4.047 -14.112 1.00 0.00 C ATOM 0 H ILE A 11 -3.231 -5.371 -9.122 1.00 0.00 H new ATOM 0 HA ILE A 11 -4.343 -5.022 -11.777 1.00 0.00 H new ATOM 0 HB ILE A 11 -1.938 -4.121 -12.377 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -1.601 -4.715 -14.147 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -2.774 -6.012 -14.039 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -0.094 -5.341 -12.052 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -0.850 -4.947 -10.490 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -0.980 -6.594 -11.151 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -3.725 -4.063 -15.199 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -4.593 -4.354 -13.673 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -3.401 -3.037 -13.782 1.00 0.00 H new ATOM 187 N GLY A 12 -3.225 -7.745 -11.851 1.00 0.00 N ATOM 188 CA GLY A 12 -3.362 -9.172 -11.639 1.00 0.00 C ATOM 189 C GLY A 12 -2.886 -9.937 -12.866 1.00 0.00 C ATOM 190 O GLY A 12 -1.922 -9.575 -13.530 1.00 0.00 O ATOM 0 H GLY A 12 -2.774 -7.466 -12.723 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -2.783 -9.474 -10.766 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -4.403 -9.417 -11.431 1.00 0.00 H new ATOM 194 N SER A 13 -3.652 -11.016 -13.111 1.00 0.00 N ATOM 195 CA SER A 13 -3.367 -11.906 -14.213 1.00 0.00 C ATOM 196 C SER A 13 -4.629 -12.753 -14.362 1.00 0.00 C ATOM 197 O SER A 13 -5.303 -12.729 -15.385 1.00 0.00 O ATOM 198 CB SER A 13 -2.116 -12.764 -13.848 1.00 0.00 C ATOM 199 OG SER A 13 -2.039 -14.190 -14.244 1.00 0.00 O ATOM 0 H SER A 13 -4.466 -11.278 -12.554 1.00 0.00 H new ATOM 0 HA SER A 13 -3.136 -11.397 -15.149 1.00 0.00 H new ATOM 0 HB2 SER A 13 -1.247 -12.264 -14.276 1.00 0.00 H new ATOM 0 HB3 SER A 13 -2.004 -12.725 -12.764 1.00 0.00 H new ATOM 0 HG SER A 13 -1.189 -14.570 -13.936 1.00 0.00 H new ATOM 205 N ASP A 14 -4.904 -13.490 -13.264 1.00 0.00 N ATOM 206 CA ASP A 14 -6.045 -14.378 -13.193 1.00 0.00 C ATOM 207 C ASP A 14 -7.271 -13.508 -12.885 1.00 0.00 C ATOM 208 O ASP A 14 -7.154 -12.454 -12.270 1.00 0.00 O ATOM 209 CB ASP A 14 -5.815 -15.466 -12.120 1.00 0.00 C ATOM 210 CG ASP A 14 -5.740 -14.895 -10.686 1.00 0.00 C ATOM 211 OD1 ASP A 14 -4.777 -14.195 -10.374 1.00 0.00 O ATOM 212 OD2 ASP A 14 -6.650 -15.154 -9.899 1.00 0.00 O ATOM 0 H ASP A 14 -4.336 -13.474 -12.417 1.00 0.00 H new ATOM 0 HA ASP A 14 -6.199 -14.907 -14.133 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -6.622 -16.196 -12.172 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -4.890 -15.997 -12.342 1.00 0.00 H new ATOM 217 N CYS A 15 -8.444 -14.012 -13.360 1.00 0.00 N ATOM 218 CA CYS A 15 -9.709 -13.329 -13.124 1.00 0.00 C ATOM 219 C CYS A 15 -9.685 -12.030 -13.943 1.00 0.00 C ATOM 220 O CYS A 15 -9.764 -12.082 -15.165 1.00 0.00 O ATOM 221 CB CYS A 15 -10.025 -13.158 -11.621 1.00 0.00 C ATOM 222 SG CYS A 15 -11.653 -12.427 -11.310 1.00 0.00 S ATOM 0 H CYS A 15 -8.521 -14.875 -13.898 1.00 0.00 H new ATOM 0 HA CYS A 15 -10.550 -13.932 -13.467 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -9.972 -14.131 -11.133 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -9.259 -12.530 -11.165 1.00 0.00 H new ATOM 0 HG CYS A 15 -11.843 -12.319 -10.028 1.00 0.00 H new ATOM 228 N HIS A 16 -9.573 -10.872 -13.236 1.00 0.00 N ATOM 229 CA HIS A 16 -9.579 -9.628 -13.991 1.00 0.00 C ATOM 230 C HIS A 16 -9.043 -8.551 -13.048 1.00 0.00 C ATOM 231 O HIS A 16 -9.575 -7.450 -12.974 1.00 0.00 O ATOM 232 CB HIS A 16 -11.015 -9.319 -14.484 1.00 0.00 C ATOM 233 CG HIS A 16 -11.020 -8.191 -15.492 1.00 0.00 C ATOM 234 ND1 HIS A 16 -10.502 -8.292 -16.735 1.00 0.00 N ATOM 235 CD2 HIS A 16 -11.542 -6.896 -15.334 1.00 0.00 C ATOM 236 CE1 HIS A 16 -10.703 -7.096 -17.314 1.00 0.00 C ATOM 237 NE2 HIS A 16 -11.329 -6.233 -16.492 1.00 0.00 N ATOM 0 H HIS A 16 -9.485 -10.790 -12.223 1.00 0.00 H new ATOM 0 HA HIS A 16 -8.955 -9.682 -14.883 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -11.448 -10.213 -14.933 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -11.644 -9.053 -13.634 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -12.024 -6.503 -14.451 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -10.398 -6.855 -18.322 1.00 0.00 H new ATOM 0 HE2 HIS A 16 -11.591 -5.270 -16.702 1.00 0.00 H new ATOM 245 N ALA A 17 -7.965 -8.937 -12.322 1.00 0.00 N ATOM 246 CA ALA A 17 -7.313 -8.043 -11.383 1.00 0.00 C ATOM 247 C ALA A 17 -8.343 -7.637 -10.320 1.00 0.00 C ATOM 248 O ALA A 17 -8.417 -6.471 -9.949 1.00 0.00 O ATOM 249 CB ALA A 17 -6.705 -6.819 -12.098 1.00 0.00 C ATOM 0 H ALA A 17 -7.543 -9.864 -12.381 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.477 -8.552 -10.902 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -6.225 -6.171 -11.365 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -5.966 -7.153 -12.826 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -7.494 -6.267 -12.609 1.00 0.00 H new ATOM 255 N VAL A 18 -9.136 -8.644 -9.867 1.00 0.00 N ATOM 256 CA VAL A 18 -10.128 -8.363 -8.830 1.00 0.00 C ATOM 257 C VAL A 18 -9.450 -7.812 -7.546 1.00 0.00 C ATOM 258 O VAL A 18 -8.776 -8.521 -6.809 1.00 0.00 O ATOM 259 CB VAL A 18 -10.975 -9.630 -8.476 1.00 0.00 C ATOM 260 CG1 VAL A 18 -10.077 -10.906 -8.392 1.00 0.00 C ATOM 261 CG2 VAL A 18 -12.361 -9.511 -7.797 1.00 0.00 C ATOM 0 H VAL A 18 -9.103 -9.610 -10.193 1.00 0.00 H new ATOM 0 HA VAL A 18 -10.800 -7.605 -9.233 1.00 0.00 H new ATOM 0 HB VAL A 18 -11.657 -9.846 -9.298 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -10.694 -11.770 -8.144 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -9.590 -11.072 -9.353 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -9.320 -10.768 -7.620 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -12.776 -10.507 -7.641 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -12.253 -9.008 -6.836 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -13.031 -8.935 -8.435 1.00 0.00 H new ATOM 271 N GLY A 19 -9.679 -6.492 -7.360 1.00 0.00 N ATOM 272 CA GLY A 19 -9.180 -5.724 -6.218 1.00 0.00 C ATOM 273 C GLY A 19 -10.278 -5.591 -5.149 1.00 0.00 C ATOM 274 O GLY A 19 -10.028 -5.390 -3.958 1.00 0.00 O ATOM 0 H GLY A 19 -10.225 -5.931 -8.014 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -8.306 -6.217 -5.793 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -8.860 -4.735 -6.547 1.00 0.00 H new ATOM 278 N ASN A 20 -11.523 -5.763 -5.682 1.00 0.00 N ATOM 279 CA ASN A 20 -12.783 -5.724 -4.942 1.00 0.00 C ATOM 280 C ASN A 20 -12.512 -6.498 -3.660 1.00 0.00 C ATOM 281 O ASN A 20 -12.696 -5.970 -2.574 1.00 0.00 O ATOM 282 CB ASN A 20 -13.935 -6.317 -5.774 1.00 0.00 C ATOM 283 CG ASN A 20 -14.166 -5.491 -7.050 1.00 0.00 C ATOM 284 OD1 ASN A 20 -14.176 -4.266 -7.030 1.00 0.00 O ATOM 285 ND2 ASN A 20 -14.344 -6.239 -8.153 1.00 0.00 N ATOM 0 H ASN A 20 -11.662 -5.938 -6.677 1.00 0.00 H new ATOM 0 HA ASN A 20 -13.105 -4.707 -4.716 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -13.705 -7.349 -6.040 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -14.847 -6.337 -5.178 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -14.501 -5.789 -9.055 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -14.322 -7.257 -8.088 1.00 0.00 H new ATOM 292 N LYS A 21 -11.984 -7.728 -3.964 1.00 0.00 N ATOM 293 CA LYS A 21 -11.435 -8.915 -3.293 1.00 0.00 C ATOM 294 C LYS A 21 -11.218 -8.568 -1.840 1.00 0.00 C ATOM 295 O LYS A 21 -10.152 -8.650 -1.242 1.00 0.00 O ATOM 296 CB LYS A 21 -10.131 -9.276 -4.032 1.00 0.00 C ATOM 297 CG LYS A 21 -9.389 -10.531 -3.543 1.00 0.00 C ATOM 298 CD LYS A 21 -8.166 -10.798 -4.429 1.00 0.00 C ATOM 299 CE LYS A 21 -7.331 -11.987 -3.961 1.00 0.00 C ATOM 300 NZ LYS A 21 -6.212 -12.257 -4.855 1.00 0.00 N ATOM 0 H LYS A 21 -11.936 -7.931 -4.963 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.098 -9.780 -3.322 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.363 -9.407 -5.089 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -9.451 -8.427 -3.958 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -9.076 -10.398 -2.508 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -10.059 -11.391 -3.565 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -8.499 -10.976 -5.452 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -7.538 -9.907 -4.449 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -6.954 -11.792 -2.957 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -7.965 -12.872 -3.897 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -5.785 -13.173 -4.610 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -6.552 -12.285 -5.838 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -5.500 -11.506 -4.756 1.00 0.00 H new ATOM 313 N ILE A 22 -12.394 -8.167 -1.365 1.00 0.00 N ATOM 314 CA ILE A 22 -12.816 -7.691 -0.104 1.00 0.00 C ATOM 315 C ILE A 22 -11.653 -6.971 0.587 1.00 0.00 C ATOM 316 O ILE A 22 -11.411 -7.098 1.779 1.00 0.00 O ATOM 317 CB ILE A 22 -13.571 -8.860 0.553 1.00 0.00 C ATOM 318 CG1 ILE A 22 -12.780 -10.121 0.951 1.00 0.00 C ATOM 319 CG2 ILE A 22 -15.096 -8.731 0.221 1.00 0.00 C ATOM 320 CD1 ILE A 22 -12.635 -11.082 -0.245 1.00 0.00 C ATOM 0 H ILE A 22 -13.195 -8.184 -1.996 1.00 0.00 H new ATOM 0 HA ILE A 22 -13.547 -6.883 -0.085 1.00 0.00 H new ATOM 0 HB ILE A 22 -13.657 -8.927 1.638 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -11.793 -9.836 1.315 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -13.287 -10.629 1.771 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -15.640 -9.555 0.682 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -15.474 -7.785 0.608 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -15.237 -8.763 -0.859 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -12.073 -11.964 0.063 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -13.624 -11.384 -0.591 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -12.106 -10.579 -1.054 1.00 0.00 H new ATOM 332 N LEU A 23 -10.967 -6.174 -0.274 1.00 0.00 N ATOM 333 CA LEU A 23 -9.874 -5.344 0.185 1.00 0.00 C ATOM 334 C LEU A 23 -10.578 -4.096 0.728 1.00 0.00 C ATOM 335 O LEU A 23 -10.183 -3.509 1.725 1.00 0.00 O ATOM 336 CB LEU A 23 -8.938 -5.052 -0.994 1.00 0.00 C ATOM 337 CG LEU A 23 -7.442 -4.963 -0.601 1.00 0.00 C ATOM 338 CD1 LEU A 23 -7.222 -3.876 0.486 1.00 0.00 C ATOM 339 CD2 LEU A 23 -6.429 -6.048 -1.045 1.00 0.00 C ATOM 0 H LEU A 23 -11.165 -6.104 -1.272 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.242 -5.795 0.950 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -9.061 -5.833 -1.744 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -9.238 -4.113 -1.459 1.00 0.00 H new ATOM 0 HG LEU A 23 -6.671 -4.701 -1.325 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -6.165 -3.831 0.747 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -7.543 -2.908 0.102 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -7.804 -4.126 1.373 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -5.438 -5.798 -0.666 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -6.735 -7.016 -0.648 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -6.400 -6.095 -2.134 1.00 0.00 H new ATOM 351 N ASP A 24 -11.682 -3.745 0.026 1.00 0.00 N ATOM 352 CA ASP A 24 -12.498 -2.628 0.449 1.00 0.00 C ATOM 353 C ASP A 24 -13.341 -3.117 1.645 1.00 0.00 C ATOM 354 O ASP A 24 -14.083 -2.348 2.236 1.00 0.00 O ATOM 355 CB ASP A 24 -13.356 -2.095 -0.718 1.00 0.00 C ATOM 356 CG ASP A 24 -14.127 -3.198 -1.474 1.00 0.00 C ATOM 357 OD1 ASP A 24 -14.882 -3.939 -0.845 1.00 0.00 O ATOM 358 OD2 ASP A 24 -13.966 -3.299 -2.690 1.00 0.00 O ATOM 0 H ASP A 24 -12.007 -4.220 -0.816 1.00 0.00 H new ATOM 0 HA ASP A 24 -11.886 -1.782 0.760 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -14.068 -1.366 -0.331 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -12.711 -1.568 -1.421 1.00 0.00 H new ATOM 363 N HIS A 25 -13.210 -4.417 1.996 1.00 0.00 N ATOM 364 CA HIS A 25 -13.975 -4.897 3.135 1.00 0.00 C ATOM 365 C HIS A 25 -13.247 -4.403 4.388 1.00 0.00 C ATOM 366 O HIS A 25 -13.859 -4.049 5.384 1.00 0.00 O ATOM 367 CB HIS A 25 -14.113 -6.427 3.133 1.00 0.00 C ATOM 368 CG HIS A 25 -15.097 -6.907 4.181 1.00 0.00 C ATOM 369 ND1 HIS A 25 -15.020 -8.126 4.757 1.00 0.00 N ATOM 370 CD2 HIS A 25 -16.207 -6.234 4.724 1.00 0.00 C ATOM 371 CE1 HIS A 25 -16.047 -8.191 5.621 1.00 0.00 C ATOM 372 NE2 HIS A 25 -16.781 -7.064 5.623 1.00 0.00 N ATOM 0 H HIS A 25 -12.617 -5.104 1.531 1.00 0.00 H new ATOM 0 HA HIS A 25 -14.995 -4.513 3.098 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -14.440 -6.761 2.148 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -13.138 -6.880 3.316 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -16.539 -5.238 4.469 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -16.259 -9.049 6.242 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -17.607 -6.874 6.190 1.00 0.00 H new ATOM 380 N SER A 26 -11.906 -4.384 4.237 1.00 0.00 N ATOM 381 CA SER A 26 -10.965 -3.994 5.272 1.00 0.00 C ATOM 382 C SER A 26 -11.256 -2.586 5.783 1.00 0.00 C ATOM 383 O SER A 26 -11.238 -2.329 6.984 1.00 0.00 O ATOM 384 CB SER A 26 -9.500 -4.089 4.785 1.00 0.00 C ATOM 385 OG SER A 26 -8.947 -3.065 3.867 1.00 0.00 O ATOM 0 H SER A 26 -11.450 -4.649 3.364 1.00 0.00 H new ATOM 0 HA SER A 26 -11.094 -4.698 6.094 1.00 0.00 H new ATOM 0 HB2 SER A 26 -8.866 -4.103 5.672 1.00 0.00 H new ATOM 0 HB3 SER A 26 -9.385 -5.056 4.296 1.00 0.00 H new ATOM 0 HG SER A 26 -9.192 -3.286 2.944 1.00 0.00 H new ATOM 391 N PHE A 27 -11.531 -1.697 4.804 1.00 0.00 N ATOM 392 CA PHE A 27 -11.795 -0.294 5.144 1.00 0.00 C ATOM 393 C PHE A 27 -12.940 -0.236 6.166 1.00 0.00 C ATOM 394 O PHE A 27 -12.899 0.473 7.161 1.00 0.00 O ATOM 395 CB PHE A 27 -12.005 0.656 3.922 1.00 0.00 C ATOM 396 CG PHE A 27 -13.421 0.833 3.404 1.00 0.00 C ATOM 397 CD1 PHE A 27 -14.410 1.453 4.168 1.00 0.00 C ATOM 398 CD2 PHE A 27 -13.768 0.380 2.138 1.00 0.00 C ATOM 399 CE1 PHE A 27 -15.712 1.574 3.705 1.00 0.00 C ATOM 400 CE2 PHE A 27 -15.072 0.496 1.667 1.00 0.00 C ATOM 401 CZ PHE A 27 -16.047 1.092 2.450 1.00 0.00 C ATOM 0 H PHE A 27 -11.574 -1.919 3.809 1.00 0.00 H new ATOM 0 HA PHE A 27 -10.888 0.108 5.596 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -11.621 1.640 4.191 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -11.390 0.288 3.101 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.156 1.847 5.141 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -13.014 -0.069 1.509 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -16.464 2.043 4.322 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -15.325 0.120 0.687 1.00 0.00 H new ATOM 0 HZ PHE A 27 -17.060 1.180 2.085 1.00 0.00 H new ATOM 411 N THR A 28 -13.939 -1.061 5.832 1.00 0.00 N ATOM 412 CA THR A 28 -15.186 -1.184 6.558 1.00 0.00 C ATOM 413 C THR A 28 -15.021 -1.890 7.900 1.00 0.00 C ATOM 414 O THR A 28 -15.772 -1.678 8.845 1.00 0.00 O ATOM 415 CB THR A 28 -16.164 -1.907 5.578 1.00 0.00 C ATOM 416 OG1 THR A 28 -15.816 -1.954 4.152 1.00 0.00 O ATOM 417 CG2 THR A 28 -17.614 -1.421 5.787 1.00 0.00 C ATOM 0 H THR A 28 -13.889 -1.677 5.021 1.00 0.00 H new ATOM 0 HA THR A 28 -15.583 -0.211 6.846 1.00 0.00 H new ATOM 0 HB THR A 28 -16.057 -2.952 5.870 1.00 0.00 H new ATOM 0 HG1 THR A 28 -15.119 -2.628 4.007 1.00 0.00 H new ATOM 0 HG21 THR A 28 -18.275 -1.940 5.093 1.00 0.00 H new ATOM 0 HG22 THR A 28 -17.925 -1.632 6.810 1.00 0.00 H new ATOM 0 HG23 THR A 28 -17.668 -0.347 5.606 1.00 0.00 H new ATOM 425 N ASN A 29 -13.997 -2.727 7.899 1.00 0.00 N ATOM 426 CA ASN A 29 -13.603 -3.572 8.992 1.00 0.00 C ATOM 427 C ASN A 29 -12.842 -2.744 10.015 1.00 0.00 C ATOM 428 O ASN A 29 -12.431 -3.291 11.032 1.00 0.00 O ATOM 429 CB ASN A 29 -12.792 -4.815 8.567 1.00 0.00 C ATOM 430 CG ASN A 29 -13.613 -5.778 7.695 1.00 0.00 C ATOM 431 OD1 ASN A 29 -14.833 -5.846 7.776 1.00 0.00 O ATOM 432 ND2 ASN A 29 -12.857 -6.510 6.859 1.00 0.00 N ATOM 0 H ASN A 29 -13.391 -2.834 7.086 1.00 0.00 H new ATOM 0 HA ASN A 29 -14.517 -3.970 9.433 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -11.906 -4.497 8.018 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -12.444 -5.341 9.456 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -13.297 -7.182 6.230 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -11.844 -6.393 6.853 1.00 0.00 H new ATOM 439 N ALA A 30 -12.661 -1.429 9.740 1.00 0.00 N ATOM 440 CA ALA A 30 -11.979 -0.615 10.705 1.00 0.00 C ATOM 441 C ALA A 30 -12.702 0.731 10.780 1.00 0.00 C ATOM 442 O ALA A 30 -12.213 1.655 11.420 1.00 0.00 O ATOM 443 CB ALA A 30 -10.492 -0.517 10.377 1.00 0.00 C ATOM 0 H ALA A 30 -12.970 -0.952 8.893 1.00 0.00 H new ATOM 0 HA ALA A 30 -12.011 -1.062 11.699 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -9.995 0.105 11.122 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -10.051 -1.514 10.384 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -10.366 -0.072 9.390 1.00 0.00 H new ATOM 449 N GLY A 31 -13.884 0.803 10.116 1.00 0.00 N ATOM 450 CA GLY A 31 -14.683 2.020 10.111 1.00 0.00 C ATOM 451 C GLY A 31 -13.897 3.240 9.614 1.00 0.00 C ATOM 452 O GLY A 31 -14.116 4.360 10.059 1.00 0.00 O ATOM 0 H GLY A 31 -14.288 0.031 9.586 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -15.558 1.873 9.477 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.049 2.214 11.119 1.00 0.00 H new ATOM 456 N PHE A 32 -12.984 2.942 8.660 1.00 0.00 N ATOM 457 CA PHE A 32 -12.154 4.013 8.110 1.00 0.00 C ATOM 458 C PHE A 32 -12.787 4.414 6.773 1.00 0.00 C ATOM 459 O PHE A 32 -13.814 3.897 6.352 1.00 0.00 O ATOM 460 CB PHE A 32 -10.692 3.549 7.938 1.00 0.00 C ATOM 461 CG PHE A 32 -9.926 3.338 9.223 1.00 0.00 C ATOM 462 CD1 PHE A 32 -10.087 4.166 10.335 1.00 0.00 C ATOM 463 CD2 PHE A 32 -9.000 2.303 9.299 1.00 0.00 C ATOM 464 CE1 PHE A 32 -9.344 3.961 11.490 1.00 0.00 C ATOM 465 CE2 PHE A 32 -8.258 2.095 10.452 1.00 0.00 C ATOM 466 CZ PHE A 32 -8.427 2.924 11.550 1.00 0.00 C ATOM 0 H PHE A 32 -12.815 2.012 8.277 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.117 4.869 8.784 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -10.688 2.616 7.375 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -10.162 4.287 7.336 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -10.799 4.977 10.297 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -8.857 1.653 8.449 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -9.481 4.610 12.342 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -7.546 1.284 10.495 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.847 2.763 12.447 1.00 0.00 H new ATOM 476 N ASN A 33 -12.095 5.401 6.154 1.00 0.00 N ATOM 477 CA ASN A 33 -12.498 5.985 4.892 1.00 0.00 C ATOM 478 C ASN A 33 -12.117 4.985 3.798 1.00 0.00 C ATOM 479 O ASN A 33 -11.105 4.296 3.849 1.00 0.00 O ATOM 480 CB ASN A 33 -11.791 7.343 4.708 1.00 0.00 C ATOM 481 CG ASN A 33 -12.200 8.044 3.403 1.00 0.00 C ATOM 482 OD1 ASN A 33 -11.488 8.016 2.408 1.00 0.00 O ATOM 483 ND2 ASN A 33 -13.388 8.669 3.483 1.00 0.00 N ATOM 0 H ASN A 33 -11.239 5.803 6.535 1.00 0.00 H new ATOM 0 HA ASN A 33 -13.570 6.177 4.851 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -12.026 7.989 5.554 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -10.712 7.191 4.713 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -13.757 9.168 2.674 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -13.920 8.644 4.353 1.00 0.00 H new ATOM 490 N VAL A 34 -13.031 4.992 2.808 1.00 0.00 N ATOM 491 CA VAL A 34 -12.940 4.154 1.625 1.00 0.00 C ATOM 492 C VAL A 34 -12.388 5.019 0.491 1.00 0.00 C ATOM 493 O VAL A 34 -12.892 6.092 0.180 1.00 0.00 O ATOM 494 CB VAL A 34 -14.316 3.556 1.205 1.00 0.00 C ATOM 495 CG1 VAL A 34 -15.496 4.445 1.780 1.00 0.00 C ATOM 496 CG2 VAL A 34 -14.069 2.786 -0.161 1.00 0.00 C ATOM 0 H VAL A 34 -13.857 5.590 2.820 1.00 0.00 H new ATOM 0 HA VAL A 34 -12.288 3.308 1.844 1.00 0.00 H new ATOM 0 HB VAL A 34 -14.859 2.709 1.626 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -16.453 4.018 1.480 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -15.435 4.471 2.868 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -15.412 5.458 1.388 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -15.005 2.344 -0.504 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -13.701 3.486 -0.912 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -13.331 1.999 -0.007 1.00 0.00 H new ATOM 506 N VAL A 35 -11.318 4.449 -0.089 1.00 0.00 N ATOM 507 CA VAL A 35 -10.644 5.037 -1.229 1.00 0.00 C ATOM 508 C VAL A 35 -10.288 3.862 -2.149 1.00 0.00 C ATOM 509 O VAL A 35 -9.731 2.855 -1.727 1.00 0.00 O ATOM 510 CB VAL A 35 -9.408 5.881 -0.787 1.00 0.00 C ATOM 511 CG1 VAL A 35 -8.941 6.769 -1.977 1.00 0.00 C ATOM 512 CG2 VAL A 35 -9.041 6.305 0.651 1.00 0.00 C ATOM 0 H VAL A 35 -10.907 3.571 0.228 1.00 0.00 H new ATOM 0 HA VAL A 35 -11.275 5.749 -1.760 1.00 0.00 H new ATOM 0 HB VAL A 35 -8.737 5.078 -0.481 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -8.078 7.361 -1.673 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -8.667 6.134 -2.819 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -9.751 7.435 -2.273 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -8.120 6.888 0.635 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -9.846 6.910 1.069 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -8.897 5.417 1.267 1.00 0.00 H new ATOM 522 N ASN A 36 -10.684 4.035 -3.421 1.00 0.00 N ATOM 523 CA ASN A 36 -10.413 2.997 -4.406 1.00 0.00 C ATOM 524 C ASN A 36 -10.118 3.751 -5.691 1.00 0.00 C ATOM 525 O ASN A 36 -10.836 4.659 -6.093 1.00 0.00 O ATOM 526 CB ASN A 36 -11.624 2.061 -4.600 1.00 0.00 C ATOM 527 CG ASN A 36 -11.795 1.079 -3.430 1.00 0.00 C ATOM 528 OD1 ASN A 36 -12.226 1.436 -2.340 1.00 0.00 O ATOM 529 ND2 ASN A 36 -11.440 -0.181 -3.739 1.00 0.00 N ATOM 0 H ASN A 36 -11.175 4.856 -3.775 1.00 0.00 H new ATOM 0 HA ASN A 36 -9.588 2.357 -4.092 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -12.529 2.659 -4.705 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -11.503 1.501 -5.527 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -11.522 -0.920 -3.040 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -11.089 -0.398 -4.672 1.00 0.00 H new ATOM 536 N ILE A 37 -9.004 3.291 -6.299 1.00 0.00 N ATOM 537 CA ILE A 37 -8.540 3.861 -7.552 1.00 0.00 C ATOM 538 C ILE A 37 -9.082 2.924 -8.635 1.00 0.00 C ATOM 539 O ILE A 37 -10.162 3.131 -9.175 1.00 0.00 O ATOM 540 CB ILE A 37 -6.993 4.002 -7.622 1.00 0.00 C ATOM 541 CG1 ILE A 37 -6.577 5.411 -8.207 1.00 0.00 C ATOM 542 CG2 ILE A 37 -6.300 3.061 -6.559 1.00 0.00 C ATOM 543 CD1 ILE A 37 -5.103 5.487 -8.616 1.00 0.00 C ATOM 0 H ILE A 37 -8.424 2.534 -5.936 1.00 0.00 H new ATOM 0 HA ILE A 37 -8.899 4.883 -7.675 1.00 0.00 H new ATOM 0 HB ILE A 37 -6.353 3.555 -8.382 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -7.199 5.635 -9.074 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -6.780 6.180 -7.462 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -5.218 3.174 -6.624 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -6.634 3.335 -5.558 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -6.569 2.024 -6.761 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -4.885 6.480 -9.009 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -4.474 5.294 -7.747 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -4.899 4.741 -9.384 1.00 0.00 H new ATOM 555 N GLY A 38 -8.264 1.888 -8.914 1.00 0.00 N ATOM 556 CA GLY A 38 -8.618 0.896 -9.914 1.00 0.00 C ATOM 557 C GLY A 38 -7.403 0.006 -10.179 1.00 0.00 C ATOM 558 O GLY A 38 -6.687 -0.388 -9.266 1.00 0.00 O ATOM 0 H GLY A 38 -7.365 1.729 -8.458 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -9.458 0.294 -9.567 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -8.935 1.385 -10.835 1.00 0.00 H new ATOM 562 N VAL A 39 -7.220 -0.269 -11.490 1.00 0.00 N ATOM 563 CA VAL A 39 -6.107 -1.094 -11.945 1.00 0.00 C ATOM 564 C VAL A 39 -4.891 -0.217 -12.310 1.00 0.00 C ATOM 565 O VAL A 39 -3.870 -0.727 -12.757 1.00 0.00 O ATOM 566 CB VAL A 39 -6.573 -1.966 -13.156 1.00 0.00 C ATOM 567 CG1 VAL A 39 -7.348 -3.203 -12.603 1.00 0.00 C ATOM 568 CG2 VAL A 39 -6.755 -1.400 -14.587 1.00 0.00 C ATOM 0 H VAL A 39 -7.828 0.070 -12.235 1.00 0.00 H new ATOM 0 HA VAL A 39 -5.792 -1.758 -11.140 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.710 -2.323 -13.718 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.682 -3.824 -13.434 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -6.691 -3.784 -11.956 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.213 -2.865 -12.032 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -7.085 -2.196 -15.254 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -7.502 -0.607 -14.572 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -5.806 -0.998 -14.943 1.00 0.00 H new ATOM 578 N LEU A 40 -5.045 1.114 -12.105 1.00 0.00 N ATOM 579 CA LEU A 40 -3.953 2.036 -12.381 1.00 0.00 C ATOM 580 C LEU A 40 -3.163 2.047 -11.077 1.00 0.00 C ATOM 581 O LEU A 40 -3.509 2.737 -10.125 1.00 0.00 O ATOM 582 CB LEU A 40 -4.469 3.443 -12.727 1.00 0.00 C ATOM 583 CG LEU A 40 -5.335 3.480 -14.025 1.00 0.00 C ATOM 584 CD1 LEU A 40 -5.898 4.922 -14.193 1.00 0.00 C ATOM 585 CD2 LEU A 40 -5.173 2.495 -15.206 1.00 0.00 C ATOM 0 H LEU A 40 -5.899 1.550 -11.758 1.00 0.00 H new ATOM 0 HA LEU A 40 -3.357 1.733 -13.242 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -5.060 3.821 -11.893 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -3.619 4.115 -12.846 1.00 0.00 H new ATOM 0 HG LEU A 40 -6.145 2.759 -13.916 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -6.508 4.972 -15.095 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -6.510 5.177 -13.327 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -5.072 5.628 -14.274 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -5.897 2.737 -15.984 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -4.164 2.576 -15.611 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -5.343 1.477 -14.856 1.00 0.00 H new ATOM 597 N SER A 41 -2.085 1.232 -11.103 1.00 0.00 N ATOM 598 CA SER A 41 -1.233 1.094 -9.936 1.00 0.00 C ATOM 599 C SER A 41 -0.044 2.023 -10.159 1.00 0.00 C ATOM 600 O SER A 41 1.106 1.610 -10.132 1.00 0.00 O ATOM 601 CB SER A 41 -0.761 -0.388 -9.812 1.00 0.00 C ATOM 602 OG SER A 41 0.128 -0.834 -8.707 1.00 0.00 O ATOM 0 H SER A 41 -1.801 0.676 -11.910 1.00 0.00 H new ATOM 0 HA SER A 41 -1.756 1.354 -9.016 1.00 0.00 H new ATOM 0 HB2 SER A 41 -1.660 -1.003 -9.762 1.00 0.00 H new ATOM 0 HB3 SER A 41 -0.255 -0.638 -10.745 1.00 0.00 H new ATOM 0 HG SER A 41 0.890 -0.222 -8.632 1.00 0.00 H new ATOM 608 N SER A 42 -0.398 3.299 -10.399 1.00 0.00 N ATOM 609 CA SER A 42 0.584 4.345 -10.594 1.00 0.00 C ATOM 610 C SER A 42 0.803 4.861 -9.173 1.00 0.00 C ATOM 611 O SER A 42 0.164 5.807 -8.740 1.00 0.00 O ATOM 612 CB SER A 42 -0.048 5.415 -11.523 1.00 0.00 C ATOM 613 OG SER A 42 -1.370 5.992 -11.172 1.00 0.00 O ATOM 0 H SER A 42 -1.365 3.617 -10.460 1.00 0.00 H new ATOM 0 HA SER A 42 1.522 4.041 -11.058 1.00 0.00 H new ATOM 0 HB2 SER A 42 0.660 6.240 -11.601 1.00 0.00 H new ATOM 0 HB3 SER A 42 -0.136 4.976 -12.517 1.00 0.00 H new ATOM 0 HG SER A 42 -1.411 6.153 -10.206 1.00 0.00 H new ATOM 619 N GLN A 43 1.738 4.171 -8.486 1.00 0.00 N ATOM 620 CA GLN A 43 2.049 4.444 -7.094 1.00 0.00 C ATOM 621 C GLN A 43 2.693 5.826 -6.959 1.00 0.00 C ATOM 622 O GLN A 43 2.312 6.595 -6.087 1.00 0.00 O ATOM 623 CB GLN A 43 2.981 3.345 -6.547 1.00 0.00 C ATOM 624 CG GLN A 43 3.294 3.464 -5.047 1.00 0.00 C ATOM 625 CD GLN A 43 2.042 3.194 -4.203 1.00 0.00 C ATOM 626 OE1 GLN A 43 1.942 1.909 -3.822 1.00 0.00 O flip ATOM 627 NE2 GLN A 43 1.247 4.081 -3.916 1.00 0.00 N flip ATOM 0 H GLN A 43 2.289 3.414 -8.892 1.00 0.00 H new ATOM 0 HA GLN A 43 1.129 4.442 -6.509 1.00 0.00 H new ATOM 0 HB2 GLN A 43 2.525 2.373 -6.734 1.00 0.00 H new ATOM 0 HB3 GLN A 43 3.918 3.370 -7.104 1.00 0.00 H new ATOM 0 HG2 GLN A 43 4.078 2.756 -4.778 1.00 0.00 H new ATOM 0 HG3 GLN A 43 3.676 4.461 -4.829 1.00 0.00 H new ATOM 0 HE21 GLN A 43 1.402 5.032 -4.250 1.00 0.00 H new ATOM 0 HE22 GLN A 43 0.430 3.868 -3.343 1.00 0.00 H new ATOM 636 N GLU A 44 3.674 6.102 -7.848 1.00 0.00 N ATOM 637 CA GLU A 44 4.413 7.358 -7.804 1.00 0.00 C ATOM 638 C GLU A 44 3.462 8.527 -8.107 1.00 0.00 C ATOM 639 O GLU A 44 3.567 9.587 -7.503 1.00 0.00 O ATOM 640 CB GLU A 44 5.653 7.282 -8.722 1.00 0.00 C ATOM 641 CG GLU A 44 5.356 7.138 -10.231 1.00 0.00 C ATOM 642 CD GLU A 44 5.280 8.475 -11.004 1.00 0.00 C ATOM 643 OE1 GLU A 44 5.170 9.535 -10.387 1.00 0.00 O ATOM 644 OE2 GLU A 44 5.340 8.437 -12.232 1.00 0.00 O ATOM 0 H GLU A 44 3.961 5.469 -8.595 1.00 0.00 H new ATOM 0 HA GLU A 44 4.806 7.541 -6.804 1.00 0.00 H new ATOM 0 HB2 GLU A 44 6.250 8.181 -8.571 1.00 0.00 H new ATOM 0 HB3 GLU A 44 6.265 6.436 -8.408 1.00 0.00 H new ATOM 0 HG2 GLU A 44 6.129 6.516 -10.682 1.00 0.00 H new ATOM 0 HG3 GLU A 44 4.411 6.609 -10.353 1.00 0.00 H new ATOM 651 N ASP A 45 2.519 8.293 -9.047 1.00 0.00 N ATOM 652 CA ASP A 45 1.580 9.354 -9.388 1.00 0.00 C ATOM 653 C ASP A 45 0.526 9.415 -8.281 1.00 0.00 C ATOM 654 O ASP A 45 -0.125 10.439 -8.114 1.00 0.00 O ATOM 655 CB ASP A 45 0.931 9.111 -10.762 1.00 0.00 C ATOM 656 CG ASP A 45 1.982 9.130 -11.886 1.00 0.00 C ATOM 657 OD1 ASP A 45 2.471 10.210 -12.216 1.00 0.00 O ATOM 658 OD2 ASP A 45 2.301 8.068 -12.420 1.00 0.00 O ATOM 0 H ASP A 45 2.399 7.417 -9.556 1.00 0.00 H new ATOM 0 HA ASP A 45 2.105 10.306 -9.461 1.00 0.00 H new ATOM 0 HB2 ASP A 45 0.416 8.150 -10.759 1.00 0.00 H new ATOM 0 HB3 ASP A 45 0.178 9.876 -10.952 1.00 0.00 H new ATOM 663 N PHE A 46 0.390 8.294 -7.526 1.00 0.00 N ATOM 664 CA PHE A 46 -0.577 8.281 -6.447 1.00 0.00 C ATOM 665 C PHE A 46 0.102 8.871 -5.202 1.00 0.00 C ATOM 666 O PHE A 46 -0.535 9.005 -4.170 1.00 0.00 O ATOM 667 CB PHE A 46 -1.234 6.908 -6.187 1.00 0.00 C ATOM 668 CG PHE A 46 -2.552 7.117 -5.490 1.00 0.00 C ATOM 669 CD1 PHE A 46 -3.678 7.447 -6.238 1.00 0.00 C ATOM 670 CD2 PHE A 46 -2.656 7.058 -4.105 1.00 0.00 C ATOM 671 CE1 PHE A 46 -4.881 7.750 -5.616 1.00 0.00 C ATOM 672 CE2 PHE A 46 -3.855 7.369 -3.482 1.00 0.00 C ATOM 673 CZ PHE A 46 -4.965 7.720 -4.234 1.00 0.00 C ATOM 0 H PHE A 46 0.922 7.433 -7.651 1.00 0.00 H new ATOM 0 HA PHE A 46 -1.427 8.898 -6.738 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -1.386 6.380 -7.128 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -0.579 6.288 -5.575 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -3.615 7.468 -7.316 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -1.800 6.769 -3.513 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -5.747 8.008 -6.207 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -3.924 7.338 -2.405 1.00 0.00 H new ATOM 0 HZ PHE A 46 -5.894 7.970 -3.743 1.00 0.00 H new ATOM 683 N ILE A 47 1.405 9.226 -5.315 1.00 0.00 N ATOM 684 CA ILE A 47 2.074 9.850 -4.180 1.00 0.00 C ATOM 685 C ILE A 47 1.536 11.298 -4.174 1.00 0.00 C ATOM 686 O ILE A 47 1.293 11.894 -3.131 1.00 0.00 O ATOM 687 CB ILE A 47 3.640 9.732 -4.268 1.00 0.00 C ATOM 688 CG1 ILE A 47 4.285 8.627 -3.383 1.00 0.00 C ATOM 689 CG2 ILE A 47 4.300 11.005 -4.898 1.00 0.00 C ATOM 690 CD1 ILE A 47 3.837 7.161 -3.586 1.00 0.00 C ATOM 0 H ILE A 47 1.981 9.093 -6.147 1.00 0.00 H new ATOM 0 HA ILE A 47 1.859 9.355 -3.233 1.00 0.00 H new ATOM 0 HB ILE A 47 4.173 9.139 -5.011 1.00 0.00 H new ATOM 0 HG12 ILE A 47 5.363 8.668 -3.536 1.00 0.00 H new ATOM 0 HG13 ILE A 47 4.101 8.888 -2.341 1.00 0.00 H new ATOM 0 HG21 ILE A 47 5.381 10.873 -4.936 1.00 0.00 H new ATOM 0 HG22 ILE A 47 3.916 11.152 -5.908 1.00 0.00 H new ATOM 0 HG23 ILE A 47 4.062 11.877 -4.289 1.00 0.00 H new ATOM 0 HD11 ILE A 47 4.379 6.516 -2.895 1.00 0.00 H new ATOM 0 HD12 ILE A 47 2.767 7.078 -3.397 1.00 0.00 H new ATOM 0 HD13 ILE A 47 4.049 6.854 -4.610 1.00 0.00 H new ATOM 702 N ASN A 48 1.333 11.794 -5.424 1.00 0.00 N ATOM 703 CA ASN A 48 0.822 13.137 -5.626 1.00 0.00 C ATOM 704 C ASN A 48 -0.686 13.126 -5.301 1.00 0.00 C ATOM 705 O ASN A 48 -1.213 14.122 -4.820 1.00 0.00 O ATOM 706 CB ASN A 48 1.110 13.585 -7.073 1.00 0.00 C ATOM 707 CG ASN A 48 0.677 15.039 -7.316 1.00 0.00 C ATOM 708 OD1 ASN A 48 -0.313 15.312 -7.984 1.00 0.00 O ATOM 709 ND2 ASN A 48 1.483 15.943 -6.729 1.00 0.00 N ATOM 0 H ASN A 48 1.519 11.276 -6.283 1.00 0.00 H new ATOM 0 HA ASN A 48 1.312 13.855 -4.968 1.00 0.00 H new ATOM 0 HB2 ASN A 48 2.175 13.483 -7.280 1.00 0.00 H new ATOM 0 HB3 ASN A 48 0.586 12.929 -7.768 1.00 0.00 H new ATOM 0 HD21 ASN A 48 1.287 16.939 -6.825 1.00 0.00 H new ATOM 0 HD22 ASN A 48 2.290 15.632 -6.188 1.00 0.00 H new ATOM 716 N ALA A 49 -1.356 11.974 -5.571 1.00 0.00 N ATOM 717 CA ALA A 49 -2.784 11.895 -5.295 1.00 0.00 C ATOM 718 C ALA A 49 -2.990 11.338 -3.871 1.00 0.00 C ATOM 719 O ALA A 49 -4.117 11.078 -3.476 1.00 0.00 O ATOM 720 CB ALA A 49 -3.503 11.061 -6.360 1.00 0.00 C ATOM 0 H ALA A 49 -0.938 11.130 -5.963 1.00 0.00 H new ATOM 0 HA ALA A 49 -3.226 12.891 -5.340 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -4.568 11.018 -6.131 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -3.361 11.520 -7.338 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -3.093 10.051 -6.370 1.00 0.00 H new ATOM 726 N ALA A 50 -1.879 11.148 -3.121 1.00 0.00 N ATOM 727 CA ALA A 50 -1.973 10.676 -1.743 1.00 0.00 C ATOM 728 C ALA A 50 -2.073 11.930 -0.885 1.00 0.00 C ATOM 729 O ALA A 50 -2.494 11.860 0.256 1.00 0.00 O ATOM 730 CB ALA A 50 -0.769 9.821 -1.336 1.00 0.00 C ATOM 0 H ALA A 50 -0.928 11.314 -3.451 1.00 0.00 H new ATOM 0 HA ALA A 50 -2.839 10.026 -1.616 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -0.887 9.495 -0.303 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -0.705 8.949 -1.987 1.00 0.00 H new ATOM 0 HB3 ALA A 50 0.143 10.410 -1.428 1.00 0.00 H new ATOM 736 N ILE A 51 -1.660 13.074 -1.471 1.00 0.00 N ATOM 737 CA ILE A 51 -1.778 14.346 -0.776 1.00 0.00 C ATOM 738 C ILE A 51 -3.272 14.715 -0.900 1.00 0.00 C ATOM 739 O ILE A 51 -3.893 15.225 0.024 1.00 0.00 O ATOM 740 CB ILE A 51 -0.871 15.420 -1.461 1.00 0.00 C ATOM 741 CG1 ILE A 51 0.435 14.910 -2.101 1.00 0.00 C ATOM 742 CG2 ILE A 51 -1.154 16.819 -0.821 1.00 0.00 C ATOM 743 CD1 ILE A 51 1.364 15.981 -2.710 1.00 0.00 C ATOM 0 H ILE A 51 -1.252 13.130 -2.404 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.458 14.293 0.265 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.077 15.714 -2.490 1.00 0.00 H new ATOM 0 HG12 ILE A 51 0.996 14.362 -1.343 1.00 0.00 H new ATOM 0 HG13 ILE A 51 0.176 14.197 -2.884 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -0.523 17.571 -1.296 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.202 17.080 -0.966 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -0.934 16.782 0.246 1.00 0.00 H new ATOM 0 HD11 ILE A 51 2.248 15.500 -3.129 1.00 0.00 H new ATOM 0 HD12 ILE A 51 0.835 16.516 -3.498 1.00 0.00 H new ATOM 0 HD13 ILE A 51 1.667 16.684 -1.934 1.00 0.00 H new ATOM 755 N GLU A 52 -3.784 14.390 -2.112 1.00 0.00 N ATOM 756 CA GLU A 52 -5.149 14.628 -2.531 1.00 0.00 C ATOM 757 C GLU A 52 -6.123 13.896 -1.591 1.00 0.00 C ATOM 758 O GLU A 52 -6.844 14.549 -0.845 1.00 0.00 O ATOM 759 CB GLU A 52 -5.331 14.214 -4.003 1.00 0.00 C ATOM 760 CG GLU A 52 -6.726 14.536 -4.562 1.00 0.00 C ATOM 761 CD GLU A 52 -6.836 14.069 -6.024 1.00 0.00 C ATOM 762 OE1 GLU A 52 -7.030 12.874 -6.246 1.00 0.00 O ATOM 763 OE2 GLU A 52 -6.728 14.903 -6.923 1.00 0.00 O ATOM 0 H GLU A 52 -3.222 13.940 -2.835 1.00 0.00 H new ATOM 0 HA GLU A 52 -5.374 15.693 -2.466 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -4.580 14.719 -4.610 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -5.149 13.143 -4.096 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -7.489 14.046 -3.958 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -6.911 15.608 -4.501 1.00 0.00 H new ATOM 770 N THR A 53 -6.137 12.533 -1.649 1.00 0.00 N ATOM 771 CA THR A 53 -7.088 11.794 -0.828 1.00 0.00 C ATOM 772 C THR A 53 -6.663 11.901 0.626 1.00 0.00 C ATOM 773 O THR A 53 -7.457 12.319 1.458 1.00 0.00 O ATOM 774 CB THR A 53 -7.412 10.329 -1.274 1.00 0.00 C ATOM 775 OG1 THR A 53 -6.781 9.208 -0.581 1.00 0.00 O ATOM 776 CG2 THR A 53 -7.380 10.188 -2.817 1.00 0.00 C ATOM 0 H THR A 53 -5.524 11.963 -2.232 1.00 0.00 H new ATOM 0 HA THR A 53 -8.056 12.273 -0.974 1.00 0.00 H new ATOM 0 HB THR A 53 -8.432 10.209 -0.908 1.00 0.00 H new ATOM 0 HG1 THR A 53 -6.255 8.683 -1.220 1.00 0.00 H new ATOM 0 HG21 THR A 53 -7.609 9.159 -3.093 1.00 0.00 H new ATOM 0 HG22 THR A 53 -8.120 10.856 -3.259 1.00 0.00 H new ATOM 0 HG23 THR A 53 -6.388 10.450 -3.186 1.00 0.00 H new ATOM 784 N LYS A 54 -5.387 11.503 0.852 1.00 0.00 N ATOM 785 CA LYS A 54 -4.712 11.520 2.159 1.00 0.00 C ATOM 786 C LYS A 54 -4.354 10.070 2.514 1.00 0.00 C ATOM 787 O LYS A 54 -4.566 9.643 3.638 1.00 0.00 O ATOM 788 CB LYS A 54 -5.503 12.231 3.286 1.00 0.00 C ATOM 789 CG LYS A 54 -4.711 12.510 4.568 1.00 0.00 C ATOM 790 CD LYS A 54 -5.530 13.314 5.586 1.00 0.00 C ATOM 791 CE LYS A 54 -4.655 14.115 6.554 1.00 0.00 C ATOM 792 NZ LYS A 54 -5.439 14.840 7.545 1.00 0.00 N ATOM 0 H LYS A 54 -4.788 11.153 0.104 1.00 0.00 H new ATOM 0 HA LYS A 54 -3.812 12.128 2.073 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -5.882 13.177 2.900 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -6.370 11.620 3.540 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -4.402 11.566 5.016 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -3.802 13.058 4.320 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -6.193 13.996 5.054 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -6.163 12.633 6.155 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -3.968 13.438 7.063 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -4.047 14.821 5.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -4.801 15.366 8.176 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -6.076 15.506 7.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -6.000 14.166 8.104 1.00 0.00 H new ATOM 805 N ALA A 55 -3.763 9.348 1.531 1.00 0.00 N ATOM 806 CA ALA A 55 -3.377 7.944 1.672 1.00 0.00 C ATOM 807 C ALA A 55 -2.593 7.737 2.971 1.00 0.00 C ATOM 808 O ALA A 55 -1.432 8.097 3.102 1.00 0.00 O ATOM 809 CB ALA A 55 -2.524 7.460 0.485 1.00 0.00 C ATOM 0 H ALA A 55 -3.544 9.738 0.614 1.00 0.00 H new ATOM 0 HA ALA A 55 -4.297 7.359 1.694 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -2.259 6.413 0.630 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -3.093 7.566 -0.439 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.615 8.058 0.422 1.00 0.00 H new ATOM 815 N ASP A 56 -3.334 7.100 3.902 1.00 0.00 N ATOM 816 CA ASP A 56 -2.841 6.719 5.212 1.00 0.00 C ATOM 817 C ASP A 56 -2.040 5.433 4.953 1.00 0.00 C ATOM 818 O ASP A 56 -0.991 5.221 5.546 1.00 0.00 O ATOM 819 CB ASP A 56 -4.018 6.547 6.198 1.00 0.00 C ATOM 820 CG ASP A 56 -3.594 5.895 7.526 1.00 0.00 C ATOM 821 OD1 ASP A 56 -2.820 6.501 8.265 1.00 0.00 O ATOM 822 OD2 ASP A 56 -4.046 4.785 7.803 1.00 0.00 O ATOM 0 H ASP A 56 -4.307 6.838 3.747 1.00 0.00 H new ATOM 0 HA ASP A 56 -2.206 7.468 5.686 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -4.460 7.522 6.402 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -4.792 5.938 5.730 1.00 0.00 H new ATOM 827 N LEU A 57 -2.586 4.603 4.029 1.00 0.00 N ATOM 828 CA LEU A 57 -1.884 3.386 3.667 1.00 0.00 C ATOM 829 C LEU A 57 -2.332 3.024 2.257 1.00 0.00 C ATOM 830 O LEU A 57 -3.318 3.529 1.733 1.00 0.00 O ATOM 831 CB LEU A 57 -2.070 2.245 4.682 1.00 0.00 C ATOM 832 CG LEU A 57 -3.520 1.991 5.194 1.00 0.00 C ATOM 833 CD1 LEU A 57 -4.405 1.370 4.073 1.00 0.00 C ATOM 834 CD2 LEU A 57 -3.725 1.680 6.682 1.00 0.00 C ATOM 0 H LEU A 57 -3.472 4.759 3.549 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.807 3.554 3.687 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.703 1.324 4.229 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.436 2.451 5.545 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.017 2.946 5.364 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.412 1.202 4.455 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.448 2.052 3.224 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -3.975 0.420 3.754 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -4.786 1.529 6.879 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -3.175 0.776 6.944 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -3.360 2.514 7.282 1.00 0.00 H new ATOM 846 N ILE A 58 -1.513 2.102 1.691 1.00 0.00 N ATOM 847 CA ILE A 58 -1.750 1.611 0.341 1.00 0.00 C ATOM 848 C ILE A 58 -1.487 0.094 0.384 1.00 0.00 C ATOM 849 O ILE A 58 -0.597 -0.385 1.076 1.00 0.00 O ATOM 850 CB ILE A 58 -0.913 2.386 -0.744 1.00 0.00 C ATOM 851 CG1 ILE A 58 -0.552 3.872 -0.466 1.00 0.00 C ATOM 852 CG2 ILE A 58 -1.161 1.712 -2.133 1.00 0.00 C ATOM 853 CD1 ILE A 58 0.520 4.246 0.598 1.00 0.00 C ATOM 0 H ILE A 58 -0.698 1.698 2.153 1.00 0.00 H new ATOM 0 HA ILE A 58 -2.777 1.795 0.025 1.00 0.00 H new ATOM 0 HB ILE A 58 0.173 2.308 -0.696 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -0.229 4.305 -1.412 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -1.475 4.378 -0.182 1.00 0.00 H new ATOM 0 HG21 ILE A 58 -0.589 2.236 -2.899 1.00 0.00 H new ATOM 0 HG22 ILE A 58 -0.845 0.670 -2.093 1.00 0.00 H new ATOM 0 HG23 ILE A 58 -2.222 1.760 -2.377 1.00 0.00 H new ATOM 0 HD11 ILE A 58 0.626 5.330 0.642 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.210 3.872 1.574 1.00 0.00 H new ATOM 0 HD13 ILE A 58 1.476 3.798 0.325 1.00 0.00 H new ATOM 865 N CYS A 59 -2.334 -0.628 -0.395 1.00 0.00 N ATOM 866 CA CYS A 59 -2.225 -2.085 -0.485 1.00 0.00 C ATOM 867 C CYS A 59 -2.415 -2.440 -1.967 1.00 0.00 C ATOM 868 O CYS A 59 -3.324 -1.956 -2.632 1.00 0.00 O ATOM 869 CB CYS A 59 -3.289 -2.783 0.385 1.00 0.00 C ATOM 870 SG CYS A 59 -3.268 -4.588 0.236 1.00 0.00 S ATOM 0 H CYS A 59 -3.083 -0.222 -0.956 1.00 0.00 H new ATOM 0 HA CYS A 59 -1.257 -2.424 -0.116 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -3.131 -2.510 1.428 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -4.276 -2.414 0.105 1.00 0.00 H new ATOM 0 HG CYS A 59 -2.104 -5.040 0.597 1.00 0.00 H new ATOM 876 N VAL A 60 -1.493 -3.325 -2.429 1.00 0.00 N ATOM 877 CA VAL A 60 -1.499 -3.817 -3.799 1.00 0.00 C ATOM 878 C VAL A 60 -2.100 -5.227 -3.770 1.00 0.00 C ATOM 879 O VAL A 60 -1.765 -6.025 -2.902 1.00 0.00 O ATOM 880 CB VAL A 60 -0.043 -3.838 -4.370 1.00 0.00 C ATOM 881 CG1 VAL A 60 0.259 -2.447 -5.009 1.00 0.00 C ATOM 882 CG2 VAL A 60 1.055 -4.841 -3.927 1.00 0.00 C ATOM 0 H VAL A 60 -0.739 -3.704 -1.856 1.00 0.00 H new ATOM 0 HA VAL A 60 -2.090 -3.169 -4.447 1.00 0.00 H new ATOM 0 HB VAL A 60 0.048 -4.633 -5.111 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.272 -2.444 -5.413 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -0.452 -2.253 -5.812 1.00 0.00 H new ATOM 0 HG13 VAL A 60 0.169 -1.670 -4.249 1.00 0.00 H new ATOM 0 HG21 VAL A 60 1.974 -4.640 -4.477 1.00 0.00 H new ATOM 0 HG22 VAL A 60 1.240 -4.730 -2.859 1.00 0.00 H new ATOM 0 HG23 VAL A 60 0.723 -5.858 -4.134 1.00 0.00 H new ATOM 892 N SER A 61 -3.004 -5.484 -4.749 1.00 0.00 N ATOM 893 CA SER A 61 -3.624 -6.797 -4.837 1.00 0.00 C ATOM 894 C SER A 61 -3.070 -7.456 -6.133 1.00 0.00 C ATOM 895 O SER A 61 -3.576 -7.270 -7.237 1.00 0.00 O ATOM 896 CB SER A 61 -5.167 -6.585 -4.711 1.00 0.00 C ATOM 897 OG SER A 61 -5.665 -5.252 -4.274 1.00 0.00 O ATOM 0 H SER A 61 -3.301 -4.814 -5.458 1.00 0.00 H new ATOM 0 HA SER A 61 -3.388 -7.504 -4.042 1.00 0.00 H new ATOM 0 HB2 SER A 61 -5.613 -6.804 -5.681 1.00 0.00 H new ATOM 0 HB3 SER A 61 -5.548 -7.328 -4.010 1.00 0.00 H new ATOM 0 HG SER A 61 -6.644 -5.263 -4.242 1.00 0.00 H new ATOM 903 N SER A 62 -1.956 -8.205 -5.913 1.00 0.00 N ATOM 904 CA SER A 62 -1.249 -8.951 -6.969 1.00 0.00 C ATOM 905 C SER A 62 0.217 -8.984 -6.534 1.00 0.00 C ATOM 906 O SER A 62 0.637 -8.249 -5.650 1.00 0.00 O ATOM 907 CB SER A 62 -1.361 -8.360 -8.419 1.00 0.00 C ATOM 908 OG SER A 62 -0.415 -8.766 -9.488 1.00 0.00 O ATOM 0 H SER A 62 -1.528 -8.303 -4.992 1.00 0.00 H new ATOM 0 HA SER A 62 -1.714 -9.933 -7.057 1.00 0.00 H new ATOM 0 HB2 SER A 62 -2.365 -8.587 -8.779 1.00 0.00 H new ATOM 0 HB3 SER A 62 -1.292 -7.276 -8.327 1.00 0.00 H new ATOM 0 HG SER A 62 0.066 -7.978 -9.816 1.00 0.00 H new ATOM 914 N LEU A 63 0.970 -9.876 -7.228 1.00 0.00 N ATOM 915 CA LEU A 63 2.386 -10.082 -6.983 1.00 0.00 C ATOM 916 C LEU A 63 3.123 -8.817 -7.466 1.00 0.00 C ATOM 917 O LEU A 63 2.796 -7.704 -7.071 1.00 0.00 O ATOM 918 CB LEU A 63 2.893 -11.396 -7.618 1.00 0.00 C ATOM 919 CG LEU A 63 2.167 -12.664 -7.078 1.00 0.00 C ATOM 920 CD1 LEU A 63 2.727 -13.903 -7.833 1.00 0.00 C ATOM 921 CD2 LEU A 63 1.544 -12.754 -5.670 1.00 0.00 C ATOM 0 H LEU A 63 0.593 -10.465 -7.971 1.00 0.00 H new ATOM 0 HA LEU A 63 2.587 -10.215 -5.920 1.00 0.00 H new ATOM 0 HB2 LEU A 63 2.761 -11.343 -8.699 1.00 0.00 H new ATOM 0 HB3 LEU A 63 3.963 -11.492 -7.432 1.00 0.00 H new ATOM 0 HG LEU A 63 1.101 -12.560 -7.282 1.00 0.00 H new ATOM 0 HD11 LEU A 63 2.232 -14.804 -7.471 1.00 0.00 H new ATOM 0 HD12 LEU A 63 2.542 -13.792 -8.901 1.00 0.00 H new ATOM 0 HD13 LEU A 63 3.800 -13.982 -7.657 1.00 0.00 H new ATOM 0 HD21 LEU A 63 1.098 -13.739 -5.532 1.00 0.00 H new ATOM 0 HD22 LEU A 63 2.318 -12.598 -4.919 1.00 0.00 H new ATOM 0 HD23 LEU A 63 0.775 -11.989 -5.563 1.00 0.00 H new ATOM 933 N TYR A 64 4.141 -9.042 -8.330 1.00 0.00 N ATOM 934 CA TYR A 64 4.940 -7.966 -8.862 1.00 0.00 C ATOM 935 C TYR A 64 4.177 -7.451 -10.087 1.00 0.00 C ATOM 936 O TYR A 64 4.409 -7.835 -11.227 1.00 0.00 O ATOM 937 CB TYR A 64 6.385 -8.432 -9.167 1.00 0.00 C ATOM 938 CG TYR A 64 7.400 -7.747 -8.284 1.00 0.00 C ATOM 939 CD1 TYR A 64 7.595 -6.375 -8.380 1.00 0.00 C ATOM 940 CD2 TYR A 64 8.156 -8.463 -7.363 1.00 0.00 C ATOM 941 CE1 TYR A 64 8.517 -5.725 -7.572 1.00 0.00 C ATOM 942 CE2 TYR A 64 9.084 -7.825 -6.549 1.00 0.00 C ATOM 943 CZ TYR A 64 9.266 -6.441 -6.630 1.00 0.00 C ATOM 944 OH TYR A 64 10.181 -5.796 -5.799 1.00 0.00 O ATOM 0 H TYR A 64 4.411 -9.968 -8.660 1.00 0.00 H new ATOM 0 HA TYR A 64 5.076 -7.155 -8.146 1.00 0.00 H new ATOM 0 HB2 TYR A 64 6.454 -9.511 -9.029 1.00 0.00 H new ATOM 0 HB3 TYR A 64 6.618 -8.229 -10.212 1.00 0.00 H new ATOM 0 HD1 TYR A 64 7.020 -5.805 -9.095 1.00 0.00 H new ATOM 0 HD2 TYR A 64 8.020 -9.531 -7.279 1.00 0.00 H new ATOM 0 HE1 TYR A 64 8.658 -4.659 -7.670 1.00 0.00 H new ATOM 0 HE2 TYR A 64 9.669 -8.402 -5.849 1.00 0.00 H new ATOM 0 HH TYR A 64 9.775 -4.982 -5.434 1.00 0.00 H new ATOM 954 N GLY A 65 3.248 -6.547 -9.728 1.00 0.00 N ATOM 955 CA GLY A 65 2.374 -5.857 -10.660 1.00 0.00 C ATOM 956 C GLY A 65 2.313 -4.395 -10.220 1.00 0.00 C ATOM 957 O GLY A 65 1.270 -3.754 -10.182 1.00 0.00 O ATOM 0 H GLY A 65 3.090 -6.278 -8.757 1.00 0.00 H new ATOM 0 HA2 GLY A 65 2.756 -5.937 -11.678 1.00 0.00 H new ATOM 0 HA3 GLY A 65 1.379 -6.302 -10.657 1.00 0.00 H new ATOM 961 N GLN A 66 3.534 -3.938 -9.878 1.00 0.00 N ATOM 962 CA GLN A 66 3.740 -2.592 -9.393 1.00 0.00 C ATOM 963 C GLN A 66 5.140 -2.162 -9.854 1.00 0.00 C ATOM 964 O GLN A 66 5.399 -1.001 -10.143 1.00 0.00 O ATOM 965 CB GLN A 66 3.529 -2.578 -7.861 1.00 0.00 C ATOM 966 CG GLN A 66 4.538 -3.426 -7.064 1.00 0.00 C ATOM 967 CD GLN A 66 4.284 -3.296 -5.553 1.00 0.00 C ATOM 968 OE1 GLN A 66 3.900 -2.248 -5.048 1.00 0.00 O ATOM 969 NE2 GLN A 66 4.526 -4.429 -4.871 1.00 0.00 N ATOM 0 H GLN A 66 4.385 -4.497 -9.935 1.00 0.00 H new ATOM 0 HA GLN A 66 3.028 -1.870 -9.792 1.00 0.00 H new ATOM 0 HB2 GLN A 66 3.584 -1.548 -7.510 1.00 0.00 H new ATOM 0 HB3 GLN A 66 2.523 -2.936 -7.643 1.00 0.00 H new ATOM 0 HG2 GLN A 66 4.458 -4.471 -7.363 1.00 0.00 H new ATOM 0 HG3 GLN A 66 5.554 -3.105 -7.296 1.00 0.00 H new ATOM 0 HE21 GLN A 66 4.844 -5.263 -5.364 1.00 0.00 H new ATOM 0 HE22 GLN A 66 4.391 -4.455 -3.860 1.00 0.00 H new ATOM 978 N GLY A 67 6.024 -3.171 -9.918 1.00 0.00 N ATOM 979 CA GLY A 67 7.402 -2.942 -10.320 1.00 0.00 C ATOM 980 C GLY A 67 8.209 -2.488 -9.104 1.00 0.00 C ATOM 981 O GLY A 67 7.664 -2.140 -8.064 1.00 0.00 O ATOM 0 H GLY A 67 5.802 -4.142 -9.697 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.829 -3.855 -10.735 1.00 0.00 H new ATOM 0 HA3 GLY A 67 7.444 -2.185 -11.103 1.00 0.00 H new ATOM 985 N GLU A 68 9.543 -2.501 -9.306 1.00 0.00 N ATOM 986 CA GLU A 68 10.452 -2.119 -8.236 1.00 0.00 C ATOM 987 C GLU A 68 10.465 -0.576 -8.111 1.00 0.00 C ATOM 988 O GLU A 68 11.183 -0.030 -7.283 1.00 0.00 O ATOM 989 CB GLU A 68 11.858 -2.683 -8.505 1.00 0.00 C ATOM 990 CG GLU A 68 11.863 -4.207 -8.701 1.00 0.00 C ATOM 991 CD GLU A 68 13.298 -4.729 -8.885 1.00 0.00 C ATOM 992 OE1 GLU A 68 13.771 -4.765 -10.021 1.00 0.00 O ATOM 993 OE2 GLU A 68 13.925 -5.097 -7.892 1.00 0.00 O ATOM 0 H GLU A 68 9.994 -2.767 -10.181 1.00 0.00 H new ATOM 0 HA GLU A 68 10.112 -2.539 -7.289 1.00 0.00 H new ATOM 0 HB2 GLU A 68 12.271 -2.206 -9.394 1.00 0.00 H new ATOM 0 HB3 GLU A 68 12.512 -2.427 -7.672 1.00 0.00 H new ATOM 0 HG2 GLU A 68 11.403 -4.691 -7.839 1.00 0.00 H new ATOM 0 HG3 GLU A 68 11.262 -4.468 -9.572 1.00 0.00 H new ATOM 1000 N ILE A 69 9.646 0.095 -8.958 1.00 0.00 N ATOM 1001 CA ILE A 69 9.534 1.544 -8.973 1.00 0.00 C ATOM 1002 C ILE A 69 8.518 1.900 -7.882 1.00 0.00 C ATOM 1003 O ILE A 69 8.743 2.792 -7.076 1.00 0.00 O ATOM 1004 CB ILE A 69 9.067 2.047 -10.380 1.00 0.00 C ATOM 1005 CG1 ILE A 69 9.313 1.117 -11.602 1.00 0.00 C ATOM 1006 CG2 ILE A 69 8.793 3.585 -10.329 1.00 0.00 C ATOM 1007 CD1 ILE A 69 10.817 0.967 -11.858 1.00 0.00 C ATOM 0 H ILE A 69 9.051 -0.369 -9.644 1.00 0.00 H new ATOM 0 HA ILE A 69 10.493 2.025 -8.781 1.00 0.00 H new ATOM 0 HB ILE A 69 8.119 1.829 -10.871 1.00 0.00 H new ATOM 0 HG12 ILE A 69 8.868 0.139 -11.419 1.00 0.00 H new ATOM 0 HG13 ILE A 69 8.825 1.529 -12.486 1.00 0.00 H new ATOM 0 HG21 ILE A 69 8.468 3.929 -11.311 1.00 0.00 H new ATOM 0 HG22 ILE A 69 8.013 3.792 -9.596 1.00 0.00 H new ATOM 0 HG23 ILE A 69 9.706 4.108 -10.045 1.00 0.00 H new ATOM 0 HD11 ILE A 69 10.977 0.314 -12.716 1.00 0.00 H new ATOM 0 HD12 ILE A 69 11.251 1.946 -12.062 1.00 0.00 H new ATOM 0 HD13 ILE A 69 11.294 0.534 -10.979 1.00 0.00 H new ATOM 1019 N ASP A 70 7.393 1.147 -7.903 1.00 0.00 N ATOM 1020 CA ASP A 70 6.322 1.362 -6.939 1.00 0.00 C ATOM 1021 C ASP A 70 6.803 0.840 -5.581 1.00 0.00 C ATOM 1022 O ASP A 70 6.361 1.323 -4.545 1.00 0.00 O ATOM 1023 CB ASP A 70 5.048 0.624 -7.374 1.00 0.00 C ATOM 1024 CG ASP A 70 4.386 1.201 -8.642 1.00 0.00 C ATOM 1025 OD1 ASP A 70 4.913 2.137 -9.244 1.00 0.00 O ATOM 1026 OD2 ASP A 70 3.333 0.692 -9.012 1.00 0.00 O ATOM 0 H ASP A 70 7.217 0.398 -8.573 1.00 0.00 H new ATOM 0 HA ASP A 70 6.082 2.423 -6.875 1.00 0.00 H new ATOM 0 HB2 ASP A 70 5.290 -0.424 -7.549 1.00 0.00 H new ATOM 0 HB3 ASP A 70 4.328 0.652 -6.556 1.00 0.00 H new ATOM 1031 N CYS A 71 7.727 -0.157 -5.626 1.00 0.00 N ATOM 1032 CA CYS A 71 8.266 -0.699 -4.387 1.00 0.00 C ATOM 1033 C CYS A 71 9.115 0.422 -3.781 1.00 0.00 C ATOM 1034 O CYS A 71 8.959 0.741 -2.612 1.00 0.00 O ATOM 1035 CB CYS A 71 9.075 -1.987 -4.604 1.00 0.00 C ATOM 1036 SG CYS A 71 8.042 -3.380 -5.121 1.00 0.00 S ATOM 0 H CYS A 71 8.092 -0.577 -6.481 1.00 0.00 H new ATOM 0 HA CYS A 71 7.463 -0.999 -3.713 1.00 0.00 H new ATOM 0 HB2 CYS A 71 9.841 -1.808 -5.359 1.00 0.00 H new ATOM 0 HB3 CYS A 71 9.592 -2.246 -3.680 1.00 0.00 H new ATOM 0 HG CYS A 71 7.688 -3.221 -6.362 1.00 0.00 H new ATOM 1042 N LYS A 72 9.969 1.035 -4.647 1.00 0.00 N ATOM 1043 CA LYS A 72 10.833 2.132 -4.215 1.00 0.00 C ATOM 1044 C LYS A 72 10.091 3.462 -4.417 1.00 0.00 C ATOM 1045 O LYS A 72 10.699 4.513 -4.568 1.00 0.00 O ATOM 1046 CB LYS A 72 12.172 2.143 -4.979 1.00 0.00 C ATOM 1047 CG LYS A 72 13.078 0.950 -4.658 1.00 0.00 C ATOM 1048 CD LYS A 72 14.470 1.091 -5.299 1.00 0.00 C ATOM 1049 CE LYS A 72 14.473 0.890 -6.819 1.00 0.00 C ATOM 1050 NZ LYS A 72 14.235 -0.496 -7.198 1.00 0.00 N ATOM 0 H LYS A 72 10.066 0.782 -5.630 1.00 0.00 H new ATOM 0 HA LYS A 72 11.068 1.992 -3.160 1.00 0.00 H new ATOM 0 HB2 LYS A 72 11.968 2.155 -6.050 1.00 0.00 H new ATOM 0 HB3 LYS A 72 12.705 3.065 -4.746 1.00 0.00 H new ATOM 0 HG2 LYS A 72 13.185 0.857 -3.577 1.00 0.00 H new ATOM 0 HG3 LYS A 72 12.608 0.033 -5.012 1.00 0.00 H new ATOM 0 HD2 LYS A 72 14.866 2.081 -5.072 1.00 0.00 H new ATOM 0 HD3 LYS A 72 15.145 0.366 -4.844 1.00 0.00 H new ATOM 0 HE2 LYS A 72 13.707 1.523 -7.268 1.00 0.00 H new ATOM 0 HE3 LYS A 72 15.432 1.215 -7.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 15.121 -0.919 -7.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 13.894 -1.028 -6.372 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 13.519 -0.532 -7.952 1.00 0.00 H new ATOM 1063 N GLY A 73 8.758 3.355 -4.399 1.00 0.00 N ATOM 1064 CA GLY A 73 7.859 4.487 -4.549 1.00 0.00 C ATOM 1065 C GLY A 73 7.435 4.961 -3.159 1.00 0.00 C ATOM 1066 O GLY A 73 7.233 6.141 -2.911 1.00 0.00 O ATOM 0 H GLY A 73 8.274 2.465 -4.278 1.00 0.00 H new ATOM 0 HA2 GLY A 73 8.354 5.294 -5.089 1.00 0.00 H new ATOM 0 HA3 GLY A 73 6.985 4.201 -5.134 1.00 0.00 H new ATOM 1070 N LEU A 74 7.343 3.936 -2.282 1.00 0.00 N ATOM 1071 CA LEU A 74 6.967 4.105 -0.894 1.00 0.00 C ATOM 1072 C LEU A 74 8.244 4.383 -0.097 1.00 0.00 C ATOM 1073 O LEU A 74 8.211 5.061 0.922 1.00 0.00 O ATOM 1074 CB LEU A 74 6.279 2.816 -0.409 1.00 0.00 C ATOM 1075 CG LEU A 74 5.206 2.327 -1.453 1.00 0.00 C ATOM 1076 CD1 LEU A 74 4.605 0.927 -1.857 1.00 0.00 C ATOM 1077 CD2 LEU A 74 4.117 3.419 -1.530 1.00 0.00 C ATOM 0 H LEU A 74 7.533 2.967 -2.538 1.00 0.00 H new ATOM 0 HA LEU A 74 6.272 4.934 -0.762 1.00 0.00 H new ATOM 0 HB2 LEU A 74 7.025 2.036 -0.255 1.00 0.00 H new ATOM 0 HB3 LEU A 74 5.801 2.994 0.554 1.00 0.00 H new ATOM 0 HG LEU A 74 6.002 2.073 -2.153 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.869 1.062 -2.649 1.00 0.00 H new ATOM 0 HD12 LEU A 74 5.404 0.277 -2.212 1.00 0.00 H new ATOM 0 HD13 LEU A 74 4.126 0.473 -0.990 1.00 0.00 H new ATOM 0 HD21 LEU A 74 3.351 3.119 -2.245 1.00 0.00 H new ATOM 0 HD22 LEU A 74 3.664 3.551 -0.547 1.00 0.00 H new ATOM 0 HD23 LEU A 74 4.566 4.359 -1.852 1.00 0.00 H new ATOM 1089 N ARG A 75 9.369 3.823 -0.601 1.00 0.00 N ATOM 1090 CA ARG A 75 10.654 4.024 0.057 1.00 0.00 C ATOM 1091 C ARG A 75 11.084 5.466 -0.271 1.00 0.00 C ATOM 1092 O ARG A 75 11.847 6.078 0.463 1.00 0.00 O ATOM 1093 CB ARG A 75 11.692 2.980 -0.404 1.00 0.00 C ATOM 1094 CG ARG A 75 11.160 1.539 -0.379 1.00 0.00 C ATOM 1095 CD ARG A 75 10.906 0.928 1.013 1.00 0.00 C ATOM 1096 NE ARG A 75 9.699 0.095 1.046 1.00 0.00 N ATOM 1097 CZ ARG A 75 9.407 -0.884 0.155 1.00 0.00 C ATOM 1098 NH1 ARG A 75 10.262 -1.258 -0.792 1.00 0.00 N ATOM 1099 NH2 ARG A 75 8.232 -1.497 0.228 1.00 0.00 N ATOM 0 H ARG A 75 9.401 3.245 -1.441 1.00 0.00 H new ATOM 0 HA ARG A 75 10.575 3.888 1.136 1.00 0.00 H new ATOM 0 HB2 ARG A 75 12.015 3.223 -1.416 1.00 0.00 H new ATOM 0 HB3 ARG A 75 12.572 3.046 0.236 1.00 0.00 H new ATOM 0 HG2 ARG A 75 10.227 1.509 -0.941 1.00 0.00 H new ATOM 0 HG3 ARG A 75 11.870 0.903 -0.907 1.00 0.00 H new ATOM 0 HD2 ARG A 75 11.767 0.327 1.306 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.812 1.729 1.747 1.00 0.00 H new ATOM 0 HE ARG A 75 9.029 0.265 1.796 1.00 0.00 H new ATOM 0 HH11 ARG A 75 11.172 -0.804 -0.865 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.007 -1.999 -1.445 1.00 0.00 H new ATOM 0 HH21 ARG A 75 7.561 -1.230 0.948 1.00 0.00 H new ATOM 0 HH22 ARG A 75 8.000 -2.235 -0.436 1.00 0.00 H new ATOM 1113 N GLU A 76 10.535 5.968 -1.406 1.00 0.00 N ATOM 1114 CA GLU A 76 10.789 7.319 -1.864 1.00 0.00 C ATOM 1115 C GLU A 76 9.838 8.240 -1.078 1.00 0.00 C ATOM 1116 O GLU A 76 10.169 9.392 -0.839 1.00 0.00 O ATOM 1117 CB GLU A 76 10.552 7.402 -3.382 1.00 0.00 C ATOM 1118 CG GLU A 76 10.669 8.823 -3.958 1.00 0.00 C ATOM 1119 CD GLU A 76 10.455 8.803 -5.481 1.00 0.00 C ATOM 1120 OE1 GLU A 76 9.303 8.809 -5.915 1.00 0.00 O ATOM 1121 OE2 GLU A 76 11.442 8.782 -6.218 1.00 0.00 O ATOM 0 H GLU A 76 9.911 5.436 -2.012 1.00 0.00 H new ATOM 0 HA GLU A 76 11.821 7.624 -1.690 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.270 6.756 -3.887 1.00 0.00 H new ATOM 0 HB3 GLU A 76 9.559 7.011 -3.606 1.00 0.00 H new ATOM 0 HG2 GLU A 76 9.931 9.474 -3.489 1.00 0.00 H new ATOM 0 HG3 GLU A 76 11.651 9.236 -3.728 1.00 0.00 H new ATOM 1128 N LYS A 77 8.663 7.685 -0.683 1.00 0.00 N ATOM 1129 CA LYS A 77 7.644 8.403 0.061 1.00 0.00 C ATOM 1130 C LYS A 77 8.085 8.527 1.542 1.00 0.00 C ATOM 1131 O LYS A 77 7.516 9.299 2.305 1.00 0.00 O ATOM 1132 CB LYS A 77 6.338 7.595 -0.059 1.00 0.00 C ATOM 1133 CG LYS A 77 5.067 8.313 0.389 1.00 0.00 C ATOM 1134 CD LYS A 77 3.862 7.367 0.326 1.00 0.00 C ATOM 1135 CE LYS A 77 2.561 8.043 0.747 1.00 0.00 C ATOM 1136 NZ LYS A 77 2.095 9.018 -0.229 1.00 0.00 N ATOM 0 H LYS A 77 8.413 6.717 -0.883 1.00 0.00 H new ATOM 0 HA LYS A 77 7.495 9.410 -0.330 1.00 0.00 H new ATOM 0 HB2 LYS A 77 6.214 7.293 -1.099 1.00 0.00 H new ATOM 0 HB3 LYS A 77 6.443 6.682 0.528 1.00 0.00 H new ATOM 0 HG2 LYS A 77 5.192 8.684 1.406 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.889 9.180 -0.247 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.757 6.986 -0.690 1.00 0.00 H new ATOM 0 HD3 LYS A 77 4.046 6.508 0.971 1.00 0.00 H new ATOM 0 HE2 LYS A 77 1.792 7.284 0.893 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.707 8.537 1.708 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.540 9.754 0.253 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.912 9.455 -0.701 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 1.499 8.543 -0.937 1.00 0.00 H new ATOM 1149 N CYS A 78 9.099 7.710 1.908 1.00 0.00 N ATOM 1150 CA CYS A 78 9.656 7.640 3.253 1.00 0.00 C ATOM 1151 C CYS A 78 10.780 8.639 3.318 1.00 0.00 C ATOM 1152 O CYS A 78 10.910 9.468 4.212 1.00 0.00 O ATOM 1153 CB CYS A 78 10.086 6.204 3.598 1.00 0.00 C ATOM 1154 SG CYS A 78 11.071 6.080 5.114 1.00 0.00 S ATOM 0 H CYS A 78 9.553 7.073 1.253 1.00 0.00 H new ATOM 0 HA CYS A 78 8.913 7.896 4.009 1.00 0.00 H new ATOM 0 HB2 CYS A 78 9.196 5.583 3.702 1.00 0.00 H new ATOM 0 HB3 CYS A 78 10.662 5.798 2.767 1.00 0.00 H new ATOM 0 HG CYS A 78 11.207 4.829 5.442 1.00 0.00 H new ATOM 1160 N ASP A 79 11.554 8.471 2.250 1.00 0.00 N ATOM 1161 CA ASP A 79 12.726 9.248 1.938 1.00 0.00 C ATOM 1162 C ASP A 79 12.297 10.658 1.505 1.00 0.00 C ATOM 1163 O ASP A 79 13.121 11.535 1.274 1.00 0.00 O ATOM 1164 CB ASP A 79 13.647 8.506 0.949 1.00 0.00 C ATOM 1165 CG ASP A 79 15.005 9.210 0.773 1.00 0.00 C ATOM 1166 OD1 ASP A 79 15.822 9.151 1.692 1.00 0.00 O ATOM 1167 OD2 ASP A 79 15.230 9.808 -0.279 1.00 0.00 O ATOM 0 H ASP A 79 11.363 7.752 1.552 1.00 0.00 H new ATOM 0 HA ASP A 79 13.347 9.377 2.824 1.00 0.00 H new ATOM 0 HB2 ASP A 79 13.811 7.488 1.303 1.00 0.00 H new ATOM 0 HB3 ASP A 79 13.151 8.431 -0.019 1.00 0.00 H new ATOM 1172 N GLU A 80 10.969 10.821 1.439 1.00 0.00 N ATOM 1173 CA GLU A 80 10.335 12.070 1.110 1.00 0.00 C ATOM 1174 C GLU A 80 10.313 12.847 2.420 1.00 0.00 C ATOM 1175 O GLU A 80 10.804 13.964 2.530 1.00 0.00 O ATOM 1176 CB GLU A 80 8.905 11.918 0.550 1.00 0.00 C ATOM 1177 CG GLU A 80 8.225 13.268 0.267 1.00 0.00 C ATOM 1178 CD GLU A 80 8.892 14.002 -0.908 1.00 0.00 C ATOM 1179 OE1 GLU A 80 8.567 13.694 -2.054 1.00 0.00 O ATOM 1180 OE2 GLU A 80 9.725 14.874 -0.664 1.00 0.00 O ATOM 0 H GLU A 80 10.308 10.065 1.619 1.00 0.00 H new ATOM 0 HA GLU A 80 10.884 12.571 0.313 1.00 0.00 H new ATOM 0 HB2 GLU A 80 8.941 11.335 -0.370 1.00 0.00 H new ATOM 0 HB3 GLU A 80 8.300 11.354 1.261 1.00 0.00 H new ATOM 0 HG2 GLU A 80 7.171 13.105 0.044 1.00 0.00 H new ATOM 0 HG3 GLU A 80 8.269 13.893 1.159 1.00 0.00 H new ATOM 1187 N ALA A 81 9.684 12.144 3.389 1.00 0.00 N ATOM 1188 CA ALA A 81 9.487 12.630 4.747 1.00 0.00 C ATOM 1189 C ALA A 81 8.621 13.899 4.640 1.00 0.00 C ATOM 1190 O ALA A 81 8.919 14.937 5.219 1.00 0.00 O ATOM 1191 CB ALA A 81 10.825 12.867 5.470 1.00 0.00 C ATOM 0 H ALA A 81 9.299 11.212 3.234 1.00 0.00 H new ATOM 0 HA ALA A 81 8.977 11.888 5.361 1.00 0.00 H new ATOM 0 HB1 ALA A 81 10.634 13.229 6.480 1.00 0.00 H new ATOM 0 HB2 ALA A 81 11.383 11.932 5.519 1.00 0.00 H new ATOM 0 HB3 ALA A 81 11.408 13.608 4.923 1.00 0.00 H new ATOM 1197 N GLY A 82 7.539 13.730 3.849 1.00 0.00 N ATOM 1198 CA GLY A 82 6.592 14.808 3.598 1.00 0.00 C ATOM 1199 C GLY A 82 5.236 14.226 3.189 1.00 0.00 C ATOM 1200 O GLY A 82 4.186 14.660 3.649 1.00 0.00 O ATOM 0 H GLY A 82 7.311 12.854 3.380 1.00 0.00 H new ATOM 0 HA2 GLY A 82 6.480 15.421 4.493 1.00 0.00 H new ATOM 0 HA3 GLY A 82 6.970 15.460 2.811 1.00 0.00 H new ATOM 1204 N LEU A 83 5.336 13.210 2.301 1.00 0.00 N ATOM 1205 CA LEU A 83 4.157 12.515 1.812 1.00 0.00 C ATOM 1206 C LEU A 83 3.786 11.540 2.933 1.00 0.00 C ATOM 1207 O LEU A 83 4.566 10.677 3.320 1.00 0.00 O ATOM 1208 CB LEU A 83 4.480 11.738 0.527 1.00 0.00 C ATOM 1209 CG LEU A 83 4.717 12.630 -0.733 1.00 0.00 C ATOM 1210 CD1 LEU A 83 5.573 11.818 -1.751 1.00 0.00 C ATOM 1211 CD2 LEU A 83 3.775 13.763 -1.188 1.00 0.00 C ATOM 0 H LEU A 83 6.218 12.867 1.921 1.00 0.00 H new ATOM 0 HA LEU A 83 3.348 13.205 1.571 1.00 0.00 H new ATOM 0 HB2 LEU A 83 5.370 11.132 0.699 1.00 0.00 H new ATOM 0 HB3 LEU A 83 3.661 11.050 0.319 1.00 0.00 H new ATOM 0 HG LEU A 83 5.246 13.516 -0.382 1.00 0.00 H new ATOM 0 HD11 LEU A 83 5.751 12.423 -2.640 1.00 0.00 H new ATOM 0 HD12 LEU A 83 6.527 11.554 -1.295 1.00 0.00 H new ATOM 0 HD13 LEU A 83 5.040 10.909 -2.031 1.00 0.00 H new ATOM 0 HD21 LEU A 83 4.171 14.225 -2.092 1.00 0.00 H new ATOM 0 HD22 LEU A 83 2.786 13.353 -1.393 1.00 0.00 H new ATOM 0 HD23 LEU A 83 3.701 14.513 -0.400 1.00 0.00 H new ATOM 1223 N LYS A 84 2.543 11.744 3.422 1.00 0.00 N ATOM 1224 CA LYS A 84 2.018 10.923 4.500 1.00 0.00 C ATOM 1225 C LYS A 84 1.447 9.672 3.830 1.00 0.00 C ATOM 1226 O LYS A 84 0.777 9.740 2.806 1.00 0.00 O ATOM 1227 CB LYS A 84 0.981 11.703 5.337 1.00 0.00 C ATOM 1228 CG LYS A 84 -0.361 11.997 4.635 1.00 0.00 C ATOM 1229 CD LYS A 84 -1.430 10.911 4.849 1.00 0.00 C ATOM 1230 CE LYS A 84 -2.013 10.903 6.265 1.00 0.00 C ATOM 1231 NZ LYS A 84 -3.000 9.847 6.444 1.00 0.00 N ATOM 0 H LYS A 84 1.904 12.463 3.084 1.00 0.00 H new ATOM 0 HA LYS A 84 2.787 10.639 5.218 1.00 0.00 H new ATOM 0 HB2 LYS A 84 0.778 11.139 6.247 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.426 12.650 5.642 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.748 12.950 4.997 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.183 12.111 3.566 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -2.238 11.060 4.132 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -0.993 9.935 4.638 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -1.208 10.772 6.988 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -2.474 11.869 6.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -3.887 10.257 6.800 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -3.176 9.378 5.532 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -2.642 9.150 7.128 1.00 0.00 H new ATOM 1244 N GLY A 85 1.776 8.536 4.480 1.00 0.00 N ATOM 1245 CA GLY A 85 1.339 7.225 4.021 1.00 0.00 C ATOM 1246 C GLY A 85 2.521 6.258 3.991 1.00 0.00 C ATOM 1247 O GLY A 85 2.806 5.628 2.981 1.00 0.00 O ATOM 0 H GLY A 85 2.345 8.513 5.326 1.00 0.00 H new ATOM 0 HA2 GLY A 85 0.561 6.841 4.681 1.00 0.00 H new ATOM 0 HA3 GLY A 85 0.901 7.307 3.026 1.00 0.00 H new ATOM 1251 N ILE A 86 3.177 6.188 5.172 1.00 0.00 N ATOM 1252 CA ILE A 86 4.341 5.330 5.360 1.00 0.00 C ATOM 1253 C ILE A 86 3.843 4.135 6.184 1.00 0.00 C ATOM 1254 O ILE A 86 4.360 3.804 7.244 1.00 0.00 O ATOM 1255 CB ILE A 86 5.535 6.056 6.050 1.00 0.00 C ATOM 1256 CG1 ILE A 86 6.862 5.200 5.900 1.00 0.00 C ATOM 1257 CG2 ILE A 86 5.307 7.622 5.996 1.00 0.00 C ATOM 1258 CD1 ILE A 86 8.096 5.773 6.624 1.00 0.00 C ATOM 0 H ILE A 86 2.911 6.720 6.001 1.00 0.00 H new ATOM 0 HA ILE A 86 4.745 5.018 4.397 1.00 0.00 H new ATOM 0 HB ILE A 86 5.674 6.087 7.131 1.00 0.00 H new ATOM 0 HG12 ILE A 86 6.672 4.195 6.278 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.095 5.103 4.840 1.00 0.00 H new ATOM 0 HG21 ILE A 86 6.143 8.128 6.479 1.00 0.00 H new ATOM 0 HG22 ILE A 86 5.239 7.944 4.957 1.00 0.00 H new ATOM 0 HG23 ILE A 86 4.382 7.873 6.515 1.00 0.00 H new ATOM 0 HD11 ILE A 86 8.951 5.117 6.461 1.00 0.00 H new ATOM 0 HD12 ILE A 86 8.320 6.765 6.231 1.00 0.00 H new ATOM 0 HD13 ILE A 86 7.891 5.843 7.692 1.00 0.00 H new ATOM 1270 N LYS A 87 2.794 3.526 5.600 1.00 0.00 N ATOM 1271 CA LYS A 87 2.130 2.352 6.135 1.00 0.00 C ATOM 1272 C LYS A 87 1.675 1.642 4.868 1.00 0.00 C ATOM 1273 O LYS A 87 0.904 2.161 4.069 1.00 0.00 O ATOM 1274 CB LYS A 87 0.942 2.697 7.043 1.00 0.00 C ATOM 1275 CG LYS A 87 1.335 3.286 8.404 1.00 0.00 C ATOM 1276 CD LYS A 87 2.136 2.301 9.267 1.00 0.00 C ATOM 1277 CE LYS A 87 2.276 2.756 10.721 1.00 0.00 C ATOM 1278 NZ LYS A 87 3.074 3.968 10.858 1.00 0.00 N ATOM 0 H LYS A 87 2.386 3.854 4.725 1.00 0.00 H new ATOM 0 HA LYS A 87 2.778 1.755 6.777 1.00 0.00 H new ATOM 0 HB2 LYS A 87 0.299 3.408 6.525 1.00 0.00 H new ATOM 0 HB3 LYS A 87 0.352 1.795 7.208 1.00 0.00 H new ATOM 0 HG2 LYS A 87 1.925 4.189 8.248 1.00 0.00 H new ATOM 0 HG3 LYS A 87 0.434 3.583 8.941 1.00 0.00 H new ATOM 0 HD2 LYS A 87 1.649 1.326 9.243 1.00 0.00 H new ATOM 0 HD3 LYS A 87 3.129 2.172 8.835 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.285 2.930 11.140 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.733 1.957 11.305 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 3.136 4.231 11.862 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 4.030 3.798 10.485 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 2.626 4.741 10.325 1.00 0.00 H new ATOM 1291 N LEU A 88 2.216 0.424 4.731 1.00 0.00 N ATOM 1292 CA LEU A 88 1.920 -0.342 3.545 1.00 0.00 C ATOM 1293 C LEU A 88 1.733 -1.775 4.005 1.00 0.00 C ATOM 1294 O LEU A 88 2.250 -2.227 5.020 1.00 0.00 O ATOM 1295 CB LEU A 88 3.103 -0.195 2.566 1.00 0.00 C ATOM 1296 CG LEU A 88 3.101 1.184 1.830 1.00 0.00 C ATOM 1297 CD1 LEU A 88 2.037 1.149 0.703 1.00 0.00 C ATOM 1298 CD2 LEU A 88 3.612 2.557 2.329 1.00 0.00 C ATOM 0 H LEU A 88 2.835 -0.026 5.405 1.00 0.00 H new ATOM 0 HA LEU A 88 1.023 -0.005 3.026 1.00 0.00 H new ATOM 0 HB2 LEU A 88 4.039 -0.311 3.112 1.00 0.00 H new ATOM 0 HB3 LEU A 88 3.063 -0.997 1.829 1.00 0.00 H new ATOM 0 HG LEU A 88 4.171 1.237 1.630 1.00 0.00 H new ATOM 0 HD11 LEU A 88 2.027 2.107 0.182 1.00 0.00 H new ATOM 0 HD12 LEU A 88 2.281 0.355 -0.003 1.00 0.00 H new ATOM 0 HD13 LEU A 88 1.055 0.961 1.136 1.00 0.00 H new ATOM 0 HD21 LEU A 88 3.455 3.307 1.554 1.00 0.00 H new ATOM 0 HD22 LEU A 88 3.066 2.844 3.228 1.00 0.00 H new ATOM 0 HD23 LEU A 88 4.676 2.488 2.557 1.00 0.00 H new ATOM 1310 N PHE A 89 0.898 -2.429 3.181 1.00 0.00 N ATOM 1311 CA PHE A 89 0.592 -3.829 3.359 1.00 0.00 C ATOM 1312 C PHE A 89 0.571 -4.326 1.911 1.00 0.00 C ATOM 1313 O PHE A 89 -0.451 -4.338 1.233 1.00 0.00 O ATOM 1314 CB PHE A 89 -0.718 -4.012 4.152 1.00 0.00 C ATOM 1315 CG PHE A 89 -0.716 -5.219 5.061 1.00 0.00 C ATOM 1316 CD1 PHE A 89 0.084 -6.332 4.807 1.00 0.00 C ATOM 1317 CD2 PHE A 89 -1.547 -5.238 6.177 1.00 0.00 C ATOM 1318 CE1 PHE A 89 0.023 -7.449 5.627 1.00 0.00 C ATOM 1319 CE2 PHE A 89 -1.593 -6.353 7.002 1.00 0.00 C ATOM 1320 CZ PHE A 89 -0.815 -7.464 6.726 1.00 0.00 C ATOM 0 H PHE A 89 0.429 -1.995 2.386 1.00 0.00 H new ATOM 0 HA PHE A 89 1.299 -4.400 3.961 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.898 -3.119 4.750 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.548 -4.098 3.450 1.00 0.00 H new ATOM 0 HD1 PHE A 89 0.758 -6.324 3.963 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.161 -4.379 6.403 1.00 0.00 H new ATOM 0 HE1 PHE A 89 0.634 -8.312 5.406 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.241 -6.354 7.866 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.862 -8.335 7.363 1.00 0.00 H new ATOM 1330 N VAL A 90 1.770 -4.772 1.491 1.00 0.00 N ATOM 1331 CA VAL A 90 1.925 -5.204 0.115 1.00 0.00 C ATOM 1332 C VAL A 90 1.600 -6.700 -0.014 1.00 0.00 C ATOM 1333 O VAL A 90 2.349 -7.630 0.270 1.00 0.00 O ATOM 1334 CB VAL A 90 3.350 -4.791 -0.389 1.00 0.00 C ATOM 1335 CG1 VAL A 90 3.400 -3.232 -0.463 1.00 0.00 C ATOM 1336 CG2 VAL A 90 4.654 -5.612 -0.258 1.00 0.00 C ATOM 0 H VAL A 90 2.608 -4.837 2.069 1.00 0.00 H new ATOM 0 HA VAL A 90 1.211 -4.706 -0.541 1.00 0.00 H new ATOM 0 HB VAL A 90 3.440 -5.328 -1.334 1.00 0.00 H new ATOM 0 HG11 VAL A 90 4.383 -2.916 -0.812 1.00 0.00 H new ATOM 0 HG12 VAL A 90 2.637 -2.876 -1.156 1.00 0.00 H new ATOM 0 HG13 VAL A 90 3.215 -2.815 0.527 1.00 0.00 H new ATOM 0 HG21 VAL A 90 5.479 -5.058 -0.705 1.00 0.00 H new ATOM 0 HG22 VAL A 90 4.867 -5.792 0.796 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.537 -6.566 -0.772 1.00 0.00 H new ATOM 1346 N GLY A 91 0.344 -6.824 -0.466 1.00 0.00 N ATOM 1347 CA GLY A 91 -0.208 -8.139 -0.729 1.00 0.00 C ATOM 1348 C GLY A 91 0.343 -8.664 -2.053 1.00 0.00 C ATOM 1349 O GLY A 91 0.010 -8.184 -3.129 1.00 0.00 O ATOM 0 H GLY A 91 -0.287 -6.044 -0.650 1.00 0.00 H new ATOM 0 HA2 GLY A 91 0.049 -8.822 0.081 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -1.296 -8.087 -0.770 1.00 0.00 H new ATOM 1353 N GLY A 92 1.208 -9.683 -1.877 1.00 0.00 N ATOM 1354 CA GLY A 92 1.874 -10.320 -2.998 1.00 0.00 C ATOM 1355 C GLY A 92 3.313 -9.800 -3.091 1.00 0.00 C ATOM 1356 O GLY A 92 4.192 -10.224 -2.351 1.00 0.00 O ATOM 0 H GLY A 92 1.452 -10.072 -0.966 1.00 0.00 H new ATOM 0 HA2 GLY A 92 1.873 -11.402 -2.870 1.00 0.00 H new ATOM 0 HA3 GLY A 92 1.338 -10.108 -3.923 1.00 0.00 H new ATOM 1360 N ASN A 93 3.478 -8.856 -4.051 1.00 0.00 N ATOM 1361 CA ASN A 93 4.748 -8.210 -4.359 1.00 0.00 C ATOM 1362 C ASN A 93 5.665 -9.331 -4.884 1.00 0.00 C ATOM 1363 O ASN A 93 5.521 -9.796 -6.005 1.00 0.00 O ATOM 1364 CB ASN A 93 5.280 -7.384 -3.164 1.00 0.00 C ATOM 1365 CG ASN A 93 6.552 -6.594 -3.520 1.00 0.00 C ATOM 1366 OD1 ASN A 93 6.833 -6.314 -4.678 1.00 0.00 O ATOM 1367 ND2 ASN A 93 7.300 -6.267 -2.451 1.00 0.00 N ATOM 0 H ASN A 93 2.709 -8.527 -4.635 1.00 0.00 H new ATOM 0 HA ASN A 93 4.666 -7.445 -5.131 1.00 0.00 H new ATOM 0 HB2 ASN A 93 4.507 -6.692 -2.831 1.00 0.00 H new ATOM 0 HB3 ASN A 93 5.492 -8.052 -2.329 1.00 0.00 H new ATOM 0 HD21 ASN A 93 8.170 -5.749 -2.576 1.00 0.00 H new ATOM 0 HD22 ASN A 93 6.998 -6.537 -1.515 1.00 0.00 H new ATOM 1374 N ILE A 94 6.605 -9.738 -4.010 1.00 0.00 N ATOM 1375 CA ILE A 94 7.546 -10.797 -4.333 1.00 0.00 C ATOM 1376 C ILE A 94 6.989 -12.017 -3.590 1.00 0.00 C ATOM 1377 O ILE A 94 6.747 -11.990 -2.390 1.00 0.00 O ATOM 1378 CB ILE A 94 9.003 -10.394 -3.957 1.00 0.00 C ATOM 1379 CG1 ILE A 94 9.107 -9.059 -3.116 1.00 0.00 C ATOM 1380 CG2 ILE A 94 9.929 -11.662 -4.037 1.00 0.00 C ATOM 1381 CD1 ILE A 94 10.539 -8.545 -2.890 1.00 0.00 C ATOM 0 H ILE A 94 6.723 -9.342 -3.078 1.00 0.00 H new ATOM 0 HA ILE A 94 7.631 -11.012 -5.398 1.00 0.00 H new ATOM 0 HB ILE A 94 9.714 -9.834 -4.564 1.00 0.00 H new ATOM 0 HG12 ILE A 94 8.534 -8.282 -3.622 1.00 0.00 H new ATOM 0 HG13 ILE A 94 8.637 -9.221 -2.146 1.00 0.00 H new ATOM 0 HG21 ILE A 94 10.950 -11.384 -3.775 1.00 0.00 H new ATOM 0 HG22 ILE A 94 9.569 -12.420 -3.341 1.00 0.00 H new ATOM 0 HG23 ILE A 94 9.911 -12.062 -5.051 1.00 0.00 H new ATOM 0 HD11 ILE A 94 10.508 -7.626 -2.304 1.00 0.00 H new ATOM 0 HD12 ILE A 94 11.115 -9.298 -2.353 1.00 0.00 H new ATOM 0 HD13 ILE A 94 11.010 -8.346 -3.852 1.00 0.00 H new ATOM 1393 N VAL A 95 6.787 -13.078 -4.402 1.00 0.00 N ATOM 1394 CA VAL A 95 6.251 -14.338 -3.907 1.00 0.00 C ATOM 1395 C VAL A 95 7.375 -15.093 -3.182 1.00 0.00 C ATOM 1396 O VAL A 95 8.517 -14.653 -3.125 1.00 0.00 O ATOM 1397 CB VAL A 95 5.684 -15.152 -5.117 1.00 0.00 C ATOM 1398 CG1 VAL A 95 4.227 -15.616 -4.818 1.00 0.00 C ATOM 1399 CG2 VAL A 95 6.380 -15.143 -6.507 1.00 0.00 C ATOM 0 H VAL A 95 6.991 -13.074 -5.401 1.00 0.00 H new ATOM 0 HA VAL A 95 5.438 -14.177 -3.200 1.00 0.00 H new ATOM 0 HB VAL A 95 6.189 -16.074 -5.404 1.00 0.00 H new ATOM 0 HG11 VAL A 95 3.844 -16.181 -5.667 1.00 0.00 H new ATOM 0 HG12 VAL A 95 4.221 -16.247 -3.930 1.00 0.00 H new ATOM 0 HG13 VAL A 95 3.595 -14.744 -4.648 1.00 0.00 H new ATOM 0 HG21 VAL A 95 5.820 -15.773 -7.198 1.00 0.00 H new ATOM 0 HG22 VAL A 95 6.413 -14.123 -6.891 1.00 0.00 H new ATOM 0 HG23 VAL A 95 7.396 -15.526 -6.408 1.00 0.00 H new ATOM 1409 N VAL A 96 6.952 -16.259 -2.634 1.00 0.00 N ATOM 1410 CA VAL A 96 7.785 -17.193 -1.883 1.00 0.00 C ATOM 1411 C VAL A 96 8.731 -16.477 -0.900 1.00 0.00 C ATOM 1412 O VAL A 96 9.944 -16.647 -0.917 1.00 0.00 O ATOM 1413 CB VAL A 96 8.498 -18.207 -2.837 1.00 0.00 C ATOM 1414 CG1 VAL A 96 9.379 -17.486 -3.905 1.00 0.00 C ATOM 1415 CG2 VAL A 96 8.587 -19.747 -2.617 1.00 0.00 C ATOM 0 H VAL A 96 5.985 -16.573 -2.713 1.00 0.00 H new ATOM 0 HA VAL A 96 7.132 -17.790 -1.247 1.00 0.00 H new ATOM 0 HB VAL A 96 7.663 -18.821 -3.174 1.00 0.00 H new ATOM 0 HG11 VAL A 96 9.855 -18.229 -4.545 1.00 0.00 H new ATOM 0 HG12 VAL A 96 8.753 -16.832 -4.511 1.00 0.00 H new ATOM 0 HG13 VAL A 96 10.145 -16.894 -3.405 1.00 0.00 H new ATOM 0 HG21 VAL A 96 9.141 -20.201 -3.439 1.00 0.00 H new ATOM 0 HG22 VAL A 96 9.100 -19.951 -1.677 1.00 0.00 H new ATOM 0 HG23 VAL A 96 7.582 -20.168 -2.581 1.00 0.00 H new ATOM 1425 N GLY A 97 8.068 -15.672 -0.045 1.00 0.00 N ATOM 1426 CA GLY A 97 8.774 -14.901 0.965 1.00 0.00 C ATOM 1427 C GLY A 97 7.759 -14.130 1.811 1.00 0.00 C ATOM 1428 O GLY A 97 6.759 -13.630 1.311 1.00 0.00 O ATOM 0 H GLY A 97 7.056 -15.548 -0.043 1.00 0.00 H new ATOM 0 HA2 GLY A 97 9.364 -15.563 1.598 1.00 0.00 H new ATOM 0 HA3 GLY A 97 9.470 -14.209 0.491 1.00 0.00 H new ATOM 1432 N LYS A 98 8.082 -14.087 3.121 1.00 0.00 N ATOM 1433 CA LYS A 98 7.246 -13.399 4.091 1.00 0.00 C ATOM 1434 C LYS A 98 8.082 -13.408 5.370 1.00 0.00 C ATOM 1435 O LYS A 98 8.224 -14.430 6.030 1.00 0.00 O ATOM 1436 CB LYS A 98 5.882 -14.099 4.269 1.00 0.00 C ATOM 1437 CG LYS A 98 5.011 -13.475 5.371 1.00 0.00 C ATOM 1438 CD LYS A 98 3.541 -13.917 5.299 1.00 0.00 C ATOM 1439 CE LYS A 98 3.345 -15.427 5.480 1.00 0.00 C ATOM 1440 NZ LYS A 98 3.829 -15.917 6.765 1.00 0.00 N ATOM 0 H LYS A 98 8.915 -14.523 3.517 1.00 0.00 H new ATOM 0 HA LYS A 98 6.987 -12.386 3.782 1.00 0.00 H new ATOM 0 HB2 LYS A 98 5.339 -14.064 3.325 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.050 -15.151 4.502 1.00 0.00 H new ATOM 0 HG2 LYS A 98 5.418 -13.746 6.345 1.00 0.00 H new ATOM 0 HG3 LYS A 98 5.062 -12.389 5.295 1.00 0.00 H new ATOM 0 HD2 LYS A 98 2.974 -13.391 6.067 1.00 0.00 H new ATOM 0 HD3 LYS A 98 3.127 -13.618 4.336 1.00 0.00 H new ATOM 0 HE2 LYS A 98 2.285 -15.664 5.383 1.00 0.00 H new ATOM 0 HE3 LYS A 98 3.864 -15.953 4.679 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 3.593 -16.925 6.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 4.861 -15.796 6.816 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 3.379 -15.380 7.533 1.00 0.00 H new ATOM 1453 N GLN A 99 8.621 -12.196 5.650 1.00 0.00 N ATOM 1454 CA GLN A 99 9.479 -11.886 6.791 1.00 0.00 C ATOM 1455 C GLN A 99 10.918 -12.036 6.276 1.00 0.00 C ATOM 1456 O GLN A 99 11.746 -11.147 6.429 1.00 0.00 O ATOM 1457 CB GLN A 99 9.187 -12.714 8.066 1.00 0.00 C ATOM 1458 CG GLN A 99 9.749 -12.099 9.361 1.00 0.00 C ATOM 1459 CD GLN A 99 11.284 -12.054 9.387 1.00 0.00 C ATOM 1460 OE1 GLN A 99 11.896 -10.993 9.374 1.00 0.00 O ATOM 1461 NE2 GLN A 99 11.856 -13.271 9.423 1.00 0.00 N ATOM 0 H GLN A 99 8.456 -11.384 5.056 1.00 0.00 H new ATOM 0 HA GLN A 99 9.286 -10.872 7.142 1.00 0.00 H new ATOM 0 HB2 GLN A 99 8.108 -12.830 8.171 1.00 0.00 H new ATOM 0 HB3 GLN A 99 9.605 -13.713 7.940 1.00 0.00 H new ATOM 0 HG2 GLN A 99 9.359 -11.087 9.475 1.00 0.00 H new ATOM 0 HG3 GLN A 99 9.393 -12.676 10.215 1.00 0.00 H new ATOM 0 HE21 GLN A 99 11.273 -14.108 9.432 1.00 0.00 H new ATOM 0 HE22 GLN A 99 12.872 -13.357 9.442 1.00 0.00 H new ATOM 1470 N ASN A 100 11.158 -13.215 5.662 1.00 0.00 N ATOM 1471 CA ASN A 100 12.445 -13.555 5.086 1.00 0.00 C ATOM 1472 C ASN A 100 12.347 -13.033 3.653 1.00 0.00 C ATOM 1473 O ASN A 100 11.374 -13.296 2.955 1.00 0.00 O ATOM 1474 CB ASN A 100 12.689 -15.077 5.163 1.00 0.00 C ATOM 1475 CG ASN A 100 11.547 -15.902 4.536 1.00 0.00 C ATOM 1476 OD1 ASN A 100 10.514 -16.141 5.150 1.00 0.00 O ATOM 1477 ND2 ASN A 100 11.807 -16.319 3.284 1.00 0.00 N ATOM 0 H ASN A 100 10.455 -13.947 5.560 1.00 0.00 H new ATOM 0 HA ASN A 100 13.294 -13.116 5.611 1.00 0.00 H new ATOM 0 HB2 ASN A 100 13.624 -15.316 4.655 1.00 0.00 H new ATOM 0 HB3 ASN A 100 12.810 -15.368 6.207 1.00 0.00 H new ATOM 0 HD21 ASN A 100 11.118 -16.876 2.779 1.00 0.00 H new ATOM 0 HD22 ASN A 100 12.693 -16.078 2.840 1.00 0.00 H new ATOM 1484 N TRP A 101 13.394 -12.269 3.270 1.00 0.00 N ATOM 1485 CA TRP A 101 13.407 -11.687 1.939 1.00 0.00 C ATOM 1486 C TRP A 101 14.859 -11.734 1.449 1.00 0.00 C ATOM 1487 O TRP A 101 15.783 -11.816 2.250 1.00 0.00 O ATOM 1488 CB TRP A 101 12.973 -10.212 2.002 1.00 0.00 C ATOM 1489 CG TRP A 101 11.531 -10.103 2.436 1.00 0.00 C ATOM 1490 CD1 TRP A 101 11.065 -9.648 3.672 1.00 0.00 C ATOM 1491 CD2 TRP A 101 10.374 -10.431 1.650 1.00 0.00 C ATOM 1492 NE1 TRP A 101 9.711 -9.684 3.674 1.00 0.00 N ATOM 1493 CE2 TRP A 101 9.246 -10.157 2.454 1.00 0.00 C ATOM 1494 CE3 TRP A 101 10.219 -10.916 0.381 1.00 0.00 C ATOM 1495 CZ2 TRP A 101 7.992 -10.377 1.959 1.00 0.00 C ATOM 1496 CZ3 TRP A 101 8.942 -11.141 -0.124 1.00 0.00 C ATOM 1497 CH2 TRP A 101 7.825 -10.869 0.664 1.00 0.00 C ATOM 0 H TRP A 101 14.206 -12.055 3.849 1.00 0.00 H new ATOM 0 HA TRP A 101 12.730 -12.231 1.281 1.00 0.00 H new ATOM 0 HB2 TRP A 101 13.611 -9.669 2.699 1.00 0.00 H new ATOM 0 HB3 TRP A 101 13.101 -9.747 1.024 1.00 0.00 H new ATOM 0 HD1 TRP A 101 11.685 -9.320 4.494 1.00 0.00 H new ATOM 0 HE1 TRP A 101 9.120 -9.405 4.457 1.00 0.00 H new ATOM 0 HE3 TRP A 101 11.086 -11.124 -0.228 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 7.127 -10.170 2.572 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 8.817 -11.526 -1.125 1.00 0.00 H new ATOM 0 HH2 TRP A 101 6.833 -11.039 0.273 1.00 0.00 H new ATOM 1508 N PRO A 102 15.038 -11.663 0.089 1.00 0.00 N ATOM 1509 CA PRO A 102 16.372 -11.651 -0.511 1.00 0.00 C ATOM 1510 C PRO A 102 17.008 -10.269 -0.203 1.00 0.00 C ATOM 1511 O PRO A 102 16.708 -9.626 0.797 1.00 0.00 O ATOM 1512 CB PRO A 102 16.128 -11.900 -2.024 1.00 0.00 C ATOM 1513 CG PRO A 102 14.660 -12.297 -2.164 1.00 0.00 C ATOM 1514 CD PRO A 102 13.967 -11.784 -0.904 1.00 0.00 C ATOM 0 HA PRO A 102 17.061 -12.405 -0.129 1.00 0.00 H new ATOM 0 HB2 PRO A 102 16.345 -11.004 -2.605 1.00 0.00 H new ATOM 0 HB3 PRO A 102 16.781 -12.688 -2.398 1.00 0.00 H new ATOM 0 HG2 PRO A 102 14.220 -11.857 -3.059 1.00 0.00 H new ATOM 0 HG3 PRO A 102 14.555 -13.378 -2.255 1.00 0.00 H new ATOM 0 HD2 PRO A 102 13.482 -10.824 -1.082 1.00 0.00 H new ATOM 0 HD3 PRO A 102 13.193 -12.475 -0.569 1.00 0.00 H new ATOM 1522 N ASP A 103 17.864 -9.832 -1.155 1.00 0.00 N ATOM 1523 CA ASP A 103 18.592 -8.575 -1.056 1.00 0.00 C ATOM 1524 C ASP A 103 17.613 -7.411 -1.284 1.00 0.00 C ATOM 1525 O ASP A 103 17.870 -6.290 -0.860 1.00 0.00 O ATOM 1526 CB ASP A 103 19.765 -8.555 -2.060 1.00 0.00 C ATOM 1527 CG ASP A 103 19.299 -8.735 -3.521 1.00 0.00 C ATOM 1528 OD1 ASP A 103 19.217 -9.874 -3.981 1.00 0.00 O ATOM 1529 OD2 ASP A 103 19.028 -7.732 -4.182 1.00 0.00 O ATOM 0 H ASP A 103 18.060 -10.352 -2.010 1.00 0.00 H new ATOM 0 HA ASP A 103 19.025 -8.468 -0.061 1.00 0.00 H new ATOM 0 HB2 ASP A 103 20.302 -7.611 -1.967 1.00 0.00 H new ATOM 0 HB3 ASP A 103 20.469 -9.348 -1.807 1.00 0.00 H new ATOM 1534 N VAL A 104 16.488 -7.734 -1.966 1.00 0.00 N ATOM 1535 CA VAL A 104 15.461 -6.749 -2.277 1.00 0.00 C ATOM 1536 C VAL A 104 14.932 -6.081 -1.010 1.00 0.00 C ATOM 1537 O VAL A 104 15.214 -4.911 -0.789 1.00 0.00 O ATOM 1538 CB VAL A 104 14.321 -7.329 -3.184 1.00 0.00 C ATOM 1539 CG1 VAL A 104 13.880 -8.750 -2.708 1.00 0.00 C ATOM 1540 CG2 VAL A 104 13.386 -6.445 -4.044 1.00 0.00 C ATOM 0 H VAL A 104 16.282 -8.674 -2.305 1.00 0.00 H new ATOM 0 HA VAL A 104 15.934 -5.968 -2.873 1.00 0.00 H new ATOM 0 HB VAL A 104 14.796 -7.423 -4.160 1.00 0.00 H new ATOM 0 HG11 VAL A 104 13.089 -9.122 -3.359 1.00 0.00 H new ATOM 0 HG12 VAL A 104 14.732 -9.428 -2.749 1.00 0.00 H new ATOM 0 HG13 VAL A 104 13.511 -8.692 -1.684 1.00 0.00 H new ATOM 0 HG21 VAL A 104 12.680 -7.078 -4.582 1.00 0.00 H new ATOM 0 HG22 VAL A 104 12.838 -5.759 -3.398 1.00 0.00 H new ATOM 0 HG23 VAL A 104 13.980 -5.875 -4.758 1.00 0.00 H new ATOM 1550 N GLU A 105 14.190 -6.851 -0.179 1.00 0.00 N ATOM 1551 CA GLU A 105 13.668 -6.226 1.023 1.00 0.00 C ATOM 1552 C GLU A 105 14.698 -6.399 2.145 1.00 0.00 C ATOM 1553 O GLU A 105 14.313 -6.359 3.299 1.00 0.00 O ATOM 1554 CB GLU A 105 12.283 -6.735 1.472 1.00 0.00 C ATOM 1555 CG GLU A 105 11.229 -6.907 0.363 1.00 0.00 C ATOM 1556 CD GLU A 105 10.616 -5.574 -0.112 1.00 0.00 C ATOM 1557 OE1 GLU A 105 10.098 -4.832 0.721 1.00 0.00 O ATOM 1558 OE2 GLU A 105 10.646 -5.298 -1.311 1.00 0.00 O ATOM 0 H GLU A 105 13.960 -7.835 -0.316 1.00 0.00 H new ATOM 0 HA GLU A 105 13.507 -5.174 0.788 1.00 0.00 H new ATOM 0 HB2 GLU A 105 12.416 -7.695 1.970 1.00 0.00 H new ATOM 0 HB3 GLU A 105 11.888 -6.043 2.215 1.00 0.00 H new ATOM 0 HG2 GLU A 105 11.687 -7.411 -0.488 1.00 0.00 H new ATOM 0 HG3 GLU A 105 10.432 -7.556 0.727 1.00 0.00 H new ATOM 1565 N GLN A 106 15.997 -6.607 1.814 1.00 0.00 N ATOM 1566 CA GLN A 106 16.998 -6.686 2.880 1.00 0.00 C ATOM 1567 C GLN A 106 17.182 -5.228 3.349 1.00 0.00 C ATOM 1568 O GLN A 106 17.254 -4.919 4.533 1.00 0.00 O ATOM 1569 CB GLN A 106 18.324 -7.261 2.356 1.00 0.00 C ATOM 1570 CG GLN A 106 19.427 -7.334 3.423 1.00 0.00 C ATOM 1571 CD GLN A 106 20.706 -7.946 2.834 1.00 0.00 C ATOM 1572 OE1 GLN A 106 21.687 -7.260 2.574 1.00 0.00 O ATOM 1573 NE2 GLN A 106 20.625 -9.276 2.646 1.00 0.00 N ATOM 0 H GLN A 106 16.353 -6.717 0.865 1.00 0.00 H new ATOM 0 HA GLN A 106 16.683 -7.346 3.688 1.00 0.00 H new ATOM 0 HB2 GLN A 106 18.146 -8.261 1.961 1.00 0.00 H new ATOM 0 HB3 GLN A 106 18.673 -6.648 1.526 1.00 0.00 H new ATOM 0 HG2 GLN A 106 19.638 -6.335 3.806 1.00 0.00 H new ATOM 0 HG3 GLN A 106 19.085 -7.933 4.267 1.00 0.00 H new ATOM 0 HE21 GLN A 106 19.769 -9.774 2.889 1.00 0.00 H new ATOM 0 HE22 GLN A 106 21.420 -9.786 2.260 1.00 0.00 H new ATOM 1582 N ARG A 107 17.233 -4.364 2.312 1.00 0.00 N ATOM 1583 CA ARG A 107 17.380 -2.934 2.494 1.00 0.00 C ATOM 1584 C ARG A 107 15.994 -2.387 2.861 1.00 0.00 C ATOM 1585 O ARG A 107 15.903 -1.430 3.621 1.00 0.00 O ATOM 1586 CB ARG A 107 17.984 -2.283 1.231 1.00 0.00 C ATOM 1587 CG ARG A 107 17.305 -2.712 -0.082 1.00 0.00 C ATOM 1588 CD ARG A 107 17.879 -2.032 -1.329 1.00 0.00 C ATOM 1589 NE ARG A 107 17.651 -0.593 -1.276 1.00 0.00 N ATOM 1590 CZ ARG A 107 17.766 0.202 -2.365 1.00 0.00 C ATOM 1591 NH1 ARG A 107 18.117 -0.294 -3.550 1.00 0.00 N ATOM 1592 NH2 ARG A 107 17.520 1.503 -2.251 1.00 0.00 N ATOM 0 H ARG A 107 17.172 -4.653 1.336 1.00 0.00 H new ATOM 0 HA ARG A 107 18.079 -2.696 3.296 1.00 0.00 H new ATOM 0 HB2 ARG A 107 17.916 -1.199 1.326 1.00 0.00 H new ATOM 0 HB3 ARG A 107 19.044 -2.532 1.178 1.00 0.00 H new ATOM 0 HG2 ARG A 107 17.400 -3.792 -0.193 1.00 0.00 H new ATOM 0 HG3 ARG A 107 16.240 -2.491 -0.018 1.00 0.00 H new ATOM 0 HD2 ARG A 107 18.948 -2.234 -1.402 1.00 0.00 H new ATOM 0 HD3 ARG A 107 17.414 -2.447 -2.223 1.00 0.00 H new ATOM 0 HE ARG A 107 17.395 -0.169 -0.384 1.00 0.00 H new ATOM 0 HH11 ARG A 107 18.305 -1.292 -3.650 1.00 0.00 H new ATOM 0 HH12 ARG A 107 18.198 0.324 -4.358 1.00 0.00 H new ATOM 0 HH21 ARG A 107 17.247 1.893 -1.349 1.00 0.00 H new ATOM 0 HH22 ARG A 107 17.604 2.111 -3.066 1.00 0.00 H new ATOM 1606 N PHE A 108 14.926 -3.035 2.322 1.00 0.00 N ATOM 1607 CA PHE A 108 13.586 -2.554 2.650 1.00 0.00 C ATOM 1608 C PHE A 108 13.056 -3.341 3.867 1.00 0.00 C ATOM 1609 O PHE A 108 11.855 -3.356 4.095 1.00 0.00 O ATOM 1610 CB PHE A 108 12.615 -2.612 1.456 1.00 0.00 C ATOM 1611 CG PHE A 108 13.223 -2.117 0.167 1.00 0.00 C ATOM 1612 CD1 PHE A 108 13.879 -0.890 0.103 1.00 0.00 C ATOM 1613 CD2 PHE A 108 13.132 -2.887 -0.988 1.00 0.00 C ATOM 1614 CE1 PHE A 108 14.433 -0.450 -1.090 1.00 0.00 C ATOM 1615 CE2 PHE A 108 13.686 -2.453 -2.182 1.00 0.00 C ATOM 1616 CZ PHE A 108 14.342 -1.235 -2.230 1.00 0.00 C ATOM 0 H PHE A 108 14.972 -3.841 1.698 1.00 0.00 H new ATOM 0 HA PHE A 108 13.654 -1.496 2.905 1.00 0.00 H new ATOM 0 HB2 PHE A 108 12.279 -3.640 1.320 1.00 0.00 H new ATOM 0 HB3 PHE A 108 11.732 -2.016 1.686 1.00 0.00 H new ATOM 0 HD1 PHE A 108 13.957 -0.277 0.989 1.00 0.00 H new ATOM 0 HD2 PHE A 108 12.622 -3.838 -0.954 1.00 0.00 H new ATOM 0 HE1 PHE A 108 14.936 0.505 -1.131 1.00 0.00 H new ATOM 0 HE2 PHE A 108 13.606 -3.062 -3.070 1.00 0.00 H new ATOM 0 HZ PHE A 108 14.783 -0.896 -3.156 1.00 0.00 H new ATOM 1626 N LYS A 109 13.968 -4.030 4.604 1.00 0.00 N ATOM 1627 CA LYS A 109 13.599 -4.746 5.830 1.00 0.00 C ATOM 1628 C LYS A 109 13.800 -3.702 6.933 1.00 0.00 C ATOM 1629 O LYS A 109 13.013 -3.580 7.863 1.00 0.00 O ATOM 1630 CB LYS A 109 14.452 -6.007 6.110 1.00 0.00 C ATOM 1631 CG LYS A 109 13.701 -7.336 5.895 1.00 0.00 C ATOM 1632 CD LYS A 109 12.969 -7.849 7.144 1.00 0.00 C ATOM 1633 CE LYS A 109 11.703 -7.058 7.483 1.00 0.00 C ATOM 1634 NZ LYS A 109 10.951 -7.671 8.572 1.00 0.00 N ATOM 0 H LYS A 109 14.957 -4.098 4.362 1.00 0.00 H new ATOM 0 HA LYS A 109 12.582 -5.132 5.759 1.00 0.00 H new ATOM 0 HB2 LYS A 109 15.330 -5.990 5.464 1.00 0.00 H new ATOM 0 HB3 LYS A 109 14.812 -5.968 7.138 1.00 0.00 H new ATOM 0 HG2 LYS A 109 12.978 -7.207 5.090 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.412 -8.094 5.566 1.00 0.00 H new ATOM 0 HD2 LYS A 109 12.704 -8.896 6.995 1.00 0.00 H new ATOM 0 HD3 LYS A 109 13.649 -7.811 7.995 1.00 0.00 H new ATOM 0 HE2 LYS A 109 11.975 -6.039 7.759 1.00 0.00 H new ATOM 0 HE3 LYS A 109 11.070 -6.990 6.598 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 10.102 -7.104 8.770 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 10.669 -8.634 8.300 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 11.546 -7.712 9.424 1.00 0.00 H new ATOM 1647 N ALA A 110 14.923 -2.960 6.740 1.00 0.00 N ATOM 1648 CA ALA A 110 15.346 -1.890 7.630 1.00 0.00 C ATOM 1649 C ALA A 110 14.230 -0.835 7.643 1.00 0.00 C ATOM 1650 O ALA A 110 13.961 -0.216 8.666 1.00 0.00 O ATOM 1651 CB ALA A 110 16.680 -1.301 7.148 1.00 0.00 C ATOM 0 H ALA A 110 15.553 -3.103 5.950 1.00 0.00 H new ATOM 0 HA ALA A 110 15.510 -2.260 8.642 1.00 0.00 H new ATOM 0 HB1 ALA A 110 16.989 -0.501 7.821 1.00 0.00 H new ATOM 0 HB2 ALA A 110 17.441 -2.082 7.140 1.00 0.00 H new ATOM 0 HB3 ALA A 110 16.559 -0.902 6.141 1.00 0.00 H new ATOM 1657 N MET A 111 13.596 -0.677 6.456 1.00 0.00 N ATOM 1658 CA MET A 111 12.492 0.256 6.318 1.00 0.00 C ATOM 1659 C MET A 111 11.286 -0.514 6.877 1.00 0.00 C ATOM 1660 O MET A 111 10.647 -0.097 7.835 1.00 0.00 O ATOM 1661 CB MET A 111 12.353 0.686 4.846 1.00 0.00 C ATOM 1662 CG MET A 111 13.631 1.364 4.334 1.00 0.00 C ATOM 1663 SD MET A 111 13.424 2.059 2.685 1.00 0.00 S ATOM 1664 CE MET A 111 12.975 3.741 3.149 1.00 0.00 C ATOM 0 H MET A 111 13.837 -1.182 5.603 1.00 0.00 H new ATOM 0 HA MET A 111 12.617 1.195 6.858 1.00 0.00 H new ATOM 0 HB2 MET A 111 12.131 -0.186 4.231 1.00 0.00 H new ATOM 0 HB3 MET A 111 11.511 1.371 4.744 1.00 0.00 H new ATOM 0 HG2 MET A 111 13.922 2.155 5.025 1.00 0.00 H new ATOM 0 HG3 MET A 111 14.444 0.638 4.320 1.00 0.00 H new ATOM 0 HE1 MET A 111 12.978 4.376 2.263 1.00 0.00 H new ATOM 0 HE2 MET A 111 11.980 3.742 3.593 1.00 0.00 H new ATOM 0 HE3 MET A 111 13.695 4.124 3.872 1.00 0.00 H new ATOM 1674 N GLY A 112 11.063 -1.673 6.212 1.00 0.00 N ATOM 1675 CA GLY A 112 10.037 -2.675 6.494 1.00 0.00 C ATOM 1676 C GLY A 112 8.709 -2.179 7.082 1.00 0.00 C ATOM 1677 O GLY A 112 8.139 -2.805 7.967 1.00 0.00 O ATOM 0 H GLY A 112 11.639 -1.939 5.414 1.00 0.00 H new ATOM 0 HA2 GLY A 112 9.818 -3.204 5.566 1.00 0.00 H new ATOM 0 HA3 GLY A 112 10.460 -3.405 7.185 1.00 0.00 H new ATOM 1681 N PHE A 113 8.251 -1.034 6.530 1.00 0.00 N ATOM 1682 CA PHE A 113 6.974 -0.471 6.964 1.00 0.00 C ATOM 1683 C PHE A 113 5.860 -1.173 6.154 1.00 0.00 C ATOM 1684 O PHE A 113 4.678 -0.962 6.397 1.00 0.00 O ATOM 1685 CB PHE A 113 6.950 1.064 6.811 1.00 0.00 C ATOM 1686 CG PHE A 113 7.408 1.529 5.454 1.00 0.00 C ATOM 1687 CD1 PHE A 113 6.608 1.338 4.331 1.00 0.00 C ATOM 1688 CD2 PHE A 113 8.641 2.157 5.304 1.00 0.00 C ATOM 1689 CE1 PHE A 113 7.038 1.752 3.080 1.00 0.00 C ATOM 1690 CE2 PHE A 113 9.067 2.583 4.054 1.00 0.00 C ATOM 1691 CZ PHE A 113 8.265 2.378 2.942 1.00 0.00 C ATOM 0 H PHE A 113 8.736 -0.503 5.806 1.00 0.00 H new ATOM 0 HA PHE A 113 6.815 -0.651 8.027 1.00 0.00 H new ATOM 0 HB2 PHE A 113 5.937 1.425 6.990 1.00 0.00 H new ATOM 0 HB3 PHE A 113 7.587 1.509 7.575 1.00 0.00 H new ATOM 0 HD1 PHE A 113 5.644 0.863 4.435 1.00 0.00 H new ATOM 0 HD2 PHE A 113 9.271 2.314 6.167 1.00 0.00 H new ATOM 0 HE1 PHE A 113 6.416 1.586 2.213 1.00 0.00 H new ATOM 0 HE2 PHE A 113 10.023 3.074 3.947 1.00 0.00 H new ATOM 0 HZ PHE A 113 8.597 2.707 1.968 1.00 0.00 H new ATOM 1701 N ASP A 114 6.308 -2.005 5.185 1.00 0.00 N ATOM 1702 CA ASP A 114 5.445 -2.767 4.309 1.00 0.00 C ATOM 1703 C ASP A 114 5.486 -4.202 4.846 1.00 0.00 C ATOM 1704 O ASP A 114 6.549 -4.742 5.130 1.00 0.00 O ATOM 1705 CB ASP A 114 5.935 -2.669 2.847 1.00 0.00 C ATOM 1706 CG ASP A 114 7.333 -3.292 2.631 1.00 0.00 C ATOM 1707 OD1 ASP A 114 8.325 -2.690 3.044 1.00 0.00 O ATOM 1708 OD2 ASP A 114 7.409 -4.376 2.052 1.00 0.00 O ATOM 0 H ASP A 114 7.300 -2.155 5.003 1.00 0.00 H new ATOM 0 HA ASP A 114 4.422 -2.391 4.299 1.00 0.00 H new ATOM 0 HB2 ASP A 114 5.217 -3.168 2.196 1.00 0.00 H new ATOM 0 HB3 ASP A 114 5.961 -1.621 2.549 1.00 0.00 H new ATOM 1713 N ARG A 115 4.269 -4.772 4.982 1.00 0.00 N ATOM 1714 CA ARG A 115 4.118 -6.144 5.443 1.00 0.00 C ATOM 1715 C ARG A 115 3.638 -6.856 4.178 1.00 0.00 C ATOM 1716 O ARG A 115 3.520 -6.230 3.133 1.00 0.00 O ATOM 1717 CB ARG A 115 3.161 -6.261 6.653 1.00 0.00 C ATOM 1718 CG ARG A 115 2.349 -5.001 7.005 1.00 0.00 C ATOM 1719 CD ARG A 115 3.168 -3.929 7.737 1.00 0.00 C ATOM 1720 NE ARG A 115 2.264 -2.968 8.354 1.00 0.00 N ATOM 1721 CZ ARG A 115 2.714 -1.982 9.160 1.00 0.00 C ATOM 1722 NH1 ARG A 115 4.017 -1.785 9.351 1.00 0.00 N ATOM 1723 NH2 ARG A 115 1.838 -1.199 9.778 1.00 0.00 N ATOM 0 H ARG A 115 3.390 -4.296 4.777 1.00 0.00 H new ATOM 0 HA ARG A 115 5.031 -6.586 5.842 1.00 0.00 H new ATOM 0 HB2 ARG A 115 2.463 -7.075 6.459 1.00 0.00 H new ATOM 0 HB3 ARG A 115 3.747 -6.545 7.527 1.00 0.00 H new ATOM 0 HG2 ARG A 115 1.942 -4.573 6.089 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.501 -5.287 7.627 1.00 0.00 H new ATOM 0 HD2 ARG A 115 3.798 -4.392 8.497 1.00 0.00 H new ATOM 0 HD3 ARG A 115 3.833 -3.422 7.037 1.00 0.00 H new ATOM 0 HE ARG A 115 1.263 -3.042 8.172 1.00 0.00 H new ATOM 0 HH11 ARG A 115 4.697 -2.385 8.884 1.00 0.00 H new ATOM 0 HH12 ARG A 115 4.335 -1.034 9.964 1.00 0.00 H new ATOM 0 HH21 ARG A 115 0.838 -1.346 9.642 1.00 0.00 H new ATOM 0 HH22 ARG A 115 2.165 -0.451 10.389 1.00 0.00 H new ATOM 1737 N VAL A 116 3.382 -8.179 4.295 1.00 0.00 N ATOM 1738 CA VAL A 116 2.927 -8.891 3.107 1.00 0.00 C ATOM 1739 C VAL A 116 1.842 -9.885 3.474 1.00 0.00 C ATOM 1740 O VAL A 116 1.696 -10.319 4.611 1.00 0.00 O ATOM 1741 CB VAL A 116 4.113 -9.614 2.377 1.00 0.00 C ATOM 1742 CG1 VAL A 116 5.093 -8.540 1.818 1.00 0.00 C ATOM 1743 CG2 VAL A 116 4.529 -11.090 2.616 1.00 0.00 C ATOM 0 H VAL A 116 3.478 -8.735 5.145 1.00 0.00 H new ATOM 0 HA VAL A 116 2.515 -8.157 2.415 1.00 0.00 H new ATOM 0 HB VAL A 116 3.681 -10.222 1.582 1.00 0.00 H new ATOM 0 HG11 VAL A 116 5.921 -9.033 1.309 1.00 0.00 H new ATOM 0 HG12 VAL A 116 4.565 -7.897 1.114 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.480 -7.937 2.640 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.380 -11.335 1.981 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.805 -11.225 3.662 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.694 -11.747 2.373 1.00 0.00 H new ATOM 1753 N TYR A 117 1.132 -10.243 2.380 1.00 0.00 N ATOM 1754 CA TYR A 117 0.047 -11.207 2.513 1.00 0.00 C ATOM 1755 C TYR A 117 0.676 -12.534 2.053 1.00 0.00 C ATOM 1756 O TYR A 117 1.631 -12.542 1.285 1.00 0.00 O ATOM 1757 CB TYR A 117 -1.133 -10.838 1.600 1.00 0.00 C ATOM 1758 CG TYR A 117 -1.918 -9.632 2.055 1.00 0.00 C ATOM 1759 CD1 TYR A 117 -1.336 -8.380 2.234 1.00 0.00 C ATOM 1760 CD2 TYR A 117 -3.284 -9.755 2.252 1.00 0.00 C ATOM 1761 CE1 TYR A 117 -2.104 -7.269 2.529 1.00 0.00 C ATOM 1762 CE2 TYR A 117 -4.067 -8.656 2.569 1.00 0.00 C ATOM 1763 CZ TYR A 117 -3.487 -7.391 2.678 1.00 0.00 C ATOM 1764 OH TYR A 117 -4.281 -6.280 2.920 1.00 0.00 O ATOM 0 H TYR A 117 1.290 -9.889 1.437 1.00 0.00 H new ATOM 0 HA TYR A 117 -0.350 -11.247 3.527 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -0.755 -10.652 0.595 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -1.807 -11.692 1.534 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -0.265 -8.275 2.141 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -3.748 -10.726 2.157 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -1.633 -6.304 2.645 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -5.128 -8.779 2.732 1.00 0.00 H new ATOM 0 HH TYR A 117 -4.148 -5.621 2.206 1.00 0.00 H new ATOM 1774 N PRO A 118 0.110 -13.672 2.559 1.00 0.00 N ATOM 1775 CA PRO A 118 0.625 -14.997 2.236 1.00 0.00 C ATOM 1776 C PRO A 118 0.204 -15.309 0.787 1.00 0.00 C ATOM 1777 O PRO A 118 -0.719 -14.702 0.255 1.00 0.00 O ATOM 1778 CB PRO A 118 -0.096 -15.927 3.228 1.00 0.00 C ATOM 1779 CG PRO A 118 -1.406 -15.203 3.540 1.00 0.00 C ATOM 1780 CD PRO A 118 -1.054 -13.716 3.453 1.00 0.00 C ATOM 0 HA PRO A 118 1.708 -15.098 2.309 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -0.278 -16.909 2.792 1.00 0.00 H new ATOM 0 HB3 PRO A 118 0.497 -16.083 4.129 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -2.186 -15.468 2.826 1.00 0.00 H new ATOM 0 HG3 PRO A 118 -1.778 -15.465 4.530 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -1.884 -13.133 3.054 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -0.818 -13.305 4.434 1.00 0.00 H new ATOM 1788 N PRO A 119 0.920 -16.296 0.166 1.00 0.00 N ATOM 1789 CA PRO A 119 0.627 -16.729 -1.197 1.00 0.00 C ATOM 1790 C PRO A 119 -0.667 -17.544 -1.053 1.00 0.00 C ATOM 1791 O PRO A 119 -0.716 -18.574 -0.393 1.00 0.00 O ATOM 1792 CB PRO A 119 1.834 -17.589 -1.597 1.00 0.00 C ATOM 1793 CG PRO A 119 2.422 -18.081 -0.270 1.00 0.00 C ATOM 1794 CD PRO A 119 2.063 -17.000 0.753 1.00 0.00 C ATOM 0 HA PRO A 119 0.485 -15.951 -1.948 1.00 0.00 H new ATOM 0 HB2 PRO A 119 1.532 -18.424 -2.230 1.00 0.00 H new ATOM 0 HB3 PRO A 119 2.563 -17.008 -2.162 1.00 0.00 H new ATOM 0 HG2 PRO A 119 2.002 -19.046 0.013 1.00 0.00 H new ATOM 0 HG3 PRO A 119 3.502 -18.212 -0.342 1.00 0.00 H new ATOM 0 HD2 PRO A 119 1.805 -17.438 1.717 1.00 0.00 H new ATOM 0 HD3 PRO A 119 2.900 -16.323 0.924 1.00 0.00 H new ATOM 1802 N GLY A 120 -1.697 -16.986 -1.716 1.00 0.00 N ATOM 1803 CA GLY A 120 -3.045 -17.533 -1.705 1.00 0.00 C ATOM 1804 C GLY A 120 -3.907 -16.519 -0.960 1.00 0.00 C ATOM 1805 O GLY A 120 -3.518 -16.029 0.094 1.00 0.00 O ATOM 0 H GLY A 120 -1.605 -16.138 -2.275 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -3.412 -17.685 -2.720 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -3.068 -18.503 -1.209 1.00 0.00 H new ATOM 1809 N THR A 121 -5.087 -16.221 -1.557 1.00 0.00 N ATOM 1810 CA THR A 121 -5.957 -15.238 -0.928 1.00 0.00 C ATOM 1811 C THR A 121 -6.580 -15.891 0.283 1.00 0.00 C ATOM 1812 O THR A 121 -6.656 -17.099 0.472 1.00 0.00 O ATOM 1813 CB THR A 121 -7.043 -14.631 -1.867 1.00 0.00 C ATOM 1814 OG1 THR A 121 -7.856 -13.525 -1.340 1.00 0.00 O ATOM 1815 CG2 THR A 121 -7.841 -15.736 -2.620 1.00 0.00 C ATOM 0 H THR A 121 -5.432 -16.630 -2.426 1.00 0.00 H new ATOM 0 HA THR A 121 -5.346 -14.380 -0.650 1.00 0.00 H new ATOM 0 HB THR A 121 -6.465 -14.088 -2.615 1.00 0.00 H new ATOM 0 HG1 THR A 121 -8.679 -13.445 -1.866 1.00 0.00 H new ATOM 0 HG21 THR A 121 -8.588 -15.271 -3.264 1.00 0.00 H new ATOM 0 HG22 THR A 121 -7.157 -16.329 -3.227 1.00 0.00 H new ATOM 0 HG23 THR A 121 -8.338 -16.383 -1.897 1.00 0.00 H new ATOM 1823 N SER A 122 -6.991 -14.905 1.077 1.00 0.00 N ATOM 1824 CA SER A 122 -7.614 -15.085 2.348 1.00 0.00 C ATOM 1825 C SER A 122 -8.014 -13.656 2.700 1.00 0.00 C ATOM 1826 O SER A 122 -7.164 -12.777 2.789 1.00 0.00 O ATOM 1827 CB SER A 122 -6.562 -15.619 3.354 1.00 0.00 C ATOM 1828 OG SER A 122 -5.236 -14.957 3.383 1.00 0.00 O ATOM 0 H SER A 122 -6.886 -13.923 0.824 1.00 0.00 H new ATOM 0 HA SER A 122 -8.447 -15.787 2.359 1.00 0.00 H new ATOM 0 HB2 SER A 122 -6.991 -15.554 4.354 1.00 0.00 H new ATOM 0 HB3 SER A 122 -6.404 -16.677 3.144 1.00 0.00 H new ATOM 0 HG SER A 122 -5.274 -14.174 3.972 1.00 0.00 H new ATOM 1834 N PRO A 123 -9.338 -13.435 2.899 1.00 0.00 N ATOM 1835 CA PRO A 123 -9.835 -12.109 3.220 1.00 0.00 C ATOM 1836 C PRO A 123 -9.577 -11.834 4.708 1.00 0.00 C ATOM 1837 O PRO A 123 -9.816 -10.731 5.179 1.00 0.00 O ATOM 1838 CB PRO A 123 -11.329 -12.230 2.935 1.00 0.00 C ATOM 1839 CG PRO A 123 -11.665 -13.694 3.210 1.00 0.00 C ATOM 1840 CD PRO A 123 -10.394 -14.448 2.826 1.00 0.00 C ATOM 0 HA PRO A 123 -9.368 -11.299 2.661 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -11.908 -11.565 3.575 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -11.558 -11.959 1.904 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -11.922 -13.854 4.257 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -12.519 -14.025 2.618 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -10.200 -15.275 3.509 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -10.470 -14.872 1.825 1.00 0.00 H new ATOM 1848 N GLU A 124 -9.073 -12.889 5.397 1.00 0.00 N ATOM 1849 CA GLU A 124 -8.731 -12.916 6.803 1.00 0.00 C ATOM 1850 C GLU A 124 -7.590 -11.919 7.025 1.00 0.00 C ATOM 1851 O GLU A 124 -7.539 -11.224 8.033 1.00 0.00 O ATOM 1852 CB GLU A 124 -8.284 -14.351 7.141 1.00 0.00 C ATOM 1853 CG GLU A 124 -7.739 -14.509 8.568 1.00 0.00 C ATOM 1854 CD GLU A 124 -7.437 -15.986 8.873 1.00 0.00 C ATOM 1855 OE1 GLU A 124 -6.329 -16.435 8.578 1.00 0.00 O ATOM 1856 OE2 GLU A 124 -8.311 -16.672 9.403 1.00 0.00 O ATOM 0 H GLU A 124 -8.892 -13.784 4.942 1.00 0.00 H new ATOM 0 HA GLU A 124 -9.571 -12.641 7.441 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -9.129 -15.026 7.008 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -7.515 -14.659 6.432 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -6.832 -13.916 8.684 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -8.465 -14.125 9.285 1.00 0.00 H new ATOM 1863 N THR A 125 -6.688 -11.894 6.019 1.00 0.00 N ATOM 1864 CA THR A 125 -5.532 -11.033 6.072 1.00 0.00 C ATOM 1865 C THR A 125 -5.993 -9.594 5.816 1.00 0.00 C ATOM 1866 O THR A 125 -5.302 -8.668 6.219 1.00 0.00 O ATOM 1867 CB THR A 125 -4.498 -11.483 4.991 1.00 0.00 C ATOM 1868 OG1 THR A 125 -4.467 -12.879 4.565 1.00 0.00 O ATOM 1869 CG2 THR A 125 -3.087 -10.922 5.301 1.00 0.00 C ATOM 0 H THR A 125 -6.755 -12.463 5.175 1.00 0.00 H new ATOM 0 HA THR A 125 -5.052 -11.092 7.049 1.00 0.00 H new ATOM 0 HB THR A 125 -4.903 -11.023 4.090 1.00 0.00 H new ATOM 0 HG1 THR A 125 -3.980 -12.952 3.718 1.00 0.00 H new ATOM 0 HG21 THR A 125 -2.388 -11.251 4.532 1.00 0.00 H new ATOM 0 HG22 THR A 125 -3.124 -9.833 5.316 1.00 0.00 H new ATOM 0 HG23 THR A 125 -2.756 -11.287 6.273 1.00 0.00 H new ATOM 1877 N THR A 126 -7.161 -9.421 5.135 1.00 0.00 N ATOM 1878 CA THR A 126 -7.577 -8.059 4.883 1.00 0.00 C ATOM 1879 C THR A 126 -8.280 -7.493 6.112 1.00 0.00 C ATOM 1880 O THR A 126 -8.310 -6.283 6.305 1.00 0.00 O ATOM 1881 CB THR A 126 -8.502 -7.768 3.697 1.00 0.00 C ATOM 1882 OG1 THR A 126 -9.948 -7.857 3.911 1.00 0.00 O ATOM 1883 CG2 THR A 126 -8.000 -8.388 2.368 1.00 0.00 C ATOM 0 H THR A 126 -7.772 -10.159 4.785 1.00 0.00 H new ATOM 0 HA THR A 126 -6.625 -7.593 4.630 1.00 0.00 H new ATOM 0 HB THR A 126 -8.403 -6.688 3.593 1.00 0.00 H new ATOM 0 HG1 THR A 126 -10.412 -7.770 3.052 1.00 0.00 H new ATOM 0 HG21 THR A 126 -8.699 -8.146 1.567 1.00 0.00 H new ATOM 0 HG22 THR A 126 -7.017 -7.984 2.126 1.00 0.00 H new ATOM 0 HG23 THR A 126 -7.931 -9.471 2.475 1.00 0.00 H new ATOM 1891 N ILE A 127 -8.862 -8.391 6.939 1.00 0.00 N ATOM 1892 CA ILE A 127 -9.473 -7.876 8.159 1.00 0.00 C ATOM 1893 C ILE A 127 -8.278 -7.373 9.004 1.00 0.00 C ATOM 1894 O ILE A 127 -8.407 -6.477 9.829 1.00 0.00 O ATOM 1895 CB ILE A 127 -10.305 -8.960 8.915 1.00 0.00 C ATOM 1896 CG1 ILE A 127 -10.928 -10.070 8.052 1.00 0.00 C ATOM 1897 CG2 ILE A 127 -10.837 -8.356 10.255 1.00 0.00 C ATOM 1898 CD1 ILE A 127 -11.801 -11.101 8.795 1.00 0.00 C ATOM 0 H ILE A 127 -8.916 -9.399 6.793 1.00 0.00 H new ATOM 0 HA ILE A 127 -10.193 -7.086 7.947 1.00 0.00 H new ATOM 0 HB ILE A 127 -9.798 -9.815 9.363 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -11.535 -9.602 7.278 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -10.123 -10.604 7.547 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -11.419 -9.108 10.788 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -9.995 -8.044 10.873 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -11.469 -7.494 10.040 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -12.185 -11.833 8.084 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -11.201 -11.609 9.550 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -12.635 -10.591 9.277 1.00 0.00 H new ATOM 1910 N ALA A 128 -7.108 -7.995 8.692 1.00 0.00 N ATOM 1911 CA ALA A 128 -5.861 -7.674 9.324 1.00 0.00 C ATOM 1912 C ALA A 128 -5.199 -6.526 8.554 1.00 0.00 C ATOM 1913 O ALA A 128 -4.194 -6.014 9.021 1.00 0.00 O ATOM 1914 CB ALA A 128 -4.963 -8.916 9.445 1.00 0.00 C ATOM 0 H ALA A 128 -7.036 -8.731 7.989 1.00 0.00 H new ATOM 0 HA ALA A 128 -6.035 -7.340 10.347 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -4.025 -8.641 9.928 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.470 -9.675 10.042 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.757 -9.314 8.451 1.00 0.00 H new ATOM 1920 N ASP A 129 -5.766 -6.099 7.396 1.00 0.00 N ATOM 1921 CA ASP A 129 -5.146 -5.008 6.656 1.00 0.00 C ATOM 1922 C ASP A 129 -5.157 -3.755 7.553 1.00 0.00 C ATOM 1923 O ASP A 129 -4.126 -3.182 7.881 1.00 0.00 O ATOM 1924 CB ASP A 129 -5.874 -4.731 5.323 1.00 0.00 C ATOM 1925 CG ASP A 129 -5.059 -3.897 4.306 1.00 0.00 C ATOM 1926 OD1 ASP A 129 -3.941 -3.483 4.611 1.00 0.00 O ATOM 1927 OD2 ASP A 129 -5.564 -3.663 3.209 1.00 0.00 O ATOM 0 H ASP A 129 -6.615 -6.484 6.981 1.00 0.00 H new ATOM 0 HA ASP A 129 -4.123 -5.284 6.400 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -6.138 -5.683 4.863 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -6.808 -4.210 5.535 1.00 0.00 H new ATOM 1932 N MET A 130 -6.398 -3.399 7.938 1.00 0.00 N ATOM 1933 CA MET A 130 -6.610 -2.205 8.745 1.00 0.00 C ATOM 1934 C MET A 130 -6.471 -2.526 10.244 1.00 0.00 C ATOM 1935 O MET A 130 -6.412 -1.598 11.038 1.00 0.00 O ATOM 1936 CB MET A 130 -8.011 -1.603 8.509 1.00 0.00 C ATOM 1937 CG MET A 130 -8.304 -1.170 7.073 1.00 0.00 C ATOM 1938 SD MET A 130 -7.054 -0.037 6.441 1.00 0.00 S ATOM 1939 CE MET A 130 -6.249 -1.134 5.264 1.00 0.00 C ATOM 0 H MET A 130 -7.246 -3.916 7.704 1.00 0.00 H new ATOM 0 HA MET A 130 -5.850 -1.484 8.443 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.759 -2.337 8.809 1.00 0.00 H new ATOM 0 HB3 MET A 130 -8.132 -0.739 9.163 1.00 0.00 H new ATOM 0 HG2 MET A 130 -8.353 -2.050 6.432 1.00 0.00 H new ATOM 0 HG3 MET A 130 -9.282 -0.691 7.031 1.00 0.00 H new ATOM 0 HE1 MET A 130 -5.217 -1.303 5.571 1.00 0.00 H new ATOM 0 HE2 MET A 130 -6.779 -2.086 5.233 1.00 0.00 H new ATOM 0 HE3 MET A 130 -6.263 -0.678 4.274 1.00 0.00 H new ATOM 1949 N LYS A 131 -6.431 -3.819 10.636 1.00 0.00 N ATOM 1950 CA LYS A 131 -6.348 -4.098 12.069 1.00 0.00 C ATOM 1951 C LYS A 131 -4.873 -4.177 12.483 1.00 0.00 C ATOM 1952 O LYS A 131 -4.465 -3.557 13.456 1.00 0.00 O ATOM 1953 CB LYS A 131 -7.135 -5.372 12.408 1.00 0.00 C ATOM 1954 CG LYS A 131 -7.141 -5.733 13.900 1.00 0.00 C ATOM 1955 CD LYS A 131 -8.039 -6.941 14.205 1.00 0.00 C ATOM 1956 CE LYS A 131 -7.580 -8.230 13.511 1.00 0.00 C ATOM 1957 NZ LYS A 131 -8.396 -9.380 13.881 1.00 0.00 N ATOM 0 H LYS A 131 -6.453 -4.631 10.020 1.00 0.00 H new ATOM 0 HA LYS A 131 -6.806 -3.291 12.641 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -8.165 -5.249 12.072 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -6.714 -6.206 11.846 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -6.123 -5.950 14.223 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -7.483 -4.874 14.478 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -8.062 -7.105 15.282 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -9.059 -6.714 13.896 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -7.620 -8.092 12.431 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -6.540 -8.428 13.769 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -8.047 -10.226 13.387 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -8.338 -9.530 14.908 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -9.385 -9.205 13.612 1.00 0.00 H new ATOM 1970 N GLU A 132 -4.095 -4.957 11.700 1.00 0.00 N ATOM 1971 CA GLU A 132 -2.680 -5.184 11.984 1.00 0.00 C ATOM 1972 C GLU A 132 -1.955 -3.846 12.119 1.00 0.00 C ATOM 1973 O GLU A 132 -1.206 -3.611 13.059 1.00 0.00 O ATOM 1974 CB GLU A 132 -2.018 -6.099 10.939 1.00 0.00 C ATOM 1975 CG GLU A 132 -0.613 -6.557 11.357 1.00 0.00 C ATOM 1976 CD GLU A 132 -0.014 -7.518 10.314 1.00 0.00 C ATOM 1977 OE1 GLU A 132 -0.460 -8.663 10.245 1.00 0.00 O ATOM 1978 OE2 GLU A 132 0.891 -7.114 9.584 1.00 0.00 O ATOM 0 H GLU A 132 -4.434 -5.437 10.866 1.00 0.00 H new ATOM 0 HA GLU A 132 -2.603 -5.712 12.934 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -2.648 -6.974 10.777 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -1.955 -5.571 9.987 1.00 0.00 H new ATOM 0 HG2 GLU A 132 0.037 -5.690 11.473 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -0.661 -7.051 12.327 1.00 0.00 H new ATOM 1985 N VAL A 133 -2.232 -2.992 11.125 1.00 0.00 N ATOM 1986 CA VAL A 133 -1.607 -1.673 11.110 1.00 0.00 C ATOM 1987 C VAL A 133 -2.183 -0.757 12.213 1.00 0.00 C ATOM 1988 O VAL A 133 -1.462 -0.301 13.092 1.00 0.00 O ATOM 1989 CB VAL A 133 -1.698 -1.060 9.668 1.00 0.00 C ATOM 1990 CG1 VAL A 133 -1.291 0.450 9.700 1.00 0.00 C ATOM 1991 CG2 VAL A 133 -1.478 -1.880 8.376 1.00 0.00 C ATOM 0 H VAL A 133 -2.863 -3.185 10.347 1.00 0.00 H new ATOM 0 HA VAL A 133 -0.548 -1.771 11.350 1.00 0.00 H new ATOM 0 HB VAL A 133 -2.757 -1.162 9.430 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -1.357 0.866 8.695 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -1.964 0.994 10.363 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -0.268 0.543 10.064 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -1.595 -1.230 7.509 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -0.473 -2.303 8.380 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -2.211 -2.686 8.327 1.00 0.00 H new ATOM 2001 N LEU A 134 -3.507 -0.515 12.098 1.00 0.00 N ATOM 2002 CA LEU A 134 -4.211 0.361 13.024 1.00 0.00 C ATOM 2003 C LEU A 134 -4.750 -0.462 14.205 1.00 0.00 C ATOM 2004 O LEU A 134 -5.933 -0.402 14.519 1.00 0.00 O ATOM 2005 CB LEU A 134 -5.312 1.156 12.295 1.00 0.00 C ATOM 2006 CG LEU A 134 -4.788 1.916 11.032 1.00 0.00 C ATOM 2007 CD1 LEU A 134 -4.836 1.004 9.769 1.00 0.00 C ATOM 2008 CD2 LEU A 134 -4.659 3.454 10.888 1.00 0.00 C ATOM 0 H LEU A 134 -4.097 -0.919 11.371 1.00 0.00 H new ATOM 0 HA LEU A 134 -3.519 1.100 13.429 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -6.107 0.473 11.996 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -5.752 1.874 12.987 1.00 0.00 H new ATOM 0 HG LEU A 134 -3.790 2.194 11.371 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -4.466 1.558 8.906 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -4.212 0.125 9.931 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -5.864 0.690 9.586 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -4.266 3.695 9.900 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -5.639 3.914 11.011 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -3.981 3.835 11.651 1.00 0.00 H new ATOM 2020 N GLY A 135 -3.836 -1.212 14.855 1.00 0.00 N ATOM 2021 CA GLY A 135 -4.231 -2.003 16.013 1.00 0.00 C ATOM 2022 C GLY A 135 -2.994 -2.504 16.757 1.00 0.00 C ATOM 2023 O GLY A 135 -2.614 -1.969 17.792 1.00 0.00 O ATOM 0 H GLY A 135 -2.851 -1.279 14.599 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -4.847 -1.401 16.681 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -4.840 -2.849 15.694 1.00 0.00 H new ATOM 2027 N VAL A 136 -2.399 -3.565 16.170 1.00 0.00 N ATOM 2028 CA VAL A 136 -1.211 -4.153 16.770 1.00 0.00 C ATOM 2029 C VAL A 136 -0.562 -5.082 15.738 1.00 0.00 C ATOM 2030 O VAL A 136 -1.216 -5.658 14.879 1.00 0.00 O ATOM 2031 CB VAL A 136 -1.580 -4.933 18.073 1.00 0.00 C ATOM 2032 CG1 VAL A 136 -0.398 -4.882 19.085 1.00 0.00 C ATOM 2033 CG2 VAL A 136 -3.013 -5.415 18.443 1.00 0.00 C ATOM 0 H VAL A 136 -2.718 -4.011 15.310 1.00 0.00 H new ATOM 0 HA VAL A 136 -0.508 -3.369 17.052 1.00 0.00 H new ATOM 0 HB VAL A 136 -1.918 -5.940 17.828 1.00 0.00 H new ATOM 0 HG11 VAL A 136 -0.668 -5.429 19.988 1.00 0.00 H new ATOM 0 HG12 VAL A 136 0.485 -5.336 18.636 1.00 0.00 H new ATOM 0 HG13 VAL A 136 -0.182 -3.845 19.340 1.00 0.00 H new ATOM 0 HG21 VAL A 136 -2.987 -5.931 19.403 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -3.680 -4.555 18.511 1.00 0.00 H new ATOM 0 HG23 VAL A 136 -3.377 -6.097 17.674 1.00 0.00 H new ATOM 2043 N GLU A 137 0.769 -5.183 15.905 1.00 0.00 N ATOM 2044 CA GLU A 137 1.586 -5.999 15.023 1.00 0.00 C ATOM 2045 C GLU A 137 2.772 -6.460 15.884 1.00 0.00 C ATOM 2046 O GLU A 137 3.546 -5.614 16.333 1.00 0.00 O ATOM 2047 CB GLU A 137 2.017 -5.166 13.801 1.00 0.00 C ATOM 2048 CG GLU A 137 2.835 -5.968 12.777 1.00 0.00 C ATOM 2049 CD GLU A 137 3.212 -5.083 11.577 1.00 0.00 C ATOM 2050 OE1 GLU A 137 2.329 -4.770 10.780 1.00 0.00 O ATOM 2051 OE2 GLU A 137 4.379 -4.714 11.450 1.00 0.00 O ATOM 2052 OXT GLU A 137 2.912 -7.664 16.096 1.00 0.00 O ATOM 0 H GLU A 137 1.289 -4.708 16.643 1.00 0.00 H new ATOM 0 HA GLU A 137 1.059 -6.864 14.620 1.00 0.00 H new ATOM 0 HB2 GLU A 137 1.129 -4.764 13.312 1.00 0.00 H new ATOM 0 HB3 GLU A 137 2.607 -4.314 14.140 1.00 0.00 H new ATOM 0 HG2 GLU A 137 3.738 -6.356 13.248 1.00 0.00 H new ATOM 0 HG3 GLU A 137 2.259 -6.828 12.435 1.00 0.00 H new TER 2059 GLU A 137 HETATM 2060 N4 FOP A 138 -0.016 -12.706 -10.492 1.00 0.00 N HETATM 2061 C5 FOP A 138 -0.152 -14.051 -11.047 1.00 0.00 C HETATM 2062 C6 FOP A 138 -1.470 -14.750 -10.674 1.00 0.00 C HETATM 2063 C7 FOP A 138 -1.529 -16.186 -11.217 1.00 0.00 C HETATM 2064 O7 FOP A 138 -1.789 -14.659 -9.294 1.00 0.00 O HETATM 0 H73 FOP A 138 -1.448 -16.168 -12.304 1.00 0.00 H new HETATM 0 H72 FOP A 138 -0.705 -16.766 -10.801 1.00 0.00 H new HETATM 0 H71 FOP A 138 -2.476 -16.644 -10.932 1.00 0.00 H new HETATM 0 H6 FOP A 138 -2.262 -14.195 -11.176 1.00 0.00 H new HETATM 0 H52 FOP A 138 -0.077 -13.994 -12.133 1.00 0.00 H new HETATM 0 H51 FOP A 138 0.682 -14.662 -10.701 1.00 0.00 H new HETATM 0 H43 FOP A 138 0.878 -12.308 -10.780 1.00 0.00 H new HETATM 0 H42 FOP A 138 -0.776 -12.118 -10.834 1.00 0.00 H new HETATM 0 H41 FOP A 138 -0.055 -12.752 -9.474 1.00 0.00 H new HETATM 2074 P DBI A 139 -1.071 -15.690 -8.323 1.00 0.00 P HETATM 2075 O1P DBI A 139 -1.806 -17.088 -8.412 1.00 0.00 O HETATM 2076 O2P DBI A 139 0.437 -15.892 -8.742 1.00 0.00 O HETATM 2077 O3' DBI A 139 -1.095 -15.138 -6.835 1.00 0.00 O HETATM 2078 O5' DBI A 139 -4.809 -16.687 -6.891 1.00 0.00 O HETATM 2079 C5' DBI A 139 -4.452 -15.409 -7.354 1.00 0.00 C HETATM 2080 C4' DBI A 139 -3.473 -14.716 -6.403 1.00 0.00 C HETATM 2081 O4' DBI A 139 -4.119 -14.472 -5.169 1.00 0.00 O HETATM 2082 C1' DBI A 139 -3.121 -14.361 -4.174 1.00 0.00 C HETATM 2083 N1 DBI A 139 -2.711 -12.968 -4.045 1.00 0.00 N HETATM 2084 C8 DBI A 139 -3.197 -12.034 -3.140 1.00 0.00 C HETATM 2085 C7 DBI A 139 -4.128 -12.093 -2.143 1.00 0.00 C HETATM 2086 C6 DBI A 139 -4.448 -10.974 -1.370 1.00 0.00 C HETATM 2087 C11 DBI A 139 -5.469 -11.118 -0.272 1.00 0.00 C HETATM 2088 C10 DBI A 139 -4.127 -8.483 -0.896 1.00 0.00 C HETATM 2089 C5 DBI A 139 -3.810 -9.753 -1.645 1.00 0.00 C HETATM 2090 C4 DBI A 139 -2.841 -9.710 -2.649 1.00 0.00 C HETATM 2091 C9 DBI A 139 -2.532 -10.811 -3.394 1.00 0.00 C HETATM 2092 N3 DBI A 139 -1.647 -11.030 -4.433 1.00 0.00 N HETATM 2093 C2 DBI A 139 -1.814 -12.315 -4.801 1.00 0.00 C HETATM 2094 C2' DBI A 139 -2.024 -15.347 -4.586 1.00 0.00 C HETATM 2095 O2' DBI A 139 -0.728 -14.975 -4.177 1.00 0.00 O HETATM 2096 C3' DBI A 139 -2.222 -15.534 -6.080 1.00 0.00 C HETATM 0 HO21 DBI A 139 -0.084 -15.652 -4.474 1.00 0.00 H new HETATM 0 H5'2 DBI A 139 -4.001 -15.493 -8.343 1.00 0.00 H new HETATM 0 H5'1 DBI A 139 -5.348 -14.798 -7.463 1.00 0.00 H new HETATM 0 H113 DBI A 139 -6.420 -11.438 -0.699 1.00 0.00 H new HETATM 0 H112 DBI A 139 -5.126 -11.861 0.448 1.00 0.00 H new HETATM 0 H111 DBI A 139 -5.601 -10.160 0.230 1.00 0.00 H new HETATM 0 H103 DBI A 139 -5.180 -8.235 -1.030 1.00 0.00 H new HETATM 0 H102 DBI A 139 -3.919 -8.625 0.165 1.00 0.00 H new HETATM 0 H101 DBI A 139 -3.511 -7.670 -1.281 1.00 0.00 H new HETATM 0 HO5 DBI A 139 -5.436 -17.100 -7.521 1.00 0.00 H new HETATM 0 H7 DBI A 139 -4.635 -13.038 -1.945 1.00 0.00 H new HETATM 0 H4' DBI A 139 -3.163 -13.807 -6.919 1.00 0.00 H new HETATM 0 H4 DBI A 139 -2.318 -8.774 -2.843 1.00 0.00 H new HETATM 0 H3' DBI A 139 -2.345 -16.584 -6.347 1.00 0.00 H new HETATM 0 H2' DBI A 139 -2.113 -16.303 -4.069 1.00 0.00 H new HETATM 0 H2 DBI A 139 -1.276 -12.778 -5.628 1.00 0.00 H new HETATM 0 H1' DBI A 139 -3.452 -14.626 -3.170 1.00 0.00 H new