USER MOD reduce.3.24.130724 H: found=0, std=0, add=1064, rem=0, adj=38 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 26 SER OG : rot 63:sc= 1.86 USER MOD Set 1.2: A 126 THR OG1 : rot 147:sc= 1.13 USER MOD Set 2.1: A 121 THR OG1 : rot -140:sc= 1.54 USER MOD Set 2.2: A 122 SER OG : rot 19:sc= 0.244 USER MOD Set 2.3: A 125 THR OG1 : rot 62:sc= 2.03 USER MOD Set 3.1: A 99 GLN : amide:sc= -0.774 K(o=-0.77,f=-1.4) USER MOD Set 3.2: A 109 LYS NZ :NH3+ 169:sc= 0 (180deg=-0.217) USER MOD Set 4.1: A 66 GLN : amide:sc= -0.615 K(o=-1.1,f=-3.5) USER MOD Set 4.2: A 93 ASN : amide:sc= -0.502 X(o=-1.1,f=-1.6) USER MOD Set 5.1: A 1 MET N :NH3+ -158:sc= -0.0747 (180deg=-0.782) USER MOD Set 5.2: A 84 LYS NZ :NH3+ -177:sc= -0.271 (180deg=-0.29) USER MOD Set 6.1: A 64 TYR OH : rot 72:sc= 1.11 USER MOD Set 6.2: A 71 CYS SG : rot 82:sc= 0.957 USER MOD Set 6.3: A 72 LYS NZ :NH3+ -125:sc= 0.639 (180deg=-0.0333) USER MOD Set 7.1: A 59 CYS SG : rot 15:sc= 0.617 USER MOD Set 7.2: A 117 TYR OH : rot 55:sc= -0.239 USER MOD Set 8.1: A 25 HIS :FLIP no HD1:sc= -0.139 F(o=-1.6,f=-0.86) USER MOD Set 8.2: A 29 ASN :FLIP amide:sc= -0.718 X(o=-1.1,f=-0.86) USER MOD Set 9.1: A 16 HIS : no HE2:sc= 0.107 K(o=0.1,f=-1.2) USER MOD Set 9.2: A 20 ASN : amide:sc=-0.00251 X(o=0.1,f=-0.073) USER MOD Set10.1: A 13 SER OG : rot 134:sc= -1.26! USER MOD Set10.2: A 138 FOP N4 :NH3+ -169:sc= -0.0455 (180deg=-0.165) USER MOD Set11.1: A 3 LYS NZ :NH3+ -142:sc= 0.746 (180deg=-0.0674) USER MOD Set11.2: A 5 THR OG1 : rot 142:sc= 1.5 USER MOD Single : A 1 MET CE :methyl -175:sc= -0.0106 (180deg=-0.0522) USER MOD Single : A 4 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.0011) USER MOD Single : A 15 CYS SG : rot 39:sc= -0.0638 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 THR OG1 : rot -68:sc= 0.118 USER MOD Single : A 33 ASN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 36 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 41 SER OG : rot 93:sc= 0.42 USER MOD Single : A 42 SER OG : rot 180:sc= 0.139 USER MOD Single : A 43 GLN :FLIP amide:sc= -0.847 F(o=-2.4,f=-0.85) USER MOD Single : A 48 ASN : amide:sc=-0.00184 X(o=-0.0018,f=0) USER MOD Single : A 53 THR OG1 : rot -120:sc= -0.0142 USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= -0.0247 (180deg=-0.0247) USER MOD Single : A 61 SER OG : rot 42:sc= 0.947 USER MOD Single : A 62 SER OG : rot 160:sc= -0.201 USER MOD Single : A 77 LYS NZ :NH3+ -138:sc= -1.27 (180deg=-2.79!) USER MOD Single : A 78 CYS SG : rot 176:sc= -0.893 USER MOD Single : A 87 LYS NZ :NH3+ -178:sc= 0 (180deg=-0.00462) USER MOD Single : A 98 LYS NZ :NH3+ 140:sc= -0.0637 (180deg=-1.31) USER MOD Single : A 100 ASN : amide:sc= 0.0341 K(o=0.034,f=-2.1!) USER MOD Single : A 106 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 111 MET CE :methyl -160:sc= 0 (180deg=-0.589) USER MOD Single : A 130 MET CE :methyl 166:sc= -0.831 (180deg=-1.29) USER MOD Single : A 131 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 139 DBI O2' : rot -124:sc= 0.123 USER MOD Single : A 139 DBI O5' : rot 180:sc= -0.0244 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -1.831 7.132 10.971 1.00 0.00 N ATOM 2 CA MET A 1 -1.609 5.740 11.298 1.00 0.00 C ATOM 3 C MET A 1 -2.989 5.084 11.394 1.00 0.00 C ATOM 4 O MET A 1 -3.151 3.924 11.036 1.00 0.00 O ATOM 5 CB MET A 1 -0.819 5.591 12.611 1.00 0.00 C ATOM 6 CG MET A 1 -0.575 4.122 12.982 1.00 0.00 C ATOM 7 SD MET A 1 0.506 3.955 14.410 1.00 0.00 S ATOM 8 CE MET A 1 0.794 2.180 14.298 1.00 0.00 C ATOM 0 H1 MET A 1 -0.973 7.528 10.537 1.00 0.00 H new ATOM 0 H2 MET A 1 -2.624 7.209 10.303 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.056 7.661 11.838 1.00 0.00 H new ATOM 0 HA MET A 1 -1.006 5.254 10.531 1.00 0.00 H new ATOM 0 HB2 MET A 1 0.139 6.103 12.516 1.00 0.00 H new ATOM 0 HB3 MET A 1 -1.364 6.081 13.418 1.00 0.00 H new ATOM 0 HG2 MET A 1 -1.529 3.638 13.192 1.00 0.00 H new ATOM 0 HG3 MET A 1 -0.134 3.602 12.131 1.00 0.00 H new ATOM 0 HE1 MET A 1 1.379 1.851 15.157 1.00 0.00 H new ATOM 0 HE2 MET A 1 -0.162 1.656 14.288 1.00 0.00 H new ATOM 0 HE3 MET A 1 1.339 1.957 13.381 1.00 0.00 H new ATOM 20 N GLU A 2 -3.960 5.883 11.897 1.00 0.00 N ATOM 21 CA GLU A 2 -5.322 5.405 12.070 1.00 0.00 C ATOM 22 C GLU A 2 -6.247 6.320 11.252 1.00 0.00 C ATOM 23 O GLU A 2 -7.456 6.316 11.450 1.00 0.00 O ATOM 24 CB GLU A 2 -5.681 5.389 13.567 1.00 0.00 C ATOM 25 CG GLU A 2 -4.708 4.520 14.380 1.00 0.00 C ATOM 26 CD GLU A 2 -5.192 4.340 15.828 1.00 0.00 C ATOM 27 OE1 GLU A 2 -4.984 5.243 16.636 1.00 0.00 O ATOM 28 OE2 GLU A 2 -5.769 3.296 16.131 1.00 0.00 O ATOM 0 H GLU A 2 -3.812 6.851 12.183 1.00 0.00 H new ATOM 0 HA GLU A 2 -5.436 4.382 11.711 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -5.668 6.408 13.954 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -6.696 5.013 13.693 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -4.606 3.544 13.905 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -3.720 4.980 14.380 1.00 0.00 H new ATOM 35 N LYS A 3 -5.639 7.089 10.316 1.00 0.00 N ATOM 36 CA LYS A 3 -6.357 7.997 9.465 1.00 0.00 C ATOM 37 C LYS A 3 -7.168 7.152 8.466 1.00 0.00 C ATOM 38 O LYS A 3 -6.762 6.089 8.016 1.00 0.00 O ATOM 39 CB LYS A 3 -5.328 8.926 8.813 1.00 0.00 C ATOM 40 CG LYS A 3 -5.911 10.305 8.575 1.00 0.00 C ATOM 41 CD LYS A 3 -5.232 11.105 7.451 1.00 0.00 C ATOM 42 CE LYS A 3 -6.245 11.891 6.610 1.00 0.00 C ATOM 43 NZ LYS A 3 -7.087 11.044 5.775 1.00 0.00 N ATOM 0 H LYS A 3 -4.633 7.078 10.150 1.00 0.00 H new ATOM 0 HA LYS A 3 -7.067 8.630 9.996 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -4.448 9.005 9.452 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -4.997 8.499 7.866 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -6.970 10.201 8.339 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -5.845 10.877 9.500 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -4.508 11.795 7.884 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -4.677 10.424 6.806 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -6.879 12.478 7.274 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -5.709 12.596 5.975 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -7.247 11.509 4.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -6.616 10.130 5.621 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -8.000 10.888 6.248 1.00 0.00 H new ATOM 56 N LYS A 4 -8.344 7.739 8.174 1.00 0.00 N ATOM 57 CA LYS A 4 -9.373 7.186 7.310 1.00 0.00 C ATOM 58 C LYS A 4 -8.967 7.430 5.860 1.00 0.00 C ATOM 59 O LYS A 4 -9.225 8.487 5.301 1.00 0.00 O ATOM 60 CB LYS A 4 -10.739 7.825 7.643 1.00 0.00 C ATOM 61 CG LYS A 4 -10.723 9.365 7.745 1.00 0.00 C ATOM 62 CD LYS A 4 -10.507 9.892 9.172 1.00 0.00 C ATOM 63 CE LYS A 4 -10.126 11.376 9.185 1.00 0.00 C ATOM 64 NZ LYS A 4 -11.181 12.235 8.661 1.00 0.00 N ATOM 0 H LYS A 4 -8.602 8.649 8.556 1.00 0.00 H new ATOM 0 HA LYS A 4 -9.474 6.112 7.468 1.00 0.00 H new ATOM 0 HB2 LYS A 4 -11.458 7.533 6.878 1.00 0.00 H new ATOM 0 HB3 LYS A 4 -11.096 7.416 8.588 1.00 0.00 H new ATOM 0 HG2 LYS A 4 -9.934 9.754 7.101 1.00 0.00 H new ATOM 0 HG3 LYS A 4 -11.667 9.754 7.363 1.00 0.00 H new ATOM 0 HD2 LYS A 4 -11.417 9.746 9.754 1.00 0.00 H new ATOM 0 HD3 LYS A 4 -9.722 9.312 9.658 1.00 0.00 H new ATOM 0 HE2 LYS A 4 -9.892 11.677 10.206 1.00 0.00 H new ATOM 0 HE3 LYS A 4 -9.221 11.519 8.595 1.00 0.00 H new ATOM 0 HZ1 LYS A 4 -10.876 13.228 8.709 1.00 0.00 H new ATOM 0 HZ2 LYS A 4 -11.377 11.980 7.672 1.00 0.00 H new ATOM 0 HZ3 LYS A 4 -12.044 12.110 9.228 1.00 0.00 H new ATOM 77 N THR A 5 -8.330 6.385 5.282 1.00 0.00 N ATOM 78 CA THR A 5 -7.875 6.450 3.898 1.00 0.00 C ATOM 79 C THR A 5 -7.048 5.169 3.699 1.00 0.00 C ATOM 80 O THR A 5 -5.979 4.996 4.267 1.00 0.00 O ATOM 81 CB THR A 5 -7.042 7.755 3.641 1.00 0.00 C ATOM 82 OG1 THR A 5 -6.496 8.373 4.848 1.00 0.00 O ATOM 83 CG2 THR A 5 -7.785 8.734 2.671 1.00 0.00 C ATOM 0 H THR A 5 -8.128 5.504 5.755 1.00 0.00 H new ATOM 0 HA THR A 5 -8.698 6.500 3.185 1.00 0.00 H new ATOM 0 HB THR A 5 -6.140 7.446 3.113 1.00 0.00 H new ATOM 0 HG1 THR A 5 -5.598 8.719 4.661 1.00 0.00 H new ATOM 0 HG21 THR A 5 -7.177 9.625 2.518 1.00 0.00 H new ATOM 0 HG22 THR A 5 -7.953 8.240 1.714 1.00 0.00 H new ATOM 0 HG23 THR A 5 -8.743 9.019 3.105 1.00 0.00 H new ATOM 91 N ILE A 6 -7.602 4.283 2.850 1.00 0.00 N ATOM 92 CA ILE A 6 -6.960 3.036 2.527 1.00 0.00 C ATOM 93 C ILE A 6 -7.271 2.883 1.057 1.00 0.00 C ATOM 94 O ILE A 6 -8.397 3.057 0.601 1.00 0.00 O ATOM 95 CB ILE A 6 -7.397 1.827 3.381 1.00 0.00 C ATOM 96 CG1 ILE A 6 -8.872 1.922 3.935 1.00 0.00 C ATOM 97 CG2 ILE A 6 -6.536 0.586 2.923 1.00 0.00 C ATOM 98 CD1 ILE A 6 -9.174 0.803 4.944 1.00 0.00 C ATOM 0 H ILE A 6 -8.498 4.427 2.384 1.00 0.00 H new ATOM 0 HA ILE A 6 -5.893 3.057 2.750 1.00 0.00 H new ATOM 0 HB ILE A 6 -7.170 1.704 4.440 1.00 0.00 H new ATOM 0 HG12 ILE A 6 -9.020 2.891 4.411 1.00 0.00 H new ATOM 0 HG13 ILE A 6 -9.577 1.864 3.105 1.00 0.00 H new ATOM 0 HG21 ILE A 6 -6.819 -0.289 3.508 1.00 0.00 H new ATOM 0 HG22 ILE A 6 -6.715 0.390 1.866 1.00 0.00 H new ATOM 0 HG23 ILE A 6 -5.479 0.799 3.079 1.00 0.00 H new ATOM 0 HD11 ILE A 6 -10.199 0.903 5.302 1.00 0.00 H new ATOM 0 HD12 ILE A 6 -9.052 -0.166 4.460 1.00 0.00 H new ATOM 0 HD13 ILE A 6 -8.486 0.877 5.786 1.00 0.00 H new ATOM 110 N VAL A 7 -6.170 2.555 0.365 1.00 0.00 N ATOM 111 CA VAL A 7 -6.175 2.423 -1.055 1.00 0.00 C ATOM 112 C VAL A 7 -5.637 1.065 -1.456 1.00 0.00 C ATOM 113 O VAL A 7 -4.713 0.535 -0.856 1.00 0.00 O ATOM 114 CB VAL A 7 -5.307 3.561 -1.691 1.00 0.00 C ATOM 115 CG1 VAL A 7 -4.661 4.501 -0.620 1.00 0.00 C ATOM 116 CG2 VAL A 7 -4.958 3.683 -3.203 1.00 0.00 C ATOM 0 H VAL A 7 -5.263 2.379 0.797 1.00 0.00 H new ATOM 0 HA VAL A 7 -7.199 2.510 -1.419 1.00 0.00 H new ATOM 0 HB VAL A 7 -5.898 3.899 -2.542 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -4.071 5.270 -1.119 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -5.446 4.972 -0.029 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -4.015 3.916 0.035 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -4.342 4.568 -3.364 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -4.410 2.797 -3.523 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -5.877 3.770 -3.783 1.00 0.00 H new ATOM 126 N LEU A 8 -6.314 0.533 -2.500 1.00 0.00 N ATOM 127 CA LEU A 8 -5.908 -0.755 -3.055 1.00 0.00 C ATOM 128 C LEU A 8 -5.686 -0.513 -4.536 1.00 0.00 C ATOM 129 O LEU A 8 -6.099 0.506 -5.082 1.00 0.00 O ATOM 130 CB LEU A 8 -6.902 -1.901 -2.798 1.00 0.00 C ATOM 131 CG LEU A 8 -8.234 -1.877 -3.621 1.00 0.00 C ATOM 132 CD1 LEU A 8 -8.022 -2.370 -5.086 1.00 0.00 C ATOM 133 CD2 LEU A 8 -9.595 -2.141 -2.984 1.00 0.00 C ATOM 0 H LEU A 8 -7.117 0.968 -2.955 1.00 0.00 H new ATOM 0 HA LEU A 8 -5.003 -1.100 -2.556 1.00 0.00 H new ATOM 0 HB2 LEU A 8 -6.394 -2.844 -3.001 1.00 0.00 H new ATOM 0 HB3 LEU A 8 -7.157 -1.898 -1.738 1.00 0.00 H new ATOM 0 HG LEU A 8 -8.435 -0.806 -3.630 1.00 0.00 H new ATOM 0 HD11 LEU A 8 -8.971 -2.337 -5.622 1.00 0.00 H new ATOM 0 HD12 LEU A 8 -7.300 -1.724 -5.586 1.00 0.00 H new ATOM 0 HD13 LEU A 8 -7.647 -3.393 -5.075 1.00 0.00 H new ATOM 0 HD21 LEU A 8 -10.372 -2.072 -3.745 1.00 0.00 H new ATOM 0 HD22 LEU A 8 -9.604 -3.139 -2.545 1.00 0.00 H new ATOM 0 HD23 LEU A 8 -9.782 -1.401 -2.206 1.00 0.00 H new ATOM 145 N GLY A 9 -5.041 -1.546 -5.138 1.00 0.00 N ATOM 146 CA GLY A 9 -4.786 -1.504 -6.568 1.00 0.00 C ATOM 147 C GLY A 9 -4.015 -2.720 -7.084 1.00 0.00 C ATOM 148 O GLY A 9 -3.779 -3.696 -6.390 1.00 0.00 O ATOM 0 H GLY A 9 -4.705 -2.382 -4.660 1.00 0.00 H new ATOM 0 HA2 GLY A 9 -5.736 -1.435 -7.097 1.00 0.00 H new ATOM 0 HA3 GLY A 9 -4.224 -0.600 -6.803 1.00 0.00 H new ATOM 152 N VAL A 10 -3.667 -2.536 -8.376 1.00 0.00 N ATOM 153 CA VAL A 10 -2.893 -3.420 -9.241 1.00 0.00 C ATOM 154 C VAL A 10 -3.614 -4.729 -9.639 1.00 0.00 C ATOM 155 O VAL A 10 -4.703 -4.686 -10.195 1.00 0.00 O ATOM 156 CB VAL A 10 -1.375 -3.507 -8.879 1.00 0.00 C ATOM 157 CG1 VAL A 10 -1.142 -4.149 -7.491 1.00 0.00 C ATOM 158 CG2 VAL A 10 -0.236 -3.108 -9.874 1.00 0.00 C ATOM 0 H VAL A 10 -3.950 -1.691 -8.872 1.00 0.00 H new ATOM 0 HA VAL A 10 -2.850 -2.916 -10.206 1.00 0.00 H new ATOM 0 HB VAL A 10 -0.668 -2.709 -9.105 1.00 0.00 H new ATOM 0 HG11 VAL A 10 -0.073 -4.188 -7.283 1.00 0.00 H new ATOM 0 HG12 VAL A 10 -1.639 -3.552 -6.726 1.00 0.00 H new ATOM 0 HG13 VAL A 10 -1.550 -5.160 -7.484 1.00 0.00 H new ATOM 0 HG21 VAL A 10 0.733 -3.254 -9.396 1.00 0.00 H new ATOM 0 HG22 VAL A 10 -0.298 -3.731 -10.766 1.00 0.00 H new ATOM 0 HG23 VAL A 10 -0.348 -2.061 -10.154 1.00 0.00 H new ATOM 168 N ILE A 11 -2.928 -5.869 -9.356 1.00 0.00 N ATOM 169 CA ILE A 11 -3.308 -7.262 -9.627 1.00 0.00 C ATOM 170 C ILE A 11 -3.573 -7.427 -11.145 1.00 0.00 C ATOM 171 O ILE A 11 -4.522 -6.877 -11.690 1.00 0.00 O ATOM 172 CB ILE A 11 -4.442 -7.839 -8.702 1.00 0.00 C ATOM 173 CG1 ILE A 11 -4.364 -9.360 -8.386 1.00 0.00 C ATOM 174 CG2 ILE A 11 -5.634 -6.849 -8.520 1.00 0.00 C ATOM 175 CD1 ILE A 11 -3.164 -9.942 -7.599 1.00 0.00 C ATOM 0 H ILE A 11 -2.020 -5.821 -8.894 1.00 0.00 H new ATOM 0 HA ILE A 11 -2.464 -7.895 -9.351 1.00 0.00 H new ATOM 0 HB ILE A 11 -4.470 -7.934 -7.617 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -5.267 -9.620 -7.833 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -4.410 -9.889 -9.338 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -6.386 -7.300 -7.873 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -5.274 -5.925 -8.068 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -6.076 -6.629 -9.492 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -3.294 -11.018 -7.481 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -2.241 -9.746 -8.145 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -3.111 -9.473 -6.617 1.00 0.00 H new ATOM 187 N GLY A 12 -2.686 -8.239 -11.792 1.00 0.00 N ATOM 188 CA GLY A 12 -2.810 -8.473 -13.224 1.00 0.00 C ATOM 189 C GLY A 12 -2.020 -9.724 -13.566 1.00 0.00 C ATOM 190 O GLY A 12 -0.912 -9.686 -14.086 1.00 0.00 O ATOM 0 H GLY A 12 -1.907 -8.720 -11.342 1.00 0.00 H new ATOM 0 HA2 GLY A 12 -3.857 -8.596 -13.501 1.00 0.00 H new ATOM 0 HA3 GLY A 12 -2.431 -7.618 -13.784 1.00 0.00 H new ATOM 194 N SER A 13 -2.707 -10.829 -13.228 1.00 0.00 N ATOM 195 CA SER A 13 -2.172 -12.155 -13.389 1.00 0.00 C ATOM 196 C SER A 13 -3.226 -12.970 -14.147 1.00 0.00 C ATOM 197 O SER A 13 -2.894 -13.809 -14.976 1.00 0.00 O ATOM 198 CB SER A 13 -1.923 -12.628 -11.929 1.00 0.00 C ATOM 199 OG SER A 13 -1.525 -11.615 -10.912 1.00 0.00 O ATOM 0 H SER A 13 -3.649 -10.807 -12.837 1.00 0.00 H new ATOM 0 HA SER A 13 -1.248 -12.243 -13.961 1.00 0.00 H new ATOM 0 HB2 SER A 13 -2.835 -13.111 -11.577 1.00 0.00 H new ATOM 0 HB3 SER A 13 -1.147 -13.393 -11.956 1.00 0.00 H new ATOM 0 HG SER A 13 -2.055 -11.743 -10.098 1.00 0.00 H new ATOM 205 N ASP A 14 -4.507 -12.680 -13.817 1.00 0.00 N ATOM 206 CA ASP A 14 -5.621 -13.359 -14.444 1.00 0.00 C ATOM 207 C ASP A 14 -6.798 -12.386 -14.255 1.00 0.00 C ATOM 208 O ASP A 14 -6.591 -11.188 -14.097 1.00 0.00 O ATOM 209 CB ASP A 14 -5.800 -14.751 -13.787 1.00 0.00 C ATOM 210 CG ASP A 14 -6.702 -15.705 -14.595 1.00 0.00 C ATOM 211 OD1 ASP A 14 -6.449 -15.892 -15.785 1.00 0.00 O ATOM 212 OD2 ASP A 14 -7.646 -16.251 -14.025 1.00 0.00 O ATOM 0 H ASP A 14 -4.774 -11.982 -13.123 1.00 0.00 H new ATOM 0 HA ASP A 14 -5.501 -13.579 -15.505 1.00 0.00 H new ATOM 0 HB2 ASP A 14 -4.820 -15.212 -13.660 1.00 0.00 H new ATOM 0 HB3 ASP A 14 -6.223 -14.621 -12.791 1.00 0.00 H new ATOM 217 N CYS A 15 -8.035 -12.948 -14.282 1.00 0.00 N ATOM 218 CA CYS A 15 -9.229 -12.138 -14.078 1.00 0.00 C ATOM 219 C CYS A 15 -9.254 -11.887 -12.565 1.00 0.00 C ATOM 220 O CYS A 15 -9.676 -12.722 -11.775 1.00 0.00 O ATOM 221 CB CYS A 15 -10.478 -12.882 -14.576 1.00 0.00 C ATOM 222 SG CYS A 15 -10.688 -14.541 -13.879 1.00 0.00 S ATOM 0 H CYS A 15 -8.213 -13.940 -14.441 1.00 0.00 H new ATOM 0 HA CYS A 15 -9.219 -11.202 -14.636 1.00 0.00 H new ATOM 0 HB2 CYS A 15 -11.360 -12.287 -14.338 1.00 0.00 H new ATOM 0 HB3 CYS A 15 -10.430 -12.961 -15.662 1.00 0.00 H new ATOM 0 HG CYS A 15 -10.342 -14.532 -12.626 1.00 0.00 H new ATOM 228 N HIS A 16 -8.747 -10.673 -12.246 1.00 0.00 N ATOM 229 CA HIS A 16 -8.580 -10.162 -10.895 1.00 0.00 C ATOM 230 C HIS A 16 -7.280 -10.813 -10.410 1.00 0.00 C ATOM 231 O HIS A 16 -6.206 -10.262 -10.600 1.00 0.00 O ATOM 232 CB HIS A 16 -9.790 -10.350 -9.952 1.00 0.00 C ATOM 233 CG HIS A 16 -10.976 -9.581 -10.485 1.00 0.00 C ATOM 234 ND1 HIS A 16 -11.170 -8.261 -10.274 1.00 0.00 N ATOM 235 CD2 HIS A 16 -12.040 -10.067 -11.261 1.00 0.00 C ATOM 236 CE1 HIS A 16 -12.317 -7.955 -10.903 1.00 0.00 C ATOM 237 NE2 HIS A 16 -12.865 -9.025 -11.508 1.00 0.00 N ATOM 0 H HIS A 16 -8.437 -10.011 -12.958 1.00 0.00 H new ATOM 0 HA HIS A 16 -8.520 -9.074 -10.892 1.00 0.00 H new ATOM 0 HB2 HIS A 16 -10.038 -11.408 -9.870 1.00 0.00 H new ATOM 0 HB3 HIS A 16 -9.540 -10.002 -8.950 1.00 0.00 H new ATOM 0 HD1 HIS A 16 -10.570 -7.627 -9.746 1.00 0.00 H new ATOM 0 HD2 HIS A 16 -12.174 -11.084 -11.598 1.00 0.00 H new ATOM 0 HE1 HIS A 16 -12.749 -6.965 -10.921 1.00 0.00 H new ATOM 245 N ALA A 17 -7.458 -12.014 -9.811 1.00 0.00 N ATOM 246 CA ALA A 17 -6.416 -12.868 -9.250 1.00 0.00 C ATOM 247 C ALA A 17 -6.308 -12.516 -7.758 1.00 0.00 C ATOM 248 O ALA A 17 -5.235 -12.564 -7.172 1.00 0.00 O ATOM 249 CB ALA A 17 -5.058 -12.811 -9.983 1.00 0.00 C ATOM 0 H ALA A 17 -8.386 -12.424 -9.707 1.00 0.00 H new ATOM 0 HA ALA A 17 -6.705 -13.910 -9.387 1.00 0.00 H new ATOM 0 HB1 ALA A 17 -4.351 -13.479 -9.491 1.00 0.00 H new ATOM 0 HB2 ALA A 17 -5.191 -13.122 -11.019 1.00 0.00 H new ATOM 0 HB3 ALA A 17 -4.673 -11.792 -9.956 1.00 0.00 H new ATOM 255 N VAL A 18 -7.489 -12.163 -7.190 1.00 0.00 N ATOM 256 CA VAL A 18 -7.668 -11.797 -5.781 1.00 0.00 C ATOM 257 C VAL A 18 -6.768 -10.562 -5.437 1.00 0.00 C ATOM 258 O VAL A 18 -5.545 -10.632 -5.416 1.00 0.00 O ATOM 259 CB VAL A 18 -7.405 -13.050 -4.834 1.00 0.00 C ATOM 260 CG1 VAL A 18 -7.510 -13.318 -3.278 1.00 0.00 C ATOM 261 CG2 VAL A 18 -8.172 -14.234 -5.467 1.00 0.00 C ATOM 0 H VAL A 18 -8.359 -12.127 -7.721 1.00 0.00 H new ATOM 0 HA VAL A 18 -8.702 -11.500 -5.605 1.00 0.00 H new ATOM 0 HB VAL A 18 -6.337 -12.832 -4.804 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -7.226 -14.349 -3.066 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -6.841 -12.641 -2.746 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -8.535 -13.149 -2.948 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -8.029 -15.127 -4.859 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -9.234 -13.995 -5.516 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -7.794 -14.416 -6.473 1.00 0.00 H new ATOM 271 N GLY A 19 -7.476 -9.453 -5.142 1.00 0.00 N ATOM 272 CA GLY A 19 -6.809 -8.208 -4.784 1.00 0.00 C ATOM 273 C GLY A 19 -7.852 -7.223 -4.268 1.00 0.00 C ATOM 274 O GLY A 19 -8.047 -7.036 -3.074 1.00 0.00 O ATOM 0 H GLY A 19 -8.495 -9.404 -5.147 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -6.053 -8.391 -4.021 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -6.294 -7.793 -5.650 1.00 0.00 H new ATOM 278 N ASN A 20 -8.553 -6.651 -5.268 1.00 0.00 N ATOM 279 CA ASN A 20 -9.624 -5.689 -5.040 1.00 0.00 C ATOM 280 C ASN A 20 -10.880 -6.453 -4.529 1.00 0.00 C ATOM 281 O ASN A 20 -11.913 -5.850 -4.256 1.00 0.00 O ATOM 282 CB ASN A 20 -9.903 -4.959 -6.374 1.00 0.00 C ATOM 283 CG ASN A 20 -10.301 -5.928 -7.506 1.00 0.00 C ATOM 284 OD1 ASN A 20 -9.459 -6.471 -8.211 1.00 0.00 O ATOM 285 ND2 ASN A 20 -11.630 -6.098 -7.630 1.00 0.00 N ATOM 0 H ASN A 20 -8.384 -6.851 -6.254 1.00 0.00 H new ATOM 0 HA ASN A 20 -9.349 -4.950 -4.288 1.00 0.00 H new ATOM 0 HB2 ASN A 20 -10.701 -4.231 -6.226 1.00 0.00 H new ATOM 0 HB3 ASN A 20 -9.015 -4.402 -6.672 1.00 0.00 H new ATOM 0 HD21 ASN A 20 -12.000 -6.716 -8.352 1.00 0.00 H new ATOM 0 HD22 ASN A 20 -12.268 -5.609 -7.002 1.00 0.00 H new ATOM 292 N LYS A 21 -10.689 -7.795 -4.422 1.00 0.00 N ATOM 293 CA LYS A 21 -11.540 -8.889 -4.044 1.00 0.00 C ATOM 294 C LYS A 21 -11.516 -8.899 -2.521 1.00 0.00 C ATOM 295 O LYS A 21 -10.913 -9.711 -1.836 1.00 0.00 O ATOM 296 CB LYS A 21 -10.974 -10.186 -4.659 1.00 0.00 C ATOM 297 CG LYS A 21 -11.921 -11.397 -4.630 1.00 0.00 C ATOM 298 CD LYS A 21 -12.116 -12.018 -3.238 1.00 0.00 C ATOM 299 CE LYS A 21 -12.836 -13.369 -3.288 1.00 0.00 C ATOM 300 NZ LYS A 21 -14.213 -13.256 -3.754 1.00 0.00 N ATOM 0 H LYS A 21 -9.764 -8.162 -4.645 1.00 0.00 H new ATOM 0 HA LYS A 21 -12.566 -8.799 -4.400 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -10.698 -9.987 -5.694 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -10.058 -10.449 -4.130 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -12.893 -11.092 -5.018 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -11.534 -12.161 -5.304 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -11.144 -12.147 -2.763 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -12.687 -11.330 -2.615 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -12.288 -14.044 -3.946 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -12.829 -13.817 -2.294 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -14.653 -14.198 -3.769 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -14.747 -12.635 -3.113 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -14.223 -12.854 -4.713 1.00 0.00 H new ATOM 313 N ILE A 22 -12.242 -7.868 -2.113 1.00 0.00 N ATOM 314 CA ILE A 22 -12.612 -7.474 -0.784 1.00 0.00 C ATOM 315 C ILE A 22 -11.646 -6.467 -0.192 1.00 0.00 C ATOM 316 O ILE A 22 -11.787 -6.194 0.993 1.00 0.00 O ATOM 317 CB ILE A 22 -13.009 -8.682 0.098 1.00 0.00 C ATOM 318 CG1 ILE A 22 -14.420 -9.251 -0.313 1.00 0.00 C ATOM 319 CG2 ILE A 22 -11.774 -9.320 0.845 1.00 0.00 C ATOM 320 CD1 ILE A 22 -14.916 -10.466 0.504 1.00 0.00 C ATOM 0 H ILE A 22 -12.626 -7.217 -2.798 1.00 0.00 H new ATOM 0 HA ILE A 22 -13.541 -6.906 -0.834 1.00 0.00 H new ATOM 0 HB ILE A 22 -13.416 -8.725 1.108 1.00 0.00 H new ATOM 0 HG12 ILE A 22 -15.155 -8.451 -0.222 1.00 0.00 H new ATOM 0 HG13 ILE A 22 -14.385 -9.534 -1.365 1.00 0.00 H new ATOM 0 HG21 ILE A 22 -12.110 -10.163 1.449 1.00 0.00 H new ATOM 0 HG22 ILE A 22 -11.045 -9.666 0.112 1.00 0.00 H new ATOM 0 HG23 ILE A 22 -11.313 -8.572 1.490 1.00 0.00 H new ATOM 0 HD11 ILE A 22 -15.895 -10.775 0.138 1.00 0.00 H new ATOM 0 HD12 ILE A 22 -14.211 -11.290 0.395 1.00 0.00 H new ATOM 0 HD13 ILE A 22 -14.992 -10.190 1.556 1.00 0.00 H new ATOM 332 N LEU A 23 -10.680 -5.896 -0.971 1.00 0.00 N ATOM 333 CA LEU A 23 -9.873 -4.880 -0.290 1.00 0.00 C ATOM 334 C LEU A 23 -10.762 -3.626 -0.172 1.00 0.00 C ATOM 335 O LEU A 23 -10.634 -2.872 0.787 1.00 0.00 O ATOM 336 CB LEU A 23 -8.451 -4.605 -0.829 1.00 0.00 C ATOM 337 CG LEU A 23 -7.363 -5.111 0.158 1.00 0.00 C ATOM 338 CD1 LEU A 23 -6.167 -5.579 -0.761 1.00 0.00 C ATOM 339 CD2 LEU A 23 -7.486 -4.141 1.409 1.00 0.00 C ATOM 0 H LEU A 23 -10.468 -6.097 -1.948 1.00 0.00 H new ATOM 0 HA LEU A 23 -9.598 -5.275 0.688 1.00 0.00 H new ATOM 0 HB2 LEU A 23 -8.325 -5.095 -1.794 1.00 0.00 H new ATOM 0 HB3 LEU A 23 -8.324 -3.535 -0.996 1.00 0.00 H new ATOM 0 HG LEU A 23 -7.334 -6.016 0.765 1.00 0.00 H new ATOM 0 HD11 LEU A 23 -5.354 -5.952 -0.138 1.00 0.00 H new ATOM 0 HD12 LEU A 23 -6.508 -6.372 -1.426 1.00 0.00 H new ATOM 0 HD13 LEU A 23 -5.812 -4.736 -1.354 1.00 0.00 H new ATOM 0 HD21 LEU A 23 -6.751 -4.424 2.163 1.00 0.00 H new ATOM 0 HD22 LEU A 23 -7.304 -3.114 1.092 1.00 0.00 H new ATOM 0 HD23 LEU A 23 -8.488 -4.218 1.832 1.00 0.00 H new ATOM 351 N ASP A 24 -11.683 -3.445 -1.160 1.00 0.00 N ATOM 352 CA ASP A 24 -12.591 -2.300 -1.035 1.00 0.00 C ATOM 353 C ASP A 24 -13.663 -2.684 0.008 1.00 0.00 C ATOM 354 O ASP A 24 -14.398 -1.834 0.491 1.00 0.00 O ATOM 355 CB ASP A 24 -13.312 -1.919 -2.358 1.00 0.00 C ATOM 356 CG ASP A 24 -12.597 -0.850 -3.213 1.00 0.00 C ATOM 357 OD1 ASP A 24 -11.956 0.041 -2.657 1.00 0.00 O ATOM 358 OD2 ASP A 24 -12.693 -0.919 -4.439 1.00 0.00 O ATOM 0 H ASP A 24 -11.804 -4.033 -1.985 1.00 0.00 H new ATOM 0 HA ASP A 24 -11.996 -1.434 -0.747 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -13.434 -2.820 -2.959 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -14.312 -1.559 -2.117 1.00 0.00 H new ATOM 363 N HIS A 25 -13.732 -3.982 0.357 1.00 0.00 N ATOM 364 CA HIS A 25 -14.759 -4.364 1.319 1.00 0.00 C ATOM 365 C HIS A 25 -14.280 -3.945 2.714 1.00 0.00 C ATOM 366 O HIS A 25 -15.063 -3.565 3.573 1.00 0.00 O ATOM 367 CB HIS A 25 -15.073 -5.866 1.196 1.00 0.00 C ATOM 368 CG HIS A 25 -16.196 -6.285 2.119 1.00 0.00 C ATOM 369 ND1 HIS A 25 -16.334 -7.519 2.776 1.00 0.00 N flip ATOM 370 CD2 HIS A 25 -17.255 -5.511 2.445 1.00 0.00 C flip ATOM 371 CE1 HIS A 25 -17.480 -7.469 3.492 1.00 0.00 C flip ATOM 372 NE2 HIS A 25 -18.010 -6.252 3.274 1.00 0.00 N flip ATOM 0 H HIS A 25 -13.132 -4.731 0.012 1.00 0.00 H new ATOM 0 HA HIS A 25 -15.701 -3.853 1.122 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -15.344 -6.097 0.166 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -14.178 -6.444 1.427 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -17.454 -4.504 2.109 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -17.889 -8.251 4.115 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -18.884 -5.929 3.690 1.00 0.00 H new ATOM 380 N SER A 26 -12.945 -4.001 2.849 1.00 0.00 N ATOM 381 CA SER A 26 -12.252 -3.704 4.084 1.00 0.00 C ATOM 382 C SER A 26 -12.237 -2.195 4.350 1.00 0.00 C ATOM 383 O SER A 26 -12.029 -1.791 5.489 1.00 0.00 O ATOM 384 CB SER A 26 -10.837 -4.354 4.015 1.00 0.00 C ATOM 385 OG SER A 26 -10.668 -5.667 3.348 1.00 0.00 O ATOM 0 H SER A 26 -12.321 -4.259 2.085 1.00 0.00 H new ATOM 0 HA SER A 26 -12.771 -4.133 4.941 1.00 0.00 H new ATOM 0 HB2 SER A 26 -10.177 -3.646 3.514 1.00 0.00 H new ATOM 0 HB3 SER A 26 -10.475 -4.459 5.038 1.00 0.00 H new ATOM 0 HG SER A 26 -10.895 -5.583 2.398 1.00 0.00 H new ATOM 391 N PHE A 27 -12.477 -1.374 3.300 1.00 0.00 N ATOM 392 CA PHE A 27 -12.479 0.075 3.540 1.00 0.00 C ATOM 393 C PHE A 27 -13.701 0.396 4.401 1.00 0.00 C ATOM 394 O PHE A 27 -13.678 1.208 5.317 1.00 0.00 O ATOM 395 CB PHE A 27 -12.389 0.975 2.266 1.00 0.00 C ATOM 396 CG PHE A 27 -13.681 1.322 1.546 1.00 0.00 C ATOM 397 CD1 PHE A 27 -14.669 2.110 2.138 1.00 0.00 C ATOM 398 CD2 PHE A 27 -13.910 0.861 0.256 1.00 0.00 C ATOM 399 CE1 PHE A 27 -15.862 2.380 1.484 1.00 0.00 C ATOM 400 CE2 PHE A 27 -15.100 1.128 -0.408 1.00 0.00 C ATOM 401 CZ PHE A 27 -16.082 1.886 0.208 1.00 0.00 C ATOM 0 H PHE A 27 -12.660 -1.670 2.341 1.00 0.00 H new ATOM 0 HA PHE A 27 -11.554 0.326 4.059 1.00 0.00 H new ATOM 0 HB2 PHE A 27 -11.904 1.909 2.550 1.00 0.00 H new ATOM 0 HB3 PHE A 27 -11.732 0.479 1.552 1.00 0.00 H new ATOM 0 HD1 PHE A 27 -14.502 2.517 3.124 1.00 0.00 H new ATOM 0 HD2 PHE A 27 -13.146 0.282 -0.242 1.00 0.00 H new ATOM 0 HE1 PHE A 27 -16.620 2.976 1.970 1.00 0.00 H new ATOM 0 HE2 PHE A 27 -15.260 0.745 -1.405 1.00 0.00 H new ATOM 0 HZ PHE A 27 -17.012 2.090 -0.302 1.00 0.00 H new ATOM 411 N THR A 28 -14.753 -0.336 4.011 1.00 0.00 N ATOM 412 CA THR A 28 -16.082 -0.230 4.556 1.00 0.00 C ATOM 413 C THR A 28 -16.178 -0.814 5.959 1.00 0.00 C ATOM 414 O THR A 28 -16.956 -0.373 6.796 1.00 0.00 O ATOM 415 CB THR A 28 -17.007 -0.886 3.479 1.00 0.00 C ATOM 416 OG1 THR A 28 -16.452 -1.114 2.136 1.00 0.00 O ATOM 417 CG2 THR A 28 -18.374 -0.167 3.419 1.00 0.00 C ATOM 0 H THR A 28 -14.682 -1.041 3.278 1.00 0.00 H new ATOM 0 HA THR A 28 -16.397 0.799 4.727 1.00 0.00 H new ATOM 0 HB THR A 28 -17.125 -1.905 3.847 1.00 0.00 H new ATOM 0 HG1 THR A 28 -16.303 -0.253 1.693 1.00 0.00 H new ATOM 0 HG21 THR A 28 -19.001 -0.640 2.663 1.00 0.00 H new ATOM 0 HG22 THR A 28 -18.863 -0.234 4.391 1.00 0.00 H new ATOM 0 HG23 THR A 28 -18.223 0.881 3.161 1.00 0.00 H new ATOM 425 N ASN A 29 -15.334 -1.817 6.139 1.00 0.00 N ATOM 426 CA ASN A 29 -15.244 -2.588 7.350 1.00 0.00 C ATOM 427 C ASN A 29 -14.270 -1.927 8.317 1.00 0.00 C ATOM 428 O ASN A 29 -14.063 -2.453 9.404 1.00 0.00 O ATOM 429 CB ASN A 29 -14.825 -4.048 7.104 1.00 0.00 C ATOM 430 CG ASN A 29 -15.765 -4.782 6.141 1.00 0.00 C ATOM 431 OD1 ASN A 29 -15.146 -5.765 5.464 1.00 0.00 O flip ATOM 432 ND2 ASN A 29 -16.945 -4.479 6.018 1.00 0.00 N flip ATOM 0 H ASN A 29 -14.677 -2.119 5.420 1.00 0.00 H new ATOM 0 HA ASN A 29 -16.244 -2.613 7.782 1.00 0.00 H new ATOM 0 HB2 ASN A 29 -13.812 -4.068 6.701 1.00 0.00 H new ATOM 0 HB3 ASN A 29 -14.800 -4.579 8.055 1.00 0.00 H new ATOM 0 HD21 ASN A 29 -17.336 -3.717 6.572 1.00 0.00 H new ATOM 0 HD22 ASN A 29 -17.537 -4.988 5.361 1.00 0.00 H new ATOM 439 N ALA A 30 -13.680 -0.780 7.912 1.00 0.00 N ATOM 440 CA ALA A 30 -12.750 -0.095 8.764 1.00 0.00 C ATOM 441 C ALA A 30 -13.352 1.265 9.103 1.00 0.00 C ATOM 442 O ALA A 30 -12.823 1.984 9.943 1.00 0.00 O ATOM 443 CB ALA A 30 -11.398 0.046 8.055 1.00 0.00 C ATOM 0 H ALA A 30 -13.844 -0.334 7.009 1.00 0.00 H new ATOM 0 HA ALA A 30 -12.573 -0.653 9.683 1.00 0.00 H new ATOM 0 HB1 ALA A 30 -10.697 0.567 8.708 1.00 0.00 H new ATOM 0 HB2 ALA A 30 -11.006 -0.943 7.818 1.00 0.00 H new ATOM 0 HB3 ALA A 30 -11.528 0.615 7.134 1.00 0.00 H new ATOM 449 N GLY A 31 -14.478 1.587 8.421 1.00 0.00 N ATOM 450 CA GLY A 31 -15.114 2.882 8.602 1.00 0.00 C ATOM 451 C GLY A 31 -14.170 3.989 8.095 1.00 0.00 C ATOM 452 O GLY A 31 -14.246 5.140 8.507 1.00 0.00 O ATOM 0 H GLY A 31 -14.945 0.970 7.756 1.00 0.00 H new ATOM 0 HA2 GLY A 31 -16.058 2.916 8.058 1.00 0.00 H new ATOM 0 HA3 GLY A 31 -15.347 3.041 9.655 1.00 0.00 H new ATOM 456 N PHE A 32 -13.274 3.536 7.181 1.00 0.00 N ATOM 457 CA PHE A 32 -12.264 4.415 6.610 1.00 0.00 C ATOM 458 C PHE A 32 -12.790 4.831 5.242 1.00 0.00 C ATOM 459 O PHE A 32 -13.778 4.322 4.727 1.00 0.00 O ATOM 460 CB PHE A 32 -10.931 3.649 6.469 1.00 0.00 C ATOM 461 CG PHE A 32 -10.048 3.635 7.696 1.00 0.00 C ATOM 462 CD1 PHE A 32 -10.522 3.915 8.978 1.00 0.00 C ATOM 463 CD2 PHE A 32 -8.691 3.367 7.537 1.00 0.00 C ATOM 464 CE1 PHE A 32 -9.659 3.934 10.065 1.00 0.00 C ATOM 465 CE2 PHE A 32 -7.827 3.386 8.619 1.00 0.00 C ATOM 466 CZ PHE A 32 -8.310 3.673 9.885 1.00 0.00 C ATOM 0 H PHE A 32 -13.243 2.576 6.838 1.00 0.00 H new ATOM 0 HA PHE A 32 -12.079 5.286 7.239 1.00 0.00 H new ATOM 0 HB2 PHE A 32 -11.153 2.618 6.193 1.00 0.00 H new ATOM 0 HB3 PHE A 32 -10.368 4.086 5.644 1.00 0.00 H new ATOM 0 HD1 PHE A 32 -11.572 4.119 9.126 1.00 0.00 H new ATOM 0 HD2 PHE A 32 -8.306 3.141 6.554 1.00 0.00 H new ATOM 0 HE1 PHE A 32 -10.039 4.152 11.052 1.00 0.00 H new ATOM 0 HE2 PHE A 32 -6.777 3.177 8.476 1.00 0.00 H new ATOM 0 HZ PHE A 32 -7.637 3.693 10.730 1.00 0.00 H new ATOM 476 N ASN A 33 -12.031 5.810 4.703 1.00 0.00 N ATOM 477 CA ASN A 33 -12.317 6.378 3.400 1.00 0.00 C ATOM 478 C ASN A 33 -11.730 5.390 2.388 1.00 0.00 C ATOM 479 O ASN A 33 -10.763 4.682 2.646 1.00 0.00 O ATOM 480 CB ASN A 33 -11.674 7.770 3.254 1.00 0.00 C ATOM 481 CG ASN A 33 -12.236 8.780 4.270 1.00 0.00 C ATOM 482 OD1 ASN A 33 -13.179 8.513 5.005 1.00 0.00 O ATOM 483 ND2 ASN A 33 -11.584 9.957 4.255 1.00 0.00 N ATOM 0 H ASN A 33 -11.216 6.214 5.165 1.00 0.00 H new ATOM 0 HA ASN A 33 -13.387 6.521 3.247 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -10.595 7.686 3.387 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -11.843 8.142 2.243 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -11.867 10.705 4.888 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -10.806 10.101 3.611 1.00 0.00 H new ATOM 490 N VAL A 34 -12.405 5.411 1.222 1.00 0.00 N ATOM 491 CA VAL A 34 -12.057 4.565 0.089 1.00 0.00 C ATOM 492 C VAL A 34 -11.252 5.421 -0.894 1.00 0.00 C ATOM 493 O VAL A 34 -11.579 6.564 -1.189 1.00 0.00 O ATOM 494 CB VAL A 34 -13.312 3.955 -0.603 1.00 0.00 C ATOM 495 CG1 VAL A 34 -14.533 4.954 -0.445 1.00 0.00 C ATOM 496 CG2 VAL A 34 -12.750 3.055 -1.782 1.00 0.00 C ATOM 0 H VAL A 34 -13.206 6.019 1.050 1.00 0.00 H new ATOM 0 HA VAL A 34 -11.468 3.717 0.438 1.00 0.00 H new ATOM 0 HB VAL A 34 -13.986 3.170 -0.259 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -15.414 4.531 -0.928 1.00 0.00 H new ATOM 0 HG12 VAL A 34 -14.740 5.111 0.614 1.00 0.00 H new ATOM 0 HG13 VAL A 34 -14.286 5.907 -0.912 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -13.581 2.592 -2.315 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -12.177 3.675 -2.472 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -12.105 2.278 -1.371 1.00 0.00 H new ATOM 506 N VAL A 35 -10.176 4.759 -1.362 1.00 0.00 N ATOM 507 CA VAL A 35 -9.250 5.331 -2.321 1.00 0.00 C ATOM 508 C VAL A 35 -8.958 4.224 -3.347 1.00 0.00 C ATOM 509 O VAL A 35 -8.080 3.387 -3.182 1.00 0.00 O ATOM 510 CB VAL A 35 -7.987 5.840 -1.555 1.00 0.00 C ATOM 511 CG1 VAL A 35 -6.987 6.462 -2.569 1.00 0.00 C ATOM 512 CG2 VAL A 35 -8.014 6.333 -0.097 1.00 0.00 C ATOM 0 H VAL A 35 -9.936 3.810 -1.076 1.00 0.00 H new ATOM 0 HA VAL A 35 -9.645 6.197 -2.852 1.00 0.00 H new ATOM 0 HB VAL A 35 -7.570 4.938 -1.108 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -6.104 6.818 -2.038 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -6.692 5.708 -3.298 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -7.463 7.297 -3.083 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -7.010 6.632 0.204 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -8.688 7.186 -0.014 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -8.363 5.530 0.552 1.00 0.00 H new ATOM 522 N ASN A 36 -9.770 4.266 -4.422 1.00 0.00 N ATOM 523 CA ASN A 36 -9.582 3.240 -5.453 1.00 0.00 C ATOM 524 C ASN A 36 -8.693 3.855 -6.551 1.00 0.00 C ATOM 525 O ASN A 36 -9.001 4.912 -7.090 1.00 0.00 O ATOM 526 CB ASN A 36 -10.952 2.783 -5.992 1.00 0.00 C ATOM 527 CG ASN A 36 -10.804 1.590 -6.952 1.00 0.00 C ATOM 528 OD1 ASN A 36 -10.632 0.450 -6.537 1.00 0.00 O ATOM 529 ND2 ASN A 36 -10.879 1.932 -8.251 1.00 0.00 N ATOM 0 H ASN A 36 -10.510 4.948 -4.590 1.00 0.00 H new ATOM 0 HA ASN A 36 -9.094 2.350 -5.055 1.00 0.00 H new ATOM 0 HB2 ASN A 36 -11.599 2.505 -5.160 1.00 0.00 H new ATOM 0 HB3 ASN A 36 -11.437 3.611 -6.509 1.00 0.00 H new ATOM 0 HD21 ASN A 36 -10.791 1.217 -8.973 1.00 0.00 H new ATOM 0 HD22 ASN A 36 -11.024 2.907 -8.514 1.00 0.00 H new ATOM 536 N ILE A 37 -7.585 3.124 -6.852 1.00 0.00 N ATOM 537 CA ILE A 37 -6.649 3.562 -7.894 1.00 0.00 C ATOM 538 C ILE A 37 -6.983 2.781 -9.181 1.00 0.00 C ATOM 539 O ILE A 37 -6.684 3.231 -10.280 1.00 0.00 O ATOM 540 CB ILE A 37 -5.175 3.330 -7.454 1.00 0.00 C ATOM 541 CG1 ILE A 37 -4.707 4.473 -6.476 1.00 0.00 C ATOM 542 CG2 ILE A 37 -4.878 1.786 -7.475 1.00 0.00 C ATOM 543 CD1 ILE A 37 -3.257 4.394 -5.933 1.00 0.00 C ATOM 0 H ILE A 37 -7.332 2.249 -6.392 1.00 0.00 H new ATOM 0 HA ILE A 37 -6.753 4.632 -8.072 1.00 0.00 H new ATOM 0 HB ILE A 37 -4.299 3.534 -8.070 1.00 0.00 H new ATOM 0 HG12 ILE A 37 -4.823 5.426 -6.991 1.00 0.00 H new ATOM 0 HG13 ILE A 37 -5.386 4.487 -5.624 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -3.847 1.610 -7.168 1.00 0.00 H new ATOM 0 HG22 ILE A 37 -5.553 1.276 -6.788 1.00 0.00 H new ATOM 0 HG23 ILE A 37 -5.028 1.400 -8.483 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -3.069 5.241 -5.273 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -3.127 3.465 -5.377 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -2.555 4.420 -6.766 1.00 0.00 H new ATOM 555 N GLY A 38 -7.605 1.594 -8.979 1.00 0.00 N ATOM 556 CA GLY A 38 -7.965 0.709 -10.077 1.00 0.00 C ATOM 557 C GLY A 38 -6.895 -0.382 -10.193 1.00 0.00 C ATOM 558 O GLY A 38 -6.239 -0.736 -9.222 1.00 0.00 O ATOM 0 H GLY A 38 -7.862 1.240 -8.057 1.00 0.00 H new ATOM 0 HA2 GLY A 38 -8.943 0.263 -9.899 1.00 0.00 H new ATOM 0 HA3 GLY A 38 -8.036 1.271 -11.009 1.00 0.00 H new ATOM 562 N VAL A 39 -6.733 -0.875 -11.440 1.00 0.00 N ATOM 563 CA VAL A 39 -5.747 -1.923 -11.696 1.00 0.00 C ATOM 564 C VAL A 39 -4.347 -1.329 -11.955 1.00 0.00 C ATOM 565 O VAL A 39 -3.455 -2.019 -12.431 1.00 0.00 O ATOM 566 CB VAL A 39 -6.227 -2.786 -12.909 1.00 0.00 C ATOM 567 CG1 VAL A 39 -7.402 -3.694 -12.427 1.00 0.00 C ATOM 568 CG2 VAL A 39 -6.023 -2.360 -14.385 1.00 0.00 C ATOM 0 H VAL A 39 -7.260 -0.569 -12.258 1.00 0.00 H new ATOM 0 HA VAL A 39 -5.662 -2.556 -10.813 1.00 0.00 H new ATOM 0 HB VAL A 39 -5.411 -3.422 -13.251 1.00 0.00 H new ATOM 0 HG11 VAL A 39 -7.753 -4.306 -13.258 1.00 0.00 H new ATOM 0 HG12 VAL A 39 -7.055 -4.341 -11.621 1.00 0.00 H new ATOM 0 HG13 VAL A 39 -8.219 -3.070 -12.065 1.00 0.00 H new ATOM 0 HG21 VAL A 39 -6.440 -3.121 -15.044 1.00 0.00 H new ATOM 0 HG22 VAL A 39 -6.528 -1.410 -14.563 1.00 0.00 H new ATOM 0 HG23 VAL A 39 -4.958 -2.248 -14.588 1.00 0.00 H new ATOM 578 N LEU A 40 -4.209 -0.029 -11.613 1.00 0.00 N ATOM 579 CA LEU A 40 -2.963 0.690 -11.787 1.00 0.00 C ATOM 580 C LEU A 40 -2.723 1.372 -10.450 1.00 0.00 C ATOM 581 O LEU A 40 -3.342 2.387 -10.159 1.00 0.00 O ATOM 582 CB LEU A 40 -3.122 1.771 -12.876 1.00 0.00 C ATOM 583 CG LEU A 40 -3.316 1.206 -14.319 1.00 0.00 C ATOM 584 CD1 LEU A 40 -3.951 2.323 -15.199 1.00 0.00 C ATOM 585 CD2 LEU A 40 -2.483 0.051 -14.915 1.00 0.00 C ATOM 0 H LEU A 40 -4.961 0.532 -11.213 1.00 0.00 H new ATOM 0 HA LEU A 40 -2.149 0.029 -12.084 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -3.977 2.399 -12.626 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.241 2.413 -12.865 1.00 0.00 H new ATOM 0 HG LEU A 40 -3.982 0.346 -14.248 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.096 1.949 -16.213 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.914 2.614 -14.779 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.289 3.188 -15.222 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -2.816 -0.150 -15.933 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -1.429 0.330 -14.926 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -2.615 -0.844 -14.307 1.00 0.00 H new ATOM 597 N SER A 41 -1.793 0.773 -9.662 1.00 0.00 N ATOM 598 CA SER A 41 -1.440 1.363 -8.375 1.00 0.00 C ATOM 599 C SER A 41 -0.372 2.400 -8.737 1.00 0.00 C ATOM 600 O SER A 41 0.831 2.179 -8.674 1.00 0.00 O ATOM 601 CB SER A 41 -1.031 0.289 -7.324 1.00 0.00 C ATOM 602 OG SER A 41 0.280 -0.395 -7.408 1.00 0.00 O ATOM 0 H SER A 41 -1.298 -0.087 -9.896 1.00 0.00 H new ATOM 0 HA SER A 41 -2.271 1.846 -7.861 1.00 0.00 H new ATOM 0 HB2 SER A 41 -1.082 0.764 -6.344 1.00 0.00 H new ATOM 0 HB3 SER A 41 -1.798 -0.485 -7.343 1.00 0.00 H new ATOM 0 HG SER A 41 0.936 0.087 -6.862 1.00 0.00 H new ATOM 608 N SER A 42 -0.965 3.545 -9.147 1.00 0.00 N ATOM 609 CA SER A 42 -0.303 4.738 -9.626 1.00 0.00 C ATOM 610 C SER A 42 0.560 5.263 -8.475 1.00 0.00 C ATOM 611 O SER A 42 0.098 5.502 -7.366 1.00 0.00 O ATOM 612 CB SER A 42 -1.398 5.726 -10.144 1.00 0.00 C ATOM 613 OG SER A 42 -2.826 5.309 -10.162 1.00 0.00 O ATOM 0 H SER A 42 -1.980 3.647 -9.144 1.00 0.00 H new ATOM 0 HA SER A 42 0.365 4.570 -10.470 1.00 0.00 H new ATOM 0 HB2 SER A 42 -1.332 6.630 -9.539 1.00 0.00 H new ATOM 0 HB3 SER A 42 -1.128 6.004 -11.163 1.00 0.00 H new ATOM 0 HG SER A 42 -3.376 6.041 -10.511 1.00 0.00 H new ATOM 619 N GLN A 43 1.852 5.412 -8.841 1.00 0.00 N ATOM 620 CA GLN A 43 2.869 5.854 -7.911 1.00 0.00 C ATOM 621 C GLN A 43 2.833 7.383 -7.863 1.00 0.00 C ATOM 622 O GLN A 43 2.066 7.959 -7.109 1.00 0.00 O ATOM 623 CB GLN A 43 4.231 5.243 -8.314 1.00 0.00 C ATOM 624 CG GLN A 43 5.456 5.738 -7.517 1.00 0.00 C ATOM 625 CD GLN A 43 5.199 5.865 -6.006 1.00 0.00 C ATOM 626 OE1 GLN A 43 4.738 4.741 -5.431 1.00 0.00 O flip ATOM 627 NE2 GLN A 43 5.411 6.914 -5.411 1.00 0.00 N flip ATOM 0 H GLN A 43 2.199 5.227 -9.782 1.00 0.00 H new ATOM 0 HA GLN A 43 2.689 5.506 -6.894 1.00 0.00 H new ATOM 0 HB2 GLN A 43 4.167 4.160 -8.208 1.00 0.00 H new ATOM 0 HB3 GLN A 43 4.402 5.450 -9.370 1.00 0.00 H new ATOM 0 HG2 GLN A 43 6.286 5.050 -7.679 1.00 0.00 H new ATOM 0 HG3 GLN A 43 5.765 6.708 -7.907 1.00 0.00 H new ATOM 0 HE21 GLN A 43 5.762 7.726 -5.918 1.00 0.00 H new ATOM 0 HE22 GLN A 43 5.237 6.976 -4.408 1.00 0.00 H new ATOM 636 N GLU A 44 3.691 7.997 -8.707 1.00 0.00 N ATOM 637 CA GLU A 44 3.879 9.439 -8.784 1.00 0.00 C ATOM 638 C GLU A 44 2.576 10.156 -9.170 1.00 0.00 C ATOM 639 O GLU A 44 2.455 11.356 -8.956 1.00 0.00 O ATOM 640 CB GLU A 44 5.023 9.762 -9.765 1.00 0.00 C ATOM 641 CG GLU A 44 4.751 9.288 -11.204 1.00 0.00 C ATOM 642 CD GLU A 44 5.947 9.609 -12.117 1.00 0.00 C ATOM 643 OE1 GLU A 44 5.978 10.699 -12.688 1.00 0.00 O ATOM 644 OE2 GLU A 44 6.833 8.765 -12.247 1.00 0.00 O ATOM 0 H GLU A 44 4.279 7.482 -9.362 1.00 0.00 H new ATOM 0 HA GLU A 44 4.157 9.810 -7.797 1.00 0.00 H new ATOM 0 HB2 GLU A 44 5.192 10.839 -9.772 1.00 0.00 H new ATOM 0 HB3 GLU A 44 5.941 9.297 -9.405 1.00 0.00 H new ATOM 0 HG2 GLU A 44 4.561 8.215 -11.209 1.00 0.00 H new ATOM 0 HG3 GLU A 44 3.853 9.772 -11.588 1.00 0.00 H new ATOM 651 N ASP A 45 1.610 9.404 -9.740 1.00 0.00 N ATOM 652 CA ASP A 45 0.366 10.038 -10.139 1.00 0.00 C ATOM 653 C ASP A 45 -0.554 10.038 -8.927 1.00 0.00 C ATOM 654 O ASP A 45 -1.195 11.048 -8.661 1.00 0.00 O ATOM 655 CB ASP A 45 -0.224 9.305 -11.360 1.00 0.00 C ATOM 656 CG ASP A 45 -1.560 9.922 -11.816 1.00 0.00 C ATOM 657 OD1 ASP A 45 -1.534 10.939 -12.508 1.00 0.00 O ATOM 658 OD2 ASP A 45 -2.609 9.378 -11.472 1.00 0.00 O ATOM 0 H ASP A 45 1.673 8.402 -9.922 1.00 0.00 H new ATOM 0 HA ASP A 45 0.514 11.071 -10.455 1.00 0.00 H new ATOM 0 HB2 ASP A 45 0.490 9.339 -12.183 1.00 0.00 H new ATOM 0 HB3 ASP A 45 -0.376 8.254 -11.113 1.00 0.00 H new ATOM 663 N PHE A 46 -0.598 8.894 -8.198 1.00 0.00 N ATOM 664 CA PHE A 46 -1.485 8.883 -7.045 1.00 0.00 C ATOM 665 C PHE A 46 -0.734 9.453 -5.831 1.00 0.00 C ATOM 666 O PHE A 46 -1.274 9.459 -4.734 1.00 0.00 O ATOM 667 CB PHE A 46 -2.174 7.529 -6.788 1.00 0.00 C ATOM 668 CG PHE A 46 -3.594 7.774 -6.346 1.00 0.00 C ATOM 669 CD1 PHE A 46 -3.905 7.945 -5.001 1.00 0.00 C ATOM 670 CD2 PHE A 46 -4.609 7.880 -7.294 1.00 0.00 C ATOM 671 CE1 PHE A 46 -5.202 8.241 -4.615 1.00 0.00 C ATOM 672 CE2 PHE A 46 -5.913 8.161 -6.905 1.00 0.00 C ATOM 673 CZ PHE A 46 -6.209 8.345 -5.562 1.00 0.00 C ATOM 0 H PHE A 46 -0.070 8.040 -8.378 1.00 0.00 H new ATOM 0 HA PHE A 46 -2.333 9.534 -7.258 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -2.161 6.923 -7.694 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -1.633 6.971 -6.024 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -3.131 7.846 -4.254 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -4.380 7.743 -8.341 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -5.430 8.392 -3.570 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -6.695 8.236 -7.647 1.00 0.00 H new ATOM 0 HZ PHE A 46 -7.220 8.568 -5.256 1.00 0.00 H new ATOM 683 N ILE A 47 0.517 9.931 -6.053 1.00 0.00 N ATOM 684 CA ILE A 47 1.267 10.559 -4.975 1.00 0.00 C ATOM 685 C ILE A 47 0.784 12.024 -5.003 1.00 0.00 C ATOM 686 O ILE A 47 0.783 12.709 -3.987 1.00 0.00 O ATOM 687 CB ILE A 47 2.815 10.335 -5.092 1.00 0.00 C ATOM 688 CG1 ILE A 47 3.419 9.278 -4.128 1.00 0.00 C ATOM 689 CG2 ILE A 47 3.521 11.536 -5.797 1.00 0.00 C ATOM 690 CD1 ILE A 47 2.738 7.891 -4.065 1.00 0.00 C ATOM 0 H ILE A 47 1.003 9.888 -6.949 1.00 0.00 H new ATOM 0 HA ILE A 47 1.081 10.118 -3.996 1.00 0.00 H new ATOM 0 HB ILE A 47 3.249 9.647 -5.817 1.00 0.00 H new ATOM 0 HG12 ILE A 47 4.462 9.127 -4.406 1.00 0.00 H new ATOM 0 HG13 ILE A 47 3.415 9.700 -3.123 1.00 0.00 H new ATOM 0 HG21 ILE A 47 4.592 11.343 -5.859 1.00 0.00 H new ATOM 0 HG22 ILE A 47 3.116 11.658 -6.801 1.00 0.00 H new ATOM 0 HG23 ILE A 47 3.349 12.447 -5.223 1.00 0.00 H new ATOM 0 HD11 ILE A 47 3.266 7.258 -3.352 1.00 0.00 H new ATOM 0 HD12 ILE A 47 1.702 8.008 -3.748 1.00 0.00 H new ATOM 0 HD13 ILE A 47 2.765 7.427 -5.051 1.00 0.00 H new ATOM 702 N ASN A 48 0.347 12.452 -6.223 1.00 0.00 N ATOM 703 CA ASN A 48 -0.193 13.792 -6.371 1.00 0.00 C ATOM 704 C ASN A 48 -1.634 13.730 -5.817 1.00 0.00 C ATOM 705 O ASN A 48 -2.142 14.711 -5.286 1.00 0.00 O ATOM 706 CB ASN A 48 -0.136 14.222 -7.848 1.00 0.00 C ATOM 707 CG ASN A 48 -0.623 15.667 -8.036 1.00 0.00 C ATOM 708 OD1 ASN A 48 -1.706 15.919 -8.548 1.00 0.00 O ATOM 709 ND2 ASN A 48 0.249 16.587 -7.585 1.00 0.00 N ATOM 0 H ASN A 48 0.365 11.894 -7.077 1.00 0.00 H new ATOM 0 HA ASN A 48 0.381 14.541 -5.824 1.00 0.00 H new ATOM 0 HB2 ASN A 48 0.887 14.132 -8.215 1.00 0.00 H new ATOM 0 HB3 ASN A 48 -0.750 13.550 -8.447 1.00 0.00 H new ATOM 0 HD21 ASN A 48 0.026 17.580 -7.658 1.00 0.00 H new ATOM 0 HD22 ASN A 48 1.133 16.292 -7.170 1.00 0.00 H new ATOM 716 N ALA A 49 -2.259 12.529 -5.950 1.00 0.00 N ATOM 717 CA ALA A 49 -3.611 12.360 -5.443 1.00 0.00 C ATOM 718 C ALA A 49 -3.510 11.802 -4.009 1.00 0.00 C ATOM 719 O ALA A 49 -4.508 11.381 -3.440 1.00 0.00 O ATOM 720 CB ALA A 49 -4.443 11.468 -6.367 1.00 0.00 C ATOM 0 H ALA A 49 -1.851 11.704 -6.390 1.00 0.00 H new ATOM 0 HA ALA A 49 -4.133 13.317 -5.417 1.00 0.00 H new ATOM 0 HB1 ALA A 49 -5.449 11.361 -5.961 1.00 0.00 H new ATOM 0 HB2 ALA A 49 -4.498 11.921 -7.357 1.00 0.00 H new ATOM 0 HB3 ALA A 49 -3.976 10.486 -6.442 1.00 0.00 H new ATOM 726 N ALA A 50 -2.271 11.792 -3.454 1.00 0.00 N ATOM 727 CA ALA A 50 -2.077 11.351 -2.080 1.00 0.00 C ATOM 728 C ALA A 50 -2.223 12.620 -1.242 1.00 0.00 C ATOM 729 O ALA A 50 -2.601 12.576 -0.085 1.00 0.00 O ATOM 730 CB ALA A 50 -0.725 10.683 -1.831 1.00 0.00 C ATOM 0 H ALA A 50 -1.420 12.080 -3.937 1.00 0.00 H new ATOM 0 HA ALA A 50 -2.803 10.580 -1.823 1.00 0.00 H new ATOM 0 HB1 ALA A 50 -0.655 10.382 -0.786 1.00 0.00 H new ATOM 0 HB2 ALA A 50 -0.630 9.804 -2.469 1.00 0.00 H new ATOM 0 HB3 ALA A 50 0.076 11.386 -2.061 1.00 0.00 H new ATOM 736 N ILE A 51 -1.914 13.766 -1.885 1.00 0.00 N ATOM 737 CA ILE A 51 -2.061 15.050 -1.221 1.00 0.00 C ATOM 738 C ILE A 51 -3.584 15.245 -1.068 1.00 0.00 C ATOM 739 O ILE A 51 -4.077 15.745 -0.064 1.00 0.00 O ATOM 740 CB ILE A 51 -1.417 16.176 -2.094 1.00 0.00 C ATOM 741 CG1 ILE A 51 -0.185 15.780 -2.937 1.00 0.00 C ATOM 742 CG2 ILE A 51 -1.757 17.569 -1.470 1.00 0.00 C ATOM 743 CD1 ILE A 51 0.475 16.906 -3.760 1.00 0.00 C ATOM 0 H ILE A 51 -1.569 13.815 -2.844 1.00 0.00 H new ATOM 0 HA ILE A 51 -1.560 15.089 -0.254 1.00 0.00 H new ATOM 0 HB ILE A 51 -1.822 16.382 -3.085 1.00 0.00 H new ATOM 0 HG12 ILE A 51 0.566 15.361 -2.268 1.00 0.00 H new ATOM 0 HG13 ILE A 51 -0.481 14.985 -3.622 1.00 0.00 H new ATOM 0 HG21 ILE A 51 -1.310 18.358 -2.075 1.00 0.00 H new ATOM 0 HG22 ILE A 51 -2.839 17.701 -1.443 1.00 0.00 H new ATOM 0 HG23 ILE A 51 -1.360 17.620 -0.456 1.00 0.00 H new ATOM 0 HD11 ILE A 51 1.327 16.504 -4.308 1.00 0.00 H new ATOM 0 HD12 ILE A 51 -0.250 17.314 -4.465 1.00 0.00 H new ATOM 0 HD13 ILE A 51 0.814 17.696 -3.090 1.00 0.00 H new ATOM 755 N GLU A 52 -4.272 14.779 -2.137 1.00 0.00 N ATOM 756 CA GLU A 52 -5.713 14.838 -2.264 1.00 0.00 C ATOM 757 C GLU A 52 -6.389 14.030 -1.131 1.00 0.00 C ATOM 758 O GLU A 52 -6.980 14.621 -0.235 1.00 0.00 O ATOM 759 CB GLU A 52 -6.137 14.347 -3.662 1.00 0.00 C ATOM 760 CG GLU A 52 -7.649 14.440 -3.921 1.00 0.00 C ATOM 761 CD GLU A 52 -7.990 13.852 -5.301 1.00 0.00 C ATOM 762 OE1 GLU A 52 -8.082 12.630 -5.413 1.00 0.00 O ATOM 763 OE2 GLU A 52 -8.157 14.621 -6.248 1.00 0.00 O ATOM 0 H GLU A 52 -3.815 14.347 -2.940 1.00 0.00 H new ATOM 0 HA GLU A 52 -6.045 15.871 -2.162 1.00 0.00 H new ATOM 0 HB2 GLU A 52 -5.612 14.932 -4.417 1.00 0.00 H new ATOM 0 HB3 GLU A 52 -5.820 13.311 -3.784 1.00 0.00 H new ATOM 0 HG2 GLU A 52 -8.192 13.902 -3.144 1.00 0.00 H new ATOM 0 HG3 GLU A 52 -7.970 15.480 -3.872 1.00 0.00 H new ATOM 770 N THR A 53 -6.296 12.673 -1.203 1.00 0.00 N ATOM 771 CA THR A 53 -6.985 11.829 -0.235 1.00 0.00 C ATOM 772 C THR A 53 -6.256 11.851 1.100 1.00 0.00 C ATOM 773 O THR A 53 -6.816 12.251 2.112 1.00 0.00 O ATOM 774 CB THR A 53 -7.306 10.382 -0.747 1.00 0.00 C ATOM 775 OG1 THR A 53 -6.438 9.264 -0.376 1.00 0.00 O ATOM 776 CG2 THR A 53 -7.652 10.395 -2.259 1.00 0.00 C ATOM 0 H THR A 53 -5.761 12.168 -1.909 1.00 0.00 H new ATOM 0 HA THR A 53 -7.973 12.264 -0.085 1.00 0.00 H new ATOM 0 HB THR A 53 -8.180 10.128 -0.147 1.00 0.00 H new ATOM 0 HG1 THR A 53 -6.066 8.856 -1.186 1.00 0.00 H new ATOM 0 HG21 THR A 53 -7.871 9.380 -2.591 1.00 0.00 H new ATOM 0 HG22 THR A 53 -8.523 11.028 -2.427 1.00 0.00 H new ATOM 0 HG23 THR A 53 -6.805 10.786 -2.823 1.00 0.00 H new ATOM 784 N LYS A 54 -4.998 11.374 1.021 1.00 0.00 N ATOM 785 CA LYS A 54 -4.064 11.267 2.141 1.00 0.00 C ATOM 786 C LYS A 54 -4.097 9.814 2.600 1.00 0.00 C ATOM 787 O LYS A 54 -4.539 9.498 3.695 1.00 0.00 O ATOM 788 CB LYS A 54 -4.328 12.280 3.279 1.00 0.00 C ATOM 789 CG LYS A 54 -3.137 12.503 4.221 1.00 0.00 C ATOM 790 CD LYS A 54 -1.906 13.137 3.548 1.00 0.00 C ATOM 791 CE LYS A 54 -2.202 14.453 2.820 1.00 0.00 C ATOM 792 NZ LYS A 54 -0.983 15.101 2.354 1.00 0.00 N ATOM 0 H LYS A 54 -4.598 11.044 0.143 1.00 0.00 H new ATOM 0 HA LYS A 54 -3.060 11.539 1.814 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -4.611 13.236 2.839 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -5.179 11.935 3.866 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -3.455 13.142 5.045 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -2.847 11.546 4.654 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -1.143 13.316 4.305 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -1.488 12.426 2.836 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -2.858 14.259 1.971 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -2.738 15.126 3.489 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -1.225 15.987 1.867 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -0.368 15.309 3.167 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -0.484 14.469 1.695 1.00 0.00 H new ATOM 805 N ALA A 55 -3.550 8.966 1.697 1.00 0.00 N ATOM 806 CA ALA A 55 -3.444 7.527 1.865 1.00 0.00 C ATOM 807 C ALA A 55 -2.702 7.248 3.178 1.00 0.00 C ATOM 808 O ALA A 55 -1.535 7.583 3.334 1.00 0.00 O ATOM 809 CB ALA A 55 -2.648 6.922 0.696 1.00 0.00 C ATOM 0 H ALA A 55 -3.164 9.290 0.811 1.00 0.00 H new ATOM 0 HA ALA A 55 -4.439 7.082 1.886 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -2.572 5.843 0.828 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -3.159 7.138 -0.242 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -1.648 7.356 0.673 1.00 0.00 H new ATOM 815 N ASP A 56 -3.453 6.605 4.104 1.00 0.00 N ATOM 816 CA ASP A 56 -2.883 6.233 5.393 1.00 0.00 C ATOM 817 C ASP A 56 -2.032 4.995 5.103 1.00 0.00 C ATOM 818 O ASP A 56 -0.876 4.917 5.501 1.00 0.00 O ATOM 819 CB ASP A 56 -3.975 5.963 6.451 1.00 0.00 C ATOM 820 CG ASP A 56 -3.444 5.430 7.799 1.00 0.00 C ATOM 821 OD1 ASP A 56 -2.303 5.720 8.156 1.00 0.00 O ATOM 822 OD2 ASP A 56 -4.185 4.717 8.474 1.00 0.00 O ATOM 0 H ASP A 56 -4.431 6.344 3.975 1.00 0.00 H new ATOM 0 HA ASP A 56 -2.285 7.037 5.822 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -4.524 6.887 6.631 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -4.686 5.243 6.045 1.00 0.00 H new ATOM 827 N LEU A 57 -2.673 4.049 4.375 1.00 0.00 N ATOM 828 CA LEU A 57 -1.963 2.828 4.025 1.00 0.00 C ATOM 829 C LEU A 57 -2.483 2.410 2.648 1.00 0.00 C ATOM 830 O LEU A 57 -3.617 2.685 2.281 1.00 0.00 O ATOM 831 CB LEU A 57 -2.143 1.761 5.117 1.00 0.00 C ATOM 832 CG LEU A 57 -3.606 1.236 5.279 1.00 0.00 C ATOM 833 CD1 LEU A 57 -3.674 -0.237 4.782 1.00 0.00 C ATOM 834 CD2 LEU A 57 -4.626 1.853 6.267 1.00 0.00 C ATOM 0 H LEU A 57 -3.634 4.113 4.039 1.00 0.00 H new ATOM 0 HA LEU A 57 -0.884 2.974 3.967 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -1.491 0.917 4.893 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -1.812 2.175 6.069 1.00 0.00 H new ATOM 0 HG LEU A 57 -4.273 1.842 4.665 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -4.692 -0.611 4.892 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -3.382 -0.281 3.733 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -2.996 -0.852 5.373 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -5.572 1.316 6.196 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -4.240 1.776 7.284 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -4.785 2.902 6.018 1.00 0.00 H new ATOM 846 N ILE A 58 -1.567 1.736 1.912 1.00 0.00 N ATOM 847 CA ILE A 58 -1.865 1.263 0.564 1.00 0.00 C ATOM 848 C ILE A 58 -1.824 -0.272 0.634 1.00 0.00 C ATOM 849 O ILE A 58 -1.410 -0.864 1.624 1.00 0.00 O ATOM 850 CB ILE A 58 -0.883 1.910 -0.463 1.00 0.00 C ATOM 851 CG1 ILE A 58 -1.036 3.485 -0.481 1.00 0.00 C ATOM 852 CG2 ILE A 58 0.380 0.991 -0.674 1.00 0.00 C ATOM 853 CD1 ILE A 58 -0.119 4.246 -1.467 1.00 0.00 C ATOM 0 H ILE A 58 -0.626 1.515 2.238 1.00 0.00 H new ATOM 0 HA ILE A 58 -2.851 1.561 0.207 1.00 0.00 H new ATOM 0 HB ILE A 58 -1.042 1.915 -1.541 1.00 0.00 H new ATOM 0 HG12 ILE A 58 -2.072 3.726 -0.720 1.00 0.00 H new ATOM 0 HG13 ILE A 58 -0.845 3.860 0.524 1.00 0.00 H new ATOM 0 HG21 ILE A 58 1.053 1.458 -1.393 1.00 0.00 H new ATOM 0 HG22 ILE A 58 0.898 0.860 0.276 1.00 0.00 H new ATOM 0 HG23 ILE A 58 0.063 0.019 -1.052 1.00 0.00 H new ATOM 0 HD11 ILE A 58 -0.312 5.316 -1.391 1.00 0.00 H new ATOM 0 HD12 ILE A 58 0.924 4.047 -1.221 1.00 0.00 H new ATOM 0 HD13 ILE A 58 -0.322 3.912 -2.484 1.00 0.00 H new ATOM 865 N CYS A 59 -2.279 -0.860 -0.496 1.00 0.00 N ATOM 866 CA CYS A 59 -2.318 -2.303 -0.642 1.00 0.00 C ATOM 867 C CYS A 59 -2.213 -2.573 -2.144 1.00 0.00 C ATOM 868 O CYS A 59 -3.132 -2.336 -2.914 1.00 0.00 O ATOM 869 CB CYS A 59 -3.616 -2.909 -0.080 1.00 0.00 C ATOM 870 SG CYS A 59 -3.703 -2.858 1.725 1.00 0.00 S ATOM 0 H CYS A 59 -2.620 -0.345 -1.308 1.00 0.00 H new ATOM 0 HA CYS A 59 -1.505 -2.764 -0.081 1.00 0.00 H new ATOM 0 HB2 CYS A 59 -4.469 -2.371 -0.494 1.00 0.00 H new ATOM 0 HB3 CYS A 59 -3.700 -3.944 -0.412 1.00 0.00 H new ATOM 0 HG CYS A 59 -2.800 -2.040 2.180 1.00 0.00 H new ATOM 876 N VAL A 60 -1.031 -3.103 -2.503 1.00 0.00 N ATOM 877 CA VAL A 60 -0.750 -3.477 -3.885 1.00 0.00 C ATOM 878 C VAL A 60 -0.978 -4.986 -3.875 1.00 0.00 C ATOM 879 O VAL A 60 -0.327 -5.702 -3.122 1.00 0.00 O ATOM 880 CB VAL A 60 0.702 -3.013 -4.246 1.00 0.00 C ATOM 881 CG1 VAL A 60 1.311 -3.862 -5.408 1.00 0.00 C ATOM 882 CG2 VAL A 60 1.151 -1.562 -3.945 1.00 0.00 C ATOM 0 H VAL A 60 -0.264 -3.278 -1.854 1.00 0.00 H new ATOM 0 HA VAL A 60 -1.371 -3.014 -4.652 1.00 0.00 H new ATOM 0 HB VAL A 60 1.351 -3.269 -3.409 1.00 0.00 H new ATOM 0 HG11 VAL A 60 2.318 -3.508 -5.628 1.00 0.00 H new ATOM 0 HG12 VAL A 60 1.351 -4.910 -5.111 1.00 0.00 H new ATOM 0 HG13 VAL A 60 0.689 -3.761 -6.297 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.185 -1.427 -4.264 1.00 0.00 H new ATOM 0 HG22 VAL A 60 0.511 -0.864 -4.485 1.00 0.00 H new ATOM 0 HG23 VAL A 60 1.074 -1.372 -2.874 1.00 0.00 H new ATOM 892 N SER A 61 -1.945 -5.421 -4.720 1.00 0.00 N ATOM 893 CA SER A 61 -2.265 -6.832 -4.712 1.00 0.00 C ATOM 894 C SER A 61 -1.591 -7.468 -5.928 1.00 0.00 C ATOM 895 O SER A 61 -1.955 -7.201 -7.059 1.00 0.00 O ATOM 896 CB SER A 61 -3.816 -7.008 -4.708 1.00 0.00 C ATOM 897 OG SER A 61 -4.710 -5.833 -4.850 1.00 0.00 O ATOM 0 H SER A 61 -2.476 -4.842 -5.370 1.00 0.00 H new ATOM 0 HA SER A 61 -1.894 -7.332 -3.818 1.00 0.00 H new ATOM 0 HB2 SER A 61 -4.063 -7.699 -5.514 1.00 0.00 H new ATOM 0 HB3 SER A 61 -4.081 -7.502 -3.773 1.00 0.00 H new ATOM 0 HG SER A 61 -4.348 -5.227 -5.530 1.00 0.00 H new ATOM 903 N SER A 62 -0.604 -8.330 -5.601 1.00 0.00 N ATOM 904 CA SER A 62 0.182 -9.122 -6.547 1.00 0.00 C ATOM 905 C SER A 62 1.536 -9.315 -5.876 1.00 0.00 C ATOM 906 O SER A 62 1.920 -8.607 -4.954 1.00 0.00 O ATOM 907 CB SER A 62 0.447 -8.523 -7.974 1.00 0.00 C ATOM 908 OG SER A 62 1.401 -9.195 -8.901 1.00 0.00 O ATOM 0 H SER A 62 -0.330 -8.493 -4.632 1.00 0.00 H new ATOM 0 HA SER A 62 -0.404 -10.019 -6.748 1.00 0.00 H new ATOM 0 HB2 SER A 62 -0.514 -8.465 -8.485 1.00 0.00 H new ATOM 0 HB3 SER A 62 0.796 -7.500 -7.836 1.00 0.00 H new ATOM 0 HG SER A 62 1.220 -8.908 -9.821 1.00 0.00 H new ATOM 914 N LEU A 63 2.232 -10.321 -6.446 1.00 0.00 N ATOM 915 CA LEU A 63 3.540 -10.751 -6.028 1.00 0.00 C ATOM 916 C LEU A 63 4.551 -9.944 -6.848 1.00 0.00 C ATOM 917 O LEU A 63 5.185 -10.445 -7.769 1.00 0.00 O ATOM 918 CB LEU A 63 3.698 -12.281 -6.200 1.00 0.00 C ATOM 919 CG LEU A 63 2.696 -13.111 -5.305 1.00 0.00 C ATOM 920 CD1 LEU A 63 1.140 -13.071 -5.059 1.00 0.00 C ATOM 921 CD2 LEU A 63 3.138 -14.580 -5.396 1.00 0.00 C ATOM 0 H LEU A 63 1.869 -10.859 -7.233 1.00 0.00 H new ATOM 0 HA LEU A 63 3.706 -10.567 -4.967 1.00 0.00 H new ATOM 0 HB2 LEU A 63 3.542 -12.541 -7.247 1.00 0.00 H new ATOM 0 HB3 LEU A 63 4.720 -12.565 -5.950 1.00 0.00 H new ATOM 0 HG LEU A 63 2.810 -12.403 -4.484 1.00 0.00 H new ATOM 0 HD11 LEU A 63 0.865 -13.845 -4.343 1.00 0.00 H new ATOM 0 HD12 LEU A 63 0.859 -12.095 -4.664 1.00 0.00 H new ATOM 0 HD13 LEU A 63 0.618 -13.245 -6.000 1.00 0.00 H new ATOM 0 HD21 LEU A 63 2.474 -15.198 -4.792 1.00 0.00 H new ATOM 0 HD22 LEU A 63 3.095 -14.909 -6.434 1.00 0.00 H new ATOM 0 HD23 LEU A 63 4.159 -14.676 -5.027 1.00 0.00 H new ATOM 933 N TYR A 64 4.650 -8.660 -6.432 1.00 0.00 N ATOM 934 CA TYR A 64 5.559 -7.680 -7.006 1.00 0.00 C ATOM 935 C TYR A 64 5.015 -7.289 -8.395 1.00 0.00 C ATOM 936 O TYR A 64 5.740 -7.290 -9.383 1.00 0.00 O ATOM 937 CB TYR A 64 7.008 -8.233 -7.019 1.00 0.00 C ATOM 938 CG TYR A 64 8.101 -7.207 -6.826 1.00 0.00 C ATOM 939 CD1 TYR A 64 8.045 -5.933 -7.381 1.00 0.00 C ATOM 940 CD2 TYR A 64 9.219 -7.549 -6.076 1.00 0.00 C ATOM 941 CE1 TYR A 64 9.083 -5.028 -7.191 1.00 0.00 C ATOM 942 CE2 TYR A 64 10.257 -6.653 -5.871 1.00 0.00 C ATOM 943 CZ TYR A 64 10.202 -5.371 -6.425 1.00 0.00 C ATOM 944 OH TYR A 64 11.246 -4.464 -6.242 1.00 0.00 O ATOM 0 H TYR A 64 4.083 -8.284 -5.672 1.00 0.00 H new ATOM 0 HA TYR A 64 5.610 -6.772 -6.405 1.00 0.00 H new ATOM 0 HB2 TYR A 64 7.098 -8.985 -6.235 1.00 0.00 H new ATOM 0 HB3 TYR A 64 7.175 -8.741 -7.969 1.00 0.00 H new ATOM 0 HD1 TYR A 64 7.185 -5.643 -7.967 1.00 0.00 H new ATOM 0 HD2 TYR A 64 9.281 -8.536 -5.642 1.00 0.00 H new ATOM 0 HE1 TYR A 64 9.025 -4.048 -7.640 1.00 0.00 H new ATOM 0 HE2 TYR A 64 11.112 -6.947 -5.280 1.00 0.00 H new ATOM 0 HH TYR A 64 10.957 -3.750 -5.637 1.00 0.00 H new ATOM 954 N GLY A 65 3.703 -6.954 -8.409 1.00 0.00 N ATOM 955 CA GLY A 65 3.050 -6.534 -9.652 1.00 0.00 C ATOM 956 C GLY A 65 3.067 -5.003 -9.824 1.00 0.00 C ATOM 957 O GLY A 65 2.520 -4.462 -10.776 1.00 0.00 O ATOM 0 H GLY A 65 3.096 -6.968 -7.590 1.00 0.00 H new ATOM 0 HA2 GLY A 65 3.552 -7.000 -10.500 1.00 0.00 H new ATOM 0 HA3 GLY A 65 2.019 -6.888 -9.658 1.00 0.00 H new ATOM 961 N GLN A 66 3.728 -4.355 -8.842 1.00 0.00 N ATOM 962 CA GLN A 66 3.851 -2.913 -8.765 1.00 0.00 C ATOM 963 C GLN A 66 5.079 -2.465 -9.551 1.00 0.00 C ATOM 964 O GLN A 66 5.185 -1.306 -9.936 1.00 0.00 O ATOM 965 CB GLN A 66 3.962 -2.487 -7.286 1.00 0.00 C ATOM 966 CG GLN A 66 4.907 -3.367 -6.443 1.00 0.00 C ATOM 967 CD GLN A 66 5.005 -2.853 -5.002 1.00 0.00 C ATOM 968 OE1 GLN A 66 4.543 -1.771 -4.666 1.00 0.00 O ATOM 969 NE2 GLN A 66 5.637 -3.707 -4.177 1.00 0.00 N ATOM 0 H GLN A 66 4.193 -4.841 -8.076 1.00 0.00 H new ATOM 0 HA GLN A 66 2.970 -2.440 -9.199 1.00 0.00 H new ATOM 0 HB2 GLN A 66 4.310 -1.455 -7.242 1.00 0.00 H new ATOM 0 HB3 GLN A 66 2.968 -2.508 -6.838 1.00 0.00 H new ATOM 0 HG2 GLN A 66 4.546 -4.395 -6.441 1.00 0.00 H new ATOM 0 HG3 GLN A 66 5.898 -3.378 -6.896 1.00 0.00 H new ATOM 0 HE21 GLN A 66 5.994 -4.592 -4.536 1.00 0.00 H new ATOM 0 HE22 GLN A 66 5.759 -3.469 -3.193 1.00 0.00 H new ATOM 978 N GLY A 67 5.998 -3.420 -9.766 1.00 0.00 N ATOM 979 CA GLY A 67 7.229 -3.091 -10.470 1.00 0.00 C ATOM 980 C GLY A 67 8.161 -2.353 -9.502 1.00 0.00 C ATOM 981 O GLY A 67 7.778 -2.021 -8.389 1.00 0.00 O ATOM 0 H GLY A 67 5.911 -4.392 -9.471 1.00 0.00 H new ATOM 0 HA2 GLY A 67 7.708 -3.998 -10.840 1.00 0.00 H new ATOM 0 HA3 GLY A 67 7.014 -2.468 -11.338 1.00 0.00 H new ATOM 985 N GLU A 68 9.387 -2.096 -9.996 1.00 0.00 N ATOM 986 CA GLU A 68 10.408 -1.434 -9.194 1.00 0.00 C ATOM 987 C GLU A 68 10.138 0.086 -9.152 1.00 0.00 C ATOM 988 O GLU A 68 10.947 0.833 -8.613 1.00 0.00 O ATOM 989 CB GLU A 68 11.785 -1.739 -9.813 1.00 0.00 C ATOM 990 CG GLU A 68 12.136 -3.235 -9.748 1.00 0.00 C ATOM 991 CD GLU A 68 13.554 -3.489 -10.285 1.00 0.00 C ATOM 992 OE1 GLU A 68 13.713 -3.604 -11.500 1.00 0.00 O ATOM 993 OE2 GLU A 68 14.484 -3.571 -9.482 1.00 0.00 O ATOM 0 H GLU A 68 9.684 -2.339 -10.941 1.00 0.00 H new ATOM 0 HA GLU A 68 10.387 -1.802 -8.168 1.00 0.00 H new ATOM 0 HB2 GLU A 68 11.794 -1.411 -10.852 1.00 0.00 H new ATOM 0 HB3 GLU A 68 12.551 -1.165 -9.291 1.00 0.00 H new ATOM 0 HG2 GLU A 68 12.065 -3.585 -8.718 1.00 0.00 H new ATOM 0 HG3 GLU A 68 11.414 -3.808 -10.330 1.00 0.00 H new ATOM 1000 N ILE A 69 8.987 0.516 -9.718 1.00 0.00 N ATOM 1001 CA ILE A 69 8.636 1.925 -9.762 1.00 0.00 C ATOM 1002 C ILE A 69 7.845 2.227 -8.485 1.00 0.00 C ATOM 1003 O ILE A 69 8.301 2.947 -7.606 1.00 0.00 O ATOM 1004 CB ILE A 69 7.808 2.244 -11.055 1.00 0.00 C ATOM 1005 CG1 ILE A 69 7.948 1.274 -12.261 1.00 0.00 C ATOM 1006 CG2 ILE A 69 7.336 3.735 -11.023 1.00 0.00 C ATOM 1007 CD1 ILE A 69 9.369 1.341 -12.833 1.00 0.00 C ATOM 0 H ILE A 69 8.298 -0.103 -10.145 1.00 0.00 H new ATOM 0 HA ILE A 69 9.524 2.555 -9.805 1.00 0.00 H new ATOM 0 HB ILE A 69 6.815 1.850 -11.271 1.00 0.00 H new ATOM 0 HG12 ILE A 69 7.723 0.255 -11.946 1.00 0.00 H new ATOM 0 HG13 ILE A 69 7.225 1.536 -13.033 1.00 0.00 H new ATOM 0 HG21 ILE A 69 6.761 3.954 -11.923 1.00 0.00 H new ATOM 0 HG22 ILE A 69 6.712 3.900 -10.144 1.00 0.00 H new ATOM 0 HG23 ILE A 69 8.205 4.391 -10.980 1.00 0.00 H new ATOM 0 HD11 ILE A 69 9.454 0.657 -13.677 1.00 0.00 H new ATOM 0 HD12 ILE A 69 9.579 2.357 -13.167 1.00 0.00 H new ATOM 0 HD13 ILE A 69 10.085 1.057 -12.062 1.00 0.00 H new ATOM 1019 N ASP A 70 6.636 1.628 -8.450 1.00 0.00 N ATOM 1020 CA ASP A 70 5.696 1.818 -7.357 1.00 0.00 C ATOM 1021 C ASP A 70 6.218 1.100 -6.097 1.00 0.00 C ATOM 1022 O ASP A 70 5.814 1.447 -4.994 1.00 0.00 O ATOM 1023 CB ASP A 70 4.299 1.359 -7.830 1.00 0.00 C ATOM 1024 CG ASP A 70 3.217 1.451 -6.735 1.00 0.00 C ATOM 1025 OD1 ASP A 70 2.763 2.557 -6.444 1.00 0.00 O ATOM 1026 OD2 ASP A 70 2.837 0.417 -6.189 1.00 0.00 O ATOM 0 H ASP A 70 6.297 1.004 -9.182 1.00 0.00 H new ATOM 0 HA ASP A 70 5.601 2.867 -7.075 1.00 0.00 H new ATOM 0 HB2 ASP A 70 3.995 1.967 -8.682 1.00 0.00 H new ATOM 0 HB3 ASP A 70 4.363 0.329 -8.180 1.00 0.00 H new ATOM 1031 N CYS A 71 7.129 0.116 -6.280 1.00 0.00 N ATOM 1032 CA CYS A 71 7.664 -0.609 -5.135 1.00 0.00 C ATOM 1033 C CYS A 71 8.620 0.323 -4.398 1.00 0.00 C ATOM 1034 O CYS A 71 8.455 0.591 -3.214 1.00 0.00 O ATOM 1035 CB CYS A 71 8.426 -1.865 -5.574 1.00 0.00 C ATOM 1036 SG CYS A 71 9.322 -2.663 -4.215 1.00 0.00 S ATOM 0 H CYS A 71 7.492 -0.178 -7.187 1.00 0.00 H new ATOM 0 HA CYS A 71 6.841 -0.924 -4.494 1.00 0.00 H new ATOM 0 HB2 CYS A 71 7.723 -2.577 -6.006 1.00 0.00 H new ATOM 0 HB3 CYS A 71 9.132 -1.598 -6.360 1.00 0.00 H new ATOM 0 HG CYS A 71 8.503 -3.409 -3.535 1.00 0.00 H new ATOM 1042 N LYS A 72 9.616 0.811 -5.175 1.00 0.00 N ATOM 1043 CA LYS A 72 10.644 1.675 -4.615 1.00 0.00 C ATOM 1044 C LYS A 72 10.201 3.142 -4.725 1.00 0.00 C ATOM 1045 O LYS A 72 11.005 4.064 -4.663 1.00 0.00 O ATOM 1046 CB LYS A 72 11.993 1.380 -5.306 1.00 0.00 C ATOM 1047 CG LYS A 72 12.262 -0.122 -5.524 1.00 0.00 C ATOM 1048 CD LYS A 72 13.644 -0.377 -6.139 1.00 0.00 C ATOM 1049 CE LYS A 72 13.817 -1.805 -6.666 1.00 0.00 C ATOM 1050 NZ LYS A 72 13.689 -2.830 -5.645 1.00 0.00 N ATOM 0 H LYS A 72 9.716 0.617 -6.171 1.00 0.00 H new ATOM 0 HA LYS A 72 10.786 1.475 -3.553 1.00 0.00 H new ATOM 0 HB2 LYS A 72 12.016 1.888 -6.270 1.00 0.00 H new ATOM 0 HB3 LYS A 72 12.799 1.801 -4.705 1.00 0.00 H new ATOM 0 HG2 LYS A 72 12.188 -0.645 -4.571 1.00 0.00 H new ATOM 0 HG3 LYS A 72 11.493 -0.537 -6.176 1.00 0.00 H new ATOM 0 HD2 LYS A 72 13.806 0.327 -6.955 1.00 0.00 H new ATOM 0 HD3 LYS A 72 14.410 -0.178 -5.390 1.00 0.00 H new ATOM 0 HE2 LYS A 72 13.075 -1.987 -7.444 1.00 0.00 H new ATOM 0 HE3 LYS A 72 14.798 -1.893 -7.134 1.00 0.00 H new ATOM 0 HZ1 LYS A 72 14.539 -3.429 -5.646 1.00 0.00 H new ATOM 0 HZ2 LYS A 72 13.583 -2.380 -4.713 1.00 0.00 H new ATOM 0 HZ3 LYS A 72 12.853 -3.415 -5.844 1.00 0.00 H new ATOM 1063 N GLY A 73 8.877 3.289 -4.864 1.00 0.00 N ATOM 1064 CA GLY A 73 8.197 4.566 -4.981 1.00 0.00 C ATOM 1065 C GLY A 73 7.519 4.918 -3.654 1.00 0.00 C ATOM 1066 O GLY A 73 7.316 6.080 -3.329 1.00 0.00 O ATOM 0 H GLY A 73 8.239 2.494 -4.898 1.00 0.00 H new ATOM 0 HA2 GLY A 73 8.910 5.344 -5.253 1.00 0.00 H new ATOM 0 HA3 GLY A 73 7.455 4.521 -5.778 1.00 0.00 H new ATOM 1070 N LEU A 74 7.187 3.831 -2.919 1.00 0.00 N ATOM 1071 CA LEU A 74 6.559 3.940 -1.615 1.00 0.00 C ATOM 1072 C LEU A 74 7.707 4.108 -0.609 1.00 0.00 C ATOM 1073 O LEU A 74 7.544 4.713 0.442 1.00 0.00 O ATOM 1074 CB LEU A 74 5.709 2.692 -1.324 1.00 0.00 C ATOM 1075 CG LEU A 74 4.638 2.410 -2.458 1.00 0.00 C ATOM 1076 CD1 LEU A 74 3.765 1.161 -2.875 1.00 0.00 C ATOM 1077 CD2 LEU A 74 3.643 3.592 -2.401 1.00 0.00 C ATOM 0 H LEU A 74 7.351 2.871 -3.223 1.00 0.00 H new ATOM 0 HA LEU A 74 5.875 4.787 -1.556 1.00 0.00 H new ATOM 0 HB2 LEU A 74 6.363 1.826 -1.223 1.00 0.00 H new ATOM 0 HB3 LEU A 74 5.198 2.819 -0.369 1.00 0.00 H new ATOM 0 HG LEU A 74 5.415 2.183 -3.187 1.00 0.00 H new ATOM 0 HD11 LEU A 74 3.149 1.419 -3.736 1.00 0.00 H new ATOM 0 HD12 LEU A 74 4.420 0.329 -3.133 1.00 0.00 H new ATOM 0 HD13 LEU A 74 3.123 0.872 -2.043 1.00 0.00 H new ATOM 0 HD21 LEU A 74 2.875 3.458 -3.162 1.00 0.00 H new ATOM 0 HD22 LEU A 74 3.176 3.628 -1.417 1.00 0.00 H new ATOM 0 HD23 LEU A 74 4.176 4.525 -2.584 1.00 0.00 H new ATOM 1089 N ARG A 75 8.878 3.549 -0.998 1.00 0.00 N ATOM 1090 CA ARG A 75 10.079 3.661 -0.186 1.00 0.00 C ATOM 1091 C ARG A 75 10.529 5.130 -0.322 1.00 0.00 C ATOM 1092 O ARG A 75 11.073 5.719 0.604 1.00 0.00 O ATOM 1093 CB ARG A 75 11.166 2.699 -0.705 1.00 0.00 C ATOM 1094 CG ARG A 75 10.720 1.231 -0.758 1.00 0.00 C ATOM 1095 CD ARG A 75 10.695 0.526 0.610 1.00 0.00 C ATOM 1096 NE ARG A 75 9.816 -0.645 0.656 1.00 0.00 N ATOM 1097 CZ ARG A 75 9.710 -1.616 -0.286 1.00 0.00 C ATOM 1098 NH1 ARG A 75 10.448 -1.629 -1.392 1.00 0.00 N ATOM 1099 NH2 ARG A 75 8.843 -2.605 -0.102 1.00 0.00 N ATOM 0 H ARG A 75 9.000 3.024 -1.864 1.00 0.00 H new ATOM 0 HA ARG A 75 9.898 3.395 0.855 1.00 0.00 H new ATOM 0 HB2 ARG A 75 11.469 3.013 -1.704 1.00 0.00 H new ATOM 0 HB3 ARG A 75 12.045 2.779 -0.065 1.00 0.00 H new ATOM 0 HG2 ARG A 75 9.723 1.182 -1.197 1.00 0.00 H new ATOM 0 HG3 ARG A 75 11.389 0.684 -1.423 1.00 0.00 H new ATOM 0 HD2 ARG A 75 11.708 0.218 0.868 1.00 0.00 H new ATOM 0 HD3 ARG A 75 10.375 1.239 1.370 1.00 0.00 H new ATOM 0 HE ARG A 75 9.223 -0.740 1.480 1.00 0.00 H new ATOM 0 HH11 ARG A 75 11.129 -0.888 -1.560 1.00 0.00 H new ATOM 0 HH12 ARG A 75 10.334 -2.380 -2.073 1.00 0.00 H new ATOM 0 HH21 ARG A 75 8.267 -2.628 0.739 1.00 0.00 H new ATOM 0 HH22 ARG A 75 8.753 -3.341 -0.802 1.00 0.00 H new ATOM 1113 N GLU A 76 10.244 5.677 -1.533 1.00 0.00 N ATOM 1114 CA GLU A 76 10.568 7.050 -1.867 1.00 0.00 C ATOM 1115 C GLU A 76 9.513 7.972 -1.216 1.00 0.00 C ATOM 1116 O GLU A 76 9.798 9.137 -0.982 1.00 0.00 O ATOM 1117 CB GLU A 76 10.608 7.209 -3.397 1.00 0.00 C ATOM 1118 CG GLU A 76 11.043 8.610 -3.858 1.00 0.00 C ATOM 1119 CD GLU A 76 11.114 8.673 -5.393 1.00 0.00 C ATOM 1120 OE1 GLU A 76 10.082 8.910 -6.021 1.00 0.00 O ATOM 1121 OE2 GLU A 76 12.198 8.486 -5.944 1.00 0.00 O ATOM 0 H GLU A 76 9.786 5.165 -2.287 1.00 0.00 H new ATOM 0 HA GLU A 76 11.551 7.326 -1.485 1.00 0.00 H new ATOM 0 HB2 GLU A 76 11.292 6.470 -3.813 1.00 0.00 H new ATOM 0 HB3 GLU A 76 9.620 6.992 -3.803 1.00 0.00 H new ATOM 0 HG2 GLU A 76 10.339 9.356 -3.490 1.00 0.00 H new ATOM 0 HG3 GLU A 76 12.017 8.854 -3.433 1.00 0.00 H new ATOM 1128 N LYS A 77 8.305 7.419 -0.929 1.00 0.00 N ATOM 1129 CA LYS A 77 7.210 8.160 -0.321 1.00 0.00 C ATOM 1130 C LYS A 77 7.488 8.324 1.195 1.00 0.00 C ATOM 1131 O LYS A 77 6.866 9.134 1.872 1.00 0.00 O ATOM 1132 CB LYS A 77 5.895 7.391 -0.550 1.00 0.00 C ATOM 1133 CG LYS A 77 4.622 8.164 -0.185 1.00 0.00 C ATOM 1134 CD LYS A 77 3.395 7.245 -0.166 1.00 0.00 C ATOM 1135 CE LYS A 77 2.098 8.009 0.096 1.00 0.00 C ATOM 1136 NZ LYS A 77 1.712 8.834 -1.038 1.00 0.00 N ATOM 0 H LYS A 77 8.080 6.443 -1.120 1.00 0.00 H new ATOM 0 HA LYS A 77 7.124 9.149 -0.772 1.00 0.00 H new ATOM 0 HB2 LYS A 77 5.838 7.102 -1.599 1.00 0.00 H new ATOM 0 HB3 LYS A 77 5.923 6.471 0.033 1.00 0.00 H new ATOM 0 HG2 LYS A 77 4.745 8.629 0.793 1.00 0.00 H new ATOM 0 HG3 LYS A 77 4.465 8.969 -0.903 1.00 0.00 H new ATOM 0 HD2 LYS A 77 3.320 6.724 -1.121 1.00 0.00 H new ATOM 0 HD3 LYS A 77 3.527 6.484 0.603 1.00 0.00 H new ATOM 0 HE2 LYS A 77 1.299 7.301 0.318 1.00 0.00 H new ATOM 0 HE3 LYS A 77 2.220 8.639 0.977 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 1.376 9.757 -0.697 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 2.533 8.973 -1.661 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 0.951 8.362 -1.567 1.00 0.00 H new ATOM 1149 N CYS A 78 8.429 7.499 1.696 1.00 0.00 N ATOM 1150 CA CYS A 78 8.816 7.488 3.101 1.00 0.00 C ATOM 1151 C CYS A 78 9.950 8.469 3.261 1.00 0.00 C ATOM 1152 O CYS A 78 10.023 9.284 4.172 1.00 0.00 O ATOM 1153 CB CYS A 78 9.104 6.058 3.568 1.00 0.00 C ATOM 1154 SG CYS A 78 7.635 5.022 3.368 1.00 0.00 S ATOM 0 H CYS A 78 8.938 6.823 1.126 1.00 0.00 H new ATOM 0 HA CYS A 78 8.012 7.816 3.760 1.00 0.00 H new ATOM 0 HB2 CYS A 78 9.932 5.641 2.994 1.00 0.00 H new ATOM 0 HB3 CYS A 78 9.412 6.065 4.613 1.00 0.00 H new ATOM 0 HG CYS A 78 7.924 3.794 3.681 1.00 0.00 H new ATOM 1160 N ASP A 79 10.795 8.313 2.245 1.00 0.00 N ATOM 1161 CA ASP A 79 11.979 9.097 2.026 1.00 0.00 C ATOM 1162 C ASP A 79 11.563 10.476 1.484 1.00 0.00 C ATOM 1163 O ASP A 79 12.391 11.349 1.254 1.00 0.00 O ATOM 1164 CB ASP A 79 13.004 8.329 1.168 1.00 0.00 C ATOM 1165 CG ASP A 79 14.376 9.026 1.140 1.00 0.00 C ATOM 1166 OD1 ASP A 79 15.085 8.971 2.144 1.00 0.00 O ATOM 1167 OD2 ASP A 79 14.721 9.614 0.115 1.00 0.00 O ATOM 0 H ASP A 79 10.655 7.602 1.527 1.00 0.00 H new ATOM 0 HA ASP A 79 12.510 9.280 2.960 1.00 0.00 H new ATOM 0 HB2 ASP A 79 13.119 7.319 1.560 1.00 0.00 H new ATOM 0 HB3 ASP A 79 12.625 8.234 0.150 1.00 0.00 H new ATOM 1172 N GLU A 80 10.236 10.619 1.323 1.00 0.00 N ATOM 1173 CA GLU A 80 9.604 11.841 0.883 1.00 0.00 C ATOM 1174 C GLU A 80 9.545 12.699 2.139 1.00 0.00 C ATOM 1175 O GLU A 80 10.009 13.832 2.185 1.00 0.00 O ATOM 1176 CB GLU A 80 8.201 11.632 0.276 1.00 0.00 C ATOM 1177 CG GLU A 80 7.507 12.926 -0.182 1.00 0.00 C ATOM 1178 CD GLU A 80 8.293 13.625 -1.303 1.00 0.00 C ATOM 1179 OE1 GLU A 80 8.176 13.207 -2.454 1.00 0.00 O ATOM 1180 OE2 GLU A 80 9.015 14.580 -1.013 1.00 0.00 O ATOM 0 H GLU A 80 9.574 9.864 1.503 1.00 0.00 H new ATOM 0 HA GLU A 80 10.167 12.302 0.071 1.00 0.00 H new ATOM 0 HB2 GLU A 80 8.284 10.958 -0.576 1.00 0.00 H new ATOM 0 HB3 GLU A 80 7.569 11.137 1.014 1.00 0.00 H new ATOM 0 HG2 GLU A 80 6.501 12.695 -0.532 1.00 0.00 H new ATOM 0 HG3 GLU A 80 7.402 13.603 0.666 1.00 0.00 H new ATOM 1187 N ALA A 81 8.928 12.039 3.145 1.00 0.00 N ATOM 1188 CA ALA A 81 8.721 12.597 4.476 1.00 0.00 C ATOM 1189 C ALA A 81 7.872 13.871 4.318 1.00 0.00 C ATOM 1190 O ALA A 81 8.106 14.888 4.959 1.00 0.00 O ATOM 1191 CB ALA A 81 10.059 12.848 5.195 1.00 0.00 C ATOM 0 H ALA A 81 8.560 11.093 3.041 1.00 0.00 H new ATOM 0 HA ALA A 81 8.188 11.891 5.113 1.00 0.00 H new ATOM 0 HB1 ALA A 81 9.868 13.264 6.184 1.00 0.00 H new ATOM 0 HB2 ALA A 81 10.600 11.907 5.295 1.00 0.00 H new ATOM 0 HB3 ALA A 81 10.657 13.551 4.615 1.00 0.00 H new ATOM 1197 N GLY A 82 6.881 13.729 3.413 1.00 0.00 N ATOM 1198 CA GLY A 82 5.943 14.791 3.081 1.00 0.00 C ATOM 1199 C GLY A 82 4.568 14.160 2.878 1.00 0.00 C ATOM 1200 O GLY A 82 3.572 14.575 3.458 1.00 0.00 O ATOM 0 H GLY A 82 6.719 12.865 2.896 1.00 0.00 H new ATOM 0 HA2 GLY A 82 5.908 15.532 3.880 1.00 0.00 H new ATOM 0 HA3 GLY A 82 6.261 15.311 2.177 1.00 0.00 H new ATOM 1204 N LEU A 83 4.600 13.118 2.016 1.00 0.00 N ATOM 1205 CA LEU A 83 3.399 12.359 1.716 1.00 0.00 C ATOM 1206 C LEU A 83 3.428 11.213 2.725 1.00 0.00 C ATOM 1207 O LEU A 83 4.359 10.417 2.764 1.00 0.00 O ATOM 1208 CB LEU A 83 3.418 11.841 0.272 1.00 0.00 C ATOM 1209 CG LEU A 83 3.338 12.983 -0.789 1.00 0.00 C ATOM 1210 CD1 LEU A 83 3.463 12.350 -2.203 1.00 0.00 C ATOM 1211 CD2 LEU A 83 2.661 14.351 -0.541 1.00 0.00 C ATOM 0 H LEU A 83 5.439 12.799 1.530 1.00 0.00 H new ATOM 0 HA LEU A 83 2.491 12.957 1.794 1.00 0.00 H new ATOM 0 HB2 LEU A 83 4.330 11.266 0.110 1.00 0.00 H new ATOM 0 HB3 LEU A 83 2.581 11.158 0.126 1.00 0.00 H new ATOM 0 HG LEU A 83 4.164 13.669 -0.601 1.00 0.00 H new ATOM 0 HD11 LEU A 83 3.409 13.134 -2.959 1.00 0.00 H new ATOM 0 HD12 LEU A 83 4.418 11.831 -2.286 1.00 0.00 H new ATOM 0 HD13 LEU A 83 2.650 11.641 -2.357 1.00 0.00 H new ATOM 0 HD21 LEU A 83 2.743 14.965 -1.438 1.00 0.00 H new ATOM 0 HD22 LEU A 83 1.609 14.198 -0.301 1.00 0.00 H new ATOM 0 HD23 LEU A 83 3.154 14.855 0.290 1.00 0.00 H new ATOM 1223 N LYS A 84 2.350 11.194 3.538 1.00 0.00 N ATOM 1224 CA LYS A 84 2.222 10.185 4.574 1.00 0.00 C ATOM 1225 C LYS A 84 1.781 8.899 3.869 1.00 0.00 C ATOM 1226 O LYS A 84 0.815 8.865 3.118 1.00 0.00 O ATOM 1227 CB LYS A 84 1.262 10.649 5.687 1.00 0.00 C ATOM 1228 CG LYS A 84 -0.219 10.764 5.278 1.00 0.00 C ATOM 1229 CD LYS A 84 -1.084 9.614 5.813 1.00 0.00 C ATOM 1230 CE LYS A 84 -1.451 9.818 7.288 1.00 0.00 C ATOM 1231 NZ LYS A 84 -2.203 8.703 7.843 1.00 0.00 N ATOM 0 H LYS A 84 1.578 11.858 3.488 1.00 0.00 H new ATOM 0 HA LYS A 84 3.164 10.006 5.092 1.00 0.00 H new ATOM 0 HB2 LYS A 84 1.338 9.952 6.522 1.00 0.00 H new ATOM 0 HB3 LYS A 84 1.597 11.620 6.051 1.00 0.00 H new ATOM 0 HG2 LYS A 84 -0.618 11.710 5.643 1.00 0.00 H new ATOM 0 HG3 LYS A 84 -0.288 10.787 4.190 1.00 0.00 H new ATOM 0 HD2 LYS A 84 -1.995 9.537 5.219 1.00 0.00 H new ATOM 0 HD3 LYS A 84 -0.548 8.672 5.698 1.00 0.00 H new ATOM 0 HE2 LYS A 84 -0.539 9.959 7.868 1.00 0.00 H new ATOM 0 HE3 LYS A 84 -2.037 10.731 7.388 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 -2.467 8.917 8.826 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 -3.063 8.549 7.279 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 -1.617 7.844 7.822 1.00 0.00 H new ATOM 1244 N GLY A 85 2.586 7.860 4.155 1.00 0.00 N ATOM 1245 CA GLY A 85 2.343 6.549 3.583 1.00 0.00 C ATOM 1246 C GLY A 85 3.531 5.639 3.890 1.00 0.00 C ATOM 1247 O GLY A 85 4.157 5.068 3.005 1.00 0.00 O ATOM 0 H GLY A 85 3.397 7.913 4.772 1.00 0.00 H new ATOM 0 HA2 GLY A 85 1.428 6.123 3.995 1.00 0.00 H new ATOM 0 HA3 GLY A 85 2.200 6.630 2.505 1.00 0.00 H new ATOM 1251 N ILE A 86 3.782 5.556 5.217 1.00 0.00 N ATOM 1252 CA ILE A 86 4.858 4.738 5.760 1.00 0.00 C ATOM 1253 C ILE A 86 4.214 3.438 6.260 1.00 0.00 C ATOM 1254 O ILE A 86 4.656 2.836 7.230 1.00 0.00 O ATOM 1255 CB ILE A 86 5.623 5.479 6.902 1.00 0.00 C ATOM 1256 CG1 ILE A 86 7.104 5.076 7.093 1.00 0.00 C ATOM 1257 CG2 ILE A 86 4.614 6.110 7.916 1.00 0.00 C ATOM 1258 CD1 ILE A 86 7.858 5.754 8.257 1.00 0.00 C ATOM 0 H ILE A 86 3.242 6.054 5.924 1.00 0.00 H new ATOM 0 HA ILE A 86 5.605 4.527 4.995 1.00 0.00 H new ATOM 0 HB ILE A 86 6.135 6.434 6.785 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.148 3.997 7.241 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.639 5.293 6.168 1.00 0.00 H new ATOM 0 HG21 ILE A 86 5.164 6.622 8.705 1.00 0.00 H new ATOM 0 HG22 ILE A 86 3.975 6.824 7.397 1.00 0.00 H new ATOM 0 HG23 ILE A 86 3.999 5.324 8.354 1.00 0.00 H new ATOM 0 HD11 ILE A 86 8.885 5.390 8.287 1.00 0.00 H new ATOM 0 HD12 ILE A 86 7.860 6.834 8.109 1.00 0.00 H new ATOM 0 HD13 ILE A 86 7.362 5.518 9.198 1.00 0.00 H new ATOM 1270 N LYS A 87 3.142 3.058 5.535 1.00 0.00 N ATOM 1271 CA LYS A 87 2.380 1.860 5.799 1.00 0.00 C ATOM 1272 C LYS A 87 1.995 1.399 4.402 1.00 0.00 C ATOM 1273 O LYS A 87 1.231 2.046 3.700 1.00 0.00 O ATOM 1274 CB LYS A 87 1.114 2.146 6.617 1.00 0.00 C ATOM 1275 CG LYS A 87 1.380 2.697 8.023 1.00 0.00 C ATOM 1276 CD LYS A 87 2.045 1.663 8.939 1.00 0.00 C ATOM 1277 CE LYS A 87 2.084 2.107 10.404 1.00 0.00 C ATOM 1278 NZ LYS A 87 2.868 3.320 10.603 1.00 0.00 N ATOM 0 H LYS A 87 2.791 3.595 4.742 1.00 0.00 H new ATOM 0 HA LYS A 87 2.944 1.131 6.381 1.00 0.00 H new ATOM 0 HB2 LYS A 87 0.497 2.859 6.071 1.00 0.00 H new ATOM 0 HB3 LYS A 87 0.536 1.226 6.704 1.00 0.00 H new ATOM 0 HG2 LYS A 87 2.018 3.578 7.951 1.00 0.00 H new ATOM 0 HG3 LYS A 87 0.439 3.021 8.468 1.00 0.00 H new ATOM 0 HD2 LYS A 87 1.506 0.718 8.864 1.00 0.00 H new ATOM 0 HD3 LYS A 87 3.062 1.478 8.593 1.00 0.00 H new ATOM 0 HE2 LYS A 87 1.066 2.275 10.756 1.00 0.00 H new ATOM 0 HE3 LYS A 87 2.503 1.305 11.012 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 2.890 3.557 11.615 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 3.839 3.166 10.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 2.436 4.104 10.073 1.00 0.00 H new ATOM 1291 N LEU A 88 2.589 0.250 4.051 1.00 0.00 N ATOM 1292 CA LEU A 88 2.353 -0.340 2.748 1.00 0.00 C ATOM 1293 C LEU A 88 2.255 -1.827 3.043 1.00 0.00 C ATOM 1294 O LEU A 88 3.253 -2.530 3.145 1.00 0.00 O ATOM 1295 CB LEU A 88 3.504 -0.014 1.775 1.00 0.00 C ATOM 1296 CG LEU A 88 3.947 1.480 1.808 1.00 0.00 C ATOM 1297 CD1 LEU A 88 2.960 2.371 1.003 1.00 0.00 C ATOM 1298 CD2 LEU A 88 5.184 2.032 2.584 1.00 0.00 C ATOM 0 H LEU A 88 3.226 -0.275 4.650 1.00 0.00 H new ATOM 0 HA LEU A 88 1.457 0.042 2.258 1.00 0.00 H new ATOM 0 HB2 LEU A 88 4.361 -0.643 2.016 1.00 0.00 H new ATOM 0 HB3 LEU A 88 3.195 -0.270 0.762 1.00 0.00 H new ATOM 0 HG LEU A 88 4.954 1.732 2.141 1.00 0.00 H new ATOM 0 HD11 LEU A 88 3.292 3.409 1.042 1.00 0.00 H new ATOM 0 HD12 LEU A 88 2.932 2.038 -0.034 1.00 0.00 H new ATOM 0 HD13 LEU A 88 1.963 2.293 1.436 1.00 0.00 H new ATOM 0 HD21 LEU A 88 5.257 3.109 2.433 1.00 0.00 H new ATOM 0 HD22 LEU A 88 5.070 1.822 3.647 1.00 0.00 H new ATOM 0 HD23 LEU A 88 6.090 1.551 2.214 1.00 0.00 H new ATOM 1310 N PHE A 89 0.986 -2.266 3.161 1.00 0.00 N ATOM 1311 CA PHE A 89 0.725 -3.662 3.460 1.00 0.00 C ATOM 1312 C PHE A 89 0.392 -4.219 2.070 1.00 0.00 C ATOM 1313 O PHE A 89 -0.744 -4.340 1.624 1.00 0.00 O ATOM 1314 CB PHE A 89 -0.381 -3.745 4.537 1.00 0.00 C ATOM 1315 CG PHE A 89 -0.395 -5.000 5.385 1.00 0.00 C ATOM 1316 CD1 PHE A 89 0.485 -6.067 5.182 1.00 0.00 C ATOM 1317 CD2 PHE A 89 -1.338 -5.113 6.402 1.00 0.00 C ATOM 1318 CE1 PHE A 89 0.405 -7.215 5.956 1.00 0.00 C ATOM 1319 CE2 PHE A 89 -1.413 -6.260 7.180 1.00 0.00 C ATOM 1320 CZ PHE A 89 -0.545 -7.315 6.957 1.00 0.00 C ATOM 0 H PHE A 89 0.156 -1.682 3.055 1.00 0.00 H new ATOM 0 HA PHE A 89 1.531 -4.246 3.905 1.00 0.00 H new ATOM 0 HB2 PHE A 89 -0.280 -2.885 5.199 1.00 0.00 H new ATOM 0 HB3 PHE A 89 -1.348 -3.655 4.043 1.00 0.00 H new ATOM 0 HD1 PHE A 89 1.238 -5.996 4.411 1.00 0.00 H new ATOM 0 HD2 PHE A 89 -2.021 -4.297 6.588 1.00 0.00 H new ATOM 0 HE1 PHE A 89 1.086 -8.034 5.777 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -2.153 -6.330 7.964 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.609 -8.209 7.560 1.00 0.00 H new ATOM 1330 N VAL A 90 1.524 -4.557 1.430 1.00 0.00 N ATOM 1331 CA VAL A 90 1.513 -5.027 0.065 1.00 0.00 C ATOM 1332 C VAL A 90 1.355 -6.554 0.026 1.00 0.00 C ATOM 1333 O VAL A 90 2.261 -7.364 0.187 1.00 0.00 O ATOM 1334 CB VAL A 90 2.820 -4.471 -0.593 1.00 0.00 C ATOM 1335 CG1 VAL A 90 2.584 -2.952 -0.875 1.00 0.00 C ATOM 1336 CG2 VAL A 90 4.243 -4.949 -0.264 1.00 0.00 C ATOM 0 H VAL A 90 2.452 -4.508 1.851 1.00 0.00 H new ATOM 0 HA VAL A 90 0.661 -4.666 -0.511 1.00 0.00 H new ATOM 0 HB VAL A 90 2.939 -5.076 -1.492 1.00 0.00 H new ATOM 0 HG11 VAL A 90 3.475 -2.525 -1.335 1.00 0.00 H new ATOM 0 HG12 VAL A 90 1.735 -2.835 -1.549 1.00 0.00 H new ATOM 0 HG13 VAL A 90 2.377 -2.436 0.062 1.00 0.00 H new ATOM 0 HG21 VAL A 90 4.962 -4.394 -0.867 1.00 0.00 H new ATOM 0 HG22 VAL A 90 4.448 -4.780 0.793 1.00 0.00 H new ATOM 0 HG23 VAL A 90 4.330 -6.013 -0.485 1.00 0.00 H new ATOM 1346 N GLY A 91 0.068 -6.857 -0.206 1.00 0.00 N ATOM 1347 CA GLY A 91 -0.359 -8.241 -0.321 1.00 0.00 C ATOM 1348 C GLY A 91 0.272 -8.975 -1.511 1.00 0.00 C ATOM 1349 O GLY A 91 0.319 -8.482 -2.630 1.00 0.00 O ATOM 0 H GLY A 91 -0.676 -6.168 -0.315 1.00 0.00 H new ATOM 0 HA2 GLY A 91 -0.106 -8.769 0.598 1.00 0.00 H new ATOM 0 HA3 GLY A 91 -1.444 -8.272 -0.418 1.00 0.00 H new ATOM 1353 N GLY A 92 0.756 -10.188 -1.156 1.00 0.00 N ATOM 1354 CA GLY A 92 1.416 -11.082 -2.096 1.00 0.00 C ATOM 1355 C GLY A 92 2.934 -10.885 -2.020 1.00 0.00 C ATOM 1356 O GLY A 92 3.669 -11.704 -1.481 1.00 0.00 O ATOM 0 H GLY A 92 0.693 -10.560 -0.209 1.00 0.00 H new ATOM 0 HA2 GLY A 92 1.162 -12.117 -1.867 1.00 0.00 H new ATOM 0 HA3 GLY A 92 1.064 -10.884 -3.109 1.00 0.00 H new ATOM 1360 N ASN A 93 3.300 -9.726 -2.616 1.00 0.00 N ATOM 1361 CA ASN A 93 4.604 -9.099 -2.803 1.00 0.00 C ATOM 1362 C ASN A 93 5.736 -10.119 -2.629 1.00 0.00 C ATOM 1363 O ASN A 93 6.109 -10.479 -1.520 1.00 0.00 O ATOM 1364 CB ASN A 93 4.747 -7.895 -1.858 1.00 0.00 C ATOM 1365 CG ASN A 93 6.088 -7.158 -2.033 1.00 0.00 C ATOM 1366 OD1 ASN A 93 6.871 -7.020 -1.102 1.00 0.00 O ATOM 1367 ND2 ASN A 93 6.295 -6.700 -3.282 1.00 0.00 N ATOM 0 H ASN A 93 2.576 -9.138 -3.030 1.00 0.00 H new ATOM 0 HA ASN A 93 4.679 -8.727 -3.825 1.00 0.00 H new ATOM 0 HB2 ASN A 93 3.928 -7.198 -2.037 1.00 0.00 H new ATOM 0 HB3 ASN A 93 4.656 -8.235 -0.826 1.00 0.00 H new ATOM 0 HD21 ASN A 93 7.154 -6.198 -3.505 1.00 0.00 H new ATOM 0 HD22 ASN A 93 5.593 -6.855 -4.005 1.00 0.00 H new ATOM 1374 N ILE A 94 6.268 -10.505 -3.814 1.00 0.00 N ATOM 1375 CA ILE A 94 7.373 -11.435 -4.013 1.00 0.00 C ATOM 1376 C ILE A 94 6.994 -12.789 -3.375 1.00 0.00 C ATOM 1377 O ILE A 94 6.757 -12.920 -2.180 1.00 0.00 O ATOM 1378 CB ILE A 94 8.781 -10.865 -3.620 1.00 0.00 C ATOM 1379 CG1 ILE A 94 8.787 -9.436 -2.941 1.00 0.00 C ATOM 1380 CG2 ILE A 94 9.827 -12.040 -3.603 1.00 0.00 C ATOM 1381 CD1 ILE A 94 10.189 -8.806 -2.799 1.00 0.00 C ATOM 0 H ILE A 94 5.907 -10.147 -4.698 1.00 0.00 H new ATOM 0 HA ILE A 94 7.514 -11.601 -5.081 1.00 0.00 H new ATOM 0 HB ILE A 94 9.470 -10.242 -4.191 1.00 0.00 H new ATOM 0 HG12 ILE A 94 8.158 -8.766 -3.527 1.00 0.00 H new ATOM 0 HG13 ILE A 94 8.335 -9.515 -1.952 1.00 0.00 H new ATOM 0 HG21 ILE A 94 10.808 -11.650 -3.331 1.00 0.00 H new ATOM 0 HG22 ILE A 94 9.520 -12.790 -2.875 1.00 0.00 H new ATOM 0 HG23 ILE A 94 9.879 -12.495 -4.592 1.00 0.00 H new ATOM 0 HD11 ILE A 94 10.102 -7.829 -2.324 1.00 0.00 H new ATOM 0 HD12 ILE A 94 10.818 -9.452 -2.187 1.00 0.00 H new ATOM 0 HD13 ILE A 94 10.638 -8.692 -3.786 1.00 0.00 H new ATOM 1393 N VAL A 95 6.983 -13.792 -4.280 1.00 0.00 N ATOM 1394 CA VAL A 95 6.657 -15.168 -3.930 1.00 0.00 C ATOM 1395 C VAL A 95 7.851 -15.778 -3.176 1.00 0.00 C ATOM 1396 O VAL A 95 8.966 -15.271 -3.215 1.00 0.00 O ATOM 1397 CB VAL A 95 6.335 -15.965 -5.240 1.00 0.00 C ATOM 1398 CG1 VAL A 95 5.485 -17.233 -4.920 1.00 0.00 C ATOM 1399 CG2 VAL A 95 6.502 -15.372 -6.669 1.00 0.00 C ATOM 0 H VAL A 95 7.201 -13.658 -5.267 1.00 0.00 H new ATOM 0 HA VAL A 95 5.781 -15.211 -3.283 1.00 0.00 H new ATOM 0 HB VAL A 95 7.260 -16.271 -5.730 1.00 0.00 H new ATOM 0 HG11 VAL A 95 5.273 -17.771 -5.844 1.00 0.00 H new ATOM 0 HG12 VAL A 95 6.040 -17.881 -4.241 1.00 0.00 H new ATOM 0 HG13 VAL A 95 4.548 -16.934 -4.451 1.00 0.00 H new ATOM 0 HG21 VAL A 95 6.215 -16.119 -7.409 1.00 0.00 H new ATOM 0 HG22 VAL A 95 5.866 -14.493 -6.775 1.00 0.00 H new ATOM 0 HG23 VAL A 95 7.543 -15.088 -6.826 1.00 0.00 H new ATOM 1409 N VAL A 96 7.513 -16.895 -2.491 1.00 0.00 N ATOM 1410 CA VAL A 96 8.406 -17.717 -1.682 1.00 0.00 C ATOM 1411 C VAL A 96 9.380 -16.880 -0.836 1.00 0.00 C ATOM 1412 O VAL A 96 10.585 -16.856 -1.054 1.00 0.00 O ATOM 1413 CB VAL A 96 9.099 -18.817 -2.553 1.00 0.00 C ATOM 1414 CG1 VAL A 96 9.848 -18.207 -3.781 1.00 0.00 C ATOM 1415 CG2 VAL A 96 9.298 -20.304 -2.131 1.00 0.00 C ATOM 0 H VAL A 96 6.559 -17.255 -2.496 1.00 0.00 H new ATOM 0 HA VAL A 96 7.799 -18.247 -0.948 1.00 0.00 H new ATOM 0 HB VAL A 96 8.282 -19.509 -2.759 1.00 0.00 H new ATOM 0 HG11 VAL A 96 10.314 -19.007 -4.357 1.00 0.00 H new ATOM 0 HG12 VAL A 96 9.138 -17.672 -4.411 1.00 0.00 H new ATOM 0 HG13 VAL A 96 10.616 -17.516 -3.432 1.00 0.00 H new ATOM 0 HG21 VAL A 96 9.809 -20.843 -2.929 1.00 0.00 H new ATOM 0 HG22 VAL A 96 9.898 -20.347 -1.222 1.00 0.00 H new ATOM 0 HG23 VAL A 96 8.327 -20.763 -1.947 1.00 0.00 H new ATOM 1425 N GLY A 97 8.754 -16.208 0.152 1.00 0.00 N ATOM 1426 CA GLY A 97 9.503 -15.361 1.065 1.00 0.00 C ATOM 1427 C GLY A 97 8.528 -14.546 1.916 1.00 0.00 C ATOM 1428 O GLY A 97 7.615 -13.912 1.403 1.00 0.00 O ATOM 0 H GLY A 97 7.749 -16.242 0.326 1.00 0.00 H new ATOM 0 HA2 GLY A 97 10.140 -15.971 1.705 1.00 0.00 H new ATOM 0 HA3 GLY A 97 10.159 -14.695 0.505 1.00 0.00 H new ATOM 1432 N LYS A 98 8.776 -14.627 3.241 1.00 0.00 N ATOM 1433 CA LYS A 98 7.984 -13.920 4.238 1.00 0.00 C ATOM 1434 C LYS A 98 8.927 -13.835 5.438 1.00 0.00 C ATOM 1435 O LYS A 98 9.087 -14.795 6.182 1.00 0.00 O ATOM 1436 CB LYS A 98 6.684 -14.663 4.614 1.00 0.00 C ATOM 1437 CG LYS A 98 5.659 -14.743 3.471 1.00 0.00 C ATOM 1438 CD LYS A 98 4.283 -15.260 3.918 1.00 0.00 C ATOM 1439 CE LYS A 98 3.494 -14.266 4.781 1.00 0.00 C ATOM 1440 NZ LYS A 98 3.241 -12.995 4.113 1.00 0.00 N ATOM 0 H LYS A 98 9.532 -15.186 3.636 1.00 0.00 H new ATOM 0 HA LYS A 98 7.645 -12.951 3.872 1.00 0.00 H new ATOM 0 HB2 LYS A 98 6.935 -15.674 4.935 1.00 0.00 H new ATOM 0 HB3 LYS A 98 6.225 -14.162 5.466 1.00 0.00 H new ATOM 0 HG2 LYS A 98 5.541 -13.753 3.029 1.00 0.00 H new ATOM 0 HG3 LYS A 98 6.048 -15.396 2.690 1.00 0.00 H new ATOM 0 HD2 LYS A 98 3.694 -15.506 3.034 1.00 0.00 H new ATOM 0 HD3 LYS A 98 4.418 -16.185 4.479 1.00 0.00 H new ATOM 0 HE2 LYS A 98 2.542 -14.716 5.063 1.00 0.00 H new ATOM 0 HE3 LYS A 98 4.044 -14.080 5.704 1.00 0.00 H new ATOM 0 HZ1 LYS A 98 2.276 -12.674 4.332 1.00 0.00 H new ATOM 0 HZ2 LYS A 98 3.926 -12.286 4.445 1.00 0.00 H new ATOM 0 HZ3 LYS A 98 3.340 -13.117 3.085 1.00 0.00 H new ATOM 1453 N GLN A 99 9.537 -12.629 5.554 1.00 0.00 N ATOM 1454 CA GLN A 99 10.513 -12.260 6.581 1.00 0.00 C ATOM 1455 C GLN A 99 11.877 -12.479 5.914 1.00 0.00 C ATOM 1456 O GLN A 99 12.737 -11.607 5.900 1.00 0.00 O ATOM 1457 CB GLN A 99 10.363 -13.009 7.928 1.00 0.00 C ATOM 1458 CG GLN A 99 11.148 -12.389 9.099 1.00 0.00 C ATOM 1459 CD GLN A 99 12.672 -12.507 8.936 1.00 0.00 C ATOM 1460 OE1 GLN A 99 13.389 -11.518 8.854 1.00 0.00 O ATOM 1461 NE2 GLN A 99 13.112 -13.779 8.898 1.00 0.00 N ATOM 0 H GLN A 99 9.348 -11.866 4.904 1.00 0.00 H new ATOM 0 HA GLN A 99 10.365 -11.227 6.894 1.00 0.00 H new ATOM 0 HB2 GLN A 99 9.306 -13.043 8.194 1.00 0.00 H new ATOM 0 HB3 GLN A 99 10.691 -14.040 7.794 1.00 0.00 H new ATOM 0 HG2 GLN A 99 10.879 -11.337 9.191 1.00 0.00 H new ATOM 0 HG3 GLN A 99 10.849 -12.877 10.027 1.00 0.00 H new ATOM 0 HE21 GLN A 99 12.449 -14.550 8.973 1.00 0.00 H new ATOM 0 HE22 GLN A 99 14.108 -13.971 8.794 1.00 0.00 H new ATOM 1470 N ASN A 100 12.009 -13.705 5.360 1.00 0.00 N ATOM 1471 CA ASN A 100 13.205 -14.126 4.658 1.00 0.00 C ATOM 1472 C ASN A 100 12.997 -13.622 3.224 1.00 0.00 C ATOM 1473 O ASN A 100 12.297 -14.225 2.418 1.00 0.00 O ATOM 1474 CB ASN A 100 13.391 -15.656 4.765 1.00 0.00 C ATOM 1475 CG ASN A 100 12.158 -16.467 4.308 1.00 0.00 C ATOM 1476 OD1 ASN A 100 11.116 -16.475 4.950 1.00 0.00 O ATOM 1477 ND2 ASN A 100 12.356 -17.152 3.166 1.00 0.00 N ATOM 0 H ASN A 100 11.280 -14.418 5.396 1.00 0.00 H new ATOM 0 HA ASN A 100 14.126 -13.719 5.076 1.00 0.00 H new ATOM 0 HB2 ASN A 100 14.251 -15.951 4.164 1.00 0.00 H new ATOM 0 HB3 ASN A 100 13.621 -15.913 5.799 1.00 0.00 H new ATOM 0 HD21 ASN A 100 11.608 -17.728 2.780 1.00 0.00 H new ATOM 0 HD22 ASN A 100 13.254 -17.095 2.686 1.00 0.00 H new ATOM 1484 N TRP A 101 13.648 -12.464 2.979 1.00 0.00 N ATOM 1485 CA TRP A 101 13.562 -11.809 1.686 1.00 0.00 C ATOM 1486 C TRP A 101 14.963 -11.884 1.078 1.00 0.00 C ATOM 1487 O TRP A 101 15.941 -12.073 1.792 1.00 0.00 O ATOM 1488 CB TRP A 101 13.181 -10.331 1.871 1.00 0.00 C ATOM 1489 CG TRP A 101 11.796 -10.215 2.460 1.00 0.00 C ATOM 1490 CD1 TRP A 101 11.473 -9.726 3.727 1.00 0.00 C ATOM 1491 CD2 TRP A 101 10.554 -10.561 1.822 1.00 0.00 C ATOM 1492 NE1 TRP A 101 10.128 -9.755 3.887 1.00 0.00 N ATOM 1493 CE2 TRP A 101 9.524 -10.259 2.743 1.00 0.00 C ATOM 1494 CE3 TRP A 101 10.254 -11.080 0.592 1.00 0.00 C ATOM 1495 CZ2 TRP A 101 8.220 -10.487 2.403 1.00 0.00 C ATOM 1496 CZ3 TRP A 101 8.927 -11.314 0.245 1.00 0.00 C ATOM 1497 CH2 TRP A 101 7.913 -11.016 1.150 1.00 0.00 C ATOM 0 H TRP A 101 14.230 -11.979 3.662 1.00 0.00 H new ATOM 0 HA TRP A 101 12.812 -12.284 1.054 1.00 0.00 H new ATOM 0 HB2 TRP A 101 13.903 -9.842 2.524 1.00 0.00 H new ATOM 0 HB3 TRP A 101 13.219 -9.816 0.911 1.00 0.00 H new ATOM 0 HD1 TRP A 101 12.183 -9.379 4.463 1.00 0.00 H new ATOM 0 HE1 TRP A 101 9.632 -9.451 4.725 1.00 0.00 H new ATOM 0 HE3 TRP A 101 11.045 -11.307 -0.107 1.00 0.00 H new ATOM 0 HZ2 TRP A 101 7.430 -10.258 3.103 1.00 0.00 H new ATOM 0 HZ3 TRP A 101 8.685 -11.726 -0.724 1.00 0.00 H new ATOM 0 HH2 TRP A 101 6.883 -11.195 0.880 1.00 0.00 H new ATOM 1508 N PRO A 102 15.043 -11.712 -0.280 1.00 0.00 N ATOM 1509 CA PRO A 102 16.330 -11.719 -0.970 1.00 0.00 C ATOM 1510 C PRO A 102 17.030 -10.387 -0.606 1.00 0.00 C ATOM 1511 O PRO A 102 16.727 -9.745 0.393 1.00 0.00 O ATOM 1512 CB PRO A 102 15.978 -11.838 -2.474 1.00 0.00 C ATOM 1513 CG PRO A 102 14.474 -12.109 -2.543 1.00 0.00 C ATOM 1514 CD PRO A 102 13.902 -11.663 -1.198 1.00 0.00 C ATOM 0 HA PRO A 102 17.006 -12.530 -0.699 1.00 0.00 H new ATOM 0 HB2 PRO A 102 16.233 -10.922 -3.007 1.00 0.00 H new ATOM 0 HB3 PRO A 102 16.540 -12.646 -2.942 1.00 0.00 H new ATOM 0 HG2 PRO A 102 14.016 -11.557 -3.364 1.00 0.00 H new ATOM 0 HG3 PRO A 102 14.276 -13.166 -2.720 1.00 0.00 H new ATOM 0 HD2 PRO A 102 13.484 -10.658 -1.258 1.00 0.00 H new ATOM 0 HD3 PRO A 102 13.099 -12.323 -0.869 1.00 0.00 H new ATOM 1522 N ASP A 103 17.944 -9.987 -1.516 1.00 0.00 N ATOM 1523 CA ASP A 103 18.731 -8.772 -1.357 1.00 0.00 C ATOM 1524 C ASP A 103 17.804 -7.557 -1.537 1.00 0.00 C ATOM 1525 O ASP A 103 18.117 -6.461 -1.085 1.00 0.00 O ATOM 1526 CB ASP A 103 19.908 -8.759 -2.356 1.00 0.00 C ATOM 1527 CG ASP A 103 19.441 -8.849 -3.825 1.00 0.00 C ATOM 1528 OD1 ASP A 103 19.311 -9.961 -4.338 1.00 0.00 O ATOM 1529 OD2 ASP A 103 19.216 -7.806 -4.438 1.00 0.00 O ATOM 0 H ASP A 103 18.147 -10.502 -2.372 1.00 0.00 H new ATOM 0 HA ASP A 103 19.166 -8.730 -0.358 1.00 0.00 H new ATOM 0 HB2 ASP A 103 20.487 -7.846 -2.218 1.00 0.00 H new ATOM 0 HB3 ASP A 103 20.574 -9.594 -2.138 1.00 0.00 H new ATOM 1534 N VAL A 104 16.657 -7.808 -2.211 1.00 0.00 N ATOM 1535 CA VAL A 104 15.684 -6.761 -2.471 1.00 0.00 C ATOM 1536 C VAL A 104 15.155 -6.149 -1.174 1.00 0.00 C ATOM 1537 O VAL A 104 15.477 -5.006 -0.879 1.00 0.00 O ATOM 1538 CB VAL A 104 14.549 -7.218 -3.444 1.00 0.00 C ATOM 1539 CG1 VAL A 104 13.930 -8.587 -3.013 1.00 0.00 C ATOM 1540 CG2 VAL A 104 13.742 -6.220 -4.294 1.00 0.00 C ATOM 0 H VAL A 104 16.399 -8.725 -2.576 1.00 0.00 H new ATOM 0 HA VAL A 104 16.208 -5.964 -2.998 1.00 0.00 H new ATOM 0 HB VAL A 104 15.076 -7.394 -4.382 1.00 0.00 H new ATOM 0 HG11 VAL A 104 13.145 -8.869 -3.715 1.00 0.00 H new ATOM 0 HG12 VAL A 104 14.706 -9.352 -3.010 1.00 0.00 H new ATOM 0 HG13 VAL A 104 13.506 -8.496 -2.013 1.00 0.00 H new ATOM 0 HG21 VAL A 104 13.009 -6.761 -4.893 1.00 0.00 H new ATOM 0 HG22 VAL A 104 13.227 -5.517 -3.639 1.00 0.00 H new ATOM 0 HG23 VAL A 104 14.417 -5.674 -4.953 1.00 0.00 H new ATOM 1550 N GLU A 105 14.353 -6.930 -0.405 1.00 0.00 N ATOM 1551 CA GLU A 105 13.831 -6.357 0.827 1.00 0.00 C ATOM 1552 C GLU A 105 14.805 -6.645 1.971 1.00 0.00 C ATOM 1553 O GLU A 105 14.377 -6.721 3.112 1.00 0.00 O ATOM 1554 CB GLU A 105 12.378 -6.735 1.164 1.00 0.00 C ATOM 1555 CG GLU A 105 11.402 -6.490 0.001 1.00 0.00 C ATOM 1556 CD GLU A 105 9.953 -6.802 0.416 1.00 0.00 C ATOM 1557 OE1 GLU A 105 9.296 -5.921 0.970 1.00 0.00 O ATOM 1558 OE2 GLU A 105 9.494 -7.917 0.178 1.00 0.00 O ATOM 0 H GLU A 105 14.077 -7.891 -0.609 1.00 0.00 H new ATOM 0 HA GLU A 105 13.765 -5.280 0.670 1.00 0.00 H new ATOM 0 HB2 GLU A 105 12.339 -7.787 1.446 1.00 0.00 H new ATOM 0 HB3 GLU A 105 12.052 -6.160 2.031 1.00 0.00 H new ATOM 0 HG2 GLU A 105 11.474 -5.453 -0.326 1.00 0.00 H new ATOM 0 HG3 GLU A 105 11.682 -7.112 -0.849 1.00 0.00 H new ATOM 1565 N GLN A 106 16.111 -6.812 1.643 1.00 0.00 N ATOM 1566 CA GLN A 106 17.118 -6.981 2.686 1.00 0.00 C ATOM 1567 C GLN A 106 17.379 -5.542 3.173 1.00 0.00 C ATOM 1568 O GLN A 106 17.483 -5.260 4.361 1.00 0.00 O ATOM 1569 CB GLN A 106 18.407 -7.609 2.129 1.00 0.00 C ATOM 1570 CG GLN A 106 19.525 -7.747 3.173 1.00 0.00 C ATOM 1571 CD GLN A 106 20.761 -8.413 2.552 1.00 0.00 C ATOM 1572 OE1 GLN A 106 21.766 -7.770 2.273 1.00 0.00 O ATOM 1573 NE2 GLN A 106 20.615 -9.736 2.357 1.00 0.00 N ATOM 0 H GLN A 106 16.471 -6.831 0.689 1.00 0.00 H new ATOM 0 HA GLN A 106 16.787 -7.650 3.480 1.00 0.00 H new ATOM 0 HB2 GLN A 106 18.176 -8.594 1.724 1.00 0.00 H new ATOM 0 HB3 GLN A 106 18.769 -7.001 1.300 1.00 0.00 H new ATOM 0 HG2 GLN A 106 19.791 -6.764 3.562 1.00 0.00 H new ATOM 0 HG3 GLN A 106 19.171 -8.339 4.017 1.00 0.00 H new ATOM 0 HE21 GLN A 106 19.743 -10.197 2.618 1.00 0.00 H new ATOM 0 HE22 GLN A 106 21.376 -10.278 1.949 1.00 0.00 H new ATOM 1582 N ARG A 107 17.458 -4.658 2.148 1.00 0.00 N ATOM 1583 CA ARG A 107 17.670 -3.239 2.361 1.00 0.00 C ATOM 1584 C ARG A 107 16.309 -2.644 2.757 1.00 0.00 C ATOM 1585 O ARG A 107 16.260 -1.699 3.535 1.00 0.00 O ATOM 1586 CB ARG A 107 18.277 -2.568 1.112 1.00 0.00 C ATOM 1587 CG ARG A 107 17.538 -2.894 -0.197 1.00 0.00 C ATOM 1588 CD ARG A 107 18.062 -2.116 -1.406 1.00 0.00 C ATOM 1589 NE ARG A 107 17.809 -0.691 -1.232 1.00 0.00 N ATOM 1590 CZ ARG A 107 18.005 0.204 -2.225 1.00 0.00 C ATOM 1591 NH1 ARG A 107 18.456 -0.178 -3.419 1.00 0.00 N ATOM 1592 NH2 ARG A 107 17.741 1.488 -2.006 1.00 0.00 N ATOM 0 H ARG A 107 17.375 -4.923 1.167 1.00 0.00 H new ATOM 0 HA ARG A 107 18.395 -3.062 3.155 1.00 0.00 H new ATOM 0 HB2 ARG A 107 18.278 -1.488 1.257 1.00 0.00 H new ATOM 0 HB3 ARG A 107 19.318 -2.877 1.016 1.00 0.00 H new ATOM 0 HG2 ARG A 107 17.625 -3.962 -0.397 1.00 0.00 H new ATOM 0 HG3 ARG A 107 16.477 -2.679 -0.069 1.00 0.00 H new ATOM 0 HD2 ARG A 107 19.131 -2.292 -1.526 1.00 0.00 H new ATOM 0 HD3 ARG A 107 17.577 -2.471 -2.315 1.00 0.00 H new ATOM 0 HE ARG A 107 17.472 -0.358 -0.329 1.00 0.00 H new ATOM 0 HH11 ARG A 107 18.660 -1.162 -3.596 1.00 0.00 H new ATOM 0 HH12 ARG A 107 18.597 0.513 -4.156 1.00 0.00 H new ATOM 0 HH21 ARG A 107 17.394 1.789 -1.095 1.00 0.00 H new ATOM 0 HH22 ARG A 107 17.885 2.172 -2.749 1.00 0.00 H new ATOM 1606 N PHE A 108 15.212 -3.240 2.212 1.00 0.00 N ATOM 1607 CA PHE A 108 13.888 -2.734 2.563 1.00 0.00 C ATOM 1608 C PHE A 108 13.386 -3.512 3.795 1.00 0.00 C ATOM 1609 O PHE A 108 12.197 -3.481 4.082 1.00 0.00 O ATOM 1610 CB PHE A 108 12.868 -2.770 1.406 1.00 0.00 C ATOM 1611 CG PHE A 108 13.419 -2.241 0.106 1.00 0.00 C ATOM 1612 CD1 PHE A 108 14.022 -0.988 0.035 1.00 0.00 C ATOM 1613 CD2 PHE A 108 13.320 -2.998 -1.056 1.00 0.00 C ATOM 1614 CE1 PHE A 108 14.510 -0.502 -1.170 1.00 0.00 C ATOM 1615 CE2 PHE A 108 13.812 -2.521 -2.259 1.00 0.00 C ATOM 1616 CZ PHE A 108 14.407 -1.271 -2.320 1.00 0.00 C ATOM 0 H PHE A 108 15.228 -4.028 1.564 1.00 0.00 H new ATOM 0 HA PHE A 108 13.985 -1.673 2.794 1.00 0.00 H new ATOM 0 HB2 PHE A 108 12.532 -3.797 1.259 1.00 0.00 H new ATOM 0 HB3 PHE A 108 11.992 -2.185 1.686 1.00 0.00 H new ATOM 0 HD1 PHE A 108 14.111 -0.387 0.928 1.00 0.00 H new ATOM 0 HD2 PHE A 108 12.853 -3.971 -1.020 1.00 0.00 H new ATOM 0 HE1 PHE A 108 14.970 0.474 -1.212 1.00 0.00 H new ATOM 0 HE2 PHE A 108 13.732 -3.124 -3.151 1.00 0.00 H new ATOM 0 HZ PHE A 108 14.789 -0.897 -3.259 1.00 0.00 H new ATOM 1626 N LYS A 109 14.309 -4.243 4.478 1.00 0.00 N ATOM 1627 CA LYS A 109 13.966 -4.947 5.713 1.00 0.00 C ATOM 1628 C LYS A 109 14.258 -3.927 6.818 1.00 0.00 C ATOM 1629 O LYS A 109 13.545 -3.828 7.809 1.00 0.00 O ATOM 1630 CB LYS A 109 14.759 -6.255 5.948 1.00 0.00 C ATOM 1631 CG LYS A 109 13.838 -7.480 6.054 1.00 0.00 C ATOM 1632 CD LYS A 109 12.995 -7.479 7.339 1.00 0.00 C ATOM 1633 CE LYS A 109 12.010 -8.651 7.394 1.00 0.00 C ATOM 1634 NZ LYS A 109 11.201 -8.642 8.606 1.00 0.00 N ATOM 0 H LYS A 109 15.281 -4.350 4.187 1.00 0.00 H new ATOM 0 HA LYS A 109 12.929 -5.281 5.681 1.00 0.00 H new ATOM 0 HB2 LYS A 109 15.464 -6.402 5.130 1.00 0.00 H new ATOM 0 HB3 LYS A 109 15.346 -6.163 6.862 1.00 0.00 H new ATOM 0 HG2 LYS A 109 13.175 -7.507 5.189 1.00 0.00 H new ATOM 0 HG3 LYS A 109 14.441 -8.387 6.021 1.00 0.00 H new ATOM 0 HD2 LYS A 109 13.657 -7.524 8.204 1.00 0.00 H new ATOM 0 HD3 LYS A 109 12.444 -6.541 7.407 1.00 0.00 H new ATOM 0 HE2 LYS A 109 11.355 -8.613 6.523 1.00 0.00 H new ATOM 0 HE3 LYS A 109 12.562 -9.589 7.336 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 10.431 -9.335 8.514 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 11.796 -8.891 9.422 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 10.798 -7.694 8.748 1.00 0.00 H new ATOM 1647 N ALA A 110 15.362 -3.174 6.560 1.00 0.00 N ATOM 1648 CA ALA A 110 15.835 -2.121 7.446 1.00 0.00 C ATOM 1649 C ALA A 110 14.728 -1.061 7.507 1.00 0.00 C ATOM 1650 O ALA A 110 14.512 -0.429 8.534 1.00 0.00 O ATOM 1651 CB ALA A 110 17.160 -1.542 6.929 1.00 0.00 C ATOM 0 H ALA A 110 15.936 -3.295 5.726 1.00 0.00 H new ATOM 0 HA ALA A 110 16.038 -2.502 8.447 1.00 0.00 H new ATOM 0 HB1 ALA A 110 17.501 -0.756 7.602 1.00 0.00 H new ATOM 0 HB2 ALA A 110 17.910 -2.332 6.885 1.00 0.00 H new ATOM 0 HB3 ALA A 110 17.011 -1.127 5.932 1.00 0.00 H new ATOM 1657 N MET A 111 14.038 -0.918 6.349 1.00 0.00 N ATOM 1658 CA MET A 111 12.919 -0.002 6.249 1.00 0.00 C ATOM 1659 C MET A 111 11.786 -0.758 6.959 1.00 0.00 C ATOM 1660 O MET A 111 11.291 -0.340 7.998 1.00 0.00 O ATOM 1661 CB MET A 111 12.629 0.311 4.769 1.00 0.00 C ATOM 1662 CG MET A 111 13.762 1.110 4.115 1.00 0.00 C ATOM 1663 SD MET A 111 13.317 1.661 2.456 1.00 0.00 S ATOM 1664 CE MET A 111 13.000 3.405 2.784 1.00 0.00 C ATOM 0 H MET A 111 14.248 -1.427 5.491 1.00 0.00 H new ATOM 0 HA MET A 111 13.082 0.975 6.705 1.00 0.00 H new ATOM 0 HB2 MET A 111 12.482 -0.621 4.224 1.00 0.00 H new ATOM 0 HB3 MET A 111 11.699 0.874 4.694 1.00 0.00 H new ATOM 0 HG2 MET A 111 14.002 1.975 4.734 1.00 0.00 H new ATOM 0 HG3 MET A 111 14.660 0.494 4.066 1.00 0.00 H new ATOM 0 HE1 MET A 111 12.387 3.820 1.984 1.00 0.00 H new ATOM 0 HE2 MET A 111 12.475 3.507 3.734 1.00 0.00 H new ATOM 0 HE3 MET A 111 13.946 3.944 2.832 1.00 0.00 H new ATOM 1674 N GLY A 112 11.456 -1.908 6.322 1.00 0.00 N ATOM 1675 CA GLY A 112 10.457 -2.890 6.736 1.00 0.00 C ATOM 1676 C GLY A 112 9.183 -2.363 7.416 1.00 0.00 C ATOM 1677 O GLY A 112 8.597 -3.036 8.256 1.00 0.00 O ATOM 0 H GLY A 112 11.916 -2.180 5.453 1.00 0.00 H new ATOM 0 HA2 GLY A 112 10.158 -3.457 5.855 1.00 0.00 H new ATOM 0 HA3 GLY A 112 10.937 -3.591 7.419 1.00 0.00 H new ATOM 1681 N PHE A 113 8.787 -1.139 7.004 1.00 0.00 N ATOM 1682 CA PHE A 113 7.570 -0.528 7.531 1.00 0.00 C ATOM 1683 C PHE A 113 6.391 -1.060 6.685 1.00 0.00 C ATOM 1684 O PHE A 113 5.230 -0.809 6.981 1.00 0.00 O ATOM 1685 CB PHE A 113 7.669 1.014 7.538 1.00 0.00 C ATOM 1686 CG PHE A 113 8.365 1.607 6.335 1.00 0.00 C ATOM 1687 CD1 PHE A 113 7.904 1.383 5.039 1.00 0.00 C ATOM 1688 CD2 PHE A 113 9.495 2.402 6.513 1.00 0.00 C ATOM 1689 CE1 PHE A 113 8.567 1.926 3.947 1.00 0.00 C ATOM 1690 CE2 PHE A 113 10.151 2.958 5.424 1.00 0.00 C ATOM 1691 CZ PHE A 113 9.689 2.716 4.139 1.00 0.00 C ATOM 0 H PHE A 113 9.289 -0.572 6.321 1.00 0.00 H new ATOM 0 HA PHE A 113 7.414 -0.800 8.575 1.00 0.00 H new ATOM 0 HB2 PHE A 113 6.663 1.429 7.600 1.00 0.00 H new ATOM 0 HB3 PHE A 113 8.199 1.327 8.438 1.00 0.00 H new ATOM 0 HD1 PHE A 113 7.021 0.780 4.883 1.00 0.00 H new ATOM 0 HD2 PHE A 113 9.865 2.588 7.511 1.00 0.00 H new ATOM 0 HE1 PHE A 113 8.208 1.733 2.947 1.00 0.00 H new ATOM 0 HE2 PHE A 113 11.021 3.579 5.577 1.00 0.00 H new ATOM 0 HZ PHE A 113 10.203 3.142 3.290 1.00 0.00 H new ATOM 1701 N ASP A 114 6.775 -1.796 5.619 1.00 0.00 N ATOM 1702 CA ASP A 114 5.885 -2.415 4.668 1.00 0.00 C ATOM 1703 C ASP A 114 5.907 -3.911 5.011 1.00 0.00 C ATOM 1704 O ASP A 114 6.964 -4.514 5.146 1.00 0.00 O ATOM 1705 CB ASP A 114 6.408 -2.130 3.243 1.00 0.00 C ATOM 1706 CG ASP A 114 7.887 -2.547 3.065 1.00 0.00 C ATOM 1707 OD1 ASP A 114 8.772 -1.748 3.373 1.00 0.00 O ATOM 1708 OD2 ASP A 114 8.134 -3.669 2.626 1.00 0.00 O ATOM 0 H ASP A 114 7.758 -1.970 5.408 1.00 0.00 H new ATOM 0 HA ASP A 114 4.864 -2.035 4.710 1.00 0.00 H new ATOM 0 HB2 ASP A 114 5.793 -2.664 2.519 1.00 0.00 H new ATOM 0 HB3 ASP A 114 6.304 -1.067 3.026 1.00 0.00 H new ATOM 1713 N ARG A 115 4.683 -4.459 5.168 1.00 0.00 N ATOM 1714 CA ARG A 115 4.511 -5.874 5.463 1.00 0.00 C ATOM 1715 C ARG A 115 3.905 -6.441 4.173 1.00 0.00 C ATOM 1716 O ARG A 115 3.639 -5.706 3.229 1.00 0.00 O ATOM 1717 CB ARG A 115 3.679 -6.095 6.746 1.00 0.00 C ATOM 1718 CG ARG A 115 2.790 -4.915 7.180 1.00 0.00 C ATOM 1719 CD ARG A 115 3.539 -3.888 8.039 1.00 0.00 C ATOM 1720 NE ARG A 115 2.582 -3.027 8.717 1.00 0.00 N ATOM 1721 CZ ARG A 115 2.983 -2.045 9.553 1.00 0.00 C ATOM 1722 NH1 ARG A 115 4.272 -1.753 9.713 1.00 0.00 N ATOM 1723 NH2 ARG A 115 2.071 -1.363 10.234 1.00 0.00 N ATOM 0 H ARG A 115 3.811 -3.935 5.093 1.00 0.00 H new ATOM 0 HA ARG A 115 5.437 -6.396 5.705 1.00 0.00 H new ATOM 0 HB2 ARG A 115 3.044 -6.969 6.599 1.00 0.00 H new ATOM 0 HB3 ARG A 115 4.361 -6.331 7.563 1.00 0.00 H new ATOM 0 HG2 ARG A 115 2.394 -4.420 6.293 1.00 0.00 H new ATOM 0 HG3 ARG A 115 1.936 -5.297 7.740 1.00 0.00 H new ATOM 0 HD2 ARG A 115 4.166 -4.399 8.770 1.00 0.00 H new ATOM 0 HD3 ARG A 115 4.202 -3.290 7.413 1.00 0.00 H new ATOM 0 HE ARG A 115 1.585 -3.168 8.557 1.00 0.00 H new ATOM 0 HH11 ARG A 115 4.981 -2.275 9.198 1.00 0.00 H new ATOM 0 HH12 ARG A 115 4.551 -1.007 10.350 1.00 0.00 H new ATOM 0 HH21 ARG A 115 1.081 -1.583 10.123 1.00 0.00 H new ATOM 0 HH22 ARG A 115 2.360 -0.619 10.869 1.00 0.00 H new ATOM 1737 N VAL A 116 3.709 -7.782 4.177 1.00 0.00 N ATOM 1738 CA VAL A 116 3.145 -8.440 3.000 1.00 0.00 C ATOM 1739 C VAL A 116 2.123 -9.488 3.451 1.00 0.00 C ATOM 1740 O VAL A 116 2.152 -9.973 4.575 1.00 0.00 O ATOM 1741 CB VAL A 116 4.268 -9.111 2.130 1.00 0.00 C ATOM 1742 CG1 VAL A 116 5.440 -8.119 1.873 1.00 0.00 C ATOM 1743 CG2 VAL A 116 4.436 -10.615 1.750 1.00 0.00 C ATOM 0 H VAL A 116 3.928 -8.401 4.958 1.00 0.00 H new ATOM 0 HA VAL A 116 2.653 -7.690 2.381 1.00 0.00 H new ATOM 0 HB VAL A 116 3.574 -9.589 1.439 1.00 0.00 H new ATOM 0 HG11 VAL A 116 6.204 -8.608 1.269 1.00 0.00 H new ATOM 0 HG12 VAL A 116 5.065 -7.242 1.345 1.00 0.00 H new ATOM 0 HG13 VAL A 116 5.872 -7.812 2.825 1.00 0.00 H new ATOM 0 HG21 VAL A 116 5.326 -10.737 1.133 1.00 0.00 H new ATOM 0 HG22 VAL A 116 4.539 -11.210 2.657 1.00 0.00 H new ATOM 0 HG23 VAL A 116 3.560 -10.950 1.194 1.00 0.00 H new ATOM 1753 N TYR A 117 1.235 -9.808 2.475 1.00 0.00 N ATOM 1754 CA TYR A 117 0.184 -10.798 2.736 1.00 0.00 C ATOM 1755 C TYR A 117 0.719 -12.098 2.101 1.00 0.00 C ATOM 1756 O TYR A 117 1.482 -12.050 1.145 1.00 0.00 O ATOM 1757 CB TYR A 117 -1.190 -10.499 2.086 1.00 0.00 C ATOM 1758 CG TYR A 117 -1.905 -9.226 2.486 1.00 0.00 C ATOM 1759 CD1 TYR A 117 -1.248 -8.034 2.763 1.00 0.00 C ATOM 1760 CD2 TYR A 117 -3.292 -9.224 2.536 1.00 0.00 C ATOM 1761 CE1 TYR A 117 -1.942 -6.879 3.054 1.00 0.00 C ATOM 1762 CE2 TYR A 117 -4.003 -8.071 2.842 1.00 0.00 C ATOM 1763 CZ TYR A 117 -3.336 -6.874 3.094 1.00 0.00 C ATOM 1764 OH TYR A 117 -4.058 -5.725 3.397 1.00 0.00 O ATOM 0 H TYR A 117 1.231 -9.407 1.537 1.00 0.00 H new ATOM 0 HA TYR A 117 -0.003 -10.825 3.809 1.00 0.00 H new ATOM 0 HB2 TYR A 117 -1.050 -10.478 1.005 1.00 0.00 H new ATOM 0 HB3 TYR A 117 -1.852 -11.337 2.305 1.00 0.00 H new ATOM 0 HD1 TYR A 117 -0.168 -8.012 2.750 1.00 0.00 H new ATOM 0 HD2 TYR A 117 -3.830 -10.138 2.333 1.00 0.00 H new ATOM 0 HE1 TYR A 117 -1.399 -5.967 3.253 1.00 0.00 H new ATOM 0 HE2 TYR A 117 -5.082 -8.102 2.885 1.00 0.00 H new ATOM 0 HH TYR A 117 -3.798 -5.005 2.786 1.00 0.00 H new ATOM 1774 N PRO A 118 0.287 -13.280 2.641 1.00 0.00 N ATOM 1775 CA PRO A 118 0.732 -14.566 2.118 1.00 0.00 C ATOM 1776 C PRO A 118 0.156 -14.699 0.693 1.00 0.00 C ATOM 1777 O PRO A 118 -0.921 -14.192 0.406 1.00 0.00 O ATOM 1778 CB PRO A 118 0.130 -15.629 3.063 1.00 0.00 C ATOM 1779 CG PRO A 118 -0.470 -14.862 4.245 1.00 0.00 C ATOM 1780 CD PRO A 118 -0.623 -13.416 3.776 1.00 0.00 C ATOM 0 HA PRO A 118 1.815 -14.675 2.070 1.00 0.00 H new ATOM 0 HB2 PRO A 118 -0.634 -16.216 2.552 1.00 0.00 H new ATOM 0 HB3 PRO A 118 0.896 -16.327 3.401 1.00 0.00 H new ATOM 0 HG2 PRO A 118 -1.433 -15.282 4.534 1.00 0.00 H new ATOM 0 HG3 PRO A 118 0.179 -14.922 5.119 1.00 0.00 H new ATOM 0 HD2 PRO A 118 -1.651 -13.204 3.483 1.00 0.00 H new ATOM 0 HD3 PRO A 118 -0.367 -12.716 4.571 1.00 0.00 H new ATOM 1788 N PRO A 119 0.910 -15.396 -0.205 1.00 0.00 N ATOM 1789 CA PRO A 119 0.453 -15.614 -1.570 1.00 0.00 C ATOM 1790 C PRO A 119 -0.541 -16.783 -1.448 1.00 0.00 C ATOM 1791 O PRO A 119 -0.177 -17.900 -1.102 1.00 0.00 O ATOM 1792 CB PRO A 119 1.729 -16.000 -2.331 1.00 0.00 C ATOM 1793 CG PRO A 119 2.653 -16.605 -1.268 1.00 0.00 C ATOM 1794 CD PRO A 119 2.254 -15.922 0.045 1.00 0.00 C ATOM 0 HA PRO A 119 -0.031 -14.779 -2.075 1.00 0.00 H new ATOM 0 HB2 PRO A 119 1.515 -16.717 -3.123 1.00 0.00 H new ATOM 0 HB3 PRO A 119 2.186 -15.130 -2.803 1.00 0.00 H new ATOM 0 HG2 PRO A 119 2.526 -17.686 -1.204 1.00 0.00 H new ATOM 0 HG3 PRO A 119 3.701 -16.421 -1.506 1.00 0.00 H new ATOM 0 HD2 PRO A 119 2.255 -16.628 0.875 1.00 0.00 H new ATOM 0 HD3 PRO A 119 2.950 -15.124 0.304 1.00 0.00 H new ATOM 1802 N GLY A 120 -1.812 -16.442 -1.747 1.00 0.00 N ATOM 1803 CA GLY A 120 -2.895 -17.417 -1.673 1.00 0.00 C ATOM 1804 C GLY A 120 -3.472 -17.465 -0.260 1.00 0.00 C ATOM 1805 O GLY A 120 -3.747 -18.523 0.293 1.00 0.00 O ATOM 0 H GLY A 120 -2.101 -15.508 -2.037 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -3.678 -17.155 -2.384 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -2.525 -18.403 -1.956 1.00 0.00 H new ATOM 1809 N THR A 121 -3.627 -16.234 0.274 1.00 0.00 N ATOM 1810 CA THR A 121 -4.154 -16.046 1.612 1.00 0.00 C ATOM 1811 C THR A 121 -5.665 -15.921 1.467 1.00 0.00 C ATOM 1812 O THR A 121 -6.279 -15.968 0.407 1.00 0.00 O ATOM 1813 CB THR A 121 -3.555 -14.765 2.272 1.00 0.00 C ATOM 1814 OG1 THR A 121 -3.750 -14.616 3.716 1.00 0.00 O ATOM 1815 CG2 THR A 121 -3.819 -13.502 1.388 1.00 0.00 C ATOM 0 H THR A 121 -3.391 -15.369 -0.212 1.00 0.00 H new ATOM 0 HA THR A 121 -3.889 -16.884 2.257 1.00 0.00 H new ATOM 0 HB THR A 121 -2.474 -14.904 2.276 1.00 0.00 H new ATOM 0 HG1 THR A 121 -3.945 -13.679 3.925 1.00 0.00 H new ATOM 0 HG21 THR A 121 -3.391 -12.624 1.871 1.00 0.00 H new ATOM 0 HG22 THR A 121 -3.357 -13.639 0.410 1.00 0.00 H new ATOM 0 HG23 THR A 121 -4.893 -13.362 1.265 1.00 0.00 H new ATOM 1823 N SER A 122 -6.154 -15.728 2.689 1.00 0.00 N ATOM 1824 CA SER A 122 -7.500 -15.532 3.116 1.00 0.00 C ATOM 1825 C SER A 122 -7.803 -14.044 2.893 1.00 0.00 C ATOM 1826 O SER A 122 -6.923 -13.254 2.584 1.00 0.00 O ATOM 1827 CB SER A 122 -7.393 -15.758 4.654 1.00 0.00 C ATOM 1828 OG SER A 122 -6.321 -15.007 5.371 1.00 0.00 O ATOM 0 H SER A 122 -5.520 -15.706 3.488 1.00 0.00 H new ATOM 0 HA SER A 122 -8.243 -16.158 2.622 1.00 0.00 H new ATOM 0 HB2 SER A 122 -8.351 -15.495 5.103 1.00 0.00 H new ATOM 0 HB3 SER A 122 -7.239 -16.822 4.831 1.00 0.00 H new ATOM 0 HG SER A 122 -6.030 -14.249 4.822 1.00 0.00 H new ATOM 1834 N PRO A 123 -9.102 -13.680 3.054 1.00 0.00 N ATOM 1835 CA PRO A 123 -9.522 -12.287 2.997 1.00 0.00 C ATOM 1836 C PRO A 123 -9.467 -11.801 4.472 1.00 0.00 C ATOM 1837 O PRO A 123 -9.768 -10.654 4.770 1.00 0.00 O ATOM 1838 CB PRO A 123 -10.973 -12.367 2.516 1.00 0.00 C ATOM 1839 CG PRO A 123 -11.470 -13.712 3.060 1.00 0.00 C ATOM 1840 CD PRO A 123 -10.229 -14.611 3.126 1.00 0.00 C ATOM 0 HA PRO A 123 -8.932 -11.629 2.360 1.00 0.00 H new ATOM 0 HB2 PRO A 123 -11.567 -11.537 2.899 1.00 0.00 H new ATOM 0 HB3 PRO A 123 -11.036 -12.328 1.428 1.00 0.00 H new ATOM 0 HG2 PRO A 123 -11.922 -13.594 4.045 1.00 0.00 H new ATOM 0 HG3 PRO A 123 -12.232 -14.141 2.409 1.00 0.00 H new ATOM 0 HD2 PRO A 123 -10.207 -15.191 4.049 1.00 0.00 H new ATOM 0 HD3 PRO A 123 -10.210 -15.323 2.301 1.00 0.00 H new ATOM 1848 N GLU A 124 -9.069 -12.741 5.371 1.00 0.00 N ATOM 1849 CA GLU A 124 -8.958 -12.522 6.794 1.00 0.00 C ATOM 1850 C GLU A 124 -7.701 -11.687 7.055 1.00 0.00 C ATOM 1851 O GLU A 124 -7.542 -11.116 8.127 1.00 0.00 O ATOM 1852 CB GLU A 124 -8.885 -13.887 7.500 1.00 0.00 C ATOM 1853 CG GLU A 124 -8.967 -13.781 9.030 1.00 0.00 C ATOM 1854 CD GLU A 124 -8.991 -15.180 9.670 1.00 0.00 C ATOM 1855 OE1 GLU A 124 -7.920 -15.720 9.947 1.00 0.00 O ATOM 1856 OE2 GLU A 124 -10.080 -15.713 9.885 1.00 0.00 O ATOM 0 H GLU A 124 -8.815 -13.689 5.094 1.00 0.00 H new ATOM 0 HA GLU A 124 -9.822 -11.983 7.183 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -9.698 -14.518 7.142 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -7.953 -14.381 7.226 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -8.114 -13.217 9.407 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -9.863 -13.230 9.314 1.00 0.00 H new ATOM 1863 N THR A 125 -6.820 -11.633 6.027 1.00 0.00 N ATOM 1864 CA THR A 125 -5.592 -10.908 6.139 1.00 0.00 C ATOM 1865 C THR A 125 -5.925 -9.415 5.997 1.00 0.00 C ATOM 1866 O THR A 125 -5.200 -8.575 6.512 1.00 0.00 O ATOM 1867 CB THR A 125 -4.651 -11.380 4.996 1.00 0.00 C ATOM 1868 OG1 THR A 125 -5.101 -12.435 4.098 1.00 0.00 O ATOM 1869 CG2 THR A 125 -3.205 -11.567 5.510 1.00 0.00 C ATOM 0 H THR A 125 -6.962 -12.090 5.126 1.00 0.00 H new ATOM 0 HA THR A 125 -5.097 -11.078 7.095 1.00 0.00 H new ATOM 0 HB THR A 125 -4.683 -10.543 4.298 1.00 0.00 H new ATOM 0 HG1 THR A 125 -5.898 -12.134 3.613 1.00 0.00 H new ATOM 0 HG21 THR A 125 -2.567 -11.898 4.690 1.00 0.00 H new ATOM 0 HG22 THR A 125 -2.832 -10.620 5.900 1.00 0.00 H new ATOM 0 HG23 THR A 125 -3.194 -12.315 6.302 1.00 0.00 H new ATOM 1877 N THR A 126 -7.028 -9.123 5.258 1.00 0.00 N ATOM 1878 CA THR A 126 -7.368 -7.734 5.068 1.00 0.00 C ATOM 1879 C THR A 126 -8.085 -7.199 6.314 1.00 0.00 C ATOM 1880 O THR A 126 -8.122 -5.994 6.547 1.00 0.00 O ATOM 1881 CB THR A 126 -8.305 -7.397 3.913 1.00 0.00 C ATOM 1882 OG1 THR A 126 -9.687 -7.854 4.045 1.00 0.00 O ATOM 1883 CG2 THR A 126 -7.673 -7.615 2.514 1.00 0.00 C ATOM 0 H THR A 126 -7.649 -9.802 4.818 1.00 0.00 H new ATOM 0 HA THR A 126 -6.399 -7.284 4.854 1.00 0.00 H new ATOM 0 HB THR A 126 -8.427 -6.317 4.000 1.00 0.00 H new ATOM 0 HG1 THR A 126 -10.286 -7.215 3.606 1.00 0.00 H new ATOM 0 HG21 THR A 126 -8.398 -7.355 1.743 1.00 0.00 H new ATOM 0 HG22 THR A 126 -6.791 -6.983 2.411 1.00 0.00 H new ATOM 0 HG23 THR A 126 -7.385 -8.661 2.404 1.00 0.00 H new ATOM 1891 N ILE A 127 -8.689 -8.122 7.087 1.00 0.00 N ATOM 1892 CA ILE A 127 -9.313 -7.660 8.318 1.00 0.00 C ATOM 1893 C ILE A 127 -8.117 -7.239 9.201 1.00 0.00 C ATOM 1894 O ILE A 127 -8.182 -6.310 9.998 1.00 0.00 O ATOM 1895 CB ILE A 127 -10.189 -8.789 8.939 1.00 0.00 C ATOM 1896 CG1 ILE A 127 -11.013 -9.613 7.934 1.00 0.00 C ATOM 1897 CG2 ILE A 127 -10.534 -8.435 10.421 1.00 0.00 C ATOM 1898 CD1 ILE A 127 -11.952 -10.670 8.545 1.00 0.00 C ATOM 0 H ILE A 127 -8.753 -9.121 6.893 1.00 0.00 H new ATOM 0 HA ILE A 127 -10.005 -6.829 8.184 1.00 0.00 H new ATOM 0 HB ILE A 127 -9.739 -9.753 9.178 1.00 0.00 H new ATOM 0 HG12 ILE A 127 -11.611 -8.927 7.334 1.00 0.00 H new ATOM 0 HG13 ILE A 127 -10.325 -10.115 7.254 1.00 0.00 H new ATOM 0 HG21 ILE A 127 -11.147 -9.227 10.851 1.00 0.00 H new ATOM 0 HG22 ILE A 127 -9.613 -8.336 10.995 1.00 0.00 H new ATOM 0 HG23 ILE A 127 -11.083 -7.494 10.452 1.00 0.00 H new ATOM 0 HD11 ILE A 127 -12.482 -11.190 7.747 1.00 0.00 H new ATOM 0 HD12 ILE A 127 -11.367 -11.388 9.120 1.00 0.00 H new ATOM 0 HD13 ILE A 127 -12.672 -10.181 9.201 1.00 0.00 H new ATOM 1910 N ALA A 128 -7.003 -7.971 8.937 1.00 0.00 N ATOM 1911 CA ALA A 128 -5.770 -7.731 9.623 1.00 0.00 C ATOM 1912 C ALA A 128 -5.041 -6.562 8.938 1.00 0.00 C ATOM 1913 O ALA A 128 -4.018 -6.126 9.452 1.00 0.00 O ATOM 1914 CB ALA A 128 -4.918 -9.007 9.710 1.00 0.00 C ATOM 0 H ALA A 128 -6.965 -8.724 8.250 1.00 0.00 H new ATOM 0 HA ALA A 128 -5.969 -7.447 10.657 1.00 0.00 H new ATOM 0 HB1 ALA A 128 -3.989 -8.789 10.237 1.00 0.00 H new ATOM 0 HB2 ALA A 128 -5.469 -9.777 10.250 1.00 0.00 H new ATOM 0 HB3 ALA A 128 -4.690 -9.362 8.705 1.00 0.00 H new ATOM 1920 N ASP A 129 -5.589 -6.048 7.796 1.00 0.00 N ATOM 1921 CA ASP A 129 -4.959 -4.940 7.090 1.00 0.00 C ATOM 1922 C ASP A 129 -4.890 -3.750 8.054 1.00 0.00 C ATOM 1923 O ASP A 129 -3.830 -3.232 8.368 1.00 0.00 O ATOM 1924 CB ASP A 129 -5.761 -4.527 5.835 1.00 0.00 C ATOM 1925 CG ASP A 129 -5.042 -3.543 4.893 1.00 0.00 C ATOM 1926 OD1 ASP A 129 -3.859 -3.270 5.090 1.00 0.00 O ATOM 1927 OD2 ASP A 129 -5.679 -3.069 3.954 1.00 0.00 O ATOM 0 H ASP A 129 -6.450 -6.390 7.369 1.00 0.00 H new ATOM 0 HA ASP A 129 -3.967 -5.250 6.760 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -6.013 -5.426 5.272 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -6.701 -4.078 6.155 1.00 0.00 H new ATOM 1932 N MET A 130 -6.105 -3.382 8.501 1.00 0.00 N ATOM 1933 CA MET A 130 -6.290 -2.242 9.386 1.00 0.00 C ATOM 1934 C MET A 130 -6.155 -2.683 10.854 1.00 0.00 C ATOM 1935 O MET A 130 -6.300 -1.851 11.738 1.00 0.00 O ATOM 1936 CB MET A 130 -7.674 -1.613 9.113 1.00 0.00 C ATOM 1937 CG MET A 130 -7.684 -0.674 7.899 1.00 0.00 C ATOM 1938 SD MET A 130 -7.162 -1.483 6.378 1.00 0.00 S ATOM 1939 CE MET A 130 -8.667 -2.401 6.013 1.00 0.00 C ATOM 0 H MET A 130 -6.969 -3.866 8.257 1.00 0.00 H new ATOM 0 HA MET A 130 -5.521 -1.494 9.195 1.00 0.00 H new ATOM 0 HB2 MET A 130 -8.402 -2.408 8.955 1.00 0.00 H new ATOM 0 HB3 MET A 130 -7.994 -1.059 9.995 1.00 0.00 H new ATOM 0 HG2 MET A 130 -8.689 -0.274 7.765 1.00 0.00 H new ATOM 0 HG3 MET A 130 -7.028 0.173 8.097 1.00 0.00 H new ATOM 0 HE1 MET A 130 -8.631 -2.766 4.987 1.00 0.00 H new ATOM 0 HE2 MET A 130 -8.752 -3.246 6.696 1.00 0.00 H new ATOM 0 HE3 MET A 130 -9.531 -1.747 6.135 1.00 0.00 H new ATOM 1949 N LYS A 131 -5.867 -3.975 11.122 1.00 0.00 N ATOM 1950 CA LYS A 131 -5.766 -4.357 12.526 1.00 0.00 C ATOM 1951 C LYS A 131 -4.379 -3.974 13.074 1.00 0.00 C ATOM 1952 O LYS A 131 -4.277 -3.374 14.137 1.00 0.00 O ATOM 1953 CB LYS A 131 -5.998 -5.867 12.689 1.00 0.00 C ATOM 1954 CG LYS A 131 -6.085 -6.326 14.152 1.00 0.00 C ATOM 1955 CD LYS A 131 -6.428 -7.816 14.284 1.00 0.00 C ATOM 1956 CE LYS A 131 -5.332 -8.739 13.740 1.00 0.00 C ATOM 1957 NZ LYS A 131 -5.641 -10.147 13.954 1.00 0.00 N ATOM 0 H LYS A 131 -5.712 -4.714 10.436 1.00 0.00 H new ATOM 0 HA LYS A 131 -6.532 -3.825 13.090 1.00 0.00 H new ATOM 0 HB2 LYS A 131 -6.920 -6.141 12.177 1.00 0.00 H new ATOM 0 HB3 LYS A 131 -5.188 -6.405 12.197 1.00 0.00 H new ATOM 0 HG2 LYS A 131 -5.134 -6.131 14.647 1.00 0.00 H new ATOM 0 HG3 LYS A 131 -6.841 -5.736 14.670 1.00 0.00 H new ATOM 0 HD2 LYS A 131 -6.603 -8.050 15.334 1.00 0.00 H new ATOM 0 HD3 LYS A 131 -7.359 -8.016 13.753 1.00 0.00 H new ATOM 0 HE2 LYS A 131 -5.201 -8.556 12.674 1.00 0.00 H new ATOM 0 HE3 LYS A 131 -4.385 -8.499 14.223 1.00 0.00 H new ATOM 0 HZ1 LYS A 131 -4.872 -10.733 13.570 1.00 0.00 H new ATOM 0 HZ2 LYS A 131 -5.740 -10.330 14.973 1.00 0.00 H new ATOM 0 HZ3 LYS A 131 -6.531 -10.384 13.472 1.00 0.00 H new ATOM 1970 N GLU A 132 -3.328 -4.349 12.307 1.00 0.00 N ATOM 1971 CA GLU A 132 -1.963 -4.134 12.771 1.00 0.00 C ATOM 1972 C GLU A 132 -1.441 -2.752 12.386 1.00 0.00 C ATOM 1973 O GLU A 132 -0.631 -2.175 13.102 1.00 0.00 O ATOM 1974 CB GLU A 132 -1.064 -5.279 12.271 1.00 0.00 C ATOM 1975 CG GLU A 132 -0.807 -5.264 10.754 1.00 0.00 C ATOM 1976 CD GLU A 132 -0.030 -6.519 10.326 1.00 0.00 C ATOM 1977 OE1 GLU A 132 -0.607 -7.606 10.353 1.00 0.00 O ATOM 1978 OE2 GLU A 132 1.141 -6.400 9.967 1.00 0.00 O ATOM 0 H GLU A 132 -3.408 -4.789 11.390 1.00 0.00 H new ATOM 0 HA GLU A 132 -1.950 -4.151 13.861 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -0.107 -5.228 12.791 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -1.523 -6.230 12.541 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -1.756 -5.217 10.219 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -0.244 -4.371 10.484 1.00 0.00 H new ATOM 1985 N VAL A 133 -1.921 -2.251 11.238 1.00 0.00 N ATOM 1986 CA VAL A 133 -1.462 -0.942 10.759 1.00 0.00 C ATOM 1987 C VAL A 133 -2.046 0.223 11.584 1.00 0.00 C ATOM 1988 O VAL A 133 -1.441 1.285 11.675 1.00 0.00 O ATOM 1989 CB VAL A 133 -1.644 -0.841 9.206 1.00 0.00 C ATOM 1990 CG1 VAL A 133 -1.600 0.647 8.738 1.00 0.00 C ATOM 1991 CG2 VAL A 133 -1.210 -1.982 8.255 1.00 0.00 C ATOM 0 H VAL A 133 -2.605 -2.716 10.641 1.00 0.00 H new ATOM 0 HA VAL A 133 -0.390 -0.846 10.931 1.00 0.00 H new ATOM 0 HB VAL A 133 -2.656 -1.203 9.023 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -1.728 0.692 7.657 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -2.402 1.205 9.222 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -0.639 1.085 9.008 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -1.428 -1.700 7.225 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -0.140 -2.159 8.364 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -1.756 -2.892 8.505 1.00 0.00 H new ATOM 2001 N LEU A 134 -3.227 -0.035 12.189 1.00 0.00 N ATOM 2002 CA LEU A 134 -3.857 0.989 13.011 1.00 0.00 C ATOM 2003 C LEU A 134 -3.311 0.796 14.432 1.00 0.00 C ATOM 2004 O LEU A 134 -3.073 1.757 15.153 1.00 0.00 O ATOM 2005 CB LEU A 134 -5.390 0.877 12.987 1.00 0.00 C ATOM 2006 CG LEU A 134 -6.007 1.080 11.567 1.00 0.00 C ATOM 2007 CD1 LEU A 134 -7.558 1.024 11.695 1.00 0.00 C ATOM 2008 CD2 LEU A 134 -5.304 1.675 10.314 1.00 0.00 C ATOM 0 H LEU A 134 -3.738 -0.915 12.121 1.00 0.00 H new ATOM 0 HA LEU A 134 -3.627 1.984 12.629 1.00 0.00 H new ATOM 0 HB2 LEU A 134 -5.681 -0.104 13.364 1.00 0.00 H new ATOM 0 HB3 LEU A 134 -5.811 1.618 13.667 1.00 0.00 H new ATOM 0 HG LEU A 134 -5.503 0.346 10.938 1.00 0.00 H new ATOM 0 HD11 LEU A 134 -8.009 1.164 10.713 1.00 0.00 H new ATOM 0 HD12 LEU A 134 -7.855 0.055 12.096 1.00 0.00 H new ATOM 0 HD13 LEU A 134 -7.896 1.814 12.366 1.00 0.00 H new ATOM 0 HD21 LEU A 134 -6.001 1.684 9.476 1.00 0.00 H new ATOM 0 HD22 LEU A 134 -4.980 2.694 10.528 1.00 0.00 H new ATOM 0 HD23 LEU A 134 -4.437 1.065 10.059 1.00 0.00 H new ATOM 2020 N GLY A 135 -3.123 -0.500 14.782 1.00 0.00 N ATOM 2021 CA GLY A 135 -2.610 -0.867 16.093 1.00 0.00 C ATOM 2022 C GLY A 135 -1.129 -0.498 16.227 1.00 0.00 C ATOM 2023 O GLY A 135 -0.779 0.626 16.565 1.00 0.00 O ATOM 0 H GLY A 135 -3.322 -1.291 14.169 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -3.186 -0.361 16.867 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -2.737 -1.938 16.250 1.00 0.00 H new ATOM 2027 N VAL A 136 -0.291 -1.520 15.949 1.00 0.00 N ATOM 2028 CA VAL A 136 1.147 -1.324 16.026 1.00 0.00 C ATOM 2029 C VAL A 136 1.842 -2.545 15.409 1.00 0.00 C ATOM 2030 O VAL A 136 1.312 -3.649 15.370 1.00 0.00 O ATOM 2031 CB VAL A 136 1.597 -1.105 17.510 1.00 0.00 C ATOM 2032 CG1 VAL A 136 2.852 -0.186 17.563 1.00 0.00 C ATOM 2033 CG2 VAL A 136 0.742 -1.428 18.769 1.00 0.00 C ATOM 0 H VAL A 136 -0.587 -2.458 15.678 1.00 0.00 H new ATOM 0 HA VAL A 136 1.429 -0.430 15.469 1.00 0.00 H new ATOM 0 HB VAL A 136 1.722 -2.100 17.937 1.00 0.00 H new ATOM 0 HG11 VAL A 136 3.154 -0.042 18.600 1.00 0.00 H new ATOM 0 HG12 VAL A 136 3.667 -0.651 17.009 1.00 0.00 H new ATOM 0 HG13 VAL A 136 2.615 0.780 17.117 1.00 0.00 H new ATOM 0 HG21 VAL A 136 1.306 -1.175 19.667 1.00 0.00 H new ATOM 0 HG22 VAL A 136 -0.179 -0.845 18.743 1.00 0.00 H new ATOM 0 HG23 VAL A 136 0.498 -2.490 18.781 1.00 0.00 H new ATOM 2043 N GLU A 137 3.066 -2.237 14.938 1.00 0.00 N ATOM 2044 CA GLU A 137 3.956 -3.199 14.309 1.00 0.00 C ATOM 2045 C GLU A 137 5.365 -2.662 14.606 1.00 0.00 C ATOM 2046 O GLU A 137 5.711 -1.591 14.105 1.00 0.00 O ATOM 2047 CB GLU A 137 3.699 -3.302 12.788 1.00 0.00 C ATOM 2048 CG GLU A 137 2.469 -4.143 12.407 1.00 0.00 C ATOM 2049 CD GLU A 137 2.675 -5.623 12.783 1.00 0.00 C ATOM 2050 OE1 GLU A 137 3.386 -6.319 12.059 1.00 0.00 O ATOM 2051 OE2 GLU A 137 2.124 -6.065 13.791 1.00 0.00 O ATOM 2052 OXT GLU A 137 6.105 -3.320 15.336 1.00 0.00 O ATOM 0 H GLU A 137 3.458 -1.297 14.990 1.00 0.00 H new ATOM 0 HA GLU A 137 3.808 -4.209 14.692 1.00 0.00 H new ATOM 0 HB2 GLU A 137 3.576 -2.297 12.384 1.00 0.00 H new ATOM 0 HB3 GLU A 137 4.580 -3.732 12.311 1.00 0.00 H new ATOM 0 HG2 GLU A 137 1.587 -3.754 12.915 1.00 0.00 H new ATOM 0 HG3 GLU A 137 2.283 -4.058 11.336 1.00 0.00 H new TER 2059 GLU A 137 HETATM 2060 N4 FOP A 138 1.638 -13.640 -10.597 1.00 0.00 N HETATM 2061 C5 FOP A 138 1.784 -14.132 -9.227 1.00 0.00 C HETATM 2062 C6 FOP A 138 0.475 -14.559 -8.546 1.00 0.00 C HETATM 2063 C7 FOP A 138 -0.581 -13.458 -8.682 1.00 0.00 C HETATM 2064 O7 FOP A 138 -0.016 -15.782 -9.061 1.00 0.00 O HETATM 0 H73 FOP A 138 -0.217 -12.545 -8.211 1.00 0.00 H new HETATM 0 H72 FOP A 138 -0.776 -13.269 -9.738 1.00 0.00 H new HETATM 0 H71 FOP A 138 -1.503 -13.776 -8.194 1.00 0.00 H new HETATM 0 H6 FOP A 138 0.692 -14.715 -7.489 1.00 0.00 H new HETATM 0 H52 FOP A 138 2.466 -14.982 -9.233 1.00 0.00 H new HETATM 0 H51 FOP A 138 2.251 -13.353 -8.625 1.00 0.00 H new HETATM 0 H43 FOP A 138 2.558 -13.555 -11.028 1.00 0.00 H new HETATM 0 H42 FOP A 138 1.070 -14.295 -11.135 1.00 0.00 H new HETATM 0 H41 FOP A 138 1.183 -12.727 -10.584 1.00 0.00 H new HETATM 2074 P DBI A 139 -1.418 -16.208 -8.453 1.00 0.00 P HETATM 2075 O1P DBI A 139 -2.557 -15.558 -9.332 1.00 0.00 O HETATM 2076 O2P DBI A 139 -1.549 -17.782 -8.502 1.00 0.00 O HETATM 2077 O3' DBI A 139 -1.520 -15.707 -6.952 1.00 0.00 O HETATM 2078 O5' DBI A 139 -5.329 -17.228 -6.842 1.00 0.00 O HETATM 2079 C5' DBI A 139 -4.983 -15.998 -7.424 1.00 0.00 C HETATM 2080 C4' DBI A 139 -3.924 -15.261 -6.595 1.00 0.00 C HETATM 2081 O4' DBI A 139 -4.531 -14.878 -5.373 1.00 0.00 O HETATM 2082 C1' DBI A 139 -3.530 -14.800 -4.377 1.00 0.00 C HETATM 2083 N1 DBI A 139 -3.046 -13.426 -4.291 1.00 0.00 N HETATM 2084 C8 DBI A 139 -3.404 -12.433 -3.380 1.00 0.00 C HETATM 2085 C7 DBI A 139 -4.241 -12.388 -2.295 1.00 0.00 C HETATM 2086 C6 DBI A 139 -4.443 -11.195 -1.584 1.00 0.00 C HETATM 2087 C11 DBI A 139 -5.394 -11.162 -0.414 1.00 0.00 C HETATM 2088 C10 DBI A 139 -3.945 -8.721 -1.256 1.00 0.00 C HETATM 2089 C5 DBI A 139 -3.754 -10.036 -1.974 1.00 0.00 C HETATM 2090 C4 DBI A 139 -2.873 -10.106 -3.052 1.00 0.00 C HETATM 2091 C9 DBI A 139 -2.700 -11.259 -3.754 1.00 0.00 C HETATM 2092 N3 DBI A 139 -1.929 -11.563 -4.857 1.00 0.00 N HETATM 2093 C2 DBI A 139 -2.187 -12.849 -5.142 1.00 0.00 C HETATM 2094 C2' DBI A 139 -2.481 -15.856 -4.763 1.00 0.00 C HETATM 2095 O2' DBI A 139 -1.165 -15.501 -4.397 1.00 0.00 O HETATM 2096 C3' DBI A 139 -2.683 -16.091 -6.250 1.00 0.00 C HETATM 0 HO21 DBI A 139 -0.588 -15.522 -5.189 1.00 0.00 H new HETATM 0 H5'2 DBI A 139 -4.605 -16.165 -8.433 1.00 0.00 H new HETATM 0 H5'1 DBI A 139 -5.873 -15.375 -7.516 1.00 0.00 H new HETATM 0 H113 DBI A 139 -6.393 -11.439 -0.750 1.00 0.00 H new HETATM 0 H112 DBI A 139 -5.059 -11.866 0.347 1.00 0.00 H new HETATM 0 H111 DBI A 139 -5.418 -10.157 0.007 1.00 0.00 H new HETATM 0 H103 DBI A 139 -4.991 -8.420 -1.321 1.00 0.00 H new HETATM 0 H102 DBI A 139 -3.664 -8.834 -0.209 1.00 0.00 H new HETATM 0 H101 DBI A 139 -3.318 -7.959 -1.720 1.00 0.00 H new HETATM 0 HO5 DBI A 139 -6.007 -17.672 -7.393 1.00 0.00 H new HETATM 0 H7 DBI A 139 -4.758 -13.294 -1.979 1.00 0.00 H new HETATM 0 H4' DBI A 139 -3.580 -14.424 -7.203 1.00 0.00 H new HETATM 0 H4 DBI A 139 -2.310 -9.218 -3.339 1.00 0.00 H new HETATM 0 H3' DBI A 139 -2.841 -17.133 -6.526 1.00 0.00 H new HETATM 0 H2' DBI A 139 -2.620 -16.784 -4.208 1.00 0.00 H new HETATM 0 H2 DBI A 139 -1.740 -13.374 -5.986 1.00 0.00 H new HETATM 0 H1' DBI A 139 -3.875 -15.025 -3.368 1.00 0.00 H new