USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=40 USER MOD reduce.3.24.130724 removed 1213 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj : A 56 ASNHD21 : A 56 ASN OD1 : A 152 CACA :(metal ligand) USER MOD NoAdj : A 56 ASNHD22 : A 56 ASN OD1 : A 152 CACA :(metal ligand) USER MOD Set 1.1: A 47 MET CE :methyl 141:sc= -0.176 (180deg=-2.03!) USER MOD Set 1.2: B 18 SER OG : rot 180:sc= 0 USER MOD Set 1.3: B 19 SER OG : rot 180:sc= 0 USER MOD Set 2.1: A 105 MET CE :methyl 161:sc=-0.000971 (180deg=-0.295) USER MOD Set 2.2: A 120 MET CE :methyl 136:sc= -0.409 (180deg=-0.47) USER MOD Set 2.3: B 7 THR OG1 : rot 93:sc= 1.27 USER MOD Set 3.1: A 68 MET CE :methyl -149:sc= -0.34 (180deg=-0.518) USER MOD Set 3.2: B 9 HIS : no HE2:sc= -1.88 K(o=-2.2,f=-3.4!) USER MOD Set 4.1: A 24 THR OG1 : rot -63:sc= 0.985 USER MOD Set 4.2: A 26 LYS NZ :NH3+ -159:sc= 1.11 (180deg=-0.698) USER MOD Single : A 1 THR N :NH3+ -122:sc= 0.00212 (180deg=-0.0777) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ -152:sc= -0.104 (180deg=-0.731) USER MOD Single : A 13 SER OG : rot 180:sc= 0 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 30 THR OG1 : rot 72:sc= 1.23 USER MOD Single : A 32 MET CE :methyl -171:sc= 0 (180deg=-0.00818) USER MOD Single : A 34 SER OG : rot 47:sc= 1.26 USER MOD Single : A 37 GLN : amide:sc= -0.114 K(o=-0.11,f=-0.83) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= -0.0297 USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 59:sc= 1.24 USER MOD Single : A 67 MET CE :methyl 143:sc= -0.278 (180deg=-0.962) USER MOD Single : A 71 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.0089) USER MOD Single : A 72 MET CE :methyl -142:sc= -0.0297 (180deg=-0.765) USER MOD Single : A 73 LYS NZ :NH3+ 141:sc= 0.747 (180deg=-0.538!) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0.0454 USER MOD Single : A 77 SER OG : rot 180:sc= 0 USER MOD Single : A 90 LYS NZ :NH3+ -165:sc= -0.0359 (180deg=-0.261) USER MOD Single : A 93 ASN : amide:sc= -0.213 K(o=-0.21,f=-1.4) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -68:sc= 0.171 USER MOD Single : A 103 HIS : no HD1:sc= -0.799 X(o=-0.8,f=-0.57) USER MOD Single : A 106 THR OG1 : rot 58:sc= 0.687 USER MOD Single : A 107 ASN : amide:sc= 0 K(o=0,f=-0.61) USER MOD Single : A 111 LYS NZ :NH3+ 162:sc= -0.037 (180deg=-0.614) USER MOD Single : A 113 THR OG1 : rot 180:sc= -0.56 USER MOD Single : A 131 GLN : amide:sc= -0.539 K(o=-0.54,f=-4.6!) USER MOD Single : A 133 ASN : amide:sc= 0.0498 K(o=0.05,f=-9!) USER MOD Single : A 134 TYR OH : rot 180:sc= -0.0262 USER MOD Single : A 139 GLN : amide:sc= -0.0763 X(o=-0.076,f=0) USER MOD Single : A 140 MET CE :methyl 180:sc= -0.154 (180deg=-0.154) USER MOD Single : A 141 MET CE :methyl 142:sc= -0.647 (180deg=-2.11) USER MOD Single : A 142 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 ARG N :NH3+ 150:sc= 0.928 (180deg=0.393) USER MOD Single : B 3 LYS NZ :NH3+ 150:sc= 1.25 (180deg=1.11) USER MOD Single : B 5 GLN : amide:sc= 0.987 K(o=0.99,f=-1.5) USER MOD Single : B 6 LYS NZ :NH3+ -162:sc= 1.2 (180deg=1.15) USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 4.448 6.195 15.517 1.00 0.00 N ATOM 2 CA THR A 1 3.353 5.738 16.402 1.00 0.00 C ATOM 3 C THR A 1 3.343 4.251 16.504 1.00 0.00 C ATOM 4 O THR A 1 3.638 3.499 15.577 1.00 0.00 O ATOM 5 CB THR A 1 1.981 6.295 16.166 1.00 0.00 C ATOM 6 OG1 THR A 1 1.451 5.815 14.939 1.00 0.00 O ATOM 7 CG2 THR A 1 1.948 7.832 16.132 1.00 0.00 C ATOM 0 H1 THR A 1 5.075 6.837 16.043 1.00 0.00 H new ATOM 0 H2 THR A 1 4.993 5.373 15.186 1.00 0.00 H new ATOM 0 H3 THR A 1 4.047 6.696 14.699 1.00 0.00 H new ATOM 0 HA THR A 1 3.608 6.183 17.364 1.00 0.00 H new ATOM 0 HB THR A 1 1.378 5.959 17.010 1.00 0.00 H new ATOM 0 HG1 THR A 1 0.555 6.187 14.802 1.00 0.00 H new ATOM 0 HG21 THR A 1 0.927 8.170 15.958 1.00 0.00 H new ATOM 0 HG22 THR A 1 2.303 8.225 17.085 1.00 0.00 H new ATOM 0 HG23 THR A 1 2.591 8.192 15.329 1.00 0.00 H new ATOM 14 N GLU A 2 2.896 3.690 17.642 1.00 0.00 N ATOM 15 CA GLU A 2 2.786 2.288 17.904 1.00 0.00 C ATOM 16 C GLU A 2 1.939 1.612 16.882 1.00 0.00 C ATOM 17 O GLU A 2 2.275 0.523 16.419 1.00 0.00 O ATOM 18 CB GLU A 2 2.204 2.050 19.308 1.00 0.00 C ATOM 19 CG GLU A 2 3.027 2.696 20.424 1.00 0.00 C ATOM 20 CD GLU A 2 4.537 2.578 20.272 1.00 0.00 C ATOM 21 OE1 GLU A 2 5.017 1.419 20.152 1.00 0.00 O ATOM 22 OE2 GLU A 2 5.282 3.594 20.262 1.00 0.00 O ATOM 0 H GLU A 2 2.590 4.256 18.433 1.00 0.00 H new ATOM 0 HA GLU A 2 3.787 1.860 17.854 1.00 0.00 H new ATOM 0 HB2 GLU A 2 1.187 2.442 19.343 1.00 0.00 H new ATOM 0 HB3 GLU A 2 2.139 0.977 19.489 1.00 0.00 H new ATOM 0 HG2 GLU A 2 2.766 3.753 20.480 1.00 0.00 H new ATOM 0 HG3 GLU A 2 2.738 2.245 21.373 1.00 0.00 H new ATOM 29 N GLU A 3 0.835 2.250 16.454 1.00 0.00 N ATOM 30 CA GLU A 3 -0.038 1.723 15.451 1.00 0.00 C ATOM 31 C GLU A 3 0.544 1.619 14.084 1.00 0.00 C ATOM 32 O GLU A 3 0.327 0.614 13.408 1.00 0.00 O ATOM 33 CB GLU A 3 -1.383 2.448 15.273 1.00 0.00 C ATOM 34 CG GLU A 3 -1.274 3.945 14.977 1.00 0.00 C ATOM 35 CD GLU A 3 -2.660 4.550 14.807 1.00 0.00 C ATOM 36 OE1 GLU A 3 -3.323 4.136 13.819 1.00 0.00 O ATOM 37 OE2 GLU A 3 -3.083 5.394 15.642 1.00 0.00 O ATOM 0 H GLU A 3 0.541 3.157 16.815 1.00 0.00 H new ATOM 0 HA GLU A 3 -0.201 0.733 15.878 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -1.932 1.971 14.461 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -1.974 2.314 16.179 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -0.748 4.446 15.789 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -0.687 4.102 14.072 1.00 0.00 H new ATOM 44 N GLN A 4 1.303 2.644 13.655 1.00 0.00 N ATOM 45 CA GLN A 4 1.894 2.655 12.353 1.00 0.00 C ATOM 46 C GLN A 4 3.084 1.763 12.274 1.00 0.00 C ATOM 47 O GLN A 4 3.399 1.149 11.256 1.00 0.00 O ATOM 48 CB GLN A 4 2.326 4.119 12.166 1.00 0.00 C ATOM 49 CG GLN A 4 2.894 4.224 10.749 1.00 0.00 C ATOM 50 CD GLN A 4 3.373 5.602 10.314 1.00 0.00 C ATOM 51 OE1 GLN A 4 4.566 5.899 10.339 1.00 0.00 O ATOM 52 NE2 GLN A 4 2.466 6.507 9.859 1.00 0.00 N ATOM 0 H GLN A 4 1.508 3.471 14.215 1.00 0.00 H new ATOM 0 HA GLN A 4 1.203 2.297 11.590 1.00 0.00 H new ATOM 0 HB2 GLN A 4 1.480 4.793 12.296 1.00 0.00 H new ATOM 0 HB3 GLN A 4 3.075 4.401 12.906 1.00 0.00 H new ATOM 0 HG2 GLN A 4 3.729 3.529 10.663 1.00 0.00 H new ATOM 0 HG3 GLN A 4 2.128 3.891 10.048 1.00 0.00 H new ATOM 0 HE21 GLN A 4 1.475 6.268 9.835 1.00 0.00 H new ATOM 0 HE22 GLN A 4 2.777 7.425 9.541 1.00 0.00 H new ATOM 61 N ILE A 5 3.964 1.726 13.291 1.00 0.00 N ATOM 62 CA ILE A 5 5.041 0.792 13.399 1.00 0.00 C ATOM 63 C ILE A 5 4.584 -0.624 13.312 1.00 0.00 C ATOM 64 O ILE A 5 5.135 -1.379 12.513 1.00 0.00 O ATOM 65 CB ILE A 5 5.823 1.019 14.659 1.00 0.00 C ATOM 66 CG1 ILE A 5 6.428 2.423 14.825 1.00 0.00 C ATOM 67 CG2 ILE A 5 6.877 -0.076 14.894 1.00 0.00 C ATOM 68 CD1 ILE A 5 7.494 2.628 13.750 1.00 0.00 C ATOM 0 H ILE A 5 3.922 2.378 14.074 1.00 0.00 H new ATOM 0 HA ILE A 5 5.694 0.968 12.544 1.00 0.00 H new ATOM 0 HB ILE A 5 5.068 0.952 15.443 1.00 0.00 H new ATOM 0 HG12 ILE A 5 5.651 3.182 14.736 1.00 0.00 H new ATOM 0 HG13 ILE A 5 6.866 2.531 15.817 1.00 0.00 H new ATOM 0 HG21 ILE A 5 7.417 0.131 15.818 1.00 0.00 H new ATOM 0 HG22 ILE A 5 6.384 -1.045 14.972 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.578 -0.092 14.059 1.00 0.00 H new ATOM 0 HD11 ILE A 5 7.932 3.621 13.856 1.00 0.00 H new ATOM 0 HD12 ILE A 5 8.273 1.874 13.862 1.00 0.00 H new ATOM 0 HD13 ILE A 5 7.039 2.536 12.764 1.00 0.00 H new ATOM 80 N ALA A 6 3.511 -1.066 13.993 1.00 0.00 N ATOM 81 CA ALA A 6 2.868 -2.320 13.751 1.00 0.00 C ATOM 82 C ALA A 6 2.260 -2.638 12.429 1.00 0.00 C ATOM 83 O ALA A 6 2.012 -3.806 12.132 1.00 0.00 O ATOM 84 CB ALA A 6 1.828 -2.557 14.860 1.00 0.00 C ATOM 0 H ALA A 6 3.074 -0.528 14.742 1.00 0.00 H new ATOM 0 HA ALA A 6 3.718 -3.003 13.748 1.00 0.00 H new ATOM 0 HB1 ALA A 6 1.327 -3.510 14.691 1.00 0.00 H new ATOM 0 HB2 ALA A 6 2.327 -2.576 15.829 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.092 -1.753 14.847 1.00 0.00 H new ATOM 90 N GLU A 7 1.938 -1.619 11.613 1.00 0.00 N ATOM 91 CA GLU A 7 1.615 -1.821 10.234 1.00 0.00 C ATOM 92 C GLU A 7 2.792 -2.215 9.410 1.00 0.00 C ATOM 93 O GLU A 7 2.704 -3.028 8.492 1.00 0.00 O ATOM 94 CB GLU A 7 1.042 -0.507 9.677 1.00 0.00 C ATOM 95 CG GLU A 7 0.508 -0.641 8.249 1.00 0.00 C ATOM 96 CD GLU A 7 0.092 0.729 7.732 1.00 0.00 C ATOM 97 OE1 GLU A 7 -0.848 1.310 8.337 1.00 0.00 O ATOM 98 OE2 GLU A 7 0.665 1.135 6.686 1.00 0.00 O ATOM 0 H GLU A 7 1.901 -0.645 11.912 1.00 0.00 H new ATOM 0 HA GLU A 7 0.896 -2.638 10.180 1.00 0.00 H new ATOM 0 HB2 GLU A 7 0.238 -0.164 10.328 1.00 0.00 H new ATOM 0 HB3 GLU A 7 1.818 0.258 9.698 1.00 0.00 H new ATOM 0 HG2 GLU A 7 1.274 -1.069 7.602 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.343 -1.322 8.230 1.00 0.00 H new ATOM 105 N PHE A 8 3.965 -1.617 9.688 1.00 0.00 N ATOM 106 CA PHE A 8 5.194 -1.973 9.049 1.00 0.00 C ATOM 107 C PHE A 8 5.696 -3.291 9.530 1.00 0.00 C ATOM 108 O PHE A 8 6.177 -4.019 8.664 1.00 0.00 O ATOM 109 CB PHE A 8 6.194 -0.814 9.190 1.00 0.00 C ATOM 110 CG PHE A 8 5.780 0.513 8.654 1.00 0.00 C ATOM 111 CD1 PHE A 8 5.426 0.650 7.332 1.00 0.00 C ATOM 112 CD2 PHE A 8 6.032 1.601 9.456 1.00 0.00 C ATOM 113 CE1 PHE A 8 5.228 1.904 6.805 1.00 0.00 C ATOM 114 CE2 PHE A 8 5.895 2.853 8.906 1.00 0.00 C ATOM 115 CZ PHE A 8 5.483 2.995 7.602 1.00 0.00 C ATOM 0 H PHE A 8 4.061 -0.868 10.374 1.00 0.00 H new ATOM 0 HA PHE A 8 5.035 -2.120 7.981 1.00 0.00 H new ATOM 0 HB2 PHE A 8 6.424 -0.694 10.249 1.00 0.00 H new ATOM 0 HB3 PHE A 8 7.120 -1.105 8.694 1.00 0.00 H new ATOM 0 HD1 PHE A 8 5.304 -0.225 6.710 1.00 0.00 H new ATOM 0 HD2 PHE A 8 6.329 1.476 10.487 1.00 0.00 H new ATOM 0 HE1 PHE A 8 4.881 2.029 5.790 1.00 0.00 H new ATOM 0 HE2 PHE A 8 6.112 3.728 9.500 1.00 0.00 H new ATOM 0 HZ PHE A 8 5.357 3.987 7.194 1.00 0.00 H new ATOM 125 N LYS A 9 5.658 -3.705 10.810 1.00 0.00 N ATOM 126 CA LYS A 9 6.062 -5.015 11.216 1.00 0.00 C ATOM 127 C LYS A 9 5.182 -6.091 10.678 1.00 0.00 C ATOM 128 O LYS A 9 5.804 -7.062 10.250 1.00 0.00 O ATOM 129 CB LYS A 9 5.971 -5.038 12.751 1.00 0.00 C ATOM 130 CG LYS A 9 6.982 -4.221 13.558 1.00 0.00 C ATOM 131 CD LYS A 9 6.756 -4.383 15.063 1.00 0.00 C ATOM 132 CE LYS A 9 7.957 -3.883 15.868 1.00 0.00 C ATOM 133 NZ LYS A 9 9.082 -4.807 15.602 1.00 0.00 N ATOM 0 H LYS A 9 5.339 -3.116 11.579 1.00 0.00 H new ATOM 0 HA LYS A 9 7.065 -5.208 10.836 1.00 0.00 H new ATOM 0 HB2 LYS A 9 4.974 -4.697 13.028 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.054 -6.076 13.072 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.994 -4.538 13.304 1.00 0.00 H new ATOM 0 HG3 LYS A 9 6.900 -3.168 13.287 1.00 0.00 H new ATOM 0 HD2 LYS A 9 5.863 -3.832 15.359 1.00 0.00 H new ATOM 0 HD3 LYS A 9 6.574 -5.433 15.294 1.00 0.00 H new ATOM 0 HE2 LYS A 9 8.218 -2.866 15.576 1.00 0.00 H new ATOM 0 HE3 LYS A 9 7.723 -3.859 16.932 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 9.722 -4.820 16.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 8.713 -5.765 15.436 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 9.603 -4.487 14.761 1.00 0.00 H new ATOM 147 N GLU A 10 3.839 -6.019 10.650 1.00 0.00 N ATOM 148 CA GLU A 10 3.101 -7.124 10.120 1.00 0.00 C ATOM 149 C GLU A 10 3.118 -7.287 8.639 1.00 0.00 C ATOM 150 O GLU A 10 3.063 -8.388 8.092 1.00 0.00 O ATOM 151 CB GLU A 10 1.611 -7.203 10.490 1.00 0.00 C ATOM 152 CG GLU A 10 1.424 -7.396 11.996 1.00 0.00 C ATOM 153 CD GLU A 10 1.909 -8.677 12.660 1.00 0.00 C ATOM 154 OE1 GLU A 10 1.375 -9.790 12.407 1.00 0.00 O ATOM 155 OE2 GLU A 10 2.781 -8.593 13.565 1.00 0.00 O ATOM 0 H GLU A 10 3.282 -5.231 10.979 1.00 0.00 H new ATOM 0 HA GLU A 10 3.670 -7.912 10.613 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.106 -6.291 10.172 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.144 -8.029 9.954 1.00 0.00 H new ATOM 0 HG2 GLU A 10 1.920 -6.563 12.495 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.358 -7.304 12.206 1.00 0.00 H new ATOM 162 N ALA A 11 3.260 -6.140 7.951 1.00 0.00 N ATOM 163 CA ALA A 11 3.567 -6.033 6.559 1.00 0.00 C ATOM 164 C ALA A 11 4.891 -6.652 6.264 1.00 0.00 C ATOM 165 O ALA A 11 4.980 -7.539 5.417 1.00 0.00 O ATOM 166 CB ALA A 11 3.450 -4.634 5.932 1.00 0.00 C ATOM 0 H ALA A 11 3.153 -5.229 8.397 1.00 0.00 H new ATOM 0 HA ALA A 11 2.771 -6.593 6.068 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.709 -4.686 4.874 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.427 -4.272 6.038 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.131 -3.950 6.438 1.00 0.00 H new ATOM 172 N PHE A 12 5.967 -6.317 6.997 1.00 0.00 N ATOM 173 CA PHE A 12 7.214 -7.018 7.009 1.00 0.00 C ATOM 174 C PHE A 12 7.083 -8.494 7.165 1.00 0.00 C ATOM 175 O PHE A 12 7.629 -9.233 6.347 1.00 0.00 O ATOM 176 CB PHE A 12 8.184 -6.396 8.027 1.00 0.00 C ATOM 177 CG PHE A 12 9.550 -6.707 7.521 1.00 0.00 C ATOM 178 CD1 PHE A 12 10.249 -7.888 7.619 1.00 0.00 C ATOM 179 CD2 PHE A 12 10.181 -5.647 6.914 1.00 0.00 C ATOM 180 CE1 PHE A 12 11.564 -7.982 7.229 1.00 0.00 C ATOM 181 CE2 PHE A 12 11.509 -5.702 6.563 1.00 0.00 C ATOM 182 CZ PHE A 12 12.202 -6.881 6.708 1.00 0.00 C ATOM 0 H PHE A 12 5.966 -5.508 7.619 1.00 0.00 H new ATOM 0 HA PHE A 12 7.645 -6.892 6.016 1.00 0.00 H new ATOM 0 HB2 PHE A 12 8.031 -5.320 8.107 1.00 0.00 H new ATOM 0 HB3 PHE A 12 8.030 -6.814 9.022 1.00 0.00 H new ATOM 0 HD1 PHE A 12 9.752 -8.763 8.012 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.619 -4.748 6.708 1.00 0.00 H new ATOM 0 HE1 PHE A 12 12.094 -8.917 7.331 1.00 0.00 H new ATOM 0 HE2 PHE A 12 12.005 -4.824 6.176 1.00 0.00 H new ATOM 0 HZ PHE A 12 13.240 -6.942 6.415 1.00 0.00 H new ATOM 192 N SER A 13 6.417 -9.012 8.212 1.00 0.00 N ATOM 193 CA SER A 13 6.273 -10.398 8.535 1.00 0.00 C ATOM 194 C SER A 13 5.679 -11.197 7.427 1.00 0.00 C ATOM 195 O SER A 13 5.946 -12.365 7.145 1.00 0.00 O ATOM 196 CB SER A 13 5.392 -10.605 9.778 1.00 0.00 C ATOM 197 OG SER A 13 5.345 -11.955 10.215 1.00 0.00 O ATOM 0 H SER A 13 5.941 -8.412 8.886 1.00 0.00 H new ATOM 0 HA SER A 13 7.289 -10.745 8.723 1.00 0.00 H new ATOM 0 HB2 SER A 13 5.768 -9.981 10.589 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.380 -10.266 9.558 1.00 0.00 H new ATOM 0 HG SER A 13 4.772 -12.023 11.007 1.00 0.00 H new ATOM 203 N LEU A 14 4.725 -10.613 6.681 1.00 0.00 N ATOM 204 CA LEU A 14 4.162 -11.103 5.461 1.00 0.00 C ATOM 205 C LEU A 14 5.044 -11.236 4.268 1.00 0.00 C ATOM 206 O LEU A 14 4.860 -12.123 3.436 1.00 0.00 O ATOM 207 CB LEU A 14 2.926 -10.246 5.138 1.00 0.00 C ATOM 208 CG LEU A 14 2.051 -10.566 3.914 1.00 0.00 C ATOM 209 CD1 LEU A 14 1.463 -11.971 4.126 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.931 -9.535 3.693 1.00 0.00 C ATOM 0 H LEU A 14 4.313 -9.721 6.956 1.00 0.00 H new ATOM 0 HA LEU A 14 3.927 -12.148 5.664 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.277 -10.275 6.013 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.268 -9.217 5.028 1.00 0.00 H new ATOM 0 HG LEU A 14 2.667 -10.526 3.016 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.834 -12.234 3.276 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.273 -12.695 4.216 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.864 -11.981 5.037 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.348 -9.814 2.816 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.281 -9.510 4.568 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.369 -8.549 3.539 1.00 0.00 H new ATOM 222 N PHE A 15 6.072 -10.385 4.107 1.00 0.00 N ATOM 223 CA PHE A 15 7.109 -10.580 3.142 1.00 0.00 C ATOM 224 C PHE A 15 8.201 -11.534 3.486 1.00 0.00 C ATOM 225 O PHE A 15 8.659 -12.369 2.707 1.00 0.00 O ATOM 226 CB PHE A 15 7.781 -9.220 2.888 1.00 0.00 C ATOM 227 CG PHE A 15 6.814 -8.370 2.137 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.554 -8.627 0.812 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.491 -7.159 2.703 1.00 0.00 C ATOM 230 CE1 PHE A 15 5.922 -7.703 0.013 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.786 -6.273 1.922 1.00 0.00 C ATOM 232 CZ PHE A 15 5.592 -6.494 0.579 1.00 0.00 C ATOM 0 H PHE A 15 6.186 -9.538 4.663 1.00 0.00 H new ATOM 0 HA PHE A 15 6.596 -11.019 2.287 1.00 0.00 H new ATOM 0 HB2 PHE A 15 8.054 -8.746 3.831 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.701 -9.348 2.317 1.00 0.00 H new ATOM 0 HD1 PHE A 15 6.852 -9.575 0.389 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.778 -6.915 3.715 1.00 0.00 H new ATOM 0 HE1 PHE A 15 5.693 -7.919 -1.020 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.375 -5.383 2.375 1.00 0.00 H new ATOM 0 HZ PHE A 15 5.176 -5.711 -0.037 1.00 0.00 H new ATOM 242 N ASP A 16 8.762 -11.349 4.694 1.00 0.00 N ATOM 243 CA ASP A 16 9.713 -12.237 5.288 1.00 0.00 C ATOM 244 C ASP A 16 9.074 -13.525 5.680 1.00 0.00 C ATOM 245 O ASP A 16 8.411 -13.542 6.716 1.00 0.00 O ATOM 246 CB ASP A 16 10.558 -11.530 6.361 1.00 0.00 C ATOM 247 CG ASP A 16 11.591 -12.285 7.186 1.00 0.00 C ATOM 248 OD1 ASP A 16 11.928 -13.430 6.783 1.00 0.00 O ATOM 249 OD2 ASP A 16 12.040 -11.702 8.209 1.00 0.00 O ATOM 0 H ASP A 16 8.543 -10.545 5.283 1.00 0.00 H new ATOM 0 HA ASP A 16 10.454 -12.532 4.545 1.00 0.00 H new ATOM 0 HB2 ASP A 16 11.084 -10.715 5.864 1.00 0.00 H new ATOM 0 HB3 ASP A 16 9.861 -11.076 7.065 1.00 0.00 H new ATOM 254 N LYS A 17 9.455 -14.626 5.008 1.00 0.00 N ATOM 255 CA LYS A 17 8.912 -15.932 5.220 1.00 0.00 C ATOM 256 C LYS A 17 9.541 -16.603 6.392 1.00 0.00 C ATOM 257 O LYS A 17 8.868 -17.375 7.074 1.00 0.00 O ATOM 258 CB LYS A 17 8.914 -16.850 3.986 1.00 0.00 C ATOM 259 CG LYS A 17 8.143 -16.362 2.758 1.00 0.00 C ATOM 260 CD LYS A 17 6.632 -16.566 2.890 1.00 0.00 C ATOM 261 CE LYS A 17 5.903 -16.421 1.553 1.00 0.00 C ATOM 262 NZ LYS A 17 4.428 -16.484 1.665 1.00 0.00 N ATOM 0 H LYS A 17 10.174 -14.605 4.285 1.00 0.00 H new ATOM 0 HA LYS A 17 7.858 -15.756 5.435 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.950 -17.019 3.691 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.505 -17.816 4.281 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.350 -15.303 2.601 1.00 0.00 H new ATOM 0 HG3 LYS A 17 8.501 -16.891 1.875 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.437 -17.556 3.301 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.231 -15.842 3.599 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.183 -15.471 1.099 1.00 0.00 H new ATOM 0 HE3 LYS A 17 6.241 -17.208 0.879 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.003 -16.379 0.721 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 4.149 -17.401 2.070 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 4.094 -15.717 2.283 1.00 0.00 H new ATOM 276 N ASP A 18 10.812 -16.289 6.698 1.00 0.00 N ATOM 277 CA ASP A 18 11.300 -16.799 7.941 1.00 0.00 C ATOM 278 C ASP A 18 10.813 -16.071 9.146 1.00 0.00 C ATOM 279 O ASP A 18 10.758 -16.570 10.269 1.00 0.00 O ATOM 280 CB ASP A 18 12.837 -16.792 8.010 1.00 0.00 C ATOM 281 CG ASP A 18 13.465 -17.121 6.663 1.00 0.00 C ATOM 282 OD1 ASP A 18 13.310 -18.276 6.182 1.00 0.00 O ATOM 283 OD2 ASP A 18 14.096 -16.199 6.081 1.00 0.00 O ATOM 0 H ASP A 18 11.456 -15.730 6.139 1.00 0.00 H new ATOM 0 HA ASP A 18 10.905 -17.815 7.960 1.00 0.00 H new ATOM 0 HB2 ASP A 18 13.181 -15.813 8.342 1.00 0.00 H new ATOM 0 HB3 ASP A 18 13.171 -17.516 8.753 1.00 0.00 H new ATOM 288 N GLY A 19 10.623 -14.741 9.068 1.00 0.00 N ATOM 289 CA GLY A 19 10.504 -13.865 10.192 1.00 0.00 C ATOM 290 C GLY A 19 11.757 -13.709 10.983 1.00 0.00 C ATOM 291 O GLY A 19 11.698 -13.600 12.206 1.00 0.00 O ATOM 0 H GLY A 19 10.549 -14.253 8.175 1.00 0.00 H new ATOM 0 HA2 GLY A 19 10.185 -12.884 9.841 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.718 -14.239 10.848 1.00 0.00 H new ATOM 295 N ASP A 20 12.912 -13.634 10.296 1.00 0.00 N ATOM 296 CA ASP A 20 14.215 -13.454 10.857 1.00 0.00 C ATOM 297 C ASP A 20 14.558 -12.006 10.928 1.00 0.00 C ATOM 298 O ASP A 20 15.381 -11.642 11.766 1.00 0.00 O ATOM 299 CB ASP A 20 15.270 -14.329 10.159 1.00 0.00 C ATOM 300 CG ASP A 20 15.586 -13.935 8.723 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.695 -13.734 7.855 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.781 -13.757 8.365 1.00 0.00 O ATOM 0 H ASP A 20 12.935 -13.704 9.279 1.00 0.00 H new ATOM 0 HA ASP A 20 14.209 -13.812 11.887 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.191 -14.294 10.740 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.926 -15.363 10.169 1.00 0.00 H new ATOM 307 N GLY A 21 14.118 -11.190 9.953 1.00 0.00 N ATOM 308 CA GLY A 21 14.488 -9.809 9.927 1.00 0.00 C ATOM 309 C GLY A 21 15.062 -9.289 8.654 1.00 0.00 C ATOM 310 O GLY A 21 15.327 -8.091 8.568 1.00 0.00 O ATOM 0 H GLY A 21 13.511 -11.484 9.188 1.00 0.00 H new ATOM 0 HA2 GLY A 21 13.605 -9.217 10.168 1.00 0.00 H new ATOM 0 HA3 GLY A 21 15.214 -9.637 10.722 1.00 0.00 H new ATOM 314 N THR A 22 15.269 -10.025 7.547 1.00 0.00 N ATOM 315 CA THR A 22 15.439 -9.505 6.226 1.00 0.00 C ATOM 316 C THR A 22 14.631 -10.200 5.185 1.00 0.00 C ATOM 317 O THR A 22 14.330 -11.393 5.195 1.00 0.00 O ATOM 318 CB THR A 22 16.847 -9.554 5.711 1.00 0.00 C ATOM 319 OG1 THR A 22 17.413 -10.856 5.760 1.00 0.00 O ATOM 320 CG2 THR A 22 17.803 -8.695 6.556 1.00 0.00 C ATOM 0 H THR A 22 15.321 -11.043 7.577 1.00 0.00 H new ATOM 0 HA THR A 22 15.108 -8.476 6.367 1.00 0.00 H new ATOM 0 HB THR A 22 16.757 -9.194 4.686 1.00 0.00 H new ATOM 0 HG1 THR A 22 18.328 -10.828 5.411 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.811 -8.761 6.146 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.471 -7.657 6.538 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.805 -9.057 7.584 1.00 0.00 H new ATOM 328 N ILE A 23 14.245 -9.472 4.122 1.00 0.00 N ATOM 329 CA ILE A 23 13.556 -9.949 2.964 1.00 0.00 C ATOM 330 C ILE A 23 14.591 -10.176 1.916 1.00 0.00 C ATOM 331 O ILE A 23 15.300 -9.266 1.490 1.00 0.00 O ATOM 332 CB ILE A 23 12.522 -9.005 2.426 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.472 -8.622 3.483 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.885 -9.804 1.276 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.859 -7.278 3.093 1.00 0.00 C ATOM 0 H ILE A 23 14.430 -8.470 4.070 1.00 0.00 H new ATOM 0 HA ILE A 23 13.014 -10.852 3.244 1.00 0.00 H new ATOM 0 HB ILE A 23 12.952 -8.054 2.111 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.699 -9.388 3.543 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.933 -8.556 4.468 1.00 0.00 H new ATOM 0 HG21 ILE A 23 11.106 -9.205 0.804 1.00 0.00 H new ATOM 0 HG22 ILE A 23 12.648 -10.052 0.539 1.00 0.00 H new ATOM 0 HG23 ILE A 23 11.448 -10.722 1.669 1.00 0.00 H new ATOM 0 HD11 ILE A 23 10.111 -6.991 3.832 1.00 0.00 H new ATOM 0 HD12 ILE A 23 11.641 -6.519 3.054 1.00 0.00 H new ATOM 0 HD13 ILE A 23 10.387 -7.364 2.114 1.00 0.00 H new ATOM 347 N THR A 24 14.715 -11.408 1.390 1.00 0.00 N ATOM 348 CA THR A 24 15.517 -11.995 0.363 1.00 0.00 C ATOM 349 C THR A 24 14.803 -12.153 -0.935 1.00 0.00 C ATOM 350 O THR A 24 13.582 -12.021 -1.012 1.00 0.00 O ATOM 351 CB THR A 24 16.173 -13.258 0.839 1.00 0.00 C ATOM 352 OG1 THR A 24 15.266 -14.328 1.061 1.00 0.00 O ATOM 353 CG2 THR A 24 16.877 -13.101 2.197 1.00 0.00 C ATOM 0 H THR A 24 14.118 -12.138 1.779 1.00 0.00 H new ATOM 0 HA THR A 24 16.315 -11.285 0.145 1.00 0.00 H new ATOM 0 HB THR A 24 16.868 -13.472 0.027 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.639 -14.083 1.773 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.330 -14.050 2.484 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.651 -12.338 2.119 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.149 -12.804 2.952 1.00 0.00 H new ATOM 361 N THR A 25 15.572 -12.512 -1.979 1.00 0.00 N ATOM 362 CA THR A 25 14.977 -12.563 -3.278 1.00 0.00 C ATOM 363 C THR A 25 13.958 -13.636 -3.452 1.00 0.00 C ATOM 364 O THR A 25 12.884 -13.407 -4.007 1.00 0.00 O ATOM 365 CB THR A 25 15.902 -12.781 -4.438 1.00 0.00 C ATOM 366 OG1 THR A 25 16.720 -13.916 -4.191 1.00 0.00 O ATOM 367 CG2 THR A 25 16.737 -11.495 -4.549 1.00 0.00 C ATOM 0 H THR A 25 16.561 -12.757 -1.931 1.00 0.00 H new ATOM 0 HA THR A 25 14.554 -11.558 -3.300 1.00 0.00 H new ATOM 0 HB THR A 25 15.368 -12.976 -5.368 1.00 0.00 H new ATOM 0 HG1 THR A 25 17.322 -14.057 -4.951 1.00 0.00 H new ATOM 0 HG21 THR A 25 17.437 -11.586 -5.380 1.00 0.00 H new ATOM 0 HG22 THR A 25 16.076 -10.646 -4.723 1.00 0.00 H new ATOM 0 HG23 THR A 25 17.291 -11.340 -3.623 1.00 0.00 H new ATOM 375 N LYS A 26 14.164 -14.833 -2.875 1.00 0.00 N ATOM 376 CA LYS A 26 13.287 -15.962 -2.869 1.00 0.00 C ATOM 377 C LYS A 26 11.976 -15.594 -2.264 1.00 0.00 C ATOM 378 O LYS A 26 10.964 -16.055 -2.789 1.00 0.00 O ATOM 379 CB LYS A 26 13.891 -17.171 -2.134 1.00 0.00 C ATOM 380 CG LYS A 26 14.292 -16.965 -0.672 1.00 0.00 C ATOM 381 CD LYS A 26 15.016 -18.187 -0.103 1.00 0.00 C ATOM 382 CE LYS A 26 15.609 -17.993 1.293 1.00 0.00 C ATOM 383 NZ LYS A 26 16.445 -16.771 1.277 1.00 0.00 N ATOM 0 H LYS A 26 15.026 -15.026 -2.365 1.00 0.00 H new ATOM 0 HA LYS A 26 13.138 -16.258 -3.907 1.00 0.00 H new ATOM 0 HB2 LYS A 26 13.170 -17.988 -2.176 1.00 0.00 H new ATOM 0 HB3 LYS A 26 14.774 -17.496 -2.685 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.938 -16.090 -0.592 1.00 0.00 H new ATOM 0 HG3 LYS A 26 13.402 -16.760 -0.077 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.317 -19.023 -0.072 1.00 0.00 H new ATOM 0 HD3 LYS A 26 15.818 -18.467 -0.787 1.00 0.00 H new ATOM 0 HE2 LYS A 26 14.815 -17.900 2.033 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.208 -18.859 1.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.123 -16.804 2.065 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 16.962 -16.716 0.376 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 15.837 -15.933 1.379 1.00 0.00 H new ATOM 397 N GLU A 27 11.925 -14.823 -1.163 1.00 0.00 N ATOM 398 CA GLU A 27 10.785 -14.458 -0.381 1.00 0.00 C ATOM 399 C GLU A 27 9.873 -13.586 -1.174 1.00 0.00 C ATOM 400 O GLU A 27 8.663 -13.788 -1.265 1.00 0.00 O ATOM 401 CB GLU A 27 11.269 -13.851 0.946 1.00 0.00 C ATOM 402 CG GLU A 27 11.883 -14.933 1.836 1.00 0.00 C ATOM 403 CD GLU A 27 12.459 -14.453 3.160 1.00 0.00 C ATOM 404 OE1 GLU A 27 13.212 -13.449 3.278 1.00 0.00 O ATOM 405 OE2 GLU A 27 12.084 -15.065 4.196 1.00 0.00 O ATOM 0 H GLU A 27 12.777 -14.412 -0.782 1.00 0.00 H new ATOM 0 HA GLU A 27 10.184 -15.329 -0.121 1.00 0.00 H new ATOM 0 HB2 GLU A 27 12.006 -13.072 0.749 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.434 -13.377 1.462 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.119 -15.682 2.044 1.00 0.00 H new ATOM 0 HG3 GLU A 27 12.675 -15.431 1.276 1.00 0.00 H new ATOM 412 N LEU A 28 10.573 -12.656 -1.846 1.00 0.00 N ATOM 413 CA LEU A 28 10.040 -11.720 -2.787 1.00 0.00 C ATOM 414 C LEU A 28 9.526 -12.370 -4.025 1.00 0.00 C ATOM 415 O LEU A 28 8.414 -12.092 -4.471 1.00 0.00 O ATOM 416 CB LEU A 28 11.039 -10.635 -3.224 1.00 0.00 C ATOM 417 CG LEU A 28 10.566 -9.341 -3.907 1.00 0.00 C ATOM 418 CD1 LEU A 28 9.684 -8.453 -3.013 1.00 0.00 C ATOM 419 CD2 LEU A 28 11.733 -8.447 -4.357 1.00 0.00 C ATOM 0 H LEU A 28 11.580 -12.551 -1.723 1.00 0.00 H new ATOM 0 HA LEU A 28 9.223 -11.255 -2.235 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.596 -10.340 -2.335 1.00 0.00 H new ATOM 0 HB3 LEU A 28 11.748 -11.111 -3.901 1.00 0.00 H new ATOM 0 HG LEU A 28 9.993 -9.710 -4.758 1.00 0.00 H new ATOM 0 HD11 LEU A 28 9.390 -7.560 -3.564 1.00 0.00 H new ATOM 0 HD12 LEU A 28 8.793 -9.006 -2.717 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.243 -8.163 -2.124 1.00 0.00 H new ATOM 0 HD21 LEU A 28 11.340 -7.548 -4.832 1.00 0.00 H new ATOM 0 HD22 LEU A 28 12.332 -8.167 -3.490 1.00 0.00 H new ATOM 0 HD23 LEU A 28 12.355 -8.991 -5.068 1.00 0.00 H new ATOM 431 N GLY A 29 10.313 -13.232 -4.693 1.00 0.00 N ATOM 432 CA GLY A 29 9.891 -13.952 -5.854 1.00 0.00 C ATOM 433 C GLY A 29 8.672 -14.768 -5.591 1.00 0.00 C ATOM 434 O GLY A 29 7.778 -14.799 -6.435 1.00 0.00 O ATOM 0 H GLY A 29 11.274 -13.434 -4.416 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.690 -13.250 -6.663 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.698 -14.603 -6.190 1.00 0.00 H new ATOM 438 N THR A 30 8.581 -15.341 -4.378 1.00 0.00 N ATOM 439 CA THR A 30 7.448 -16.160 -4.076 1.00 0.00 C ATOM 440 C THR A 30 6.097 -15.534 -4.032 1.00 0.00 C ATOM 441 O THR A 30 5.160 -16.170 -4.513 1.00 0.00 O ATOM 442 CB THR A 30 7.617 -16.913 -2.790 1.00 0.00 C ATOM 443 OG1 THR A 30 8.798 -17.694 -2.901 1.00 0.00 O ATOM 444 CG2 THR A 30 6.477 -17.884 -2.440 1.00 0.00 C ATOM 0 H THR A 30 9.266 -15.243 -3.629 1.00 0.00 H new ATOM 0 HA THR A 30 7.451 -16.800 -4.958 1.00 0.00 H new ATOM 0 HB THR A 30 7.642 -16.159 -2.004 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.583 -17.108 -2.863 1.00 0.00 H new ATOM 0 HG21 THR A 30 6.697 -18.377 -1.493 1.00 0.00 H new ATOM 0 HG22 THR A 30 5.542 -17.331 -2.353 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.383 -18.633 -3.226 1.00 0.00 H new ATOM 452 N VAL A 31 6.026 -14.283 -3.542 1.00 0.00 N ATOM 453 CA VAL A 31 4.835 -13.494 -3.607 1.00 0.00 C ATOM 454 C VAL A 31 4.357 -13.090 -4.959 1.00 0.00 C ATOM 455 O VAL A 31 3.220 -13.307 -5.377 1.00 0.00 O ATOM 456 CB VAL A 31 4.919 -12.342 -2.651 1.00 0.00 C ATOM 457 CG1 VAL A 31 5.561 -11.038 -3.154 1.00 0.00 C ATOM 458 CG2 VAL A 31 3.522 -11.887 -2.195 1.00 0.00 C ATOM 0 H VAL A 31 6.810 -13.811 -3.092 1.00 0.00 H new ATOM 0 HA VAL A 31 4.043 -14.174 -3.294 1.00 0.00 H new ATOM 0 HB VAL A 31 5.552 -12.777 -1.877 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.552 -10.296 -2.355 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.590 -11.232 -3.457 1.00 0.00 H new ATOM 0 HG13 VAL A 31 4.997 -10.660 -4.007 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.620 -11.051 -1.503 1.00 0.00 H new ATOM 0 HG22 VAL A 31 2.940 -11.574 -3.062 1.00 0.00 H new ATOM 0 HG23 VAL A 31 3.015 -12.713 -1.696 1.00 0.00 H new ATOM 468 N MET A 32 5.257 -12.541 -5.793 1.00 0.00 N ATOM 469 CA MET A 32 4.962 -12.160 -7.140 1.00 0.00 C ATOM 470 C MET A 32 4.567 -13.292 -8.026 1.00 0.00 C ATOM 471 O MET A 32 3.578 -13.279 -8.757 1.00 0.00 O ATOM 472 CB MET A 32 6.144 -11.458 -7.829 1.00 0.00 C ATOM 473 CG MET A 32 6.627 -10.184 -7.133 1.00 0.00 C ATOM 474 SD MET A 32 8.123 -9.452 -7.861 1.00 0.00 S ATOM 475 CE MET A 32 8.010 -7.817 -7.078 1.00 0.00 C ATOM 0 H MET A 32 6.223 -12.356 -5.521 1.00 0.00 H new ATOM 0 HA MET A 32 4.117 -11.482 -7.020 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.977 -12.158 -7.893 1.00 0.00 H new ATOM 0 HB3 MET A 32 5.856 -11.210 -8.851 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.826 -9.445 -7.158 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.821 -10.409 -6.084 1.00 0.00 H new ATOM 0 HE1 MET A 32 8.753 -7.151 -7.517 1.00 0.00 H new ATOM 0 HE2 MET A 32 7.014 -7.405 -7.238 1.00 0.00 H new ATOM 0 HE3 MET A 32 8.196 -7.912 -6.008 1.00 0.00 H new ATOM 485 N ARG A 33 5.308 -14.410 -7.939 1.00 0.00 N ATOM 486 CA ARG A 33 4.892 -15.640 -8.539 1.00 0.00 C ATOM 487 C ARG A 33 3.564 -16.197 -8.159 1.00 0.00 C ATOM 488 O ARG A 33 2.819 -16.730 -8.981 1.00 0.00 O ATOM 489 CB ARG A 33 5.989 -16.709 -8.392 1.00 0.00 C ATOM 490 CG ARG A 33 7.210 -16.333 -9.235 1.00 0.00 C ATOM 491 CD ARG A 33 8.502 -17.135 -9.071 1.00 0.00 C ATOM 492 NE ARG A 33 9.494 -16.253 -9.747 1.00 0.00 N ATOM 493 CZ ARG A 33 10.738 -16.024 -9.234 1.00 0.00 C ATOM 494 NH1 ARG A 33 11.167 -16.595 -8.071 1.00 0.00 N ATOM 495 NH2 ARG A 33 11.715 -15.450 -9.995 1.00 0.00 N ATOM 0 H ARG A 33 6.201 -14.463 -7.450 1.00 0.00 H new ATOM 0 HA ARG A 33 4.740 -15.358 -9.581 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.276 -16.804 -7.345 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.606 -17.680 -8.707 1.00 0.00 H new ATOM 0 HG2 ARG A 33 6.917 -16.393 -10.283 1.00 0.00 H new ATOM 0 HG3 ARG A 33 7.443 -15.288 -9.028 1.00 0.00 H new ATOM 0 HD2 ARG A 33 8.750 -17.301 -8.023 1.00 0.00 H new ATOM 0 HD3 ARG A 33 8.438 -18.115 -9.543 1.00 0.00 H new ATOM 0 HE ARG A 33 9.234 -15.804 -10.625 1.00 0.00 H new ATOM 0 HH11 ARG A 33 10.550 -17.219 -7.551 1.00 0.00 H new ATOM 0 HH12 ARG A 33 12.105 -16.398 -7.722 1.00 0.00 H new ATOM 0 HH21 ARG A 33 11.520 -15.186 -10.961 1.00 0.00 H new ATOM 0 HH22 ARG A 33 12.640 -15.285 -9.598 1.00 0.00 H new ATOM 509 N SER A 34 3.245 -16.033 -6.863 1.00 0.00 N ATOM 510 CA SER A 34 1.985 -16.352 -6.265 1.00 0.00 C ATOM 511 C SER A 34 0.858 -15.542 -6.808 1.00 0.00 C ATOM 512 O SER A 34 -0.275 -15.979 -7.002 1.00 0.00 O ATOM 513 CB SER A 34 1.868 -16.283 -4.733 1.00 0.00 C ATOM 514 OG SER A 34 2.801 -17.183 -4.152 1.00 0.00 O ATOM 0 H SER A 34 3.910 -15.653 -6.190 1.00 0.00 H new ATOM 0 HA SER A 34 1.922 -17.404 -6.542 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.060 -15.267 -4.387 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.855 -16.539 -4.422 1.00 0.00 H new ATOM 0 HG SER A 34 3.677 -17.065 -4.576 1.00 0.00 H new ATOM 520 N LEU A 35 1.048 -14.226 -7.007 1.00 0.00 N ATOM 521 CA LEU A 35 0.043 -13.413 -7.619 1.00 0.00 C ATOM 522 C LEU A 35 0.016 -13.617 -9.094 1.00 0.00 C ATOM 523 O LEU A 35 -0.957 -13.219 -9.734 1.00 0.00 O ATOM 524 CB LEU A 35 0.304 -11.951 -7.221 1.00 0.00 C ATOM 525 CG LEU A 35 0.259 -11.580 -5.730 1.00 0.00 C ATOM 526 CD1 LEU A 35 1.090 -10.289 -5.643 1.00 0.00 C ATOM 527 CD2 LEU A 35 -1.196 -11.436 -5.250 1.00 0.00 C ATOM 0 H LEU A 35 1.897 -13.725 -6.745 1.00 0.00 H new ATOM 0 HA LEU A 35 -0.948 -13.698 -7.267 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.287 -11.673 -7.603 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.427 -11.330 -7.740 1.00 0.00 H new ATOM 0 HG LEU A 35 0.672 -12.341 -5.068 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.117 -9.943 -4.610 1.00 0.00 H new ATOM 0 HD12 LEU A 35 2.105 -10.486 -5.987 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.637 -9.522 -6.271 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.206 -11.173 -4.192 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.692 -10.653 -5.823 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.722 -12.380 -5.394 1.00 0.00 H new ATOM 539 N GLY A 36 0.968 -14.334 -9.716 1.00 0.00 N ATOM 540 CA GLY A 36 0.921 -14.637 -11.113 1.00 0.00 C ATOM 541 C GLY A 36 1.626 -13.587 -11.900 1.00 0.00 C ATOM 542 O GLY A 36 1.109 -13.301 -12.979 1.00 0.00 O ATOM 0 H GLY A 36 1.787 -14.711 -9.239 1.00 0.00 H new ATOM 0 HA2 GLY A 36 1.382 -15.608 -11.296 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.116 -14.710 -11.440 1.00 0.00 H new ATOM 546 N GLN A 37 2.803 -13.085 -11.485 1.00 0.00 N ATOM 547 CA GLN A 37 3.796 -12.346 -12.201 1.00 0.00 C ATOM 548 C GLN A 37 4.913 -13.280 -12.515 1.00 0.00 C ATOM 549 O GLN A 37 5.153 -14.193 -11.727 1.00 0.00 O ATOM 550 CB GLN A 37 4.411 -11.147 -11.459 1.00 0.00 C ATOM 551 CG GLN A 37 5.291 -10.147 -12.212 1.00 0.00 C ATOM 552 CD GLN A 37 4.468 -8.998 -12.777 1.00 0.00 C ATOM 553 OE1 GLN A 37 3.632 -8.448 -12.061 1.00 0.00 O ATOM 554 NE2 GLN A 37 4.579 -8.570 -14.063 1.00 0.00 N ATOM 0 H GLN A 37 3.092 -13.218 -10.516 1.00 0.00 H new ATOM 0 HA GLN A 37 3.283 -11.936 -13.071 1.00 0.00 H new ATOM 0 HB2 GLN A 37 3.589 -10.585 -11.015 1.00 0.00 H new ATOM 0 HB3 GLN A 37 5.005 -11.546 -10.637 1.00 0.00 H new ATOM 0 HG2 GLN A 37 6.054 -9.754 -11.540 1.00 0.00 H new ATOM 0 HG3 GLN A 37 5.812 -10.657 -13.023 1.00 0.00 H new ATOM 0 HE21 GLN A 37 5.261 -9.002 -14.687 1.00 0.00 H new ATOM 0 HE22 GLN A 37 3.981 -7.817 -14.403 1.00 0.00 H new ATOM 563 N ASN A 38 5.633 -13.096 -13.636 1.00 0.00 N ATOM 564 CA ASN A 38 6.707 -13.996 -13.920 1.00 0.00 C ATOM 565 C ASN A 38 8.059 -13.379 -13.814 1.00 0.00 C ATOM 566 O ASN A 38 8.712 -13.301 -14.854 1.00 0.00 O ATOM 567 CB ASN A 38 6.508 -14.538 -15.346 1.00 0.00 C ATOM 568 CG ASN A 38 5.302 -15.463 -15.424 1.00 0.00 C ATOM 569 OD1 ASN A 38 5.367 -16.678 -15.244 1.00 0.00 O ATOM 570 ND2 ASN A 38 4.083 -14.913 -15.672 1.00 0.00 N ATOM 0 H ASN A 38 5.482 -12.356 -14.321 1.00 0.00 H new ATOM 0 HA ASN A 38 6.676 -14.786 -13.169 1.00 0.00 H new ATOM 0 HB2 ASN A 38 6.376 -13.706 -16.038 1.00 0.00 H new ATOM 0 HB3 ASN A 38 7.402 -15.076 -15.661 1.00 0.00 H new ATOM 0 HD21 ASN A 38 3.253 -15.505 -15.705 1.00 0.00 H new ATOM 0 HD22 ASN A 38 3.999 -13.908 -15.825 1.00 0.00 H new ATOM 577 N PRO A 39 8.628 -12.908 -12.745 1.00 0.00 N ATOM 578 CA PRO A 39 9.774 -12.052 -12.644 1.00 0.00 C ATOM 579 C PRO A 39 11.048 -12.824 -12.648 1.00 0.00 C ATOM 580 O PRO A 39 11.124 -14.018 -12.363 1.00 0.00 O ATOM 581 CB PRO A 39 9.452 -11.232 -11.397 1.00 0.00 C ATOM 582 CG PRO A 39 8.938 -12.328 -10.449 1.00 0.00 C ATOM 583 CD PRO A 39 8.055 -13.122 -11.424 1.00 0.00 C ATOM 0 HA PRO A 39 9.951 -11.392 -13.493 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.330 -10.723 -11.000 1.00 0.00 H new ATOM 0 HB3 PRO A 39 8.700 -10.467 -11.589 1.00 0.00 H new ATOM 0 HG2 PRO A 39 9.744 -12.930 -10.030 1.00 0.00 H new ATOM 0 HG3 PRO A 39 8.374 -11.923 -9.609 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.046 -14.182 -11.169 1.00 0.00 H new ATOM 0 HD3 PRO A 39 7.022 -12.776 -11.386 1.00 0.00 H new ATOM 591 N THR A 40 12.111 -12.187 -13.171 1.00 0.00 N ATOM 592 CA THR A 40 13.320 -12.936 -13.327 1.00 0.00 C ATOM 593 C THR A 40 14.215 -12.623 -12.178 1.00 0.00 C ATOM 594 O THR A 40 14.012 -11.611 -11.511 1.00 0.00 O ATOM 595 CB THR A 40 14.126 -12.475 -14.505 1.00 0.00 C ATOM 596 OG1 THR A 40 14.101 -11.069 -14.705 1.00 0.00 O ATOM 597 CG2 THR A 40 13.364 -12.916 -15.766 1.00 0.00 C ATOM 0 H THR A 40 12.140 -11.212 -13.470 1.00 0.00 H new ATOM 0 HA THR A 40 13.026 -13.981 -13.422 1.00 0.00 H new ATOM 0 HB THR A 40 15.134 -12.855 -14.337 1.00 0.00 H new ATOM 0 HG1 THR A 40 14.647 -10.840 -15.486 1.00 0.00 H new ATOM 0 HG21 THR A 40 13.915 -12.601 -16.653 1.00 0.00 H new ATOM 0 HG22 THR A 40 13.262 -14.001 -15.769 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.375 -12.459 -15.772 1.00 0.00 H new ATOM 605 N GLU A 41 15.265 -13.413 -11.887 1.00 0.00 N ATOM 606 CA GLU A 41 16.058 -13.171 -10.722 1.00 0.00 C ATOM 607 C GLU A 41 16.805 -11.882 -10.744 1.00 0.00 C ATOM 608 O GLU A 41 16.794 -11.140 -9.763 1.00 0.00 O ATOM 609 CB GLU A 41 17.093 -14.280 -10.467 1.00 0.00 C ATOM 610 CG GLU A 41 16.392 -15.640 -10.480 1.00 0.00 C ATOM 611 CD GLU A 41 15.532 -15.900 -9.252 1.00 0.00 C ATOM 612 OE1 GLU A 41 16.106 -15.968 -8.132 1.00 0.00 O ATOM 613 OE2 GLU A 41 14.297 -16.119 -9.369 1.00 0.00 O ATOM 0 H GLU A 41 15.562 -14.210 -12.451 1.00 0.00 H new ATOM 0 HA GLU A 41 15.314 -13.141 -9.926 1.00 0.00 H new ATOM 0 HB2 GLU A 41 17.869 -14.251 -11.231 1.00 0.00 H new ATOM 0 HB3 GLU A 41 17.584 -14.121 -9.507 1.00 0.00 H new ATOM 0 HG2 GLU A 41 15.767 -15.708 -11.370 1.00 0.00 H new ATOM 0 HG3 GLU A 41 17.144 -16.425 -10.558 1.00 0.00 H new ATOM 620 N ALA A 42 17.311 -11.580 -11.952 1.00 0.00 N ATOM 621 CA ALA A 42 17.970 -10.353 -12.280 1.00 0.00 C ATOM 622 C ALA A 42 17.208 -9.092 -12.058 1.00 0.00 C ATOM 623 O ALA A 42 17.771 -8.029 -11.797 1.00 0.00 O ATOM 624 CB ALA A 42 18.311 -10.455 -13.777 1.00 0.00 C ATOM 0 H ALA A 42 17.258 -12.224 -12.741 1.00 0.00 H new ATOM 0 HA ALA A 42 18.821 -10.265 -11.605 1.00 0.00 H new ATOM 0 HB1 ALA A 42 18.819 -9.546 -14.097 1.00 0.00 H new ATOM 0 HB2 ALA A 42 18.962 -11.313 -13.944 1.00 0.00 H new ATOM 0 HB3 ALA A 42 17.393 -10.579 -14.352 1.00 0.00 H new ATOM 630 N GLU A 43 15.866 -9.179 -12.079 1.00 0.00 N ATOM 631 CA GLU A 43 14.992 -8.084 -11.793 1.00 0.00 C ATOM 632 C GLU A 43 14.710 -7.973 -10.334 1.00 0.00 C ATOM 633 O GLU A 43 14.681 -6.874 -9.783 1.00 0.00 O ATOM 634 CB GLU A 43 13.600 -8.356 -12.389 1.00 0.00 C ATOM 635 CG GLU A 43 13.499 -8.063 -13.887 1.00 0.00 C ATOM 636 CD GLU A 43 12.158 -8.466 -14.483 1.00 0.00 C ATOM 637 OE1 GLU A 43 11.692 -9.614 -14.252 1.00 0.00 O ATOM 638 OE2 GLU A 43 11.563 -7.625 -15.208 1.00 0.00 O ATOM 0 H GLU A 43 15.372 -10.043 -12.303 1.00 0.00 H new ATOM 0 HA GLU A 43 15.485 -7.198 -12.193 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.338 -9.400 -12.214 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.864 -7.750 -11.860 1.00 0.00 H new ATOM 0 HG2 GLU A 43 13.660 -6.998 -14.055 1.00 0.00 H new ATOM 0 HG3 GLU A 43 14.296 -8.592 -14.410 1.00 0.00 H new ATOM 645 N LEU A 44 14.613 -9.059 -9.546 1.00 0.00 N ATOM 646 CA LEU A 44 14.216 -9.087 -8.173 1.00 0.00 C ATOM 647 C LEU A 44 15.381 -8.658 -7.348 1.00 0.00 C ATOM 648 O LEU A 44 15.227 -7.932 -6.367 1.00 0.00 O ATOM 649 CB LEU A 44 14.018 -10.566 -7.800 1.00 0.00 C ATOM 650 CG LEU A 44 12.745 -11.224 -8.358 1.00 0.00 C ATOM 651 CD1 LEU A 44 12.889 -12.682 -7.890 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.553 -10.416 -7.815 1.00 0.00 C ATOM 0 H LEU A 44 14.830 -9.991 -9.899 1.00 0.00 H new ATOM 0 HA LEU A 44 13.333 -8.467 -8.017 1.00 0.00 H new ATOM 0 HB2 LEU A 44 14.882 -11.130 -8.152 1.00 0.00 H new ATOM 0 HB3 LEU A 44 14.003 -10.650 -6.713 1.00 0.00 H new ATOM 0 HG LEU A 44 12.590 -11.229 -9.437 1.00 0.00 H new ATOM 0 HD11 LEU A 44 12.030 -13.260 -8.231 1.00 0.00 H new ATOM 0 HD12 LEU A 44 13.802 -13.109 -8.305 1.00 0.00 H new ATOM 0 HD13 LEU A 44 12.937 -12.712 -6.801 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.623 -10.847 -8.185 1.00 0.00 H new ATOM 0 HD22 LEU A 44 11.559 -10.447 -6.725 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.632 -9.382 -8.149 1.00 0.00 H new ATOM 664 N GLN A 45 16.593 -9.075 -7.757 1.00 0.00 N ATOM 665 CA GLN A 45 17.770 -8.673 -7.052 1.00 0.00 C ATOM 666 C GLN A 45 18.114 -7.232 -7.214 1.00 0.00 C ATOM 667 O GLN A 45 18.644 -6.554 -6.336 1.00 0.00 O ATOM 668 CB GLN A 45 19.023 -9.463 -7.464 1.00 0.00 C ATOM 669 CG GLN A 45 19.454 -9.251 -8.916 1.00 0.00 C ATOM 670 CD GLN A 45 20.786 -9.939 -9.176 1.00 0.00 C ATOM 671 OE1 GLN A 45 20.832 -11.056 -9.689 1.00 0.00 O ATOM 672 NE2 GLN A 45 21.938 -9.260 -8.927 1.00 0.00 N ATOM 0 H GLN A 45 16.757 -9.680 -8.562 1.00 0.00 H new ATOM 0 HA GLN A 45 17.505 -8.878 -6.015 1.00 0.00 H new ATOM 0 HB2 GLN A 45 19.847 -9.182 -6.808 1.00 0.00 H new ATOM 0 HB3 GLN A 45 18.837 -10.525 -7.304 1.00 0.00 H new ATOM 0 HG2 GLN A 45 18.694 -9.647 -9.590 1.00 0.00 H new ATOM 0 HG3 GLN A 45 19.540 -8.185 -9.125 1.00 0.00 H new ATOM 0 HE21 GLN A 45 21.902 -8.334 -8.502 1.00 0.00 H new ATOM 0 HE22 GLN A 45 22.838 -9.677 -9.166 1.00 0.00 H new ATOM 681 N ASP A 46 17.575 -6.658 -8.305 1.00 0.00 N ATOM 682 CA ASP A 46 17.723 -5.279 -8.653 1.00 0.00 C ATOM 683 C ASP A 46 16.814 -4.469 -7.794 1.00 0.00 C ATOM 684 O ASP A 46 17.164 -3.489 -7.139 1.00 0.00 O ATOM 685 CB ASP A 46 17.442 -5.085 -10.153 1.00 0.00 C ATOM 686 CG ASP A 46 17.811 -3.673 -10.586 1.00 0.00 C ATOM 687 OD1 ASP A 46 19.014 -3.338 -10.424 1.00 0.00 O ATOM 688 OD2 ASP A 46 16.981 -2.843 -11.042 1.00 0.00 O ATOM 0 H ASP A 46 17.010 -7.180 -8.975 1.00 0.00 H new ATOM 0 HA ASP A 46 18.745 -4.943 -8.476 1.00 0.00 H new ATOM 0 HB2 ASP A 46 18.013 -5.810 -10.733 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.388 -5.271 -10.359 1.00 0.00 H new ATOM 693 N MET A 47 15.534 -4.874 -7.713 1.00 0.00 N ATOM 694 CA MET A 47 14.513 -4.280 -6.908 1.00 0.00 C ATOM 695 C MET A 47 14.859 -3.987 -5.489 1.00 0.00 C ATOM 696 O MET A 47 14.604 -2.974 -4.838 1.00 0.00 O ATOM 697 CB MET A 47 13.120 -4.933 -6.937 1.00 0.00 C ATOM 698 CG MET A 47 12.481 -4.905 -8.327 1.00 0.00 C ATOM 699 SD MET A 47 11.363 -6.303 -8.643 1.00 0.00 S ATOM 700 CE MET A 47 11.089 -5.865 -10.384 1.00 0.00 C ATOM 0 H MET A 47 15.190 -5.672 -8.248 1.00 0.00 H new ATOM 0 HA MET A 47 14.453 -3.337 -7.451 1.00 0.00 H new ATOM 0 HB2 MET A 47 13.201 -5.966 -6.600 1.00 0.00 H new ATOM 0 HB3 MET A 47 12.468 -4.418 -6.232 1.00 0.00 H new ATOM 0 HG2 MET A 47 11.927 -3.974 -8.444 1.00 0.00 H new ATOM 0 HG3 MET A 47 13.269 -4.904 -9.080 1.00 0.00 H new ATOM 0 HE1 MET A 47 11.056 -6.773 -10.987 1.00 0.00 H new ATOM 0 HE2 MET A 47 10.144 -5.331 -10.480 1.00 0.00 H new ATOM 0 HE3 MET A 47 11.903 -5.228 -10.731 1.00 0.00 H new ATOM 710 N ILE A 48 15.508 -5.017 -4.918 1.00 0.00 N ATOM 711 CA ILE A 48 15.934 -5.141 -3.558 1.00 0.00 C ATOM 712 C ILE A 48 17.142 -4.286 -3.386 1.00 0.00 C ATOM 713 O ILE A 48 17.160 -3.466 -2.469 1.00 0.00 O ATOM 714 CB ILE A 48 16.126 -6.538 -3.049 1.00 0.00 C ATOM 715 CG1 ILE A 48 14.750 -7.224 -2.990 1.00 0.00 C ATOM 716 CG2 ILE A 48 16.925 -6.608 -1.737 1.00 0.00 C ATOM 717 CD1 ILE A 48 14.698 -8.513 -2.171 1.00 0.00 C ATOM 0 H ILE A 48 15.758 -5.842 -5.463 1.00 0.00 H new ATOM 0 HA ILE A 48 15.116 -4.795 -2.926 1.00 0.00 H new ATOM 0 HB ILE A 48 16.758 -7.092 -3.743 1.00 0.00 H new ATOM 0 HG12 ILE A 48 14.029 -6.520 -2.575 1.00 0.00 H new ATOM 0 HG13 ILE A 48 14.429 -7.446 -4.008 1.00 0.00 H new ATOM 0 HG21 ILE A 48 17.025 -7.648 -1.427 1.00 0.00 H new ATOM 0 HG22 ILE A 48 17.915 -6.178 -1.890 1.00 0.00 H new ATOM 0 HG23 ILE A 48 16.402 -6.048 -0.962 1.00 0.00 H new ATOM 0 HD11 ILE A 48 13.686 -8.917 -2.193 1.00 0.00 H new ATOM 0 HD12 ILE A 48 15.389 -9.242 -2.595 1.00 0.00 H new ATOM 0 HD13 ILE A 48 14.982 -8.301 -1.140 1.00 0.00 H new ATOM 729 N ASN A 49 18.096 -4.269 -4.334 1.00 0.00 N ATOM 730 CA ASN A 49 19.245 -3.426 -4.218 1.00 0.00 C ATOM 731 C ASN A 49 19.032 -1.954 -4.295 1.00 0.00 C ATOM 732 O ASN A 49 19.832 -1.215 -3.723 1.00 0.00 O ATOM 733 CB ASN A 49 20.210 -3.751 -5.370 1.00 0.00 C ATOM 734 CG ASN A 49 21.652 -3.334 -5.121 1.00 0.00 C ATOM 735 OD1 ASN A 49 22.268 -3.655 -4.105 1.00 0.00 O ATOM 736 ND2 ASN A 49 22.282 -2.774 -6.188 1.00 0.00 N ATOM 0 H ASN A 49 18.072 -4.838 -5.180 1.00 0.00 H new ATOM 0 HA ASN A 49 19.609 -3.640 -3.213 1.00 0.00 H new ATOM 0 HB2 ASN A 49 20.183 -4.824 -5.558 1.00 0.00 H new ATOM 0 HB3 ASN A 49 19.854 -3.259 -6.275 1.00 0.00 H new ATOM 0 HD21 ASN A 49 23.288 -2.611 -6.158 1.00 0.00 H new ATOM 0 HD22 ASN A 49 21.748 -2.517 -7.018 1.00 0.00 H new ATOM 743 N GLU A 50 18.016 -1.440 -5.012 1.00 0.00 N ATOM 744 CA GLU A 50 17.691 -0.049 -5.086 1.00 0.00 C ATOM 745 C GLU A 50 17.394 0.580 -3.768 1.00 0.00 C ATOM 746 O GLU A 50 17.760 1.710 -3.449 1.00 0.00 O ATOM 747 CB GLU A 50 16.459 0.133 -5.988 1.00 0.00 C ATOM 748 CG GLU A 50 16.714 -0.117 -7.476 1.00 0.00 C ATOM 749 CD GLU A 50 17.746 0.881 -7.980 1.00 0.00 C ATOM 750 OE1 GLU A 50 17.364 2.067 -8.166 1.00 0.00 O ATOM 751 OE2 GLU A 50 18.915 0.500 -8.253 1.00 0.00 O ATOM 0 H GLU A 50 17.391 -2.024 -5.567 1.00 0.00 H new ATOM 0 HA GLU A 50 18.576 0.446 -5.486 1.00 0.00 H new ATOM 0 HB2 GLU A 50 15.674 -0.543 -5.649 1.00 0.00 H new ATOM 0 HB3 GLU A 50 16.081 1.148 -5.863 1.00 0.00 H new ATOM 0 HG2 GLU A 50 17.070 -1.136 -7.630 1.00 0.00 H new ATOM 0 HG3 GLU A 50 15.786 -0.015 -8.039 1.00 0.00 H new ATOM 758 N VAL A 51 16.648 -0.102 -2.880 1.00 0.00 N ATOM 759 CA VAL A 51 16.320 0.258 -1.536 1.00 0.00 C ATOM 760 C VAL A 51 17.334 -0.152 -0.525 1.00 0.00 C ATOM 761 O VAL A 51 17.400 0.368 0.587 1.00 0.00 O ATOM 762 CB VAL A 51 14.952 -0.181 -1.104 1.00 0.00 C ATOM 763 CG1 VAL A 51 13.907 0.678 -1.835 1.00 0.00 C ATOM 764 CG2 VAL A 51 14.784 -1.662 -1.485 1.00 0.00 C ATOM 0 H VAL A 51 16.233 -0.999 -3.133 1.00 0.00 H new ATOM 0 HA VAL A 51 16.322 1.347 -1.571 1.00 0.00 H new ATOM 0 HB VAL A 51 14.821 -0.062 -0.028 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.906 0.371 -1.531 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.057 1.727 -1.581 1.00 0.00 H new ATOM 0 HG13 VAL A 51 14.016 0.546 -2.911 1.00 0.00 H new ATOM 0 HG21 VAL A 51 13.795 -2.006 -1.181 1.00 0.00 H new ATOM 0 HG22 VAL A 51 14.891 -1.775 -2.564 1.00 0.00 H new ATOM 0 HG23 VAL A 51 15.546 -2.256 -0.981 1.00 0.00 H new ATOM 774 N ASP A 52 18.281 -1.064 -0.810 1.00 0.00 N ATOM 775 CA ASP A 52 19.347 -1.428 0.071 1.00 0.00 C ATOM 776 C ASP A 52 20.307 -0.307 0.276 1.00 0.00 C ATOM 777 O ASP A 52 20.836 0.261 -0.678 1.00 0.00 O ATOM 778 CB ASP A 52 20.080 -2.666 -0.475 1.00 0.00 C ATOM 779 CG ASP A 52 21.198 -3.258 0.371 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.828 -3.736 1.477 1.00 0.00 O ATOM 781 OD2 ASP A 52 22.401 -3.219 -0.001 1.00 0.00 O ATOM 0 H ASP A 52 18.304 -1.571 -1.695 1.00 0.00 H new ATOM 0 HA ASP A 52 18.910 -1.664 1.041 1.00 0.00 H new ATOM 0 HB2 ASP A 52 19.339 -3.447 -0.644 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.497 -2.406 -1.448 1.00 0.00 H new ATOM 786 N ALA A 53 20.457 0.078 1.556 1.00 0.00 N ATOM 787 CA ALA A 53 21.151 1.205 2.097 1.00 0.00 C ATOM 788 C ALA A 53 22.464 0.648 2.527 1.00 0.00 C ATOM 789 O ALA A 53 23.468 1.077 1.961 1.00 0.00 O ATOM 790 CB ALA A 53 20.452 1.698 3.375 1.00 0.00 C ATOM 0 H ALA A 53 20.036 -0.475 2.303 1.00 0.00 H new ATOM 0 HA ALA A 53 21.208 2.022 1.377 1.00 0.00 H new ATOM 0 HB1 ALA A 53 20.991 2.556 3.776 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.428 1.990 3.140 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.441 0.898 4.115 1.00 0.00 H new ATOM 796 N ASP A 54 22.577 -0.313 3.462 1.00 0.00 N ATOM 797 CA ASP A 54 23.755 -0.925 3.993 1.00 0.00 C ATOM 798 C ASP A 54 24.725 -1.407 2.971 1.00 0.00 C ATOM 799 O ASP A 54 25.742 -0.769 2.705 1.00 0.00 O ATOM 800 CB ASP A 54 23.534 -1.919 5.146 1.00 0.00 C ATOM 801 CG ASP A 54 22.429 -2.927 4.865 1.00 0.00 C ATOM 802 OD1 ASP A 54 22.387 -3.646 3.831 1.00 0.00 O ATOM 803 OD2 ASP A 54 21.431 -3.120 5.610 1.00 0.00 O ATOM 0 H ASP A 54 21.740 -0.704 3.894 1.00 0.00 H new ATOM 0 HA ASP A 54 24.248 -0.080 4.474 1.00 0.00 H new ATOM 0 HB2 ASP A 54 24.464 -2.454 5.340 1.00 0.00 H new ATOM 0 HB3 ASP A 54 23.290 -1.365 6.053 1.00 0.00 H new ATOM 808 N GLY A 55 24.408 -2.554 2.343 1.00 0.00 N ATOM 809 CA GLY A 55 25.270 -3.249 1.438 1.00 0.00 C ATOM 810 C GLY A 55 25.311 -4.718 1.688 1.00 0.00 C ATOM 811 O GLY A 55 26.351 -5.363 1.560 1.00 0.00 O ATOM 0 H GLY A 55 23.509 -3.018 2.473 1.00 0.00 H new ATOM 0 HA2 GLY A 55 24.937 -3.069 0.416 1.00 0.00 H new ATOM 0 HA3 GLY A 55 26.278 -2.843 1.521 1.00 0.00 H new ATOM 815 N ASN A 56 24.231 -5.331 2.203 1.00 0.00 N ATOM 816 CA ASN A 56 23.988 -6.733 2.346 1.00 0.00 C ATOM 817 C ASN A 56 23.305 -7.118 1.079 1.00 0.00 C ATOM 818 O ASN A 56 23.439 -8.249 0.616 1.00 0.00 O ATOM 819 CB ASN A 56 23.385 -7.215 3.677 1.00 0.00 C ATOM 820 CG ASN A 56 22.007 -6.638 3.972 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.376 -6.016 3.120 1.00 0.00 O ATOM 822 ND2 ASN A 56 21.402 -6.998 5.135 1.00 0.00 N ATOM 0 H ASN A 56 23.446 -4.784 2.556 1.00 0.00 H new ATOM 0 HA ASN A 56 24.917 -7.291 2.462 1.00 0.00 H new ATOM 0 HB2 ASN A 56 23.317 -8.303 3.662 1.00 0.00 H new ATOM 0 HB3 ASN A 56 24.062 -6.949 4.489 1.00 0.00 H new ATOM 0 HD21 ASN A 56 20.426 -6.752 5.300 1.00 0.00 H new ATOM 0 HD22 ASN A 56 21.924 -7.514 5.843 1.00 0.00 H new ATOM 829 N GLY A 57 22.485 -6.238 0.476 1.00 0.00 N ATOM 830 CA GLY A 57 21.721 -6.635 -0.666 1.00 0.00 C ATOM 831 C GLY A 57 20.446 -7.359 -0.400 1.00 0.00 C ATOM 832 O GLY A 57 19.867 -8.003 -1.273 1.00 0.00 O ATOM 0 H GLY A 57 22.352 -5.271 0.771 1.00 0.00 H new ATOM 0 HA2 GLY A 57 21.490 -5.743 -1.248 1.00 0.00 H new ATOM 0 HA3 GLY A 57 22.349 -7.270 -1.291 1.00 0.00 H new ATOM 836 N THR A 58 19.910 -7.203 0.824 1.00 0.00 N ATOM 837 CA THR A 58 18.654 -7.728 1.261 1.00 0.00 C ATOM 838 C THR A 58 17.887 -6.684 1.996 1.00 0.00 C ATOM 839 O THR A 58 18.484 -5.751 2.533 1.00 0.00 O ATOM 840 CB THR A 58 18.737 -8.966 2.104 1.00 0.00 C ATOM 841 OG1 THR A 58 19.710 -8.815 3.127 1.00 0.00 O ATOM 842 CG2 THR A 58 19.181 -10.147 1.225 1.00 0.00 C ATOM 0 H THR A 58 20.386 -6.675 1.555 1.00 0.00 H new ATOM 0 HA THR A 58 18.142 -8.025 0.345 1.00 0.00 H new ATOM 0 HB THR A 58 17.756 -9.141 2.545 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.747 -9.632 3.666 1.00 0.00 H new ATOM 0 HG21 THR A 58 19.243 -11.050 1.833 1.00 0.00 H new ATOM 0 HG22 THR A 58 18.456 -10.297 0.425 1.00 0.00 H new ATOM 0 HG23 THR A 58 20.159 -9.932 0.794 1.00 0.00 H new ATOM 850 N ILE A 59 16.542 -6.690 2.001 1.00 0.00 N ATOM 851 CA ILE A 59 15.877 -5.588 2.623 1.00 0.00 C ATOM 852 C ILE A 59 15.798 -5.734 4.104 1.00 0.00 C ATOM 853 O ILE A 59 15.311 -6.741 4.616 1.00 0.00 O ATOM 854 CB ILE A 59 14.474 -5.340 2.155 1.00 0.00 C ATOM 855 CG1 ILE A 59 14.257 -5.735 0.685 1.00 0.00 C ATOM 856 CG2 ILE A 59 14.149 -3.858 2.408 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.797 -5.613 0.250 1.00 0.00 C ATOM 0 H ILE A 59 15.943 -7.412 1.600 1.00 0.00 H new ATOM 0 HA ILE A 59 16.503 -4.746 2.328 1.00 0.00 H new ATOM 0 HB ILE A 59 13.790 -5.975 2.718 1.00 0.00 H new ATOM 0 HG12 ILE A 59 14.875 -5.103 0.048 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.592 -6.762 0.536 1.00 0.00 H new ATOM 0 HG21 ILE A 59 13.132 -3.647 2.077 1.00 0.00 H new ATOM 0 HG22 ILE A 59 14.236 -3.643 3.473 1.00 0.00 H new ATOM 0 HG23 ILE A 59 14.848 -3.232 1.854 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.703 -5.904 -0.796 1.00 0.00 H new ATOM 0 HD12 ILE A 59 12.178 -6.266 0.865 1.00 0.00 H new ATOM 0 HD13 ILE A 59 12.467 -4.581 0.370 1.00 0.00 H new ATOM 869 N ASP A 60 16.232 -4.705 4.854 1.00 0.00 N ATOM 870 CA ASP A 60 16.338 -4.693 6.280 1.00 0.00 C ATOM 871 C ASP A 60 15.166 -3.868 6.689 1.00 0.00 C ATOM 872 O ASP A 60 14.563 -3.104 5.938 1.00 0.00 O ATOM 873 CB ASP A 60 17.599 -4.023 6.851 1.00 0.00 C ATOM 874 CG ASP A 60 18.781 -4.963 6.658 1.00 0.00 C ATOM 875 OD1 ASP A 60 19.206 -5.213 5.498 1.00 0.00 O ATOM 876 OD2 ASP A 60 19.207 -5.454 7.737 1.00 0.00 O ATOM 0 H ASP A 60 16.528 -3.823 4.435 1.00 0.00 H new ATOM 0 HA ASP A 60 16.380 -5.718 6.647 1.00 0.00 H new ATOM 0 HB2 ASP A 60 17.784 -3.075 6.347 1.00 0.00 H new ATOM 0 HB3 ASP A 60 17.462 -3.800 7.909 1.00 0.00 H new ATOM 881 N PHE A 61 14.764 -3.850 7.972 1.00 0.00 N ATOM 882 CA PHE A 61 13.736 -3.062 8.578 1.00 0.00 C ATOM 883 C PHE A 61 13.864 -1.598 8.332 1.00 0.00 C ATOM 884 O PHE A 61 12.823 -1.094 7.914 1.00 0.00 O ATOM 885 CB PHE A 61 13.479 -3.452 10.043 1.00 0.00 C ATOM 886 CG PHE A 61 12.199 -2.862 10.525 1.00 0.00 C ATOM 887 CD1 PHE A 61 11.016 -3.503 10.243 1.00 0.00 C ATOM 888 CD2 PHE A 61 12.183 -1.708 11.273 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.833 -2.954 10.680 1.00 0.00 C ATOM 890 CE2 PHE A 61 11.006 -1.195 11.763 1.00 0.00 C ATOM 891 CZ PHE A 61 9.824 -1.841 11.486 1.00 0.00 C ATOM 0 H PHE A 61 15.212 -4.457 8.659 1.00 0.00 H new ATOM 0 HA PHE A 61 12.816 -3.319 8.053 1.00 0.00 H new ATOM 0 HB2 PHE A 61 13.443 -4.537 10.135 1.00 0.00 H new ATOM 0 HB3 PHE A 61 14.303 -3.106 10.667 1.00 0.00 H new ATOM 0 HD1 PHE A 61 11.016 -4.427 9.685 1.00 0.00 H new ATOM 0 HD2 PHE A 61 13.111 -1.196 11.479 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.897 -3.405 10.385 1.00 0.00 H new ATOM 0 HE2 PHE A 61 11.009 -0.294 12.359 1.00 0.00 H new ATOM 0 HZ PHE A 61 8.895 -1.476 11.899 1.00 0.00 H new ATOM 901 N PRO A 62 14.896 -0.829 8.521 1.00 0.00 N ATOM 902 CA PRO A 62 14.882 0.590 8.312 1.00 0.00 C ATOM 903 C PRO A 62 14.933 0.911 6.858 1.00 0.00 C ATOM 904 O PRO A 62 14.506 1.998 6.473 1.00 0.00 O ATOM 905 CB PRO A 62 16.123 1.150 9.004 1.00 0.00 C ATOM 906 CG PRO A 62 16.961 -0.129 9.164 1.00 0.00 C ATOM 907 CD PRO A 62 15.971 -1.283 9.390 1.00 0.00 C ATOM 0 HA PRO A 62 13.967 1.025 8.715 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.629 1.903 8.400 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.889 1.614 9.962 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.567 -0.308 8.276 1.00 0.00 H new ATOM 0 HG3 PRO A 62 17.648 -0.038 10.006 1.00 0.00 H new ATOM 0 HD2 PRO A 62 16.375 -2.250 9.091 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.661 -1.375 10.431 1.00 0.00 H new ATOM 915 N GLU A 63 15.326 -0.007 5.956 1.00 0.00 N ATOM 916 CA GLU A 63 15.217 0.297 4.563 1.00 0.00 C ATOM 917 C GLU A 63 13.829 0.179 4.032 1.00 0.00 C ATOM 918 O GLU A 63 13.388 1.041 3.273 1.00 0.00 O ATOM 919 CB GLU A 63 16.040 -0.784 3.843 1.00 0.00 C ATOM 920 CG GLU A 63 17.493 -0.541 4.255 1.00 0.00 C ATOM 921 CD GLU A 63 18.355 -1.716 3.816 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.831 -2.856 3.703 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.572 -1.494 3.572 1.00 0.00 O ATOM 0 H GLU A 63 15.706 -0.927 6.179 1.00 0.00 H new ATOM 0 HA GLU A 63 15.547 1.324 4.408 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.713 -1.783 4.132 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.922 -0.711 2.762 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.860 0.380 3.803 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.558 -0.414 5.336 1.00 0.00 H new ATOM 930 N PHE A 64 13.034 -0.754 4.585 1.00 0.00 N ATOM 931 CA PHE A 64 11.620 -0.925 4.463 1.00 0.00 C ATOM 932 C PHE A 64 10.899 0.304 4.900 1.00 0.00 C ATOM 933 O PHE A 64 10.167 0.986 4.185 1.00 0.00 O ATOM 934 CB PHE A 64 11.162 -2.176 5.232 1.00 0.00 C ATOM 935 CG PHE A 64 9.738 -2.596 5.105 1.00 0.00 C ATOM 936 CD1 PHE A 64 8.660 -2.179 5.849 1.00 0.00 C ATOM 937 CD2 PHE A 64 9.489 -3.511 4.109 1.00 0.00 C ATOM 938 CE1 PHE A 64 7.412 -2.730 5.673 1.00 0.00 C ATOM 939 CE2 PHE A 64 8.254 -4.058 3.851 1.00 0.00 C ATOM 940 CZ PHE A 64 7.215 -3.601 4.628 1.00 0.00 C ATOM 0 H PHE A 64 13.434 -1.472 5.189 1.00 0.00 H new ATOM 0 HA PHE A 64 11.372 -1.081 3.413 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.786 -3.011 4.912 1.00 0.00 H new ATOM 0 HB3 PHE A 64 11.368 -2.011 6.290 1.00 0.00 H new ATOM 0 HD1 PHE A 64 8.796 -1.402 6.587 1.00 0.00 H new ATOM 0 HD2 PHE A 64 10.317 -3.820 3.489 1.00 0.00 H new ATOM 0 HE1 PHE A 64 6.602 -2.483 6.343 1.00 0.00 H new ATOM 0 HE2 PHE A 64 8.108 -4.803 3.083 1.00 0.00 H new ATOM 0 HZ PHE A 64 6.212 -3.937 4.410 1.00 0.00 H new ATOM 950 N LEU A 65 11.184 0.830 6.104 1.00 0.00 N ATOM 951 CA LEU A 65 10.733 2.117 6.534 1.00 0.00 C ATOM 952 C LEU A 65 11.172 3.316 5.766 1.00 0.00 C ATOM 953 O LEU A 65 10.345 4.213 5.612 1.00 0.00 O ATOM 954 CB LEU A 65 11.164 2.421 7.979 1.00 0.00 C ATOM 955 CG LEU A 65 10.636 1.511 9.100 1.00 0.00 C ATOM 956 CD1 LEU A 65 10.963 2.186 10.443 1.00 0.00 C ATOM 957 CD2 LEU A 65 9.123 1.251 9.011 1.00 0.00 C ATOM 0 H LEU A 65 11.747 0.344 6.802 1.00 0.00 H new ATOM 0 HA LEU A 65 9.660 1.994 6.385 1.00 0.00 H new ATOM 0 HB2 LEU A 65 12.253 2.395 8.014 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.862 3.443 8.209 1.00 0.00 H new ATOM 0 HG LEU A 65 11.119 0.539 9.003 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.600 1.563 11.261 1.00 0.00 H new ATOM 0 HD12 LEU A 65 12.042 2.312 10.534 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.479 3.162 10.487 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.816 0.602 9.831 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.587 2.198 9.077 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.892 0.769 8.061 1.00 0.00 H new ATOM 969 N THR A 66 12.394 3.367 5.207 1.00 0.00 N ATOM 970 CA THR A 66 12.875 4.457 4.416 1.00 0.00 C ATOM 971 C THR A 66 12.060 4.758 3.206 1.00 0.00 C ATOM 972 O THR A 66 11.622 5.875 2.935 1.00 0.00 O ATOM 973 CB THR A 66 14.344 4.509 4.114 1.00 0.00 C ATOM 974 OG1 THR A 66 15.108 4.375 5.304 1.00 0.00 O ATOM 975 CG2 THR A 66 14.780 5.844 3.486 1.00 0.00 C ATOM 0 H THR A 66 13.076 2.616 5.311 1.00 0.00 H new ATOM 0 HA THR A 66 12.727 5.269 5.128 1.00 0.00 H new ATOM 0 HB THR A 66 14.519 3.691 3.415 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.884 3.528 5.743 1.00 0.00 H new ATOM 0 HG21 THR A 66 15.852 5.821 3.290 1.00 0.00 H new ATOM 0 HG22 THR A 66 14.244 5.998 2.550 1.00 0.00 H new ATOM 0 HG23 THR A 66 14.554 6.660 4.172 1.00 0.00 H new ATOM 983 N MET A 67 11.732 3.703 2.438 1.00 0.00 N ATOM 984 CA MET A 67 10.986 3.713 1.218 1.00 0.00 C ATOM 985 C MET A 67 9.640 4.344 1.321 1.00 0.00 C ATOM 986 O MET A 67 9.187 5.029 0.405 1.00 0.00 O ATOM 987 CB MET A 67 10.773 2.253 0.785 1.00 0.00 C ATOM 988 CG MET A 67 10.374 2.156 -0.689 1.00 0.00 C ATOM 989 SD MET A 67 10.077 0.461 -1.274 1.00 0.00 S ATOM 990 CE MET A 67 8.700 0.062 -0.159 1.00 0.00 C ATOM 0 H MET A 67 12.016 2.758 2.697 1.00 0.00 H new ATOM 0 HA MET A 67 11.563 4.304 0.507 1.00 0.00 H new ATOM 0 HB2 MET A 67 11.688 1.686 0.953 1.00 0.00 H new ATOM 0 HB3 MET A 67 9.999 1.799 1.403 1.00 0.00 H new ATOM 0 HG2 MET A 67 9.472 2.746 -0.849 1.00 0.00 H new ATOM 0 HG3 MET A 67 11.160 2.605 -1.296 1.00 0.00 H new ATOM 0 HE1 MET A 67 7.970 -0.551 -0.687 1.00 0.00 H new ATOM 0 HE2 MET A 67 9.078 -0.486 0.704 1.00 0.00 H new ATOM 0 HE3 MET A 67 8.225 0.984 0.176 1.00 0.00 H new ATOM 1000 N MET A 68 8.913 4.021 2.406 1.00 0.00 N ATOM 1001 CA MET A 68 7.587 4.439 2.739 1.00 0.00 C ATOM 1002 C MET A 68 7.522 5.793 3.356 1.00 0.00 C ATOM 1003 O MET A 68 6.466 6.391 3.158 1.00 0.00 O ATOM 1004 CB MET A 68 7.021 3.348 3.664 1.00 0.00 C ATOM 1005 CG MET A 68 6.872 1.978 3.000 1.00 0.00 C ATOM 1006 SD MET A 68 5.811 1.768 1.538 1.00 0.00 S ATOM 1007 CE MET A 68 4.323 2.487 2.292 1.00 0.00 C ATOM 0 H MET A 68 9.297 3.403 3.121 1.00 0.00 H new ATOM 0 HA MET A 68 6.990 4.546 1.833 1.00 0.00 H new ATOM 0 HB2 MET A 68 7.673 3.250 4.532 1.00 0.00 H new ATOM 0 HB3 MET A 68 6.046 3.669 4.032 1.00 0.00 H new ATOM 0 HG2 MET A 68 7.872 1.646 2.721 1.00 0.00 H new ATOM 0 HG3 MET A 68 6.508 1.289 3.763 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.436 2.015 1.869 1.00 0.00 H new ATOM 0 HE2 MET A 68 4.344 2.320 3.369 1.00 0.00 H new ATOM 0 HE3 MET A 68 4.295 3.558 2.092 1.00 0.00 H new ATOM 1017 N ALA A 69 8.644 6.268 3.927 1.00 0.00 N ATOM 1018 CA ALA A 69 8.765 7.561 4.526 1.00 0.00 C ATOM 1019 C ALA A 69 9.139 8.672 3.606 1.00 0.00 C ATOM 1020 O ALA A 69 9.264 9.816 4.041 1.00 0.00 O ATOM 1021 CB ALA A 69 9.948 7.413 5.497 1.00 0.00 C ATOM 0 H ALA A 69 9.506 5.725 3.973 1.00 0.00 H new ATOM 0 HA ALA A 69 7.794 7.825 4.946 1.00 0.00 H new ATOM 0 HB1 ALA A 69 10.120 8.360 6.008 1.00 0.00 H new ATOM 0 HB2 ALA A 69 9.721 6.640 6.232 1.00 0.00 H new ATOM 0 HB3 ALA A 69 10.843 7.133 4.941 1.00 0.00 H new ATOM 1027 N ARG A 70 9.224 8.432 2.285 1.00 0.00 N ATOM 1028 CA ARG A 70 9.277 9.486 1.320 1.00 0.00 C ATOM 1029 C ARG A 70 7.855 9.868 1.090 1.00 0.00 C ATOM 1030 O ARG A 70 6.999 8.998 0.942 1.00 0.00 O ATOM 1031 CB ARG A 70 9.953 9.153 -0.021 1.00 0.00 C ATOM 1032 CG ARG A 70 9.201 8.199 -0.951 1.00 0.00 C ATOM 1033 CD ARG A 70 10.130 7.631 -2.025 1.00 0.00 C ATOM 1034 NE ARG A 70 10.734 8.665 -2.912 1.00 0.00 N ATOM 1035 CZ ARG A 70 11.824 8.460 -3.708 1.00 0.00 C ATOM 1036 NH1 ARG A 70 12.462 7.259 -3.821 1.00 0.00 N ATOM 1037 NH2 ARG A 70 12.460 9.530 -4.268 1.00 0.00 N ATOM 0 H ARG A 70 9.256 7.496 1.882 1.00 0.00 H new ATOM 0 HA ARG A 70 9.906 10.281 1.721 1.00 0.00 H new ATOM 0 HB2 ARG A 70 10.124 10.087 -0.557 1.00 0.00 H new ATOM 0 HB3 ARG A 70 10.932 8.722 0.189 1.00 0.00 H new ATOM 0 HG2 ARG A 70 8.771 7.384 -0.370 1.00 0.00 H new ATOM 0 HG3 ARG A 70 8.372 8.725 -1.424 1.00 0.00 H new ATOM 0 HD2 ARG A 70 10.930 7.071 -1.540 1.00 0.00 H new ATOM 0 HD3 ARG A 70 9.571 6.923 -2.637 1.00 0.00 H new ATOM 0 HE ARG A 70 10.303 9.590 -2.925 1.00 0.00 H new ATOM 0 HH11 ARG A 70 12.128 6.452 -3.293 1.00 0.00 H new ATOM 0 HH12 ARG A 70 13.273 7.168 -4.433 1.00 0.00 H new ATOM 0 HH21 ARG A 70 12.120 10.475 -4.091 1.00 0.00 H new ATOM 0 HH22 ARG A 70 13.275 9.384 -4.864 1.00 0.00 H new ATOM 1051 N LYS A 71 7.583 11.173 0.917 1.00 0.00 N ATOM 1052 CA LYS A 71 6.218 11.514 0.660 1.00 0.00 C ATOM 1053 C LYS A 71 6.211 11.773 -0.807 1.00 0.00 C ATOM 1054 O LYS A 71 7.026 12.511 -1.360 1.00 0.00 O ATOM 1055 CB LYS A 71 5.792 12.701 1.540 1.00 0.00 C ATOM 1056 CG LYS A 71 4.450 13.377 1.254 1.00 0.00 C ATOM 1057 CD LYS A 71 4.394 14.787 1.844 1.00 0.00 C ATOM 1058 CE LYS A 71 3.111 15.565 1.544 1.00 0.00 C ATOM 1059 NZ LYS A 71 1.932 14.888 2.130 1.00 0.00 N ATOM 0 H LYS A 71 8.251 11.943 0.951 1.00 0.00 H new ATOM 0 HA LYS A 71 5.487 10.746 0.913 1.00 0.00 H new ATOM 0 HB2 LYS A 71 5.777 12.358 2.574 1.00 0.00 H new ATOM 0 HB3 LYS A 71 6.569 13.462 1.468 1.00 0.00 H new ATOM 0 HG2 LYS A 71 4.288 13.426 0.177 1.00 0.00 H new ATOM 0 HG3 LYS A 71 3.642 12.775 1.671 1.00 0.00 H new ATOM 0 HD2 LYS A 71 4.514 14.717 2.925 1.00 0.00 H new ATOM 0 HD3 LYS A 71 5.243 15.357 1.466 1.00 0.00 H new ATOM 0 HE2 LYS A 71 3.192 16.575 1.945 1.00 0.00 H new ATOM 0 HE3 LYS A 71 2.982 15.660 0.466 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 1.081 15.461 1.957 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.815 13.952 1.691 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.070 14.775 3.155 1.00 0.00 H new ATOM 1073 N MET A 72 5.311 11.023 -1.466 1.00 0.00 N ATOM 1074 CA MET A 72 5.337 10.913 -2.892 1.00 0.00 C ATOM 1075 C MET A 72 4.661 12.061 -3.559 1.00 0.00 C ATOM 1076 O MET A 72 3.894 12.799 -2.943 1.00 0.00 O ATOM 1077 CB MET A 72 4.678 9.598 -3.339 1.00 0.00 C ATOM 1078 CG MET A 72 5.547 8.386 -2.996 1.00 0.00 C ATOM 1079 SD MET A 72 5.109 6.940 -4.006 1.00 0.00 S ATOM 1080 CE MET A 72 3.339 6.746 -3.648 1.00 0.00 C ATOM 0 H MET A 72 4.566 10.493 -1.013 1.00 0.00 H new ATOM 0 HA MET A 72 6.385 10.922 -3.193 1.00 0.00 H new ATOM 0 HB2 MET A 72 3.705 9.496 -2.858 1.00 0.00 H new ATOM 0 HB3 MET A 72 4.501 9.627 -4.414 1.00 0.00 H new ATOM 0 HG2 MET A 72 6.597 8.635 -3.152 1.00 0.00 H new ATOM 0 HG3 MET A 72 5.431 8.142 -1.940 1.00 0.00 H new ATOM 0 HE1 MET A 72 3.094 5.686 -3.586 1.00 0.00 H new ATOM 0 HE2 MET A 72 3.105 7.229 -2.699 1.00 0.00 H new ATOM 0 HE3 MET A 72 2.754 7.207 -4.444 1.00 0.00 H new ATOM 1090 N LYS A 73 4.986 12.348 -4.833 1.00 0.00 N ATOM 1091 CA LYS A 73 4.420 13.403 -5.615 1.00 0.00 C ATOM 1092 C LYS A 73 3.013 13.041 -5.946 1.00 0.00 C ATOM 1093 O LYS A 73 2.683 11.858 -5.884 1.00 0.00 O ATOM 1094 CB LYS A 73 5.097 13.818 -6.932 1.00 0.00 C ATOM 1095 CG LYS A 73 5.448 12.661 -7.870 1.00 0.00 C ATOM 1096 CD LYS A 73 5.922 13.162 -9.235 1.00 0.00 C ATOM 1097 CE LYS A 73 6.900 12.236 -9.962 1.00 0.00 C ATOM 1098 NZ LYS A 73 6.217 10.965 -10.291 1.00 0.00 N ATOM 0 H LYS A 73 5.685 11.811 -5.346 1.00 0.00 H new ATOM 0 HA LYS A 73 4.552 14.269 -4.967 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.438 14.507 -7.460 1.00 0.00 H new ATOM 0 HB3 LYS A 73 6.010 14.366 -6.697 1.00 0.00 H new ATOM 0 HG2 LYS A 73 6.228 12.049 -7.417 1.00 0.00 H new ATOM 0 HG3 LYS A 73 4.575 12.021 -8.000 1.00 0.00 H new ATOM 0 HD2 LYS A 73 5.050 13.316 -9.871 1.00 0.00 H new ATOM 0 HD3 LYS A 73 6.396 14.135 -9.103 1.00 0.00 H new ATOM 0 HE2 LYS A 73 7.263 12.714 -10.872 1.00 0.00 H new ATOM 0 HE3 LYS A 73 7.770 12.043 -9.335 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.517 10.644 -11.234 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 6.466 10.244 -9.584 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 5.188 11.113 -10.287 1.00 0.00 H new ATOM 1112 N ASP A 74 2.086 13.988 -6.180 1.00 0.00 N ATOM 1113 CA ASP A 74 0.666 13.848 -6.270 1.00 0.00 C ATOM 1114 C ASP A 74 0.268 12.978 -7.412 1.00 0.00 C ATOM 1115 O ASP A 74 -0.829 12.432 -7.512 1.00 0.00 O ATOM 1116 CB ASP A 74 -0.047 15.204 -6.410 1.00 0.00 C ATOM 1117 CG ASP A 74 0.183 16.071 -5.180 1.00 0.00 C ATOM 1118 OD1 ASP A 74 1.243 16.727 -5.001 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -0.765 16.083 -4.350 1.00 0.00 O ATOM 0 H ASP A 74 2.367 14.958 -6.321 1.00 0.00 H new ATOM 0 HA ASP A 74 0.357 13.382 -5.334 1.00 0.00 H new ATOM 0 HB2 ASP A 74 0.318 15.721 -7.297 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -1.116 15.044 -6.552 1.00 0.00 H new ATOM 1124 N THR A 75 1.155 12.683 -8.380 1.00 0.00 N ATOM 1125 CA THR A 75 0.785 11.759 -9.406 1.00 0.00 C ATOM 1126 C THR A 75 0.882 10.339 -8.966 1.00 0.00 C ATOM 1127 O THR A 75 -0.009 9.498 -9.071 1.00 0.00 O ATOM 1128 CB THR A 75 1.570 11.803 -10.684 1.00 0.00 C ATOM 1129 OG1 THR A 75 2.959 11.550 -10.529 1.00 0.00 O ATOM 1130 CG2 THR A 75 1.509 13.220 -11.279 1.00 0.00 C ATOM 0 H THR A 75 2.096 13.069 -8.453 1.00 0.00 H new ATOM 0 HA THR A 75 -0.234 12.093 -9.600 1.00 0.00 H new ATOM 0 HB THR A 75 1.120 11.029 -11.306 1.00 0.00 H new ATOM 0 HG1 THR A 75 3.399 11.594 -11.403 1.00 0.00 H new ATOM 0 HG21 THR A 75 2.080 13.250 -12.207 1.00 0.00 H new ATOM 0 HG22 THR A 75 0.471 13.485 -11.482 1.00 0.00 H new ATOM 0 HG23 THR A 75 1.933 13.931 -10.570 1.00 0.00 H new ATOM 1138 N ASP A 76 1.926 9.987 -8.195 1.00 0.00 N ATOM 1139 CA ASP A 76 2.319 8.707 -7.692 1.00 0.00 C ATOM 1140 C ASP A 76 1.360 8.312 -6.622 1.00 0.00 C ATOM 1141 O ASP A 76 0.804 7.215 -6.629 1.00 0.00 O ATOM 1142 CB ASP A 76 3.748 8.788 -7.130 1.00 0.00 C ATOM 1143 CG ASP A 76 4.727 9.038 -8.269 1.00 0.00 C ATOM 1144 OD1 ASP A 76 4.460 8.582 -9.413 1.00 0.00 O ATOM 1145 OD2 ASP A 76 5.827 9.559 -7.943 1.00 0.00 O ATOM 0 H ASP A 76 2.582 10.704 -7.884 1.00 0.00 H new ATOM 0 HA ASP A 76 2.307 7.964 -8.489 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.816 9.590 -6.395 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.001 7.861 -6.615 1.00 0.00 H new ATOM 1150 N SER A 77 1.094 9.194 -5.642 1.00 0.00 N ATOM 1151 CA SER A 77 0.007 9.094 -4.718 1.00 0.00 C ATOM 1152 C SER A 77 -1.319 8.546 -5.122 1.00 0.00 C ATOM 1153 O SER A 77 -2.063 7.793 -4.495 1.00 0.00 O ATOM 1154 CB SER A 77 -0.067 10.435 -3.969 1.00 0.00 C ATOM 1155 OG SER A 77 1.020 10.407 -3.055 1.00 0.00 O ATOM 0 H SER A 77 1.669 10.022 -5.486 1.00 0.00 H new ATOM 0 HA SER A 77 0.269 8.247 -4.084 1.00 0.00 H new ATOM 0 HB2 SER A 77 0.018 11.276 -4.657 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.018 10.544 -3.448 1.00 0.00 H new ATOM 0 HG SER A 77 1.035 11.240 -2.539 1.00 0.00 H new ATOM 1161 N GLU A 78 -1.710 9.123 -6.272 1.00 0.00 N ATOM 1162 CA GLU A 78 -3.022 8.901 -6.798 1.00 0.00 C ATOM 1163 C GLU A 78 -3.027 7.662 -7.626 1.00 0.00 C ATOM 1164 O GLU A 78 -4.016 6.958 -7.826 1.00 0.00 O ATOM 1165 CB GLU A 78 -3.373 10.047 -7.761 1.00 0.00 C ATOM 1166 CG GLU A 78 -4.706 9.867 -8.490 1.00 0.00 C ATOM 1167 CD GLU A 78 -5.289 11.213 -8.897 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -4.807 11.744 -9.934 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -6.303 11.562 -8.237 1.00 0.00 O ATOM 0 H GLU A 78 -1.123 9.739 -6.835 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.722 8.830 -5.966 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.401 10.982 -7.201 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.577 10.142 -8.500 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -4.560 9.247 -9.375 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.410 9.342 -7.845 1.00 0.00 H new ATOM 1176 N GLU A 79 -1.877 7.158 -8.107 1.00 0.00 N ATOM 1177 CA GLU A 79 -1.716 5.914 -8.793 1.00 0.00 C ATOM 1178 C GLU A 79 -1.508 4.807 -7.817 1.00 0.00 C ATOM 1179 O GLU A 79 -2.087 3.745 -8.036 1.00 0.00 O ATOM 1180 CB GLU A 79 -0.543 6.114 -9.767 1.00 0.00 C ATOM 1181 CG GLU A 79 -0.272 4.920 -10.684 1.00 0.00 C ATOM 1182 CD GLU A 79 -1.205 4.745 -11.874 1.00 0.00 C ATOM 1183 OE1 GLU A 79 -2.253 5.430 -12.016 1.00 0.00 O ATOM 1184 OE2 GLU A 79 -0.816 3.852 -12.673 1.00 0.00 O ATOM 0 H GLU A 79 -0.994 7.659 -8.008 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.603 5.625 -9.356 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -0.743 6.991 -10.382 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.358 6.327 -9.192 1.00 0.00 H new ATOM 0 HG2 GLU A 79 0.747 5.005 -11.061 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -0.315 4.012 -10.082 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.724 4.976 -6.737 1.00 0.00 N ATOM 1192 CA GLU A 80 -0.649 4.182 -5.550 1.00 0.00 C ATOM 1193 C GLU A 80 -1.880 3.486 -5.080 1.00 0.00 C ATOM 1194 O GLU A 80 -1.870 2.274 -4.873 1.00 0.00 O ATOM 1195 CB GLU A 80 0.151 4.878 -4.436 1.00 0.00 C ATOM 1196 CG GLU A 80 0.175 4.047 -3.151 1.00 0.00 C ATOM 1197 CD GLU A 80 0.768 4.858 -2.007 1.00 0.00 C ATOM 1198 OE1 GLU A 80 0.029 5.710 -1.445 1.00 0.00 O ATOM 1199 OE2 GLU A 80 1.857 4.486 -1.495 1.00 0.00 O ATOM 0 H GLU A 80 -0.071 5.758 -6.695 1.00 0.00 H new ATOM 0 HA GLU A 80 -0.076 3.317 -5.885 1.00 0.00 H new ATOM 0 HB2 GLU A 80 1.172 5.052 -4.776 1.00 0.00 H new ATOM 0 HB3 GLU A 80 -0.287 5.855 -4.229 1.00 0.00 H new ATOM 0 HG2 GLU A 80 -0.836 3.731 -2.895 1.00 0.00 H new ATOM 0 HG3 GLU A 80 0.762 3.142 -3.306 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.943 4.291 -4.906 1.00 0.00 N ATOM 1207 CA ILE A 81 -4.242 3.879 -4.471 1.00 0.00 C ATOM 1208 C ILE A 81 -5.076 3.178 -5.487 1.00 0.00 C ATOM 1209 O ILE A 81 -5.923 2.321 -5.236 1.00 0.00 O ATOM 1210 CB ILE A 81 -5.011 5.045 -3.926 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -6.283 4.706 -3.131 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -5.333 6.125 -4.974 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -6.050 3.970 -1.813 1.00 0.00 C ATOM 0 H ILE A 81 -2.891 5.295 -5.081 1.00 0.00 H new ATOM 0 HA ILE A 81 -4.037 3.139 -3.697 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.298 5.449 -3.207 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -6.819 5.632 -2.922 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -6.933 4.097 -3.759 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.890 6.935 -4.503 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -4.405 6.517 -5.389 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.932 5.689 -5.773 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -7.008 3.778 -1.329 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -5.546 3.024 -2.009 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -5.430 4.583 -1.159 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.785 3.508 -6.758 1.00 0.00 N ATOM 1226 CA ARG A 82 -5.445 2.897 -7.871 1.00 0.00 C ATOM 1227 C ARG A 82 -4.855 1.542 -8.062 1.00 0.00 C ATOM 1228 O ARG A 82 -5.568 0.541 -8.112 1.00 0.00 O ATOM 1229 CB ARG A 82 -5.325 3.667 -9.197 1.00 0.00 C ATOM 1230 CG ARG A 82 -6.228 3.101 -10.294 1.00 0.00 C ATOM 1231 CD ARG A 82 -6.195 3.877 -11.612 1.00 0.00 C ATOM 1232 NE ARG A 82 -4.833 3.780 -12.210 1.00 0.00 N ATOM 1233 CZ ARG A 82 -4.423 2.642 -12.843 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -5.324 1.699 -13.247 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -3.094 2.430 -13.072 1.00 0.00 N ATOM 0 H ARG A 82 -4.086 4.204 -7.017 1.00 0.00 H new ATOM 0 HA ARG A 82 -6.508 2.876 -7.630 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -5.578 4.714 -9.028 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -4.289 3.640 -9.535 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -5.937 2.069 -10.488 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -7.254 3.079 -9.926 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.937 3.475 -12.302 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -6.454 4.921 -11.438 1.00 0.00 H new ATOM 0 HE ARG A 82 -4.198 4.576 -12.145 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -6.320 1.839 -13.077 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -5.001 0.854 -13.719 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -2.408 3.122 -12.770 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -2.787 1.580 -13.545 1.00 0.00 H new ATOM 1249 N GLU A 83 -3.520 1.407 -8.146 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.828 0.159 -8.250 1.00 0.00 C ATOM 1251 C GLU A 83 -3.060 -0.748 -7.091 1.00 0.00 C ATOM 1252 O GLU A 83 -2.953 -1.954 -7.309 1.00 0.00 O ATOM 1253 CB GLU A 83 -1.327 0.367 -8.515 1.00 0.00 C ATOM 1254 CG GLU A 83 -1.115 0.905 -9.931 1.00 0.00 C ATOM 1255 CD GLU A 83 -1.289 -0.054 -11.100 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -0.456 -0.978 -11.300 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -2.323 0.072 -11.809 1.00 0.00 O ATOM 0 H GLU A 83 -2.890 2.210 -8.141 1.00 0.00 H new ATOM 0 HA GLU A 83 -3.256 -0.349 -9.114 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.914 1.065 -7.786 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.794 -0.576 -8.392 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.804 1.737 -10.078 1.00 0.00 H new ATOM 0 HG3 GLU A 83 -0.106 1.314 -9.984 1.00 0.00 H new ATOM 1264 N ALA A 84 -3.452 -0.334 -5.873 1.00 0.00 N ATOM 1265 CA ALA A 84 -3.833 -1.116 -4.739 1.00 0.00 C ATOM 1266 C ALA A 84 -5.155 -1.758 -4.987 1.00 0.00 C ATOM 1267 O ALA A 84 -5.437 -2.858 -4.515 1.00 0.00 O ATOM 1268 CB ALA A 84 -3.773 -0.202 -3.503 1.00 0.00 C ATOM 0 H ALA A 84 -3.507 0.663 -5.663 1.00 0.00 H new ATOM 0 HA ALA A 84 -3.153 -1.948 -4.556 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -4.059 -0.769 -2.617 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -2.758 0.177 -3.380 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -4.459 0.635 -3.635 1.00 0.00 H new ATOM 1274 N PHE A 85 -6.066 -1.096 -5.722 1.00 0.00 N ATOM 1275 CA PHE A 85 -7.339 -1.622 -6.109 1.00 0.00 C ATOM 1276 C PHE A 85 -7.199 -2.564 -7.255 1.00 0.00 C ATOM 1277 O PHE A 85 -7.885 -3.585 -7.262 1.00 0.00 O ATOM 1278 CB PHE A 85 -8.337 -0.498 -6.434 1.00 0.00 C ATOM 1279 CG PHE A 85 -9.737 -0.983 -6.588 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -10.472 -1.056 -5.428 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -10.388 -1.274 -7.764 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -11.802 -1.403 -5.437 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -11.738 -1.533 -7.782 1.00 0.00 C ATOM 1284 CZ PHE A 85 -12.454 -1.674 -6.617 1.00 0.00 C ATOM 0 H PHE A 85 -5.907 -0.148 -6.063 1.00 0.00 H new ATOM 0 HA PHE A 85 -7.739 -2.179 -5.261 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -8.303 0.249 -5.641 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -8.028 -0.001 -7.354 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -9.992 -0.835 -4.486 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -9.830 -1.299 -8.688 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -12.343 -1.464 -4.504 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -12.246 -1.628 -8.730 1.00 0.00 H new ATOM 0 HZ PHE A 85 -13.488 -1.985 -6.628 1.00 0.00 H new ATOM 1294 N ARG A 86 -6.243 -2.406 -8.188 1.00 0.00 N ATOM 1295 CA ARG A 86 -6.156 -3.308 -9.294 1.00 0.00 C ATOM 1296 C ARG A 86 -5.581 -4.645 -8.972 1.00 0.00 C ATOM 1297 O ARG A 86 -5.579 -5.524 -9.832 1.00 0.00 O ATOM 1298 CB ARG A 86 -5.253 -2.623 -10.333 1.00 0.00 C ATOM 1299 CG ARG A 86 -5.378 -3.071 -11.791 1.00 0.00 C ATOM 1300 CD ARG A 86 -4.745 -2.174 -12.856 1.00 0.00 C ATOM 1301 NE ARG A 86 -3.271 -2.147 -12.642 1.00 0.00 N ATOM 1302 CZ ARG A 86 -2.338 -2.846 -13.353 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -2.674 -3.850 -14.215 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -1.011 -2.550 -13.238 1.00 0.00 N ATOM 0 H ARG A 86 -5.541 -1.666 -8.178 1.00 0.00 H new ATOM 0 HA ARG A 86 -7.169 -3.507 -9.643 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -5.450 -1.552 -10.294 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -4.218 -2.769 -10.025 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -4.935 -4.063 -11.878 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -6.438 -3.174 -12.023 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -4.975 -2.550 -13.853 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -5.155 -1.166 -12.793 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.925 -1.549 -11.892 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -3.653 -4.103 -14.347 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -1.946 -4.348 -14.727 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.708 -1.800 -12.616 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -0.322 -3.078 -13.774 1.00 0.00 H new ATOM 1318 N VAL A 87 -5.159 -4.847 -7.711 1.00 0.00 N ATOM 1319 CA VAL A 87 -4.720 -6.100 -7.180 1.00 0.00 C ATOM 1320 C VAL A 87 -5.845 -6.890 -6.606 1.00 0.00 C ATOM 1321 O VAL A 87 -5.899 -8.101 -6.814 1.00 0.00 O ATOM 1322 CB VAL A 87 -3.567 -5.803 -6.267 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -3.160 -7.067 -5.490 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -2.373 -5.280 -7.083 1.00 0.00 C ATOM 0 H VAL A 87 -5.122 -4.094 -7.024 1.00 0.00 H new ATOM 0 HA VAL A 87 -4.355 -6.776 -7.953 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.874 -5.038 -5.553 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -2.322 -6.836 -4.832 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -4.004 -7.416 -4.895 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -2.865 -7.847 -6.192 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.540 -5.067 -6.413 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -2.070 -6.034 -7.809 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.661 -4.368 -7.606 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.771 -6.192 -5.924 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.910 -6.854 -5.368 1.00 0.00 C ATOM 1336 C PHE A 88 -8.826 -7.153 -6.504 1.00 0.00 C ATOM 1337 O PHE A 88 -9.148 -8.329 -6.668 1.00 0.00 O ATOM 1338 CB PHE A 88 -8.673 -6.091 -4.272 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.776 -5.939 -3.092 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.329 -7.010 -2.355 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -7.330 -4.668 -2.813 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -6.455 -6.783 -1.319 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.496 -4.473 -1.738 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.066 -5.516 -0.952 1.00 0.00 C ATOM 0 H PHE A 88 -6.733 -5.186 -5.759 1.00 0.00 H new ATOM 0 HA PHE A 88 -7.542 -7.742 -4.854 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -8.986 -5.113 -4.639 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -9.578 -6.632 -3.993 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -7.659 -8.012 -2.586 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -7.631 -3.835 -3.430 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -6.060 -7.628 -0.775 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -6.169 -3.471 -1.504 1.00 0.00 H new ATOM 0 HZ PHE A 88 -5.448 -5.347 -0.082 1.00 0.00 H new ATOM 1354 N ASP A 89 -9.265 -6.174 -7.315 1.00 0.00 N ATOM 1355 CA ASP A 89 -10.219 -6.302 -8.372 1.00 0.00 C ATOM 1356 C ASP A 89 -9.521 -6.892 -9.549 1.00 0.00 C ATOM 1357 O ASP A 89 -8.702 -6.249 -10.203 1.00 0.00 O ATOM 1358 CB ASP A 89 -10.748 -4.879 -8.619 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.840 -5.078 -9.661 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -12.821 -5.812 -9.367 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.799 -4.339 -10.681 1.00 0.00 O ATOM 0 H ASP A 89 -8.924 -5.217 -7.223 1.00 0.00 H new ATOM 0 HA ASP A 89 -11.060 -6.959 -8.148 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -11.142 -4.434 -7.705 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.962 -4.217 -8.983 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.807 -8.157 -9.906 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.055 -8.841 -10.912 1.00 0.00 C ATOM 1368 C LYS A 90 -9.525 -8.563 -12.298 1.00 0.00 C ATOM 1369 O LYS A 90 -8.665 -8.351 -13.152 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.104 -10.367 -10.721 1.00 0.00 C ATOM 1371 CG LYS A 90 -7.954 -11.090 -11.424 1.00 0.00 C ATOM 1372 CD LYS A 90 -8.261 -12.570 -11.667 1.00 0.00 C ATOM 1373 CE LYS A 90 -8.085 -13.593 -10.543 1.00 0.00 C ATOM 1374 NZ LYS A 90 -6.706 -13.480 -10.016 1.00 0.00 N ATOM 0 H LYS A 90 -10.562 -8.708 -9.496 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.040 -8.461 -10.792 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -9.074 -10.596 -9.656 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.052 -10.746 -11.102 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -7.750 -10.602 -12.377 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -7.050 -11.003 -10.821 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -9.297 -12.633 -12.001 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -7.637 -12.896 -12.499 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -8.810 -13.412 -9.749 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -8.266 -14.601 -10.916 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -6.484 -14.318 -9.441 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.036 -13.417 -10.809 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -6.628 -12.626 -9.428 1.00 0.00 H new ATOM 1388 N ASP A 91 -10.855 -8.515 -12.496 1.00 0.00 N ATOM 1389 CA ASP A 91 -11.552 -8.352 -13.734 1.00 0.00 C ATOM 1390 C ASP A 91 -11.588 -6.955 -14.250 1.00 0.00 C ATOM 1391 O ASP A 91 -11.333 -6.724 -15.430 1.00 0.00 O ATOM 1392 CB ASP A 91 -12.932 -9.026 -13.649 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.963 -8.288 -12.806 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -13.578 -7.730 -11.744 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -15.152 -8.132 -13.193 1.00 0.00 O ATOM 0 H ASP A 91 -11.502 -8.599 -11.712 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.973 -8.867 -14.501 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -13.326 -9.139 -14.659 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.804 -10.029 -13.242 1.00 0.00 H new ATOM 1400 N GLY A 92 -11.865 -5.924 -13.432 1.00 0.00 N ATOM 1401 CA GLY A 92 -11.952 -4.546 -13.806 1.00 0.00 C ATOM 1402 C GLY A 92 -13.345 -4.038 -13.955 1.00 0.00 C ATOM 1403 O GLY A 92 -13.523 -3.122 -14.756 1.00 0.00 O ATOM 0 H GLY A 92 -12.041 -6.065 -12.437 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -11.437 -3.945 -13.057 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.423 -4.403 -14.748 1.00 0.00 H new ATOM 1407 N ASN A 93 -14.321 -4.606 -13.225 1.00 0.00 N ATOM 1408 CA ASN A 93 -15.643 -4.063 -13.187 1.00 0.00 C ATOM 1409 C ASN A 93 -15.755 -2.920 -12.237 1.00 0.00 C ATOM 1410 O ASN A 93 -16.475 -1.959 -12.502 1.00 0.00 O ATOM 1411 CB ASN A 93 -16.654 -5.218 -13.099 1.00 0.00 C ATOM 1412 CG ASN A 93 -16.733 -5.830 -11.707 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.842 -5.844 -10.859 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.860 -6.511 -11.367 1.00 0.00 N ATOM 0 H ASN A 93 -14.194 -5.445 -12.659 1.00 0.00 H new ATOM 0 HA ASN A 93 -15.910 -3.557 -14.115 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -17.640 -4.854 -13.387 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -16.378 -5.992 -13.816 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.918 -6.983 -10.465 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -18.648 -6.549 -12.014 1.00 0.00 H new ATOM 1421 N GLY A 94 -15.021 -2.955 -11.111 1.00 0.00 N ATOM 1422 CA GLY A 94 -15.018 -1.847 -10.206 1.00 0.00 C ATOM 1423 C GLY A 94 -15.396 -2.230 -8.816 1.00 0.00 C ATOM 1424 O GLY A 94 -15.585 -1.347 -7.982 1.00 0.00 O ATOM 0 H GLY A 94 -14.435 -3.741 -10.829 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -14.026 -1.396 -10.196 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -15.710 -1.087 -10.569 1.00 0.00 H new ATOM 1428 N TYR A 95 -15.433 -3.528 -8.465 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.914 -4.031 -7.216 1.00 0.00 C ATOM 1430 C TYR A 95 -15.088 -5.192 -6.779 1.00 0.00 C ATOM 1431 O TYR A 95 -14.751 -6.074 -7.568 1.00 0.00 O ATOM 1432 CB TYR A 95 -17.338 -4.609 -7.281 1.00 0.00 C ATOM 1433 CG TYR A 95 -18.396 -3.779 -7.923 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -19.061 -2.827 -7.186 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.507 -3.820 -9.292 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -20.002 -2.053 -7.823 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -19.399 -2.975 -9.911 1.00 0.00 C ATOM 1438 CZ TYR A 95 -20.185 -2.112 -9.184 1.00 0.00 C ATOM 1439 OH TYR A 95 -21.193 -1.363 -9.826 1.00 0.00 O ATOM 0 H TYR A 95 -15.109 -4.267 -9.088 1.00 0.00 H new ATOM 0 HA TYR A 95 -15.876 -3.170 -6.549 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.290 -5.560 -7.812 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.657 -4.829 -6.262 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -18.850 -2.691 -6.136 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -17.905 -4.504 -9.872 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -20.613 -1.381 -7.239 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -19.483 -2.990 -10.988 1.00 0.00 H new ATOM 0 HH TYR A 95 -21.165 -1.536 -10.790 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.634 -5.222 -5.514 1.00 0.00 N ATOM 1450 CA ILE A 96 -14.018 -6.341 -4.872 1.00 0.00 C ATOM 1451 C ILE A 96 -15.022 -7.319 -4.367 1.00 0.00 C ATOM 1452 O ILE A 96 -15.590 -7.023 -3.317 1.00 0.00 O ATOM 1453 CB ILE A 96 -13.101 -5.991 -3.737 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -12.134 -4.852 -4.103 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -12.266 -7.250 -3.451 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -11.329 -4.359 -2.902 1.00 0.00 C ATOM 0 H ILE A 96 -14.702 -4.411 -4.900 1.00 0.00 H new ATOM 0 HA ILE A 96 -13.413 -6.782 -5.664 1.00 0.00 H new ATOM 0 HB ILE A 96 -13.693 -5.662 -2.883 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -11.450 -5.196 -4.878 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -12.700 -4.020 -4.523 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -11.578 -7.051 -2.629 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.928 -8.072 -3.179 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.699 -7.521 -4.342 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -10.663 -3.556 -3.216 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -12.009 -3.988 -2.136 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.740 -5.182 -2.497 1.00 0.00 H new ATOM 1468 N SER A 97 -15.184 -8.509 -4.974 1.00 0.00 N ATOM 1469 CA SER A 97 -15.979 -9.522 -4.353 1.00 0.00 C ATOM 1470 C SER A 97 -15.242 -10.384 -3.387 1.00 0.00 C ATOM 1471 O SER A 97 -14.032 -10.403 -3.167 1.00 0.00 O ATOM 1472 CB SER A 97 -16.635 -10.372 -5.453 1.00 0.00 C ATOM 1473 OG SER A 97 -15.861 -11.297 -6.202 1.00 0.00 O ATOM 0 H SER A 97 -14.776 -8.766 -5.873 1.00 0.00 H new ATOM 0 HA SER A 97 -16.730 -9.013 -3.749 1.00 0.00 H new ATOM 0 HB2 SER A 97 -17.446 -10.932 -4.987 1.00 0.00 H new ATOM 0 HB3 SER A 97 -17.091 -9.683 -6.164 1.00 0.00 H new ATOM 0 HG SER A 97 -15.225 -10.810 -6.767 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.929 -11.307 -2.690 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.416 -12.197 -1.695 1.00 0.00 C ATOM 1481 C ALA A 98 -14.462 -13.253 -2.135 1.00 0.00 C ATOM 1482 O ALA A 98 -13.478 -13.582 -1.475 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.566 -12.866 -0.925 1.00 0.00 C ATOM 0 H ALA A 98 -16.930 -11.440 -2.837 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.821 -11.531 -1.070 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -16.156 -13.540 -0.172 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -17.171 -12.101 -0.437 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -17.188 -13.432 -1.619 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.733 -13.799 -3.335 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.979 -14.765 -4.070 1.00 0.00 C ATOM 1491 C ALA A 99 -12.711 -14.119 -4.512 1.00 0.00 C ATOM 1492 O ALA A 99 -11.614 -14.645 -4.330 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.834 -15.252 -5.252 1.00 0.00 C ATOM 0 H ALA A 99 -15.576 -13.530 -3.843 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.724 -15.635 -3.465 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.275 -15.991 -5.826 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.752 -15.704 -4.875 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -15.083 -14.407 -5.894 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.745 -13.023 -5.291 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.606 -12.227 -5.629 1.00 0.00 C ATOM 1501 C GLU A 100 -10.648 -11.891 -4.538 1.00 0.00 C ATOM 1502 O GLU A 100 -9.424 -11.988 -4.606 1.00 0.00 O ATOM 1503 CB GLU A 100 -12.024 -10.894 -6.273 1.00 0.00 C ATOM 1504 CG GLU A 100 -12.500 -11.033 -7.721 1.00 0.00 C ATOM 1505 CD GLU A 100 -13.074 -9.726 -8.247 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -14.074 -9.210 -7.680 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.600 -9.220 -9.299 1.00 0.00 O ATOM 0 H GLU A 100 -13.610 -12.675 -5.705 1.00 0.00 H new ATOM 0 HA GLU A 100 -11.078 -12.892 -6.312 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.822 -10.448 -5.679 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -11.180 -10.205 -6.242 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.667 -11.345 -8.351 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -13.257 -11.815 -7.783 1.00 0.00 H new ATOM 1514 N LEU A 101 -11.145 -11.383 -3.396 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.398 -11.016 -2.234 1.00 0.00 C ATOM 1516 C LEU A 101 -9.670 -12.182 -1.659 1.00 0.00 C ATOM 1517 O LEU A 101 -8.476 -12.135 -1.369 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.328 -10.519 -1.114 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.501 -10.054 0.097 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -9.509 -8.899 -0.121 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -11.605 -9.540 1.037 1.00 0.00 C ATOM 0 H LEU A 101 -12.144 -11.217 -3.278 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.706 -10.240 -2.560 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.943 -9.697 -1.480 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.007 -11.317 -0.815 1.00 0.00 H new ATOM 0 HG LEU A 101 -9.863 -10.873 0.429 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -8.997 -8.678 0.815 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.777 -9.186 -0.876 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -10.049 -8.014 -0.457 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.155 -9.170 1.959 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.150 -8.732 0.550 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.293 -10.353 1.270 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.315 -13.346 -1.467 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.803 -14.533 -0.855 1.00 0.00 C ATOM 1535 C ARG A 102 -8.703 -15.104 -1.682 1.00 0.00 C ATOM 1536 O ARG A 102 -7.686 -15.558 -1.158 1.00 0.00 O ATOM 1537 CB ARG A 102 -10.950 -15.535 -0.645 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.486 -16.690 0.245 1.00 0.00 C ATOM 1539 CD ARG A 102 -11.629 -17.704 0.324 1.00 0.00 C ATOM 1540 NE ARG A 102 -11.054 -18.744 1.222 1.00 0.00 N ATOM 1541 CZ ARG A 102 -11.770 -19.808 1.689 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -13.096 -19.974 1.408 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -11.184 -20.667 2.573 1.00 0.00 N ATOM 0 H ARG A 102 -11.282 -13.465 -1.768 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.381 -14.296 0.122 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.802 -15.033 -0.187 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.287 -15.920 -1.607 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -9.590 -17.155 -0.167 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.228 -16.327 1.240 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.537 -17.265 0.737 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -11.886 -18.107 -0.656 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.077 -18.657 1.502 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -13.585 -19.289 0.831 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -13.598 -20.783 1.775 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -10.223 -20.510 2.876 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -11.707 -21.466 2.930 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.874 -15.086 -3.015 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.912 -15.394 -4.028 1.00 0.00 C ATOM 1559 C HIS A 103 -6.604 -14.697 -3.875 1.00 0.00 C ATOM 1560 O HIS A 103 -5.590 -15.391 -3.910 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.649 -15.276 -5.372 1.00 0.00 C ATOM 1562 CG HIS A 103 -9.627 -16.372 -5.676 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -9.408 -17.640 -5.179 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -10.786 -16.472 -6.381 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -10.457 -18.426 -5.542 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -11.318 -17.741 -6.272 1.00 0.00 N ATOM 0 H HIS A 103 -9.774 -14.831 -3.421 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.543 -16.416 -3.943 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.180 -14.324 -5.392 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -7.908 -15.244 -6.170 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -11.230 -15.668 -6.949 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -10.570 -19.465 -5.271 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -12.193 -18.079 -6.672 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.626 -13.360 -3.729 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.429 -12.592 -3.581 1.00 0.00 C ATOM 1576 C VAL A 104 -4.801 -12.757 -2.240 1.00 0.00 C ATOM 1577 O VAL A 104 -3.584 -12.923 -2.178 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.602 -11.218 -4.157 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -6.428 -10.349 -3.195 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -4.227 -10.572 -4.401 1.00 0.00 C ATOM 0 H VAL A 104 -7.482 -12.806 -3.713 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.629 -12.996 -4.202 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.129 -11.295 -5.108 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -6.550 -9.352 -3.619 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -7.408 -10.802 -3.045 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -5.912 -10.275 -2.237 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -4.363 -9.575 -4.819 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -3.687 -10.499 -3.457 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -3.656 -11.184 -5.100 1.00 0.00 H new ATOM 1590 N MET A 105 -5.604 -12.877 -1.167 1.00 0.00 N ATOM 1591 CA MET A 105 -4.949 -13.006 0.097 1.00 0.00 C ATOM 1592 C MET A 105 -4.226 -14.296 0.284 1.00 0.00 C ATOM 1593 O MET A 105 -3.162 -14.324 0.901 1.00 0.00 O ATOM 1594 CB MET A 105 -5.934 -12.666 1.228 1.00 0.00 C ATOM 1595 CG MET A 105 -6.375 -11.202 1.265 1.00 0.00 C ATOM 1596 SD MET A 105 -7.510 -10.745 2.610 1.00 0.00 S ATOM 1597 CE MET A 105 -6.421 -10.803 4.061 1.00 0.00 C ATOM 0 H MET A 105 -6.624 -12.885 -1.164 1.00 0.00 H new ATOM 0 HA MET A 105 -4.140 -12.276 0.128 1.00 0.00 H new ATOM 0 HB2 MET A 105 -6.817 -13.296 1.125 1.00 0.00 H new ATOM 0 HB3 MET A 105 -5.472 -12.918 2.183 1.00 0.00 H new ATOM 0 HG2 MET A 105 -5.485 -10.577 1.339 1.00 0.00 H new ATOM 0 HG3 MET A 105 -6.854 -10.963 0.315 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.870 -10.236 4.876 1.00 0.00 H new ATOM 0 HE2 MET A 105 -6.284 -11.839 4.372 1.00 0.00 H new ATOM 0 HE3 MET A 105 -5.454 -10.369 3.807 1.00 0.00 H new ATOM 1607 N THR A 106 -4.743 -15.433 -0.216 1.00 0.00 N ATOM 1608 CA THR A 106 -4.048 -16.682 -0.254 1.00 0.00 C ATOM 1609 C THR A 106 -2.802 -16.690 -1.070 1.00 0.00 C ATOM 1610 O THR A 106 -1.848 -17.344 -0.650 1.00 0.00 O ATOM 1611 CB THR A 106 -4.838 -17.890 -0.660 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.232 -17.746 -0.428 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.308 -19.137 0.067 1.00 0.00 C ATOM 0 H THR A 106 -5.683 -15.484 -0.609 1.00 0.00 H new ATOM 0 HA THR A 106 -3.812 -16.766 0.807 1.00 0.00 H new ATOM 0 HB THR A 106 -4.708 -18.004 -1.736 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.564 -16.960 -0.910 1.00 0.00 H new ATOM 0 HG21 THR A 106 -4.889 -20.009 -0.235 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.261 -19.291 -0.192 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.399 -18.996 1.144 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.794 -15.985 -2.216 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.664 -15.668 -3.032 1.00 0.00 C ATOM 1623 C ASN A 107 -0.598 -14.882 -2.350 1.00 0.00 C ATOM 1624 O ASN A 107 0.580 -15.235 -2.377 1.00 0.00 O ATOM 1625 CB ASN A 107 -2.085 -15.047 -4.375 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.865 -15.994 -5.276 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -3.021 -17.187 -5.018 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.515 -15.509 -6.367 1.00 0.00 N ATOM 0 H ASN A 107 -3.657 -15.604 -2.604 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.192 -16.628 -3.243 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.693 -14.163 -4.181 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -1.193 -14.710 -4.904 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.099 -16.128 -6.929 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -3.418 -14.526 -6.623 1.00 0.00 H new ATOM 1635 N LEU A 108 -1.071 -13.886 -1.580 1.00 0.00 N ATOM 1636 CA LEU A 108 -0.248 -13.119 -0.696 1.00 0.00 C ATOM 1637 C LEU A 108 0.485 -13.915 0.328 1.00 0.00 C ATOM 1638 O LEU A 108 1.669 -13.666 0.550 1.00 0.00 O ATOM 1639 CB LEU A 108 -1.014 -11.943 -0.068 1.00 0.00 C ATOM 1640 CG LEU A 108 -1.260 -10.641 -0.848 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -2.290 -9.758 -0.123 1.00 0.00 C ATOM 1642 CD2 LEU A 108 0.079 -9.895 -0.970 1.00 0.00 C ATOM 0 H LEU A 108 -2.052 -13.606 -1.571 1.00 0.00 H new ATOM 0 HA LEU A 108 0.532 -12.709 -1.337 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.991 -12.324 0.231 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -0.485 -11.671 0.845 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.657 -10.874 -1.836 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -2.449 -8.842 -0.692 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -3.233 -10.298 -0.033 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -1.919 -9.508 0.871 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.071 -8.966 -1.521 1.00 0.00 H new ATOM 0 HD22 LEU A 108 0.462 -9.669 0.025 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.797 -10.520 -1.501 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.220 -14.878 0.949 1.00 0.00 N ATOM 1655 CA GLY A 109 0.388 -15.794 1.863 1.00 0.00 C ATOM 1656 C GLY A 109 -0.469 -15.965 3.069 1.00 0.00 C ATOM 1657 O GLY A 109 -0.151 -16.647 4.042 1.00 0.00 O ATOM 0 H GLY A 109 -1.221 -15.022 0.816 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.539 -16.758 1.376 1.00 0.00 H new ATOM 0 HA3 GLY A 109 1.372 -15.427 2.156 1.00 0.00 H new ATOM 1661 N GLU A 110 -1.704 -15.434 3.060 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.634 -15.575 4.138 1.00 0.00 C ATOM 1663 C GLU A 110 -3.359 -16.869 4.000 1.00 0.00 C ATOM 1664 O GLU A 110 -3.330 -17.558 2.981 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.641 -14.412 4.163 1.00 0.00 C ATOM 1666 CG GLU A 110 -3.109 -13.010 4.467 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.534 -12.707 5.843 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -2.265 -13.620 6.669 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -2.467 -11.505 6.213 1.00 0.00 O ATOM 0 H GLU A 110 -2.068 -14.889 2.278 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.079 -15.559 5.076 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -4.137 -14.378 3.193 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.405 -14.647 4.904 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -2.334 -12.789 3.734 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.923 -12.307 4.292 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.078 -17.292 5.055 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.906 -18.456 5.117 1.00 0.00 C ATOM 1678 C LYS A 111 -6.246 -18.133 5.684 1.00 0.00 C ATOM 1679 O LYS A 111 -6.366 -17.772 6.854 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.305 -19.660 5.861 1.00 0.00 C ATOM 1681 CG LYS A 111 -3.715 -19.302 7.227 1.00 0.00 C ATOM 1682 CD LYS A 111 -2.793 -20.416 7.726 1.00 0.00 C ATOM 1683 CE LYS A 111 -2.130 -20.058 9.058 1.00 0.00 C ATOM 1684 NZ LYS A 111 -3.215 -19.801 10.032 1.00 0.00 N ATOM 0 H LYS A 111 -4.079 -16.777 5.935 1.00 0.00 H new ATOM 0 HA LYS A 111 -4.996 -18.770 4.077 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -5.078 -20.417 5.995 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -3.526 -20.106 5.243 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -3.159 -18.368 7.155 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -4.519 -19.140 7.945 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -3.366 -21.336 7.842 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.024 -20.612 6.979 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.490 -20.872 9.400 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -1.496 -19.179 8.948 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -2.834 -19.855 10.998 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -3.611 -18.853 9.869 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -3.963 -20.514 9.914 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.310 -18.138 4.861 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.585 -17.624 5.253 1.00 0.00 C ATOM 1700 C LEU A 112 -9.504 -18.792 5.362 1.00 0.00 C ATOM 1701 O LEU A 112 -9.291 -19.836 4.747 1.00 0.00 O ATOM 1702 CB LEU A 112 -9.203 -16.609 4.277 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.505 -15.260 4.034 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -7.484 -15.242 2.883 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -9.606 -14.247 3.681 1.00 0.00 C ATOM 0 H LEU A 112 -7.285 -18.504 3.909 1.00 0.00 H new ATOM 0 HA LEU A 112 -8.443 -17.083 6.189 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.299 -17.104 3.311 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -10.213 -16.394 4.627 1.00 0.00 H new ATOM 0 HG LEU A 112 -7.945 -15.032 4.941 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -7.051 -14.246 2.797 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -6.694 -15.965 3.086 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -7.983 -15.503 1.950 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -9.157 -13.270 3.499 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -10.131 -14.578 2.785 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -10.312 -14.174 4.508 1.00 0.00 H new ATOM 1717 N THR A 113 -10.561 -18.540 6.154 1.00 0.00 N ATOM 1718 CA THR A 113 -11.706 -19.395 6.105 1.00 0.00 C ATOM 1719 C THR A 113 -12.837 -18.726 5.403 1.00 0.00 C ATOM 1720 O THR A 113 -12.747 -17.581 4.962 1.00 0.00 O ATOM 1721 CB THR A 113 -12.167 -19.799 7.474 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.354 -18.646 8.281 1.00 0.00 O ATOM 1723 CG2 THR A 113 -11.048 -20.621 8.135 1.00 0.00 C ATOM 0 H THR A 113 -10.624 -17.764 6.813 1.00 0.00 H new ATOM 0 HA THR A 113 -11.401 -20.288 5.559 1.00 0.00 H new ATOM 0 HB THR A 113 -13.096 -20.362 7.386 1.00 0.00 H new ATOM 0 HG1 THR A 113 -12.657 -18.917 9.173 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.362 -20.926 9.133 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.843 -21.506 7.533 1.00 0.00 H new ATOM 0 HG23 THR A 113 -10.145 -20.014 8.208 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.967 -19.449 5.306 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.144 -18.971 4.651 1.00 0.00 C ATOM 1733 C ASP A 114 -15.757 -17.796 5.332 1.00 0.00 C ATOM 1734 O ASP A 114 -16.072 -16.733 4.799 1.00 0.00 O ATOM 1735 CB ASP A 114 -16.203 -20.085 4.600 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.875 -21.294 3.736 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -15.002 -21.160 2.837 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -16.513 -22.370 3.887 1.00 0.00 O ATOM 0 H ASP A 114 -14.065 -20.388 5.692 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.831 -18.665 3.653 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.383 -20.432 5.618 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -17.137 -19.652 4.241 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.818 -17.911 6.671 1.00 0.00 N ATOM 1744 CA GLU A 115 -16.272 -16.902 7.577 1.00 0.00 C ATOM 1745 C GLU A 115 -15.426 -15.676 7.546 1.00 0.00 C ATOM 1746 O GLU A 115 -15.947 -14.603 7.245 1.00 0.00 O ATOM 1747 CB GLU A 115 -16.535 -17.602 8.921 1.00 0.00 C ATOM 1748 CG GLU A 115 -17.249 -16.656 9.888 1.00 0.00 C ATOM 1749 CD GLU A 115 -17.631 -17.442 11.134 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -16.749 -17.585 12.023 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -18.740 -18.030 11.242 1.00 0.00 O ATOM 0 H GLU A 115 -15.531 -18.764 7.151 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.221 -16.453 7.285 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -17.142 -18.493 8.761 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -15.592 -17.932 9.356 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.600 -15.821 10.151 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -18.138 -16.234 9.419 1.00 0.00 H new ATOM 1758 N GLU A 116 -14.084 -15.727 7.623 1.00 0.00 N ATOM 1759 CA GLU A 116 -13.266 -14.556 7.556 1.00 0.00 C ATOM 1760 C GLU A 116 -13.436 -13.570 6.452 1.00 0.00 C ATOM 1761 O GLU A 116 -13.429 -12.362 6.684 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.772 -14.915 7.625 1.00 0.00 C ATOM 1763 CG GLU A 116 -11.279 -15.558 8.923 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.771 -15.729 9.030 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.045 -14.753 8.700 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.328 -16.763 9.597 1.00 0.00 O ATOM 0 H GLU A 116 -13.559 -16.594 7.733 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.650 -14.030 8.430 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.547 -15.594 6.802 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -11.195 -14.006 7.455 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.620 -14.952 9.762 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -11.748 -16.537 9.025 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.592 -14.016 5.193 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.792 -13.182 4.048 1.00 0.00 C ATOM 1775 C VAL A 117 -15.143 -12.574 3.886 1.00 0.00 C ATOM 1776 O VAL A 117 -15.282 -11.402 3.538 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.321 -13.885 2.810 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.289 -15.026 2.454 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -13.128 -12.806 1.731 1.00 0.00 C ATOM 0 H VAL A 117 -13.578 -15.009 4.962 1.00 0.00 H new ATOM 0 HA VAL A 117 -13.174 -12.303 4.231 1.00 0.00 H new ATOM 0 HB VAL A 117 -12.362 -14.387 2.936 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -13.940 -15.532 1.554 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -14.330 -15.739 3.278 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -15.284 -14.617 2.278 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.784 -13.272 0.808 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -14.076 -12.299 1.550 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.387 -12.082 2.069 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.240 -13.251 4.269 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.559 -12.704 4.331 1.00 0.00 C ATOM 1791 C ASP A 118 -17.652 -11.706 5.433 1.00 0.00 C ATOM 1792 O ASP A 118 -18.241 -10.652 5.195 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.441 -13.912 4.691 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.947 -13.717 4.591 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.367 -12.801 3.834 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.718 -14.480 5.232 1.00 0.00 O ATOM 0 H ASP A 118 -16.204 -14.231 4.550 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.845 -12.208 3.404 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.162 -14.742 4.041 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -18.205 -14.213 5.712 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.978 -11.828 6.591 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.723 -10.818 7.570 1.00 0.00 C ATOM 1803 C GLU A 119 -15.992 -9.601 7.116 1.00 0.00 C ATOM 1804 O GLU A 119 -16.377 -8.490 7.479 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.918 -11.385 8.751 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.985 -10.557 10.036 1.00 0.00 C ATOM 1807 CD GLU A 119 -14.631 -10.687 10.719 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -13.836 -9.755 10.426 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -14.468 -11.438 11.718 1.00 0.00 O ATOM 0 H GLU A 119 -16.573 -12.723 6.866 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.732 -10.505 7.837 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -16.277 -12.391 8.966 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.875 -11.476 8.449 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -16.205 -9.513 9.811 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -16.782 -10.918 10.687 1.00 0.00 H new ATOM 1816 N MET A 120 -14.982 -9.777 6.246 1.00 0.00 N ATOM 1817 CA MET A 120 -14.033 -8.826 5.755 1.00 0.00 C ATOM 1818 C MET A 120 -14.569 -7.875 4.742 1.00 0.00 C ATOM 1819 O MET A 120 -14.357 -6.669 4.866 1.00 0.00 O ATOM 1820 CB MET A 120 -12.700 -9.426 5.277 1.00 0.00 C ATOM 1821 CG MET A 120 -11.437 -8.607 5.001 1.00 0.00 C ATOM 1822 SD MET A 120 -9.947 -9.571 4.606 1.00 0.00 S ATOM 1823 CE MET A 120 -8.956 -8.050 4.585 1.00 0.00 C ATOM 0 H MET A 120 -14.814 -10.698 5.840 1.00 0.00 H new ATOM 0 HA MET A 120 -13.816 -8.248 6.653 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.420 -10.174 6.019 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.922 -9.961 4.354 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.639 -7.928 4.172 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.228 -7.990 5.875 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.020 -8.218 5.117 1.00 0.00 H new ATOM 0 HE2 MET A 120 -8.742 -7.769 3.554 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.510 -7.248 5.072 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.440 -8.486 3.919 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.265 -7.820 2.960 1.00 0.00 C ATOM 1835 C ILE A 121 -17.372 -7.139 3.688 1.00 0.00 C ATOM 1836 O ILE A 121 -17.735 -6.013 3.352 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.785 -8.723 1.881 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -15.673 -9.297 0.986 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -17.784 -7.996 0.965 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -14.894 -8.319 0.108 1.00 0.00 C ATOM 0 H ILE A 121 -15.575 -9.497 3.923 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.651 -7.089 2.433 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.273 -9.539 2.414 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -14.959 -9.814 1.627 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.120 -10.049 0.336 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.139 -8.682 0.196 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.630 -7.644 1.556 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.292 -7.145 0.493 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.145 -8.863 -0.467 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -15.580 -7.817 -0.574 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.401 -7.578 0.737 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.982 -7.704 4.745 1.00 0.00 N ATOM 1853 CA ARG A 122 -19.045 -7.064 5.455 1.00 0.00 C ATOM 1854 C ARG A 122 -18.649 -5.788 6.114 1.00 0.00 C ATOM 1855 O ARG A 122 -19.389 -4.810 6.021 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.512 -7.925 6.641 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.791 -7.538 7.387 1.00 0.00 C ATOM 1858 CD ARG A 122 -20.842 -8.207 8.762 1.00 0.00 C ATOM 1859 NE ARG A 122 -22.138 -7.814 9.381 1.00 0.00 N ATOM 1860 CZ ARG A 122 -23.339 -8.407 9.115 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -23.379 -9.529 8.339 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -24.507 -7.867 9.571 1.00 0.00 N ATOM 0 H ARG A 122 -17.732 -8.622 5.113 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.801 -6.902 4.687 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.641 -8.944 6.276 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.701 -7.947 7.369 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -20.836 -6.455 7.503 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -21.662 -7.833 6.802 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -20.771 -9.291 8.668 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -20.004 -7.885 9.380 1.00 0.00 H new ATOM 0 HE ARG A 122 -22.128 -7.046 10.052 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -22.515 -9.919 7.962 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -24.273 -9.977 8.136 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -24.491 -7.007 10.120 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -25.395 -8.323 9.363 1.00 0.00 H new ATOM 1876 N GLU A 123 -17.452 -5.854 6.725 1.00 0.00 N ATOM 1877 CA GLU A 123 -16.715 -4.756 7.268 1.00 0.00 C ATOM 1878 C GLU A 123 -16.539 -3.610 6.333 1.00 0.00 C ATOM 1879 O GLU A 123 -16.766 -2.470 6.736 1.00 0.00 O ATOM 1880 CB GLU A 123 -15.357 -5.161 7.866 1.00 0.00 C ATOM 1881 CG GLU A 123 -14.601 -4.058 8.610 1.00 0.00 C ATOM 1882 CD GLU A 123 -13.288 -4.490 9.246 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -13.278 -5.503 9.995 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -12.272 -3.771 9.047 1.00 0.00 O ATOM 0 H GLU A 123 -16.965 -6.742 6.848 1.00 0.00 H new ATOM 0 HA GLU A 123 -17.353 -4.412 8.082 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -15.517 -5.992 8.553 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -14.722 -5.531 7.061 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -14.399 -3.244 7.913 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -15.249 -3.657 9.389 1.00 0.00 H new ATOM 1891 N ALA A 124 -16.045 -3.893 5.114 1.00 0.00 N ATOM 1892 CA ALA A 124 -15.755 -2.935 4.093 1.00 0.00 C ATOM 1893 C ALA A 124 -16.951 -2.317 3.454 1.00 0.00 C ATOM 1894 O ALA A 124 -16.900 -1.132 3.128 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.929 -3.581 2.968 1.00 0.00 C ATOM 0 H ALA A 124 -15.836 -4.849 4.825 1.00 0.00 H new ATOM 0 HA ALA A 124 -15.209 -2.148 4.613 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.717 -2.838 2.199 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.991 -3.959 3.376 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.492 -4.405 2.530 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.964 -3.118 3.078 1.00 0.00 N ATOM 1902 CA ASP A 125 -19.086 -2.589 2.367 1.00 0.00 C ATOM 1903 C ASP A 125 -19.957 -1.668 3.150 1.00 0.00 C ATOM 1904 O ASP A 125 -20.369 -1.888 4.287 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.887 -3.708 1.681 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.370 -3.356 0.281 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -19.505 -3.320 -0.634 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -21.579 -3.087 0.051 1.00 0.00 O ATOM 0 H ASP A 125 -18.007 -4.120 3.263 1.00 0.00 H new ATOM 0 HA ASP A 125 -18.657 -1.948 1.596 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -19.267 -4.603 1.626 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -20.749 -3.955 2.300 1.00 0.00 H new ATOM 1913 N ILE A 126 -20.331 -0.537 2.525 1.00 0.00 N ATOM 1914 CA ILE A 126 -20.973 0.621 3.067 1.00 0.00 C ATOM 1915 C ILE A 126 -22.414 0.623 2.688 1.00 0.00 C ATOM 1916 O ILE A 126 -23.305 0.775 3.522 1.00 0.00 O ATOM 1917 CB ILE A 126 -20.293 1.875 2.601 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -18.876 1.946 3.194 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -21.042 3.173 2.948 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -17.913 2.994 2.638 1.00 0.00 C ATOM 0 H ILE A 126 -20.163 -0.425 1.525 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.898 0.589 4.154 1.00 0.00 H new ATOM 0 HB ILE A 126 -20.271 1.811 1.513 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -18.972 2.117 4.266 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -18.413 0.968 3.068 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.480 4.029 2.574 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -22.029 3.158 2.487 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -21.148 3.254 4.030 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -16.956 2.920 3.155 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -17.763 2.822 1.572 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -18.331 3.989 2.789 1.00 0.00 H new ATOM 1932 N ASP A 127 -22.752 0.378 1.410 1.00 0.00 N ATOM 1933 CA ASP A 127 -24.104 0.197 0.981 1.00 0.00 C ATOM 1934 C ASP A 127 -24.720 -1.051 1.513 1.00 0.00 C ATOM 1935 O ASP A 127 -25.699 -0.943 2.250 1.00 0.00 O ATOM 1936 CB ASP A 127 -24.229 0.493 -0.523 1.00 0.00 C ATOM 1937 CG ASP A 127 -23.305 -0.335 -1.406 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -23.562 -1.545 -1.646 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -22.333 0.254 -1.949 1.00 0.00 O ATOM 0 H ASP A 127 -22.069 0.304 0.656 1.00 0.00 H new ATOM 0 HA ASP A 127 -24.752 0.942 1.442 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -25.260 0.317 -0.831 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -24.022 1.550 -0.691 1.00 0.00 H new ATOM 1944 N GLY A 128 -24.099 -2.220 1.275 1.00 0.00 N ATOM 1945 CA GLY A 128 -24.628 -3.459 1.753 1.00 0.00 C ATOM 1946 C GLY A 128 -24.750 -4.573 0.771 1.00 0.00 C ATOM 1947 O GLY A 128 -25.390 -5.552 1.153 1.00 0.00 O ATOM 0 H GLY A 128 -23.229 -2.307 0.750 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -23.998 -3.801 2.574 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -25.617 -3.266 2.169 1.00 0.00 H new ATOM 1951 N ASP A 129 -24.141 -4.518 -0.427 1.00 0.00 N ATOM 1952 CA ASP A 129 -24.314 -5.504 -1.448 1.00 0.00 C ATOM 1953 C ASP A 129 -23.321 -6.610 -1.353 1.00 0.00 C ATOM 1954 O ASP A 129 -23.545 -7.743 -1.778 1.00 0.00 O ATOM 1955 CB ASP A 129 -24.356 -4.978 -2.893 1.00 0.00 C ATOM 1956 CG ASP A 129 -23.136 -4.181 -3.331 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -22.155 -4.013 -2.558 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -23.275 -3.588 -4.434 1.00 0.00 O ATOM 0 H ASP A 129 -23.508 -3.764 -0.694 1.00 0.00 H new ATOM 0 HA ASP A 129 -25.313 -5.884 -1.236 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -24.477 -5.826 -3.567 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -25.240 -4.351 -3.008 1.00 0.00 H new ATOM 1963 N GLY A 130 -22.158 -6.321 -0.744 1.00 0.00 N ATOM 1964 CA GLY A 130 -21.103 -7.280 -0.630 1.00 0.00 C ATOM 1965 C GLY A 130 -20.073 -7.229 -1.706 1.00 0.00 C ATOM 1966 O GLY A 130 -19.263 -8.145 -1.840 1.00 0.00 O ATOM 0 H GLY A 130 -21.947 -5.415 -0.327 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.608 -7.138 0.330 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.542 -8.278 -0.618 1.00 0.00 H new ATOM 1970 N GLN A 131 -20.054 -6.139 -2.494 1.00 0.00 N ATOM 1971 CA GLN A 131 -19.230 -5.816 -3.618 1.00 0.00 C ATOM 1972 C GLN A 131 -18.619 -4.488 -3.327 1.00 0.00 C ATOM 1973 O GLN A 131 -19.183 -3.400 -3.432 1.00 0.00 O ATOM 1974 CB GLN A 131 -19.989 -5.769 -4.954 1.00 0.00 C ATOM 1975 CG GLN A 131 -20.750 -7.063 -5.253 1.00 0.00 C ATOM 1976 CD GLN A 131 -19.848 -8.215 -5.674 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -18.749 -8.054 -6.202 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -20.368 -9.458 -5.490 1.00 0.00 N ATOM 0 H GLN A 131 -20.712 -5.381 -2.312 1.00 0.00 H new ATOM 0 HA GLN A 131 -18.485 -6.602 -3.744 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -20.692 -4.936 -4.938 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -19.282 -5.574 -5.761 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -21.312 -7.357 -4.367 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -21.477 -6.873 -6.043 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -21.281 -9.569 -5.050 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -19.845 -10.280 -5.792 1.00 0.00 H new ATOM 1987 N VAL A 132 -17.354 -4.502 -2.872 1.00 0.00 N ATOM 1988 CA VAL A 132 -16.652 -3.335 -2.437 1.00 0.00 C ATOM 1989 C VAL A 132 -16.232 -2.457 -3.565 1.00 0.00 C ATOM 1990 O VAL A 132 -15.380 -2.884 -4.343 1.00 0.00 O ATOM 1991 CB VAL A 132 -15.446 -3.618 -1.590 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -14.899 -2.314 -0.986 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -15.774 -4.568 -0.426 1.00 0.00 C ATOM 0 H VAL A 132 -16.800 -5.356 -2.805 1.00 0.00 H new ATOM 0 HA VAL A 132 -17.389 -2.820 -1.821 1.00 0.00 H new ATOM 0 HB VAL A 132 -14.709 -4.085 -2.243 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -14.024 -2.535 -0.374 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -14.618 -1.632 -1.788 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -15.667 -1.850 -0.367 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -14.874 -4.747 0.162 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -16.538 -4.117 0.207 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -16.143 -5.514 -0.822 1.00 0.00 H new ATOM 2003 N ASN A 133 -16.812 -1.281 -3.864 1.00 0.00 N ATOM 2004 CA ASN A 133 -16.407 -0.517 -5.003 1.00 0.00 C ATOM 2005 C ASN A 133 -15.131 0.173 -4.664 1.00 0.00 C ATOM 2006 O ASN A 133 -14.418 -0.058 -3.689 1.00 0.00 O ATOM 2007 CB ASN A 133 -17.541 0.346 -5.581 1.00 0.00 C ATOM 2008 CG ASN A 133 -18.004 1.464 -4.659 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -17.243 2.037 -3.880 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -19.292 1.879 -4.799 1.00 0.00 N ATOM 0 H ASN A 133 -17.562 -0.859 -3.317 1.00 0.00 H new ATOM 0 HA ASN A 133 -16.191 -1.161 -5.855 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -17.207 0.781 -6.523 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -18.391 -0.297 -5.810 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -19.634 2.671 -4.256 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -19.915 1.398 -5.447 1.00 0.00 H new ATOM 2017 N TYR A 134 -14.832 1.159 -5.528 1.00 0.00 N ATOM 2018 CA TYR A 134 -13.651 1.957 -5.411 1.00 0.00 C ATOM 2019 C TYR A 134 -13.673 2.899 -4.256 1.00 0.00 C ATOM 2020 O TYR A 134 -12.750 2.946 -3.445 1.00 0.00 O ATOM 2021 CB TYR A 134 -13.389 2.714 -6.724 1.00 0.00 C ATOM 2022 CG TYR A 134 -12.020 3.301 -6.710 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -10.879 2.538 -6.797 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -11.794 4.646 -6.541 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -9.594 3.026 -6.806 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -10.551 5.232 -6.560 1.00 0.00 C ATOM 2027 CZ TYR A 134 -9.477 4.395 -6.753 1.00 0.00 C ATOM 2028 OH TYR A 134 -8.174 4.920 -6.621 1.00 0.00 O ATOM 0 H TYR A 134 -15.421 1.407 -6.323 1.00 0.00 H new ATOM 0 HA TYR A 134 -12.832 1.265 -5.215 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -13.494 2.036 -7.571 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -14.130 3.503 -6.853 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -11.003 1.467 -6.864 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -12.650 5.285 -6.383 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -8.732 2.376 -6.852 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -10.424 6.297 -6.430 1.00 0.00 H new ATOM 0 HH TYR A 134 -8.217 5.899 -6.595 1.00 0.00 H new ATOM 2038 N GLU A 135 -14.746 3.681 -4.039 1.00 0.00 N ATOM 2039 CA GLU A 135 -15.105 4.492 -2.918 1.00 0.00 C ATOM 2040 C GLU A 135 -14.897 3.755 -1.640 1.00 0.00 C ATOM 2041 O GLU A 135 -14.214 4.267 -0.754 1.00 0.00 O ATOM 2042 CB GLU A 135 -16.546 5.024 -3.005 1.00 0.00 C ATOM 2043 CG GLU A 135 -16.763 6.111 -1.950 1.00 0.00 C ATOM 2044 CD GLU A 135 -18.100 6.791 -2.205 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -18.166 7.745 -3.024 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -19.042 6.471 -1.431 1.00 0.00 O ATOM 0 H GLU A 135 -15.463 3.749 -4.761 1.00 0.00 H new ATOM 0 HA GLU A 135 -14.444 5.359 -2.939 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -16.735 5.427 -4.000 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -17.254 4.209 -2.852 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -16.747 5.674 -0.951 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -15.955 6.842 -1.991 1.00 0.00 H new ATOM 2053 N GLU A 136 -15.578 2.603 -1.503 1.00 0.00 N ATOM 2054 CA GLU A 136 -15.473 1.766 -0.349 1.00 0.00 C ATOM 2055 C GLU A 136 -14.162 1.198 0.073 1.00 0.00 C ATOM 2056 O GLU A 136 -13.895 1.103 1.270 1.00 0.00 O ATOM 2057 CB GLU A 136 -16.523 0.653 -0.511 1.00 0.00 C ATOM 2058 CG GLU A 136 -17.991 1.082 -0.546 1.00 0.00 C ATOM 2059 CD GLU A 136 -19.069 0.112 -1.008 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -18.883 -0.513 -2.086 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -20.015 -0.163 -0.222 1.00 0.00 O ATOM 0 H GLU A 136 -16.217 2.245 -2.212 1.00 0.00 H new ATOM 0 HA GLU A 136 -15.637 2.452 0.482 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -16.306 0.114 -1.433 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -16.396 -0.054 0.309 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -18.257 1.402 0.462 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -18.054 1.962 -1.187 1.00 0.00 H new ATOM 2068 N PHE A 137 -13.312 0.921 -0.932 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.942 0.622 -0.649 1.00 0.00 C ATOM 2070 C PHE A 137 -11.154 1.748 -0.073 1.00 0.00 C ATOM 2071 O PHE A 137 -10.461 1.617 0.935 1.00 0.00 O ATOM 2072 CB PHE A 137 -11.330 -0.060 -1.885 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.897 -0.381 -1.633 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.503 -1.351 -0.741 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -8.953 0.361 -2.303 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -8.168 -1.542 -0.474 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -7.618 0.176 -2.034 1.00 0.00 C ATOM 2078 CZ PHE A 137 -7.227 -0.807 -1.156 1.00 0.00 C ATOM 0 H PHE A 137 -13.565 0.904 -1.920 1.00 0.00 H new ATOM 0 HA PHE A 137 -11.900 -0.083 0.182 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.880 -0.972 -2.117 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -11.418 0.594 -2.752 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -10.244 -1.964 -0.249 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -9.260 1.088 -3.040 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -7.860 -2.265 0.267 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -6.878 0.801 -2.511 1.00 0.00 H new ATOM 0 HZ PHE A 137 -6.176 -1.003 -1.001 1.00 0.00 H new ATOM 2088 N VAL A 138 -11.203 2.892 -0.777 1.00 0.00 N ATOM 2089 CA VAL A 138 -10.437 4.045 -0.417 1.00 0.00 C ATOM 2090 C VAL A 138 -10.828 4.679 0.874 1.00 0.00 C ATOM 2091 O VAL A 138 -10.036 5.337 1.545 1.00 0.00 O ATOM 2092 CB VAL A 138 -10.547 5.033 -1.540 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -9.660 6.271 -1.323 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -10.129 4.354 -2.856 1.00 0.00 C ATOM 0 H VAL A 138 -11.782 3.019 -1.607 1.00 0.00 H new ATOM 0 HA VAL A 138 -9.410 3.717 -0.259 1.00 0.00 H new ATOM 0 HB VAL A 138 -11.584 5.365 -1.579 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -9.777 6.954 -2.164 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -9.957 6.774 -0.403 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -8.617 5.963 -1.248 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -10.208 5.069 -3.675 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -9.099 4.007 -2.775 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -10.784 3.505 -3.051 1.00 0.00 H new ATOM 2104 N GLN A 139 -11.990 4.302 1.438 1.00 0.00 N ATOM 2105 CA GLN A 139 -12.399 4.832 2.701 1.00 0.00 C ATOM 2106 C GLN A 139 -11.784 4.181 3.892 1.00 0.00 C ATOM 2107 O GLN A 139 -11.972 4.671 5.004 1.00 0.00 O ATOM 2108 CB GLN A 139 -13.904 4.978 2.981 1.00 0.00 C ATOM 2109 CG GLN A 139 -14.289 6.280 3.686 1.00 0.00 C ATOM 2110 CD GLN A 139 -15.788 6.483 3.853 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -16.303 6.745 4.939 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -16.451 6.536 2.667 1.00 0.00 N ATOM 0 H GLN A 139 -12.641 3.636 1.023 1.00 0.00 H new ATOM 0 HA GLN A 139 -12.004 5.838 2.563 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -14.445 4.916 2.037 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -14.231 4.137 3.592 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -13.820 6.299 4.670 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -13.881 7.119 3.122 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -15.965 6.306 1.800 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -17.434 6.806 2.644 1.00 0.00 H new ATOM 2121 N MET A 140 -11.100 3.059 3.606 1.00 0.00 N ATOM 2122 CA MET A 140 -10.350 2.274 4.537 1.00 0.00 C ATOM 2123 C MET A 140 -8.891 2.570 4.477 1.00 0.00 C ATOM 2124 O MET A 140 -8.153 2.457 5.454 1.00 0.00 O ATOM 2125 CB MET A 140 -10.403 0.771 4.215 1.00 0.00 C ATOM 2126 CG MET A 140 -11.877 0.367 4.147 1.00 0.00 C ATOM 2127 SD MET A 140 -12.012 -1.433 4.359 1.00 0.00 S ATOM 2128 CE MET A 140 -11.854 -1.692 2.569 1.00 0.00 C ATOM 0 H MET A 140 -11.069 2.675 2.661 1.00 0.00 H new ATOM 0 HA MET A 140 -10.799 2.519 5.499 1.00 0.00 H new ATOM 0 HB2 MET A 140 -9.905 0.564 3.268 1.00 0.00 H new ATOM 0 HB3 MET A 140 -9.883 0.196 4.981 1.00 0.00 H new ATOM 0 HG2 MET A 140 -12.444 0.880 4.924 1.00 0.00 H new ATOM 0 HG3 MET A 140 -12.305 0.666 3.190 1.00 0.00 H new ATOM 0 HE1 MET A 140 -11.900 -2.759 2.350 1.00 0.00 H new ATOM 0 HE2 MET A 140 -12.667 -1.180 2.054 1.00 0.00 H new ATOM 0 HE3 MET A 140 -10.899 -1.293 2.226 1.00 0.00 H new ATOM 2138 N MET A 141 -8.385 2.894 3.274 1.00 0.00 N ATOM 2139 CA MET A 141 -7.012 3.246 3.084 1.00 0.00 C ATOM 2140 C MET A 141 -6.819 4.657 3.522 1.00 0.00 C ATOM 2141 O MET A 141 -5.912 4.882 4.322 1.00 0.00 O ATOM 2142 CB MET A 141 -6.835 2.884 1.600 1.00 0.00 C ATOM 2143 CG MET A 141 -7.042 1.398 1.301 1.00 0.00 C ATOM 2144 SD MET A 141 -5.969 0.362 2.342 1.00 0.00 S ATOM 2145 CE MET A 141 -7.319 -0.644 3.024 1.00 0.00 C ATOM 0 H MET A 141 -8.939 2.912 2.418 1.00 0.00 H new ATOM 0 HA MET A 141 -6.239 2.743 3.665 1.00 0.00 H new ATOM 0 HB2 MET A 141 -7.540 3.467 1.006 1.00 0.00 H new ATOM 0 HB3 MET A 141 -5.834 3.174 1.281 1.00 0.00 H new ATOM 0 HG2 MET A 141 -8.085 1.132 1.471 1.00 0.00 H new ATOM 0 HG3 MET A 141 -6.831 1.203 0.250 1.00 0.00 H new ATOM 0 HE1 MET A 141 -6.989 -1.678 3.121 1.00 0.00 H new ATOM 0 HE2 MET A 141 -7.600 -0.259 4.004 1.00 0.00 H new ATOM 0 HE3 MET A 141 -8.179 -0.599 2.356 1.00 0.00 H new ATOM 2155 N THR A 142 -7.551 5.705 3.106 1.00 0.00 N ATOM 2156 CA THR A 142 -7.275 7.054 3.495 1.00 0.00 C ATOM 2157 C THR A 142 -7.774 7.321 4.907 1.00 0.00 C ATOM 2158 O THR A 142 -8.963 6.979 5.144 1.00 0.00 O ATOM 2159 CB THR A 142 -7.814 7.992 2.456 1.00 0.00 C ATOM 2160 OG1 THR A 142 -7.040 8.070 1.268 1.00 0.00 O ATOM 2161 CG2 THR A 142 -7.842 9.382 3.114 1.00 0.00 C ATOM 0 H THR A 142 -8.354 5.613 2.484 1.00 0.00 H new ATOM 0 HA THR A 142 -6.200 7.227 3.539 1.00 0.00 H new ATOM 0 HB THR A 142 -8.791 7.624 2.143 1.00 0.00 H new ATOM 0 HG1 THR A 142 -7.460 8.699 0.645 1.00 0.00 H new ATOM 0 HG21 THR A 142 -8.227 10.113 2.403 1.00 0.00 H new ATOM 0 HG22 THR A 142 -8.486 9.356 3.993 1.00 0.00 H new ATOM 0 HG23 THR A 142 -6.832 9.664 3.413 1.00 0.00 H new TER 2169 THR A 142 ATOM 2170 N ARG B 1 -10.537 -2.108 10.674 1.00 0.00 N ATOM 2171 CA ARG B 1 -9.618 -1.351 9.794 1.00 0.00 C ATOM 2172 C ARG B 1 -8.318 -2.018 9.503 1.00 0.00 C ATOM 2173 O ARG B 1 -7.873 -1.960 8.358 1.00 0.00 O ATOM 2174 CB ARG B 1 -9.409 0.124 10.175 1.00 0.00 C ATOM 2175 CG ARG B 1 -8.934 1.010 9.022 1.00 0.00 C ATOM 2176 CD ARG B 1 -8.776 2.459 9.484 1.00 0.00 C ATOM 2177 NE ARG B 1 -8.170 3.167 8.321 1.00 0.00 N ATOM 2178 CZ ARG B 1 -7.888 4.498 8.216 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -8.319 5.361 9.181 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -7.438 4.995 7.026 1.00 0.00 N ATOM 0 H1 ARG B 1 -11.124 -1.443 11.217 1.00 0.00 H new ATOM 0 H2 ARG B 1 -11.150 -2.717 10.095 1.00 0.00 H new ATOM 0 H3 ARG B 1 -9.984 -2.697 11.329 1.00 0.00 H new ATOM 0 HA ARG B 1 -10.178 -1.351 8.859 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -10.346 0.523 10.563 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -8.680 0.179 10.984 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -7.983 0.639 8.640 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -9.649 0.961 8.201 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -9.738 2.895 9.755 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -8.137 2.526 10.364 1.00 0.00 H new ATOM 0 HE ARG B 1 -7.940 2.591 7.511 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -8.850 5.011 9.978 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -8.110 6.356 9.105 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -7.316 4.373 6.227 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -7.224 5.988 6.936 1.00 0.00 H new ATOM 2193 N ARG B 2 -7.624 -2.645 10.471 1.00 0.00 N ATOM 2194 CA ARG B 2 -6.330 -3.238 10.343 1.00 0.00 C ATOM 2195 C ARG B 2 -6.196 -4.338 9.346 1.00 0.00 C ATOM 2196 O ARG B 2 -5.248 -4.385 8.564 1.00 0.00 O ATOM 2197 CB ARG B 2 -6.134 -3.957 11.688 1.00 0.00 C ATOM 2198 CG ARG B 2 -4.686 -4.356 11.978 1.00 0.00 C ATOM 2199 CD ARG B 2 -4.474 -4.969 13.364 1.00 0.00 C ATOM 2200 NE ARG B 2 -4.971 -3.957 14.338 1.00 0.00 N ATOM 2201 CZ ARG B 2 -4.215 -3.553 15.401 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -3.147 -4.205 15.946 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -4.363 -2.249 15.775 1.00 0.00 N ATOM 0 H ARG B 2 -7.999 -2.743 11.415 1.00 0.00 H new ATOM 0 HA ARG B 2 -5.641 -2.447 10.047 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -6.488 -3.309 12.489 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -6.756 -4.852 11.703 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -4.359 -5.070 11.222 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -4.051 -3.475 11.881 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -5.019 -5.908 13.464 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -3.421 -5.192 13.536 1.00 0.00 H new ATOM 0 HE ARG B 2 -5.900 -3.556 14.207 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -2.839 -5.095 15.554 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -2.657 -3.802 16.745 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -5.008 -1.643 15.268 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -3.828 -1.880 16.562 1.00 0.00 H new ATOM 2217 N LYS B 3 -7.068 -5.355 9.224 1.00 0.00 N ATOM 2218 CA LYS B 3 -6.873 -6.488 8.374 1.00 0.00 C ATOM 2219 C LYS B 3 -6.929 -6.082 6.941 1.00 0.00 C ATOM 2220 O LYS B 3 -6.291 -6.727 6.111 1.00 0.00 O ATOM 2221 CB LYS B 3 -7.834 -7.613 8.794 1.00 0.00 C ATOM 2222 CG LYS B 3 -7.561 -8.991 8.188 1.00 0.00 C ATOM 2223 CD LYS B 3 -8.608 -9.993 8.679 1.00 0.00 C ATOM 2224 CE LYS B 3 -8.172 -11.459 8.636 1.00 0.00 C ATOM 2225 NZ LYS B 3 -9.277 -12.188 9.298 1.00 0.00 N ATOM 0 H LYS B 3 -7.947 -5.389 9.740 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.873 -6.905 8.492 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -7.803 -7.703 9.880 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -8.848 -7.316 8.527 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -7.585 -8.931 7.100 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -6.563 -9.329 8.466 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -8.878 -9.740 9.704 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -9.508 -9.880 8.075 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -8.027 -11.801 7.611 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -7.227 -11.609 9.159 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -9.349 -13.146 8.899 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -9.089 -12.251 10.319 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -10.171 -11.680 9.142 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.661 -5.034 6.522 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.533 -4.466 5.216 1.00 0.00 C ATOM 2241 C TRP B 4 -6.272 -3.718 4.948 1.00 0.00 C ATOM 2242 O TRP B 4 -5.652 -3.766 3.887 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.719 -3.571 4.820 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.941 -4.430 4.596 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.990 -4.725 5.418 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -10.323 -4.907 3.292 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -12.013 -5.301 4.713 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.621 -5.420 3.400 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -9.742 -4.798 2.058 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -12.347 -5.843 2.321 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -10.440 -5.257 0.966 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -11.746 -5.667 1.097 1.00 0.00 C ATOM 0 H TRP B 4 -8.358 -4.571 7.105 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.514 -5.362 4.595 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.914 -2.839 5.603 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.482 -3.013 3.914 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -11.010 -4.531 6.480 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.912 -5.592 5.096 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -8.760 -4.363 1.945 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -13.327 -6.286 2.423 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -9.960 -5.296 -0.001 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -12.322 -5.858 0.204 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.852 -2.939 5.960 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.783 -1.989 5.992 1.00 0.00 C ATOM 2265 C GLN B 5 -3.436 -2.626 5.983 1.00 0.00 C ATOM 2266 O GLN B 5 -2.581 -2.249 5.184 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.918 -1.081 7.226 1.00 0.00 C ATOM 2268 CG GLN B 5 -4.085 0.199 7.320 1.00 0.00 C ATOM 2269 CD GLN B 5 -4.238 0.837 8.693 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -5.364 1.086 9.121 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -3.154 1.127 9.462 1.00 0.00 N ATOM 0 H GLN B 5 -6.322 -2.983 6.864 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.864 -1.398 5.080 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -5.966 -0.794 7.306 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -4.686 -1.686 8.102 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -3.036 -0.029 7.134 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -4.400 0.902 6.549 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -2.215 0.925 9.117 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -3.280 1.547 10.383 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.202 -3.668 6.801 1.00 0.00 N ATOM 2281 CA LYS B 6 -2.075 -4.548 6.801 1.00 0.00 C ATOM 2282 C LYS B 6 -1.904 -5.113 5.433 1.00 0.00 C ATOM 2283 O LYS B 6 -0.828 -5.088 4.838 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.261 -5.789 7.690 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.099 -6.780 7.792 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.434 -8.264 7.955 1.00 0.00 C ATOM 2287 CE LYS B 6 -0.327 -9.240 7.551 1.00 0.00 C ATOM 2288 NZ LYS B 6 -0.614 -10.662 7.846 1.00 0.00 N ATOM 0 H LYS B 6 -3.868 -3.916 7.532 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.239 -3.947 7.159 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.497 -5.446 8.697 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -3.133 -6.333 7.326 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -0.488 -6.672 6.896 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.479 -6.482 8.638 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -1.692 -8.447 8.998 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.322 -8.485 7.363 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -0.142 -9.136 6.482 1.00 0.00 H new ATOM 0 HE3 LYS B 6 0.593 -8.956 8.062 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 0.273 -11.205 7.831 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.052 -10.740 8.786 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -1.264 -11.041 7.128 1.00 0.00 H new ATOM 2302 N THR B 7 -3.006 -5.699 4.933 1.00 0.00 N ATOM 2303 CA THR B 7 -3.077 -6.351 3.662 1.00 0.00 C ATOM 2304 C THR B 7 -2.815 -5.401 2.544 1.00 0.00 C ATOM 2305 O THR B 7 -2.047 -5.718 1.637 1.00 0.00 O ATOM 2306 CB THR B 7 -4.419 -6.989 3.455 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.675 -8.010 4.408 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.590 -7.597 2.053 1.00 0.00 C ATOM 0 H THR B 7 -3.891 -5.719 5.440 1.00 0.00 H new ATOM 0 HA THR B 7 -2.306 -7.121 3.661 1.00 0.00 H new ATOM 0 HB THR B 7 -5.132 -6.174 3.576 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.161 -7.632 5.170 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.581 -8.042 1.968 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.477 -6.816 1.301 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.833 -8.365 1.894 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.312 -4.153 2.478 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.027 -3.213 1.439 1.00 0.00 C ATOM 2318 C GLY B 8 -1.665 -2.614 1.504 1.00 0.00 C ATOM 2319 O GLY B 8 -1.106 -2.121 0.525 1.00 0.00 O ATOM 0 H GLY B 8 -3.945 -3.781 3.186 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.147 -3.708 0.475 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.765 -2.412 1.479 1.00 0.00 H new ATOM 2323 N HIS B 9 -1.079 -2.586 2.714 1.00 0.00 N ATOM 2324 CA HIS B 9 0.291 -2.260 2.963 1.00 0.00 C ATOM 2325 C HIS B 9 1.226 -3.040 2.104 1.00 0.00 C ATOM 2326 O HIS B 9 2.083 -2.433 1.463 1.00 0.00 O ATOM 2327 CB HIS B 9 0.781 -2.402 4.414 1.00 0.00 C ATOM 2328 CG HIS B 9 2.046 -1.615 4.590 1.00 0.00 C ATOM 2329 ND1 HIS B 9 2.022 -0.266 4.880 1.00 0.00 N ATOM 2330 CD2 HIS B 9 3.343 -1.842 4.251 1.00 0.00 C ATOM 2331 CE1 HIS B 9 3.291 0.220 4.842 1.00 0.00 C ATOM 2332 NE2 HIS B 9 4.100 -0.692 4.335 1.00 0.00 N ATOM 0 H HIS B 9 -1.592 -2.804 3.568 1.00 0.00 H new ATOM 0 HA HIS B 9 0.306 -1.197 2.720 1.00 0.00 H new ATOM 0 HB2 HIS B 9 0.017 -2.044 5.104 1.00 0.00 H new ATOM 0 HB3 HIS B 9 0.957 -3.452 4.650 1.00 0.00 H new ATOM 0 HD1 HIS B 9 1.186 0.279 5.089 1.00 0.00 H new ATOM 0 HD2 HIS B 9 3.733 -2.804 3.953 1.00 0.00 H new ATOM 0 HE1 HIS B 9 3.592 1.202 5.176 1.00 0.00 H new ATOM 2340 N ALA B 10 1.168 -4.383 2.147 1.00 0.00 N ATOM 2341 CA ALA B 10 1.875 -5.245 1.252 1.00 0.00 C ATOM 2342 C ALA B 10 1.819 -5.015 -0.219 1.00 0.00 C ATOM 2343 O ALA B 10 2.846 -4.868 -0.881 1.00 0.00 O ATOM 2344 CB ALA B 10 1.448 -6.711 1.434 1.00 0.00 C ATOM 0 H ALA B 10 0.606 -4.888 2.832 1.00 0.00 H new ATOM 0 HA ALA B 10 2.892 -4.999 1.557 1.00 0.00 H new ATOM 0 HB1 ALA B 10 2.004 -7.341 0.739 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.657 -7.027 2.456 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.380 -6.806 1.236 1.00 0.00 H new ATOM 2350 N VAL B 11 0.615 -4.812 -0.781 1.00 0.00 N ATOM 2351 CA VAL B 11 0.242 -4.339 -2.079 1.00 0.00 C ATOM 2352 C VAL B 11 0.892 -3.042 -2.420 1.00 0.00 C ATOM 2353 O VAL B 11 1.622 -2.858 -3.393 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.239 -4.153 -2.221 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -1.680 -3.666 -3.612 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -1.986 -5.464 -1.925 1.00 0.00 C ATOM 0 H VAL B 11 -0.223 -5.013 -0.235 1.00 0.00 H new ATOM 0 HA VAL B 11 0.583 -5.117 -2.763 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.492 -3.378 -1.497 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -2.764 -3.557 -3.632 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -1.214 -2.704 -3.825 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -1.374 -4.392 -4.365 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -3.059 -5.304 -2.034 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.661 -6.234 -2.624 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.769 -5.784 -0.906 1.00 0.00 H new ATOM 2366 N ARG B 12 0.665 -2.065 -1.524 1.00 0.00 N ATOM 2367 CA ARG B 12 1.154 -0.724 -1.604 1.00 0.00 C ATOM 2368 C ARG B 12 2.639 -0.606 -1.639 1.00 0.00 C ATOM 2369 O ARG B 12 3.203 0.213 -2.363 1.00 0.00 O ATOM 2370 CB ARG B 12 0.666 0.166 -0.449 1.00 0.00 C ATOM 2371 CG ARG B 12 1.092 1.632 -0.346 1.00 0.00 C ATOM 2372 CD ARG B 12 0.565 2.300 0.926 1.00 0.00 C ATOM 2373 NE ARG B 12 1.039 3.712 0.906 1.00 0.00 N ATOM 2374 CZ ARG B 12 0.531 4.620 1.790 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -0.006 4.264 2.994 1.00 0.00 N ATOM 2376 NH2 ARG B 12 0.329 5.909 1.388 1.00 0.00 N ATOM 0 H ARG B 12 0.102 -2.224 -0.688 1.00 0.00 H new ATOM 0 HA ARG B 12 0.745 -0.384 -2.555 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -0.424 0.152 -0.474 1.00 0.00 H new ATOM 0 HB3 ARG B 12 0.970 -0.320 0.478 1.00 0.00 H new ATOM 0 HG2 ARG B 12 2.180 1.694 -0.363 1.00 0.00 H new ATOM 0 HG3 ARG B 12 0.728 2.176 -1.217 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -0.524 2.259 0.960 1.00 0.00 H new ATOM 0 HD3 ARG B 12 0.931 1.783 1.813 1.00 0.00 H new ATOM 0 HE ARG B 12 1.745 4.001 0.230 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -0.040 3.282 3.267 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -0.373 4.980 3.621 1.00 0.00 H new ATOM 0 HH21 ARG B 12 0.557 6.187 0.434 1.00 0.00 H new ATOM 0 HH22 ARG B 12 -0.050 6.594 2.042 1.00 0.00 H new ATOM 2390 N ALA B 13 3.292 -1.457 -0.828 1.00 0.00 N ATOM 2391 CA ALA B 13 4.718 -1.524 -0.752 1.00 0.00 C ATOM 2392 C ALA B 13 5.374 -2.204 -1.905 1.00 0.00 C ATOM 2393 O ALA B 13 6.379 -1.750 -2.448 1.00 0.00 O ATOM 2394 CB ALA B 13 5.157 -2.140 0.587 1.00 0.00 C ATOM 0 H ALA B 13 2.817 -2.115 -0.210 1.00 0.00 H new ATOM 0 HA ALA B 13 5.065 -0.492 -0.808 1.00 0.00 H new ATOM 0 HB1 ALA B 13 6.245 -2.183 0.628 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.787 -1.526 1.408 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.750 -3.147 0.675 1.00 0.00 H new ATOM 2400 N ILE B 14 4.729 -3.254 -2.445 1.00 0.00 N ATOM 2401 CA ILE B 14 5.313 -4.068 -3.466 1.00 0.00 C ATOM 2402 C ILE B 14 5.316 -3.376 -4.785 1.00 0.00 C ATOM 2403 O ILE B 14 6.096 -3.580 -5.714 1.00 0.00 O ATOM 2404 CB ILE B 14 4.735 -5.449 -3.557 1.00 0.00 C ATOM 2405 CG1 ILE B 14 5.710 -6.411 -4.256 1.00 0.00 C ATOM 2406 CG2 ILE B 14 3.436 -5.477 -4.381 1.00 0.00 C ATOM 2407 CD1 ILE B 14 5.271 -7.873 -4.186 1.00 0.00 C ATOM 0 H ILE B 14 3.790 -3.542 -2.170 1.00 0.00 H new ATOM 0 HA ILE B 14 6.349 -4.216 -3.162 1.00 0.00 H new ATOM 0 HB ILE B 14 4.541 -5.755 -2.529 1.00 0.00 H new ATOM 0 HG12 ILE B 14 5.811 -6.119 -5.301 1.00 0.00 H new ATOM 0 HG13 ILE B 14 6.696 -6.313 -3.801 1.00 0.00 H new ATOM 0 HG21 ILE B 14 3.052 -6.496 -4.421 1.00 0.00 H new ATOM 0 HG22 ILE B 14 2.695 -4.828 -3.914 1.00 0.00 H new ATOM 0 HG23 ILE B 14 3.639 -5.126 -5.393 1.00 0.00 H new ATOM 0 HD11 ILE B 14 6.003 -8.498 -4.698 1.00 0.00 H new ATOM 0 HD12 ILE B 14 5.197 -8.181 -3.143 1.00 0.00 H new ATOM 0 HD13 ILE B 14 4.299 -7.984 -4.667 1.00 0.00 H new ATOM 2419 N GLY B 15 4.338 -2.459 -4.897 1.00 0.00 N ATOM 2420 CA GLY B 15 4.071 -1.644 -6.041 1.00 0.00 C ATOM 2421 C GLY B 15 4.950 -0.443 -6.118 1.00 0.00 C ATOM 2422 O GLY B 15 5.106 0.100 -7.210 1.00 0.00 O ATOM 0 H GLY B 15 3.688 -2.275 -4.133 1.00 0.00 H new ATOM 0 HA2 GLY B 15 4.201 -2.241 -6.944 1.00 0.00 H new ATOM 0 HA3 GLY B 15 3.029 -1.324 -6.017 1.00 0.00 H new ATOM 2426 N ARG B 16 5.565 -0.029 -4.995 1.00 0.00 N ATOM 2427 CA ARG B 16 6.587 0.969 -4.923 1.00 0.00 C ATOM 2428 C ARG B 16 7.930 0.341 -5.070 1.00 0.00 C ATOM 2429 O ARG B 16 8.854 0.862 -5.692 1.00 0.00 O ATOM 2430 CB ARG B 16 6.399 1.735 -3.602 1.00 0.00 C ATOM 2431 CG ARG B 16 5.225 2.714 -3.679 1.00 0.00 C ATOM 2432 CD ARG B 16 4.664 3.111 -2.312 1.00 0.00 C ATOM 2433 NE ARG B 16 5.679 3.973 -1.644 1.00 0.00 N ATOM 2434 CZ ARG B 16 5.421 4.828 -0.612 1.00 0.00 C ATOM 2435 NH1 ARG B 16 4.141 4.900 -0.145 1.00 0.00 N ATOM 2436 NH2 ARG B 16 6.408 5.611 -0.088 1.00 0.00 N ATOM 0 H ARG B 16 5.333 -0.416 -4.080 1.00 0.00 H new ATOM 0 HA ARG B 16 6.512 1.685 -5.741 1.00 0.00 H new ATOM 0 HB2 ARG B 16 6.230 1.027 -2.791 1.00 0.00 H new ATOM 0 HB3 ARG B 16 7.313 2.280 -3.364 1.00 0.00 H new ATOM 0 HG2 ARG B 16 5.547 3.613 -4.205 1.00 0.00 H new ATOM 0 HG3 ARG B 16 4.428 2.266 -4.273 1.00 0.00 H new ATOM 0 HD2 ARG B 16 3.721 3.646 -2.425 1.00 0.00 H new ATOM 0 HD3 ARG B 16 4.457 2.226 -1.711 1.00 0.00 H new ATOM 0 HE ARG B 16 6.639 3.920 -1.984 1.00 0.00 H new ATOM 0 HH11 ARG B 16 3.411 4.325 -0.566 1.00 0.00 H new ATOM 0 HH12 ARG B 16 3.914 5.529 0.625 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.353 5.562 -0.468 1.00 0.00 H new ATOM 0 HH22 ARG B 16 6.200 6.245 0.683 1.00 0.00 H new ATOM 2450 N LEU B 17 8.063 -0.918 -4.614 1.00 0.00 N ATOM 2451 CA LEU B 17 9.305 -1.625 -4.663 1.00 0.00 C ATOM 2452 C LEU B 17 9.678 -2.109 -6.022 1.00 0.00 C ATOM 2453 O LEU B 17 10.836 -1.899 -6.380 1.00 0.00 O ATOM 2454 CB LEU B 17 9.257 -2.765 -3.632 1.00 0.00 C ATOM 2455 CG LEU B 17 10.486 -3.685 -3.530 1.00 0.00 C ATOM 2456 CD1 LEU B 17 11.746 -2.890 -3.148 1.00 0.00 C ATOM 2457 CD2 LEU B 17 10.057 -4.758 -2.515 1.00 0.00 C ATOM 0 H LEU B 17 7.297 -1.453 -4.205 1.00 0.00 H new ATOM 0 HA LEU B 17 10.101 -0.925 -4.409 1.00 0.00 H new ATOM 0 HB2 LEU B 17 9.086 -2.323 -2.650 1.00 0.00 H new ATOM 0 HB3 LEU B 17 8.390 -3.386 -3.858 1.00 0.00 H new ATOM 0 HG LEU B 17 10.775 -4.152 -4.472 1.00 0.00 H new ATOM 0 HD11 LEU B 17 12.598 -3.567 -3.084 1.00 0.00 H new ATOM 0 HD12 LEU B 17 11.942 -2.132 -3.906 1.00 0.00 H new ATOM 0 HD13 LEU B 17 11.593 -2.407 -2.183 1.00 0.00 H new ATOM 0 HD21 LEU B 17 10.871 -5.469 -2.371 1.00 0.00 H new ATOM 0 HD22 LEU B 17 9.817 -4.284 -1.564 1.00 0.00 H new ATOM 0 HD23 LEU B 17 9.179 -5.283 -2.890 1.00 0.00 H new ATOM 2469 N SER B 18 8.738 -2.631 -6.832 1.00 0.00 N ATOM 2470 CA SER B 18 8.934 -3.071 -8.178 1.00 0.00 C ATOM 2471 C SER B 18 9.303 -1.994 -9.138 1.00 0.00 C ATOM 2472 O SER B 18 8.845 -0.863 -8.979 1.00 0.00 O ATOM 2473 CB SER B 18 7.619 -3.764 -8.575 1.00 0.00 C ATOM 2474 OG SER B 18 7.565 -4.269 -9.901 1.00 0.00 O ATOM 0 H SER B 18 7.774 -2.753 -6.522 1.00 0.00 H new ATOM 0 HA SER B 18 9.793 -3.741 -8.223 1.00 0.00 H new ATOM 0 HB2 SER B 18 7.441 -4.588 -7.884 1.00 0.00 H new ATOM 0 HB3 SER B 18 6.802 -3.055 -8.442 1.00 0.00 H new ATOM 0 HG SER B 18 6.694 -4.691 -10.055 1.00 0.00 H new ATOM 2480 N SER B 19 10.137 -2.299 -10.148 1.00 0.00 N ATOM 2481 CA SER B 19 10.754 -1.384 -11.058 1.00 0.00 C ATOM 2482 C SER B 19 9.685 -0.798 -11.969 1.00 0.00 C ATOM 2483 O SER B 19 9.158 0.333 -11.797 1.00 0.00 O ATOM 2484 CB SER B 19 11.931 -2.070 -11.773 1.00 0.00 C ATOM 2485 OG SER B 19 12.907 -2.491 -10.832 1.00 0.00 O ATOM 2486 OXT SER B 19 9.309 -1.509 -12.940 1.00 0.00 O ATOM 0 H SER B 19 10.400 -3.265 -10.343 1.00 0.00 H new ATOM 0 HA SER B 19 11.201 -0.535 -10.540 1.00 0.00 H new ATOM 0 HB2 SER B 19 11.570 -2.928 -12.340 1.00 0.00 H new ATOM 0 HB3 SER B 19 12.380 -1.382 -12.489 1.00 0.00 H new ATOM 0 HG SER B 19 13.648 -2.927 -11.302 1.00 0.00 H new TER 2492 SER B 19 HETATM 2493 CA CA A 151 13.915 -13.902 5.594 1.00 0.00 CA HETATM 2494 CA CA A 152 20.000 -4.023 3.654 1.00 0.00 CA HETATM 2495 CA CA A 153 -14.312 -7.543 -9.502 1.00 0.00 CA HETATM 2496 CA CA A 154 -20.899 -1.899 -2.011 1.00 0.00 CA