USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=38 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 93 ASNHD21 : A 93 ASN OD1 : A 153 CACA :(metal ligand) USER MOD NoAdj : A 93 ASNHD22 : A 93 ASN OD1 : A 153 CACA :(metal ligand) USER MOD Set 1.1: B 5 GLN : amide:sc= 0 X(o=-0.65,f=-0.65) USER MOD Set 1.2: B 9 HIS : no HE2:sc= -0.649 K(o=-0.65,f=-1.9!) USER MOD Set 2.1: A 105 MET CE :methyl 151:sc= -0.0324 (180deg=-0.0217) USER MOD Set 2.2: B 7 THR OG1 : rot 79:sc= 1.24 USER MOD Set 3.1: A 45 GLN : amide:sc= 0.625 K(o=1.2,f=-0.53) USER MOD Set 3.2: A 49 ASN : amide:sc= 0.579 K(o=1.2,f=-1.5) USER MOD Single : A 1 THR N :NH3+ -130:sc= 0 (180deg=-0.0184) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=-0.05) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 13 SER OG : rot 58:sc= 1.23 USER MOD Single : A 17 LYS NZ :NH3+ 172:sc= 1.21 (180deg=1.04) USER MOD Single : A 22 THR OG1 : rot -54:sc= 1.07 USER MOD Single : A 24 THR OG1 : rot -57:sc= 1.12 USER MOD Single : A 25 THR OG1 : rot 180:sc= 0 USER MOD Single : A 26 LYS NZ :NH3+ -128:sc= 0 (180deg=-0.0124) USER MOD Single : A 30 THR OG1 : rot 81:sc= 0.544 USER MOD Single : A 32 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 34 SER OG : rot 76:sc= 0.958 USER MOD Single : A 37 GLN : amide:sc= 1.06 K(o=1.1,f=-7.4!) USER MOD Single : A 38 ASN : amide:sc= 0.286 K(o=0.29,f=-3.1!) USER MOD Single : A 40 THR OG1 : rot -54:sc= 0.68 USER MOD Single : A 47 MET CE :methyl -173:sc=-8.38e-05 (180deg=-0.191) USER MOD Single : A 56 ASN : amide:sc= -0.372 K(o=-0.37,f=-6.9!) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 111:sc= 1.26 USER MOD Single : A 67 MET CE :methyl -164:sc= 0 (180deg=-0.0597) USER MOD Single : A 68 MET CE :methyl -141:sc= -0.183 (180deg=-0.881) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl -178:sc= -1.05 (180deg=-1.09) USER MOD Single : A 73 LYS NZ :NH3+ 163:sc= 1.26 (180deg=0.974) USER MOD Single : A 75 THR OG1 : rot 180:sc= 0.028 USER MOD Single : A 77 SER OG : rot 71:sc= 0.6 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot -66:sc= 0.754 USER MOD Single : A 103 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 106 THR OG1 : rot 88:sc= 1.18 USER MOD Single : A 107 ASN : amide:sc= -0.0121 K(o=-0.012,f=-0.58) USER MOD Single : A 111 LYS NZ :NH3+ 149:sc= -0.126 (180deg=-0.586) USER MOD Single : A 113 THR OG1 : rot -84:sc= 0.726 USER MOD Single : A 120 MET CE :methyl -155:sc= -0.483 (180deg=-1.35!) USER MOD Single : A 131 GLN : amide:sc= 0.349 K(o=0.35,f=-0.77) USER MOD Single : A 133 ASN : amide:sc= 0.43 K(o=0.43,f=-5.1!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= -0.927 X(o=-0.93,f=-0.78) USER MOD Single : A 140 MET CE :methyl 167:sc=-0.00539 (180deg=-0.156) USER MOD Single : A 141 MET CE :methyl 175:sc=-0.00525 (180deg=-0.0257) USER MOD Single : A 142 THR OG1 : rot -70:sc= 0.717 USER MOD Single : B 1 ARG N :NH3+ -160:sc= -0.357 (180deg=-1.19) USER MOD Single : B 3 LYS NZ :NH3+ 168:sc= 1.26 (180deg=1.12) USER MOD Single : B 6 LYS NZ :NH3+ 177:sc= 1.22 (180deg=1.17) USER MOD Single : B 18 SER OG : rot 171:sc= 1.27 USER MOD Single : B 19 SER OG : rot 42:sc= 0.42 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 4.200 6.681 15.485 1.00 0.00 N ATOM 2 CA THR A 1 3.470 5.901 16.509 1.00 0.00 C ATOM 3 C THR A 1 3.499 4.412 16.461 1.00 0.00 C ATOM 4 O THR A 1 3.383 3.777 15.415 1.00 0.00 O ATOM 5 CB THR A 1 2.093 6.464 16.701 1.00 0.00 C ATOM 6 OG1 THR A 1 1.455 5.980 17.874 1.00 0.00 O ATOM 7 CG2 THR A 1 1.099 6.113 15.582 1.00 0.00 C ATOM 0 H1 THR A 1 4.792 7.397 15.951 1.00 0.00 H new ATOM 0 H2 THR A 1 4.803 6.043 14.927 1.00 0.00 H new ATOM 0 H3 THR A 1 3.519 7.152 14.856 1.00 0.00 H new ATOM 0 HA THR A 1 4.077 6.046 17.402 1.00 0.00 H new ATOM 0 HB THR A 1 2.295 7.535 16.735 1.00 0.00 H new ATOM 0 HG1 THR A 1 0.564 6.380 17.950 1.00 0.00 H new ATOM 0 HG21 THR A 1 0.130 6.561 15.803 1.00 0.00 H new ATOM 0 HG22 THR A 1 1.469 6.499 14.632 1.00 0.00 H new ATOM 0 HG23 THR A 1 0.992 5.030 15.517 1.00 0.00 H new ATOM 14 N GLU A 2 3.691 3.772 17.629 1.00 0.00 N ATOM 15 CA GLU A 2 3.888 2.359 17.724 1.00 0.00 C ATOM 16 C GLU A 2 2.924 1.427 17.075 1.00 0.00 C ATOM 17 O GLU A 2 3.421 0.539 16.385 1.00 0.00 O ATOM 18 CB GLU A 2 4.067 2.092 19.228 1.00 0.00 C ATOM 19 CG GLU A 2 4.820 0.797 19.541 1.00 0.00 C ATOM 20 CD GLU A 2 5.281 0.569 20.973 1.00 0.00 C ATOM 21 OE1 GLU A 2 4.317 0.423 21.771 1.00 0.00 O ATOM 22 OE2 GLU A 2 6.506 0.638 21.259 1.00 0.00 O ATOM 0 H GLU A 2 3.710 4.250 18.530 1.00 0.00 H new ATOM 0 HA GLU A 2 4.753 2.114 17.108 1.00 0.00 H new ATOM 0 HB2 GLU A 2 4.603 2.930 19.675 1.00 0.00 H new ATOM 0 HB3 GLU A 2 3.085 2.053 19.700 1.00 0.00 H new ATOM 0 HG2 GLU A 2 4.179 -0.039 19.259 1.00 0.00 H new ATOM 0 HG3 GLU A 2 5.698 0.757 18.897 1.00 0.00 H new ATOM 29 N GLU A 3 1.591 1.602 17.130 1.00 0.00 N ATOM 30 CA GLU A 3 0.605 0.846 16.423 1.00 0.00 C ATOM 31 C GLU A 3 0.866 0.779 14.957 1.00 0.00 C ATOM 32 O GLU A 3 0.544 -0.224 14.322 1.00 0.00 O ATOM 33 CB GLU A 3 -0.791 1.418 16.722 1.00 0.00 C ATOM 34 CG GLU A 3 -1.074 2.883 16.383 1.00 0.00 C ATOM 35 CD GLU A 3 -2.524 3.337 16.294 1.00 0.00 C ATOM 36 OE1 GLU A 3 -3.080 3.778 17.335 1.00 0.00 O ATOM 37 OE2 GLU A 3 -3.148 3.319 15.200 1.00 0.00 O ATOM 0 H GLU A 3 1.173 2.327 17.713 1.00 0.00 H new ATOM 0 HA GLU A 3 0.657 -0.184 16.777 1.00 0.00 H new ATOM 0 HB2 GLU A 3 -1.519 0.809 16.187 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -0.983 1.282 17.786 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -0.578 3.499 17.133 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -0.598 3.101 15.427 1.00 0.00 H new ATOM 44 N GLN A 4 1.374 1.844 14.312 1.00 0.00 N ATOM 45 CA GLN A 4 1.585 1.829 12.898 1.00 0.00 C ATOM 46 C GLN A 4 2.863 1.172 12.502 1.00 0.00 C ATOM 47 O GLN A 4 2.931 0.384 11.559 1.00 0.00 O ATOM 48 CB GLN A 4 1.616 3.264 12.347 1.00 0.00 C ATOM 49 CG GLN A 4 0.282 4.012 12.393 1.00 0.00 C ATOM 50 CD GLN A 4 0.313 5.403 11.776 1.00 0.00 C ATOM 51 OE1 GLN A 4 1.202 5.906 11.090 1.00 0.00 O ATOM 52 NE2 GLN A 4 -0.805 6.146 11.992 1.00 0.00 N ATOM 0 H GLN A 4 1.639 2.716 14.770 1.00 0.00 H new ATOM 0 HA GLN A 4 0.755 1.257 12.483 1.00 0.00 H new ATOM 0 HB2 GLN A 4 2.354 3.836 12.910 1.00 0.00 H new ATOM 0 HB3 GLN A 4 1.960 3.231 11.313 1.00 0.00 H new ATOM 0 HG2 GLN A 4 -0.471 3.417 11.877 1.00 0.00 H new ATOM 0 HG3 GLN A 4 -0.036 4.097 13.432 1.00 0.00 H new ATOM 0 HE21 GLN A 4 -1.567 5.769 12.555 1.00 0.00 H new ATOM 0 HE22 GLN A 4 -0.881 7.081 11.591 1.00 0.00 H new ATOM 61 N ILE A 5 3.910 1.393 13.317 1.00 0.00 N ATOM 62 CA ILE A 5 5.201 0.801 13.150 1.00 0.00 C ATOM 63 C ILE A 5 5.132 -0.684 13.252 1.00 0.00 C ATOM 64 O ILE A 5 5.611 -1.432 12.402 1.00 0.00 O ATOM 65 CB ILE A 5 6.159 1.382 14.147 1.00 0.00 C ATOM 66 CG1 ILE A 5 6.284 2.909 14.002 1.00 0.00 C ATOM 67 CG2 ILE A 5 7.570 0.816 13.915 1.00 0.00 C ATOM 68 CD1 ILE A 5 6.700 3.271 12.577 1.00 0.00 C ATOM 0 H ILE A 5 3.854 2.011 14.127 1.00 0.00 H new ATOM 0 HA ILE A 5 5.566 1.031 12.149 1.00 0.00 H new ATOM 0 HB ILE A 5 5.769 1.126 15.132 1.00 0.00 H new ATOM 0 HG12 ILE A 5 5.333 3.384 14.243 1.00 0.00 H new ATOM 0 HG13 ILE A 5 7.019 3.290 14.711 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.258 1.244 14.644 1.00 0.00 H new ATOM 0 HG22 ILE A 5 7.550 -0.268 14.028 1.00 0.00 H new ATOM 0 HG23 ILE A 5 7.903 1.070 12.909 1.00 0.00 H new ATOM 0 HD11 ILE A 5 6.785 4.354 12.487 1.00 0.00 H new ATOM 0 HD12 ILE A 5 7.662 2.811 12.351 1.00 0.00 H new ATOM 0 HD13 ILE A 5 5.950 2.906 11.875 1.00 0.00 H new ATOM 80 N ALA A 6 4.304 -1.176 14.191 1.00 0.00 N ATOM 81 CA ALA A 6 3.972 -2.560 14.328 1.00 0.00 C ATOM 82 C ALA A 6 3.279 -3.174 13.161 1.00 0.00 C ATOM 83 O ALA A 6 3.676 -4.242 12.698 1.00 0.00 O ATOM 84 CB ALA A 6 3.173 -2.709 15.633 1.00 0.00 C ATOM 0 H ALA A 6 3.847 -0.584 14.884 1.00 0.00 H new ATOM 0 HA ALA A 6 4.902 -3.127 14.366 1.00 0.00 H new ATOM 0 HB1 ALA A 6 2.899 -3.755 15.775 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.783 -2.376 16.473 1.00 0.00 H new ATOM 0 HB3 ALA A 6 2.269 -2.102 15.578 1.00 0.00 H new ATOM 90 N GLU A 7 2.277 -2.487 12.582 1.00 0.00 N ATOM 91 CA GLU A 7 1.462 -3.085 11.571 1.00 0.00 C ATOM 92 C GLU A 7 2.289 -3.195 10.337 1.00 0.00 C ATOM 93 O GLU A 7 2.230 -4.172 9.593 1.00 0.00 O ATOM 94 CB GLU A 7 0.226 -2.214 11.287 1.00 0.00 C ATOM 95 CG GLU A 7 -1.014 -3.097 11.137 1.00 0.00 C ATOM 96 CD GLU A 7 -1.647 -3.701 12.383 1.00 0.00 C ATOM 97 OE1 GLU A 7 -2.253 -2.994 13.231 1.00 0.00 O ATOM 98 OE2 GLU A 7 -1.264 -4.862 12.689 1.00 0.00 O ATOM 0 H GLU A 7 2.033 -1.524 12.812 1.00 0.00 H new ATOM 0 HA GLU A 7 1.116 -4.065 11.900 1.00 0.00 H new ATOM 0 HB2 GLU A 7 0.079 -1.501 12.099 1.00 0.00 H new ATOM 0 HB3 GLU A 7 0.381 -1.634 10.378 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -1.779 -2.506 10.633 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.754 -3.918 10.469 1.00 0.00 H new ATOM 105 N PHE A 8 3.176 -2.218 10.076 1.00 0.00 N ATOM 106 CA PHE A 8 4.044 -2.315 8.943 1.00 0.00 C ATOM 107 C PHE A 8 5.018 -3.429 9.119 1.00 0.00 C ATOM 108 O PHE A 8 5.241 -4.193 8.181 1.00 0.00 O ATOM 109 CB PHE A 8 5.026 -1.138 8.818 1.00 0.00 C ATOM 110 CG PHE A 8 4.479 0.106 8.208 1.00 0.00 C ATOM 111 CD1 PHE A 8 3.941 0.094 6.942 1.00 0.00 C ATOM 112 CD2 PHE A 8 4.678 1.329 8.804 1.00 0.00 C ATOM 113 CE1 PHE A 8 3.494 1.242 6.333 1.00 0.00 C ATOM 114 CE2 PHE A 8 4.282 2.502 8.206 1.00 0.00 C ATOM 115 CZ PHE A 8 3.697 2.447 6.963 1.00 0.00 C ATOM 0 H PHE A 8 3.292 -1.375 10.638 1.00 0.00 H new ATOM 0 HA PHE A 8 3.352 -2.401 8.106 1.00 0.00 H new ATOM 0 HB2 PHE A 8 5.402 -0.897 9.812 1.00 0.00 H new ATOM 0 HB3 PHE A 8 5.880 -1.465 8.225 1.00 0.00 H new ATOM 0 HD1 PHE A 8 3.868 -0.844 6.412 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.159 1.369 9.770 1.00 0.00 H new ATOM 0 HE1 PHE A 8 2.993 1.198 5.377 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.428 3.449 8.704 1.00 0.00 H new ATOM 0 HZ PHE A 8 3.393 3.362 6.476 1.00 0.00 H new ATOM 125 N LYS A 9 5.537 -3.682 10.333 1.00 0.00 N ATOM 126 CA LYS A 9 6.507 -4.692 10.624 1.00 0.00 C ATOM 127 C LYS A 9 6.070 -6.116 10.630 1.00 0.00 C ATOM 128 O LYS A 9 6.782 -7.062 10.298 1.00 0.00 O ATOM 129 CB LYS A 9 7.033 -4.394 12.038 1.00 0.00 C ATOM 130 CG LYS A 9 8.128 -5.385 12.439 1.00 0.00 C ATOM 131 CD LYS A 9 8.816 -5.005 13.752 1.00 0.00 C ATOM 132 CE LYS A 9 9.752 -6.046 14.370 1.00 0.00 C ATOM 133 NZ LYS A 9 10.610 -5.407 15.392 1.00 0.00 N ATOM 0 H LYS A 9 5.264 -3.151 11.160 1.00 0.00 H new ATOM 0 HA LYS A 9 7.223 -4.628 9.805 1.00 0.00 H new ATOM 0 HB2 LYS A 9 7.426 -3.378 12.077 1.00 0.00 H new ATOM 0 HB3 LYS A 9 6.212 -4.446 12.753 1.00 0.00 H new ATOM 0 HG2 LYS A 9 7.694 -6.380 12.536 1.00 0.00 H new ATOM 0 HG3 LYS A 9 8.873 -5.438 11.645 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.388 -4.092 13.584 1.00 0.00 H new ATOM 0 HD3 LYS A 9 8.043 -4.767 14.483 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.170 -6.849 14.822 1.00 0.00 H new ATOM 0 HE3 LYS A 9 10.370 -6.498 13.594 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 11.243 -6.119 15.808 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 11.177 -4.656 14.949 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 10.014 -4.996 16.138 1.00 0.00 H new ATOM 147 N GLU A 10 4.771 -6.355 10.883 1.00 0.00 N ATOM 148 CA GLU A 10 4.013 -7.559 10.736 1.00 0.00 C ATOM 149 C GLU A 10 3.863 -7.937 9.302 1.00 0.00 C ATOM 150 O GLU A 10 4.202 -9.013 8.811 1.00 0.00 O ATOM 151 CB GLU A 10 2.638 -7.504 11.423 1.00 0.00 C ATOM 152 CG GLU A 10 2.007 -8.883 11.624 1.00 0.00 C ATOM 153 CD GLU A 10 0.813 -8.843 12.568 1.00 0.00 C ATOM 154 OE1 GLU A 10 0.986 -8.326 13.704 1.00 0.00 O ATOM 155 OE2 GLU A 10 -0.256 -9.448 12.287 1.00 0.00 O ATOM 0 H GLU A 10 4.179 -5.603 11.236 1.00 0.00 H new ATOM 0 HA GLU A 10 4.588 -8.331 11.247 1.00 0.00 H new ATOM 0 HB2 GLU A 10 2.743 -7.015 12.392 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.966 -6.888 10.826 1.00 0.00 H new ATOM 0 HG2 GLU A 10 1.691 -9.279 10.659 1.00 0.00 H new ATOM 0 HG3 GLU A 10 2.757 -9.568 12.019 1.00 0.00 H new ATOM 162 N ALA A 11 3.481 -6.942 8.483 1.00 0.00 N ATOM 163 CA ALA A 11 3.342 -7.017 7.062 1.00 0.00 C ATOM 164 C ALA A 11 4.595 -7.224 6.281 1.00 0.00 C ATOM 165 O ALA A 11 4.626 -8.082 5.400 1.00 0.00 O ATOM 166 CB ALA A 11 2.662 -5.788 6.434 1.00 0.00 C ATOM 0 H ALA A 11 3.252 -6.015 8.842 1.00 0.00 H new ATOM 0 HA ALA A 11 2.721 -7.909 6.984 1.00 0.00 H new ATOM 0 HB1 ALA A 11 2.594 -5.922 5.354 1.00 0.00 H new ATOM 0 HB2 ALA A 11 1.661 -5.674 6.849 1.00 0.00 H new ATOM 0 HB3 ALA A 11 3.249 -4.896 6.653 1.00 0.00 H new ATOM 172 N PHE A 12 5.740 -6.624 6.650 1.00 0.00 N ATOM 173 CA PHE A 12 7.066 -7.046 6.317 1.00 0.00 C ATOM 174 C PHE A 12 7.379 -8.480 6.569 1.00 0.00 C ATOM 175 O PHE A 12 7.799 -9.221 5.681 1.00 0.00 O ATOM 176 CB PHE A 12 8.026 -6.198 7.168 1.00 0.00 C ATOM 177 CG PHE A 12 9.460 -6.585 7.053 1.00 0.00 C ATOM 178 CD1 PHE A 12 10.168 -6.241 5.926 1.00 0.00 C ATOM 179 CD2 PHE A 12 10.106 -7.217 8.089 1.00 0.00 C ATOM 180 CE1 PHE A 12 11.524 -6.447 5.822 1.00 0.00 C ATOM 181 CE2 PHE A 12 11.443 -7.527 8.007 1.00 0.00 C ATOM 182 CZ PHE A 12 12.114 -7.058 6.903 1.00 0.00 C ATOM 0 H PHE A 12 5.738 -5.781 7.224 1.00 0.00 H new ATOM 0 HA PHE A 12 7.170 -6.915 5.240 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.921 -5.152 6.879 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.726 -6.271 8.213 1.00 0.00 H new ATOM 0 HD1 PHE A 12 9.642 -5.794 5.095 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.555 -7.474 8.981 1.00 0.00 H new ATOM 0 HE1 PHE A 12 12.087 -6.149 4.950 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.940 -8.108 8.770 1.00 0.00 H new ATOM 0 HZ PHE A 12 13.187 -7.179 6.883 1.00 0.00 H new ATOM 192 N SER A 13 6.930 -9.037 7.708 1.00 0.00 N ATOM 193 CA SER A 13 7.246 -10.376 8.096 1.00 0.00 C ATOM 194 C SER A 13 6.341 -11.333 7.399 1.00 0.00 C ATOM 195 O SER A 13 6.513 -12.546 7.510 1.00 0.00 O ATOM 196 CB SER A 13 7.178 -10.638 9.610 1.00 0.00 C ATOM 197 OG SER A 13 7.780 -9.599 10.367 1.00 0.00 O ATOM 0 H SER A 13 6.334 -8.546 8.374 1.00 0.00 H new ATOM 0 HA SER A 13 8.286 -10.524 7.804 1.00 0.00 H new ATOM 0 HB2 SER A 13 6.136 -10.746 9.911 1.00 0.00 H new ATOM 0 HB3 SER A 13 7.674 -11.582 9.835 1.00 0.00 H new ATOM 0 HG SER A 13 7.343 -8.747 10.158 1.00 0.00 H new ATOM 203 N LEU A 14 5.281 -10.941 6.671 1.00 0.00 N ATOM 204 CA LEU A 14 4.332 -11.761 5.983 1.00 0.00 C ATOM 205 C LEU A 14 4.907 -12.345 4.739 1.00 0.00 C ATOM 206 O LEU A 14 4.488 -13.372 4.208 1.00 0.00 O ATOM 207 CB LEU A 14 3.123 -10.940 5.502 1.00 0.00 C ATOM 208 CG LEU A 14 1.953 -11.734 4.898 1.00 0.00 C ATOM 209 CD1 LEU A 14 1.383 -12.954 5.641 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.824 -10.718 4.660 1.00 0.00 C ATOM 0 H LEU A 14 5.069 -9.950 6.554 1.00 0.00 H new ATOM 0 HA LEU A 14 4.048 -12.531 6.701 1.00 0.00 H new ATOM 0 HB2 LEU A 14 2.745 -10.363 6.346 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.471 -10.224 4.757 1.00 0.00 H new ATOM 0 HG LEU A 14 2.376 -12.206 4.011 1.00 0.00 H new ATOM 0 HD11 LEU A 14 0.565 -13.383 5.062 1.00 0.00 H new ATOM 0 HD12 LEU A 14 2.167 -13.700 5.770 1.00 0.00 H new ATOM 0 HD13 LEU A 14 1.012 -12.644 6.618 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.039 -11.227 4.230 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.540 -10.261 5.608 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.169 -9.945 3.974 1.00 0.00 H new ATOM 222 N PHE A 15 5.988 -11.716 4.244 1.00 0.00 N ATOM 223 CA PHE A 15 6.719 -12.105 3.078 1.00 0.00 C ATOM 224 C PHE A 15 7.713 -13.153 3.443 1.00 0.00 C ATOM 225 O PHE A 15 8.121 -13.961 2.610 1.00 0.00 O ATOM 226 CB PHE A 15 7.423 -10.915 2.405 1.00 0.00 C ATOM 227 CG PHE A 15 6.390 -10.075 1.735 1.00 0.00 C ATOM 228 CD1 PHE A 15 5.680 -9.074 2.355 1.00 0.00 C ATOM 229 CD2 PHE A 15 6.085 -10.403 0.435 1.00 0.00 C ATOM 230 CE1 PHE A 15 4.735 -8.388 1.629 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.134 -9.699 -0.266 1.00 0.00 C ATOM 232 CZ PHE A 15 4.338 -8.775 0.370 1.00 0.00 C ATOM 0 H PHE A 15 6.375 -10.883 4.687 1.00 0.00 H new ATOM 0 HA PHE A 15 6.006 -12.502 2.355 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.967 -10.328 3.145 1.00 0.00 H new ATOM 0 HB3 PHE A 15 8.154 -11.269 1.678 1.00 0.00 H new ATOM 0 HD1 PHE A 15 5.861 -8.831 3.392 1.00 0.00 H new ATOM 0 HD2 PHE A 15 6.599 -11.224 -0.042 1.00 0.00 H new ATOM 0 HE1 PHE A 15 4.286 -7.508 2.066 1.00 0.00 H new ATOM 0 HE2 PHE A 15 5.011 -9.873 -1.325 1.00 0.00 H new ATOM 0 HZ PHE A 15 3.449 -8.375 -0.094 1.00 0.00 H new ATOM 242 N ASP A 16 8.079 -13.182 4.737 1.00 0.00 N ATOM 243 CA ASP A 16 9.041 -14.058 5.331 1.00 0.00 C ATOM 244 C ASP A 16 8.566 -15.464 5.466 1.00 0.00 C ATOM 245 O ASP A 16 7.526 -15.699 6.080 1.00 0.00 O ATOM 246 CB ASP A 16 9.587 -13.441 6.629 1.00 0.00 C ATOM 247 CG ASP A 16 11.050 -13.788 6.865 1.00 0.00 C ATOM 248 OD1 ASP A 16 11.491 -14.948 6.643 1.00 0.00 O ATOM 249 OD2 ASP A 16 11.818 -12.850 7.209 1.00 0.00 O ATOM 0 H ASP A 16 7.670 -12.543 5.419 1.00 0.00 H new ATOM 0 HA ASP A 16 9.882 -14.151 4.644 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.475 -12.358 6.588 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.993 -13.791 7.473 1.00 0.00 H new ATOM 254 N LYS A 17 9.320 -16.401 4.863 1.00 0.00 N ATOM 255 CA LYS A 17 9.120 -17.816 4.917 1.00 0.00 C ATOM 256 C LYS A 17 9.669 -18.487 6.128 1.00 0.00 C ATOM 257 O LYS A 17 9.199 -19.501 6.641 1.00 0.00 O ATOM 258 CB LYS A 17 9.558 -18.550 3.639 1.00 0.00 C ATOM 259 CG LYS A 17 11.056 -18.616 3.335 1.00 0.00 C ATOM 260 CD LYS A 17 11.434 -19.664 2.286 1.00 0.00 C ATOM 261 CE LYS A 17 12.935 -19.800 2.021 1.00 0.00 C ATOM 262 NZ LYS A 17 13.526 -20.435 3.220 1.00 0.00 N ATOM 0 H LYS A 17 10.129 -16.149 4.296 1.00 0.00 H new ATOM 0 HA LYS A 17 8.036 -17.900 4.993 1.00 0.00 H new ATOM 0 HB2 LYS A 17 9.181 -19.571 3.693 1.00 0.00 H new ATOM 0 HB3 LYS A 17 9.065 -18.073 2.792 1.00 0.00 H new ATOM 0 HG2 LYS A 17 11.390 -17.637 2.992 1.00 0.00 H new ATOM 0 HG3 LYS A 17 11.594 -18.831 4.258 1.00 0.00 H new ATOM 0 HD2 LYS A 17 11.047 -20.632 2.605 1.00 0.00 H new ATOM 0 HD3 LYS A 17 10.936 -19.415 1.349 1.00 0.00 H new ATOM 0 HE2 LYS A 17 13.117 -20.406 1.133 1.00 0.00 H new ATOM 0 HE3 LYS A 17 13.385 -18.824 1.839 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 14.521 -20.671 3.033 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 13.472 -19.777 4.024 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 13.001 -21.303 3.447 1.00 0.00 H new ATOM 276 N ASP A 18 10.779 -17.880 6.584 1.00 0.00 N ATOM 277 CA ASP A 18 11.638 -18.310 7.643 1.00 0.00 C ATOM 278 C ASP A 18 11.115 -17.707 8.901 1.00 0.00 C ATOM 279 O ASP A 18 10.791 -18.443 9.832 1.00 0.00 O ATOM 280 CB ASP A 18 13.079 -17.824 7.410 1.00 0.00 C ATOM 281 CG ASP A 18 13.482 -17.879 5.944 1.00 0.00 C ATOM 282 OD1 ASP A 18 13.672 -19.032 5.472 1.00 0.00 O ATOM 283 OD2 ASP A 18 13.610 -16.825 5.265 1.00 0.00 O ATOM 0 H ASP A 18 11.104 -17.006 6.171 1.00 0.00 H new ATOM 0 HA ASP A 18 11.654 -19.399 7.694 1.00 0.00 H new ATOM 0 HB2 ASP A 18 13.177 -16.801 7.772 1.00 0.00 H new ATOM 0 HB3 ASP A 18 13.765 -18.436 7.995 1.00 0.00 H new ATOM 288 N GLY A 19 10.975 -16.370 8.929 1.00 0.00 N ATOM 289 CA GLY A 19 10.662 -15.697 10.151 1.00 0.00 C ATOM 290 C GLY A 19 11.838 -14.991 10.734 1.00 0.00 C ATOM 291 O GLY A 19 11.867 -14.844 11.955 1.00 0.00 O ATOM 0 H GLY A 19 11.077 -15.761 8.117 1.00 0.00 H new ATOM 0 HA2 GLY A 19 9.863 -14.977 9.971 1.00 0.00 H new ATOM 0 HA3 GLY A 19 10.282 -16.420 10.873 1.00 0.00 H new ATOM 295 N ASP A 20 12.843 -14.456 10.018 1.00 0.00 N ATOM 296 CA ASP A 20 13.997 -13.835 10.592 1.00 0.00 C ATOM 297 C ASP A 20 13.893 -12.350 10.654 1.00 0.00 C ATOM 298 O ASP A 20 13.562 -11.766 11.684 1.00 0.00 O ATOM 299 CB ASP A 20 15.259 -14.327 9.864 1.00 0.00 C ATOM 300 CG ASP A 20 15.389 -13.886 8.413 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.456 -14.203 7.627 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.359 -13.215 7.969 1.00 0.00 O ATOM 0 H ASP A 20 12.852 -14.456 8.998 1.00 0.00 H new ATOM 0 HA ASP A 20 14.067 -14.139 11.636 1.00 0.00 H new ATOM 0 HB2 ASP A 20 16.134 -13.977 10.412 1.00 0.00 H new ATOM 0 HB3 ASP A 20 15.276 -15.416 9.898 1.00 0.00 H new ATOM 307 N GLY A 21 14.192 -11.645 9.548 1.00 0.00 N ATOM 308 CA GLY A 21 14.365 -10.226 9.542 1.00 0.00 C ATOM 309 C GLY A 21 14.911 -9.754 8.238 1.00 0.00 C ATOM 310 O GLY A 21 15.018 -8.533 8.140 1.00 0.00 O ATOM 0 H GLY A 21 14.317 -12.075 8.631 1.00 0.00 H new ATOM 0 HA2 GLY A 21 13.409 -9.740 9.736 1.00 0.00 H new ATOM 0 HA3 GLY A 21 15.039 -9.936 10.348 1.00 0.00 H new ATOM 314 N THR A 22 15.298 -10.564 7.237 1.00 0.00 N ATOM 315 CA THR A 22 15.538 -10.206 5.873 1.00 0.00 C ATOM 316 C THR A 22 14.544 -10.724 4.892 1.00 0.00 C ATOM 317 O THR A 22 14.078 -11.853 5.037 1.00 0.00 O ATOM 318 CB THR A 22 16.869 -10.720 5.408 1.00 0.00 C ATOM 319 OG1 THR A 22 17.087 -12.113 5.578 1.00 0.00 O ATOM 320 CG2 THR A 22 18.001 -10.120 6.258 1.00 0.00 C ATOM 0 H THR A 22 15.457 -11.559 7.398 1.00 0.00 H new ATOM 0 HA THR A 22 15.478 -9.118 5.890 1.00 0.00 H new ATOM 0 HB THR A 22 16.866 -10.453 4.351 1.00 0.00 H new ATOM 0 HG1 THR A 22 16.924 -12.358 6.513 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.960 -10.502 5.909 1.00 0.00 H new ATOM 0 HG22 THR A 22 17.988 -9.034 6.167 1.00 0.00 H new ATOM 0 HG23 THR A 22 17.858 -10.398 7.302 1.00 0.00 H new ATOM 328 N ILE A 23 14.184 -9.874 3.914 1.00 0.00 N ATOM 329 CA ILE A 23 13.280 -10.259 2.876 1.00 0.00 C ATOM 330 C ILE A 23 14.064 -10.312 1.610 1.00 0.00 C ATOM 331 O ILE A 23 14.570 -9.295 1.137 1.00 0.00 O ATOM 332 CB ILE A 23 12.139 -9.289 2.961 1.00 0.00 C ATOM 333 CG1 ILE A 23 11.240 -9.556 4.180 1.00 0.00 C ATOM 334 CG2 ILE A 23 11.291 -9.197 1.681 1.00 0.00 C ATOM 335 CD1 ILE A 23 10.551 -10.919 4.146 1.00 0.00 C ATOM 0 H ILE A 23 14.522 -8.914 3.842 1.00 0.00 H new ATOM 0 HA ILE A 23 12.832 -11.250 2.951 1.00 0.00 H new ATOM 0 HB ILE A 23 12.618 -8.318 3.084 1.00 0.00 H new ATOM 0 HG12 ILE A 23 11.841 -9.485 5.087 1.00 0.00 H new ATOM 0 HG13 ILE A 23 10.481 -8.776 4.239 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.488 -8.474 1.827 1.00 0.00 H new ATOM 0 HG22 ILE A 23 11.920 -8.878 0.850 1.00 0.00 H new ATOM 0 HG23 ILE A 23 10.863 -10.174 1.457 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.934 -11.037 5.037 1.00 0.00 H new ATOM 0 HD12 ILE A 23 9.923 -10.987 3.258 1.00 0.00 H new ATOM 0 HD13 ILE A 23 11.304 -11.707 4.119 1.00 0.00 H new ATOM 347 N THR A 24 14.222 -11.504 1.009 1.00 0.00 N ATOM 348 CA THR A 24 14.830 -11.631 -0.279 1.00 0.00 C ATOM 349 C THR A 24 13.874 -11.378 -1.393 1.00 0.00 C ATOM 350 O THR A 24 12.657 -11.219 -1.307 1.00 0.00 O ATOM 351 CB THR A 24 15.487 -12.947 -0.575 1.00 0.00 C ATOM 352 OG1 THR A 24 14.549 -14.003 -0.430 1.00 0.00 O ATOM 353 CG2 THR A 24 16.745 -13.212 0.269 1.00 0.00 C ATOM 0 H THR A 24 13.925 -12.389 1.420 1.00 0.00 H new ATOM 0 HA THR A 24 15.606 -10.868 -0.224 1.00 0.00 H new ATOM 0 HB THR A 24 15.829 -12.900 -1.609 1.00 0.00 H new ATOM 0 HG1 THR A 24 14.169 -13.981 0.473 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.166 -14.181 0.001 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.482 -12.431 0.079 1.00 0.00 H new ATOM 0 HG23 THR A 24 16.480 -13.212 1.326 1.00 0.00 H new ATOM 361 N THR A 25 14.458 -11.111 -2.575 1.00 0.00 N ATOM 362 CA THR A 25 13.653 -10.807 -3.717 1.00 0.00 C ATOM 363 C THR A 25 12.897 -12.017 -4.147 1.00 0.00 C ATOM 364 O THR A 25 11.800 -11.950 -4.700 1.00 0.00 O ATOM 365 CB THR A 25 14.530 -10.436 -4.876 1.00 0.00 C ATOM 366 OG1 THR A 25 15.571 -11.371 -5.111 1.00 0.00 O ATOM 367 CG2 THR A 25 15.282 -9.130 -4.567 1.00 0.00 C ATOM 0 H THR A 25 15.465 -11.105 -2.739 1.00 0.00 H new ATOM 0 HA THR A 25 12.982 -9.993 -3.442 1.00 0.00 H new ATOM 0 HB THR A 25 13.856 -10.375 -5.730 1.00 0.00 H new ATOM 0 HG1 THR A 25 16.107 -11.078 -5.877 1.00 0.00 H new ATOM 0 HG21 THR A 25 15.917 -8.867 -5.413 1.00 0.00 H new ATOM 0 HG22 THR A 25 14.564 -8.330 -4.390 1.00 0.00 H new ATOM 0 HG23 THR A 25 15.899 -9.267 -3.679 1.00 0.00 H new ATOM 375 N LYS A 26 13.418 -13.209 -3.804 1.00 0.00 N ATOM 376 CA LYS A 26 12.781 -14.485 -3.895 1.00 0.00 C ATOM 377 C LYS A 26 11.598 -14.539 -2.990 1.00 0.00 C ATOM 378 O LYS A 26 10.566 -15.051 -3.420 1.00 0.00 O ATOM 379 CB LYS A 26 13.812 -15.552 -3.490 1.00 0.00 C ATOM 380 CG LYS A 26 14.841 -16.034 -4.515 1.00 0.00 C ATOM 381 CD LYS A 26 15.479 -17.336 -4.025 1.00 0.00 C ATOM 382 CE LYS A 26 16.475 -17.995 -4.982 1.00 0.00 C ATOM 383 NZ LYS A 26 17.690 -17.153 -4.901 1.00 0.00 N ATOM 0 H LYS A 26 14.365 -13.284 -3.432 1.00 0.00 H new ATOM 0 HA LYS A 26 12.430 -14.662 -4.912 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.362 -15.165 -2.632 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.259 -16.426 -3.146 1.00 0.00 H new ATOM 0 HG2 LYS A 26 14.361 -16.193 -5.481 1.00 0.00 H new ATOM 0 HG3 LYS A 26 15.608 -15.273 -4.661 1.00 0.00 H new ATOM 0 HD2 LYS A 26 15.989 -17.136 -3.083 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.683 -18.050 -3.812 1.00 0.00 H new ATOM 0 HE2 LYS A 26 16.686 -19.023 -4.688 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.084 -18.028 -5.999 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.985 -16.876 -5.859 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.485 -16.300 -4.342 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 18.455 -17.690 -4.445 1.00 0.00 H new ATOM 397 N GLU A 27 11.623 -13.976 -1.769 1.00 0.00 N ATOM 398 CA GLU A 27 10.523 -13.948 -0.855 1.00 0.00 C ATOM 399 C GLU A 27 9.354 -13.164 -1.345 1.00 0.00 C ATOM 400 O GLU A 27 8.178 -13.489 -1.190 1.00 0.00 O ATOM 401 CB GLU A 27 11.020 -13.593 0.556 1.00 0.00 C ATOM 402 CG GLU A 27 11.479 -14.828 1.333 1.00 0.00 C ATOM 403 CD GLU A 27 12.439 -14.450 2.452 1.00 0.00 C ATOM 404 OE1 GLU A 27 13.577 -14.046 2.091 1.00 0.00 O ATOM 405 OE2 GLU A 27 12.114 -14.587 3.662 1.00 0.00 O ATOM 0 H GLU A 27 12.455 -13.516 -1.400 1.00 0.00 H new ATOM 0 HA GLU A 27 10.104 -14.952 -0.787 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.845 -12.885 0.481 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.222 -13.095 1.106 1.00 0.00 H new ATOM 0 HG2 GLU A 27 10.613 -15.340 1.751 1.00 0.00 H new ATOM 0 HG3 GLU A 27 11.966 -15.528 0.654 1.00 0.00 H new ATOM 412 N LEU A 28 9.689 -12.082 -2.070 1.00 0.00 N ATOM 413 CA LEU A 28 8.818 -11.180 -2.756 1.00 0.00 C ATOM 414 C LEU A 28 8.289 -11.760 -4.022 1.00 0.00 C ATOM 415 O LEU A 28 7.102 -11.806 -4.343 1.00 0.00 O ATOM 416 CB LEU A 28 9.568 -9.867 -3.040 1.00 0.00 C ATOM 417 CG LEU A 28 10.092 -9.133 -1.794 1.00 0.00 C ATOM 418 CD1 LEU A 28 11.209 -8.136 -2.146 1.00 0.00 C ATOM 419 CD2 LEU A 28 8.943 -8.388 -1.094 1.00 0.00 C ATOM 0 H LEU A 28 10.667 -11.815 -2.185 1.00 0.00 H new ATOM 0 HA LEU A 28 7.959 -10.987 -2.114 1.00 0.00 H new ATOM 0 HB2 LEU A 28 10.411 -10.083 -3.697 1.00 0.00 H new ATOM 0 HB3 LEU A 28 8.903 -9.197 -3.585 1.00 0.00 H new ATOM 0 HG LEU A 28 10.507 -9.886 -1.124 1.00 0.00 H new ATOM 0 HD11 LEU A 28 11.552 -7.638 -1.239 1.00 0.00 H new ATOM 0 HD12 LEU A 28 12.042 -8.670 -2.604 1.00 0.00 H new ATOM 0 HD13 LEU A 28 10.826 -7.392 -2.845 1.00 0.00 H new ATOM 0 HD21 LEU A 28 9.327 -7.872 -0.214 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.510 -7.661 -1.780 1.00 0.00 H new ATOM 0 HD23 LEU A 28 8.177 -9.102 -0.791 1.00 0.00 H new ATOM 431 N GLY A 29 9.176 -12.404 -4.801 1.00 0.00 N ATOM 432 CA GLY A 29 8.859 -12.967 -6.077 1.00 0.00 C ATOM 433 C GLY A 29 7.919 -14.122 -6.125 1.00 0.00 C ATOM 434 O GLY A 29 7.142 -14.295 -7.063 1.00 0.00 O ATOM 0 H GLY A 29 10.151 -12.538 -4.532 1.00 0.00 H new ATOM 0 HA2 GLY A 29 8.442 -12.173 -6.697 1.00 0.00 H new ATOM 0 HA3 GLY A 29 9.793 -13.279 -6.544 1.00 0.00 H new ATOM 438 N THR A 30 8.023 -15.010 -5.120 1.00 0.00 N ATOM 439 CA THR A 30 7.084 -16.071 -4.928 1.00 0.00 C ATOM 440 C THR A 30 5.671 -15.657 -4.697 1.00 0.00 C ATOM 441 O THR A 30 4.724 -16.228 -5.236 1.00 0.00 O ATOM 442 CB THR A 30 7.404 -16.829 -3.673 1.00 0.00 C ATOM 443 OG1 THR A 30 8.725 -17.337 -3.787 1.00 0.00 O ATOM 444 CG2 THR A 30 6.454 -18.016 -3.440 1.00 0.00 C ATOM 0 H THR A 30 8.773 -14.991 -4.428 1.00 0.00 H new ATOM 0 HA THR A 30 7.169 -16.631 -5.860 1.00 0.00 H new ATOM 0 HB THR A 30 7.295 -16.143 -2.833 1.00 0.00 H new ATOM 0 HG1 THR A 30 9.367 -16.632 -3.563 1.00 0.00 H new ATOM 0 HG21 THR A 30 6.731 -18.529 -2.519 1.00 0.00 H new ATOM 0 HG22 THR A 30 5.430 -17.652 -3.359 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.527 -18.710 -4.277 1.00 0.00 H new ATOM 452 N VAL A 31 5.489 -14.585 -3.906 1.00 0.00 N ATOM 453 CA VAL A 31 4.210 -13.979 -3.703 1.00 0.00 C ATOM 454 C VAL A 31 3.526 -13.319 -4.851 1.00 0.00 C ATOM 455 O VAL A 31 2.381 -13.588 -5.211 1.00 0.00 O ATOM 456 CB VAL A 31 4.253 -12.984 -2.581 1.00 0.00 C ATOM 457 CG1 VAL A 31 2.861 -12.411 -2.267 1.00 0.00 C ATOM 458 CG2 VAL A 31 4.849 -13.615 -1.312 1.00 0.00 C ATOM 0 H VAL A 31 6.246 -14.130 -3.397 1.00 0.00 H new ATOM 0 HA VAL A 31 3.609 -14.863 -3.490 1.00 0.00 H new ATOM 0 HB VAL A 31 4.892 -12.164 -2.910 1.00 0.00 H new ATOM 0 HG11 VAL A 31 2.938 -11.695 -1.449 1.00 0.00 H new ATOM 0 HG12 VAL A 31 2.466 -11.911 -3.151 1.00 0.00 H new ATOM 0 HG13 VAL A 31 2.191 -13.221 -1.978 1.00 0.00 H new ATOM 0 HG21 VAL A 31 4.870 -12.874 -0.513 1.00 0.00 H new ATOM 0 HG22 VAL A 31 4.237 -14.463 -1.005 1.00 0.00 H new ATOM 0 HG23 VAL A 31 5.864 -13.956 -1.517 1.00 0.00 H new ATOM 468 N MET A 32 4.277 -12.445 -5.545 1.00 0.00 N ATOM 469 CA MET A 32 3.823 -11.627 -6.626 1.00 0.00 C ATOM 470 C MET A 32 3.293 -12.455 -7.746 1.00 0.00 C ATOM 471 O MET A 32 2.205 -12.263 -8.286 1.00 0.00 O ATOM 472 CB MET A 32 4.944 -10.713 -7.151 1.00 0.00 C ATOM 473 CG MET A 32 5.292 -9.602 -6.159 1.00 0.00 C ATOM 474 SD MET A 32 6.863 -8.787 -6.571 1.00 0.00 S ATOM 475 CE MET A 32 6.868 -7.358 -5.451 1.00 0.00 C ATOM 0 H MET A 32 5.265 -12.301 -5.337 1.00 0.00 H new ATOM 0 HA MET A 32 3.018 -11.005 -6.234 1.00 0.00 H new ATOM 0 HB2 MET A 32 5.833 -11.310 -7.353 1.00 0.00 H new ATOM 0 HB3 MET A 32 4.636 -10.270 -8.098 1.00 0.00 H new ATOM 0 HG2 MET A 32 4.492 -8.862 -6.148 1.00 0.00 H new ATOM 0 HG3 MET A 32 5.353 -10.020 -5.154 1.00 0.00 H new ATOM 0 HE1 MET A 32 7.778 -6.778 -5.605 1.00 0.00 H new ATOM 0 HE2 MET A 32 6.000 -6.732 -5.656 1.00 0.00 H new ATOM 0 HE3 MET A 32 6.829 -7.705 -4.418 1.00 0.00 H new ATOM 485 N ARG A 33 4.027 -13.535 -8.068 1.00 0.00 N ATOM 486 CA ARG A 33 3.762 -14.552 -9.038 1.00 0.00 C ATOM 487 C ARG A 33 2.580 -15.336 -8.580 1.00 0.00 C ATOM 488 O ARG A 33 1.849 -15.827 -9.439 1.00 0.00 O ATOM 489 CB ARG A 33 5.005 -15.411 -9.325 1.00 0.00 C ATOM 490 CG ARG A 33 4.953 -16.412 -10.481 1.00 0.00 C ATOM 491 CD ARG A 33 6.219 -17.270 -10.422 1.00 0.00 C ATOM 492 NE ARG A 33 7.448 -16.493 -10.748 1.00 0.00 N ATOM 493 CZ ARG A 33 8.527 -16.293 -9.936 1.00 0.00 C ATOM 494 NH1 ARG A 33 8.670 -16.889 -8.717 1.00 0.00 N ATOM 495 NH2 ARG A 33 9.386 -15.294 -10.293 1.00 0.00 N ATOM 0 H ARG A 33 4.910 -13.713 -7.589 1.00 0.00 H new ATOM 0 HA ARG A 33 3.520 -14.102 -10.001 1.00 0.00 H new ATOM 0 HB2 ARG A 33 5.839 -14.734 -9.510 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.241 -15.966 -8.417 1.00 0.00 H new ATOM 0 HG2 ARG A 33 4.064 -17.038 -10.403 1.00 0.00 H new ATOM 0 HG3 ARG A 33 4.891 -15.889 -11.435 1.00 0.00 H new ATOM 0 HD2 ARG A 33 6.318 -17.699 -9.425 1.00 0.00 H new ATOM 0 HD3 ARG A 33 6.123 -18.102 -11.119 1.00 0.00 H new ATOM 0 HE ARG A 33 7.487 -16.066 -11.674 1.00 0.00 H new ATOM 0 HH11 ARG A 33 7.948 -17.521 -8.371 1.00 0.00 H new ATOM 0 HH12 ARG A 33 9.499 -16.703 -8.152 1.00 0.00 H new ATOM 0 HH21 ARG A 33 9.205 -14.741 -11.131 1.00 0.00 H new ATOM 0 HH22 ARG A 33 10.209 -15.101 -9.722 1.00 0.00 H new ATOM 509 N SER A 34 2.371 -15.616 -7.281 1.00 0.00 N ATOM 510 CA SER A 34 1.271 -16.348 -6.733 1.00 0.00 C ATOM 511 C SER A 34 -0.004 -15.595 -6.896 1.00 0.00 C ATOM 512 O SER A 34 -1.071 -16.105 -7.234 1.00 0.00 O ATOM 513 CB SER A 34 1.340 -16.797 -5.263 1.00 0.00 C ATOM 514 OG SER A 34 2.356 -17.776 -5.110 1.00 0.00 O ATOM 0 H SER A 34 3.022 -15.306 -6.559 1.00 0.00 H new ATOM 0 HA SER A 34 1.324 -17.266 -7.319 1.00 0.00 H new ATOM 0 HB2 SER A 34 1.546 -15.941 -4.620 1.00 0.00 H new ATOM 0 HB3 SER A 34 0.378 -17.205 -4.952 1.00 0.00 H new ATOM 0 HG SER A 34 3.234 -17.341 -5.125 1.00 0.00 H new ATOM 520 N LEU A 35 0.054 -14.264 -6.715 1.00 0.00 N ATOM 521 CA LEU A 35 -0.968 -13.332 -7.077 1.00 0.00 C ATOM 522 C LEU A 35 -1.312 -13.305 -8.527 1.00 0.00 C ATOM 523 O LEU A 35 -2.399 -13.757 -8.886 1.00 0.00 O ATOM 524 CB LEU A 35 -0.650 -11.940 -6.504 1.00 0.00 C ATOM 525 CG LEU A 35 -0.552 -12.047 -4.973 1.00 0.00 C ATOM 526 CD1 LEU A 35 -0.073 -10.701 -4.406 1.00 0.00 C ATOM 527 CD2 LEU A 35 -1.934 -12.308 -4.350 1.00 0.00 C ATOM 0 H LEU A 35 0.864 -13.812 -6.290 1.00 0.00 H new ATOM 0 HA LEU A 35 -1.887 -13.693 -6.615 1.00 0.00 H new ATOM 0 HB2 LEU A 35 0.287 -11.566 -6.917 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -1.428 -11.230 -6.784 1.00 0.00 H new ATOM 0 HG LEU A 35 0.132 -12.863 -4.740 1.00 0.00 H new ATOM 0 HD11 LEU A 35 -0.001 -10.768 -3.320 1.00 0.00 H new ATOM 0 HD12 LEU A 35 0.906 -10.459 -4.820 1.00 0.00 H new ATOM 0 HD13 LEU A 35 -0.784 -9.919 -4.674 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.837 -12.380 -3.267 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -2.607 -11.488 -4.601 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -2.339 -13.242 -4.740 1.00 0.00 H new ATOM 539 N GLY A 36 -0.377 -12.870 -9.390 1.00 0.00 N ATOM 540 CA GLY A 36 -0.577 -12.938 -10.804 1.00 0.00 C ATOM 541 C GLY A 36 0.309 -12.233 -11.773 1.00 0.00 C ATOM 542 O GLY A 36 -0.116 -12.212 -12.927 1.00 0.00 O ATOM 0 H GLY A 36 0.518 -12.471 -9.108 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -0.554 -13.994 -11.072 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -1.590 -12.584 -10.993 1.00 0.00 H new ATOM 546 N GLN A 37 1.479 -11.676 -11.411 1.00 0.00 N ATOM 547 CA GLN A 37 2.331 -10.942 -12.294 1.00 0.00 C ATOM 548 C GLN A 37 3.728 -11.316 -11.937 1.00 0.00 C ATOM 549 O GLN A 37 4.092 -11.583 -10.792 1.00 0.00 O ATOM 550 CB GLN A 37 2.167 -9.413 -12.271 1.00 0.00 C ATOM 551 CG GLN A 37 2.529 -8.749 -10.940 1.00 0.00 C ATOM 552 CD GLN A 37 2.339 -7.239 -10.949 1.00 0.00 C ATOM 553 OE1 GLN A 37 2.045 -6.625 -11.974 1.00 0.00 O ATOM 554 NE2 GLN A 37 2.460 -6.575 -9.769 1.00 0.00 N ATOM 0 H GLN A 37 1.847 -11.740 -10.462 1.00 0.00 H new ATOM 0 HA GLN A 37 2.056 -11.211 -13.314 1.00 0.00 H new ATOM 0 HB2 GLN A 37 2.789 -8.983 -13.056 1.00 0.00 H new ATOM 0 HB3 GLN A 37 1.133 -9.169 -12.513 1.00 0.00 H new ATOM 0 HG2 GLN A 37 1.917 -9.181 -10.148 1.00 0.00 H new ATOM 0 HG3 GLN A 37 3.568 -8.976 -10.699 1.00 0.00 H new ATOM 0 HE21 GLN A 37 2.704 -7.085 -8.920 1.00 0.00 H new ATOM 0 HE22 GLN A 37 2.307 -5.567 -9.733 1.00 0.00 H new ATOM 563 N ASN A 38 4.592 -11.464 -12.958 1.00 0.00 N ATOM 564 CA ASN A 38 5.832 -12.175 -12.968 1.00 0.00 C ATOM 565 C ASN A 38 6.927 -11.182 -13.155 1.00 0.00 C ATOM 566 O ASN A 38 7.194 -10.948 -14.333 1.00 0.00 O ATOM 567 CB ASN A 38 5.734 -13.188 -14.121 1.00 0.00 C ATOM 568 CG ASN A 38 6.867 -14.202 -14.041 1.00 0.00 C ATOM 569 OD1 ASN A 38 7.446 -14.482 -12.993 1.00 0.00 O ATOM 570 ND2 ASN A 38 7.154 -14.827 -15.214 1.00 0.00 N ATOM 0 H ASN A 38 4.399 -11.042 -13.866 1.00 0.00 H new ATOM 0 HA ASN A 38 6.041 -12.713 -12.043 1.00 0.00 H new ATOM 0 HB2 ASN A 38 4.774 -13.703 -14.079 1.00 0.00 H new ATOM 0 HB3 ASN A 38 5.774 -12.665 -15.076 1.00 0.00 H new ATOM 0 HD21 ASN A 38 7.869 -15.553 -15.243 1.00 0.00 H new ATOM 0 HD22 ASN A 38 6.654 -14.569 -16.065 1.00 0.00 H new ATOM 577 N PRO A 39 7.564 -10.602 -12.181 1.00 0.00 N ATOM 578 CA PRO A 39 8.747 -9.820 -12.397 1.00 0.00 C ATOM 579 C PRO A 39 9.938 -10.697 -12.579 1.00 0.00 C ATOM 580 O PRO A 39 9.969 -11.780 -11.998 1.00 0.00 O ATOM 581 CB PRO A 39 8.880 -9.061 -11.079 1.00 0.00 C ATOM 582 CG PRO A 39 8.289 -9.988 -10.005 1.00 0.00 C ATOM 583 CD PRO A 39 7.126 -10.609 -10.794 1.00 0.00 C ATOM 0 HA PRO A 39 8.686 -9.188 -13.283 1.00 0.00 H new ATOM 0 HB2 PRO A 39 9.923 -8.828 -10.865 1.00 0.00 H new ATOM 0 HB3 PRO A 39 8.343 -8.113 -11.117 1.00 0.00 H new ATOM 0 HG2 PRO A 39 9.004 -10.735 -9.661 1.00 0.00 H new ATOM 0 HG3 PRO A 39 7.950 -9.442 -9.125 1.00 0.00 H new ATOM 0 HD2 PRO A 39 6.914 -11.622 -10.452 1.00 0.00 H new ATOM 0 HD3 PRO A 39 6.210 -10.032 -10.667 1.00 0.00 H new ATOM 591 N THR A 40 10.975 -10.236 -13.301 1.00 0.00 N ATOM 592 CA THR A 40 12.335 -10.678 -13.306 1.00 0.00 C ATOM 593 C THR A 40 13.249 -10.329 -12.182 1.00 0.00 C ATOM 594 O THR A 40 13.096 -9.291 -11.540 1.00 0.00 O ATOM 595 CB THR A 40 13.062 -10.343 -14.574 1.00 0.00 C ATOM 596 OG1 THR A 40 13.422 -8.984 -14.774 1.00 0.00 O ATOM 597 CG2 THR A 40 12.249 -10.748 -15.815 1.00 0.00 C ATOM 0 H THR A 40 10.841 -9.465 -13.955 1.00 0.00 H new ATOM 0 HA THR A 40 12.131 -11.742 -13.184 1.00 0.00 H new ATOM 0 HB THR A 40 13.983 -10.913 -14.450 1.00 0.00 H new ATOM 0 HG1 THR A 40 12.625 -8.419 -14.692 1.00 0.00 H new ATOM 0 HG21 THR A 40 12.807 -10.490 -16.715 1.00 0.00 H new ATOM 0 HG22 THR A 40 12.067 -11.823 -15.796 1.00 0.00 H new ATOM 0 HG23 THR A 40 11.296 -10.219 -15.814 1.00 0.00 H new ATOM 605 N GLU A 41 14.168 -11.239 -11.815 1.00 0.00 N ATOM 606 CA GLU A 41 15.018 -11.017 -10.686 1.00 0.00 C ATOM 607 C GLU A 41 15.901 -9.840 -10.918 1.00 0.00 C ATOM 608 O GLU A 41 16.338 -9.197 -9.965 1.00 0.00 O ATOM 609 CB GLU A 41 15.960 -12.231 -10.621 1.00 0.00 C ATOM 610 CG GLU A 41 16.820 -12.258 -9.356 1.00 0.00 C ATOM 611 CD GLU A 41 17.467 -13.596 -9.030 1.00 0.00 C ATOM 612 OE1 GLU A 41 16.732 -14.470 -8.496 1.00 0.00 O ATOM 613 OE2 GLU A 41 18.683 -13.808 -9.286 1.00 0.00 O ATOM 0 H GLU A 41 14.323 -12.125 -12.297 1.00 0.00 H new ATOM 0 HA GLU A 41 14.413 -10.864 -9.792 1.00 0.00 H new ATOM 0 HB2 GLU A 41 15.368 -13.145 -10.670 1.00 0.00 H new ATOM 0 HB3 GLU A 41 16.611 -12.225 -11.495 1.00 0.00 H new ATOM 0 HG2 GLU A 41 17.606 -11.509 -9.456 1.00 0.00 H new ATOM 0 HG3 GLU A 41 16.201 -11.958 -8.511 1.00 0.00 H new ATOM 620 N ALA A 42 16.182 -9.577 -12.207 1.00 0.00 N ATOM 621 CA ALA A 42 16.758 -8.337 -12.627 1.00 0.00 C ATOM 622 C ALA A 42 16.115 -7.061 -12.203 1.00 0.00 C ATOM 623 O ALA A 42 16.669 -6.255 -11.457 1.00 0.00 O ATOM 624 CB ALA A 42 16.729 -8.345 -14.164 1.00 0.00 C ATOM 0 H ALA A 42 16.007 -10.233 -12.968 1.00 0.00 H new ATOM 0 HA ALA A 42 17.735 -8.319 -12.144 1.00 0.00 H new ATOM 0 HB1 ALA A 42 17.159 -7.417 -14.541 1.00 0.00 H new ATOM 0 HB2 ALA A 42 17.309 -9.190 -14.534 1.00 0.00 H new ATOM 0 HB3 ALA A 42 15.698 -8.433 -14.508 1.00 0.00 H new ATOM 630 N GLU A 43 14.825 -6.864 -12.528 1.00 0.00 N ATOM 631 CA GLU A 43 14.050 -5.748 -12.084 1.00 0.00 C ATOM 632 C GLU A 43 13.887 -5.594 -10.611 1.00 0.00 C ATOM 633 O GLU A 43 14.094 -4.578 -9.951 1.00 0.00 O ATOM 634 CB GLU A 43 12.760 -5.644 -12.916 1.00 0.00 C ATOM 635 CG GLU A 43 11.528 -6.461 -12.523 1.00 0.00 C ATOM 636 CD GLU A 43 10.610 -6.693 -13.715 1.00 0.00 C ATOM 637 OE1 GLU A 43 11.002 -7.608 -14.487 1.00 0.00 O ATOM 638 OE2 GLU A 43 9.576 -5.998 -13.902 1.00 0.00 O ATOM 0 H GLU A 43 14.302 -7.507 -13.123 1.00 0.00 H new ATOM 0 HA GLU A 43 14.643 -4.856 -12.285 1.00 0.00 H new ATOM 0 HB2 GLU A 43 12.464 -4.595 -12.925 1.00 0.00 H new ATOM 0 HB3 GLU A 43 13.013 -5.913 -13.942 1.00 0.00 H new ATOM 0 HG2 GLU A 43 11.842 -7.420 -12.112 1.00 0.00 H new ATOM 0 HG3 GLU A 43 10.981 -5.941 -11.737 1.00 0.00 H new ATOM 645 N LEU A 44 13.579 -6.720 -9.942 1.00 0.00 N ATOM 646 CA LEU A 44 13.215 -6.744 -8.560 1.00 0.00 C ATOM 647 C LEU A 44 14.419 -6.542 -7.706 1.00 0.00 C ATOM 648 O LEU A 44 14.468 -5.747 -6.769 1.00 0.00 O ATOM 649 CB LEU A 44 12.565 -8.107 -8.269 1.00 0.00 C ATOM 650 CG LEU A 44 11.809 -8.188 -6.932 1.00 0.00 C ATOM 651 CD1 LEU A 44 10.661 -7.186 -6.718 1.00 0.00 C ATOM 652 CD2 LEU A 44 11.241 -9.615 -6.860 1.00 0.00 C ATOM 0 H LEU A 44 13.584 -7.643 -10.377 1.00 0.00 H new ATOM 0 HA LEU A 44 12.514 -5.940 -8.336 1.00 0.00 H new ATOM 0 HB2 LEU A 44 11.873 -8.344 -9.077 1.00 0.00 H new ATOM 0 HB3 LEU A 44 13.340 -8.873 -8.279 1.00 0.00 H new ATOM 0 HG LEU A 44 12.523 -7.931 -6.150 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.213 -7.350 -5.738 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.050 -6.169 -6.773 1.00 0.00 H new ATOM 0 HD13 LEU A 44 9.906 -7.328 -7.491 1.00 0.00 H new ATOM 0 HD21 LEU A 44 10.689 -9.740 -5.929 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.572 -9.783 -7.704 1.00 0.00 H new ATOM 0 HD23 LEU A 44 12.059 -10.334 -6.896 1.00 0.00 H new ATOM 664 N GLN A 45 15.558 -7.172 -8.047 1.00 0.00 N ATOM 665 CA GLN A 45 16.809 -6.903 -7.410 1.00 0.00 C ATOM 666 C GLN A 45 17.277 -5.504 -7.622 1.00 0.00 C ATOM 667 O GLN A 45 17.595 -4.840 -6.637 1.00 0.00 O ATOM 668 CB GLN A 45 17.892 -7.968 -7.650 1.00 0.00 C ATOM 669 CG GLN A 45 19.076 -7.873 -6.685 1.00 0.00 C ATOM 670 CD GLN A 45 18.672 -8.086 -5.233 1.00 0.00 C ATOM 671 OE1 GLN A 45 18.446 -9.210 -4.787 1.00 0.00 O ATOM 672 NE2 GLN A 45 18.679 -6.982 -4.440 1.00 0.00 N ATOM 0 H GLN A 45 15.610 -7.881 -8.778 1.00 0.00 H new ATOM 0 HA GLN A 45 16.604 -6.986 -6.343 1.00 0.00 H new ATOM 0 HB2 GLN A 45 17.442 -8.957 -7.562 1.00 0.00 H new ATOM 0 HB3 GLN A 45 18.260 -7.875 -8.672 1.00 0.00 H new ATOM 0 HG2 GLN A 45 19.825 -8.615 -6.962 1.00 0.00 H new ATOM 0 HG3 GLN A 45 19.545 -6.894 -6.787 1.00 0.00 H new ATOM 0 HE21 GLN A 45 18.870 -6.065 -4.844 1.00 0.00 H new ATOM 0 HE22 GLN A 45 18.493 -7.070 -3.441 1.00 0.00 H new ATOM 681 N ASP A 46 17.261 -4.970 -8.856 1.00 0.00 N ATOM 682 CA ASP A 46 17.621 -3.619 -9.157 1.00 0.00 C ATOM 683 C ASP A 46 16.992 -2.591 -8.281 1.00 0.00 C ATOM 684 O ASP A 46 17.584 -1.615 -7.823 1.00 0.00 O ATOM 685 CB ASP A 46 17.478 -3.210 -10.633 1.00 0.00 C ATOM 686 CG ASP A 46 18.276 -1.930 -10.833 1.00 0.00 C ATOM 687 OD1 ASP A 46 19.531 -1.930 -10.723 1.00 0.00 O ATOM 688 OD2 ASP A 46 17.663 -0.945 -11.325 1.00 0.00 O ATOM 0 H ASP A 46 16.985 -5.503 -9.680 1.00 0.00 H new ATOM 0 HA ASP A 46 18.688 -3.635 -8.933 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.849 -3.999 -11.287 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.430 -3.052 -10.887 1.00 0.00 H new ATOM 693 N MET A 47 15.668 -2.688 -8.065 1.00 0.00 N ATOM 694 CA MET A 47 14.825 -1.912 -7.210 1.00 0.00 C ATOM 695 C MET A 47 15.262 -2.077 -5.795 1.00 0.00 C ATOM 696 O MET A 47 15.426 -1.052 -5.136 1.00 0.00 O ATOM 697 CB MET A 47 13.329 -2.222 -7.389 1.00 0.00 C ATOM 698 CG MET A 47 12.798 -1.706 -8.729 1.00 0.00 C ATOM 699 SD MET A 47 10.988 -1.597 -8.860 1.00 0.00 S ATOM 700 CE MET A 47 10.714 -3.383 -9.040 1.00 0.00 C ATOM 0 H MET A 47 15.125 -3.401 -8.553 1.00 0.00 H new ATOM 0 HA MET A 47 14.935 -0.866 -7.498 1.00 0.00 H new ATOM 0 HB2 MET A 47 13.171 -3.299 -7.326 1.00 0.00 H new ATOM 0 HB3 MET A 47 12.764 -1.768 -6.575 1.00 0.00 H new ATOM 0 HG2 MET A 47 13.219 -0.717 -8.911 1.00 0.00 H new ATOM 0 HG3 MET A 47 13.164 -2.359 -9.521 1.00 0.00 H new ATOM 0 HE1 MET A 47 9.664 -3.569 -9.264 1.00 0.00 H new ATOM 0 HE2 MET A 47 11.332 -3.766 -9.852 1.00 0.00 H new ATOM 0 HE3 MET A 47 10.982 -3.888 -8.112 1.00 0.00 H new ATOM 710 N ILE A 48 15.428 -3.332 -5.340 1.00 0.00 N ATOM 711 CA ILE A 48 15.755 -3.651 -3.985 1.00 0.00 C ATOM 712 C ILE A 48 17.111 -3.105 -3.696 1.00 0.00 C ATOM 713 O ILE A 48 17.333 -2.628 -2.584 1.00 0.00 O ATOM 714 CB ILE A 48 15.460 -5.080 -3.637 1.00 0.00 C ATOM 715 CG1 ILE A 48 13.947 -5.357 -3.612 1.00 0.00 C ATOM 716 CG2 ILE A 48 16.195 -5.445 -2.337 1.00 0.00 C ATOM 717 CD1 ILE A 48 13.089 -4.623 -2.582 1.00 0.00 C ATOM 0 H ILE A 48 15.331 -4.154 -5.937 1.00 0.00 H new ATOM 0 HA ILE A 48 15.094 -3.156 -3.274 1.00 0.00 H new ATOM 0 HB ILE A 48 15.841 -5.741 -4.415 1.00 0.00 H new ATOM 0 HG12 ILE A 48 13.551 -5.124 -4.600 1.00 0.00 H new ATOM 0 HG13 ILE A 48 13.808 -6.427 -3.457 1.00 0.00 H new ATOM 0 HG21 ILE A 48 15.984 -6.483 -2.079 1.00 0.00 H new ATOM 0 HG22 ILE A 48 17.268 -5.317 -2.478 1.00 0.00 H new ATOM 0 HG23 ILE A 48 15.854 -4.795 -1.531 1.00 0.00 H new ATOM 0 HD11 ILE A 48 12.048 -4.926 -2.693 1.00 0.00 H new ATOM 0 HD12 ILE A 48 13.434 -4.871 -1.578 1.00 0.00 H new ATOM 0 HD13 ILE A 48 13.172 -3.548 -2.739 1.00 0.00 H new ATOM 729 N ASN A 49 18.036 -2.927 -4.656 1.00 0.00 N ATOM 730 CA ASN A 49 19.302 -2.272 -4.538 1.00 0.00 C ATOM 731 C ASN A 49 19.111 -0.837 -4.183 1.00 0.00 C ATOM 732 O ASN A 49 19.885 -0.311 -3.385 1.00 0.00 O ATOM 733 CB ASN A 49 20.122 -2.470 -5.824 1.00 0.00 C ATOM 734 CG ASN A 49 20.444 -3.939 -6.060 1.00 0.00 C ATOM 735 OD1 ASN A 49 20.340 -4.891 -5.289 1.00 0.00 O ATOM 736 ND2 ASN A 49 20.967 -4.141 -7.299 1.00 0.00 N ATOM 0 H ASN A 49 17.881 -3.275 -5.602 1.00 0.00 H new ATOM 0 HA ASN A 49 19.875 -2.721 -3.726 1.00 0.00 H new ATOM 0 HB2 ASN A 49 19.566 -2.077 -6.675 1.00 0.00 H new ATOM 0 HB3 ASN A 49 21.048 -1.900 -5.757 1.00 0.00 H new ATOM 0 HD21 ASN A 49 21.268 -5.074 -7.580 1.00 0.00 H new ATOM 0 HD22 ASN A 49 21.058 -3.359 -7.948 1.00 0.00 H new ATOM 743 N GLU A 50 18.075 -0.125 -4.663 1.00 0.00 N ATOM 744 CA GLU A 50 17.907 1.281 -4.463 1.00 0.00 C ATOM 745 C GLU A 50 17.233 1.530 -3.158 1.00 0.00 C ATOM 746 O GLU A 50 17.255 2.614 -2.578 1.00 0.00 O ATOM 747 CB GLU A 50 17.184 2.062 -5.574 1.00 0.00 C ATOM 748 CG GLU A 50 17.979 2.098 -6.881 1.00 0.00 C ATOM 749 CD GLU A 50 17.357 3.016 -7.923 1.00 0.00 C ATOM 750 OE1 GLU A 50 17.125 4.239 -7.727 1.00 0.00 O ATOM 751 OE2 GLU A 50 17.173 2.509 -9.061 1.00 0.00 O ATOM 0 H GLU A 50 17.325 -0.546 -5.212 1.00 0.00 H new ATOM 0 HA GLU A 50 18.925 1.671 -4.481 1.00 0.00 H new ATOM 0 HB2 GLU A 50 16.210 1.608 -5.758 1.00 0.00 H new ATOM 0 HB3 GLU A 50 17.001 3.082 -5.236 1.00 0.00 H new ATOM 0 HG2 GLU A 50 18.997 2.428 -6.673 1.00 0.00 H new ATOM 0 HG3 GLU A 50 18.048 1.089 -7.287 1.00 0.00 H new ATOM 758 N VAL A 51 16.524 0.501 -2.660 1.00 0.00 N ATOM 759 CA VAL A 51 15.877 0.438 -1.387 1.00 0.00 C ATOM 760 C VAL A 51 16.814 0.011 -0.310 1.00 0.00 C ATOM 761 O VAL A 51 16.556 0.286 0.861 1.00 0.00 O ATOM 762 CB VAL A 51 14.601 -0.350 -1.356 1.00 0.00 C ATOM 763 CG1 VAL A 51 13.809 -0.251 -0.042 1.00 0.00 C ATOM 764 CG2 VAL A 51 13.673 0.181 -2.461 1.00 0.00 C ATOM 0 H VAL A 51 16.394 -0.358 -3.195 1.00 0.00 H new ATOM 0 HA VAL A 51 15.568 1.465 -1.190 1.00 0.00 H new ATOM 0 HB VAL A 51 14.899 -1.391 -1.484 1.00 0.00 H new ATOM 0 HG11 VAL A 51 12.904 -0.854 -0.116 1.00 0.00 H new ATOM 0 HG12 VAL A 51 14.422 -0.618 0.781 1.00 0.00 H new ATOM 0 HG13 VAL A 51 13.538 0.789 0.142 1.00 0.00 H new ATOM 0 HG21 VAL A 51 12.739 -0.381 -2.453 1.00 0.00 H new ATOM 0 HG22 VAL A 51 13.463 1.236 -2.284 1.00 0.00 H new ATOM 0 HG23 VAL A 51 14.158 0.065 -3.430 1.00 0.00 H new ATOM 774 N ASP A 52 17.877 -0.778 -0.548 1.00 0.00 N ATOM 775 CA ASP A 52 18.887 -1.236 0.354 1.00 0.00 C ATOM 776 C ASP A 52 19.874 -0.168 0.682 1.00 0.00 C ATOM 777 O ASP A 52 20.420 0.466 -0.219 1.00 0.00 O ATOM 778 CB ASP A 52 19.592 -2.426 -0.318 1.00 0.00 C ATOM 779 CG ASP A 52 20.627 -2.999 0.639 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.449 -3.151 1.877 1.00 0.00 O ATOM 781 OD2 ASP A 52 21.675 -3.374 0.049 1.00 0.00 O ATOM 0 H ASP A 52 18.045 -1.136 -1.488 1.00 0.00 H new ATOM 0 HA ASP A 52 18.426 -1.529 1.298 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.864 -3.191 -0.586 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.072 -2.105 -1.242 1.00 0.00 H new ATOM 786 N ALA A 53 20.118 0.016 1.992 1.00 0.00 N ATOM 787 CA ALA A 53 21.060 0.945 2.535 1.00 0.00 C ATOM 788 C ALA A 53 22.391 0.312 2.753 1.00 0.00 C ATOM 789 O ALA A 53 23.406 1.001 2.840 1.00 0.00 O ATOM 790 CB ALA A 53 20.501 1.522 3.846 1.00 0.00 C ATOM 0 H ALA A 53 19.629 -0.515 2.713 1.00 0.00 H new ATOM 0 HA ALA A 53 21.209 1.753 1.819 1.00 0.00 H new ATOM 0 HB1 ALA A 53 21.215 2.231 4.265 1.00 0.00 H new ATOM 0 HB2 ALA A 53 19.558 2.031 3.647 1.00 0.00 H new ATOM 0 HB3 ALA A 53 20.333 0.713 4.557 1.00 0.00 H new ATOM 796 N ASP A 54 22.440 -1.024 2.901 1.00 0.00 N ATOM 797 CA ASP A 54 23.664 -1.717 3.157 1.00 0.00 C ATOM 798 C ASP A 54 24.574 -1.764 1.978 1.00 0.00 C ATOM 799 O ASP A 54 25.680 -1.232 2.063 1.00 0.00 O ATOM 800 CB ASP A 54 23.414 -3.146 3.669 1.00 0.00 C ATOM 801 CG ASP A 54 22.695 -3.187 5.010 1.00 0.00 C ATOM 802 OD1 ASP A 54 23.204 -2.625 6.016 1.00 0.00 O ATOM 803 OD2 ASP A 54 21.547 -3.705 5.041 1.00 0.00 O ATOM 0 H ASP A 54 21.622 -1.630 2.842 1.00 0.00 H new ATOM 0 HA ASP A 54 24.161 -1.137 3.934 1.00 0.00 H new ATOM 0 HB2 ASP A 54 22.825 -3.691 2.932 1.00 0.00 H new ATOM 0 HB3 ASP A 54 24.369 -3.664 3.760 1.00 0.00 H new ATOM 808 N GLY A 55 24.173 -2.366 0.844 1.00 0.00 N ATOM 809 CA GLY A 55 24.958 -2.914 -0.218 1.00 0.00 C ATOM 810 C GLY A 55 24.970 -4.403 -0.280 1.00 0.00 C ATOM 811 O GLY A 55 25.809 -4.996 -0.956 1.00 0.00 O ATOM 0 H GLY A 55 23.178 -2.480 0.653 1.00 0.00 H new ATOM 0 HA2 GLY A 55 24.583 -2.528 -1.166 1.00 0.00 H new ATOM 0 HA3 GLY A 55 25.984 -2.560 -0.113 1.00 0.00 H new ATOM 815 N ASN A 56 23.994 -5.093 0.338 1.00 0.00 N ATOM 816 CA ASN A 56 23.826 -6.511 0.398 1.00 0.00 C ATOM 817 C ASN A 56 22.679 -6.969 -0.436 1.00 0.00 C ATOM 818 O ASN A 56 22.793 -8.029 -1.049 1.00 0.00 O ATOM 819 CB ASN A 56 23.725 -6.999 1.854 1.00 0.00 C ATOM 820 CG ASN A 56 22.520 -6.435 2.593 1.00 0.00 C ATOM 821 OD1 ASN A 56 21.524 -5.918 2.089 1.00 0.00 O ATOM 822 ND2 ASN A 56 22.523 -6.706 3.926 1.00 0.00 N ATOM 0 H ASN A 56 23.253 -4.608 0.843 1.00 0.00 H new ATOM 0 HA ASN A 56 24.718 -6.968 -0.030 1.00 0.00 H new ATOM 0 HB2 ASN A 56 23.672 -8.088 1.863 1.00 0.00 H new ATOM 0 HB3 ASN A 56 24.634 -6.720 2.388 1.00 0.00 H new ATOM 0 HD21 ASN A 56 21.706 -6.481 4.494 1.00 0.00 H new ATOM 0 HD22 ASN A 56 23.342 -7.135 4.357 1.00 0.00 H new ATOM 829 N GLY A 57 21.615 -6.181 -0.673 1.00 0.00 N ATOM 830 CA GLY A 57 20.582 -6.552 -1.589 1.00 0.00 C ATOM 831 C GLY A 57 19.510 -7.408 -1.009 1.00 0.00 C ATOM 832 O GLY A 57 18.866 -8.205 -1.691 1.00 0.00 O ATOM 0 H GLY A 57 21.470 -5.277 -0.224 1.00 0.00 H new ATOM 0 HA2 GLY A 57 20.127 -5.645 -1.988 1.00 0.00 H new ATOM 0 HA3 GLY A 57 21.033 -7.079 -2.430 1.00 0.00 H new ATOM 836 N THR A 58 19.240 -7.233 0.297 1.00 0.00 N ATOM 837 CA THR A 58 18.097 -7.702 1.018 1.00 0.00 C ATOM 838 C THR A 58 17.571 -6.521 1.758 1.00 0.00 C ATOM 839 O THR A 58 18.238 -5.606 2.238 1.00 0.00 O ATOM 840 CB THR A 58 18.182 -8.877 1.947 1.00 0.00 C ATOM 841 OG1 THR A 58 19.179 -8.731 2.947 1.00 0.00 O ATOM 842 CG2 THR A 58 18.511 -10.134 1.124 1.00 0.00 C ATOM 0 H THR A 58 19.880 -6.717 0.901 1.00 0.00 H new ATOM 0 HA THR A 58 17.461 -8.129 0.243 1.00 0.00 H new ATOM 0 HB THR A 58 17.219 -8.954 2.451 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.185 -9.525 3.521 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.576 -10.997 1.787 1.00 0.00 H new ATOM 0 HG22 THR A 58 17.726 -10.302 0.386 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.464 -9.996 0.614 1.00 0.00 H new ATOM 850 N ILE A 59 16.236 -6.559 1.915 1.00 0.00 N ATOM 851 CA ILE A 59 15.541 -5.436 2.465 1.00 0.00 C ATOM 852 C ILE A 59 15.135 -5.812 3.849 1.00 0.00 C ATOM 853 O ILE A 59 14.727 -6.948 4.083 1.00 0.00 O ATOM 854 CB ILE A 59 14.364 -4.938 1.681 1.00 0.00 C ATOM 855 CG1 ILE A 59 13.730 -3.658 2.253 1.00 0.00 C ATOM 856 CG2 ILE A 59 13.317 -6.053 1.517 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.493 -3.186 1.491 1.00 0.00 C ATOM 0 H ILE A 59 15.645 -7.353 1.666 1.00 0.00 H new ATOM 0 HA ILE A 59 16.227 -4.590 2.440 1.00 0.00 H new ATOM 0 HB ILE A 59 14.747 -4.658 0.700 1.00 0.00 H new ATOM 0 HG12 ILE A 59 13.459 -3.833 3.294 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.474 -2.862 2.247 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.469 -5.675 0.946 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.763 -6.896 0.989 1.00 0.00 H new ATOM 0 HG23 ILE A 59 12.976 -6.379 2.500 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.104 -2.279 1.955 1.00 0.00 H new ATOM 0 HD12 ILE A 59 12.761 -2.978 0.455 1.00 0.00 H new ATOM 0 HD13 ILE A 59 11.730 -3.964 1.519 1.00 0.00 H new ATOM 869 N ASP A 60 15.272 -4.874 4.803 1.00 0.00 N ATOM 870 CA ASP A 60 15.125 -4.866 6.226 1.00 0.00 C ATOM 871 C ASP A 60 13.957 -4.010 6.577 1.00 0.00 C ATOM 872 O ASP A 60 13.407 -3.240 5.791 1.00 0.00 O ATOM 873 CB ASP A 60 16.366 -4.384 6.996 1.00 0.00 C ATOM 874 CG ASP A 60 17.613 -5.029 6.410 1.00 0.00 C ATOM 875 OD1 ASP A 60 17.670 -6.277 6.240 1.00 0.00 O ATOM 876 OD2 ASP A 60 18.557 -4.260 6.086 1.00 0.00 O ATOM 0 H ASP A 60 15.540 -3.937 4.503 1.00 0.00 H new ATOM 0 HA ASP A 60 14.977 -5.902 6.530 1.00 0.00 H new ATOM 0 HB2 ASP A 60 16.444 -3.298 6.937 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.274 -4.640 8.051 1.00 0.00 H new ATOM 881 N PHE A 61 13.528 -4.036 7.851 1.00 0.00 N ATOM 882 CA PHE A 61 12.644 -3.083 8.448 1.00 0.00 C ATOM 883 C PHE A 61 12.907 -1.619 8.360 1.00 0.00 C ATOM 884 O PHE A 61 11.949 -0.968 7.948 1.00 0.00 O ATOM 885 CB PHE A 61 12.135 -3.602 9.803 1.00 0.00 C ATOM 886 CG PHE A 61 10.975 -2.772 10.236 1.00 0.00 C ATOM 887 CD1 PHE A 61 9.742 -2.924 9.645 1.00 0.00 C ATOM 888 CD2 PHE A 61 11.098 -2.010 11.373 1.00 0.00 C ATOM 889 CE1 PHE A 61 8.694 -2.161 10.103 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.066 -1.194 11.774 1.00 0.00 C ATOM 891 CZ PHE A 61 8.832 -1.320 11.182 1.00 0.00 C ATOM 0 H PHE A 61 13.815 -4.766 8.503 1.00 0.00 H new ATOM 0 HA PHE A 61 11.823 -3.045 7.731 1.00 0.00 H new ATOM 0 HB2 PHE A 61 11.839 -4.648 9.719 1.00 0.00 H new ATOM 0 HB3 PHE A 61 12.930 -3.555 10.547 1.00 0.00 H new ATOM 0 HD1 PHE A 61 9.600 -3.628 8.838 1.00 0.00 H new ATOM 0 HD2 PHE A 61 12.008 -2.052 11.953 1.00 0.00 H new ATOM 0 HE1 PHE A 61 7.739 -2.224 9.603 1.00 0.00 H new ATOM 0 HE2 PHE A 61 10.224 -0.459 12.549 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.984 -0.767 11.558 1.00 0.00 H new ATOM 901 N PRO A 62 14.064 -1.082 8.611 1.00 0.00 N ATOM 902 CA PRO A 62 14.211 0.334 8.438 1.00 0.00 C ATOM 903 C PRO A 62 14.376 0.769 7.022 1.00 0.00 C ATOM 904 O PRO A 62 14.413 1.978 6.798 1.00 0.00 O ATOM 905 CB PRO A 62 15.476 0.650 9.233 1.00 0.00 C ATOM 906 CG PRO A 62 16.281 -0.658 9.178 1.00 0.00 C ATOM 907 CD PRO A 62 15.174 -1.717 9.305 1.00 0.00 C ATOM 0 HA PRO A 62 13.314 0.858 8.769 1.00 0.00 H new ATOM 0 HB2 PRO A 62 16.029 1.479 8.791 1.00 0.00 H new ATOM 0 HB3 PRO A 62 15.243 0.933 10.259 1.00 0.00 H new ATOM 0 HG2 PRO A 62 16.836 -0.757 8.245 1.00 0.00 H new ATOM 0 HG3 PRO A 62 17.006 -0.726 9.989 1.00 0.00 H new ATOM 0 HD2 PRO A 62 15.458 -2.661 8.841 1.00 0.00 H new ATOM 0 HD3 PRO A 62 14.934 -1.933 10.346 1.00 0.00 H new ATOM 915 N GLU A 63 14.384 -0.168 6.058 1.00 0.00 N ATOM 916 CA GLU A 63 14.521 0.152 4.671 1.00 0.00 C ATOM 917 C GLU A 63 13.145 0.138 4.098 1.00 0.00 C ATOM 918 O GLU A 63 12.677 1.119 3.522 1.00 0.00 O ATOM 919 CB GLU A 63 15.500 -0.787 3.947 1.00 0.00 C ATOM 920 CG GLU A 63 16.945 -0.645 4.430 1.00 0.00 C ATOM 921 CD GLU A 63 17.846 -1.807 4.036 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.352 -2.953 3.859 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.092 -1.658 4.147 1.00 0.00 O ATOM 0 H GLU A 63 14.294 -1.167 6.245 1.00 0.00 H new ATOM 0 HA GLU A 63 14.967 1.137 4.537 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.176 -1.818 4.090 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.461 -0.586 2.876 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.363 0.278 4.028 1.00 0.00 H new ATOM 0 HG3 GLU A 63 16.947 -0.549 5.516 1.00 0.00 H new ATOM 930 N PHE A 64 12.365 -0.930 4.340 1.00 0.00 N ATOM 931 CA PHE A 64 10.944 -1.057 4.233 1.00 0.00 C ATOM 932 C PHE A 64 10.222 0.100 4.834 1.00 0.00 C ATOM 933 O PHE A 64 9.463 0.766 4.132 1.00 0.00 O ATOM 934 CB PHE A 64 10.509 -2.417 4.803 1.00 0.00 C ATOM 935 CG PHE A 64 9.111 -2.827 4.492 1.00 0.00 C ATOM 936 CD1 PHE A 64 8.708 -3.085 3.204 1.00 0.00 C ATOM 937 CD2 PHE A 64 8.141 -2.744 5.463 1.00 0.00 C ATOM 938 CE1 PHE A 64 7.371 -3.136 2.887 1.00 0.00 C ATOM 939 CE2 PHE A 64 6.832 -3.043 5.167 1.00 0.00 C ATOM 940 CZ PHE A 64 6.406 -3.178 3.866 1.00 0.00 C ATOM 0 H PHE A 64 12.784 -1.808 4.647 1.00 0.00 H new ATOM 0 HA PHE A 64 10.664 -1.033 3.180 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.186 -3.183 4.425 1.00 0.00 H new ATOM 0 HB3 PHE A 64 10.629 -2.392 5.886 1.00 0.00 H new ATOM 0 HD1 PHE A 64 9.448 -3.249 2.434 1.00 0.00 H new ATOM 0 HD2 PHE A 64 8.409 -2.442 6.465 1.00 0.00 H new ATOM 0 HE1 PHE A 64 7.073 -3.143 1.849 1.00 0.00 H new ATOM 0 HE2 PHE A 64 6.124 -3.174 5.972 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.362 -3.311 3.624 1.00 0.00 H new ATOM 950 N LEU A 65 10.335 0.387 6.143 1.00 0.00 N ATOM 951 CA LEU A 65 9.720 1.481 6.828 1.00 0.00 C ATOM 952 C LEU A 65 9.978 2.813 6.213 1.00 0.00 C ATOM 953 O LEU A 65 9.078 3.610 5.955 1.00 0.00 O ATOM 954 CB LEU A 65 10.143 1.408 8.305 1.00 0.00 C ATOM 955 CG LEU A 65 9.877 2.583 9.261 1.00 0.00 C ATOM 956 CD1 LEU A 65 8.371 2.897 9.263 1.00 0.00 C ATOM 957 CD2 LEU A 65 10.353 2.410 10.713 1.00 0.00 C ATOM 0 H LEU A 65 10.899 -0.189 6.768 1.00 0.00 H new ATOM 0 HA LEU A 65 8.638 1.381 6.744 1.00 0.00 H new ATOM 0 HB2 LEU A 65 9.658 0.531 8.734 1.00 0.00 H new ATOM 0 HB3 LEU A 65 11.216 1.219 8.321 1.00 0.00 H new ATOM 0 HG LEU A 65 10.481 3.401 8.867 1.00 0.00 H new ATOM 0 HD11 LEU A 65 8.174 3.729 9.939 1.00 0.00 H new ATOM 0 HD12 LEU A 65 8.054 3.165 8.255 1.00 0.00 H new ATOM 0 HD13 LEU A 65 7.817 2.020 9.597 1.00 0.00 H new ATOM 0 HD21 LEU A 65 10.108 3.305 11.285 1.00 0.00 H new ATOM 0 HD22 LEU A 65 9.857 1.547 11.158 1.00 0.00 H new ATOM 0 HD23 LEU A 65 11.432 2.255 10.726 1.00 0.00 H new ATOM 969 N THR A 66 11.240 3.228 6.002 1.00 0.00 N ATOM 970 CA THR A 66 11.567 4.484 5.401 1.00 0.00 C ATOM 971 C THR A 66 11.025 4.619 4.020 1.00 0.00 C ATOM 972 O THR A 66 10.794 5.703 3.486 1.00 0.00 O ATOM 973 CB THR A 66 13.045 4.722 5.502 1.00 0.00 C ATOM 974 OG1 THR A 66 13.490 4.474 6.827 1.00 0.00 O ATOM 975 CG2 THR A 66 13.408 6.194 5.245 1.00 0.00 C ATOM 0 H THR A 66 12.057 2.673 6.257 1.00 0.00 H new ATOM 0 HA THR A 66 11.071 5.279 5.957 1.00 0.00 H new ATOM 0 HB THR A 66 13.504 4.064 4.765 1.00 0.00 H new ATOM 0 HG1 THR A 66 14.053 3.672 6.838 1.00 0.00 H new ATOM 0 HG21 THR A 66 14.487 6.322 5.328 1.00 0.00 H new ATOM 0 HG22 THR A 66 13.084 6.479 4.244 1.00 0.00 H new ATOM 0 HG23 THR A 66 12.910 6.825 5.981 1.00 0.00 H new ATOM 983 N MET A 67 10.793 3.517 3.285 1.00 0.00 N ATOM 984 CA MET A 67 10.042 3.572 2.070 1.00 0.00 C ATOM 985 C MET A 67 8.599 3.806 2.357 1.00 0.00 C ATOM 986 O MET A 67 8.049 4.833 1.962 1.00 0.00 O ATOM 987 CB MET A 67 10.246 2.316 1.206 1.00 0.00 C ATOM 988 CG MET A 67 9.258 2.012 0.078 1.00 0.00 C ATOM 989 SD MET A 67 9.762 0.670 -1.041 1.00 0.00 S ATOM 990 CE MET A 67 9.076 -0.706 -0.075 1.00 0.00 C ATOM 0 H MET A 67 11.127 2.586 3.533 1.00 0.00 H new ATOM 0 HA MET A 67 10.417 4.415 1.489 1.00 0.00 H new ATOM 0 HB2 MET A 67 11.239 2.382 0.762 1.00 0.00 H new ATOM 0 HB3 MET A 67 10.253 1.456 1.876 1.00 0.00 H new ATOM 0 HG2 MET A 67 8.294 1.756 0.518 1.00 0.00 H new ATOM 0 HG3 MET A 67 9.109 2.918 -0.509 1.00 0.00 H new ATOM 0 HE1 MET A 67 9.508 -1.645 -0.422 1.00 0.00 H new ATOM 0 HE2 MET A 67 9.314 -0.565 0.979 1.00 0.00 H new ATOM 0 HE3 MET A 67 7.994 -0.736 -0.202 1.00 0.00 H new ATOM 1000 N MET A 68 7.948 2.925 3.139 1.00 0.00 N ATOM 1001 CA MET A 68 6.523 2.878 3.247 1.00 0.00 C ATOM 1002 C MET A 68 5.899 4.063 3.901 1.00 0.00 C ATOM 1003 O MET A 68 4.751 4.439 3.669 1.00 0.00 O ATOM 1004 CB MET A 68 5.920 1.599 3.852 1.00 0.00 C ATOM 1005 CG MET A 68 6.126 0.381 2.949 1.00 0.00 C ATOM 1006 SD MET A 68 4.921 0.238 1.595 1.00 0.00 S ATOM 1007 CE MET A 68 3.284 0.098 2.370 1.00 0.00 C ATOM 0 H MET A 68 8.425 2.228 3.711 1.00 0.00 H new ATOM 0 HA MET A 68 6.263 2.883 2.188 1.00 0.00 H new ATOM 0 HB2 MET A 68 6.375 1.410 4.824 1.00 0.00 H new ATOM 0 HB3 MET A 68 4.854 1.747 4.022 1.00 0.00 H new ATOM 0 HG2 MET A 68 7.129 0.425 2.524 1.00 0.00 H new ATOM 0 HG3 MET A 68 6.077 -0.521 3.559 1.00 0.00 H new ATOM 0 HE1 MET A 68 2.680 -0.621 1.817 1.00 0.00 H new ATOM 0 HE2 MET A 68 3.397 -0.240 3.400 1.00 0.00 H new ATOM 0 HE3 MET A 68 2.792 1.070 2.359 1.00 0.00 H new ATOM 1017 N ALA A 69 6.627 4.664 4.859 1.00 0.00 N ATOM 1018 CA ALA A 69 6.034 5.594 5.768 1.00 0.00 C ATOM 1019 C ALA A 69 6.071 7.031 5.374 1.00 0.00 C ATOM 1020 O ALA A 69 5.585 7.973 5.998 1.00 0.00 O ATOM 1021 CB ALA A 69 6.522 5.354 7.206 1.00 0.00 C ATOM 0 H ALA A 69 7.624 4.506 5.004 1.00 0.00 H new ATOM 0 HA ALA A 69 4.968 5.372 5.719 1.00 0.00 H new ATOM 0 HB1 ALA A 69 6.054 6.077 7.874 1.00 0.00 H new ATOM 0 HB2 ALA A 69 6.254 4.344 7.518 1.00 0.00 H new ATOM 0 HB3 ALA A 69 7.605 5.471 7.247 1.00 0.00 H new ATOM 1027 N ARG A 70 6.718 7.283 4.222 1.00 0.00 N ATOM 1028 CA ARG A 70 6.824 8.571 3.610 1.00 0.00 C ATOM 1029 C ARG A 70 5.581 8.729 2.804 1.00 0.00 C ATOM 1030 O ARG A 70 5.032 7.820 2.183 1.00 0.00 O ATOM 1031 CB ARG A 70 8.072 8.713 2.723 1.00 0.00 C ATOM 1032 CG ARG A 70 9.404 8.654 3.473 1.00 0.00 C ATOM 1033 CD ARG A 70 10.644 8.584 2.579 1.00 0.00 C ATOM 1034 NE ARG A 70 10.710 9.900 1.882 1.00 0.00 N ATOM 1035 CZ ARG A 70 11.712 10.219 1.012 1.00 0.00 C ATOM 1036 NH1 ARG A 70 12.581 9.251 0.598 1.00 0.00 N ATOM 1037 NH2 ARG A 70 11.726 11.422 0.368 1.00 0.00 N ATOM 0 H ARG A 70 7.191 6.551 3.691 1.00 0.00 H new ATOM 0 HA ARG A 70 6.931 9.345 4.370 1.00 0.00 H new ATOM 0 HB2 ARG A 70 8.059 7.923 1.973 1.00 0.00 H new ATOM 0 HB3 ARG A 70 8.014 9.661 2.188 1.00 0.00 H new ATOM 0 HG2 ARG A 70 9.484 9.533 4.112 1.00 0.00 H new ATOM 0 HG3 ARG A 70 9.397 7.783 4.129 1.00 0.00 H new ATOM 0 HD2 ARG A 70 11.543 8.407 3.169 1.00 0.00 H new ATOM 0 HD3 ARG A 70 10.566 7.765 1.864 1.00 0.00 H new ATOM 0 HE ARG A 70 9.979 10.588 2.062 1.00 0.00 H new ATOM 0 HH11 ARG A 70 12.480 8.295 0.939 1.00 0.00 H new ATOM 0 HH12 ARG A 70 13.332 9.484 -0.052 1.00 0.00 H new ATOM 0 HH21 ARG A 70 10.980 12.098 0.534 1.00 0.00 H new ATOM 0 HH22 ARG A 70 12.482 11.645 -0.279 1.00 0.00 H new ATOM 1051 N LYS A 71 5.071 9.969 2.702 1.00 0.00 N ATOM 1052 CA LYS A 71 3.826 10.357 2.116 1.00 0.00 C ATOM 1053 C LYS A 71 4.158 11.087 0.860 1.00 0.00 C ATOM 1054 O LYS A 71 4.501 12.267 0.912 1.00 0.00 O ATOM 1055 CB LYS A 71 2.944 11.205 3.047 1.00 0.00 C ATOM 1056 CG LYS A 71 1.492 11.233 2.563 1.00 0.00 C ATOM 1057 CD LYS A 71 0.755 12.263 3.421 1.00 0.00 C ATOM 1058 CE LYS A 71 -0.762 12.194 3.234 1.00 0.00 C ATOM 1059 NZ LYS A 71 -1.243 12.618 1.900 1.00 0.00 N ATOM 0 H LYS A 71 5.580 10.775 3.065 1.00 0.00 H new ATOM 0 HA LYS A 71 3.226 9.469 1.917 1.00 0.00 H new ATOM 0 HB2 LYS A 71 2.985 10.801 4.058 1.00 0.00 H new ATOM 0 HB3 LYS A 71 3.334 12.222 3.094 1.00 0.00 H new ATOM 0 HG2 LYS A 71 1.442 11.503 1.508 1.00 0.00 H new ATOM 0 HG3 LYS A 71 1.033 10.249 2.662 1.00 0.00 H new ATOM 0 HD2 LYS A 71 0.997 12.099 4.471 1.00 0.00 H new ATOM 0 HD3 LYS A 71 1.105 13.263 3.166 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -1.090 11.170 3.414 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -1.236 12.819 3.991 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -2.279 12.539 1.863 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -0.965 13.605 1.728 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -0.823 12.008 1.170 1.00 0.00 H new ATOM 1073 N MET A 72 4.054 10.480 -0.335 1.00 0.00 N ATOM 1074 CA MET A 72 4.402 11.084 -1.584 1.00 0.00 C ATOM 1075 C MET A 72 3.319 11.955 -2.120 1.00 0.00 C ATOM 1076 O MET A 72 2.394 12.303 -1.387 1.00 0.00 O ATOM 1077 CB MET A 72 4.744 9.928 -2.539 1.00 0.00 C ATOM 1078 CG MET A 72 5.947 9.085 -2.113 1.00 0.00 C ATOM 1079 SD MET A 72 7.383 10.120 -1.698 1.00 0.00 S ATOM 1080 CE MET A 72 8.525 8.719 -1.526 1.00 0.00 C ATOM 0 H MET A 72 3.712 9.524 -0.436 1.00 0.00 H new ATOM 0 HA MET A 72 5.253 11.754 -1.462 1.00 0.00 H new ATOM 0 HB2 MET A 72 3.874 9.277 -2.627 1.00 0.00 H new ATOM 0 HB3 MET A 72 4.937 10.338 -3.530 1.00 0.00 H new ATOM 0 HG2 MET A 72 5.677 8.476 -1.251 1.00 0.00 H new ATOM 0 HG3 MET A 72 6.213 8.399 -2.917 1.00 0.00 H new ATOM 0 HE1 MET A 72 9.508 9.085 -1.229 1.00 0.00 H new ATOM 0 HE2 MET A 72 8.148 8.034 -0.767 1.00 0.00 H new ATOM 0 HE3 MET A 72 8.605 8.196 -2.479 1.00 0.00 H new ATOM 1090 N LYS A 73 3.409 12.481 -3.355 1.00 0.00 N ATOM 1091 CA LYS A 73 2.432 13.341 -3.948 1.00 0.00 C ATOM 1092 C LYS A 73 1.198 12.630 -4.385 1.00 0.00 C ATOM 1093 O LYS A 73 1.083 11.418 -4.214 1.00 0.00 O ATOM 1094 CB LYS A 73 3.076 14.030 -5.163 1.00 0.00 C ATOM 1095 CG LYS A 73 4.369 14.800 -4.891 1.00 0.00 C ATOM 1096 CD LYS A 73 5.051 15.522 -6.055 1.00 0.00 C ATOM 1097 CE LYS A 73 5.490 14.843 -7.353 1.00 0.00 C ATOM 1098 NZ LYS A 73 6.396 13.696 -7.119 1.00 0.00 N ATOM 0 H LYS A 73 4.202 12.297 -3.970 1.00 0.00 H new ATOM 0 HA LYS A 73 2.121 14.058 -3.188 1.00 0.00 H new ATOM 0 HB2 LYS A 73 3.280 13.272 -5.919 1.00 0.00 H new ATOM 0 HB3 LYS A 73 2.349 14.720 -5.592 1.00 0.00 H new ATOM 0 HG2 LYS A 73 4.157 15.541 -4.121 1.00 0.00 H new ATOM 0 HG3 LYS A 73 5.089 14.099 -4.469 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.378 16.328 -6.348 1.00 0.00 H new ATOM 0 HD3 LYS A 73 5.945 15.988 -5.640 1.00 0.00 H new ATOM 0 HE2 LYS A 73 4.609 14.500 -7.895 1.00 0.00 H new ATOM 0 HE3 LYS A 73 5.991 15.573 -7.989 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.434 13.104 -7.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 7.350 14.047 -6.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 6.041 13.131 -6.321 1.00 0.00 H new ATOM 1112 N ASP A 74 0.144 13.291 -4.896 1.00 0.00 N ATOM 1113 CA ASP A 74 -1.156 12.729 -5.096 1.00 0.00 C ATOM 1114 C ASP A 74 -1.176 11.949 -6.365 1.00 0.00 C ATOM 1115 O ASP A 74 -1.899 10.971 -6.545 1.00 0.00 O ATOM 1116 CB ASP A 74 -2.388 13.644 -4.997 1.00 0.00 C ATOM 1117 CG ASP A 74 -2.418 14.271 -3.610 1.00 0.00 C ATOM 1118 OD1 ASP A 74 -1.663 15.258 -3.404 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -3.113 13.681 -2.740 1.00 0.00 O ATOM 0 H ASP A 74 0.202 14.268 -5.184 1.00 0.00 H new ATOM 0 HA ASP A 74 -1.284 12.098 -4.216 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -2.346 14.420 -5.762 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -3.299 13.072 -5.173 1.00 0.00 H new ATOM 1124 N THR A 75 -0.207 12.225 -7.256 1.00 0.00 N ATOM 1125 CA THR A 75 0.158 11.560 -8.469 1.00 0.00 C ATOM 1126 C THR A 75 0.923 10.285 -8.372 1.00 0.00 C ATOM 1127 O THR A 75 0.393 9.321 -8.923 1.00 0.00 O ATOM 1128 CB THR A 75 1.107 12.379 -9.292 1.00 0.00 C ATOM 1129 OG1 THR A 75 2.230 12.907 -8.600 1.00 0.00 O ATOM 1130 CG2 THR A 75 0.355 13.641 -9.747 1.00 0.00 C ATOM 0 H THR A 75 0.402 13.028 -7.099 1.00 0.00 H new ATOM 0 HA THR A 75 -0.838 11.386 -8.876 1.00 0.00 H new ATOM 0 HB THR A 75 1.455 11.700 -10.070 1.00 0.00 H new ATOM 0 HG1 THR A 75 2.785 13.421 -9.222 1.00 0.00 H new ATOM 0 HG21 THR A 75 1.018 14.262 -10.350 1.00 0.00 H new ATOM 0 HG22 THR A 75 -0.513 13.353 -10.341 1.00 0.00 H new ATOM 0 HG23 THR A 75 0.026 14.204 -8.873 1.00 0.00 H new ATOM 1138 N ASP A 76 1.966 10.348 -7.526 1.00 0.00 N ATOM 1139 CA ASP A 76 2.759 9.278 -7.004 1.00 0.00 C ATOM 1140 C ASP A 76 1.916 8.262 -6.312 1.00 0.00 C ATOM 1141 O ASP A 76 1.982 7.049 -6.506 1.00 0.00 O ATOM 1142 CB ASP A 76 3.800 9.819 -6.009 1.00 0.00 C ATOM 1143 CG ASP A 76 4.752 10.860 -6.579 1.00 0.00 C ATOM 1144 OD1 ASP A 76 4.797 11.169 -7.800 1.00 0.00 O ATOM 1145 OD2 ASP A 76 5.414 11.564 -5.770 1.00 0.00 O ATOM 0 H ASP A 76 2.287 11.249 -7.170 1.00 0.00 H new ATOM 0 HA ASP A 76 3.260 8.805 -7.848 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.276 10.255 -5.158 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.386 8.982 -5.628 1.00 0.00 H new ATOM 1150 N SER A 77 0.975 8.760 -5.490 1.00 0.00 N ATOM 1151 CA SER A 77 0.021 8.048 -4.698 1.00 0.00 C ATOM 1152 C SER A 77 -1.010 7.312 -5.483 1.00 0.00 C ATOM 1153 O SER A 77 -1.265 6.157 -5.146 1.00 0.00 O ATOM 1154 CB SER A 77 -0.781 8.744 -3.585 1.00 0.00 C ATOM 1155 OG SER A 77 0.013 9.301 -2.548 1.00 0.00 O ATOM 0 H SER A 77 0.875 9.768 -5.370 1.00 0.00 H new ATOM 0 HA SER A 77 0.768 7.423 -4.209 1.00 0.00 H new ATOM 0 HB2 SER A 77 -1.383 9.536 -4.030 1.00 0.00 H new ATOM 0 HB3 SER A 77 -1.473 8.024 -3.149 1.00 0.00 H new ATOM 0 HG SER A 77 0.489 10.088 -2.887 1.00 0.00 H new ATOM 1161 N GLU A 78 -1.703 7.930 -6.456 1.00 0.00 N ATOM 1162 CA GLU A 78 -2.738 7.381 -7.275 1.00 0.00 C ATOM 1163 C GLU A 78 -2.193 6.314 -8.160 1.00 0.00 C ATOM 1164 O GLU A 78 -2.916 5.333 -8.327 1.00 0.00 O ATOM 1165 CB GLU A 78 -3.366 8.490 -8.137 1.00 0.00 C ATOM 1166 CG GLU A 78 -4.663 8.194 -8.893 1.00 0.00 C ATOM 1167 CD GLU A 78 -5.426 9.487 -9.142 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -6.207 9.943 -8.264 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -5.224 10.113 -10.216 1.00 0.00 O ATOM 0 H GLU A 78 -1.519 8.906 -6.689 1.00 0.00 H new ATOM 0 HA GLU A 78 -3.499 6.947 -6.626 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -3.551 9.347 -7.489 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -2.621 8.800 -8.870 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -4.438 7.706 -9.841 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -5.279 7.503 -8.318 1.00 0.00 H new ATOM 1176 N GLU A 79 -0.939 6.388 -8.642 1.00 0.00 N ATOM 1177 CA GLU A 79 -0.317 5.361 -9.418 1.00 0.00 C ATOM 1178 C GLU A 79 0.037 4.202 -8.551 1.00 0.00 C ATOM 1179 O GLU A 79 -0.228 3.084 -8.992 1.00 0.00 O ATOM 1180 CB GLU A 79 0.965 5.920 -10.058 1.00 0.00 C ATOM 1181 CG GLU A 79 1.784 4.798 -10.700 1.00 0.00 C ATOM 1182 CD GLU A 79 3.052 5.279 -11.390 1.00 0.00 C ATOM 1183 OE1 GLU A 79 3.042 6.300 -12.129 1.00 0.00 O ATOM 1184 OE2 GLU A 79 4.029 4.483 -11.415 1.00 0.00 O ATOM 0 H GLU A 79 -0.335 7.195 -8.485 1.00 0.00 H new ATOM 0 HA GLU A 79 -1.011 5.029 -10.191 1.00 0.00 H new ATOM 0 HB2 GLU A 79 0.706 6.665 -10.811 1.00 0.00 H new ATOM 0 HB3 GLU A 79 1.564 6.427 -9.301 1.00 0.00 H new ATOM 0 HG2 GLU A 79 2.053 4.072 -9.932 1.00 0.00 H new ATOM 0 HG3 GLU A 79 1.161 4.277 -11.427 1.00 0.00 H new ATOM 1191 N GLU A 80 0.506 4.473 -7.320 1.00 0.00 N ATOM 1192 CA GLU A 80 0.757 3.430 -6.375 1.00 0.00 C ATOM 1193 C GLU A 80 -0.391 2.583 -5.944 1.00 0.00 C ATOM 1194 O GLU A 80 -0.365 1.356 -5.858 1.00 0.00 O ATOM 1195 CB GLU A 80 1.434 4.000 -5.117 1.00 0.00 C ATOM 1196 CG GLU A 80 1.960 2.998 -4.087 1.00 0.00 C ATOM 1197 CD GLU A 80 2.485 3.715 -2.851 1.00 0.00 C ATOM 1198 OE1 GLU A 80 1.879 4.733 -2.422 1.00 0.00 O ATOM 1199 OE2 GLU A 80 3.488 3.277 -2.227 1.00 0.00 O ATOM 0 H GLU A 80 0.711 5.412 -6.980 1.00 0.00 H new ATOM 0 HA GLU A 80 1.399 2.755 -6.941 1.00 0.00 H new ATOM 0 HB2 GLU A 80 2.268 4.624 -5.437 1.00 0.00 H new ATOM 0 HB3 GLU A 80 0.720 4.654 -4.617 1.00 0.00 H new ATOM 0 HG2 GLU A 80 1.163 2.311 -3.803 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.755 2.399 -4.530 1.00 0.00 H new ATOM 1206 N ILE A 81 -1.515 3.268 -5.667 1.00 0.00 N ATOM 1207 CA ILE A 81 -2.792 2.696 -5.373 1.00 0.00 C ATOM 1208 C ILE A 81 -3.361 1.968 -6.542 1.00 0.00 C ATOM 1209 O ILE A 81 -3.785 0.827 -6.365 1.00 0.00 O ATOM 1210 CB ILE A 81 -3.797 3.654 -4.804 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -3.386 4.288 -3.465 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -5.225 3.083 -4.769 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -3.361 3.198 -2.394 1.00 0.00 C ATOM 0 H ILE A 81 -1.532 4.288 -5.647 1.00 0.00 H new ATOM 0 HA ILE A 81 -2.586 1.980 -4.578 1.00 0.00 H new ATOM 0 HB ILE A 81 -3.809 4.480 -5.515 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.405 4.754 -3.553 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -4.088 5.074 -3.188 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.903 3.825 -4.347 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -5.543 2.835 -5.782 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.242 2.184 -4.153 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -3.071 3.634 -1.438 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -4.352 2.753 -2.304 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.642 2.428 -2.675 1.00 0.00 H new ATOM 1225 N ARG A 82 -3.266 2.581 -7.736 1.00 0.00 N ATOM 1226 CA ARG A 82 -3.585 1.983 -8.995 1.00 0.00 C ATOM 1227 C ARG A 82 -2.929 0.660 -9.188 1.00 0.00 C ATOM 1228 O ARG A 82 -3.587 -0.348 -9.442 1.00 0.00 O ATOM 1229 CB ARG A 82 -3.273 2.859 -10.220 1.00 0.00 C ATOM 1230 CG ARG A 82 -3.741 2.427 -11.610 1.00 0.00 C ATOM 1231 CD ARG A 82 -3.288 3.325 -12.763 1.00 0.00 C ATOM 1232 NE ARG A 82 -3.962 4.650 -12.662 1.00 0.00 N ATOM 1233 CZ ARG A 82 -3.286 5.824 -12.494 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -2.053 5.945 -13.066 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -4.000 6.926 -12.121 1.00 0.00 N ATOM 0 H ARG A 82 -2.949 3.546 -7.827 1.00 0.00 H new ATOM 0 HA ARG A 82 -4.666 1.859 -8.938 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.695 3.846 -10.028 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -2.191 2.978 -10.265 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -3.382 1.415 -11.797 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -4.830 2.384 -11.611 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -2.206 3.453 -12.733 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -3.527 2.856 -13.718 1.00 0.00 H new ATOM 0 HE ARG A 82 -4.980 4.681 -12.721 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -1.661 5.170 -13.601 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -1.523 6.810 -12.958 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -5.007 6.856 -11.977 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -3.526 7.819 -11.987 1.00 0.00 H new ATOM 1249 N GLU A 83 -1.593 0.575 -9.058 1.00 0.00 N ATOM 1250 CA GLU A 83 -0.803 -0.617 -9.043 1.00 0.00 C ATOM 1251 C GLU A 83 -1.198 -1.606 -8.001 1.00 0.00 C ATOM 1252 O GLU A 83 -1.090 -2.820 -8.173 1.00 0.00 O ATOM 1253 CB GLU A 83 0.673 -0.189 -8.970 1.00 0.00 C ATOM 1254 CG GLU A 83 1.087 0.346 -10.342 1.00 0.00 C ATOM 1255 CD GLU A 83 1.259 -0.853 -11.264 1.00 0.00 C ATOM 1256 OE1 GLU A 83 1.865 -1.913 -10.951 1.00 0.00 O ATOM 1257 OE2 GLU A 83 0.800 -0.753 -12.433 1.00 0.00 O ATOM 0 H GLU A 83 -1.019 1.412 -8.955 1.00 0.00 H new ATOM 0 HA GLU A 83 -0.980 -1.176 -9.962 1.00 0.00 H new ATOM 0 HB2 GLU A 83 0.809 0.577 -8.207 1.00 0.00 H new ATOM 0 HB3 GLU A 83 1.300 -1.035 -8.687 1.00 0.00 H new ATOM 0 HG2 GLU A 83 0.330 1.026 -10.733 1.00 0.00 H new ATOM 0 HG3 GLU A 83 2.016 0.911 -10.269 1.00 0.00 H new ATOM 1264 N ALA A 84 -1.750 -1.198 -6.845 1.00 0.00 N ATOM 1265 CA ALA A 84 -2.070 -2.097 -5.780 1.00 0.00 C ATOM 1266 C ALA A 84 -3.447 -2.630 -5.976 1.00 0.00 C ATOM 1267 O ALA A 84 -3.821 -3.620 -5.349 1.00 0.00 O ATOM 1268 CB ALA A 84 -1.916 -1.296 -4.476 1.00 0.00 C ATOM 0 H ALA A 84 -1.979 -0.224 -6.646 1.00 0.00 H new ATOM 0 HA ALA A 84 -1.411 -2.965 -5.749 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.149 -1.937 -3.626 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -0.891 -0.936 -4.389 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -2.599 -0.446 -4.488 1.00 0.00 H new ATOM 1274 N PHE A 85 -4.288 -2.108 -6.886 1.00 0.00 N ATOM 1275 CA PHE A 85 -5.634 -2.554 -7.075 1.00 0.00 C ATOM 1276 C PHE A 85 -5.635 -3.441 -8.272 1.00 0.00 C ATOM 1277 O PHE A 85 -6.360 -4.434 -8.290 1.00 0.00 O ATOM 1278 CB PHE A 85 -6.564 -1.333 -7.167 1.00 0.00 C ATOM 1279 CG PHE A 85 -7.994 -1.706 -6.983 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -8.703 -2.163 -8.069 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -8.728 -1.494 -5.840 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.022 -2.546 -8.002 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -10.065 -1.800 -5.742 1.00 0.00 C ATOM 1284 CZ PHE A 85 -10.718 -2.307 -6.841 1.00 0.00 C ATOM 0 H PHE A 85 -4.022 -1.348 -7.513 1.00 0.00 H new ATOM 0 HA PHE A 85 -6.018 -3.138 -6.238 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.279 -0.603 -6.410 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -6.437 -0.852 -8.137 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -8.199 -2.224 -9.022 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -8.232 -1.068 -4.980 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -10.501 -3.024 -8.844 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -10.595 -1.644 -4.814 1.00 0.00 H new ATOM 0 HZ PHE A 85 -11.776 -2.517 -6.792 1.00 0.00 H new ATOM 1294 N ARG A 86 -4.781 -3.121 -9.261 1.00 0.00 N ATOM 1295 CA ARG A 86 -4.467 -3.888 -10.426 1.00 0.00 C ATOM 1296 C ARG A 86 -3.994 -5.259 -10.085 1.00 0.00 C ATOM 1297 O ARG A 86 -4.313 -6.228 -10.771 1.00 0.00 O ATOM 1298 CB ARG A 86 -3.471 -3.082 -11.277 1.00 0.00 C ATOM 1299 CG ARG A 86 -3.348 -3.656 -12.690 1.00 0.00 C ATOM 1300 CD ARG A 86 -2.235 -3.056 -13.552 1.00 0.00 C ATOM 1301 NE ARG A 86 -0.924 -3.126 -12.847 1.00 0.00 N ATOM 1302 CZ ARG A 86 -0.286 -4.306 -12.597 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -0.674 -5.505 -13.123 1.00 0.00 N ATOM 1304 NH2 ARG A 86 0.947 -4.157 -12.031 1.00 0.00 N ATOM 0 H ARG A 86 -4.263 -2.242 -9.241 1.00 0.00 H new ATOM 0 HA ARG A 86 -5.367 -4.057 -11.018 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -3.796 -2.043 -11.332 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -2.493 -3.085 -10.795 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -3.184 -4.731 -12.613 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -4.298 -3.514 -13.205 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -2.173 -3.592 -14.499 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -2.471 -2.018 -13.788 1.00 0.00 H new ATOM 0 HE ARG A 86 -0.486 -2.258 -12.539 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -1.484 -5.552 -13.742 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -0.154 -6.353 -12.897 1.00 0.00 H new ATOM 0 HH21 ARG A 86 1.309 -3.224 -11.835 1.00 0.00 H new ATOM 0 HH22 ARG A 86 1.507 -4.979 -11.804 1.00 0.00 H new ATOM 1318 N VAL A 87 -3.262 -5.374 -8.963 1.00 0.00 N ATOM 1319 CA VAL A 87 -3.047 -6.690 -8.447 1.00 0.00 C ATOM 1320 C VAL A 87 -4.299 -7.382 -8.029 1.00 0.00 C ATOM 1321 O VAL A 87 -4.516 -8.535 -8.397 1.00 0.00 O ATOM 1322 CB VAL A 87 -2.068 -6.589 -7.315 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -1.720 -7.884 -6.562 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -0.747 -6.176 -7.985 1.00 0.00 C ATOM 0 H VAL A 87 -2.841 -4.607 -8.439 1.00 0.00 H new ATOM 0 HA VAL A 87 -2.646 -7.312 -9.248 1.00 0.00 H new ATOM 0 HB VAL A 87 -2.520 -5.920 -6.583 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.003 -7.664 -5.771 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -2.625 -8.305 -6.124 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -1.285 -8.603 -7.256 1.00 0.00 H new ATOM 0 HG21 VAL A 87 0.030 -6.078 -7.227 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -0.454 -6.935 -8.710 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -0.880 -5.221 -8.494 1.00 0.00 H new ATOM 1334 N PHE A 88 -5.030 -6.789 -7.068 1.00 0.00 N ATOM 1335 CA PHE A 88 -6.125 -7.382 -6.364 1.00 0.00 C ATOM 1336 C PHE A 88 -7.376 -7.810 -7.051 1.00 0.00 C ATOM 1337 O PHE A 88 -7.800 -8.926 -6.755 1.00 0.00 O ATOM 1338 CB PHE A 88 -6.417 -6.426 -5.196 1.00 0.00 C ATOM 1339 CG PHE A 88 -6.493 -7.009 -3.826 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.534 -7.882 -3.618 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -5.858 -6.428 -2.753 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -7.831 -8.292 -2.340 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -6.222 -6.754 -1.468 1.00 0.00 C ATOM 1344 CZ PHE A 88 -7.187 -7.713 -1.271 1.00 0.00 C ATOM 0 H PHE A 88 -4.844 -5.834 -6.764 1.00 0.00 H new ATOM 0 HA PHE A 88 -5.773 -8.381 -6.106 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -5.645 -5.657 -5.191 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -7.364 -5.926 -5.401 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.115 -8.244 -4.453 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -5.068 -5.711 -2.921 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -8.567 -9.065 -2.176 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.757 -6.264 -0.626 1.00 0.00 H new ATOM 0 HZ PHE A 88 -7.442 -8.015 -0.266 1.00 0.00 H new ATOM 1354 N ASP A 89 -7.838 -6.981 -8.004 1.00 0.00 N ATOM 1355 CA ASP A 89 -8.956 -7.294 -8.839 1.00 0.00 C ATOM 1356 C ASP A 89 -8.483 -8.100 -9.999 1.00 0.00 C ATOM 1357 O ASP A 89 -7.827 -7.611 -10.917 1.00 0.00 O ATOM 1358 CB ASP A 89 -9.604 -5.938 -9.164 1.00 0.00 C ATOM 1359 CG ASP A 89 -10.772 -6.153 -10.116 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -11.838 -6.677 -9.694 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -10.602 -5.671 -11.268 1.00 0.00 O ATOM 0 H ASP A 89 -7.424 -6.070 -8.199 1.00 0.00 H new ATOM 0 HA ASP A 89 -9.719 -7.924 -8.382 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -9.950 -5.459 -8.248 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -8.870 -5.270 -9.616 1.00 0.00 H new ATOM 1366 N LYS A 90 -8.669 -9.418 -9.804 1.00 0.00 N ATOM 1367 CA LYS A 90 -8.143 -10.439 -10.656 1.00 0.00 C ATOM 1368 C LYS A 90 -8.577 -10.453 -12.082 1.00 0.00 C ATOM 1369 O LYS A 90 -7.776 -10.654 -12.994 1.00 0.00 O ATOM 1370 CB LYS A 90 -8.394 -11.822 -10.031 1.00 0.00 C ATOM 1371 CG LYS A 90 -7.627 -13.071 -10.467 1.00 0.00 C ATOM 1372 CD LYS A 90 -6.200 -12.689 -10.868 1.00 0.00 C ATOM 1373 CE LYS A 90 -5.430 -13.975 -11.171 1.00 0.00 C ATOM 1374 NZ LYS A 90 -5.493 -14.295 -12.614 1.00 0.00 N ATOM 0 H LYS A 90 -9.208 -9.787 -9.021 1.00 0.00 H new ATOM 0 HA LYS A 90 -7.084 -10.188 -10.715 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.231 -11.714 -8.959 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -9.452 -12.041 -10.172 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -7.604 -13.797 -9.654 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -8.135 -13.547 -11.306 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -6.212 -12.038 -11.742 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -5.714 -12.135 -10.065 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -4.390 -13.863 -10.863 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -5.847 -14.799 -10.592 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -4.964 -15.171 -12.799 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -6.485 -14.423 -12.898 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -5.074 -13.516 -13.161 1.00 0.00 H new ATOM 1388 N ASP A 91 -9.907 -10.346 -12.248 1.00 0.00 N ATOM 1389 CA ASP A 91 -10.647 -10.477 -13.465 1.00 0.00 C ATOM 1390 C ASP A 91 -10.539 -9.291 -14.361 1.00 0.00 C ATOM 1391 O ASP A 91 -10.055 -9.363 -15.489 1.00 0.00 O ATOM 1392 CB ASP A 91 -12.071 -10.969 -13.159 1.00 0.00 C ATOM 1393 CG ASP A 91 -12.736 -10.116 -12.088 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -12.658 -8.859 -12.046 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -13.351 -10.692 -11.151 1.00 0.00 O ATOM 0 H ASP A 91 -10.519 -10.150 -11.456 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.187 -11.252 -14.078 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.670 -10.944 -14.070 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.036 -12.007 -12.829 1.00 0.00 H new ATOM 1400 N GLY A 92 -10.868 -8.098 -13.833 1.00 0.00 N ATOM 1401 CA GLY A 92 -10.636 -6.839 -14.470 1.00 0.00 C ATOM 1402 C GLY A 92 -11.904 -6.061 -14.554 1.00 0.00 C ATOM 1403 O GLY A 92 -12.125 -5.277 -15.476 1.00 0.00 O ATOM 0 H GLY A 92 -11.316 -8.008 -12.921 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -9.890 -6.273 -13.912 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -10.232 -6.998 -15.470 1.00 0.00 H new ATOM 1407 N ASN A 93 -12.829 -6.208 -13.589 1.00 0.00 N ATOM 1408 CA ASN A 93 -14.018 -5.414 -13.543 1.00 0.00 C ATOM 1409 C ASN A 93 -13.841 -4.197 -12.703 1.00 0.00 C ATOM 1410 O ASN A 93 -14.757 -3.378 -12.644 1.00 0.00 O ATOM 1411 CB ASN A 93 -15.250 -6.274 -13.214 1.00 0.00 C ATOM 1412 CG ASN A 93 -15.437 -6.884 -11.833 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -14.568 -7.001 -10.971 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -16.679 -7.382 -11.589 1.00 0.00 N ATOM 0 H ASN A 93 -12.751 -6.886 -12.831 1.00 0.00 H new ATOM 0 HA ASN A 93 -14.217 -5.017 -14.539 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -16.129 -5.661 -13.413 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -15.265 -7.096 -13.930 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -16.878 -7.844 -10.702 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -17.411 -7.293 -12.293 1.00 0.00 H new ATOM 1421 N GLY A 94 -12.726 -4.093 -11.958 1.00 0.00 N ATOM 1422 CA GLY A 94 -12.463 -3.178 -10.891 1.00 0.00 C ATOM 1423 C GLY A 94 -13.393 -3.256 -9.728 1.00 0.00 C ATOM 1424 O GLY A 94 -13.818 -2.191 -9.284 1.00 0.00 O ATOM 0 H GLY A 94 -11.932 -4.712 -12.121 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -11.448 -3.348 -10.533 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -12.494 -2.164 -11.290 1.00 0.00 H new ATOM 1428 N TYR A 95 -13.607 -4.482 -9.217 1.00 0.00 N ATOM 1429 CA TYR A 95 -14.359 -4.779 -8.038 1.00 0.00 C ATOM 1430 C TYR A 95 -13.763 -5.939 -7.317 1.00 0.00 C ATOM 1431 O TYR A 95 -13.959 -7.069 -7.762 1.00 0.00 O ATOM 1432 CB TYR A 95 -15.835 -5.110 -8.316 1.00 0.00 C ATOM 1433 CG TYR A 95 -16.572 -3.955 -8.902 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -17.191 -3.083 -8.038 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -16.837 -3.878 -10.249 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -18.095 -2.152 -8.493 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -17.672 -2.904 -10.745 1.00 0.00 C ATOM 1438 CZ TYR A 95 -18.284 -2.056 -9.852 1.00 0.00 C ATOM 1439 OH TYR A 95 -19.178 -1.113 -10.400 1.00 0.00 O ATOM 0 H TYR A 95 -13.229 -5.321 -9.658 1.00 0.00 H new ATOM 0 HA TYR A 95 -14.320 -3.871 -7.436 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -15.893 -5.959 -8.997 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -16.318 -5.413 -7.387 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -16.963 -3.130 -6.983 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -16.385 -4.589 -10.924 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -18.638 -1.518 -7.807 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -17.842 -2.808 -11.807 1.00 0.00 H new ATOM 0 HH TYR A 95 -19.179 -1.192 -11.377 1.00 0.00 H new ATOM 1449 N ILE A 96 -13.087 -5.716 -6.176 1.00 0.00 N ATOM 1450 CA ILE A 96 -12.650 -6.795 -5.346 1.00 0.00 C ATOM 1451 C ILE A 96 -13.767 -7.479 -4.636 1.00 0.00 C ATOM 1452 O ILE A 96 -14.368 -6.840 -3.774 1.00 0.00 O ATOM 1453 CB ILE A 96 -11.650 -6.379 -4.308 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -10.533 -5.484 -4.870 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.140 -7.627 -3.569 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -9.753 -4.861 -3.713 1.00 0.00 C ATOM 0 H ILE A 96 -12.843 -4.789 -5.828 1.00 0.00 H new ATOM 0 HA ILE A 96 -12.183 -7.482 -6.052 1.00 0.00 H new ATOM 0 HB ILE A 96 -12.145 -5.738 -3.579 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -9.864 -6.070 -5.500 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -10.960 -4.702 -5.499 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.413 -7.330 -2.813 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -11.977 -8.133 -3.088 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -10.668 -8.304 -4.281 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -8.960 -4.226 -4.109 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -10.427 -4.261 -3.101 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -9.315 -5.651 -3.103 1.00 0.00 H new ATOM 1468 N SER A 97 -14.078 -8.760 -4.906 1.00 0.00 N ATOM 1469 CA SER A 97 -15.149 -9.518 -4.337 1.00 0.00 C ATOM 1470 C SER A 97 -14.590 -10.393 -3.268 1.00 0.00 C ATOM 1471 O SER A 97 -13.375 -10.501 -3.108 1.00 0.00 O ATOM 1472 CB SER A 97 -15.830 -10.467 -5.338 1.00 0.00 C ATOM 1473 OG SER A 97 -15.007 -11.474 -5.909 1.00 0.00 O ATOM 0 H SER A 97 -13.537 -9.307 -5.575 1.00 0.00 H new ATOM 0 HA SER A 97 -15.881 -8.793 -3.981 1.00 0.00 H new ATOM 0 HB2 SER A 97 -16.666 -10.953 -4.835 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.249 -9.868 -6.147 1.00 0.00 H new ATOM 0 HG SER A 97 -14.329 -11.057 -6.481 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.512 -11.069 -2.559 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.210 -11.957 -1.479 1.00 0.00 C ATOM 1481 C ALA A 98 -14.466 -13.147 -1.978 1.00 0.00 C ATOM 1482 O ALA A 98 -13.670 -13.756 -1.266 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.383 -12.367 -0.572 1.00 0.00 C ATOM 0 H ALA A 98 -16.512 -10.993 -2.747 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.580 -11.366 -0.814 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -16.023 -13.040 0.206 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.815 -11.478 -0.112 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -17.143 -12.873 -1.167 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.824 -13.617 -3.187 1.00 0.00 N ATOM 1490 CA ALA A 99 -14.222 -14.715 -3.878 1.00 0.00 C ATOM 1491 C ALA A 99 -12.793 -14.389 -4.144 1.00 0.00 C ATOM 1492 O ALA A 99 -11.880 -15.154 -3.837 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.965 -15.026 -5.188 1.00 0.00 C ATOM 0 H ALA A 99 -15.588 -13.199 -3.718 1.00 0.00 H new ATOM 0 HA ALA A 99 -14.285 -15.607 -3.255 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -14.483 -15.865 -5.689 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -16.001 -15.282 -4.967 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -14.938 -14.151 -5.838 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.553 -13.147 -4.602 1.00 0.00 N ATOM 1500 CA GLU A 100 -11.281 -12.583 -4.931 1.00 0.00 C ATOM 1501 C GLU A 100 -10.409 -12.435 -3.732 1.00 0.00 C ATOM 1502 O GLU A 100 -9.300 -12.966 -3.696 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.434 -11.291 -5.752 1.00 0.00 C ATOM 1504 CG GLU A 100 -11.570 -11.672 -7.228 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.037 -10.444 -7.996 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.112 -9.979 -7.531 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -11.529 -9.940 -9.034 1.00 0.00 O ATOM 0 H GLU A 100 -13.313 -12.484 -4.754 1.00 0.00 H new ATOM 0 HA GLU A 100 -10.759 -13.287 -5.579 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -12.310 -10.733 -5.422 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.570 -10.643 -5.605 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -10.615 -12.024 -7.619 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -12.283 -12.488 -7.346 1.00 0.00 H new ATOM 1514 N LEU A 101 -10.849 -11.700 -2.695 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.268 -11.479 -1.407 1.00 0.00 C ATOM 1516 C LEU A 101 -9.718 -12.752 -0.862 1.00 0.00 C ATOM 1517 O LEU A 101 -8.530 -12.882 -0.574 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.304 -10.835 -0.470 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.772 -10.435 0.917 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -9.502 -9.596 0.694 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -11.754 -9.642 1.795 1.00 0.00 C ATOM 0 H LEU A 101 -11.731 -11.195 -2.776 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.432 -10.785 -1.494 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.708 -9.947 -0.956 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -12.132 -11.531 -0.337 1.00 0.00 H new ATOM 0 HG LEU A 101 -10.589 -11.359 1.465 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.093 -9.292 1.657 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -8.763 -10.191 0.157 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -9.749 -8.710 0.109 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.282 -9.410 2.750 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.027 -8.715 1.290 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -12.650 -10.238 1.968 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.536 -13.805 -0.689 1.00 0.00 N ATOM 1534 CA ARG A 102 -10.141 -15.130 -0.322 1.00 0.00 C ATOM 1535 C ARG A 102 -9.003 -15.660 -1.124 1.00 0.00 C ATOM 1536 O ARG A 102 -8.108 -16.223 -0.495 1.00 0.00 O ATOM 1537 CB ARG A 102 -11.254 -16.187 -0.431 1.00 0.00 C ATOM 1538 CG ARG A 102 -12.234 -16.120 0.741 1.00 0.00 C ATOM 1539 CD ARG A 102 -13.539 -16.868 0.458 1.00 0.00 C ATOM 1540 NE ARG A 102 -14.323 -17.169 1.689 1.00 0.00 N ATOM 1541 CZ ARG A 102 -15.421 -16.458 2.076 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -15.998 -15.466 1.336 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -15.933 -16.707 3.317 1.00 0.00 N ATOM 0 H ARG A 102 -11.545 -13.724 -0.815 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.857 -14.990 0.721 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.798 -16.044 -1.365 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -10.806 -17.180 -0.471 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -11.763 -16.541 1.629 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -12.458 -15.077 0.964 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -14.152 -16.272 -0.219 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -13.311 -17.801 -0.057 1.00 0.00 H new ATOM 0 HE ARG A 102 -14.022 -17.949 2.274 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -15.607 -15.214 0.428 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -16.820 -14.977 1.691 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -15.495 -17.404 3.919 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -16.753 -16.196 3.642 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.993 -15.599 -2.468 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.954 -16.197 -3.248 1.00 0.00 C ATOM 1559 C HIS A 103 -6.708 -15.393 -3.104 1.00 0.00 C ATOM 1560 O HIS A 103 -5.595 -15.896 -2.963 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.230 -16.282 -4.759 1.00 0.00 C ATOM 1562 CG HIS A 103 -9.331 -17.208 -5.184 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -9.255 -18.569 -4.970 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -10.473 -17.023 -5.899 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -10.320 -19.128 -5.604 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -11.131 -18.218 -6.111 1.00 0.00 N ATOM 0 H HIS A 103 -9.712 -15.130 -3.019 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.876 -17.214 -2.865 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -8.467 -15.281 -5.120 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -7.311 -16.592 -5.257 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -10.820 -16.064 -6.255 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -10.483 -20.193 -5.684 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -12.036 -18.364 -6.557 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.822 -14.056 -3.200 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.793 -13.114 -2.886 1.00 0.00 C ATOM 1576 C VAL A 104 -5.112 -13.286 -1.572 1.00 0.00 C ATOM 1577 O VAL A 104 -3.893 -13.197 -1.434 1.00 0.00 O ATOM 1578 CB VAL A 104 -6.271 -11.704 -3.071 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -5.202 -10.676 -2.666 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -6.712 -11.518 -4.533 1.00 0.00 C ATOM 0 H VAL A 104 -7.682 -13.608 -3.515 1.00 0.00 H new ATOM 0 HA VAL A 104 -5.011 -13.337 -3.612 1.00 0.00 H new ATOM 0 HB VAL A 104 -7.121 -11.528 -2.412 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.591 -9.669 -2.816 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -4.945 -10.813 -1.616 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -4.312 -10.816 -3.279 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -7.062 -10.496 -4.680 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -5.868 -11.712 -5.195 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -7.519 -12.214 -4.761 1.00 0.00 H new ATOM 1590 N MET A 105 -5.843 -13.506 -0.464 1.00 0.00 N ATOM 1591 CA MET A 105 -5.275 -13.818 0.810 1.00 0.00 C ATOM 1592 C MET A 105 -4.432 -15.043 0.896 1.00 0.00 C ATOM 1593 O MET A 105 -3.303 -15.142 1.373 1.00 0.00 O ATOM 1594 CB MET A 105 -6.327 -13.902 1.929 1.00 0.00 C ATOM 1595 CG MET A 105 -6.901 -12.503 2.162 1.00 0.00 C ATOM 1596 SD MET A 105 -5.692 -11.625 3.197 1.00 0.00 S ATOM 1597 CE MET A 105 -6.791 -10.229 3.573 1.00 0.00 C ATOM 0 H MET A 105 -6.862 -13.465 -0.455 1.00 0.00 H new ATOM 0 HA MET A 105 -4.609 -12.966 0.947 1.00 0.00 H new ATOM 0 HB2 MET A 105 -7.121 -14.596 1.651 1.00 0.00 H new ATOM 0 HB3 MET A 105 -5.876 -14.284 2.845 1.00 0.00 H new ATOM 0 HG2 MET A 105 -7.055 -11.983 1.217 1.00 0.00 H new ATOM 0 HG3 MET A 105 -7.871 -12.557 2.657 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.533 -9.815 4.548 1.00 0.00 H new ATOM 0 HE2 MET A 105 -6.676 -9.459 2.810 1.00 0.00 H new ATOM 0 HE3 MET A 105 -7.825 -10.574 3.588 1.00 0.00 H new ATOM 1607 N THR A 106 -4.902 -16.129 0.256 1.00 0.00 N ATOM 1608 CA THR A 106 -4.276 -17.383 -0.028 1.00 0.00 C ATOM 1609 C THR A 106 -2.954 -17.299 -0.710 1.00 0.00 C ATOM 1610 O THR A 106 -1.897 -17.686 -0.213 1.00 0.00 O ATOM 1611 CB THR A 106 -5.245 -18.322 -0.684 1.00 0.00 C ATOM 1612 OG1 THR A 106 -6.436 -18.342 0.089 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.620 -19.725 -0.756 1.00 0.00 C ATOM 0 H THR A 106 -5.854 -16.120 -0.111 1.00 0.00 H new ATOM 0 HA THR A 106 -4.004 -17.809 0.938 1.00 0.00 H new ATOM 0 HB THR A 106 -5.477 -17.996 -1.698 1.00 0.00 H new ATOM 0 HG1 THR A 106 -7.036 -17.630 -0.217 1.00 0.00 H new ATOM 0 HG21 THR A 106 -5.320 -20.411 -1.232 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.700 -19.684 -1.339 1.00 0.00 H new ATOM 0 HG23 THR A 106 -4.396 -20.076 0.251 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.977 -16.680 -1.904 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.851 -16.369 -2.729 1.00 0.00 C ATOM 1623 C ASN A 107 -0.948 -15.316 -2.184 1.00 0.00 C ATOM 1624 O ASN A 107 0.231 -15.407 -2.525 1.00 0.00 O ATOM 1625 CB ASN A 107 -2.308 -15.935 -4.131 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.846 -17.138 -4.893 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -2.316 -18.247 -4.854 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.935 -16.981 -5.692 1.00 0.00 N ATOM 0 H ASN A 107 -3.854 -16.373 -2.325 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.277 -17.295 -2.766 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -3.079 -15.169 -4.051 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -1.474 -15.492 -4.675 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -4.287 -17.769 -6.235 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -4.400 -16.075 -5.749 1.00 0.00 H new ATOM 1635 N LEU A 108 -1.345 -14.356 -1.331 1.00 0.00 N ATOM 1636 CA LEU A 108 -0.550 -13.528 -0.477 1.00 0.00 C ATOM 1637 C LEU A 108 0.275 -14.359 0.445 1.00 0.00 C ATOM 1638 O LEU A 108 1.468 -14.155 0.666 1.00 0.00 O ATOM 1639 CB LEU A 108 -1.356 -12.419 0.219 1.00 0.00 C ATOM 1640 CG LEU A 108 -0.489 -11.310 0.838 1.00 0.00 C ATOM 1641 CD1 LEU A 108 0.462 -10.615 -0.151 1.00 0.00 C ATOM 1642 CD2 LEU A 108 -1.400 -10.248 1.477 1.00 0.00 C ATOM 0 H LEU A 108 -2.336 -14.137 -1.230 1.00 0.00 H new ATOM 0 HA LEU A 108 0.149 -12.977 -1.107 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -2.038 -11.972 -0.504 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -1.969 -12.866 1.002 1.00 0.00 H new ATOM 0 HG LEU A 108 0.142 -11.804 1.577 1.00 0.00 H new ATOM 0 HD11 LEU A 108 1.034 -9.848 0.372 1.00 0.00 H new ATOM 0 HD12 LEU A 108 1.145 -11.350 -0.576 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -0.118 -10.154 -0.950 1.00 0.00 H new ATOM 0 HD21 LEU A 108 -0.788 -9.461 1.917 1.00 0.00 H new ATOM 0 HD22 LEU A 108 -2.050 -9.819 0.714 1.00 0.00 H new ATOM 0 HD23 LEU A 108 -2.009 -10.711 2.254 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.361 -15.372 1.060 1.00 0.00 N ATOM 1655 CA GLY A 109 0.276 -16.223 2.016 1.00 0.00 C ATOM 1656 C GLY A 109 -0.231 -16.082 3.410 1.00 0.00 C ATOM 1657 O GLY A 109 0.516 -16.411 4.330 1.00 0.00 O ATOM 0 H GLY A 109 -1.339 -15.605 0.889 1.00 0.00 H new ATOM 0 HA2 GLY A 109 0.150 -17.259 1.701 1.00 0.00 H new ATOM 0 HA3 GLY A 109 1.346 -16.016 2.010 1.00 0.00 H new ATOM 1661 N GLU A 110 -1.492 -15.637 3.562 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.195 -15.683 4.806 1.00 0.00 C ATOM 1663 C GLU A 110 -3.039 -16.907 4.899 1.00 0.00 C ATOM 1664 O GLU A 110 -3.289 -17.564 3.890 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.030 -14.428 5.111 1.00 0.00 C ATOM 1666 CG GLU A 110 -2.422 -13.328 5.983 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.340 -13.835 7.416 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -3.402 -14.006 8.071 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -1.205 -14.023 7.931 1.00 0.00 O ATOM 0 H GLU A 110 -2.037 -15.235 2.799 1.00 0.00 H new ATOM 0 HA GLU A 110 -1.419 -15.716 5.571 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.307 -13.977 4.158 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -3.953 -14.755 5.589 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.430 -13.061 5.619 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -3.032 -12.426 5.935 1.00 0.00 H new ATOM 1676 N LYS A 111 -3.484 -17.164 6.142 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.600 -18.030 6.362 1.00 0.00 C ATOM 1678 C LYS A 111 -5.525 -17.440 7.371 1.00 0.00 C ATOM 1679 O LYS A 111 -5.053 -16.915 8.378 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.172 -19.425 6.846 1.00 0.00 C ATOM 1681 CG LYS A 111 -2.930 -19.434 7.739 1.00 0.00 C ATOM 1682 CD LYS A 111 -2.870 -20.613 8.711 1.00 0.00 C ATOM 1683 CE LYS A 111 -1.607 -20.638 9.575 1.00 0.00 C ATOM 1684 NZ LYS A 111 -1.399 -19.290 10.148 1.00 0.00 N ATOM 0 H LYS A 111 -3.073 -16.774 6.991 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.103 -18.138 5.401 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -5.000 -19.876 7.393 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -3.983 -20.055 5.977 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -2.042 -19.452 7.108 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.898 -18.505 8.308 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -3.744 -20.580 9.362 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -2.930 -21.542 8.144 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.708 -21.376 10.371 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -0.745 -20.931 8.976 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 -0.936 -19.375 11.075 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 -0.797 -18.731 9.510 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 -2.318 -18.816 10.262 1.00 0.00 H new ATOM 1698 N LEU A 112 -6.843 -17.474 7.104 1.00 0.00 N ATOM 1699 CA LEU A 112 -7.915 -16.698 7.647 1.00 0.00 C ATOM 1700 C LEU A 112 -9.240 -17.379 7.614 1.00 0.00 C ATOM 1701 O LEU A 112 -9.612 -18.019 6.631 1.00 0.00 O ATOM 1702 CB LEU A 112 -7.897 -15.283 7.047 1.00 0.00 C ATOM 1703 CG LEU A 112 -8.602 -14.999 5.709 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.583 -13.534 5.241 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -8.080 -15.913 4.587 1.00 0.00 C ATOM 0 H LEU A 112 -7.199 -18.136 6.414 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.742 -16.591 8.718 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -8.330 -14.612 7.789 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -6.852 -14.996 6.929 1.00 0.00 H new ATOM 0 HG LEU A 112 -9.647 -15.223 5.921 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -9.107 -13.449 4.289 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -9.077 -12.908 5.984 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -7.551 -13.205 5.117 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -8.601 -15.683 3.658 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -7.011 -15.750 4.453 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -8.258 -16.955 4.854 1.00 0.00 H new ATOM 1717 N THR A 113 -10.164 -17.262 8.584 1.00 0.00 N ATOM 1718 CA THR A 113 -11.421 -17.944 8.576 1.00 0.00 C ATOM 1719 C THR A 113 -12.486 -17.199 7.848 1.00 0.00 C ATOM 1720 O THR A 113 -12.406 -15.999 7.594 1.00 0.00 O ATOM 1721 CB THR A 113 -11.839 -18.001 10.016 1.00 0.00 C ATOM 1722 OG1 THR A 113 -11.981 -16.735 10.642 1.00 0.00 O ATOM 1723 CG2 THR A 113 -10.781 -18.743 10.850 1.00 0.00 C ATOM 0 H THR A 113 -10.031 -16.671 9.404 1.00 0.00 H new ATOM 0 HA THR A 113 -11.303 -18.910 8.086 1.00 0.00 H new ATOM 0 HB THR A 113 -12.807 -18.501 9.990 1.00 0.00 H new ATOM 0 HG1 THR A 113 -11.106 -16.426 10.956 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.097 -18.777 11.893 1.00 0.00 H new ATOM 0 HG22 THR A 113 -10.667 -19.759 10.472 1.00 0.00 H new ATOM 0 HG23 THR A 113 -9.828 -18.220 10.777 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.617 -17.881 7.590 1.00 0.00 N ATOM 1732 CA ASP A 114 -14.693 -17.339 6.819 1.00 0.00 C ATOM 1733 C ASP A 114 -15.350 -16.217 7.547 1.00 0.00 C ATOM 1734 O ASP A 114 -15.689 -15.199 6.946 1.00 0.00 O ATOM 1735 CB ASP A 114 -15.768 -18.381 6.468 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.223 -19.487 5.575 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -15.009 -19.235 4.360 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -15.106 -20.634 6.084 1.00 0.00 O ATOM 0 H ASP A 114 -13.787 -18.829 7.924 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.243 -16.987 5.891 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.162 -18.818 7.386 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -16.600 -17.888 5.966 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.363 -16.226 8.892 1.00 0.00 N ATOM 1744 CA GLU A 115 -15.868 -15.223 9.777 1.00 0.00 C ATOM 1745 C GLU A 115 -15.206 -13.917 9.501 1.00 0.00 C ATOM 1746 O GLU A 115 -15.814 -12.857 9.359 1.00 0.00 O ATOM 1747 CB GLU A 115 -15.679 -15.611 11.254 1.00 0.00 C ATOM 1748 CG GLU A 115 -16.292 -16.950 11.668 1.00 0.00 C ATOM 1749 CD GLU A 115 -15.527 -18.208 11.280 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -15.596 -18.722 10.132 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -14.896 -18.777 12.211 1.00 0.00 O ATOM 0 H GLU A 115 -14.980 -17.017 9.409 1.00 0.00 H new ATOM 0 HA GLU A 115 -16.939 -15.133 9.596 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -14.611 -15.638 11.470 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.110 -14.826 11.876 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.413 -16.947 12.751 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -17.291 -17.014 11.236 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.875 -13.964 9.315 1.00 0.00 N ATOM 1759 CA GLU A 116 -12.988 -12.853 9.161 1.00 0.00 C ATOM 1760 C GLU A 116 -13.248 -12.259 7.820 1.00 0.00 C ATOM 1761 O GLU A 116 -13.152 -11.034 7.760 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.497 -13.192 9.328 1.00 0.00 C ATOM 1763 CG GLU A 116 -11.360 -13.639 10.785 1.00 0.00 C ATOM 1764 CD GLU A 116 -9.941 -14.166 10.944 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.722 -15.382 10.697 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -9.055 -13.365 11.343 1.00 0.00 O ATOM 0 H GLU A 116 -13.380 -14.854 9.269 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.194 -12.148 9.967 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.191 -13.981 8.641 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -10.868 -12.326 9.119 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -11.543 -12.807 11.465 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -12.090 -14.412 11.024 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.451 -13.019 6.729 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.683 -12.555 5.396 1.00 0.00 C ATOM 1775 C VAL A 117 -14.937 -11.751 5.369 1.00 0.00 C ATOM 1776 O VAL A 117 -14.851 -10.593 4.963 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.799 -13.739 4.483 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -14.129 -13.222 3.073 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.497 -14.552 4.392 1.00 0.00 C ATOM 0 H VAL A 117 -13.453 -14.037 6.785 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.856 -11.928 5.063 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.574 -14.391 4.884 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -14.219 -14.065 2.388 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -15.070 -12.673 3.098 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.332 -12.561 2.732 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -12.641 -15.396 3.717 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.697 -13.917 4.012 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -12.228 -14.921 5.382 1.00 0.00 H new ATOM 1789 N ASP A 118 -16.079 -12.264 5.861 1.00 0.00 N ATOM 1790 CA ASP A 118 -17.375 -11.695 6.069 1.00 0.00 C ATOM 1791 C ASP A 118 -17.384 -10.352 6.715 1.00 0.00 C ATOM 1792 O ASP A 118 -17.950 -9.395 6.188 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.286 -12.670 6.832 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.706 -12.160 7.029 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.445 -11.969 6.027 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -20.100 -11.982 8.213 1.00 0.00 O ATOM 0 H ASP A 118 -16.086 -13.239 6.160 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.768 -11.528 5.066 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.322 -13.616 6.292 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -17.846 -12.876 7.808 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.577 -10.215 7.781 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.344 -8.990 8.481 1.00 0.00 C ATOM 1803 C GLU A 119 -15.550 -7.971 7.738 1.00 0.00 C ATOM 1804 O GLU A 119 -15.934 -6.806 7.646 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.599 -9.481 9.733 1.00 0.00 C ATOM 1806 CG GLU A 119 -15.416 -8.265 10.643 1.00 0.00 C ATOM 1807 CD GLU A 119 -14.744 -8.731 11.927 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -13.924 -9.681 11.818 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -14.909 -8.079 12.993 1.00 0.00 O ATOM 0 H GLU A 119 -16.060 -11.000 8.176 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.274 -8.454 8.670 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -16.167 -10.261 10.240 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.634 -9.912 9.465 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.808 -7.508 10.148 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -16.380 -7.806 10.863 1.00 0.00 H new ATOM 1816 N MET A 120 -14.393 -8.314 7.145 1.00 0.00 N ATOM 1817 CA MET A 120 -13.660 -7.523 6.206 1.00 0.00 C ATOM 1818 C MET A 120 -14.516 -7.029 5.091 1.00 0.00 C ATOM 1819 O MET A 120 -14.459 -5.876 4.667 1.00 0.00 O ATOM 1820 CB MET A 120 -12.379 -8.241 5.747 1.00 0.00 C ATOM 1821 CG MET A 120 -11.138 -8.117 6.632 1.00 0.00 C ATOM 1822 SD MET A 120 -9.737 -8.904 5.781 1.00 0.00 S ATOM 1823 CE MET A 120 -9.854 -10.352 6.871 1.00 0.00 C ATOM 0 H MET A 120 -13.939 -9.207 7.336 1.00 0.00 H new ATOM 0 HA MET A 120 -13.326 -6.620 6.718 1.00 0.00 H new ATOM 0 HB2 MET A 120 -12.609 -9.301 5.639 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.122 -7.868 4.756 1.00 0.00 H new ATOM 0 HG2 MET A 120 -10.919 -7.068 6.831 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.312 -8.595 7.596 1.00 0.00 H new ATOM 0 HE1 MET A 120 -8.884 -10.847 6.924 1.00 0.00 H new ATOM 0 HE2 MET A 120 -10.154 -10.033 7.869 1.00 0.00 H new ATOM 0 HE3 MET A 120 -10.594 -11.047 6.475 1.00 0.00 H new ATOM 1833 N ILE A 121 -15.432 -7.862 4.567 1.00 0.00 N ATOM 1834 CA ILE A 121 -16.268 -7.337 3.532 1.00 0.00 C ATOM 1835 C ILE A 121 -17.215 -6.327 4.084 1.00 0.00 C ATOM 1836 O ILE A 121 -17.239 -5.212 3.563 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.978 -8.442 2.809 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -15.990 -9.251 1.952 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -18.188 -7.862 2.056 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -15.293 -8.472 0.838 1.00 0.00 C ATOM 0 H ILE A 121 -15.590 -8.833 4.835 1.00 0.00 H new ATOM 0 HA ILE A 121 -15.641 -6.827 2.801 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.387 -9.171 3.509 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.228 -9.673 2.608 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.525 -10.089 1.505 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -18.707 -8.663 1.529 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -18.869 -7.395 2.767 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -17.846 -7.117 1.338 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.619 -9.136 0.296 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -16.039 -8.073 0.151 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.722 -7.650 1.271 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.954 -6.623 5.168 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.693 -5.605 5.848 1.00 0.00 C ATOM 1854 C ARG A 122 -18.010 -4.323 6.181 1.00 0.00 C ATOM 1855 O ARG A 122 -18.584 -3.293 5.829 1.00 0.00 O ATOM 1856 CB ARG A 122 -19.270 -6.260 7.114 1.00 0.00 C ATOM 1857 CG ARG A 122 -20.392 -5.459 7.776 1.00 0.00 C ATOM 1858 CD ARG A 122 -21.188 -6.254 8.814 1.00 0.00 C ATOM 1859 NE ARG A 122 -21.824 -7.443 8.181 1.00 0.00 N ATOM 1860 CZ ARG A 122 -21.338 -8.719 8.218 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -20.173 -9.070 8.836 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -21.892 -9.619 7.354 1.00 0.00 N ATOM 0 H ARG A 122 -18.040 -7.556 5.570 1.00 0.00 H new ATOM 0 HA ARG A 122 -19.441 -5.259 5.135 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -19.647 -7.250 6.858 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -18.465 -6.402 7.835 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -19.963 -4.579 8.256 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -21.074 -5.101 7.005 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -20.529 -6.573 9.621 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.953 -5.618 9.260 1.00 0.00 H new ATOM 0 HE ARG A 122 -22.697 -7.291 7.677 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -19.611 -8.360 9.306 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -19.864 -10.042 8.828 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -22.635 -9.326 6.719 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -21.563 -10.585 7.343 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.783 -4.338 6.731 1.00 0.00 N ATOM 1877 CA GLU A 123 -15.902 -3.226 6.909 1.00 0.00 C ATOM 1878 C GLU A 123 -15.577 -2.423 5.697 1.00 0.00 C ATOM 1879 O GLU A 123 -15.585 -1.193 5.684 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.631 -3.658 7.660 1.00 0.00 C ATOM 1881 CG GLU A 123 -13.844 -2.485 8.247 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.623 -2.909 9.052 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -12.819 -3.260 10.246 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -11.479 -2.750 8.548 1.00 0.00 O ATOM 0 H GLU A 123 -16.374 -5.204 7.081 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.479 -2.527 7.514 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.907 -4.339 8.465 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -13.987 -4.214 6.979 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -13.524 -1.831 7.436 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -14.505 -1.900 8.887 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.257 -3.123 4.593 1.00 0.00 N ATOM 1892 CA ALA A 124 -14.966 -2.558 3.312 1.00 0.00 C ATOM 1893 C ALA A 124 -16.119 -1.877 2.658 1.00 0.00 C ATOM 1894 O ALA A 124 -15.952 -0.709 2.314 1.00 0.00 O ATOM 1895 CB ALA A 124 -14.331 -3.612 2.390 1.00 0.00 C ATOM 0 H ALA A 124 -15.198 -4.141 4.596 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.245 -1.761 3.494 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -14.116 -3.165 1.420 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -13.405 -3.974 2.836 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -15.021 -4.445 2.260 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.274 -2.563 2.591 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.309 -2.053 1.746 1.00 0.00 C ATOM 1903 C ASP A 125 -19.105 -0.922 2.298 1.00 0.00 C ATOM 1904 O ASP A 125 -19.539 -0.850 3.447 1.00 0.00 O ATOM 1905 CB ASP A 125 -19.199 -3.260 1.404 1.00 0.00 C ATOM 1906 CG ASP A 125 -20.367 -2.858 0.514 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -20.059 -2.336 -0.591 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -21.577 -3.033 0.817 1.00 0.00 O ATOM 0 H ASP A 125 -17.487 -3.425 3.092 1.00 0.00 H new ATOM 0 HA ASP A 125 -17.847 -1.600 0.869 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.603 -4.022 0.902 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -19.578 -3.706 2.324 1.00 0.00 H new ATOM 1913 N ILE A 126 -19.207 0.125 1.459 1.00 0.00 N ATOM 1914 CA ILE A 126 -19.886 1.349 1.749 1.00 0.00 C ATOM 1915 C ILE A 126 -21.202 1.473 1.061 1.00 0.00 C ATOM 1916 O ILE A 126 -22.190 1.874 1.675 1.00 0.00 O ATOM 1917 CB ILE A 126 -19.007 2.525 1.444 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -17.875 2.586 2.484 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -19.804 3.840 1.446 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -16.760 3.497 1.973 1.00 0.00 C ATOM 0 H ILE A 126 -18.792 0.116 0.527 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.105 1.335 2.817 1.00 0.00 H new ATOM 0 HB ILE A 126 -18.589 2.400 0.445 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -18.259 2.961 3.433 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -17.484 1.586 2.671 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -19.135 4.671 1.221 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -20.589 3.791 0.691 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -20.254 3.991 2.427 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -15.958 3.540 2.710 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -16.369 3.103 1.035 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -17.156 4.499 1.809 1.00 0.00 H new ATOM 1932 N ASP A 127 -21.350 1.075 -0.215 1.00 0.00 N ATOM 1933 CA ASP A 127 -22.575 1.132 -0.951 1.00 0.00 C ATOM 1934 C ASP A 127 -23.402 -0.052 -0.583 1.00 0.00 C ATOM 1935 O ASP A 127 -24.133 -0.112 0.404 1.00 0.00 O ATOM 1936 CB ASP A 127 -22.453 1.280 -2.477 1.00 0.00 C ATOM 1937 CG ASP A 127 -21.299 0.477 -3.061 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -20.124 0.930 -3.039 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.507 -0.729 -3.360 1.00 0.00 O ATOM 0 H ASP A 127 -20.577 0.694 -0.761 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.057 2.065 -0.659 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -23.385 0.959 -2.943 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -22.318 2.333 -2.725 1.00 0.00 H new ATOM 1944 N GLY A 128 -23.384 -1.104 -1.421 1.00 0.00 N ATOM 1945 CA GLY A 128 -24.287 -2.192 -1.207 1.00 0.00 C ATOM 1946 C GLY A 128 -24.145 -3.382 -2.092 1.00 0.00 C ATOM 1947 O GLY A 128 -24.969 -4.292 -2.018 1.00 0.00 O ATOM 0 H GLY A 128 -22.763 -1.202 -2.225 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -24.176 -2.524 -0.175 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -25.303 -1.813 -1.312 1.00 0.00 H new ATOM 1951 N ASP A 129 -23.121 -3.601 -2.937 1.00 0.00 N ATOM 1952 CA ASP A 129 -22.839 -4.751 -3.737 1.00 0.00 C ATOM 1953 C ASP A 129 -22.148 -5.792 -2.926 1.00 0.00 C ATOM 1954 O ASP A 129 -22.188 -6.981 -3.239 1.00 0.00 O ATOM 1955 CB ASP A 129 -22.052 -4.449 -5.024 1.00 0.00 C ATOM 1956 CG ASP A 129 -20.700 -3.764 -4.891 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -20.290 -3.476 -3.735 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -19.985 -3.578 -5.913 1.00 0.00 O ATOM 0 H ASP A 129 -22.409 -2.883 -3.072 1.00 0.00 H new ATOM 0 HA ASP A 129 -23.806 -5.127 -4.070 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -21.899 -5.391 -5.550 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -22.680 -3.827 -5.661 1.00 0.00 H new ATOM 1963 N GLY A 130 -21.346 -5.333 -1.948 1.00 0.00 N ATOM 1964 CA GLY A 130 -20.554 -6.208 -1.141 1.00 0.00 C ATOM 1965 C GLY A 130 -19.209 -6.597 -1.652 1.00 0.00 C ATOM 1966 O GLY A 130 -18.600 -7.605 -1.296 1.00 0.00 O ATOM 0 H GLY A 130 -21.246 -4.345 -1.715 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.419 -5.736 -0.168 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.126 -7.121 -0.976 1.00 0.00 H new ATOM 1970 N GLN A 131 -18.749 -5.772 -2.609 1.00 0.00 N ATOM 1971 CA GLN A 131 -17.455 -5.686 -3.212 1.00 0.00 C ATOM 1972 C GLN A 131 -16.833 -4.352 -2.985 1.00 0.00 C ATOM 1973 O GLN A 131 -17.519 -3.364 -2.726 1.00 0.00 O ATOM 1974 CB GLN A 131 -17.528 -5.789 -4.745 1.00 0.00 C ATOM 1975 CG GLN A 131 -18.270 -7.033 -5.238 1.00 0.00 C ATOM 1976 CD GLN A 131 -18.379 -6.942 -6.753 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -17.856 -7.750 -7.518 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -19.148 -5.935 -7.248 1.00 0.00 N ATOM 0 H GLN A 131 -19.373 -5.072 -3.011 1.00 0.00 H new ATOM 0 HA GLN A 131 -16.888 -6.502 -2.764 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -18.023 -4.901 -5.138 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -16.516 -5.795 -5.150 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -17.735 -7.937 -4.948 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -19.261 -7.090 -4.787 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -19.582 -5.265 -6.613 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -19.291 -5.850 -8.254 1.00 0.00 H new ATOM 1987 N VAL A 132 -15.491 -4.382 -3.075 1.00 0.00 N ATOM 1988 CA VAL A 132 -14.659 -3.223 -2.984 1.00 0.00 C ATOM 1989 C VAL A 132 -14.258 -2.713 -4.326 1.00 0.00 C ATOM 1990 O VAL A 132 -13.547 -3.360 -5.093 1.00 0.00 O ATOM 1991 CB VAL A 132 -13.546 -3.318 -1.983 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -13.826 -2.175 -0.994 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -13.564 -4.641 -1.197 1.00 0.00 C ATOM 0 H VAL A 132 -14.966 -5.245 -3.216 1.00 0.00 H new ATOM 0 HA VAL A 132 -15.287 -2.445 -2.550 1.00 0.00 H new ATOM 0 HB VAL A 132 -12.580 -3.264 -2.485 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -13.058 -2.166 -0.221 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.816 -1.223 -1.526 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.803 -2.324 -0.533 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -12.736 -4.654 -0.488 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -14.506 -4.730 -0.657 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -13.462 -5.477 -1.889 1.00 0.00 H new ATOM 2003 N ASN A 133 -14.789 -1.536 -4.701 1.00 0.00 N ATOM 2004 CA ASN A 133 -14.331 -0.733 -5.792 1.00 0.00 C ATOM 2005 C ASN A 133 -13.242 0.182 -5.347 1.00 0.00 C ATOM 2006 O ASN A 133 -12.862 0.364 -4.192 1.00 0.00 O ATOM 2007 CB ASN A 133 -15.544 -0.038 -6.431 1.00 0.00 C ATOM 2008 CG ASN A 133 -16.007 1.344 -5.992 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -15.345 2.297 -6.402 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -16.985 1.552 -5.071 1.00 0.00 N ATOM 0 H ASN A 133 -15.584 -1.121 -4.214 1.00 0.00 H new ATOM 0 HA ASN A 133 -13.874 -1.342 -6.572 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -15.344 0.023 -7.501 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -16.394 -0.709 -6.304 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -17.167 2.494 -4.724 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -17.537 0.766 -4.727 1.00 0.00 H new ATOM 2017 N TYR A 134 -12.663 0.894 -6.330 1.00 0.00 N ATOM 2018 CA TYR A 134 -11.567 1.807 -6.236 1.00 0.00 C ATOM 2019 C TYR A 134 -11.773 2.948 -5.300 1.00 0.00 C ATOM 2020 O TYR A 134 -10.952 3.189 -4.416 1.00 0.00 O ATOM 2021 CB TYR A 134 -11.238 2.332 -7.644 1.00 0.00 C ATOM 2022 CG TYR A 134 -9.901 2.977 -7.771 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -8.757 2.273 -8.067 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -9.731 4.292 -7.409 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -7.483 2.788 -8.023 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -8.468 4.829 -7.322 1.00 0.00 C ATOM 2027 CZ TYR A 134 -7.347 4.103 -7.648 1.00 0.00 C ATOM 2028 OH TYR A 134 -6.086 4.734 -7.591 1.00 0.00 O ATOM 0 H TYR A 134 -13.000 0.820 -7.290 1.00 0.00 H new ATOM 0 HA TYR A 134 -10.736 1.244 -5.812 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -11.295 1.502 -8.349 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -12.003 3.051 -7.937 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -8.868 1.238 -8.356 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -10.593 4.906 -7.192 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -6.624 2.183 -8.273 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -8.354 5.850 -6.988 1.00 0.00 H new ATOM 0 HH TYR A 134 -6.199 5.665 -7.305 1.00 0.00 H new ATOM 2038 N GLU A 135 -12.930 3.628 -5.394 1.00 0.00 N ATOM 2039 CA GLU A 135 -13.355 4.778 -4.658 1.00 0.00 C ATOM 2040 C GLU A 135 -13.642 4.389 -3.249 1.00 0.00 C ATOM 2041 O GLU A 135 -13.495 5.242 -2.374 1.00 0.00 O ATOM 2042 CB GLU A 135 -14.591 5.333 -5.386 1.00 0.00 C ATOM 2043 CG GLU A 135 -14.235 5.651 -6.840 1.00 0.00 C ATOM 2044 CD GLU A 135 -15.316 6.533 -7.449 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -15.667 7.601 -6.879 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -15.774 6.131 -8.552 1.00 0.00 O ATOM 0 H GLU A 135 -13.645 3.336 -6.061 1.00 0.00 H new ATOM 0 HA GLU A 135 -12.588 5.551 -4.612 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -15.402 4.606 -5.351 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -14.947 6.232 -4.884 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -13.270 6.156 -6.887 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -14.140 4.728 -7.412 1.00 0.00 H new ATOM 2053 N GLU A 136 -13.988 3.133 -2.914 1.00 0.00 N ATOM 2054 CA GLU A 136 -14.026 2.706 -1.549 1.00 0.00 C ATOM 2055 C GLU A 136 -12.667 2.414 -1.012 1.00 0.00 C ATOM 2056 O GLU A 136 -12.482 2.446 0.204 1.00 0.00 O ATOM 2057 CB GLU A 136 -14.920 1.471 -1.350 1.00 0.00 C ATOM 2058 CG GLU A 136 -16.413 1.635 -1.644 1.00 0.00 C ATOM 2059 CD GLU A 136 -17.102 0.304 -1.910 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -16.754 -0.450 -2.857 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -18.107 -0.009 -1.218 1.00 0.00 O ATOM 0 H GLU A 136 -14.242 2.412 -3.589 1.00 0.00 H new ATOM 0 HA GLU A 136 -14.452 3.542 -0.995 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -14.537 0.671 -1.983 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -14.813 1.139 -0.317 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -16.895 2.128 -0.800 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -16.541 2.286 -2.509 1.00 0.00 H new ATOM 2068 N PHE A 137 -11.787 1.951 -1.917 1.00 0.00 N ATOM 2069 CA PHE A 137 -10.459 1.467 -1.697 1.00 0.00 C ATOM 2070 C PHE A 137 -9.609 2.568 -1.163 1.00 0.00 C ATOM 2071 O PHE A 137 -8.979 2.396 -0.121 1.00 0.00 O ATOM 2072 CB PHE A 137 -9.877 0.690 -2.890 1.00 0.00 C ATOM 2073 CG PHE A 137 -8.729 -0.196 -2.550 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -8.869 -1.528 -2.238 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -7.453 0.288 -2.718 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -7.749 -2.294 -2.014 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -6.360 -0.532 -2.565 1.00 0.00 C ATOM 2078 CZ PHE A 137 -6.459 -1.830 -2.120 1.00 0.00 C ATOM 0 H PHE A 137 -12.034 1.913 -2.906 1.00 0.00 H new ATOM 0 HA PHE A 137 -10.487 0.696 -0.927 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -10.668 0.085 -3.334 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -9.557 1.403 -3.650 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -9.852 -1.970 -2.169 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -7.307 1.327 -2.974 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -7.892 -3.328 -1.737 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -5.382 -0.141 -2.804 1.00 0.00 H new ATOM 0 HZ PHE A 137 -5.597 -2.433 -1.875 1.00 0.00 H new ATOM 2088 N VAL A 138 -9.726 3.749 -1.796 1.00 0.00 N ATOM 2089 CA VAL A 138 -9.040 4.930 -1.372 1.00 0.00 C ATOM 2090 C VAL A 138 -9.423 5.350 0.005 1.00 0.00 C ATOM 2091 O VAL A 138 -8.610 5.711 0.855 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.231 6.063 -2.335 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -8.296 7.254 -2.063 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -8.894 5.604 -3.764 1.00 0.00 C ATOM 0 H VAL A 138 -10.310 3.886 -2.621 1.00 0.00 H new ATOM 0 HA VAL A 138 -7.981 4.671 -1.354 1.00 0.00 H new ATOM 0 HB VAL A 138 -10.271 6.368 -2.215 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -8.485 8.039 -2.795 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -8.481 7.640 -1.060 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -7.259 6.928 -2.141 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -9.036 6.434 -4.456 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -7.857 5.271 -3.804 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -9.550 4.781 -4.046 1.00 0.00 H new ATOM 2104 N GLN A 139 -10.729 5.299 0.323 1.00 0.00 N ATOM 2105 CA GLN A 139 -11.246 5.841 1.541 1.00 0.00 C ATOM 2106 C GLN A 139 -10.848 4.868 2.597 1.00 0.00 C ATOM 2107 O GLN A 139 -10.654 5.287 3.737 1.00 0.00 O ATOM 2108 CB GLN A 139 -12.767 5.982 1.361 1.00 0.00 C ATOM 2109 CG GLN A 139 -13.301 6.829 2.518 1.00 0.00 C ATOM 2110 CD GLN A 139 -13.459 6.134 3.863 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -13.365 6.815 4.883 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -13.854 4.836 3.958 1.00 0.00 N ATOM 0 H GLN A 139 -11.438 4.874 -0.275 1.00 0.00 H new ATOM 0 HA GLN A 139 -10.868 6.827 1.814 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -12.996 6.454 0.405 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -13.243 5.001 1.355 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -12.633 7.680 2.652 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -14.272 7.229 2.226 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -13.934 4.265 3.117 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -14.070 4.434 4.870 1.00 0.00 H new ATOM 2121 N MET A 140 -10.872 3.551 2.323 1.00 0.00 N ATOM 2122 CA MET A 140 -10.375 2.462 3.105 1.00 0.00 C ATOM 2123 C MET A 140 -8.909 2.554 3.355 1.00 0.00 C ATOM 2124 O MET A 140 -8.478 2.279 4.473 1.00 0.00 O ATOM 2125 CB MET A 140 -10.693 1.111 2.442 1.00 0.00 C ATOM 2126 CG MET A 140 -10.424 -0.086 3.357 1.00 0.00 C ATOM 2127 SD MET A 140 -11.115 -1.680 2.823 1.00 0.00 S ATOM 2128 CE MET A 140 -10.494 -1.779 1.119 1.00 0.00 C ATOM 0 H MET A 140 -11.288 3.216 1.454 1.00 0.00 H new ATOM 0 HA MET A 140 -10.885 2.527 4.066 1.00 0.00 H new ATOM 0 HB2 MET A 140 -11.740 1.100 2.138 1.00 0.00 H new ATOM 0 HB3 MET A 140 -10.096 1.009 1.535 1.00 0.00 H new ATOM 0 HG2 MET A 140 -9.345 -0.199 3.464 1.00 0.00 H new ATOM 0 HG3 MET A 140 -10.820 0.144 4.346 1.00 0.00 H new ATOM 0 HE1 MET A 140 -10.635 -2.791 0.739 1.00 0.00 H new ATOM 0 HE2 MET A 140 -11.041 -1.076 0.491 1.00 0.00 H new ATOM 0 HE3 MET A 140 -9.433 -1.530 1.103 1.00 0.00 H new ATOM 2138 N MET A 141 -8.054 2.842 2.357 1.00 0.00 N ATOM 2139 CA MET A 141 -6.675 3.098 2.636 1.00 0.00 C ATOM 2140 C MET A 141 -6.368 4.270 3.503 1.00 0.00 C ATOM 2141 O MET A 141 -5.628 4.260 4.486 1.00 0.00 O ATOM 2142 CB MET A 141 -5.866 3.205 1.333 1.00 0.00 C ATOM 2143 CG MET A 141 -5.791 1.859 0.610 1.00 0.00 C ATOM 2144 SD MET A 141 -4.852 0.577 1.493 1.00 0.00 S ATOM 2145 CE MET A 141 -6.293 -0.528 1.545 1.00 0.00 C ATOM 0 H MET A 141 -8.312 2.897 1.372 1.00 0.00 H new ATOM 0 HA MET A 141 -6.378 2.231 3.226 1.00 0.00 H new ATOM 0 HB2 MET A 141 -6.324 3.946 0.678 1.00 0.00 H new ATOM 0 HB3 MET A 141 -4.859 3.556 1.556 1.00 0.00 H new ATOM 0 HG2 MET A 141 -6.805 1.496 0.440 1.00 0.00 H new ATOM 0 HG3 MET A 141 -5.338 2.012 -0.370 1.00 0.00 H new ATOM 0 HE1 MET A 141 -6.001 -1.487 1.974 1.00 0.00 H new ATOM 0 HE2 MET A 141 -7.074 -0.079 2.159 1.00 0.00 H new ATOM 0 HE3 MET A 141 -6.670 -0.682 0.534 1.00 0.00 H new ATOM 2155 N THR A 142 -6.932 5.442 3.161 1.00 0.00 N ATOM 2156 CA THR A 142 -6.573 6.725 3.680 1.00 0.00 C ATOM 2157 C THR A 142 -7.047 6.968 5.106 1.00 0.00 C ATOM 2158 O THR A 142 -6.201 7.247 5.997 1.00 0.00 O ATOM 2159 CB THR A 142 -6.969 7.927 2.875 1.00 0.00 C ATOM 2160 OG1 THR A 142 -8.373 7.951 2.661 1.00 0.00 O ATOM 2161 CG2 THR A 142 -6.201 7.975 1.544 1.00 0.00 C ATOM 0 H THR A 142 -7.687 5.496 2.478 1.00 0.00 H new ATOM 0 HA THR A 142 -5.487 6.641 3.631 1.00 0.00 H new ATOM 0 HB THR A 142 -6.703 8.819 3.443 1.00 0.00 H new ATOM 0 HG1 THR A 142 -8.623 7.229 2.048 1.00 0.00 H new ATOM 0 HG21 THR A 142 -6.506 8.856 0.979 1.00 0.00 H new ATOM 0 HG22 THR A 142 -5.131 8.025 1.743 1.00 0.00 H new ATOM 0 HG23 THR A 142 -6.421 7.078 0.965 1.00 0.00 H new TER 2169 THR A 142 ATOM 2170 N ARG B 1 -10.389 -2.876 11.161 1.00 0.00 N ATOM 2171 CA ARG B 1 -9.312 -2.002 10.644 1.00 0.00 C ATOM 2172 C ARG B 1 -8.065 -2.765 10.356 1.00 0.00 C ATOM 2173 O ARG B 1 -7.582 -2.697 9.226 1.00 0.00 O ATOM 2174 CB ARG B 1 -9.014 -0.834 11.598 1.00 0.00 C ATOM 2175 CG ARG B 1 -10.067 0.276 11.550 1.00 0.00 C ATOM 2176 CD ARG B 1 -9.547 1.510 12.290 1.00 0.00 C ATOM 2177 NE ARG B 1 -10.266 2.691 11.737 1.00 0.00 N ATOM 2178 CZ ARG B 1 -9.817 3.947 12.026 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -8.578 4.140 12.565 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -10.644 4.976 11.678 1.00 0.00 N ATOM 0 H1 ARG B 1 -11.308 -2.408 11.031 1.00 0.00 H new ATOM 0 H2 ARG B 1 -10.383 -3.778 10.643 1.00 0.00 H new ATOM 0 H3 ARG B 1 -10.233 -3.058 12.173 1.00 0.00 H new ATOM 0 HA ARG B 1 -9.679 -1.588 9.705 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -8.946 -1.215 12.617 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -8.040 -0.412 11.350 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -10.295 0.530 10.515 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -10.995 -0.069 12.006 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -9.724 1.419 13.362 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -8.471 1.616 12.153 1.00 0.00 H new ATOM 0 HE ARG B 1 -11.088 2.562 11.147 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -7.975 3.340 12.757 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -8.255 5.084 12.776 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -11.539 4.781 11.229 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -10.367 5.939 11.867 1.00 0.00 H new ATOM 2193 N ARG B 2 -7.538 -3.578 11.289 1.00 0.00 N ATOM 2194 CA ARG B 2 -6.182 -4.031 11.234 1.00 0.00 C ATOM 2195 C ARG B 2 -5.807 -5.095 10.262 1.00 0.00 C ATOM 2196 O ARG B 2 -4.654 -5.276 9.873 1.00 0.00 O ATOM 2197 CB ARG B 2 -5.865 -4.471 12.673 1.00 0.00 C ATOM 2198 CG ARG B 2 -5.863 -3.373 13.740 1.00 0.00 C ATOM 2199 CD ARG B 2 -5.337 -3.654 15.148 1.00 0.00 C ATOM 2200 NE ARG B 2 -3.972 -4.202 14.907 1.00 0.00 N ATOM 2201 CZ ARG B 2 -3.373 -5.240 15.560 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -3.879 -5.893 16.647 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -2.380 -5.849 14.848 1.00 0.00 N ATOM 0 H ARG B 2 -8.060 -3.926 12.093 1.00 0.00 H new ATOM 0 HA ARG B 2 -5.589 -3.203 10.845 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -6.591 -5.229 12.965 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -4.886 -4.950 12.675 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -5.284 -2.540 13.342 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -6.891 -3.026 13.845 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -5.305 -2.748 15.753 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -5.968 -4.368 15.677 1.00 0.00 H new ATOM 0 HE ARG B 2 -3.425 -3.752 14.173 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -4.779 -5.613 17.037 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -3.357 -6.661 17.069 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -2.146 -5.517 13.912 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -1.872 -6.636 15.252 1.00 0.00 H new ATOM 2217 N LYS B 3 -6.808 -5.880 9.825 1.00 0.00 N ATOM 2218 CA LYS B 3 -6.567 -6.918 8.872 1.00 0.00 C ATOM 2219 C LYS B 3 -6.485 -6.351 7.496 1.00 0.00 C ATOM 2220 O LYS B 3 -5.587 -6.626 6.702 1.00 0.00 O ATOM 2221 CB LYS B 3 -7.585 -8.038 9.145 1.00 0.00 C ATOM 2222 CG LYS B 3 -7.540 -8.558 10.583 1.00 0.00 C ATOM 2223 CD LYS B 3 -8.402 -9.792 10.857 1.00 0.00 C ATOM 2224 CE LYS B 3 -8.393 -10.163 12.341 1.00 0.00 C ATOM 2225 NZ LYS B 3 -9.431 -11.159 12.693 1.00 0.00 N ATOM 0 H LYS B 3 -7.778 -5.797 10.129 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.591 -7.394 8.971 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -8.588 -7.668 8.931 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -7.397 -8.865 8.461 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -6.506 -8.794 10.835 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -7.857 -7.758 11.252 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -9.426 -9.601 10.535 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -8.034 -10.632 10.268 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -7.412 -10.559 12.605 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -8.544 -9.262 12.936 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -9.252 -11.523 13.651 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -10.368 -10.709 12.663 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -9.402 -11.945 12.013 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.433 -5.462 7.149 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.338 -4.642 5.982 1.00 0.00 C ATOM 2241 C TRP B 4 -6.125 -3.778 6.021 1.00 0.00 C ATOM 2242 O TRP B 4 -5.477 -3.673 4.981 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.609 -3.782 5.886 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.643 -4.419 4.988 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.907 -4.748 5.385 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -9.544 -4.870 3.625 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.593 -5.353 4.365 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -10.773 -5.435 3.264 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -8.531 -4.820 2.706 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -10.948 -5.943 2.007 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -8.771 -5.217 1.411 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -9.963 -5.805 1.057 1.00 0.00 C ATOM 0 H TRP B 4 -8.284 -5.310 7.691 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.249 -5.280 5.102 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -9.029 -3.639 6.882 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.353 -2.794 5.504 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -11.311 -4.557 6.368 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.555 -5.688 4.414 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -7.551 -4.471 2.995 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -11.865 -6.456 1.758 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -8.011 -5.064 0.659 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -10.123 -6.153 0.047 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.712 -3.211 7.169 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.545 -2.387 7.243 1.00 0.00 C ATOM 2265 C GLN B 5 -3.308 -3.144 6.901 1.00 0.00 C ATOM 2266 O GLN B 5 -2.553 -2.732 6.022 1.00 0.00 O ATOM 2267 CB GLN B 5 -4.431 -1.620 8.571 1.00 0.00 C ATOM 2268 CG GLN B 5 -3.383 -0.509 8.476 1.00 0.00 C ATOM 2269 CD GLN B 5 -3.321 0.467 9.643 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -4.220 1.289 9.815 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -2.183 0.492 10.386 1.00 0.00 N ATOM 0 H GLN B 5 -6.196 -3.326 8.060 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.661 -1.619 6.479 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -5.399 -1.191 8.831 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -4.163 -2.310 9.371 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -2.403 -0.973 8.367 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -3.570 0.060 7.565 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -1.453 -0.201 10.224 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -2.060 1.204 11.106 1.00 0.00 H new ATOM 2280 N LYS B 6 -3.112 -4.297 7.565 1.00 0.00 N ATOM 2281 CA LYS B 6 -1.980 -5.119 7.265 1.00 0.00 C ATOM 2282 C LYS B 6 -1.842 -5.575 5.854 1.00 0.00 C ATOM 2283 O LYS B 6 -0.806 -5.492 5.196 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.036 -6.326 8.216 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.143 -7.531 7.913 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.084 -8.580 9.025 1.00 0.00 C ATOM 2287 CE LYS B 6 -2.396 -9.194 9.519 1.00 0.00 C ATOM 2288 NZ LYS B 6 -2.066 -10.175 10.577 1.00 0.00 N ATOM 0 H LYS B 6 -3.725 -4.656 8.297 1.00 0.00 H new ATOM 0 HA LYS B 6 -1.096 -4.498 7.408 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -1.789 -5.972 9.217 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -3.068 -6.676 8.248 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -1.499 -8.009 7.000 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.132 -7.176 7.714 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -0.446 -9.394 8.680 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -0.586 -8.127 9.882 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -3.057 -8.420 9.909 1.00 0.00 H new ATOM 0 HE3 LYS B 6 -2.923 -9.680 8.698 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -2.944 -10.572 10.968 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.489 -10.940 10.173 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -1.533 -9.702 11.334 1.00 0.00 H new ATOM 2302 N THR B 7 -2.994 -5.996 5.302 1.00 0.00 N ATOM 2303 CA THR B 7 -3.128 -6.323 3.916 1.00 0.00 C ATOM 2304 C THR B 7 -2.902 -5.190 2.975 1.00 0.00 C ATOM 2305 O THR B 7 -2.315 -5.377 1.911 1.00 0.00 O ATOM 2306 CB THR B 7 -4.563 -6.687 3.672 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.915 -7.824 4.446 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.794 -7.121 2.215 1.00 0.00 C ATOM 0 H THR B 7 -3.856 -6.112 5.834 1.00 0.00 H new ATOM 0 HA THR B 7 -2.387 -7.101 3.734 1.00 0.00 H new ATOM 0 HB THR B 7 -5.150 -5.804 3.924 1.00 0.00 H new ATOM 0 HG1 THR B 7 -5.086 -7.550 5.371 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.844 -7.377 2.074 1.00 0.00 H new ATOM 0 HG22 THR B 7 -4.527 -6.304 1.545 1.00 0.00 H new ATOM 0 HG23 THR B 7 -4.175 -7.990 1.992 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.404 -4.008 3.376 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.235 -2.715 2.787 1.00 0.00 C ATOM 2318 C GLY B 8 -1.803 -2.397 2.528 1.00 0.00 C ATOM 2319 O GLY B 8 -1.450 -2.073 1.395 1.00 0.00 O ATOM 0 H GLY B 8 -3.994 -3.956 4.206 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.791 -2.669 1.850 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.660 -1.959 3.447 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.980 -2.598 3.573 1.00 0.00 N ATOM 2324 CA HIS B 9 0.421 -2.312 3.597 1.00 0.00 C ATOM 2325 C HIS B 9 1.206 -3.288 2.789 1.00 0.00 C ATOM 2326 O HIS B 9 2.139 -3.023 2.032 1.00 0.00 O ATOM 2327 CB HIS B 9 1.117 -2.304 4.968 1.00 0.00 C ATOM 2328 CG HIS B 9 0.679 -1.327 6.019 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.510 0.001 5.684 1.00 0.00 N ATOM 2330 CD2 HIS B 9 0.244 -1.458 7.301 1.00 0.00 C ATOM 2331 CE1 HIS B 9 0.030 0.652 6.777 1.00 0.00 C ATOM 2332 NE2 HIS B 9 -0.149 -0.216 7.756 1.00 0.00 N ATOM 0 H HIS B 9 -1.315 -2.984 4.456 1.00 0.00 H new ATOM 0 HA HIS B 9 0.421 -1.297 3.199 1.00 0.00 H new ATOM 0 HB2 HIS B 9 1.016 -3.304 5.390 1.00 0.00 H new ATOM 0 HB3 HIS B 9 2.180 -2.139 4.792 1.00 0.00 H new ATOM 0 HD1 HIS B 9 0.710 0.421 4.776 1.00 0.00 H new ATOM 0 HD2 HIS B 9 0.212 -2.378 7.867 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -0.173 1.711 6.835 1.00 0.00 H new ATOM 2340 N ALA B 10 0.849 -4.577 2.925 1.00 0.00 N ATOM 2341 CA ALA B 10 1.275 -5.644 2.073 1.00 0.00 C ATOM 2342 C ALA B 10 1.046 -5.540 0.605 1.00 0.00 C ATOM 2343 O ALA B 10 1.970 -5.666 -0.197 1.00 0.00 O ATOM 2344 CB ALA B 10 0.765 -6.961 2.681 1.00 0.00 C ATOM 0 H ALA B 10 0.229 -4.892 3.671 1.00 0.00 H new ATOM 0 HA ALA B 10 2.364 -5.587 2.065 1.00 0.00 H new ATOM 0 HB1 ALA B 10 1.075 -7.796 2.052 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.181 -7.086 3.681 1.00 0.00 H new ATOM 0 HB3 ALA B 10 -0.323 -6.936 2.742 1.00 0.00 H new ATOM 2350 N VAL B 11 -0.171 -5.241 0.117 1.00 0.00 N ATOM 2351 CA VAL B 11 -0.524 -5.053 -1.256 1.00 0.00 C ATOM 2352 C VAL B 11 -0.052 -3.719 -1.722 1.00 0.00 C ATOM 2353 O VAL B 11 -0.063 -3.555 -2.941 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.956 -5.401 -1.538 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -2.939 -4.300 -1.104 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -2.182 -5.829 -2.998 1.00 0.00 C ATOM 0 H VAL B 11 -0.973 -5.121 0.735 1.00 0.00 H new ATOM 0 HA VAL B 11 0.006 -5.774 -1.879 1.00 0.00 H new ATOM 0 HB VAL B 11 -2.175 -6.269 -0.916 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -3.958 -4.611 -1.334 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -2.845 -4.130 -0.031 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -2.711 -3.378 -1.638 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -3.234 -6.070 -3.148 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.898 -5.014 -3.664 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.574 -6.707 -3.218 1.00 0.00 H new ATOM 2366 N ARG B 12 0.218 -2.676 -0.916 1.00 0.00 N ATOM 2367 CA ARG B 12 0.809 -1.483 -1.438 1.00 0.00 C ATOM 2368 C ARG B 12 2.278 -1.642 -1.627 1.00 0.00 C ATOM 2369 O ARG B 12 2.823 -1.008 -2.530 1.00 0.00 O ATOM 2370 CB ARG B 12 0.394 -0.332 -0.505 1.00 0.00 C ATOM 2371 CG ARG B 12 0.666 1.116 -0.919 1.00 0.00 C ATOM 2372 CD ARG B 12 0.086 2.138 0.061 1.00 0.00 C ATOM 2373 NE ARG B 12 0.117 3.399 -0.731 1.00 0.00 N ATOM 2374 CZ ARG B 12 -0.350 4.588 -0.250 1.00 0.00 C ATOM 2375 NH1 ARG B 12 -1.260 4.630 0.767 1.00 0.00 N ATOM 2376 NH2 ARG B 12 0.343 5.720 -0.570 1.00 0.00 N ATOM 0 H ARG B 12 0.030 -2.658 0.086 1.00 0.00 H new ATOM 0 HA ARG B 12 0.449 -1.254 -2.441 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -0.678 -0.425 -0.331 1.00 0.00 H new ATOM 0 HB3 ARG B 12 0.888 -0.495 0.453 1.00 0.00 H new ATOM 0 HG2 ARG B 12 1.742 1.269 -1.000 1.00 0.00 H new ATOM 0 HG3 ARG B 12 0.244 1.290 -1.909 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -0.927 1.876 0.368 1.00 0.00 H new ATOM 0 HD3 ARG B 12 0.684 2.214 0.969 1.00 0.00 H new ATOM 0 HE ARG B 12 0.504 3.373 -1.674 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -1.603 3.763 1.181 1.00 0.00 H new ATOM 0 HH12 ARG B 12 -1.597 5.528 1.113 1.00 0.00 H new ATOM 0 HH21 ARG B 12 1.180 5.659 -1.150 1.00 0.00 H new ATOM 0 HH22 ARG B 12 0.024 6.627 -0.229 1.00 0.00 H new ATOM 2390 N ALA B 13 2.928 -2.513 -0.835 1.00 0.00 N ATOM 2391 CA ALA B 13 4.275 -2.951 -1.026 1.00 0.00 C ATOM 2392 C ALA B 13 4.610 -3.723 -2.256 1.00 0.00 C ATOM 2393 O ALA B 13 5.752 -3.702 -2.713 1.00 0.00 O ATOM 2394 CB ALA B 13 4.713 -3.763 0.205 1.00 0.00 C ATOM 0 H ALA B 13 2.489 -2.934 -0.017 1.00 0.00 H new ATOM 0 HA ALA B 13 4.821 -2.018 -1.163 1.00 0.00 H new ATOM 0 HB1 ALA B 13 5.740 -4.103 0.070 1.00 0.00 H new ATOM 0 HB2 ALA B 13 4.652 -3.136 1.095 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.058 -4.626 0.323 1.00 0.00 H new ATOM 2400 N ILE B 14 3.580 -4.456 -2.714 1.00 0.00 N ATOM 2401 CA ILE B 14 3.639 -5.134 -3.972 1.00 0.00 C ATOM 2402 C ILE B 14 3.459 -4.103 -5.033 1.00 0.00 C ATOM 2403 O ILE B 14 4.187 -4.119 -6.024 1.00 0.00 O ATOM 2404 CB ILE B 14 2.626 -6.230 -4.118 1.00 0.00 C ATOM 2405 CG1 ILE B 14 3.291 -7.377 -3.338 1.00 0.00 C ATOM 2406 CG2 ILE B 14 2.261 -6.672 -5.545 1.00 0.00 C ATOM 2407 CD1 ILE B 14 2.463 -8.639 -3.097 1.00 0.00 C ATOM 0 H ILE B 14 2.702 -4.580 -2.210 1.00 0.00 H new ATOM 0 HA ILE B 14 4.604 -5.635 -4.053 1.00 0.00 H new ATOM 0 HB ILE B 14 1.654 -5.893 -3.757 1.00 0.00 H new ATOM 0 HG12 ILE B 14 4.197 -7.666 -3.871 1.00 0.00 H new ATOM 0 HG13 ILE B 14 3.602 -6.988 -2.368 1.00 0.00 H new ATOM 0 HG21 ILE B 14 1.519 -7.469 -5.500 1.00 0.00 H new ATOM 0 HG22 ILE B 14 1.851 -5.825 -6.094 1.00 0.00 H new ATOM 0 HG23 ILE B 14 3.154 -7.035 -6.053 1.00 0.00 H new ATOM 0 HD11 ILE B 14 3.056 -9.362 -2.537 1.00 0.00 H new ATOM 0 HD12 ILE B 14 1.569 -8.384 -2.528 1.00 0.00 H new ATOM 0 HD13 ILE B 14 2.173 -9.072 -4.054 1.00 0.00 H new ATOM 2419 N GLY B 15 2.562 -3.128 -4.799 1.00 0.00 N ATOM 2420 CA GLY B 15 2.249 -2.118 -5.761 1.00 0.00 C ATOM 2421 C GLY B 15 3.425 -1.245 -6.039 1.00 0.00 C ATOM 2422 O GLY B 15 3.685 -0.892 -7.188 1.00 0.00 O ATOM 0 H GLY B 15 2.044 -3.040 -3.925 1.00 0.00 H new ATOM 0 HA2 GLY B 15 1.916 -2.587 -6.687 1.00 0.00 H new ATOM 0 HA3 GLY B 15 1.421 -1.510 -5.396 1.00 0.00 H new ATOM 2426 N ARG B 16 4.127 -0.736 -5.010 1.00 0.00 N ATOM 2427 CA ARG B 16 5.193 0.211 -5.118 1.00 0.00 C ATOM 2428 C ARG B 16 6.446 -0.327 -5.719 1.00 0.00 C ATOM 2429 O ARG B 16 6.996 0.244 -6.660 1.00 0.00 O ATOM 2430 CB ARG B 16 5.419 0.794 -3.713 1.00 0.00 C ATOM 2431 CG ARG B 16 6.521 1.855 -3.685 1.00 0.00 C ATOM 2432 CD ARG B 16 6.145 3.162 -4.385 1.00 0.00 C ATOM 2433 NE ARG B 16 7.041 4.243 -3.886 1.00 0.00 N ATOM 2434 CZ ARG B 16 6.850 4.888 -2.698 1.00 0.00 C ATOM 2435 NH1 ARG B 16 5.733 4.772 -1.922 1.00 0.00 N ATOM 2436 NH2 ARG B 16 7.768 5.818 -2.304 1.00 0.00 N ATOM 0 H ARG B 16 3.938 -1.003 -4.044 1.00 0.00 H new ATOM 0 HA ARG B 16 4.901 0.988 -5.825 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.489 1.233 -3.352 1.00 0.00 H new ATOM 0 HB3 ARG B 16 5.679 -0.012 -3.027 1.00 0.00 H new ATOM 0 HG2 ARG B 16 6.777 2.071 -2.648 1.00 0.00 H new ATOM 0 HG3 ARG B 16 7.416 1.447 -4.156 1.00 0.00 H new ATOM 0 HD2 ARG B 16 6.246 3.055 -5.465 1.00 0.00 H new ATOM 0 HD3 ARG B 16 5.103 3.412 -4.185 1.00 0.00 H new ATOM 0 HE ARG B 16 7.838 4.515 -4.462 1.00 0.00 H new ATOM 0 HH11 ARG B 16 4.966 4.169 -2.219 1.00 0.00 H new ATOM 0 HH12 ARG B 16 5.666 5.288 -1.045 1.00 0.00 H new ATOM 0 HH21 ARG B 16 8.576 6.019 -2.893 1.00 0.00 H new ATOM 0 HH22 ARG B 16 7.646 6.312 -1.420 1.00 0.00 H new ATOM 2450 N LEU B 17 6.931 -1.520 -5.334 1.00 0.00 N ATOM 2451 CA LEU B 17 8.024 -2.203 -5.955 1.00 0.00 C ATOM 2452 C LEU B 17 7.728 -2.828 -7.274 1.00 0.00 C ATOM 2453 O LEU B 17 7.849 -4.027 -7.522 1.00 0.00 O ATOM 2454 CB LEU B 17 8.403 -3.280 -4.924 1.00 0.00 C ATOM 2455 CG LEU B 17 8.960 -2.809 -3.570 1.00 0.00 C ATOM 2456 CD1 LEU B 17 8.995 -3.985 -2.580 1.00 0.00 C ATOM 2457 CD2 LEU B 17 10.397 -2.278 -3.704 1.00 0.00 C ATOM 0 H LEU B 17 6.539 -2.037 -4.546 1.00 0.00 H new ATOM 0 HA LEU B 17 8.815 -1.493 -6.196 1.00 0.00 H new ATOM 0 HB2 LEU B 17 7.517 -3.885 -4.730 1.00 0.00 H new ATOM 0 HB3 LEU B 17 9.144 -3.936 -5.381 1.00 0.00 H new ATOM 0 HG LEU B 17 8.307 -2.012 -3.215 1.00 0.00 H new ATOM 0 HD11 LEU B 17 9.391 -3.644 -1.623 1.00 0.00 H new ATOM 0 HD12 LEU B 17 7.986 -4.371 -2.438 1.00 0.00 H new ATOM 0 HD13 LEU B 17 9.634 -4.775 -2.976 1.00 0.00 H new ATOM 0 HD21 LEU B 17 10.758 -1.954 -2.728 1.00 0.00 H new ATOM 0 HD22 LEU B 17 11.043 -3.069 -4.086 1.00 0.00 H new ATOM 0 HD23 LEU B 17 10.410 -1.434 -4.394 1.00 0.00 H new ATOM 2469 N SER B 18 7.259 -2.092 -8.298 1.00 0.00 N ATOM 2470 CA SER B 18 6.642 -2.535 -9.509 1.00 0.00 C ATOM 2471 C SER B 18 7.384 -2.001 -10.685 1.00 0.00 C ATOM 2472 O SER B 18 7.883 -2.830 -11.445 1.00 0.00 O ATOM 2473 CB SER B 18 5.187 -2.040 -9.564 1.00 0.00 C ATOM 2474 OG SER B 18 4.501 -2.499 -10.719 1.00 0.00 O ATOM 0 H SER B 18 7.321 -1.074 -8.270 1.00 0.00 H new ATOM 0 HA SER B 18 6.660 -3.625 -9.533 1.00 0.00 H new ATOM 0 HB2 SER B 18 4.658 -2.377 -8.673 1.00 0.00 H new ATOM 0 HB3 SER B 18 5.176 -0.950 -9.548 1.00 0.00 H new ATOM 0 HG SER B 18 3.547 -2.291 -10.637 1.00 0.00 H new ATOM 2480 N SER B 19 7.474 -0.663 -10.795 1.00 0.00 N ATOM 2481 CA SER B 19 8.082 0.053 -11.873 1.00 0.00 C ATOM 2482 C SER B 19 8.061 1.498 -11.397 1.00 0.00 C ATOM 2483 O SER B 19 9.114 2.162 -11.592 1.00 0.00 O ATOM 2484 CB SER B 19 7.349 -0.053 -13.221 1.00 0.00 C ATOM 2485 OG SER B 19 7.893 -1.175 -13.899 1.00 0.00 O ATOM 2486 OXT SER B 19 6.987 1.972 -10.938 1.00 0.00 O ATOM 0 H SER B 19 7.096 -0.040 -10.081 1.00 0.00 H new ATOM 0 HA SER B 19 9.071 -0.357 -12.079 1.00 0.00 H new ATOM 0 HB2 SER B 19 6.277 -0.176 -13.069 1.00 0.00 H new ATOM 0 HB3 SER B 19 7.485 0.856 -13.807 1.00 0.00 H new ATOM 0 HG SER B 19 8.016 -1.912 -13.265 1.00 0.00 H new TER 2492 SER B 19 HETATM 2493 CA CA A 151 13.555 -14.337 5.478 1.00 0.00 CA HETATM 2494 CA CA A 152 19.550 -4.099 3.850 1.00 0.00 CA HETATM 2495 CA CA A 153 -13.285 -8.638 -9.784 1.00 0.00 CA HETATM 2496 CA CA A 154 -19.150 -1.498 -2.738 1.00 0.00 CA