USER MOD reduce.3.24.130724 H: found=0, std=0, add=1221, rem=0, adj=34 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 Set 1.1: A 140 MET CE :methyl -153:sc= 0 (180deg=-0.381) USER MOD Set 1.2: A 141 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 2.1: A 105 MET CE :methyl 177:sc= -0.13 (180deg=-0.229) USER MOD Set 2.2: A 120 MET CE :methyl 179:sc= -0.164 (180deg=-0.121) USER MOD Set 2.3: B 7 THR OG1 : rot 101:sc= 1.08 USER MOD Set 3.1: A 103 HIS : no HD1:sc= -0.112 K(o=-0.35,f=-1.9) USER MOD Set 3.2: A 107 ASN : amide:sc= -0.237 K(o=-0.35,f=-1.9!) USER MOD Single : A 1 THR N :NH3+ -125:sc= 0.0275 (180deg=0) USER MOD Single : A 1 THR OG1 : rot 180:sc= 0 USER MOD Single : A 4 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 9 LYS NZ :NH3+ -157:sc= -0.111 (180deg=-0.757) USER MOD Single : A 13 SER OG : rot 76:sc= 1.22 USER MOD Single : A 17 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 22 THR OG1 : rot -105:sc= 1.2 USER MOD Single : A 24 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 THR OG1 : rot 116:sc= 1.27 USER MOD Single : A 26 LYS NZ :NH3+ -130:sc= 0.772 (180deg=-0.754!) USER MOD Single : A 30 THR OG1 : rot 76:sc= 0.0889 USER MOD Single : A 32 MET CE :methyl -127:sc= -0.678 (180deg=-0.812) USER MOD Single : A 34 SER OG : rot 72:sc= 0.343 USER MOD Single : A 37 GLN : amide:sc= 0 K(o=0,f=-1.4) USER MOD Single : A 38 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 40 THR OG1 : rot 180:sc= 0 USER MOD Single : A 45 GLN : amide:sc= 0 K(o=0,f=-0.59) USER MOD Single : A 47 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 49 ASN : amide:sc= -0.303 K(o=-0.3,f=-2.8!) USER MOD Single : A 56 ASN : amide:sc= -0.161 K(o=-0.16,f=-0.89) USER MOD Single : A 58 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 THR OG1 : rot 180:sc= 0 USER MOD Single : A 67 MET CE :methyl -175:sc= 0 (180deg=-0.0199) USER MOD Single : A 68 MET CE :methyl -155:sc= -0.142 (180deg=-0.912) USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 73 LYS NZ :NH3+ -125:sc= 1.14 (180deg=0.382) USER MOD Single : A 75 THR OG1 : rot 180:sc= -0.03 USER MOD Single : A 77 SER OG : rot 180:sc= 0.407 USER MOD Single : A 90 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 ASN : amide:sc= 0.571 K(o=0.57,f=-7.1!) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 106 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 113 THR OG1 : rot 124:sc= 1.28 USER MOD Single : A 131 GLN : amide:sc= -0.0815 K(o=-0.082,f=-0.6) USER MOD Single : A 133 ASN : amide:sc= 0.966 K(o=0.97,f=-5.5!) USER MOD Single : A 134 TYR OH : rot 180:sc= 0 USER MOD Single : A 139 GLN : amide:sc= -0.0141 X(o=-0.014,f=-0.014) USER MOD Single : A 142 THR OG1 : rot 180:sc= 0 USER MOD Single : B 1 ARG N :NH3+ -138:sc= 1.34 (180deg=0.483) USER MOD Single : B 3 LYS NZ :NH3+ -177:sc= 1.94 (180deg=1.87) USER MOD Single : B 5 GLN : amide:sc= -0.288 K(o=-0.29,f=-1.9) USER MOD Single : B 6 LYS NZ :NH3+ 168:sc= 1.22 (180deg=0.43) USER MOD Single : B 9 HIS : no HD1:sc= -0.119 X(o=-0.12,f=-0.13) USER MOD Single : B 18 SER OG : rot 149:sc= 1.21 USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 4.584 7.281 15.719 1.00 0.00 N ATOM 2 CA THR A 1 4.195 6.503 16.917 1.00 0.00 C ATOM 3 C THR A 1 4.673 5.098 16.792 1.00 0.00 C ATOM 4 O THR A 1 5.154 4.579 15.786 1.00 0.00 O ATOM 5 CB THR A 1 2.760 6.527 17.353 1.00 0.00 C ATOM 6 OG1 THR A 1 1.995 5.893 16.339 1.00 0.00 O ATOM 7 CG2 THR A 1 1.979 7.851 17.303 1.00 0.00 C ATOM 0 H1 THR A 1 5.120 8.123 16.011 1.00 0.00 H new ATOM 0 H2 THR A 1 5.176 6.692 15.100 1.00 0.00 H new ATOM 0 H3 THR A 1 3.730 7.575 15.204 1.00 0.00 H new ATOM 0 HA THR A 1 4.694 7.041 17.723 1.00 0.00 H new ATOM 0 HB THR A 1 2.848 6.138 18.367 1.00 0.00 H new ATOM 0 HG1 THR A 1 1.049 5.891 16.596 1.00 0.00 H new ATOM 0 HG21 THR A 1 0.960 7.686 17.653 1.00 0.00 H new ATOM 0 HG22 THR A 1 2.467 8.586 17.943 1.00 0.00 H new ATOM 0 HG23 THR A 1 1.955 8.221 16.278 1.00 0.00 H new ATOM 14 N GLU A 2 4.545 4.342 17.898 1.00 0.00 N ATOM 15 CA GLU A 2 4.831 2.956 18.100 1.00 0.00 C ATOM 16 C GLU A 2 3.871 1.982 17.510 1.00 0.00 C ATOM 17 O GLU A 2 4.237 0.888 17.082 1.00 0.00 O ATOM 18 CB GLU A 2 4.891 2.612 19.598 1.00 0.00 C ATOM 19 CG GLU A 2 3.645 2.612 20.486 1.00 0.00 C ATOM 20 CD GLU A 2 2.893 3.933 20.418 1.00 0.00 C ATOM 21 OE1 GLU A 2 3.380 4.977 20.927 1.00 0.00 O ATOM 22 OE2 GLU A 2 1.804 3.886 19.786 1.00 0.00 O ATOM 0 H GLU A 2 4.195 4.763 18.759 1.00 0.00 H new ATOM 0 HA GLU A 2 5.785 2.847 17.583 1.00 0.00 H new ATOM 0 HB2 GLU A 2 5.329 1.617 19.673 1.00 0.00 H new ATOM 0 HB3 GLU A 2 5.598 3.307 20.051 1.00 0.00 H new ATOM 0 HG2 GLU A 2 2.983 1.802 20.180 1.00 0.00 H new ATOM 0 HG3 GLU A 2 3.936 2.414 21.518 1.00 0.00 H new ATOM 29 N GLU A 3 2.644 2.495 17.309 1.00 0.00 N ATOM 30 CA GLU A 3 1.587 1.813 16.630 1.00 0.00 C ATOM 31 C GLU A 3 1.707 1.802 15.145 1.00 0.00 C ATOM 32 O GLU A 3 1.466 0.807 14.464 1.00 0.00 O ATOM 33 CB GLU A 3 0.218 2.359 17.069 1.00 0.00 C ATOM 34 CG GLU A 3 -0.906 1.329 16.943 1.00 0.00 C ATOM 35 CD GLU A 3 -0.777 0.038 17.739 1.00 0.00 C ATOM 36 OE1 GLU A 3 -1.258 0.168 18.896 1.00 0.00 O ATOM 37 OE2 GLU A 3 -0.446 -1.061 17.219 1.00 0.00 O ATOM 0 H GLU A 3 2.378 3.425 17.634 1.00 0.00 H new ATOM 0 HA GLU A 3 1.676 0.769 16.929 1.00 0.00 H new ATOM 0 HB2 GLU A 3 0.282 2.694 18.104 1.00 0.00 H new ATOM 0 HB3 GLU A 3 -0.029 3.233 16.466 1.00 0.00 H new ATOM 0 HG2 GLU A 3 -1.838 1.812 17.237 1.00 0.00 H new ATOM 0 HG3 GLU A 3 -1.002 1.065 15.890 1.00 0.00 H new ATOM 44 N GLN A 4 2.233 2.940 14.656 1.00 0.00 N ATOM 45 CA GLN A 4 2.667 2.985 13.295 1.00 0.00 C ATOM 46 C GLN A 4 3.795 2.095 12.902 1.00 0.00 C ATOM 47 O GLN A 4 3.643 1.344 11.939 1.00 0.00 O ATOM 48 CB GLN A 4 3.071 4.433 12.968 1.00 0.00 C ATOM 49 CG GLN A 4 3.415 4.692 11.500 1.00 0.00 C ATOM 50 CD GLN A 4 3.755 6.153 11.244 1.00 0.00 C ATOM 51 OE1 GLN A 4 4.857 6.662 11.442 1.00 0.00 O ATOM 52 NE2 GLN A 4 2.689 6.894 10.840 1.00 0.00 N ATOM 0 H GLN A 4 2.355 3.804 15.184 1.00 0.00 H new ATOM 0 HA GLN A 4 1.814 2.613 12.728 1.00 0.00 H new ATOM 0 HB2 GLN A 4 2.255 5.096 13.257 1.00 0.00 H new ATOM 0 HB3 GLN A 4 3.932 4.701 13.580 1.00 0.00 H new ATOM 0 HG2 GLN A 4 4.259 4.067 11.210 1.00 0.00 H new ATOM 0 HG3 GLN A 4 2.572 4.401 10.873 1.00 0.00 H new ATOM 0 HE21 GLN A 4 1.786 6.446 10.683 1.00 0.00 H new ATOM 0 HE22 GLN A 4 2.792 7.898 10.694 1.00 0.00 H new ATOM 61 N ILE A 5 4.846 2.107 13.741 1.00 0.00 N ATOM 62 CA ILE A 5 5.801 1.044 13.795 1.00 0.00 C ATOM 63 C ILE A 5 5.244 -0.335 13.701 1.00 0.00 C ATOM 64 O ILE A 5 5.555 -1.115 12.802 1.00 0.00 O ATOM 65 CB ILE A 5 6.753 1.108 14.953 1.00 0.00 C ATOM 66 CG1 ILE A 5 7.535 2.427 15.064 1.00 0.00 C ATOM 67 CG2 ILE A 5 7.712 -0.094 14.937 1.00 0.00 C ATOM 68 CD1 ILE A 5 8.277 2.858 13.799 1.00 0.00 C ATOM 0 H ILE A 5 5.036 2.868 14.393 1.00 0.00 H new ATOM 0 HA ILE A 5 6.358 1.235 12.878 1.00 0.00 H new ATOM 0 HB ILE A 5 6.128 1.066 15.845 1.00 0.00 H new ATOM 0 HG12 ILE A 5 6.841 3.219 15.345 1.00 0.00 H new ATOM 0 HG13 ILE A 5 8.258 2.334 15.875 1.00 0.00 H new ATOM 0 HG21 ILE A 5 8.393 -0.027 15.785 1.00 0.00 H new ATOM 0 HG22 ILE A 5 7.138 -1.018 15.004 1.00 0.00 H new ATOM 0 HG23 ILE A 5 8.285 -0.090 14.010 1.00 0.00 H new ATOM 0 HD11 ILE A 5 8.795 3.799 13.984 1.00 0.00 H new ATOM 0 HD12 ILE A 5 9.002 2.092 13.524 1.00 0.00 H new ATOM 0 HD13 ILE A 5 7.563 2.991 12.986 1.00 0.00 H new ATOM 80 N ALA A 6 4.266 -0.761 14.521 1.00 0.00 N ATOM 81 CA ALA A 6 3.543 -1.994 14.532 1.00 0.00 C ATOM 82 C ALA A 6 2.933 -2.303 13.208 1.00 0.00 C ATOM 83 O ALA A 6 3.003 -3.350 12.566 1.00 0.00 O ATOM 84 CB ALA A 6 2.505 -2.055 15.666 1.00 0.00 C ATOM 0 H ALA A 6 3.944 -0.155 15.275 1.00 0.00 H new ATOM 0 HA ALA A 6 4.276 -2.775 14.734 1.00 0.00 H new ATOM 0 HB1 ALA A 6 1.983 -3.011 15.631 1.00 0.00 H new ATOM 0 HB2 ALA A 6 3.009 -1.952 16.627 1.00 0.00 H new ATOM 0 HB3 ALA A 6 1.786 -1.245 15.545 1.00 0.00 H new ATOM 90 N GLU A 7 2.305 -1.275 12.609 1.00 0.00 N ATOM 91 CA GLU A 7 1.663 -1.401 11.337 1.00 0.00 C ATOM 92 C GLU A 7 2.547 -1.981 10.286 1.00 0.00 C ATOM 93 O GLU A 7 2.185 -2.962 9.638 1.00 0.00 O ATOM 94 CB GLU A 7 1.027 -0.122 10.767 1.00 0.00 C ATOM 95 CG GLU A 7 -0.301 0.243 11.433 1.00 0.00 C ATOM 96 CD GLU A 7 -1.063 1.417 10.835 1.00 0.00 C ATOM 97 OE1 GLU A 7 -0.695 1.885 9.724 1.00 0.00 O ATOM 98 OE2 GLU A 7 -1.942 1.962 11.555 1.00 0.00 O ATOM 0 H GLU A 7 2.242 -0.341 13.014 1.00 0.00 H new ATOM 0 HA GLU A 7 0.851 -2.087 11.578 1.00 0.00 H new ATOM 0 HB2 GLU A 7 1.725 0.707 10.886 1.00 0.00 H new ATOM 0 HB3 GLU A 7 0.865 -0.251 9.697 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -0.949 -0.633 11.405 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -0.107 0.462 12.483 1.00 0.00 H new ATOM 105 N PHE A 8 3.771 -1.433 10.186 1.00 0.00 N ATOM 106 CA PHE A 8 4.789 -1.945 9.322 1.00 0.00 C ATOM 107 C PHE A 8 5.443 -3.210 9.760 1.00 0.00 C ATOM 108 O PHE A 8 5.862 -3.994 8.910 1.00 0.00 O ATOM 109 CB PHE A 8 5.820 -0.849 9.005 1.00 0.00 C ATOM 110 CG PHE A 8 5.288 0.333 8.270 1.00 0.00 C ATOM 111 CD1 PHE A 8 4.639 0.161 7.070 1.00 0.00 C ATOM 112 CD2 PHE A 8 5.341 1.552 8.902 1.00 0.00 C ATOM 113 CE1 PHE A 8 4.186 1.309 6.465 1.00 0.00 C ATOM 114 CE2 PHE A 8 4.903 2.684 8.256 1.00 0.00 C ATOM 115 CZ PHE A 8 4.366 2.565 6.996 1.00 0.00 C ATOM 0 H PHE A 8 4.060 -0.613 10.719 1.00 0.00 H new ATOM 0 HA PHE A 8 4.266 -2.237 8.411 1.00 0.00 H new ATOM 0 HB2 PHE A 8 6.260 -0.506 9.941 1.00 0.00 H new ATOM 0 HB3 PHE A 8 6.625 -1.290 8.417 1.00 0.00 H new ATOM 0 HD1 PHE A 8 4.494 -0.815 6.630 1.00 0.00 H new ATOM 0 HD2 PHE A 8 5.727 1.621 9.908 1.00 0.00 H new ATOM 0 HE1 PHE A 8 3.662 1.220 5.525 1.00 0.00 H new ATOM 0 HE2 PHE A 8 4.980 3.651 8.731 1.00 0.00 H new ATOM 0 HZ PHE A 8 4.090 3.444 6.432 1.00 0.00 H new ATOM 125 N LYS A 9 5.412 -3.549 11.061 1.00 0.00 N ATOM 126 CA LYS A 9 5.857 -4.802 11.588 1.00 0.00 C ATOM 127 C LYS A 9 4.982 -5.931 11.162 1.00 0.00 C ATOM 128 O LYS A 9 5.342 -6.979 10.628 1.00 0.00 O ATOM 129 CB LYS A 9 5.962 -4.752 13.122 1.00 0.00 C ATOM 130 CG LYS A 9 6.896 -5.841 13.652 1.00 0.00 C ATOM 131 CD LYS A 9 7.382 -5.601 15.083 1.00 0.00 C ATOM 132 CE LYS A 9 8.291 -6.746 15.534 1.00 0.00 C ATOM 133 NZ LYS A 9 7.501 -7.997 15.535 1.00 0.00 N ATOM 0 H LYS A 9 5.059 -2.918 11.781 1.00 0.00 H new ATOM 0 HA LYS A 9 6.850 -4.983 11.178 1.00 0.00 H new ATOM 0 HB2 LYS A 9 6.329 -3.773 13.432 1.00 0.00 H new ATOM 0 HB3 LYS A 9 4.972 -4.875 13.560 1.00 0.00 H new ATOM 0 HG2 LYS A 9 6.380 -6.800 13.611 1.00 0.00 H new ATOM 0 HG3 LYS A 9 7.761 -5.916 12.993 1.00 0.00 H new ATOM 0 HD2 LYS A 9 7.922 -4.656 15.137 1.00 0.00 H new ATOM 0 HD3 LYS A 9 6.528 -5.519 15.755 1.00 0.00 H new ATOM 0 HE2 LYS A 9 9.146 -6.838 14.864 1.00 0.00 H new ATOM 0 HE3 LYS A 9 8.687 -6.546 16.530 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 7.941 -8.685 16.180 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 6.532 -7.795 15.853 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 7.475 -8.392 14.573 1.00 0.00 H new ATOM 147 N GLU A 10 3.666 -5.684 11.287 1.00 0.00 N ATOM 148 CA GLU A 10 2.641 -6.476 10.683 1.00 0.00 C ATOM 149 C GLU A 10 2.762 -6.766 9.226 1.00 0.00 C ATOM 150 O GLU A 10 2.818 -7.928 8.827 1.00 0.00 O ATOM 151 CB GLU A 10 1.296 -5.870 11.119 1.00 0.00 C ATOM 152 CG GLU A 10 0.169 -6.904 11.160 1.00 0.00 C ATOM 153 CD GLU A 10 0.003 -7.546 12.530 1.00 0.00 C ATOM 154 OE1 GLU A 10 -0.358 -6.743 13.431 1.00 0.00 O ATOM 155 OE2 GLU A 10 0.257 -8.771 12.681 1.00 0.00 O ATOM 0 H GLU A 10 3.302 -4.901 11.830 1.00 0.00 H new ATOM 0 HA GLU A 10 2.744 -7.497 11.051 1.00 0.00 H new ATOM 0 HB2 GLU A 10 1.407 -5.420 12.106 1.00 0.00 H new ATOM 0 HB3 GLU A 10 1.024 -5.068 10.432 1.00 0.00 H new ATOM 0 HG2 GLU A 10 -0.767 -6.425 10.873 1.00 0.00 H new ATOM 0 HG3 GLU A 10 0.369 -7.681 10.422 1.00 0.00 H new ATOM 162 N ALA A 11 2.900 -5.698 8.421 1.00 0.00 N ATOM 163 CA ALA A 11 3.056 -5.675 6.999 1.00 0.00 C ATOM 164 C ALA A 11 4.198 -6.496 6.507 1.00 0.00 C ATOM 165 O ALA A 11 4.100 -7.241 5.533 1.00 0.00 O ATOM 166 CB ALA A 11 3.164 -4.231 6.481 1.00 0.00 C ATOM 0 H ALA A 11 2.902 -4.754 8.808 1.00 0.00 H new ATOM 0 HA ALA A 11 2.155 -6.136 6.594 1.00 0.00 H new ATOM 0 HB1 ALA A 11 3.282 -4.241 5.397 1.00 0.00 H new ATOM 0 HB2 ALA A 11 2.259 -3.682 6.743 1.00 0.00 H new ATOM 0 HB3 ALA A 11 4.027 -3.745 6.935 1.00 0.00 H new ATOM 172 N PHE A 12 5.381 -6.319 7.121 1.00 0.00 N ATOM 173 CA PHE A 12 6.611 -7.006 6.875 1.00 0.00 C ATOM 174 C PHE A 12 6.368 -8.466 7.045 1.00 0.00 C ATOM 175 O PHE A 12 6.858 -9.241 6.225 1.00 0.00 O ATOM 176 CB PHE A 12 7.608 -6.495 7.929 1.00 0.00 C ATOM 177 CG PHE A 12 9.050 -6.835 7.771 1.00 0.00 C ATOM 178 CD1 PHE A 12 9.383 -8.128 8.101 1.00 0.00 C ATOM 179 CD2 PHE A 12 9.959 -5.983 7.190 1.00 0.00 C ATOM 180 CE1 PHE A 12 10.666 -8.556 7.852 1.00 0.00 C ATOM 181 CE2 PHE A 12 11.195 -6.463 6.825 1.00 0.00 C ATOM 182 CZ PHE A 12 11.563 -7.727 7.221 1.00 0.00 C ATOM 0 H PHE A 12 5.484 -5.626 7.862 1.00 0.00 H new ATOM 0 HA PHE A 12 6.999 -6.833 5.871 1.00 0.00 H new ATOM 0 HB2 PHE A 12 7.526 -5.409 7.963 1.00 0.00 H new ATOM 0 HB3 PHE A 12 7.284 -6.870 8.900 1.00 0.00 H new ATOM 0 HD1 PHE A 12 8.655 -8.791 8.545 1.00 0.00 H new ATOM 0 HD2 PHE A 12 9.705 -4.947 7.022 1.00 0.00 H new ATOM 0 HE1 PHE A 12 10.970 -9.547 8.153 1.00 0.00 H new ATOM 0 HE2 PHE A 12 11.867 -5.856 6.236 1.00 0.00 H new ATOM 0 HZ PHE A 12 12.569 -8.073 7.034 1.00 0.00 H new ATOM 192 N SER A 13 5.728 -8.940 8.129 1.00 0.00 N ATOM 193 CA SER A 13 5.558 -10.281 8.595 1.00 0.00 C ATOM 194 C SER A 13 4.930 -11.160 7.568 1.00 0.00 C ATOM 195 O SER A 13 5.215 -12.356 7.569 1.00 0.00 O ATOM 196 CB SER A 13 4.740 -10.395 9.892 1.00 0.00 C ATOM 197 OG SER A 13 5.344 -9.685 10.964 1.00 0.00 O ATOM 0 H SER A 13 5.268 -8.287 8.763 1.00 0.00 H new ATOM 0 HA SER A 13 6.574 -10.615 8.804 1.00 0.00 H new ATOM 0 HB2 SER A 13 3.735 -10.009 9.722 1.00 0.00 H new ATOM 0 HB3 SER A 13 4.637 -11.445 10.165 1.00 0.00 H new ATOM 0 HG SER A 13 5.185 -8.725 10.851 1.00 0.00 H new ATOM 203 N LEU A 14 3.996 -10.635 6.755 1.00 0.00 N ATOM 204 CA LEU A 14 3.337 -11.256 5.648 1.00 0.00 C ATOM 205 C LEU A 14 4.250 -11.794 4.600 1.00 0.00 C ATOM 206 O LEU A 14 4.021 -12.831 3.979 1.00 0.00 O ATOM 207 CB LEU A 14 2.222 -10.338 5.121 1.00 0.00 C ATOM 208 CG LEU A 14 1.383 -10.961 3.993 1.00 0.00 C ATOM 209 CD1 LEU A 14 0.498 -12.175 4.322 1.00 0.00 C ATOM 210 CD2 LEU A 14 0.573 -9.786 3.419 1.00 0.00 C ATOM 0 H LEU A 14 3.671 -9.677 6.889 1.00 0.00 H new ATOM 0 HA LEU A 14 2.864 -12.166 6.017 1.00 0.00 H new ATOM 0 HB2 LEU A 14 1.562 -10.073 5.947 1.00 0.00 H new ATOM 0 HB3 LEU A 14 2.668 -9.412 4.759 1.00 0.00 H new ATOM 0 HG LEU A 14 2.068 -11.428 3.286 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.028 -12.496 3.423 1.00 0.00 H new ATOM 0 HD12 LEU A 14 1.121 -12.991 4.688 1.00 0.00 H new ATOM 0 HD13 LEU A 14 -0.227 -11.900 5.088 1.00 0.00 H new ATOM 0 HD21 LEU A 14 -0.057 -10.142 2.604 1.00 0.00 H new ATOM 0 HD22 LEU A 14 -0.053 -9.359 4.202 1.00 0.00 H new ATOM 0 HD23 LEU A 14 1.255 -9.023 3.043 1.00 0.00 H new ATOM 222 N PHE A 15 5.316 -11.030 4.303 1.00 0.00 N ATOM 223 CA PHE A 15 6.174 -11.231 3.177 1.00 0.00 C ATOM 224 C PHE A 15 7.189 -12.269 3.511 1.00 0.00 C ATOM 225 O PHE A 15 7.519 -13.090 2.656 1.00 0.00 O ATOM 226 CB PHE A 15 7.048 -9.993 2.917 1.00 0.00 C ATOM 227 CG PHE A 15 6.294 -8.961 2.151 1.00 0.00 C ATOM 228 CD1 PHE A 15 6.169 -8.962 0.781 1.00 0.00 C ATOM 229 CD2 PHE A 15 5.741 -7.887 2.807 1.00 0.00 C ATOM 230 CE1 PHE A 15 5.490 -7.965 0.121 1.00 0.00 C ATOM 231 CE2 PHE A 15 5.222 -6.787 2.167 1.00 0.00 C ATOM 232 CZ PHE A 15 5.018 -6.872 0.810 1.00 0.00 C ATOM 0 H PHE A 15 5.593 -10.233 4.876 1.00 0.00 H new ATOM 0 HA PHE A 15 5.526 -11.479 2.337 1.00 0.00 H new ATOM 0 HB2 PHE A 15 7.384 -9.574 3.866 1.00 0.00 H new ATOM 0 HB3 PHE A 15 7.941 -10.283 2.363 1.00 0.00 H new ATOM 0 HD1 PHE A 15 6.614 -9.764 0.211 1.00 0.00 H new ATOM 0 HD2 PHE A 15 5.713 -7.909 3.886 1.00 0.00 H new ATOM 0 HE1 PHE A 15 5.326 -8.040 -0.944 1.00 0.00 H new ATOM 0 HE2 PHE A 15 4.982 -5.886 2.712 1.00 0.00 H new ATOM 0 HZ PHE A 15 4.491 -6.086 0.289 1.00 0.00 H new ATOM 242 N ASP A 16 7.673 -12.279 4.765 1.00 0.00 N ATOM 243 CA ASP A 16 8.821 -13.038 5.155 1.00 0.00 C ATOM 244 C ASP A 16 8.430 -14.471 5.268 1.00 0.00 C ATOM 245 O ASP A 16 7.492 -14.775 6.005 1.00 0.00 O ATOM 246 CB ASP A 16 9.526 -12.473 6.400 1.00 0.00 C ATOM 247 CG ASP A 16 10.922 -13.053 6.578 1.00 0.00 C ATOM 248 OD1 ASP A 16 10.990 -14.288 6.816 1.00 0.00 O ATOM 249 OD2 ASP A 16 11.950 -12.379 6.298 1.00 0.00 O ATOM 0 H ASP A 16 7.256 -11.746 5.528 1.00 0.00 H new ATOM 0 HA ASP A 16 9.586 -12.957 4.383 1.00 0.00 H new ATOM 0 HB2 ASP A 16 9.592 -11.388 6.318 1.00 0.00 H new ATOM 0 HB3 ASP A 16 8.928 -12.690 7.285 1.00 0.00 H new ATOM 254 N LYS A 17 9.084 -15.411 4.563 1.00 0.00 N ATOM 255 CA LYS A 17 8.702 -16.789 4.535 1.00 0.00 C ATOM 256 C LYS A 17 9.218 -17.667 5.622 1.00 0.00 C ATOM 257 O LYS A 17 8.687 -18.751 5.857 1.00 0.00 O ATOM 258 CB LYS A 17 9.089 -17.520 3.238 1.00 0.00 C ATOM 259 CG LYS A 17 8.537 -16.828 1.990 1.00 0.00 C ATOM 260 CD LYS A 17 7.041 -17.040 1.751 1.00 0.00 C ATOM 261 CE LYS A 17 6.517 -17.037 0.314 1.00 0.00 C ATOM 262 NZ LYS A 17 5.105 -17.481 0.308 1.00 0.00 N ATOM 0 H LYS A 17 9.905 -15.206 3.994 1.00 0.00 H new ATOM 0 HA LYS A 17 7.626 -16.663 4.652 1.00 0.00 H new ATOM 0 HB2 LYS A 17 10.175 -17.578 3.167 1.00 0.00 H new ATOM 0 HB3 LYS A 17 8.717 -18.544 3.277 1.00 0.00 H new ATOM 0 HG2 LYS A 17 8.731 -15.758 2.069 1.00 0.00 H new ATOM 0 HG3 LYS A 17 9.085 -17.188 1.119 1.00 0.00 H new ATOM 0 HD2 LYS A 17 6.767 -17.995 2.200 1.00 0.00 H new ATOM 0 HD3 LYS A 17 6.506 -16.264 2.299 1.00 0.00 H new ATOM 0 HE2 LYS A 17 6.598 -16.037 -0.113 1.00 0.00 H new ATOM 0 HE3 LYS A 17 7.121 -17.698 -0.307 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 4.745 -17.480 -0.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 5.042 -18.442 0.700 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 4.535 -16.833 0.888 1.00 0.00 H new ATOM 276 N ASP A 18 10.259 -17.231 6.353 1.00 0.00 N ATOM 277 CA ASP A 18 10.941 -17.834 7.456 1.00 0.00 C ATOM 278 C ASP A 18 10.311 -17.362 8.722 1.00 0.00 C ATOM 279 O ASP A 18 9.826 -18.086 9.590 1.00 0.00 O ATOM 280 CB ASP A 18 12.464 -17.627 7.414 1.00 0.00 C ATOM 281 CG ASP A 18 13.066 -17.748 6.021 1.00 0.00 C ATOM 282 OD1 ASP A 18 13.278 -18.900 5.557 1.00 0.00 O ATOM 283 OD2 ASP A 18 13.409 -16.665 5.476 1.00 0.00 O ATOM 0 H ASP A 18 10.677 -16.327 6.135 1.00 0.00 H new ATOM 0 HA ASP A 18 10.828 -18.916 7.393 1.00 0.00 H new ATOM 0 HB2 ASP A 18 12.698 -16.641 7.815 1.00 0.00 H new ATOM 0 HB3 ASP A 18 12.938 -18.358 8.069 1.00 0.00 H new ATOM 288 N GLY A 19 10.326 -16.030 8.906 1.00 0.00 N ATOM 289 CA GLY A 19 10.074 -15.296 10.107 1.00 0.00 C ATOM 290 C GLY A 19 11.399 -15.004 10.723 1.00 0.00 C ATOM 291 O GLY A 19 11.493 -14.843 11.939 1.00 0.00 O ATOM 0 H GLY A 19 10.537 -15.404 8.129 1.00 0.00 H new ATOM 0 HA2 GLY A 19 9.538 -14.372 9.890 1.00 0.00 H new ATOM 0 HA3 GLY A 19 9.450 -15.874 10.789 1.00 0.00 H new ATOM 295 N ASP A 20 12.415 -14.645 9.919 1.00 0.00 N ATOM 296 CA ASP A 20 13.685 -14.342 10.503 1.00 0.00 C ATOM 297 C ASP A 20 13.880 -12.880 10.711 1.00 0.00 C ATOM 298 O ASP A 20 13.779 -12.415 11.845 1.00 0.00 O ATOM 299 CB ASP A 20 14.896 -15.002 9.822 1.00 0.00 C ATOM 300 CG ASP A 20 14.983 -14.819 8.313 1.00 0.00 C ATOM 301 OD1 ASP A 20 14.047 -14.276 7.667 1.00 0.00 O ATOM 302 OD2 ASP A 20 16.085 -15.268 7.899 1.00 0.00 O ATOM 0 H ASP A 20 12.365 -14.566 8.903 1.00 0.00 H new ATOM 0 HA ASP A 20 13.643 -14.812 11.485 1.00 0.00 H new ATOM 0 HB2 ASP A 20 15.805 -14.603 10.271 1.00 0.00 H new ATOM 0 HB3 ASP A 20 14.875 -16.070 10.040 1.00 0.00 H new ATOM 307 N GLY A 21 14.170 -12.073 9.674 1.00 0.00 N ATOM 308 CA GLY A 21 14.024 -10.662 9.850 1.00 0.00 C ATOM 309 C GLY A 21 14.523 -9.967 8.630 1.00 0.00 C ATOM 310 O GLY A 21 14.692 -8.749 8.590 1.00 0.00 O ATOM 0 H GLY A 21 14.491 -12.378 8.755 1.00 0.00 H new ATOM 0 HA2 GLY A 21 12.978 -10.411 10.025 1.00 0.00 H new ATOM 0 HA3 GLY A 21 14.582 -10.332 10.726 1.00 0.00 H new ATOM 314 N THR A 22 14.466 -10.725 7.521 1.00 0.00 N ATOM 315 CA THR A 22 14.980 -10.099 6.342 1.00 0.00 C ATOM 316 C THR A 22 14.377 -10.803 5.176 1.00 0.00 C ATOM 317 O THR A 22 14.472 -12.023 5.054 1.00 0.00 O ATOM 318 CB THR A 22 16.457 -10.191 6.098 1.00 0.00 C ATOM 319 OG1 THR A 22 17.194 -9.730 7.220 1.00 0.00 O ATOM 320 CG2 THR A 22 16.934 -9.339 4.910 1.00 0.00 C ATOM 0 H THR A 22 14.104 -11.675 7.435 1.00 0.00 H new ATOM 0 HA THR A 22 14.740 -9.044 6.474 1.00 0.00 H new ATOM 0 HB THR A 22 16.632 -11.248 5.895 1.00 0.00 H new ATOM 0 HG1 THR A 22 17.559 -8.841 7.029 1.00 0.00 H new ATOM 0 HG21 THR A 22 18.011 -9.452 4.790 1.00 0.00 H new ATOM 0 HG22 THR A 22 16.431 -9.669 4.001 1.00 0.00 H new ATOM 0 HG23 THR A 22 16.698 -8.291 5.096 1.00 0.00 H new ATOM 328 N ILE A 23 13.803 -10.002 4.261 1.00 0.00 N ATOM 329 CA ILE A 23 13.015 -10.421 3.143 1.00 0.00 C ATOM 330 C ILE A 23 13.895 -10.403 1.941 1.00 0.00 C ATOM 331 O ILE A 23 14.426 -9.369 1.540 1.00 0.00 O ATOM 332 CB ILE A 23 11.784 -9.639 2.791 1.00 0.00 C ATOM 333 CG1 ILE A 23 10.835 -9.309 3.955 1.00 0.00 C ATOM 334 CG2 ILE A 23 10.896 -10.412 1.802 1.00 0.00 C ATOM 335 CD1 ILE A 23 9.828 -8.189 3.698 1.00 0.00 C ATOM 0 H ILE A 23 13.897 -8.987 4.307 1.00 0.00 H new ATOM 0 HA ILE A 23 12.636 -11.396 3.450 1.00 0.00 H new ATOM 0 HB ILE A 23 12.210 -8.717 2.394 1.00 0.00 H new ATOM 0 HG12 ILE A 23 10.285 -10.213 4.217 1.00 0.00 H new ATOM 0 HG13 ILE A 23 11.436 -9.039 4.823 1.00 0.00 H new ATOM 0 HG21 ILE A 23 10.012 -9.819 1.567 1.00 0.00 H new ATOM 0 HG22 ILE A 23 11.456 -10.608 0.887 1.00 0.00 H new ATOM 0 HG23 ILE A 23 10.590 -11.357 2.250 1.00 0.00 H new ATOM 0 HD11 ILE A 23 9.212 -8.043 4.585 1.00 0.00 H new ATOM 0 HD12 ILE A 23 10.361 -7.266 3.470 1.00 0.00 H new ATOM 0 HD13 ILE A 23 9.192 -8.458 2.855 1.00 0.00 H new ATOM 347 N THR A 24 14.149 -11.542 1.272 1.00 0.00 N ATOM 348 CA THR A 24 15.053 -11.603 0.166 1.00 0.00 C ATOM 349 C THR A 24 14.344 -11.518 -1.141 1.00 0.00 C ATOM 350 O THR A 24 13.119 -11.638 -1.143 1.00 0.00 O ATOM 351 CB THR A 24 15.896 -12.844 0.172 1.00 0.00 C ATOM 352 OG1 THR A 24 15.223 -14.041 -0.190 1.00 0.00 O ATOM 353 CG2 THR A 24 16.581 -13.097 1.526 1.00 0.00 C ATOM 0 H THR A 24 13.718 -12.437 1.504 1.00 0.00 H new ATOM 0 HA THR A 24 15.704 -10.737 0.285 1.00 0.00 H new ATOM 0 HB THR A 24 16.631 -12.620 -0.601 1.00 0.00 H new ATOM 0 HG1 THR A 24 15.852 -14.792 -0.159 1.00 0.00 H new ATOM 0 HG21 THR A 24 17.176 -14.008 1.468 1.00 0.00 H new ATOM 0 HG22 THR A 24 17.229 -12.255 1.769 1.00 0.00 H new ATOM 0 HG23 THR A 24 15.824 -13.207 2.302 1.00 0.00 H new ATOM 361 N THR A 25 15.116 -11.579 -2.241 1.00 0.00 N ATOM 362 CA THR A 25 14.597 -11.631 -3.572 1.00 0.00 C ATOM 363 C THR A 25 13.855 -12.878 -3.912 1.00 0.00 C ATOM 364 O THR A 25 12.875 -12.900 -4.655 1.00 0.00 O ATOM 365 CB THR A 25 15.575 -11.399 -4.685 1.00 0.00 C ATOM 366 OG1 THR A 25 16.683 -12.288 -4.694 1.00 0.00 O ATOM 367 CG2 THR A 25 16.093 -9.963 -4.501 1.00 0.00 C ATOM 0 H THR A 25 16.135 -11.593 -2.202 1.00 0.00 H new ATOM 0 HA THR A 25 13.916 -10.781 -3.520 1.00 0.00 H new ATOM 0 HB THR A 25 15.061 -11.569 -5.631 1.00 0.00 H new ATOM 0 HG1 THR A 25 16.654 -12.838 -5.505 1.00 0.00 H new ATOM 0 HG21 THR A 25 16.813 -9.733 -5.286 1.00 0.00 H new ATOM 0 HG22 THR A 25 15.258 -9.265 -4.559 1.00 0.00 H new ATOM 0 HG23 THR A 25 16.575 -9.872 -3.528 1.00 0.00 H new ATOM 375 N LYS A 26 14.265 -13.983 -3.265 1.00 0.00 N ATOM 376 CA LYS A 26 13.604 -15.245 -3.384 1.00 0.00 C ATOM 377 C LYS A 26 12.214 -15.282 -2.850 1.00 0.00 C ATOM 378 O LYS A 26 11.301 -15.786 -3.503 1.00 0.00 O ATOM 379 CB LYS A 26 14.398 -16.524 -3.071 1.00 0.00 C ATOM 380 CG LYS A 26 15.639 -16.769 -3.932 1.00 0.00 C ATOM 381 CD LYS A 26 15.320 -17.386 -5.296 1.00 0.00 C ATOM 382 CE LYS A 26 16.548 -17.909 -6.043 1.00 0.00 C ATOM 383 NZ LYS A 26 17.547 -16.857 -6.335 1.00 0.00 N ATOM 0 H LYS A 26 15.075 -14.000 -2.645 1.00 0.00 H new ATOM 0 HA LYS A 26 13.527 -15.289 -4.470 1.00 0.00 H new ATOM 0 HB2 LYS A 26 14.706 -16.491 -2.026 1.00 0.00 H new ATOM 0 HB3 LYS A 26 13.730 -17.379 -3.179 1.00 0.00 H new ATOM 0 HG2 LYS A 26 16.160 -15.824 -4.082 1.00 0.00 H new ATOM 0 HG3 LYS A 26 16.321 -17.427 -3.394 1.00 0.00 H new ATOM 0 HD2 LYS A 26 14.615 -18.206 -5.157 1.00 0.00 H new ATOM 0 HD3 LYS A 26 14.822 -16.639 -5.914 1.00 0.00 H new ATOM 0 HE2 LYS A 26 17.019 -18.693 -5.450 1.00 0.00 H new ATOM 0 HE3 LYS A 26 16.228 -18.366 -6.979 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 17.810 -16.897 -7.340 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 17.141 -15.924 -6.121 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 18.393 -17.009 -5.750 1.00 0.00 H new ATOM 397 N GLU A 27 12.015 -14.707 -1.651 1.00 0.00 N ATOM 398 CA GLU A 27 10.763 -14.674 -0.962 1.00 0.00 C ATOM 399 C GLU A 27 9.751 -13.812 -1.636 1.00 0.00 C ATOM 400 O GLU A 27 8.559 -14.100 -1.732 1.00 0.00 O ATOM 401 CB GLU A 27 11.056 -14.244 0.486 1.00 0.00 C ATOM 402 CG GLU A 27 12.110 -15.067 1.230 1.00 0.00 C ATOM 403 CD GLU A 27 12.382 -14.540 2.632 1.00 0.00 C ATOM 404 OE1 GLU A 27 11.631 -14.826 3.603 1.00 0.00 O ATOM 405 OE2 GLU A 27 13.273 -13.671 2.828 1.00 0.00 O ATOM 0 H GLU A 27 12.764 -14.243 -1.137 1.00 0.00 H new ATOM 0 HA GLU A 27 10.304 -15.663 -0.970 1.00 0.00 H new ATOM 0 HB2 GLU A 27 11.377 -13.202 0.477 1.00 0.00 H new ATOM 0 HB3 GLU A 27 10.125 -14.286 1.052 1.00 0.00 H new ATOM 0 HG2 GLU A 27 11.778 -16.103 1.293 1.00 0.00 H new ATOM 0 HG3 GLU A 27 13.038 -15.064 0.658 1.00 0.00 H new ATOM 412 N LEU A 28 10.265 -12.759 -2.298 1.00 0.00 N ATOM 413 CA LEU A 28 9.576 -11.806 -3.112 1.00 0.00 C ATOM 414 C LEU A 28 9.318 -12.326 -4.484 1.00 0.00 C ATOM 415 O LEU A 28 8.251 -12.201 -5.083 1.00 0.00 O ATOM 416 CB LEU A 28 10.336 -10.469 -3.092 1.00 0.00 C ATOM 417 CG LEU A 28 10.109 -9.631 -1.822 1.00 0.00 C ATOM 418 CD1 LEU A 28 11.147 -8.497 -1.772 1.00 0.00 C ATOM 419 CD2 LEU A 28 8.727 -8.959 -1.741 1.00 0.00 C ATOM 0 H LEU A 28 11.264 -12.558 -2.257 1.00 0.00 H new ATOM 0 HA LEU A 28 8.586 -11.626 -2.694 1.00 0.00 H new ATOM 0 HB2 LEU A 28 11.402 -10.669 -3.195 1.00 0.00 H new ATOM 0 HB3 LEU A 28 10.036 -9.881 -3.960 1.00 0.00 H new ATOM 0 HG LEU A 28 10.194 -10.335 -0.994 1.00 0.00 H new ATOM 0 HD11 LEU A 28 10.991 -7.900 -0.874 1.00 0.00 H new ATOM 0 HD12 LEU A 28 12.150 -8.923 -1.755 1.00 0.00 H new ATOM 0 HD13 LEU A 28 11.037 -7.864 -2.652 1.00 0.00 H new ATOM 0 HD21 LEU A 28 8.653 -8.389 -0.815 1.00 0.00 H new ATOM 0 HD22 LEU A 28 8.598 -8.288 -2.591 1.00 0.00 H new ATOM 0 HD23 LEU A 28 7.949 -9.723 -1.760 1.00 0.00 H new ATOM 431 N GLY A 29 10.234 -13.054 -5.148 1.00 0.00 N ATOM 432 CA GLY A 29 9.969 -13.728 -6.381 1.00 0.00 C ATOM 433 C GLY A 29 8.932 -14.793 -6.281 1.00 0.00 C ATOM 434 O GLY A 29 8.143 -14.959 -7.210 1.00 0.00 O ATOM 0 H GLY A 29 11.190 -13.177 -4.816 1.00 0.00 H new ATOM 0 HA2 GLY A 29 9.651 -12.995 -7.122 1.00 0.00 H new ATOM 0 HA3 GLY A 29 10.895 -14.171 -6.747 1.00 0.00 H new ATOM 438 N THR A 30 8.846 -15.488 -5.133 1.00 0.00 N ATOM 439 CA THR A 30 7.843 -16.468 -4.854 1.00 0.00 C ATOM 440 C THR A 30 6.501 -15.827 -4.760 1.00 0.00 C ATOM 441 O THR A 30 5.542 -16.311 -5.359 1.00 0.00 O ATOM 442 CB THR A 30 8.187 -17.340 -3.683 1.00 0.00 C ATOM 443 OG1 THR A 30 9.306 -18.191 -3.887 1.00 0.00 O ATOM 444 CG2 THR A 30 6.962 -18.220 -3.380 1.00 0.00 C ATOM 0 H THR A 30 9.505 -15.361 -4.365 1.00 0.00 H new ATOM 0 HA THR A 30 7.804 -17.161 -5.695 1.00 0.00 H new ATOM 0 HB THR A 30 8.455 -16.675 -2.862 1.00 0.00 H new ATOM 0 HG1 THR A 30 10.132 -17.667 -3.820 1.00 0.00 H new ATOM 0 HG21 THR A 30 7.180 -18.868 -2.531 1.00 0.00 H new ATOM 0 HG22 THR A 30 6.108 -17.586 -3.142 1.00 0.00 H new ATOM 0 HG23 THR A 30 6.728 -18.831 -4.252 1.00 0.00 H new ATOM 452 N VAL A 31 6.410 -14.688 -4.051 1.00 0.00 N ATOM 453 CA VAL A 31 5.068 -14.254 -3.816 1.00 0.00 C ATOM 454 C VAL A 31 4.531 -13.518 -4.995 1.00 0.00 C ATOM 455 O VAL A 31 3.435 -13.855 -5.439 1.00 0.00 O ATOM 456 CB VAL A 31 5.030 -13.376 -2.600 1.00 0.00 C ATOM 457 CG1 VAL A 31 5.749 -12.020 -2.694 1.00 0.00 C ATOM 458 CG2 VAL A 31 3.534 -13.211 -2.283 1.00 0.00 C ATOM 0 H VAL A 31 7.170 -14.121 -3.676 1.00 0.00 H new ATOM 0 HA VAL A 31 4.443 -15.131 -3.652 1.00 0.00 H new ATOM 0 HB VAL A 31 5.602 -13.857 -1.807 1.00 0.00 H new ATOM 0 HG11 VAL A 31 5.645 -11.487 -1.749 1.00 0.00 H new ATOM 0 HG12 VAL A 31 6.806 -12.183 -2.904 1.00 0.00 H new ATOM 0 HG13 VAL A 31 5.307 -11.428 -3.495 1.00 0.00 H new ATOM 0 HG21 VAL A 31 3.416 -12.579 -1.403 1.00 0.00 H new ATOM 0 HG22 VAL A 31 3.031 -12.748 -3.132 1.00 0.00 H new ATOM 0 HG23 VAL A 31 3.093 -14.189 -2.089 1.00 0.00 H new ATOM 468 N MET A 32 5.282 -12.648 -5.694 1.00 0.00 N ATOM 469 CA MET A 32 4.860 -12.015 -6.905 1.00 0.00 C ATOM 470 C MET A 32 4.437 -13.009 -7.931 1.00 0.00 C ATOM 471 O MET A 32 3.460 -12.871 -8.665 1.00 0.00 O ATOM 472 CB MET A 32 5.940 -11.014 -7.351 1.00 0.00 C ATOM 473 CG MET A 32 5.988 -9.752 -6.487 1.00 0.00 C ATOM 474 SD MET A 32 7.223 -8.637 -7.220 1.00 0.00 S ATOM 475 CE MET A 32 7.023 -7.201 -6.126 1.00 0.00 C ATOM 0 H MET A 32 6.221 -12.375 -5.404 1.00 0.00 H new ATOM 0 HA MET A 32 3.954 -11.432 -6.738 1.00 0.00 H new ATOM 0 HB2 MET A 32 6.914 -11.503 -7.322 1.00 0.00 H new ATOM 0 HB3 MET A 32 5.757 -10.730 -8.387 1.00 0.00 H new ATOM 0 HG2 MET A 32 5.010 -9.272 -6.454 1.00 0.00 H new ATOM 0 HG3 MET A 32 6.256 -10.000 -5.460 1.00 0.00 H new ATOM 0 HE1 MET A 32 6.848 -6.308 -6.726 1.00 0.00 H new ATOM 0 HE2 MET A 32 6.174 -7.365 -5.462 1.00 0.00 H new ATOM 0 HE3 MET A 32 7.927 -7.067 -5.532 1.00 0.00 H new ATOM 485 N ARG A 33 5.144 -14.139 -8.107 1.00 0.00 N ATOM 486 CA ARG A 33 4.687 -15.288 -8.824 1.00 0.00 C ATOM 487 C ARG A 33 3.288 -15.752 -8.605 1.00 0.00 C ATOM 488 O ARG A 33 2.460 -15.974 -9.487 1.00 0.00 O ATOM 489 CB ARG A 33 5.564 -16.540 -8.658 1.00 0.00 C ATOM 490 CG ARG A 33 5.151 -17.747 -9.502 1.00 0.00 C ATOM 491 CD ARG A 33 6.069 -18.968 -9.581 1.00 0.00 C ATOM 492 NE ARG A 33 6.386 -19.526 -8.236 1.00 0.00 N ATOM 493 CZ ARG A 33 5.666 -20.392 -7.465 1.00 0.00 C ATOM 494 NH1 ARG A 33 4.445 -20.847 -7.874 1.00 0.00 N ATOM 495 NH2 ARG A 33 6.075 -20.727 -6.207 1.00 0.00 N ATOM 0 H ARG A 33 6.084 -14.257 -7.729 1.00 0.00 H new ATOM 0 HA ARG A 33 4.752 -14.862 -9.825 1.00 0.00 H new ATOM 0 HB2 ARG A 33 6.592 -16.278 -8.908 1.00 0.00 H new ATOM 0 HB3 ARG A 33 5.555 -16.832 -7.608 1.00 0.00 H new ATOM 0 HG2 ARG A 33 4.186 -18.089 -9.130 1.00 0.00 H new ATOM 0 HG3 ARG A 33 4.992 -17.393 -10.521 1.00 0.00 H new ATOM 0 HD2 ARG A 33 5.594 -19.738 -10.189 1.00 0.00 H new ATOM 0 HD3 ARG A 33 6.995 -18.691 -10.084 1.00 0.00 H new ATOM 0 HE ARG A 33 7.270 -19.215 -7.833 1.00 0.00 H new ATOM 0 HH11 ARG A 33 4.059 -20.540 -8.767 1.00 0.00 H new ATOM 0 HH12 ARG A 33 3.919 -21.494 -7.287 1.00 0.00 H new ATOM 0 HH21 ARG A 33 6.933 -20.328 -5.827 1.00 0.00 H new ATOM 0 HH22 ARG A 33 5.522 -21.376 -5.647 1.00 0.00 H new ATOM 509 N SER A 34 3.022 -15.988 -7.308 1.00 0.00 N ATOM 510 CA SER A 34 1.830 -16.525 -6.728 1.00 0.00 C ATOM 511 C SER A 34 0.628 -15.651 -6.837 1.00 0.00 C ATOM 512 O SER A 34 -0.443 -16.165 -7.155 1.00 0.00 O ATOM 513 CB SER A 34 1.982 -16.992 -5.271 1.00 0.00 C ATOM 514 OG SER A 34 2.997 -17.958 -5.043 1.00 0.00 O ATOM 0 H SER A 34 3.718 -15.779 -6.592 1.00 0.00 H new ATOM 0 HA SER A 34 1.663 -17.402 -7.353 1.00 0.00 H new ATOM 0 HB2 SER A 34 2.186 -16.121 -4.648 1.00 0.00 H new ATOM 0 HB3 SER A 34 1.030 -17.405 -4.939 1.00 0.00 H new ATOM 0 HG SER A 34 3.877 -17.533 -5.122 1.00 0.00 H new ATOM 520 N LEU A 35 0.753 -14.313 -6.773 1.00 0.00 N ATOM 521 CA LEU A 35 -0.215 -13.397 -7.294 1.00 0.00 C ATOM 522 C LEU A 35 -0.446 -13.382 -8.765 1.00 0.00 C ATOM 523 O LEU A 35 -1.604 -13.307 -9.175 1.00 0.00 O ATOM 524 CB LEU A 35 0.121 -11.986 -6.782 1.00 0.00 C ATOM 525 CG LEU A 35 0.138 -11.788 -5.257 1.00 0.00 C ATOM 526 CD1 LEU A 35 0.790 -10.420 -5.000 1.00 0.00 C ATOM 527 CD2 LEU A 35 -1.310 -11.822 -4.739 1.00 0.00 C ATOM 0 H LEU A 35 1.556 -13.853 -6.344 1.00 0.00 H new ATOM 0 HA LEU A 35 -1.169 -13.767 -6.919 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.100 -11.707 -7.172 1.00 0.00 H new ATOM 0 HB3 LEU A 35 -0.601 -11.289 -7.207 1.00 0.00 H new ATOM 0 HG LEU A 35 0.696 -12.569 -4.741 1.00 0.00 H new ATOM 0 HD11 LEU A 35 0.827 -10.230 -3.927 1.00 0.00 H new ATOM 0 HD12 LEU A 35 1.803 -10.418 -5.404 1.00 0.00 H new ATOM 0 HD13 LEU A 35 0.204 -9.640 -5.487 1.00 0.00 H new ATOM 0 HD21 LEU A 35 -1.313 -11.683 -3.658 1.00 0.00 H new ATOM 0 HD22 LEU A 35 -1.884 -11.023 -5.209 1.00 0.00 H new ATOM 0 HD23 LEU A 35 -1.761 -12.784 -4.982 1.00 0.00 H new ATOM 539 N GLY A 36 0.572 -13.340 -9.643 1.00 0.00 N ATOM 540 CA GLY A 36 0.494 -13.535 -11.057 1.00 0.00 C ATOM 541 C GLY A 36 1.453 -12.732 -11.867 1.00 0.00 C ATOM 542 O GLY A 36 1.142 -11.889 -12.707 1.00 0.00 O ATOM 0 H GLY A 36 1.527 -13.154 -9.337 1.00 0.00 H new ATOM 0 HA2 GLY A 36 0.659 -14.591 -11.271 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -0.519 -13.298 -11.384 1.00 0.00 H new ATOM 546 N GLN A 37 2.754 -12.875 -11.555 1.00 0.00 N ATOM 547 CA GLN A 37 3.757 -12.101 -12.219 1.00 0.00 C ATOM 548 C GLN A 37 4.910 -12.925 -12.677 1.00 0.00 C ATOM 549 O GLN A 37 5.202 -14.041 -12.248 1.00 0.00 O ATOM 550 CB GLN A 37 4.231 -10.979 -11.280 1.00 0.00 C ATOM 551 CG GLN A 37 3.106 -10.099 -10.731 1.00 0.00 C ATOM 552 CD GLN A 37 3.598 -9.107 -9.686 1.00 0.00 C ATOM 553 OE1 GLN A 37 3.259 -9.184 -8.506 1.00 0.00 O ATOM 554 NE2 GLN A 37 4.399 -8.106 -10.138 1.00 0.00 N ATOM 0 H GLN A 37 3.109 -13.520 -10.850 1.00 0.00 H new ATOM 0 HA GLN A 37 3.311 -11.674 -13.117 1.00 0.00 H new ATOM 0 HB2 GLN A 37 4.769 -11.425 -10.443 1.00 0.00 H new ATOM 0 HB3 GLN A 37 4.941 -10.349 -11.816 1.00 0.00 H new ATOM 0 HG2 GLN A 37 2.641 -9.555 -11.553 1.00 0.00 H new ATOM 0 HG3 GLN A 37 2.335 -10.732 -10.291 1.00 0.00 H new ATOM 0 HE21 GLN A 37 4.663 -8.069 -11.123 1.00 0.00 H new ATOM 0 HE22 GLN A 37 4.736 -7.392 -9.493 1.00 0.00 H new ATOM 563 N ASN A 38 5.738 -12.311 -13.541 1.00 0.00 N ATOM 564 CA ASN A 38 7.079 -12.717 -13.828 1.00 0.00 C ATOM 565 C ASN A 38 7.995 -11.625 -13.393 1.00 0.00 C ATOM 566 O ASN A 38 8.186 -10.618 -14.074 1.00 0.00 O ATOM 567 CB ASN A 38 7.268 -12.967 -15.334 1.00 0.00 C ATOM 568 CG ASN A 38 6.269 -14.021 -15.790 1.00 0.00 C ATOM 569 OD1 ASN A 38 5.328 -13.639 -16.484 1.00 0.00 O ATOM 570 ND2 ASN A 38 6.463 -15.324 -15.455 1.00 0.00 N ATOM 0 H ASN A 38 5.455 -11.485 -14.069 1.00 0.00 H new ATOM 0 HA ASN A 38 7.296 -13.645 -13.299 1.00 0.00 H new ATOM 0 HB2 ASN A 38 7.120 -12.042 -15.891 1.00 0.00 H new ATOM 0 HB3 ASN A 38 8.286 -13.301 -15.536 1.00 0.00 H new ATOM 0 HD21 ASN A 38 5.811 -16.037 -15.782 1.00 0.00 H new ATOM 0 HD22 ASN A 38 7.260 -15.589 -14.876 1.00 0.00 H new ATOM 577 N PRO A 39 8.535 -11.653 -12.211 1.00 0.00 N ATOM 578 CA PRO A 39 9.625 -10.775 -11.901 1.00 0.00 C ATOM 579 C PRO A 39 10.998 -11.293 -12.159 1.00 0.00 C ATOM 580 O PRO A 39 11.263 -12.476 -11.951 1.00 0.00 O ATOM 581 CB PRO A 39 9.439 -10.419 -10.428 1.00 0.00 C ATOM 582 CG PRO A 39 8.834 -11.726 -9.891 1.00 0.00 C ATOM 583 CD PRO A 39 7.968 -12.287 -11.030 1.00 0.00 C ATOM 0 HA PRO A 39 9.579 -9.921 -12.577 1.00 0.00 H new ATOM 0 HB2 PRO A 39 10.382 -10.169 -9.941 1.00 0.00 H new ATOM 0 HB3 PRO A 39 8.773 -9.567 -10.289 1.00 0.00 H new ATOM 0 HG2 PRO A 39 9.616 -12.432 -9.610 1.00 0.00 H new ATOM 0 HG3 PRO A 39 8.235 -11.542 -8.999 1.00 0.00 H new ATOM 0 HD2 PRO A 39 8.029 -13.374 -11.086 1.00 0.00 H new ATOM 0 HD3 PRO A 39 6.916 -12.033 -10.901 1.00 0.00 H new ATOM 591 N THR A 40 11.993 -10.490 -12.575 1.00 0.00 N ATOM 592 CA THR A 40 13.352 -10.897 -12.397 1.00 0.00 C ATOM 593 C THR A 40 13.890 -10.480 -11.071 1.00 0.00 C ATOM 594 O THR A 40 13.288 -9.542 -10.550 1.00 0.00 O ATOM 595 CB THR A 40 14.378 -10.500 -13.417 1.00 0.00 C ATOM 596 OG1 THR A 40 14.683 -9.115 -13.349 1.00 0.00 O ATOM 597 CG2 THR A 40 13.877 -10.834 -14.832 1.00 0.00 C ATOM 0 H THR A 40 11.864 -9.583 -13.023 1.00 0.00 H new ATOM 0 HA THR A 40 13.229 -11.974 -12.508 1.00 0.00 H new ATOM 0 HB THR A 40 15.285 -11.063 -13.198 1.00 0.00 H new ATOM 0 HG1 THR A 40 15.356 -8.895 -14.027 1.00 0.00 H new ATOM 0 HG21 THR A 40 14.630 -10.541 -15.563 1.00 0.00 H new ATOM 0 HG22 THR A 40 13.693 -11.906 -14.909 1.00 0.00 H new ATOM 0 HG23 THR A 40 12.952 -10.292 -15.028 1.00 0.00 H new ATOM 605 N GLU A 41 14.837 -11.224 -10.473 1.00 0.00 N ATOM 606 CA GLU A 41 15.221 -11.010 -9.112 1.00 0.00 C ATOM 607 C GLU A 41 16.131 -9.832 -9.036 1.00 0.00 C ATOM 608 O GLU A 41 16.165 -9.133 -8.025 1.00 0.00 O ATOM 609 CB GLU A 41 15.958 -12.195 -8.464 1.00 0.00 C ATOM 610 CG GLU A 41 14.980 -13.287 -8.028 1.00 0.00 C ATOM 611 CD GLU A 41 15.779 -14.453 -7.463 1.00 0.00 C ATOM 612 OE1 GLU A 41 16.528 -14.263 -6.468 1.00 0.00 O ATOM 613 OE2 GLU A 41 15.690 -15.552 -8.072 1.00 0.00 O ATOM 0 H GLU A 41 15.341 -11.980 -10.937 1.00 0.00 H new ATOM 0 HA GLU A 41 14.288 -10.863 -8.567 1.00 0.00 H new ATOM 0 HB2 GLU A 41 16.677 -12.609 -9.171 1.00 0.00 H new ATOM 0 HB3 GLU A 41 16.524 -11.846 -7.601 1.00 0.00 H new ATOM 0 HG2 GLU A 41 14.291 -12.901 -7.277 1.00 0.00 H new ATOM 0 HG3 GLU A 41 14.377 -13.616 -8.875 1.00 0.00 H new ATOM 620 N ALA A 42 16.950 -9.743 -10.099 1.00 0.00 N ATOM 621 CA ALA A 42 17.670 -8.537 -10.368 1.00 0.00 C ATOM 622 C ALA A 42 16.845 -7.297 -10.358 1.00 0.00 C ATOM 623 O ALA A 42 17.407 -6.271 -9.978 1.00 0.00 O ATOM 624 CB ALA A 42 18.524 -8.871 -11.603 1.00 0.00 C ATOM 0 H ALA A 42 17.113 -10.497 -10.766 1.00 0.00 H new ATOM 0 HA ALA A 42 18.337 -8.234 -9.561 1.00 0.00 H new ATOM 0 HB1 ALA A 42 19.114 -7.999 -11.884 1.00 0.00 H new ATOM 0 HB2 ALA A 42 19.191 -9.701 -11.370 1.00 0.00 H new ATOM 0 HB3 ALA A 42 17.873 -9.150 -12.431 1.00 0.00 H new ATOM 630 N GLU A 43 15.565 -7.343 -10.770 1.00 0.00 N ATOM 631 CA GLU A 43 14.811 -6.133 -10.662 1.00 0.00 C ATOM 632 C GLU A 43 14.357 -5.739 -9.299 1.00 0.00 C ATOM 633 O GLU A 43 14.372 -4.557 -8.956 1.00 0.00 O ATOM 634 CB GLU A 43 13.579 -6.249 -11.576 1.00 0.00 C ATOM 635 CG GLU A 43 12.751 -4.966 -11.668 1.00 0.00 C ATOM 636 CD GLU A 43 11.676 -5.064 -12.741 1.00 0.00 C ATOM 637 OE1 GLU A 43 10.560 -5.629 -12.592 1.00 0.00 O ATOM 638 OE2 GLU A 43 12.013 -4.659 -13.886 1.00 0.00 O ATOM 0 H GLU A 43 15.079 -8.155 -11.152 1.00 0.00 H new ATOM 0 HA GLU A 43 15.504 -5.345 -10.956 1.00 0.00 H new ATOM 0 HB2 GLU A 43 13.907 -6.531 -12.577 1.00 0.00 H new ATOM 0 HB3 GLU A 43 12.943 -7.055 -11.211 1.00 0.00 H new ATOM 0 HG2 GLU A 43 12.285 -4.764 -10.704 1.00 0.00 H new ATOM 0 HG3 GLU A 43 13.408 -4.124 -11.887 1.00 0.00 H new ATOM 645 N LEU A 44 14.052 -6.758 -8.477 1.00 0.00 N ATOM 646 CA LEU A 44 13.756 -6.478 -7.106 1.00 0.00 C ATOM 647 C LEU A 44 14.912 -5.975 -6.312 1.00 0.00 C ATOM 648 O LEU A 44 14.848 -5.099 -5.451 1.00 0.00 O ATOM 649 CB LEU A 44 13.248 -7.760 -6.425 1.00 0.00 C ATOM 650 CG LEU A 44 11.805 -7.987 -6.908 1.00 0.00 C ATOM 651 CD1 LEU A 44 11.526 -9.500 -6.881 1.00 0.00 C ATOM 652 CD2 LEU A 44 10.800 -7.118 -6.135 1.00 0.00 C ATOM 0 H LEU A 44 14.010 -7.741 -8.746 1.00 0.00 H new ATOM 0 HA LEU A 44 13.008 -5.685 -7.126 1.00 0.00 H new ATOM 0 HB2 LEU A 44 13.879 -8.610 -6.684 1.00 0.00 H new ATOM 0 HB3 LEU A 44 13.280 -7.659 -5.340 1.00 0.00 H new ATOM 0 HG LEU A 44 11.678 -7.653 -7.938 1.00 0.00 H new ATOM 0 HD11 LEU A 44 10.507 -9.688 -7.220 1.00 0.00 H new ATOM 0 HD12 LEU A 44 12.228 -10.011 -7.540 1.00 0.00 H new ATOM 0 HD13 LEU A 44 11.645 -9.874 -5.864 1.00 0.00 H new ATOM 0 HD21 LEU A 44 9.793 -7.308 -6.507 1.00 0.00 H new ATOM 0 HD22 LEU A 44 10.848 -7.363 -5.074 1.00 0.00 H new ATOM 0 HD23 LEU A 44 11.046 -6.065 -6.276 1.00 0.00 H new ATOM 664 N GLN A 45 16.067 -6.645 -6.479 1.00 0.00 N ATOM 665 CA GLN A 45 17.345 -6.218 -6.002 1.00 0.00 C ATOM 666 C GLN A 45 17.736 -4.807 -6.278 1.00 0.00 C ATOM 667 O GLN A 45 18.125 -4.077 -5.367 1.00 0.00 O ATOM 668 CB GLN A 45 18.393 -7.210 -6.534 1.00 0.00 C ATOM 669 CG GLN A 45 19.885 -6.873 -6.495 1.00 0.00 C ATOM 670 CD GLN A 45 20.736 -8.043 -6.968 1.00 0.00 C ATOM 671 OE1 GLN A 45 20.450 -8.890 -7.813 1.00 0.00 O ATOM 672 NE2 GLN A 45 21.973 -8.072 -6.403 1.00 0.00 N ATOM 0 H GLN A 45 16.110 -7.535 -6.975 1.00 0.00 H new ATOM 0 HA GLN A 45 17.282 -6.222 -4.914 1.00 0.00 H new ATOM 0 HB2 GLN A 45 18.261 -8.141 -5.983 1.00 0.00 H new ATOM 0 HB3 GLN A 45 18.139 -7.417 -7.574 1.00 0.00 H new ATOM 0 HG2 GLN A 45 20.079 -6.004 -7.123 1.00 0.00 H new ATOM 0 HG3 GLN A 45 20.171 -6.602 -5.479 1.00 0.00 H new ATOM 0 HE21 GLN A 45 22.229 -7.378 -5.700 1.00 0.00 H new ATOM 0 HE22 GLN A 45 22.644 -8.787 -6.682 1.00 0.00 H new ATOM 681 N ASP A 46 17.470 -4.296 -7.494 1.00 0.00 N ATOM 682 CA ASP A 46 17.735 -2.963 -7.939 1.00 0.00 C ATOM 683 C ASP A 46 16.983 -1.927 -7.176 1.00 0.00 C ATOM 684 O ASP A 46 17.649 -1.083 -6.579 1.00 0.00 O ATOM 685 CB ASP A 46 17.332 -2.798 -9.414 1.00 0.00 C ATOM 686 CG ASP A 46 17.970 -1.612 -10.124 1.00 0.00 C ATOM 687 OD1 ASP A 46 18.750 -0.828 -9.522 1.00 0.00 O ATOM 688 OD2 ASP A 46 17.595 -1.354 -11.299 1.00 0.00 O ATOM 0 H ASP A 46 17.035 -4.862 -8.223 1.00 0.00 H new ATOM 0 HA ASP A 46 18.804 -2.817 -7.786 1.00 0.00 H new ATOM 0 HB2 ASP A 46 17.595 -3.709 -9.951 1.00 0.00 H new ATOM 0 HB3 ASP A 46 16.248 -2.696 -9.470 1.00 0.00 H new ATOM 693 N MET A 47 15.669 -2.164 -7.017 1.00 0.00 N ATOM 694 CA MET A 47 14.850 -1.338 -6.185 1.00 0.00 C ATOM 695 C MET A 47 15.176 -1.205 -4.738 1.00 0.00 C ATOM 696 O MET A 47 15.257 -0.125 -4.153 1.00 0.00 O ATOM 697 CB MET A 47 13.365 -1.656 -6.427 1.00 0.00 C ATOM 698 CG MET A 47 13.035 -1.356 -7.891 1.00 0.00 C ATOM 699 SD MET A 47 12.905 0.418 -8.264 1.00 0.00 S ATOM 700 CE MET A 47 12.816 0.317 -10.075 1.00 0.00 C ATOM 0 H MET A 47 15.171 -2.932 -7.467 1.00 0.00 H new ATOM 0 HA MET A 47 15.102 -0.332 -6.521 1.00 0.00 H new ATOM 0 HB2 MET A 47 13.160 -2.702 -6.199 1.00 0.00 H new ATOM 0 HB3 MET A 47 12.737 -1.057 -5.767 1.00 0.00 H new ATOM 0 HG2 MET A 47 13.805 -1.796 -8.525 1.00 0.00 H new ATOM 0 HG3 MET A 47 12.094 -1.842 -8.149 1.00 0.00 H new ATOM 0 HE1 MET A 47 12.732 1.321 -10.492 1.00 0.00 H new ATOM 0 HE2 MET A 47 13.718 -0.160 -10.458 1.00 0.00 H new ATOM 0 HE3 MET A 47 11.945 -0.270 -10.364 1.00 0.00 H new ATOM 710 N ILE A 48 15.434 -2.356 -4.092 1.00 0.00 N ATOM 711 CA ILE A 48 15.748 -2.381 -2.697 1.00 0.00 C ATOM 712 C ILE A 48 17.110 -1.844 -2.423 1.00 0.00 C ATOM 713 O ILE A 48 17.379 -1.241 -1.385 1.00 0.00 O ATOM 714 CB ILE A 48 15.479 -3.743 -2.129 1.00 0.00 C ATOM 715 CG1 ILE A 48 13.980 -4.072 -2.037 1.00 0.00 C ATOM 716 CG2 ILE A 48 16.077 -3.853 -0.717 1.00 0.00 C ATOM 717 CD1 ILE A 48 13.546 -5.518 -1.802 1.00 0.00 C ATOM 0 H ILE A 48 15.425 -3.273 -4.538 1.00 0.00 H new ATOM 0 HA ILE A 48 15.084 -1.699 -2.166 1.00 0.00 H new ATOM 0 HB ILE A 48 15.943 -4.453 -2.813 1.00 0.00 H new ATOM 0 HG12 ILE A 48 13.561 -3.469 -1.232 1.00 0.00 H new ATOM 0 HG13 ILE A 48 13.513 -3.736 -2.963 1.00 0.00 H new ATOM 0 HG21 ILE A 48 15.876 -4.845 -0.313 1.00 0.00 H new ATOM 0 HG22 ILE A 48 17.154 -3.691 -0.764 1.00 0.00 H new ATOM 0 HG23 ILE A 48 15.625 -3.100 -0.071 1.00 0.00 H new ATOM 0 HD11 ILE A 48 12.458 -5.570 -1.764 1.00 0.00 H new ATOM 0 HD12 ILE A 48 13.911 -6.144 -2.616 1.00 0.00 H new ATOM 0 HD13 ILE A 48 13.959 -5.873 -0.858 1.00 0.00 H new ATOM 729 N ASN A 49 18.077 -2.000 -3.345 1.00 0.00 N ATOM 730 CA ASN A 49 19.406 -1.482 -3.247 1.00 0.00 C ATOM 731 C ASN A 49 19.548 -0.023 -2.980 1.00 0.00 C ATOM 732 O ASN A 49 20.422 0.395 -2.222 1.00 0.00 O ATOM 733 CB ASN A 49 20.315 -1.850 -4.432 1.00 0.00 C ATOM 734 CG ASN A 49 21.370 -2.762 -3.821 1.00 0.00 C ATOM 735 OD1 ASN A 49 21.839 -2.299 -2.782 1.00 0.00 O ATOM 736 ND2 ASN A 49 21.742 -3.912 -4.443 1.00 0.00 N ATOM 0 H ASN A 49 17.921 -2.518 -4.209 1.00 0.00 H new ATOM 0 HA ASN A 49 19.738 -1.998 -2.346 1.00 0.00 H new ATOM 0 HB2 ASN A 49 19.758 -2.357 -5.220 1.00 0.00 H new ATOM 0 HB3 ASN A 49 20.765 -0.964 -4.880 1.00 0.00 H new ATOM 0 HD21 ASN A 49 22.484 -4.489 -4.047 1.00 0.00 H new ATOM 0 HD22 ASN A 49 21.279 -4.198 -5.306 1.00 0.00 H new ATOM 743 N GLU A 50 18.645 0.830 -3.496 1.00 0.00 N ATOM 744 CA GLU A 50 18.562 2.202 -3.102 1.00 0.00 C ATOM 745 C GLU A 50 18.423 2.426 -1.635 1.00 0.00 C ATOM 746 O GLU A 50 19.214 3.129 -1.007 1.00 0.00 O ATOM 747 CB GLU A 50 17.358 2.927 -3.726 1.00 0.00 C ATOM 748 CG GLU A 50 17.572 2.922 -5.241 1.00 0.00 C ATOM 749 CD GLU A 50 16.607 3.945 -5.824 1.00 0.00 C ATOM 750 OE1 GLU A 50 15.378 3.677 -5.894 1.00 0.00 O ATOM 751 OE2 GLU A 50 17.042 5.049 -6.248 1.00 0.00 O ATOM 0 H GLU A 50 17.959 0.561 -4.201 1.00 0.00 H new ATOM 0 HA GLU A 50 19.515 2.596 -3.455 1.00 0.00 H new ATOM 0 HB2 GLU A 50 16.427 2.423 -3.466 1.00 0.00 H new ATOM 0 HB3 GLU A 50 17.284 3.947 -3.350 1.00 0.00 H new ATOM 0 HG2 GLU A 50 18.602 3.178 -5.487 1.00 0.00 H new ATOM 0 HG3 GLU A 50 17.382 1.932 -5.655 1.00 0.00 H new ATOM 758 N VAL A 51 17.478 1.728 -0.981 1.00 0.00 N ATOM 759 CA VAL A 51 17.347 2.012 0.415 1.00 0.00 C ATOM 760 C VAL A 51 18.181 1.149 1.297 1.00 0.00 C ATOM 761 O VAL A 51 18.492 1.591 2.402 1.00 0.00 O ATOM 762 CB VAL A 51 15.871 2.033 0.680 1.00 0.00 C ATOM 763 CG1 VAL A 51 15.293 0.659 0.303 1.00 0.00 C ATOM 764 CG2 VAL A 51 15.666 2.404 2.158 1.00 0.00 C ATOM 0 H VAL A 51 16.852 1.025 -1.374 1.00 0.00 H new ATOM 0 HA VAL A 51 17.769 2.982 0.678 1.00 0.00 H new ATOM 0 HB VAL A 51 15.343 2.774 0.080 1.00 0.00 H new ATOM 0 HG11 VAL A 51 14.219 0.653 0.488 1.00 0.00 H new ATOM 0 HG12 VAL A 51 15.480 0.463 -0.753 1.00 0.00 H new ATOM 0 HG13 VAL A 51 15.770 -0.114 0.906 1.00 0.00 H new ATOM 0 HG21 VAL A 51 14.600 2.428 2.383 1.00 0.00 H new ATOM 0 HG22 VAL A 51 16.154 1.662 2.790 1.00 0.00 H new ATOM 0 HG23 VAL A 51 16.099 3.386 2.350 1.00 0.00 H new ATOM 774 N ASP A 52 18.598 -0.065 0.893 1.00 0.00 N ATOM 775 CA ASP A 52 19.457 -0.974 1.587 1.00 0.00 C ATOM 776 C ASP A 52 20.690 -0.375 2.170 1.00 0.00 C ATOM 777 O ASP A 52 21.558 0.188 1.504 1.00 0.00 O ATOM 778 CB ASP A 52 19.729 -2.119 0.597 1.00 0.00 C ATOM 779 CG ASP A 52 20.318 -3.359 1.254 1.00 0.00 C ATOM 780 OD1 ASP A 52 20.622 -3.304 2.476 1.00 0.00 O ATOM 781 OD2 ASP A 52 20.274 -4.448 0.621 1.00 0.00 O ATOM 0 H ASP A 52 18.304 -0.444 -0.007 1.00 0.00 H new ATOM 0 HA ASP A 52 18.963 -1.333 2.490 1.00 0.00 H new ATOM 0 HB2 ASP A 52 18.797 -2.388 0.100 1.00 0.00 H new ATOM 0 HB3 ASP A 52 20.413 -1.767 -0.176 1.00 0.00 H new ATOM 786 N ALA A 53 20.916 -0.386 3.496 1.00 0.00 N ATOM 787 CA ALA A 53 22.092 0.092 4.154 1.00 0.00 C ATOM 788 C ALA A 53 23.252 -0.804 3.886 1.00 0.00 C ATOM 789 O ALA A 53 24.386 -0.382 3.669 1.00 0.00 O ATOM 790 CB ALA A 53 21.800 0.144 5.663 1.00 0.00 C ATOM 0 H ALA A 53 20.228 -0.755 4.153 1.00 0.00 H new ATOM 0 HA ALA A 53 22.349 1.083 3.779 1.00 0.00 H new ATOM 0 HB1 ALA A 53 22.682 0.506 6.192 1.00 0.00 H new ATOM 0 HB2 ALA A 53 20.963 0.818 5.849 1.00 0.00 H new ATOM 0 HB3 ALA A 53 21.548 -0.855 6.019 1.00 0.00 H new ATOM 796 N ASP A 54 22.985 -2.120 3.805 1.00 0.00 N ATOM 797 CA ASP A 54 23.966 -3.144 3.625 1.00 0.00 C ATOM 798 C ASP A 54 24.535 -3.162 2.248 1.00 0.00 C ATOM 799 O ASP A 54 25.744 -3.021 2.069 1.00 0.00 O ATOM 800 CB ASP A 54 23.308 -4.509 3.888 1.00 0.00 C ATOM 801 CG ASP A 54 22.730 -4.537 5.296 1.00 0.00 C ATOM 802 OD1 ASP A 54 23.518 -4.447 6.275 1.00 0.00 O ATOM 803 OD2 ASP A 54 21.493 -4.694 5.470 1.00 0.00 O ATOM 0 H ASP A 54 22.036 -2.488 3.868 1.00 0.00 H new ATOM 0 HA ASP A 54 24.779 -2.940 4.322 1.00 0.00 H new ATOM 0 HB2 ASP A 54 22.520 -4.690 3.157 1.00 0.00 H new ATOM 0 HB3 ASP A 54 24.042 -5.306 3.770 1.00 0.00 H new ATOM 808 N GLY A 55 23.664 -3.193 1.224 1.00 0.00 N ATOM 809 CA GLY A 55 23.896 -3.163 -0.187 1.00 0.00 C ATOM 810 C GLY A 55 23.829 -4.463 -0.911 1.00 0.00 C ATOM 811 O GLY A 55 24.563 -4.766 -1.851 1.00 0.00 O ATOM 0 H GLY A 55 22.664 -3.246 1.417 1.00 0.00 H new ATOM 0 HA2 GLY A 55 23.168 -2.487 -0.636 1.00 0.00 H new ATOM 0 HA3 GLY A 55 24.881 -2.730 -0.359 1.00 0.00 H new ATOM 815 N ASN A 56 22.802 -5.267 -0.584 1.00 0.00 N ATOM 816 CA ASN A 56 22.587 -6.627 -0.970 1.00 0.00 C ATOM 817 C ASN A 56 21.327 -6.731 -1.759 1.00 0.00 C ATOM 818 O ASN A 56 21.113 -7.721 -2.456 1.00 0.00 O ATOM 819 CB ASN A 56 22.535 -7.623 0.201 1.00 0.00 C ATOM 820 CG ASN A 56 23.789 -7.551 1.060 1.00 0.00 C ATOM 821 OD1 ASN A 56 23.850 -7.193 2.235 1.00 0.00 O ATOM 822 ND2 ASN A 56 24.857 -8.141 0.459 1.00 0.00 N ATOM 0 H ASN A 56 22.047 -4.927 0.011 1.00 0.00 H new ATOM 0 HA ASN A 56 23.455 -6.905 -1.568 1.00 0.00 H new ATOM 0 HB2 ASN A 56 21.660 -7.415 0.817 1.00 0.00 H new ATOM 0 HB3 ASN A 56 22.418 -8.635 -0.187 1.00 0.00 H new ATOM 0 HD21 ASN A 56 25.719 -8.290 0.983 1.00 0.00 H new ATOM 0 HD22 ASN A 56 24.796 -8.434 -0.516 1.00 0.00 H new ATOM 829 N GLY A 57 20.465 -5.700 -1.698 1.00 0.00 N ATOM 830 CA GLY A 57 19.186 -5.743 -2.335 1.00 0.00 C ATOM 831 C GLY A 57 18.165 -6.505 -1.564 1.00 0.00 C ATOM 832 O GLY A 57 17.152 -6.922 -2.124 1.00 0.00 O ATOM 0 H GLY A 57 20.657 -4.829 -1.203 1.00 0.00 H new ATOM 0 HA2 GLY A 57 18.830 -4.724 -2.487 1.00 0.00 H new ATOM 0 HA3 GLY A 57 19.295 -6.193 -3.322 1.00 0.00 H new ATOM 836 N THR A 58 18.376 -6.677 -0.246 1.00 0.00 N ATOM 837 CA THR A 58 17.448 -7.336 0.618 1.00 0.00 C ATOM 838 C THR A 58 17.134 -6.470 1.789 1.00 0.00 C ATOM 839 O THR A 58 17.994 -5.777 2.329 1.00 0.00 O ATOM 840 CB THR A 58 17.853 -8.740 0.958 1.00 0.00 C ATOM 841 OG1 THR A 58 19.050 -8.848 1.715 1.00 0.00 O ATOM 842 CG2 THR A 58 18.221 -9.580 -0.277 1.00 0.00 C ATOM 0 H THR A 58 19.216 -6.348 0.231 1.00 0.00 H new ATOM 0 HA THR A 58 16.511 -7.477 0.079 1.00 0.00 H new ATOM 0 HB THR A 58 16.970 -9.081 1.498 1.00 0.00 H new ATOM 0 HG1 THR A 58 19.240 -9.793 1.894 1.00 0.00 H new ATOM 0 HG21 THR A 58 18.505 -10.584 0.037 1.00 0.00 H new ATOM 0 HG22 THR A 58 17.363 -9.638 -0.946 1.00 0.00 H new ATOM 0 HG23 THR A 58 19.057 -9.114 -0.798 1.00 0.00 H new ATOM 850 N ILE A 59 15.843 -6.501 2.168 1.00 0.00 N ATOM 851 CA ILE A 59 15.229 -5.507 2.991 1.00 0.00 C ATOM 852 C ILE A 59 14.888 -5.941 4.375 1.00 0.00 C ATOM 853 O ILE A 59 14.178 -6.907 4.650 1.00 0.00 O ATOM 854 CB ILE A 59 14.037 -4.947 2.273 1.00 0.00 C ATOM 855 CG1 ILE A 59 13.443 -3.765 3.058 1.00 0.00 C ATOM 856 CG2 ILE A 59 12.997 -6.053 2.024 1.00 0.00 C ATOM 857 CD1 ILE A 59 12.495 -3.041 2.103 1.00 0.00 C ATOM 0 H ILE A 59 15.204 -7.246 1.891 1.00 0.00 H new ATOM 0 HA ILE A 59 15.979 -4.732 3.150 1.00 0.00 H new ATOM 0 HB ILE A 59 14.351 -4.567 1.301 1.00 0.00 H new ATOM 0 HG12 ILE A 59 12.910 -4.115 3.942 1.00 0.00 H new ATOM 0 HG13 ILE A 59 14.230 -3.095 3.405 1.00 0.00 H new ATOM 0 HG21 ILE A 59 12.137 -5.633 1.502 1.00 0.00 H new ATOM 0 HG22 ILE A 59 13.442 -6.840 1.415 1.00 0.00 H new ATOM 0 HG23 ILE A 59 12.674 -6.470 2.978 1.00 0.00 H new ATOM 0 HD11 ILE A 59 12.045 -2.190 2.613 1.00 0.00 H new ATOM 0 HD12 ILE A 59 13.052 -2.690 1.234 1.00 0.00 H new ATOM 0 HD13 ILE A 59 11.711 -3.726 1.779 1.00 0.00 H new ATOM 869 N ASP A 60 15.482 -5.227 5.348 1.00 0.00 N ATOM 870 CA ASP A 60 15.303 -5.511 6.738 1.00 0.00 C ATOM 871 C ASP A 60 14.323 -4.577 7.359 1.00 0.00 C ATOM 872 O ASP A 60 13.616 -3.731 6.812 1.00 0.00 O ATOM 873 CB ASP A 60 16.686 -5.206 7.338 1.00 0.00 C ATOM 874 CG ASP A 60 17.808 -6.070 6.778 1.00 0.00 C ATOM 875 OD1 ASP A 60 17.912 -7.221 7.279 1.00 0.00 O ATOM 876 OD2 ASP A 60 18.605 -5.604 5.921 1.00 0.00 O ATOM 0 H ASP A 60 16.099 -4.436 5.165 1.00 0.00 H new ATOM 0 HA ASP A 60 14.940 -6.526 6.902 1.00 0.00 H new ATOM 0 HB2 ASP A 60 16.925 -4.158 7.160 1.00 0.00 H new ATOM 0 HB3 ASP A 60 16.640 -5.343 8.418 1.00 0.00 H new ATOM 881 N PHE A 61 14.165 -4.690 8.690 1.00 0.00 N ATOM 882 CA PHE A 61 13.237 -3.880 9.416 1.00 0.00 C ATOM 883 C PHE A 61 13.561 -2.426 9.436 1.00 0.00 C ATOM 884 O PHE A 61 12.651 -1.638 9.185 1.00 0.00 O ATOM 885 CB PHE A 61 12.769 -4.486 10.750 1.00 0.00 C ATOM 886 CG PHE A 61 11.457 -3.881 11.117 1.00 0.00 C ATOM 887 CD1 PHE A 61 10.390 -4.281 10.348 1.00 0.00 C ATOM 888 CD2 PHE A 61 11.270 -2.971 12.131 1.00 0.00 C ATOM 889 CE1 PHE A 61 9.136 -3.738 10.499 1.00 0.00 C ATOM 890 CE2 PHE A 61 10.011 -2.447 12.307 1.00 0.00 C ATOM 891 CZ PHE A 61 8.955 -2.826 11.512 1.00 0.00 C ATOM 0 H PHE A 61 14.686 -5.349 9.268 1.00 0.00 H new ATOM 0 HA PHE A 61 12.329 -3.905 8.814 1.00 0.00 H new ATOM 0 HB2 PHE A 61 12.674 -5.568 10.660 1.00 0.00 H new ATOM 0 HB3 PHE A 61 13.505 -4.294 11.531 1.00 0.00 H new ATOM 0 HD1 PHE A 61 10.542 -5.046 9.601 1.00 0.00 H new ATOM 0 HD2 PHE A 61 12.089 -2.676 12.771 1.00 0.00 H new ATOM 0 HE1 PHE A 61 8.323 -4.018 9.846 1.00 0.00 H new ATOM 0 HE2 PHE A 61 9.848 -1.720 13.089 1.00 0.00 H new ATOM 0 HZ PHE A 61 7.976 -2.404 11.685 1.00 0.00 H new ATOM 901 N PRO A 62 14.738 -1.934 9.689 1.00 0.00 N ATOM 902 CA PRO A 62 15.001 -0.531 9.552 1.00 0.00 C ATOM 903 C PRO A 62 14.966 0.078 8.193 1.00 0.00 C ATOM 904 O PRO A 62 15.006 1.306 8.152 1.00 0.00 O ATOM 905 CB PRO A 62 16.399 -0.406 10.153 1.00 0.00 C ATOM 906 CG PRO A 62 16.551 -1.581 11.133 1.00 0.00 C ATOM 907 CD PRO A 62 15.786 -2.677 10.374 1.00 0.00 C ATOM 0 HA PRO A 62 14.195 0.023 10.033 1.00 0.00 H new ATOM 0 HB2 PRO A 62 17.162 -0.446 9.376 1.00 0.00 H new ATOM 0 HB3 PRO A 62 16.518 0.548 10.667 1.00 0.00 H new ATOM 0 HG2 PRO A 62 17.594 -1.846 11.304 1.00 0.00 H new ATOM 0 HG3 PRO A 62 16.112 -1.368 12.108 1.00 0.00 H new ATOM 0 HD2 PRO A 62 16.430 -3.206 9.672 1.00 0.00 H new ATOM 0 HD3 PRO A 62 15.373 -3.424 11.052 1.00 0.00 H new ATOM 915 N GLU A 63 14.970 -0.718 7.108 1.00 0.00 N ATOM 916 CA GLU A 63 15.006 -0.377 5.720 1.00 0.00 C ATOM 917 C GLU A 63 13.606 -0.292 5.217 1.00 0.00 C ATOM 918 O GLU A 63 13.222 0.781 4.753 1.00 0.00 O ATOM 919 CB GLU A 63 15.891 -1.399 4.989 1.00 0.00 C ATOM 920 CG GLU A 63 17.369 -1.209 5.336 1.00 0.00 C ATOM 921 CD GLU A 63 18.216 -2.398 4.903 1.00 0.00 C ATOM 922 OE1 GLU A 63 17.611 -3.321 4.295 1.00 0.00 O ATOM 923 OE2 GLU A 63 19.472 -2.452 4.979 1.00 0.00 O ATOM 0 H GLU A 63 14.945 -1.731 7.225 1.00 0.00 H new ATOM 0 HA GLU A 63 15.455 0.600 5.538 1.00 0.00 H new ATOM 0 HB2 GLU A 63 15.580 -2.409 5.257 1.00 0.00 H new ATOM 0 HB3 GLU A 63 15.753 -1.298 3.913 1.00 0.00 H new ATOM 0 HG2 GLU A 63 17.741 -0.305 4.854 1.00 0.00 H new ATOM 0 HG3 GLU A 63 17.473 -1.063 6.411 1.00 0.00 H new ATOM 930 N PHE A 64 12.720 -1.296 5.342 1.00 0.00 N ATOM 931 CA PHE A 64 11.292 -1.246 5.277 1.00 0.00 C ATOM 932 C PHE A 64 10.654 -0.053 5.902 1.00 0.00 C ATOM 933 O PHE A 64 9.960 0.680 5.198 1.00 0.00 O ATOM 934 CB PHE A 64 10.778 -2.574 5.857 1.00 0.00 C ATOM 935 CG PHE A 64 9.365 -2.866 5.484 1.00 0.00 C ATOM 936 CD1 PHE A 64 8.352 -2.503 6.340 1.00 0.00 C ATOM 937 CD2 PHE A 64 9.174 -3.667 4.382 1.00 0.00 C ATOM 938 CE1 PHE A 64 7.089 -2.933 6.006 1.00 0.00 C ATOM 939 CE2 PHE A 64 7.910 -4.132 4.108 1.00 0.00 C ATOM 940 CZ PHE A 64 6.906 -3.860 5.007 1.00 0.00 C ATOM 0 H PHE A 64 13.044 -2.249 5.507 1.00 0.00 H new ATOM 0 HA PHE A 64 11.000 -1.124 4.234 1.00 0.00 H new ATOM 0 HB2 PHE A 64 11.415 -3.387 5.508 1.00 0.00 H new ATOM 0 HB3 PHE A 64 10.863 -2.546 6.943 1.00 0.00 H new ATOM 0 HD1 PHE A 64 8.538 -1.913 7.225 1.00 0.00 H new ATOM 0 HD2 PHE A 64 10.004 -3.926 3.742 1.00 0.00 H new ATOM 0 HE1 PHE A 64 6.233 -2.539 6.533 1.00 0.00 H new ATOM 0 HE2 PHE A 64 7.711 -4.697 3.209 1.00 0.00 H new ATOM 0 HZ PHE A 64 5.963 -4.380 4.928 1.00 0.00 H new ATOM 950 N LEU A 65 10.926 0.280 7.176 1.00 0.00 N ATOM 951 CA LEU A 65 10.388 1.415 7.860 1.00 0.00 C ATOM 952 C LEU A 65 10.615 2.705 7.150 1.00 0.00 C ATOM 953 O LEU A 65 9.824 3.647 7.141 1.00 0.00 O ATOM 954 CB LEU A 65 10.868 1.516 9.318 1.00 0.00 C ATOM 955 CG LEU A 65 10.236 0.539 10.324 1.00 0.00 C ATOM 956 CD1 LEU A 65 11.068 0.768 11.596 1.00 0.00 C ATOM 957 CD2 LEU A 65 8.739 0.793 10.573 1.00 0.00 C ATOM 0 H LEU A 65 11.555 -0.272 7.760 1.00 0.00 H new ATOM 0 HA LEU A 65 9.312 1.239 7.869 1.00 0.00 H new ATOM 0 HB2 LEU A 65 11.948 1.367 9.332 1.00 0.00 H new ATOM 0 HB3 LEU A 65 10.682 2.532 9.668 1.00 0.00 H new ATOM 0 HG LEU A 65 10.258 -0.489 9.961 1.00 0.00 H new ATOM 0 HD11 LEU A 65 10.704 0.117 12.391 1.00 0.00 H new ATOM 0 HD12 LEU A 65 12.114 0.541 11.392 1.00 0.00 H new ATOM 0 HD13 LEU A 65 10.977 1.808 11.908 1.00 0.00 H new ATOM 0 HD21 LEU A 65 8.361 0.067 11.293 1.00 0.00 H new ATOM 0 HD22 LEU A 65 8.601 1.800 10.968 1.00 0.00 H new ATOM 0 HD23 LEU A 65 8.192 0.693 9.635 1.00 0.00 H new ATOM 969 N THR A 66 11.737 2.776 6.412 1.00 0.00 N ATOM 970 CA THR A 66 12.074 3.901 5.596 1.00 0.00 C ATOM 971 C THR A 66 11.413 3.806 4.263 1.00 0.00 C ATOM 972 O THR A 66 10.724 4.764 3.917 1.00 0.00 O ATOM 973 CB THR A 66 13.555 4.134 5.571 1.00 0.00 C ATOM 974 OG1 THR A 66 14.144 4.608 6.773 1.00 0.00 O ATOM 975 CG2 THR A 66 13.992 5.107 4.462 1.00 0.00 C ATOM 0 H THR A 66 12.430 2.029 6.382 1.00 0.00 H new ATOM 0 HA THR A 66 11.670 4.810 6.041 1.00 0.00 H new ATOM 0 HB THR A 66 13.916 3.121 5.393 1.00 0.00 H new ATOM 0 HG1 THR A 66 15.109 4.722 6.642 1.00 0.00 H new ATOM 0 HG21 THR A 66 15.074 5.235 4.496 1.00 0.00 H new ATOM 0 HG22 THR A 66 13.704 4.705 3.491 1.00 0.00 H new ATOM 0 HG23 THR A 66 13.508 6.072 4.613 1.00 0.00 H new ATOM 983 N MET A 67 11.537 2.699 3.510 1.00 0.00 N ATOM 984 CA MET A 67 11.152 2.616 2.135 1.00 0.00 C ATOM 985 C MET A 67 9.675 2.745 1.980 1.00 0.00 C ATOM 986 O MET A 67 9.141 3.431 1.109 1.00 0.00 O ATOM 987 CB MET A 67 11.560 1.279 1.494 1.00 0.00 C ATOM 988 CG MET A 67 11.425 1.195 -0.027 1.00 0.00 C ATOM 989 SD MET A 67 11.451 -0.500 -0.685 1.00 0.00 S ATOM 990 CE MET A 67 11.839 0.083 -2.361 1.00 0.00 C ATOM 0 H MET A 67 11.921 1.827 3.873 1.00 0.00 H new ATOM 0 HA MET A 67 11.668 3.436 1.636 1.00 0.00 H new ATOM 0 HB2 MET A 67 12.597 1.074 1.759 1.00 0.00 H new ATOM 0 HB3 MET A 67 10.956 0.487 1.937 1.00 0.00 H new ATOM 0 HG2 MET A 67 10.492 1.674 -0.325 1.00 0.00 H new ATOM 0 HG3 MET A 67 12.235 1.763 -0.484 1.00 0.00 H new ATOM 0 HE1 MET A 67 11.836 -0.762 -3.050 1.00 0.00 H new ATOM 0 HE2 MET A 67 11.091 0.811 -2.675 1.00 0.00 H new ATOM 0 HE3 MET A 67 12.824 0.550 -2.365 1.00 0.00 H new ATOM 1000 N MET A 68 8.906 2.182 2.928 1.00 0.00 N ATOM 1001 CA MET A 68 7.489 2.263 3.105 1.00 0.00 C ATOM 1002 C MET A 68 6.928 3.573 3.538 1.00 0.00 C ATOM 1003 O MET A 68 5.716 3.743 3.665 1.00 0.00 O ATOM 1004 CB MET A 68 6.884 1.197 4.036 1.00 0.00 C ATOM 1005 CG MET A 68 7.155 -0.198 3.469 1.00 0.00 C ATOM 1006 SD MET A 68 6.018 -0.631 2.118 1.00 0.00 S ATOM 1007 CE MET A 68 4.503 -0.775 3.108 1.00 0.00 C ATOM 0 H MET A 68 9.330 1.603 3.653 1.00 0.00 H new ATOM 0 HA MET A 68 7.193 2.088 2.071 1.00 0.00 H new ATOM 0 HB2 MET A 68 7.315 1.285 5.033 1.00 0.00 H new ATOM 0 HB3 MET A 68 5.811 1.356 4.138 1.00 0.00 H new ATOM 0 HG2 MET A 68 8.182 -0.246 3.106 1.00 0.00 H new ATOM 0 HG3 MET A 68 7.064 -0.935 4.267 1.00 0.00 H new ATOM 0 HE1 MET A 68 3.801 -1.439 2.604 1.00 0.00 H new ATOM 0 HE2 MET A 68 4.747 -1.182 4.089 1.00 0.00 H new ATOM 0 HE3 MET A 68 4.051 0.210 3.226 1.00 0.00 H new ATOM 1017 N ALA A 69 7.732 4.627 3.765 1.00 0.00 N ATOM 1018 CA ALA A 69 7.284 5.977 3.913 1.00 0.00 C ATOM 1019 C ALA A 69 7.483 6.813 2.696 1.00 0.00 C ATOM 1020 O ALA A 69 6.883 7.872 2.519 1.00 0.00 O ATOM 1021 CB ALA A 69 7.907 6.708 5.114 1.00 0.00 C ATOM 0 H ALA A 69 8.744 4.533 3.849 1.00 0.00 H new ATOM 0 HA ALA A 69 6.214 5.861 4.088 1.00 0.00 H new ATOM 0 HB1 ALA A 69 7.520 7.726 5.161 1.00 0.00 H new ATOM 0 HB2 ALA A 69 7.653 6.180 6.033 1.00 0.00 H new ATOM 0 HB3 ALA A 69 8.991 6.737 5.000 1.00 0.00 H new ATOM 1027 N ARG A 70 8.312 6.387 1.726 1.00 0.00 N ATOM 1028 CA ARG A 70 8.662 7.158 0.574 1.00 0.00 C ATOM 1029 C ARG A 70 7.615 7.300 -0.476 1.00 0.00 C ATOM 1030 O ARG A 70 7.015 6.322 -0.920 1.00 0.00 O ATOM 1031 CB ARG A 70 9.892 6.463 -0.034 1.00 0.00 C ATOM 1032 CG ARG A 70 11.201 6.824 0.671 1.00 0.00 C ATOM 1033 CD ARG A 70 12.364 6.108 -0.019 1.00 0.00 C ATOM 1034 NE ARG A 70 13.631 6.707 0.487 1.00 0.00 N ATOM 1035 CZ ARG A 70 14.848 6.686 -0.131 1.00 0.00 C ATOM 1036 NH1 ARG A 70 15.012 6.026 -1.315 1.00 0.00 N ATOM 1037 NH2 ARG A 70 15.883 7.485 0.261 1.00 0.00 N ATOM 0 H ARG A 70 8.756 5.469 1.745 1.00 0.00 H new ATOM 0 HA ARG A 70 8.831 8.181 0.910 1.00 0.00 H new ATOM 0 HB2 ARG A 70 9.749 5.383 0.010 1.00 0.00 H new ATOM 0 HB3 ARG A 70 9.969 6.732 -1.088 1.00 0.00 H new ATOM 0 HG2 ARG A 70 11.356 7.903 0.644 1.00 0.00 H new ATOM 0 HG3 ARG A 70 11.153 6.535 1.721 1.00 0.00 H new ATOM 0 HD2 ARG A 70 12.335 5.039 0.194 1.00 0.00 H new ATOM 0 HD3 ARG A 70 12.294 6.220 -1.101 1.00 0.00 H new ATOM 0 HE ARG A 70 13.584 7.182 1.388 1.00 0.00 H new ATOM 0 HH11 ARG A 70 14.222 5.544 -1.744 1.00 0.00 H new ATOM 0 HH12 ARG A 70 15.925 6.015 -1.771 1.00 0.00 H new ATOM 0 HH21 ARG A 70 15.762 8.129 1.043 1.00 0.00 H new ATOM 0 HH22 ARG A 70 16.777 7.438 -0.228 1.00 0.00 H new ATOM 1051 N LYS A 71 7.380 8.546 -0.926 1.00 0.00 N ATOM 1052 CA LYS A 71 6.466 8.859 -1.981 1.00 0.00 C ATOM 1053 C LYS A 71 7.070 10.005 -2.718 1.00 0.00 C ATOM 1054 O LYS A 71 7.870 10.742 -2.145 1.00 0.00 O ATOM 1055 CB LYS A 71 5.033 9.235 -1.568 1.00 0.00 C ATOM 1056 CG LYS A 71 5.048 10.183 -0.367 1.00 0.00 C ATOM 1057 CD LYS A 71 3.625 10.436 0.134 1.00 0.00 C ATOM 1058 CE LYS A 71 3.719 11.507 1.223 1.00 0.00 C ATOM 1059 NZ LYS A 71 2.429 11.540 1.947 1.00 0.00 N ATOM 0 H LYS A 71 7.845 9.368 -0.540 1.00 0.00 H new ATOM 0 HA LYS A 71 6.337 7.949 -2.567 1.00 0.00 H new ATOM 0 HB2 LYS A 71 4.520 9.709 -2.405 1.00 0.00 H new ATOM 0 HB3 LYS A 71 4.472 8.334 -1.319 1.00 0.00 H new ATOM 0 HG2 LYS A 71 5.651 9.755 0.434 1.00 0.00 H new ATOM 0 HG3 LYS A 71 5.514 11.127 -0.648 1.00 0.00 H new ATOM 0 HD2 LYS A 71 2.983 10.770 -0.681 1.00 0.00 H new ATOM 0 HD3 LYS A 71 3.187 9.520 0.530 1.00 0.00 H new ATOM 0 HE2 LYS A 71 4.535 11.281 1.909 1.00 0.00 H new ATOM 0 HE3 LYS A 71 3.933 12.481 0.782 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 2.469 12.262 2.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 1.664 11.771 1.282 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 2.247 10.610 2.374 1.00 0.00 H new ATOM 1073 N MET A 72 6.638 10.246 -3.969 1.00 0.00 N ATOM 1074 CA MET A 72 6.891 11.466 -4.670 1.00 0.00 C ATOM 1075 C MET A 72 5.759 12.387 -4.370 1.00 0.00 C ATOM 1076 O MET A 72 5.491 12.786 -3.238 1.00 0.00 O ATOM 1077 CB MET A 72 7.132 11.186 -6.163 1.00 0.00 C ATOM 1078 CG MET A 72 8.537 10.647 -6.439 1.00 0.00 C ATOM 1079 SD MET A 72 9.877 11.844 -6.159 1.00 0.00 S ATOM 1080 CE MET A 72 11.234 10.658 -6.380 1.00 0.00 C ATOM 0 H MET A 72 6.096 9.571 -4.509 1.00 0.00 H new ATOM 0 HA MET A 72 7.808 11.956 -4.342 1.00 0.00 H new ATOM 0 HB2 MET A 72 6.394 10.467 -6.518 1.00 0.00 H new ATOM 0 HB3 MET A 72 6.981 12.104 -6.731 1.00 0.00 H new ATOM 0 HG2 MET A 72 8.708 9.776 -5.807 1.00 0.00 H new ATOM 0 HG3 MET A 72 8.584 10.305 -7.473 1.00 0.00 H new ATOM 0 HE1 MET A 72 12.188 11.169 -6.252 1.00 0.00 H new ATOM 0 HE2 MET A 72 11.146 9.863 -5.640 1.00 0.00 H new ATOM 0 HE3 MET A 72 11.183 10.229 -7.381 1.00 0.00 H new ATOM 1090 N LYS A 73 4.968 12.791 -5.380 1.00 0.00 N ATOM 1091 CA LYS A 73 3.845 13.676 -5.378 1.00 0.00 C ATOM 1092 C LYS A 73 2.550 12.996 -5.094 1.00 0.00 C ATOM 1093 O LYS A 73 2.389 11.780 -5.189 1.00 0.00 O ATOM 1094 CB LYS A 73 3.960 14.345 -6.758 1.00 0.00 C ATOM 1095 CG LYS A 73 5.124 15.336 -6.823 1.00 0.00 C ATOM 1096 CD LYS A 73 4.982 16.038 -8.174 1.00 0.00 C ATOM 1097 CE LYS A 73 4.792 15.083 -9.354 1.00 0.00 C ATOM 1098 NZ LYS A 73 5.789 13.996 -9.476 1.00 0.00 N ATOM 0 H LYS A 73 5.145 12.447 -6.324 1.00 0.00 H new ATOM 0 HA LYS A 73 3.855 14.407 -4.570 1.00 0.00 H new ATOM 0 HB2 LYS A 73 4.094 13.579 -7.522 1.00 0.00 H new ATOM 0 HB3 LYS A 73 3.029 14.864 -6.987 1.00 0.00 H new ATOM 0 HG2 LYS A 73 5.078 16.051 -6.002 1.00 0.00 H new ATOM 0 HG3 LYS A 73 6.082 14.823 -6.745 1.00 0.00 H new ATOM 0 HD2 LYS A 73 4.132 16.719 -8.130 1.00 0.00 H new ATOM 0 HD3 LYS A 73 5.869 16.646 -8.351 1.00 0.00 H new ATOM 0 HE2 LYS A 73 3.802 14.634 -9.277 1.00 0.00 H new ATOM 0 HE3 LYS A 73 4.806 15.667 -10.274 1.00 0.00 H new ATOM 0 HZ1 LYS A 73 6.221 14.025 -10.422 1.00 0.00 H new ATOM 0 HZ2 LYS A 73 6.528 14.120 -8.754 1.00 0.00 H new ATOM 0 HZ3 LYS A 73 5.320 13.078 -9.338 1.00 0.00 H new ATOM 1112 N ASP A 74 1.480 13.773 -4.847 1.00 0.00 N ATOM 1113 CA ASP A 74 0.147 13.294 -4.648 1.00 0.00 C ATOM 1114 C ASP A 74 -0.392 12.517 -5.799 1.00 0.00 C ATOM 1115 O ASP A 74 -0.961 11.461 -5.526 1.00 0.00 O ATOM 1116 CB ASP A 74 -0.741 14.432 -4.117 1.00 0.00 C ATOM 1117 CG ASP A 74 -0.212 15.113 -2.863 1.00 0.00 C ATOM 1118 OD1 ASP A 74 0.702 15.965 -3.022 1.00 0.00 O ATOM 1119 OD2 ASP A 74 -0.652 14.824 -1.717 1.00 0.00 O ATOM 0 H ASP A 74 1.549 14.789 -4.783 1.00 0.00 H new ATOM 0 HA ASP A 74 0.157 12.533 -3.868 1.00 0.00 H new ATOM 0 HB2 ASP A 74 -0.857 15.181 -4.900 1.00 0.00 H new ATOM 0 HB3 ASP A 74 -1.734 14.034 -3.907 1.00 0.00 H new ATOM 1124 N THR A 75 -0.202 13.088 -7.002 1.00 0.00 N ATOM 1125 CA THR A 75 -0.353 12.499 -8.296 1.00 0.00 C ATOM 1126 C THR A 75 0.287 11.176 -8.542 1.00 0.00 C ATOM 1127 O THR A 75 -0.353 10.259 -9.054 1.00 0.00 O ATOM 1128 CB THR A 75 0.098 13.370 -9.431 1.00 0.00 C ATOM 1129 OG1 THR A 75 1.471 13.703 -9.290 1.00 0.00 O ATOM 1130 CG2 THR A 75 -0.716 14.674 -9.471 1.00 0.00 C ATOM 0 H THR A 75 0.087 14.064 -7.072 1.00 0.00 H new ATOM 0 HA THR A 75 -1.434 12.363 -8.274 1.00 0.00 H new ATOM 0 HB THR A 75 -0.054 12.811 -10.355 1.00 0.00 H new ATOM 0 HG1 THR A 75 1.749 14.270 -10.040 1.00 0.00 H new ATOM 0 HG21 THR A 75 -0.373 15.292 -10.301 1.00 0.00 H new ATOM 0 HG22 THR A 75 -1.772 14.440 -9.605 1.00 0.00 H new ATOM 0 HG23 THR A 75 -0.580 15.216 -8.535 1.00 0.00 H new ATOM 1138 N ASP A 76 1.512 10.957 -8.031 1.00 0.00 N ATOM 1139 CA ASP A 76 2.232 9.721 -8.038 1.00 0.00 C ATOM 1140 C ASP A 76 1.698 8.681 -7.114 1.00 0.00 C ATOM 1141 O ASP A 76 1.548 7.509 -7.453 1.00 0.00 O ATOM 1142 CB ASP A 76 3.717 9.949 -7.708 1.00 0.00 C ATOM 1143 CG ASP A 76 4.461 10.692 -8.808 1.00 0.00 C ATOM 1144 OD1 ASP A 76 4.425 10.268 -9.994 1.00 0.00 O ATOM 1145 OD2 ASP A 76 5.129 11.696 -8.441 1.00 0.00 O ATOM 0 H ASP A 76 2.039 11.704 -7.578 1.00 0.00 H new ATOM 0 HA ASP A 76 2.107 9.341 -9.052 1.00 0.00 H new ATOM 0 HB2 ASP A 76 3.795 10.513 -6.779 1.00 0.00 H new ATOM 0 HB3 ASP A 76 4.198 8.986 -7.538 1.00 0.00 H new ATOM 1150 N SER A 77 1.520 9.092 -5.846 1.00 0.00 N ATOM 1151 CA SER A 77 1.148 8.267 -4.738 1.00 0.00 C ATOM 1152 C SER A 77 -0.219 7.674 -4.716 1.00 0.00 C ATOM 1153 O SER A 77 -0.559 6.691 -4.059 1.00 0.00 O ATOM 1154 CB SER A 77 1.268 9.137 -3.475 1.00 0.00 C ATOM 1155 OG SER A 77 1.079 8.432 -2.257 1.00 0.00 O ATOM 0 H SER A 77 1.645 10.068 -5.577 1.00 0.00 H new ATOM 0 HA SER A 77 1.816 7.409 -4.809 1.00 0.00 H new ATOM 0 HB2 SER A 77 2.253 9.603 -3.462 1.00 0.00 H new ATOM 0 HB3 SER A 77 0.535 9.942 -3.532 1.00 0.00 H new ATOM 0 HG SER A 77 1.172 9.051 -1.503 1.00 0.00 H new ATOM 1161 N GLU A 78 -1.087 8.227 -5.582 1.00 0.00 N ATOM 1162 CA GLU A 78 -2.451 7.861 -5.803 1.00 0.00 C ATOM 1163 C GLU A 78 -2.465 6.870 -6.916 1.00 0.00 C ATOM 1164 O GLU A 78 -3.419 6.095 -6.954 1.00 0.00 O ATOM 1165 CB GLU A 78 -3.385 9.053 -6.075 1.00 0.00 C ATOM 1166 CG GLU A 78 -3.281 9.725 -7.445 1.00 0.00 C ATOM 1167 CD GLU A 78 -4.366 10.775 -7.639 1.00 0.00 C ATOM 1168 OE1 GLU A 78 -4.518 11.756 -6.863 1.00 0.00 O ATOM 1169 OE2 GLU A 78 -5.146 10.633 -8.618 1.00 0.00 O ATOM 0 H GLU A 78 -0.805 9.002 -6.182 1.00 0.00 H new ATOM 0 HA GLU A 78 -2.853 7.426 -4.888 1.00 0.00 H new ATOM 0 HB2 GLU A 78 -4.412 8.714 -5.942 1.00 0.00 H new ATOM 0 HB3 GLU A 78 -3.198 9.809 -5.313 1.00 0.00 H new ATOM 0 HG2 GLU A 78 -2.301 10.191 -7.549 1.00 0.00 H new ATOM 0 HG3 GLU A 78 -3.360 8.971 -8.228 1.00 0.00 H new ATOM 1176 N GLU A 79 -1.505 6.837 -7.857 1.00 0.00 N ATOM 1177 CA GLU A 79 -1.370 5.808 -8.842 1.00 0.00 C ATOM 1178 C GLU A 79 -1.115 4.472 -8.234 1.00 0.00 C ATOM 1179 O GLU A 79 -1.538 3.427 -8.726 1.00 0.00 O ATOM 1180 CB GLU A 79 -0.302 6.230 -9.865 1.00 0.00 C ATOM 1181 CG GLU A 79 -0.265 5.219 -11.013 1.00 0.00 C ATOM 1182 CD GLU A 79 0.817 5.575 -12.022 1.00 0.00 C ATOM 1183 OE1 GLU A 79 2.005 5.385 -11.647 1.00 0.00 O ATOM 1184 OE2 GLU A 79 0.462 5.992 -13.157 1.00 0.00 O ATOM 0 H GLU A 79 -0.790 7.560 -7.935 1.00 0.00 H new ATOM 0 HA GLU A 79 -2.316 5.689 -9.371 1.00 0.00 H new ATOM 0 HB2 GLU A 79 -0.525 7.225 -10.250 1.00 0.00 H new ATOM 0 HB3 GLU A 79 0.675 6.286 -9.384 1.00 0.00 H new ATOM 0 HG2 GLU A 79 -0.082 4.220 -10.616 1.00 0.00 H new ATOM 0 HG3 GLU A 79 -1.235 5.192 -11.510 1.00 0.00 H new ATOM 1191 N GLU A 80 -0.287 4.426 -7.175 1.00 0.00 N ATOM 1192 CA GLU A 80 0.061 3.251 -6.437 1.00 0.00 C ATOM 1193 C GLU A 80 -1.101 2.591 -5.779 1.00 0.00 C ATOM 1194 O GLU A 80 -1.200 1.374 -5.625 1.00 0.00 O ATOM 1195 CB GLU A 80 1.142 3.626 -5.409 1.00 0.00 C ATOM 1196 CG GLU A 80 2.443 4.202 -5.971 1.00 0.00 C ATOM 1197 CD GLU A 80 3.570 4.155 -4.949 1.00 0.00 C ATOM 1198 OE1 GLU A 80 3.323 4.050 -3.718 1.00 0.00 O ATOM 1199 OE2 GLU A 80 4.750 4.314 -5.363 1.00 0.00 O ATOM 0 H GLU A 80 0.168 5.263 -6.811 1.00 0.00 H new ATOM 0 HA GLU A 80 0.442 2.512 -7.142 1.00 0.00 H new ATOM 0 HB2 GLU A 80 0.718 4.353 -4.716 1.00 0.00 H new ATOM 0 HB3 GLU A 80 1.385 2.736 -4.828 1.00 0.00 H new ATOM 0 HG2 GLU A 80 2.735 3.642 -6.860 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.279 5.233 -6.284 1.00 0.00 H new ATOM 1206 N ILE A 81 -2.102 3.438 -5.481 1.00 0.00 N ATOM 1207 CA ILE A 81 -3.382 3.064 -4.963 1.00 0.00 C ATOM 1208 C ILE A 81 -4.156 2.343 -6.013 1.00 0.00 C ATOM 1209 O ILE A 81 -4.494 1.180 -5.800 1.00 0.00 O ATOM 1210 CB ILE A 81 -4.159 4.196 -4.359 1.00 0.00 C ATOM 1211 CG1 ILE A 81 -3.316 5.057 -3.403 1.00 0.00 C ATOM 1212 CG2 ILE A 81 -5.382 3.550 -3.687 1.00 0.00 C ATOM 1213 CD1 ILE A 81 -2.745 4.247 -2.239 1.00 0.00 C ATOM 0 H ILE A 81 -2.012 4.446 -5.610 1.00 0.00 H new ATOM 0 HA ILE A 81 -3.202 2.391 -4.124 1.00 0.00 H new ATOM 0 HB ILE A 81 -4.473 4.910 -5.120 1.00 0.00 H new ATOM 0 HG12 ILE A 81 -2.498 5.517 -3.958 1.00 0.00 H new ATOM 0 HG13 ILE A 81 -3.930 5.868 -3.011 1.00 0.00 H new ATOM 0 HG21 ILE A 81 -5.994 4.324 -3.225 1.00 0.00 H new ATOM 0 HG22 ILE A 81 -5.971 3.020 -4.436 1.00 0.00 H new ATOM 0 HG23 ILE A 81 -5.049 2.847 -2.924 1.00 0.00 H new ATOM 0 HD11 ILE A 81 -2.158 4.901 -1.594 1.00 0.00 H new ATOM 0 HD12 ILE A 81 -3.562 3.809 -1.665 1.00 0.00 H new ATOM 0 HD13 ILE A 81 -2.107 3.453 -2.627 1.00 0.00 H new ATOM 1225 N ARG A 82 -4.431 2.872 -7.219 1.00 0.00 N ATOM 1226 CA ARG A 82 -4.987 2.188 -8.344 1.00 0.00 C ATOM 1227 C ARG A 82 -4.236 0.961 -8.730 1.00 0.00 C ATOM 1228 O ARG A 82 -4.828 -0.064 -9.066 1.00 0.00 O ATOM 1229 CB ARG A 82 -4.870 3.243 -9.456 1.00 0.00 C ATOM 1230 CG ARG A 82 -5.880 4.392 -9.456 1.00 0.00 C ATOM 1231 CD ARG A 82 -5.744 5.472 -10.531 1.00 0.00 C ATOM 1232 NE ARG A 82 -5.365 4.736 -11.770 1.00 0.00 N ATOM 1233 CZ ARG A 82 -4.325 5.205 -12.518 1.00 0.00 C ATOM 1234 NH1 ARG A 82 -3.821 6.465 -12.365 1.00 0.00 N ATOM 1235 NH2 ARG A 82 -3.669 4.400 -13.405 1.00 0.00 N ATOM 0 H ARG A 82 -4.250 3.855 -7.421 1.00 0.00 H new ATOM 0 HA ARG A 82 -5.997 1.833 -8.140 1.00 0.00 H new ATOM 0 HB2 ARG A 82 -3.871 3.675 -9.404 1.00 0.00 H new ATOM 0 HB3 ARG A 82 -4.946 2.730 -10.415 1.00 0.00 H new ATOM 0 HG2 ARG A 82 -6.877 3.959 -9.542 1.00 0.00 H new ATOM 0 HG3 ARG A 82 -5.828 4.881 -8.483 1.00 0.00 H new ATOM 0 HD2 ARG A 82 -6.679 6.016 -10.665 1.00 0.00 H new ATOM 0 HD3 ARG A 82 -4.985 6.206 -10.260 1.00 0.00 H new ATOM 0 HE ARG A 82 -5.873 3.898 -12.053 1.00 0.00 H new ATOM 0 HH11 ARG A 82 -4.224 7.094 -11.671 1.00 0.00 H new ATOM 0 HH12 ARG A 82 -3.042 6.777 -12.945 1.00 0.00 H new ATOM 0 HH21 ARG A 82 -3.954 3.427 -13.518 1.00 0.00 H new ATOM 0 HH22 ARG A 82 -2.894 4.772 -13.954 1.00 0.00 H new ATOM 1249 N GLU A 83 -2.891 0.927 -8.750 1.00 0.00 N ATOM 1250 CA GLU A 83 -2.124 -0.227 -9.106 1.00 0.00 C ATOM 1251 C GLU A 83 -2.135 -1.361 -8.139 1.00 0.00 C ATOM 1252 O GLU A 83 -2.168 -2.534 -8.505 1.00 0.00 O ATOM 1253 CB GLU A 83 -0.719 0.235 -9.526 1.00 0.00 C ATOM 1254 CG GLU A 83 -0.640 0.752 -10.964 1.00 0.00 C ATOM 1255 CD GLU A 83 -1.092 -0.243 -12.023 1.00 0.00 C ATOM 1256 OE1 GLU A 83 -0.378 -1.205 -12.415 1.00 0.00 O ATOM 1257 OE2 GLU A 83 -2.223 -0.008 -12.525 1.00 0.00 O ATOM 0 H GLU A 83 -2.316 1.734 -8.509 1.00 0.00 H new ATOM 0 HA GLU A 83 -2.626 -0.696 -9.952 1.00 0.00 H new ATOM 0 HB2 GLU A 83 -0.389 1.022 -8.849 1.00 0.00 H new ATOM 0 HB3 GLU A 83 -0.024 -0.597 -9.411 1.00 0.00 H new ATOM 0 HG2 GLU A 83 -1.250 1.652 -11.046 1.00 0.00 H new ATOM 0 HG3 GLU A 83 0.389 1.044 -11.175 1.00 0.00 H new ATOM 1264 N ALA A 84 -2.221 -1.068 -6.829 1.00 0.00 N ATOM 1265 CA ALA A 84 -2.459 -2.036 -5.803 1.00 0.00 C ATOM 1266 C ALA A 84 -3.818 -2.643 -5.862 1.00 0.00 C ATOM 1267 O ALA A 84 -4.059 -3.806 -5.539 1.00 0.00 O ATOM 1268 CB ALA A 84 -2.310 -1.384 -4.418 1.00 0.00 C ATOM 0 H ALA A 84 -2.121 -0.119 -6.470 1.00 0.00 H new ATOM 0 HA ALA A 84 -1.722 -2.823 -5.966 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -2.493 -2.129 -3.644 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -1.300 -0.988 -4.309 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -3.031 -0.572 -4.318 1.00 0.00 H new ATOM 1274 N PHE A 85 -4.852 -1.840 -6.170 1.00 0.00 N ATOM 1275 CA PHE A 85 -6.232 -2.188 -6.307 1.00 0.00 C ATOM 1276 C PHE A 85 -6.424 -3.053 -7.505 1.00 0.00 C ATOM 1277 O PHE A 85 -7.205 -4.003 -7.481 1.00 0.00 O ATOM 1278 CB PHE A 85 -7.106 -0.924 -6.250 1.00 0.00 C ATOM 1279 CG PHE A 85 -8.588 -1.062 -6.319 1.00 0.00 C ATOM 1280 CD1 PHE A 85 -9.273 -1.114 -7.510 1.00 0.00 C ATOM 1281 CD2 PHE A 85 -9.327 -1.161 -5.164 1.00 0.00 C ATOM 1282 CE1 PHE A 85 -10.609 -1.435 -7.564 1.00 0.00 C ATOM 1283 CE2 PHE A 85 -10.672 -1.446 -5.168 1.00 0.00 C ATOM 1284 CZ PHE A 85 -11.288 -1.625 -6.384 1.00 0.00 C ATOM 0 H PHE A 85 -4.703 -0.845 -6.340 1.00 0.00 H new ATOM 0 HA PHE A 85 -6.568 -2.795 -5.466 1.00 0.00 H new ATOM 0 HB2 PHE A 85 -6.868 -0.402 -5.323 1.00 0.00 H new ATOM 0 HB3 PHE A 85 -6.798 -0.275 -7.070 1.00 0.00 H new ATOM 0 HD1 PHE A 85 -8.747 -0.897 -8.428 1.00 0.00 H new ATOM 0 HD2 PHE A 85 -8.832 -1.009 -4.216 1.00 0.00 H new ATOM 0 HE1 PHE A 85 -11.114 -1.536 -8.513 1.00 0.00 H new ATOM 0 HE2 PHE A 85 -11.227 -1.527 -4.245 1.00 0.00 H new ATOM 0 HZ PHE A 85 -12.326 -1.921 -6.413 1.00 0.00 H new ATOM 1294 N ARG A 86 -5.718 -2.718 -8.599 1.00 0.00 N ATOM 1295 CA ARG A 86 -5.603 -3.580 -9.735 1.00 0.00 C ATOM 1296 C ARG A 86 -5.059 -4.950 -9.522 1.00 0.00 C ATOM 1297 O ARG A 86 -5.190 -5.842 -10.359 1.00 0.00 O ATOM 1298 CB ARG A 86 -4.844 -2.757 -10.790 1.00 0.00 C ATOM 1299 CG ARG A 86 -5.116 -3.266 -12.207 1.00 0.00 C ATOM 1300 CD ARG A 86 -4.934 -2.278 -13.361 1.00 0.00 C ATOM 1301 NE ARG A 86 -3.450 -2.191 -13.455 1.00 0.00 N ATOM 1302 CZ ARG A 86 -2.672 -3.100 -14.112 1.00 0.00 C ATOM 1303 NH1 ARG A 86 -3.141 -4.091 -14.926 1.00 0.00 N ATOM 1304 NH2 ARG A 86 -1.330 -2.880 -14.226 1.00 0.00 N ATOM 0 H ARG A 86 -5.218 -1.834 -8.697 1.00 0.00 H new ATOM 0 HA ARG A 86 -6.605 -3.860 -10.059 1.00 0.00 H new ATOM 0 HB2 ARG A 86 -5.139 -1.710 -10.716 1.00 0.00 H new ATOM 0 HB3 ARG A 86 -3.774 -2.802 -10.586 1.00 0.00 H new ATOM 0 HG2 ARG A 86 -4.462 -4.119 -12.389 1.00 0.00 H new ATOM 0 HG3 ARG A 86 -6.141 -3.636 -12.240 1.00 0.00 H new ATOM 0 HD2 ARG A 86 -5.382 -2.642 -14.286 1.00 0.00 H new ATOM 0 HD3 ARG A 86 -5.388 -1.310 -13.147 1.00 0.00 H new ATOM 0 HE ARG A 86 -2.987 -1.404 -13.001 1.00 0.00 H new ATOM 0 HH11 ARG A 86 -4.144 -4.192 -15.080 1.00 0.00 H new ATOM 0 HH12 ARG A 86 -2.488 -4.730 -15.380 1.00 0.00 H new ATOM 0 HH21 ARG A 86 -0.915 -2.041 -13.822 1.00 0.00 H new ATOM 0 HH22 ARG A 86 -0.742 -3.555 -14.716 1.00 0.00 H new ATOM 1318 N VAL A 87 -4.339 -5.218 -8.418 1.00 0.00 N ATOM 1319 CA VAL A 87 -3.960 -6.547 -8.050 1.00 0.00 C ATOM 1320 C VAL A 87 -5.119 -7.401 -7.667 1.00 0.00 C ATOM 1321 O VAL A 87 -5.203 -8.583 -7.995 1.00 0.00 O ATOM 1322 CB VAL A 87 -2.986 -6.604 -6.910 1.00 0.00 C ATOM 1323 CG1 VAL A 87 -2.482 -8.019 -6.581 1.00 0.00 C ATOM 1324 CG2 VAL A 87 -1.787 -5.707 -7.263 1.00 0.00 C ATOM 0 H VAL A 87 -4.015 -4.500 -7.770 1.00 0.00 H new ATOM 0 HA VAL A 87 -3.490 -6.927 -8.957 1.00 0.00 H new ATOM 0 HB VAL A 87 -3.512 -6.260 -6.019 1.00 0.00 H new ATOM 0 HG11 VAL A 87 -1.783 -7.971 -5.746 1.00 0.00 H new ATOM 0 HG12 VAL A 87 -3.327 -8.653 -6.311 1.00 0.00 H new ATOM 0 HG13 VAL A 87 -1.978 -8.438 -7.452 1.00 0.00 H new ATOM 0 HG21 VAL A 87 -1.063 -5.731 -6.449 1.00 0.00 H new ATOM 0 HG22 VAL A 87 -1.318 -6.070 -8.177 1.00 0.00 H new ATOM 0 HG23 VAL A 87 -2.130 -4.683 -7.413 1.00 0.00 H new ATOM 1334 N PHE A 88 -6.029 -6.774 -6.899 1.00 0.00 N ATOM 1335 CA PHE A 88 -7.193 -7.405 -6.360 1.00 0.00 C ATOM 1336 C PHE A 88 -8.182 -7.718 -7.429 1.00 0.00 C ATOM 1337 O PHE A 88 -8.684 -8.841 -7.462 1.00 0.00 O ATOM 1338 CB PHE A 88 -7.858 -6.516 -5.295 1.00 0.00 C ATOM 1339 CG PHE A 88 -7.248 -6.758 -3.957 1.00 0.00 C ATOM 1340 CD1 PHE A 88 -7.680 -7.904 -3.332 1.00 0.00 C ATOM 1341 CD2 PHE A 88 -6.316 -5.965 -3.330 1.00 0.00 C ATOM 1342 CE1 PHE A 88 -7.331 -8.174 -2.030 1.00 0.00 C ATOM 1343 CE2 PHE A 88 -5.873 -6.307 -2.074 1.00 0.00 C ATOM 1344 CZ PHE A 88 -6.393 -7.388 -1.403 1.00 0.00 C ATOM 0 H PHE A 88 -5.950 -5.790 -6.644 1.00 0.00 H new ATOM 0 HA PHE A 88 -6.868 -8.337 -5.897 1.00 0.00 H new ATOM 0 HB2 PHE A 88 -7.746 -5.467 -5.568 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -8.927 -6.723 -5.256 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -8.303 -8.602 -3.872 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -5.935 -5.081 -3.820 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -7.790 -8.998 -1.503 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.101 -5.714 -1.605 1.00 0.00 H new ATOM 0 HZ PHE A 88 -6.070 -7.617 -0.398 1.00 0.00 H new ATOM 1354 N ASP A 89 -8.491 -6.768 -8.330 1.00 0.00 N ATOM 1355 CA ASP A 89 -9.468 -6.988 -9.350 1.00 0.00 C ATOM 1356 C ASP A 89 -8.999 -7.788 -10.517 1.00 0.00 C ATOM 1357 O ASP A 89 -8.062 -7.481 -11.252 1.00 0.00 O ATOM 1358 CB ASP A 89 -9.990 -5.597 -9.749 1.00 0.00 C ATOM 1359 CG ASP A 89 -11.186 -5.690 -10.685 1.00 0.00 C ATOM 1360 OD1 ASP A 89 -12.192 -6.311 -10.251 1.00 0.00 O ATOM 1361 OD2 ASP A 89 -11.083 -5.308 -11.882 1.00 0.00 O ATOM 0 H ASP A 89 -8.061 -5.843 -8.351 1.00 0.00 H new ATOM 0 HA ASP A 89 -10.264 -7.618 -8.953 1.00 0.00 H new ATOM 0 HB2 ASP A 89 -10.272 -5.044 -8.853 1.00 0.00 H new ATOM 0 HB3 ASP A 89 -9.192 -5.034 -10.234 1.00 0.00 H new ATOM 1366 N LYS A 90 -9.616 -8.975 -10.657 1.00 0.00 N ATOM 1367 CA LYS A 90 -9.234 -9.927 -11.653 1.00 0.00 C ATOM 1368 C LYS A 90 -9.961 -9.843 -12.950 1.00 0.00 C ATOM 1369 O LYS A 90 -9.349 -9.387 -13.914 1.00 0.00 O ATOM 1370 CB LYS A 90 -9.316 -11.364 -11.110 1.00 0.00 C ATOM 1371 CG LYS A 90 -8.790 -12.463 -12.035 1.00 0.00 C ATOM 1372 CD LYS A 90 -7.411 -12.130 -12.607 1.00 0.00 C ATOM 1373 CE LYS A 90 -6.862 -13.210 -13.541 1.00 0.00 C ATOM 1374 NZ LYS A 90 -5.537 -12.889 -14.118 1.00 0.00 N ATOM 0 H LYS A 90 -10.392 -9.279 -10.069 1.00 0.00 H new ATOM 0 HA LYS A 90 -8.203 -9.657 -11.881 1.00 0.00 H new ATOM 0 HB2 LYS A 90 -8.761 -11.409 -10.173 1.00 0.00 H new ATOM 0 HB3 LYS A 90 -10.357 -11.583 -10.874 1.00 0.00 H new ATOM 0 HG2 LYS A 90 -8.735 -13.402 -11.485 1.00 0.00 H new ATOM 0 HG3 LYS A 90 -9.494 -12.613 -12.854 1.00 0.00 H new ATOM 0 HD2 LYS A 90 -7.469 -11.187 -13.150 1.00 0.00 H new ATOM 0 HD3 LYS A 90 -6.711 -11.982 -11.785 1.00 0.00 H new ATOM 0 HE2 LYS A 90 -6.790 -14.149 -12.992 1.00 0.00 H new ATOM 0 HE3 LYS A 90 -7.572 -13.369 -14.353 1.00 0.00 H new ATOM 0 HZ1 LYS A 90 -5.231 -13.666 -14.739 1.00 0.00 H new ATOM 0 HZ2 LYS A 90 -5.602 -12.010 -14.670 1.00 0.00 H new ATOM 0 HZ3 LYS A 90 -4.845 -12.766 -13.351 1.00 0.00 H new ATOM 1388 N ASP A 91 -11.255 -10.212 -12.931 1.00 0.00 N ATOM 1389 CA ASP A 91 -12.184 -10.110 -14.013 1.00 0.00 C ATOM 1390 C ASP A 91 -12.108 -8.884 -14.858 1.00 0.00 C ATOM 1391 O ASP A 91 -11.702 -9.007 -16.012 1.00 0.00 O ATOM 1392 CB ASP A 91 -13.572 -10.438 -13.437 1.00 0.00 C ATOM 1393 CG ASP A 91 -13.897 -9.662 -12.169 1.00 0.00 C ATOM 1394 OD1 ASP A 91 -14.033 -8.410 -12.216 1.00 0.00 O ATOM 1395 OD2 ASP A 91 -14.094 -10.262 -11.079 1.00 0.00 O ATOM 0 H ASP A 91 -11.682 -10.612 -12.095 1.00 0.00 H new ATOM 0 HA ASP A 91 -11.911 -10.838 -14.777 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -14.330 -10.223 -14.190 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -13.627 -11.506 -13.225 1.00 0.00 H new ATOM 1400 N GLY A 92 -12.417 -7.701 -14.298 1.00 0.00 N ATOM 1401 CA GLY A 92 -11.991 -6.466 -14.879 1.00 0.00 C ATOM 1402 C GLY A 92 -13.011 -5.427 -14.562 1.00 0.00 C ATOM 1403 O GLY A 92 -13.009 -4.354 -15.164 1.00 0.00 O ATOM 0 H GLY A 92 -12.962 -7.600 -13.442 1.00 0.00 H new ATOM 0 HA2 GLY A 92 -11.017 -6.176 -14.484 1.00 0.00 H new ATOM 0 HA3 GLY A 92 -11.879 -6.572 -15.958 1.00 0.00 H new ATOM 1407 N ASN A 93 -14.000 -5.686 -13.688 1.00 0.00 N ATOM 1408 CA ASN A 93 -15.136 -4.857 -13.428 1.00 0.00 C ATOM 1409 C ASN A 93 -14.866 -3.624 -12.636 1.00 0.00 C ATOM 1410 O ASN A 93 -15.325 -2.534 -12.973 1.00 0.00 O ATOM 1411 CB ASN A 93 -16.345 -5.703 -12.996 1.00 0.00 C ATOM 1412 CG ASN A 93 -16.197 -6.362 -11.632 1.00 0.00 C ATOM 1413 OD1 ASN A 93 -15.260 -6.190 -10.854 1.00 0.00 O ATOM 1414 ND2 ASN A 93 -17.286 -7.106 -11.301 1.00 0.00 N ATOM 0 H ASN A 93 -14.005 -6.535 -13.123 1.00 0.00 H new ATOM 0 HA ASN A 93 -15.421 -4.402 -14.377 1.00 0.00 H new ATOM 0 HB2 ASN A 93 -17.231 -5.069 -12.985 1.00 0.00 H new ATOM 0 HB3 ASN A 93 -16.516 -6.478 -13.743 1.00 0.00 H new ATOM 0 HD21 ASN A 93 -17.345 -7.543 -10.381 1.00 0.00 H new ATOM 0 HD22 ASN A 93 -18.044 -7.227 -11.972 1.00 0.00 H new ATOM 1421 N GLY A 94 -14.025 -3.736 -11.592 1.00 0.00 N ATOM 1422 CA GLY A 94 -13.578 -2.720 -10.691 1.00 0.00 C ATOM 1423 C GLY A 94 -14.041 -2.967 -9.297 1.00 0.00 C ATOM 1424 O GLY A 94 -13.990 -2.112 -8.415 1.00 0.00 O ATOM 0 H GLY A 94 -13.615 -4.640 -11.357 1.00 0.00 H new ATOM 0 HA2 GLY A 94 -12.489 -2.674 -10.708 1.00 0.00 H new ATOM 0 HA3 GLY A 94 -13.944 -1.750 -11.028 1.00 0.00 H new ATOM 1428 N TYR A 95 -14.601 -4.136 -8.936 1.00 0.00 N ATOM 1429 CA TYR A 95 -15.189 -4.408 -7.662 1.00 0.00 C ATOM 1430 C TYR A 95 -14.566 -5.665 -7.162 1.00 0.00 C ATOM 1431 O TYR A 95 -14.449 -6.629 -7.917 1.00 0.00 O ATOM 1432 CB TYR A 95 -16.727 -4.436 -7.690 1.00 0.00 C ATOM 1433 CG TYR A 95 -17.428 -3.413 -8.515 1.00 0.00 C ATOM 1434 CD1 TYR A 95 -17.093 -2.082 -8.427 1.00 0.00 C ATOM 1435 CD2 TYR A 95 -18.316 -3.872 -9.460 1.00 0.00 C ATOM 1436 CE1 TYR A 95 -17.695 -1.153 -9.242 1.00 0.00 C ATOM 1437 CE2 TYR A 95 -18.912 -2.946 -10.284 1.00 0.00 C ATOM 1438 CZ TYR A 95 -18.616 -1.610 -10.155 1.00 0.00 C ATOM 1439 OH TYR A 95 -19.331 -0.776 -11.041 1.00 0.00 O ATOM 0 H TYR A 95 -14.645 -4.935 -9.569 1.00 0.00 H new ATOM 0 HA TYR A 95 -14.983 -3.594 -6.967 1.00 0.00 H new ATOM 0 HB2 TYR A 95 -17.037 -5.420 -8.043 1.00 0.00 H new ATOM 0 HB3 TYR A 95 -17.082 -4.339 -6.664 1.00 0.00 H new ATOM 0 HD1 TYR A 95 -16.350 -1.764 -7.711 1.00 0.00 H new ATOM 0 HD2 TYR A 95 -18.538 -4.925 -9.552 1.00 0.00 H new ATOM 0 HE1 TYR A 95 -17.453 -0.103 -9.168 1.00 0.00 H new ATOM 0 HE2 TYR A 95 -19.616 -3.270 -11.036 1.00 0.00 H new ATOM 0 HH TYR A 95 -19.926 -1.322 -11.596 1.00 0.00 H new ATOM 1449 N ILE A 96 -14.164 -5.760 -5.882 1.00 0.00 N ATOM 1450 CA ILE A 96 -13.481 -6.901 -5.355 1.00 0.00 C ATOM 1451 C ILE A 96 -14.486 -7.853 -4.802 1.00 0.00 C ATOM 1452 O ILE A 96 -15.209 -7.472 -3.883 1.00 0.00 O ATOM 1453 CB ILE A 96 -12.437 -6.553 -4.335 1.00 0.00 C ATOM 1454 CG1 ILE A 96 -11.418 -5.536 -4.876 1.00 0.00 C ATOM 1455 CG2 ILE A 96 -11.688 -7.866 -4.052 1.00 0.00 C ATOM 1456 CD1 ILE A 96 -10.626 -4.917 -3.725 1.00 0.00 C ATOM 0 H ILE A 96 -14.318 -5.023 -5.194 1.00 0.00 H new ATOM 0 HA ILE A 96 -12.934 -7.370 -6.173 1.00 0.00 H new ATOM 0 HB ILE A 96 -12.908 -6.113 -3.456 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -10.738 -6.027 -5.572 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -11.934 -4.754 -5.433 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -10.907 -7.687 -3.313 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -12.388 -8.609 -3.669 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -11.237 -8.234 -4.974 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -9.908 -4.199 -4.122 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -11.310 -4.409 -3.045 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -10.094 -5.701 -3.186 1.00 0.00 H new ATOM 1468 N SER A 97 -14.612 -9.070 -5.359 1.00 0.00 N ATOM 1469 CA SER A 97 -15.452 -10.132 -4.899 1.00 0.00 C ATOM 1470 C SER A 97 -14.719 -10.949 -3.891 1.00 0.00 C ATOM 1471 O SER A 97 -13.501 -10.929 -3.718 1.00 0.00 O ATOM 1472 CB SER A 97 -16.059 -10.998 -6.015 1.00 0.00 C ATOM 1473 OG SER A 97 -15.215 -12.013 -6.539 1.00 0.00 O ATOM 0 H SER A 97 -14.087 -9.330 -6.194 1.00 0.00 H new ATOM 0 HA SER A 97 -16.318 -9.665 -4.429 1.00 0.00 H new ATOM 0 HB2 SER A 97 -16.965 -11.467 -5.632 1.00 0.00 H new ATOM 0 HB3 SER A 97 -16.360 -10.344 -6.833 1.00 0.00 H new ATOM 0 HG SER A 97 -15.692 -12.506 -7.239 1.00 0.00 H new ATOM 1479 N ALA A 98 -15.489 -11.750 -3.133 1.00 0.00 N ATOM 1480 CA ALA A 98 -15.001 -12.414 -1.964 1.00 0.00 C ATOM 1481 C ALA A 98 -13.966 -13.443 -2.264 1.00 0.00 C ATOM 1482 O ALA A 98 -12.984 -13.573 -1.535 1.00 0.00 O ATOM 1483 CB ALA A 98 -16.187 -13.033 -1.204 1.00 0.00 C ATOM 0 H ALA A 98 -16.470 -11.940 -3.336 1.00 0.00 H new ATOM 0 HA ALA A 98 -14.506 -11.668 -1.342 1.00 0.00 H new ATOM 0 HB1 ALA A 98 -15.822 -13.541 -0.311 1.00 0.00 H new ATOM 0 HB2 ALA A 98 -16.884 -12.247 -0.914 1.00 0.00 H new ATOM 0 HB3 ALA A 98 -16.697 -13.751 -1.847 1.00 0.00 H new ATOM 1489 N ALA A 99 -14.255 -14.016 -3.446 1.00 0.00 N ATOM 1490 CA ALA A 99 -13.459 -14.911 -4.227 1.00 0.00 C ATOM 1491 C ALA A 99 -12.124 -14.470 -4.721 1.00 0.00 C ATOM 1492 O ALA A 99 -11.155 -15.213 -4.573 1.00 0.00 O ATOM 1493 CB ALA A 99 -14.266 -15.344 -5.463 1.00 0.00 C ATOM 0 H ALA A 99 -15.148 -13.829 -3.903 1.00 0.00 H new ATOM 0 HA ALA A 99 -13.232 -15.696 -3.505 1.00 0.00 H new ATOM 0 HB1 ALA A 99 -13.669 -16.027 -6.067 1.00 0.00 H new ATOM 0 HB2 ALA A 99 -15.179 -15.846 -5.144 1.00 0.00 H new ATOM 0 HB3 ALA A 99 -14.523 -14.466 -6.056 1.00 0.00 H new ATOM 1499 N GLU A 100 -12.029 -13.219 -5.207 1.00 0.00 N ATOM 1500 CA GLU A 100 -10.820 -12.542 -5.559 1.00 0.00 C ATOM 1501 C GLU A 100 -10.031 -12.201 -4.342 1.00 0.00 C ATOM 1502 O GLU A 100 -8.835 -12.485 -4.294 1.00 0.00 O ATOM 1503 CB GLU A 100 -11.112 -11.211 -6.273 1.00 0.00 C ATOM 1504 CG GLU A 100 -11.912 -11.364 -7.568 1.00 0.00 C ATOM 1505 CD GLU A 100 -12.474 -10.109 -8.221 1.00 0.00 C ATOM 1506 OE1 GLU A 100 -13.465 -9.493 -7.745 1.00 0.00 O ATOM 1507 OE2 GLU A 100 -12.008 -9.684 -9.312 1.00 0.00 O ATOM 0 H GLU A 100 -12.855 -12.642 -5.364 1.00 0.00 H new ATOM 0 HA GLU A 100 -10.268 -13.218 -6.212 1.00 0.00 H new ATOM 0 HB2 GLU A 100 -11.661 -10.558 -5.594 1.00 0.00 H new ATOM 0 HB3 GLU A 100 -10.167 -10.716 -6.498 1.00 0.00 H new ATOM 0 HG2 GLU A 100 -11.272 -11.860 -8.298 1.00 0.00 H new ATOM 0 HG3 GLU A 100 -12.746 -12.036 -7.366 1.00 0.00 H new ATOM 1514 N LEU A 101 -10.651 -11.748 -3.237 1.00 0.00 N ATOM 1515 CA LEU A 101 -10.093 -11.551 -1.936 1.00 0.00 C ATOM 1516 C LEU A 101 -9.602 -12.786 -1.261 1.00 0.00 C ATOM 1517 O LEU A 101 -8.521 -12.761 -0.675 1.00 0.00 O ATOM 1518 CB LEU A 101 -11.115 -10.814 -1.055 1.00 0.00 C ATOM 1519 CG LEU A 101 -10.618 -10.331 0.318 1.00 0.00 C ATOM 1520 CD1 LEU A 101 -10.176 -8.860 0.242 1.00 0.00 C ATOM 1521 CD2 LEU A 101 -11.668 -10.410 1.439 1.00 0.00 C ATOM 0 H LEU A 101 -11.639 -11.496 -3.260 1.00 0.00 H new ATOM 0 HA LEU A 101 -9.196 -10.949 -2.079 1.00 0.00 H new ATOM 0 HB2 LEU A 101 -11.481 -9.949 -1.608 1.00 0.00 H new ATOM 0 HB3 LEU A 101 -11.967 -11.475 -0.896 1.00 0.00 H new ATOM 0 HG LEU A 101 -9.798 -11.006 0.562 1.00 0.00 H new ATOM 0 HD11 LEU A 101 -9.827 -8.534 1.222 1.00 0.00 H new ATOM 0 HD12 LEU A 101 -9.368 -8.760 -0.483 1.00 0.00 H new ATOM 0 HD13 LEU A 101 -11.019 -8.242 -0.067 1.00 0.00 H new ATOM 0 HD21 LEU A 101 -11.233 -10.050 2.371 1.00 0.00 H new ATOM 0 HD22 LEU A 101 -12.527 -9.792 1.177 1.00 0.00 H new ATOM 0 HD23 LEU A 101 -11.990 -11.444 1.564 1.00 0.00 H new ATOM 1533 N ARG A 102 -10.306 -13.930 -1.335 1.00 0.00 N ATOM 1534 CA ARG A 102 -9.797 -15.125 -0.737 1.00 0.00 C ATOM 1535 C ARG A 102 -8.704 -15.737 -1.544 1.00 0.00 C ATOM 1536 O ARG A 102 -7.764 -16.286 -0.972 1.00 0.00 O ATOM 1537 CB ARG A 102 -10.994 -16.058 -0.490 1.00 0.00 C ATOM 1538 CG ARG A 102 -10.727 -17.204 0.489 1.00 0.00 C ATOM 1539 CD ARG A 102 -12.004 -17.911 0.948 1.00 0.00 C ATOM 1540 NE ARG A 102 -11.720 -18.638 2.218 1.00 0.00 N ATOM 1541 CZ ARG A 102 -12.666 -19.091 3.091 1.00 0.00 C ATOM 1542 NH1 ARG A 102 -13.973 -19.089 2.697 1.00 0.00 N ATOM 1543 NH2 ARG A 102 -12.327 -19.602 4.311 1.00 0.00 N ATOM 0 H ARG A 102 -11.209 -14.028 -1.799 1.00 0.00 H new ATOM 0 HA ARG A 102 -9.318 -14.908 0.218 1.00 0.00 H new ATOM 0 HB2 ARG A 102 -11.827 -15.464 -0.113 1.00 0.00 H new ATOM 0 HB3 ARG A 102 -11.309 -16.481 -1.444 1.00 0.00 H new ATOM 0 HG2 ARG A 102 -10.066 -17.931 0.017 1.00 0.00 H new ATOM 0 HG3 ARG A 102 -10.201 -16.814 1.361 1.00 0.00 H new ATOM 0 HD2 ARG A 102 -12.804 -17.186 1.099 1.00 0.00 H new ATOM 0 HD3 ARG A 102 -12.346 -18.608 0.183 1.00 0.00 H new ATOM 0 HE ARG A 102 -10.742 -18.810 2.453 1.00 0.00 H new ATOM 0 HH11 ARG A 102 -14.225 -18.754 1.767 1.00 0.00 H new ATOM 0 HH12 ARG A 102 -14.698 -19.423 3.332 1.00 0.00 H new ATOM 0 HH21 ARG A 102 -11.347 -19.652 4.589 1.00 0.00 H new ATOM 0 HH22 ARG A 102 -13.054 -19.934 4.945 1.00 0.00 H new ATOM 1557 N HIS A 103 -8.721 -15.507 -2.869 1.00 0.00 N ATOM 1558 CA HIS A 103 -7.683 -15.813 -3.804 1.00 0.00 C ATOM 1559 C HIS A 103 -6.414 -15.128 -3.430 1.00 0.00 C ATOM 1560 O HIS A 103 -5.379 -15.776 -3.279 1.00 0.00 O ATOM 1561 CB HIS A 103 -8.098 -15.708 -5.281 1.00 0.00 C ATOM 1562 CG HIS A 103 -7.064 -16.201 -6.249 1.00 0.00 C ATOM 1563 ND1 HIS A 103 -6.859 -17.520 -6.603 1.00 0.00 N ATOM 1564 CD2 HIS A 103 -6.180 -15.456 -6.966 1.00 0.00 C ATOM 1565 CE1 HIS A 103 -5.832 -17.525 -7.495 1.00 0.00 C ATOM 1566 NE2 HIS A 103 -5.416 -16.298 -7.748 1.00 0.00 N ATOM 0 H HIS A 103 -9.525 -15.072 -3.321 1.00 0.00 H new ATOM 0 HA HIS A 103 -7.476 -16.880 -3.724 1.00 0.00 H new ATOM 0 HB2 HIS A 103 -9.017 -16.275 -5.429 1.00 0.00 H new ATOM 0 HB3 HIS A 103 -8.325 -14.667 -5.509 1.00 0.00 H new ATOM 0 HD2 HIS A 103 -6.091 -14.380 -6.929 1.00 0.00 H new ATOM 0 HE1 HIS A 103 -5.412 -18.416 -7.938 1.00 0.00 H new ATOM 0 HE2 HIS A 103 -4.675 -16.026 -8.394 1.00 0.00 H new ATOM 1574 N VAL A 104 -6.349 -13.787 -3.355 1.00 0.00 N ATOM 1575 CA VAL A 104 -5.240 -13.020 -2.879 1.00 0.00 C ATOM 1576 C VAL A 104 -4.711 -13.382 -1.534 1.00 0.00 C ATOM 1577 O VAL A 104 -3.497 -13.483 -1.364 1.00 0.00 O ATOM 1578 CB VAL A 104 -5.679 -11.586 -2.892 1.00 0.00 C ATOM 1579 CG1 VAL A 104 -4.767 -10.464 -2.367 1.00 0.00 C ATOM 1580 CG2 VAL A 104 -6.038 -11.218 -4.341 1.00 0.00 C ATOM 0 H VAL A 104 -7.128 -13.197 -3.648 1.00 0.00 H new ATOM 0 HA VAL A 104 -4.399 -13.228 -3.541 1.00 0.00 H new ATOM 0 HB VAL A 104 -6.486 -11.602 -2.159 1.00 0.00 H new ATOM 0 HG11 VAL A 104 -5.275 -9.505 -2.467 1.00 0.00 H new ATOM 0 HG12 VAL A 104 -4.536 -10.644 -1.317 1.00 0.00 H new ATOM 0 HG13 VAL A 104 -3.842 -10.447 -2.944 1.00 0.00 H new ATOM 0 HG21 VAL A 104 -6.362 -10.178 -4.383 1.00 0.00 H new ATOM 0 HG22 VAL A 104 -5.163 -11.351 -4.978 1.00 0.00 H new ATOM 0 HG23 VAL A 104 -6.844 -11.863 -4.691 1.00 0.00 H new ATOM 1590 N MET A 105 -5.538 -13.697 -0.521 1.00 0.00 N ATOM 1591 CA MET A 105 -5.058 -14.096 0.765 1.00 0.00 C ATOM 1592 C MET A 105 -4.337 -15.400 0.775 1.00 0.00 C ATOM 1593 O MET A 105 -3.237 -15.473 1.321 1.00 0.00 O ATOM 1594 CB MET A 105 -6.101 -14.164 1.893 1.00 0.00 C ATOM 1595 CG MET A 105 -6.845 -12.850 2.137 1.00 0.00 C ATOM 1596 SD MET A 105 -5.923 -11.584 3.060 1.00 0.00 S ATOM 1597 CE MET A 105 -7.024 -10.253 2.500 1.00 0.00 C ATOM 0 H MET A 105 -6.555 -13.674 -0.596 1.00 0.00 H new ATOM 0 HA MET A 105 -4.375 -13.272 0.970 1.00 0.00 H new ATOM 0 HB2 MET A 105 -6.827 -14.941 1.655 1.00 0.00 H new ATOM 0 HB3 MET A 105 -5.604 -14.464 2.815 1.00 0.00 H new ATOM 0 HG2 MET A 105 -7.134 -12.432 1.172 1.00 0.00 H new ATOM 0 HG3 MET A 105 -7.766 -13.070 2.678 1.00 0.00 H new ATOM 0 HE1 MET A 105 -6.726 -9.314 2.967 1.00 0.00 H new ATOM 0 HE2 MET A 105 -6.957 -10.157 1.416 1.00 0.00 H new ATOM 0 HE3 MET A 105 -8.051 -10.488 2.780 1.00 0.00 H new ATOM 1607 N THR A 106 -4.876 -16.493 0.207 1.00 0.00 N ATOM 1608 CA THR A 106 -4.113 -17.670 -0.071 1.00 0.00 C ATOM 1609 C THR A 106 -2.879 -17.547 -0.896 1.00 0.00 C ATOM 1610 O THR A 106 -1.857 -18.202 -0.693 1.00 0.00 O ATOM 1611 CB THR A 106 -4.855 -18.927 -0.419 1.00 0.00 C ATOM 1612 OG1 THR A 106 -5.787 -19.233 0.607 1.00 0.00 O ATOM 1613 CG2 THR A 106 -4.163 -20.283 -0.633 1.00 0.00 C ATOM 0 H THR A 106 -5.857 -16.561 -0.064 1.00 0.00 H new ATOM 0 HA THR A 106 -3.767 -17.788 0.956 1.00 0.00 H new ATOM 0 HB THR A 106 -5.203 -18.613 -1.403 1.00 0.00 H new ATOM 0 HG1 THR A 106 -6.271 -20.053 0.376 1.00 0.00 H new ATOM 0 HG21 THR A 106 -4.910 -21.039 -0.875 1.00 0.00 H new ATOM 0 HG22 THR A 106 -3.450 -20.202 -1.454 1.00 0.00 H new ATOM 0 HG23 THR A 106 -3.637 -20.571 0.277 1.00 0.00 H new ATOM 1621 N ASN A 107 -2.784 -16.635 -1.880 1.00 0.00 N ATOM 1622 CA ASN A 107 -1.583 -16.291 -2.575 1.00 0.00 C ATOM 1623 C ASN A 107 -0.519 -15.734 -1.693 1.00 0.00 C ATOM 1624 O ASN A 107 0.657 -16.087 -1.630 1.00 0.00 O ATOM 1625 CB ASN A 107 -1.799 -15.226 -3.663 1.00 0.00 C ATOM 1626 CG ASN A 107 -2.453 -15.913 -4.853 1.00 0.00 C ATOM 1627 OD1 ASN A 107 -2.201 -17.087 -5.123 1.00 0.00 O ATOM 1628 ND2 ASN A 107 -3.381 -15.265 -5.607 1.00 0.00 N ATOM 0 H ASN A 107 -3.593 -16.108 -2.209 1.00 0.00 H new ATOM 0 HA ASN A 107 -1.275 -17.245 -3.003 1.00 0.00 H new ATOM 0 HB2 ASN A 107 -2.432 -14.420 -3.290 1.00 0.00 H new ATOM 0 HB3 ASN A 107 -0.849 -14.777 -3.954 1.00 0.00 H new ATOM 0 HD21 ASN A 107 -3.847 -15.752 -6.372 1.00 0.00 H new ATOM 0 HD22 ASN A 107 -3.611 -14.292 -5.407 1.00 0.00 H new ATOM 1635 N LEU A 108 -0.978 -14.873 -0.767 1.00 0.00 N ATOM 1636 CA LEU A 108 -0.077 -14.101 0.031 1.00 0.00 C ATOM 1637 C LEU A 108 0.513 -14.810 1.201 1.00 0.00 C ATOM 1638 O LEU A 108 1.645 -14.551 1.609 1.00 0.00 O ATOM 1639 CB LEU A 108 -0.697 -12.772 0.495 1.00 0.00 C ATOM 1640 CG LEU A 108 -1.000 -11.652 -0.514 1.00 0.00 C ATOM 1641 CD1 LEU A 108 -1.788 -10.503 0.138 1.00 0.00 C ATOM 1642 CD2 LEU A 108 0.326 -11.069 -1.030 1.00 0.00 C ATOM 0 H LEU A 108 -1.966 -14.712 -0.572 1.00 0.00 H new ATOM 0 HA LEU A 108 0.748 -13.905 -0.654 1.00 0.00 H new ATOM 0 HB2 LEU A 108 -1.634 -13.013 0.997 1.00 0.00 H new ATOM 0 HB3 LEU A 108 -0.030 -12.353 1.249 1.00 0.00 H new ATOM 0 HG LEU A 108 -1.593 -12.083 -1.321 1.00 0.00 H new ATOM 0 HD11 LEU A 108 -1.984 -9.729 -0.604 1.00 0.00 H new ATOM 0 HD12 LEU A 108 -2.733 -10.884 0.524 1.00 0.00 H new ATOM 0 HD13 LEU A 108 -1.205 -10.081 0.957 1.00 0.00 H new ATOM 0 HD21 LEU A 108 0.120 -10.274 -1.746 1.00 0.00 H new ATOM 0 HD22 LEU A 108 0.896 -10.665 -0.193 1.00 0.00 H new ATOM 0 HD23 LEU A 108 0.904 -11.855 -1.517 1.00 0.00 H new ATOM 1654 N GLY A 109 -0.190 -15.814 1.754 1.00 0.00 N ATOM 1655 CA GLY A 109 0.142 -16.794 2.741 1.00 0.00 C ATOM 1656 C GLY A 109 -0.606 -16.497 3.995 1.00 0.00 C ATOM 1657 O GLY A 109 0.012 -16.526 5.058 1.00 0.00 O ATOM 0 H GLY A 109 -1.154 -15.955 1.451 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -0.110 -17.791 2.380 1.00 0.00 H new ATOM 0 HA3 GLY A 109 1.215 -16.786 2.933 1.00 0.00 H new ATOM 1661 N GLU A 110 -1.861 -16.019 3.906 1.00 0.00 N ATOM 1662 CA GLU A 110 -2.874 -15.832 4.897 1.00 0.00 C ATOM 1663 C GLU A 110 -3.988 -16.818 4.819 1.00 0.00 C ATOM 1664 O GLU A 110 -4.452 -17.166 3.735 1.00 0.00 O ATOM 1665 CB GLU A 110 -3.502 -14.428 4.878 1.00 0.00 C ATOM 1666 CG GLU A 110 -2.576 -13.337 5.417 1.00 0.00 C ATOM 1667 CD GLU A 110 -2.733 -13.025 6.899 1.00 0.00 C ATOM 1668 OE1 GLU A 110 -2.348 -13.960 7.651 1.00 0.00 O ATOM 1669 OE2 GLU A 110 -3.212 -11.971 7.395 1.00 0.00 O ATOM 0 H GLU A 110 -2.211 -15.720 2.996 1.00 0.00 H new ATOM 0 HA GLU A 110 -2.325 -15.979 5.827 1.00 0.00 H new ATOM 0 HB2 GLU A 110 -3.786 -14.180 3.855 1.00 0.00 H new ATOM 0 HB3 GLU A 110 -4.418 -14.440 5.469 1.00 0.00 H new ATOM 0 HG2 GLU A 110 -1.544 -13.635 5.233 1.00 0.00 H new ATOM 0 HG3 GLU A 110 -2.750 -12.423 4.850 1.00 0.00 H new ATOM 1676 N LYS A 111 -4.307 -17.472 5.951 1.00 0.00 N ATOM 1677 CA LYS A 111 -4.961 -18.741 6.021 1.00 0.00 C ATOM 1678 C LYS A 111 -6.195 -18.514 6.825 1.00 0.00 C ATOM 1679 O LYS A 111 -6.223 -18.714 8.038 1.00 0.00 O ATOM 1680 CB LYS A 111 -4.050 -19.841 6.593 1.00 0.00 C ATOM 1681 CG LYS A 111 -3.138 -19.412 7.744 1.00 0.00 C ATOM 1682 CD LYS A 111 -1.781 -18.922 7.234 1.00 0.00 C ATOM 1683 CE LYS A 111 -0.726 -19.052 8.334 1.00 0.00 C ATOM 1684 NZ LYS A 111 0.496 -18.316 7.941 1.00 0.00 N ATOM 0 H LYS A 111 -4.095 -17.090 6.873 1.00 0.00 H new ATOM 0 HA LYS A 111 -5.216 -19.115 5.029 1.00 0.00 H new ATOM 0 HB2 LYS A 111 -4.676 -20.664 6.937 1.00 0.00 H new ATOM 0 HB3 LYS A 111 -3.428 -20.229 5.786 1.00 0.00 H new ATOM 0 HG2 LYS A 111 -3.621 -18.619 8.315 1.00 0.00 H new ATOM 0 HG3 LYS A 111 -2.991 -20.251 8.424 1.00 0.00 H new ATOM 0 HD2 LYS A 111 -1.481 -19.502 6.362 1.00 0.00 H new ATOM 0 HD3 LYS A 111 -1.858 -17.883 6.914 1.00 0.00 H new ATOM 0 HE2 LYS A 111 -1.114 -18.657 9.273 1.00 0.00 H new ATOM 0 HE3 LYS A 111 -0.491 -20.103 8.504 1.00 0.00 H new ATOM 0 HZ1 LYS A 111 1.212 -18.406 8.690 1.00 0.00 H new ATOM 0 HZ2 LYS A 111 0.870 -18.713 7.055 1.00 0.00 H new ATOM 0 HZ3 LYS A 111 0.266 -17.311 7.801 1.00 0.00 H new ATOM 1698 N LEU A 112 -7.285 -18.011 6.218 1.00 0.00 N ATOM 1699 CA LEU A 112 -8.378 -17.438 6.942 1.00 0.00 C ATOM 1700 C LEU A 112 -9.607 -18.273 7.050 1.00 0.00 C ATOM 1701 O LEU A 112 -9.826 -19.201 6.272 1.00 0.00 O ATOM 1702 CB LEU A 112 -8.907 -16.128 6.335 1.00 0.00 C ATOM 1703 CG LEU A 112 -7.921 -14.977 6.599 1.00 0.00 C ATOM 1704 CD1 LEU A 112 -8.298 -13.794 5.693 1.00 0.00 C ATOM 1705 CD2 LEU A 112 -7.869 -14.586 8.086 1.00 0.00 C ATOM 0 H LEU A 112 -7.410 -18.002 5.206 1.00 0.00 H new ATOM 0 HA LEU A 112 -7.902 -17.310 7.914 1.00 0.00 H new ATOM 0 HB2 LEU A 112 -9.054 -16.250 5.262 1.00 0.00 H new ATOM 0 HB3 LEU A 112 -9.880 -15.888 6.764 1.00 0.00 H new ATOM 0 HG LEU A 112 -6.910 -15.304 6.355 1.00 0.00 H new ATOM 0 HD11 LEU A 112 -7.608 -12.968 5.867 1.00 0.00 H new ATOM 0 HD12 LEU A 112 -8.239 -14.102 4.649 1.00 0.00 H new ATOM 0 HD13 LEU A 112 -9.314 -13.472 5.919 1.00 0.00 H new ATOM 0 HD21 LEU A 112 -7.160 -13.770 8.223 1.00 0.00 H new ATOM 0 HD22 LEU A 112 -8.858 -14.266 8.413 1.00 0.00 H new ATOM 0 HD23 LEU A 112 -7.552 -15.445 8.677 1.00 0.00 H new ATOM 1717 N THR A 113 -10.397 -18.081 8.121 1.00 0.00 N ATOM 1718 CA THR A 113 -11.655 -18.757 8.195 1.00 0.00 C ATOM 1719 C THR A 113 -12.810 -18.025 7.602 1.00 0.00 C ATOM 1720 O THR A 113 -12.592 -16.862 7.266 1.00 0.00 O ATOM 1721 CB THR A 113 -12.060 -19.125 9.591 1.00 0.00 C ATOM 1722 OG1 THR A 113 -12.286 -18.012 10.443 1.00 0.00 O ATOM 1723 CG2 THR A 113 -11.114 -20.117 10.289 1.00 0.00 C ATOM 0 H THR A 113 -10.176 -17.478 8.913 1.00 0.00 H new ATOM 0 HA THR A 113 -11.450 -19.646 7.599 1.00 0.00 H new ATOM 0 HB THR A 113 -13.013 -19.630 9.430 1.00 0.00 H new ATOM 0 HG1 THR A 113 -13.190 -18.065 10.818 1.00 0.00 H new ATOM 0 HG21 THR A 113 -11.483 -20.327 11.293 1.00 0.00 H new ATOM 0 HG22 THR A 113 -11.072 -21.044 9.717 1.00 0.00 H new ATOM 0 HG23 THR A 113 -10.116 -19.684 10.353 1.00 0.00 H new ATOM 1731 N ASP A 114 -13.976 -18.677 7.447 1.00 0.00 N ATOM 1732 CA ASP A 114 -15.006 -18.176 6.592 1.00 0.00 C ATOM 1733 C ASP A 114 -15.695 -16.977 7.148 1.00 0.00 C ATOM 1734 O ASP A 114 -16.172 -16.096 6.435 1.00 0.00 O ATOM 1735 CB ASP A 114 -15.886 -19.428 6.446 1.00 0.00 C ATOM 1736 CG ASP A 114 -15.130 -20.443 5.601 1.00 0.00 C ATOM 1737 OD1 ASP A 114 -14.090 -21.031 6.002 1.00 0.00 O ATOM 1738 OD2 ASP A 114 -15.510 -20.545 4.404 1.00 0.00 O ATOM 0 H ASP A 114 -14.206 -19.554 7.915 1.00 0.00 H new ATOM 0 HA ASP A 114 -14.663 -17.782 5.635 1.00 0.00 H new ATOM 0 HB2 ASP A 114 -16.118 -19.846 7.425 1.00 0.00 H new ATOM 0 HB3 ASP A 114 -16.835 -19.173 5.975 1.00 0.00 H new ATOM 1743 N GLU A 115 -15.691 -16.860 8.488 1.00 0.00 N ATOM 1744 CA GLU A 115 -16.029 -15.708 9.265 1.00 0.00 C ATOM 1745 C GLU A 115 -15.214 -14.486 9.017 1.00 0.00 C ATOM 1746 O GLU A 115 -15.686 -13.411 8.652 1.00 0.00 O ATOM 1747 CB GLU A 115 -16.014 -15.964 10.782 1.00 0.00 C ATOM 1748 CG GLU A 115 -16.732 -17.177 11.377 1.00 0.00 C ATOM 1749 CD GLU A 115 -16.020 -18.452 10.949 1.00 0.00 C ATOM 1750 OE1 GLU A 115 -14.793 -18.566 11.215 1.00 0.00 O ATOM 1751 OE2 GLU A 115 -16.591 -19.245 10.153 1.00 0.00 O ATOM 0 H GLU A 115 -15.426 -17.647 9.081 1.00 0.00 H new ATOM 0 HA GLU A 115 -17.042 -15.514 8.912 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -14.969 -16.029 11.086 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -16.431 -15.078 11.261 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -16.749 -17.105 12.465 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -17.769 -17.198 11.043 1.00 0.00 H new ATOM 1758 N GLU A 116 -13.880 -14.655 9.058 1.00 0.00 N ATOM 1759 CA GLU A 116 -12.905 -13.648 8.772 1.00 0.00 C ATOM 1760 C GLU A 116 -13.006 -13.127 7.380 1.00 0.00 C ATOM 1761 O GLU A 116 -12.891 -11.927 7.134 1.00 0.00 O ATOM 1762 CB GLU A 116 -11.513 -14.252 9.023 1.00 0.00 C ATOM 1763 CG GLU A 116 -11.164 -14.550 10.483 1.00 0.00 C ATOM 1764 CD GLU A 116 -10.828 -13.302 11.288 1.00 0.00 C ATOM 1765 OE1 GLU A 116 -9.705 -12.781 11.055 1.00 0.00 O ATOM 1766 OE2 GLU A 116 -11.674 -12.927 12.143 1.00 0.00 O ATOM 0 H GLU A 116 -13.457 -15.549 9.306 1.00 0.00 H new ATOM 0 HA GLU A 116 -13.083 -12.794 9.425 1.00 0.00 H new ATOM 0 HB2 GLU A 116 -11.433 -15.179 8.455 1.00 0.00 H new ATOM 0 HB3 GLU A 116 -10.764 -13.568 8.624 1.00 0.00 H new ATOM 0 HG2 GLU A 116 -12.004 -15.062 10.953 1.00 0.00 H new ATOM 0 HG3 GLU A 116 -10.316 -15.234 10.514 1.00 0.00 H new ATOM 1773 N VAL A 117 -13.248 -14.037 6.420 1.00 0.00 N ATOM 1774 CA VAL A 117 -13.408 -13.645 5.055 1.00 0.00 C ATOM 1775 C VAL A 117 -14.612 -12.795 4.833 1.00 0.00 C ATOM 1776 O VAL A 117 -14.495 -11.686 4.314 1.00 0.00 O ATOM 1777 CB VAL A 117 -13.420 -14.799 4.096 1.00 0.00 C ATOM 1778 CG1 VAL A 117 -13.740 -14.484 2.625 1.00 0.00 C ATOM 1779 CG2 VAL A 117 -12.025 -15.424 4.264 1.00 0.00 C ATOM 0 H VAL A 117 -13.333 -15.040 6.588 1.00 0.00 H new ATOM 0 HA VAL A 117 -12.520 -13.048 4.844 1.00 0.00 H new ATOM 0 HB VAL A 117 -14.249 -15.464 4.340 1.00 0.00 H new ATOM 0 HG11 VAL A 117 -13.716 -15.405 2.042 1.00 0.00 H new ATOM 0 HG12 VAL A 117 -14.732 -14.037 2.556 1.00 0.00 H new ATOM 0 HG13 VAL A 117 -13.000 -13.787 2.233 1.00 0.00 H new ATOM 0 HG21 VAL A 117 -11.929 -16.284 3.601 1.00 0.00 H new ATOM 0 HG22 VAL A 117 -11.263 -14.686 4.014 1.00 0.00 H new ATOM 0 HG23 VAL A 117 -11.893 -15.746 5.297 1.00 0.00 H new ATOM 1789 N ASP A 118 -15.780 -13.114 5.418 1.00 0.00 N ATOM 1790 CA ASP A 118 -16.939 -12.276 5.385 1.00 0.00 C ATOM 1791 C ASP A 118 -16.756 -10.918 5.970 1.00 0.00 C ATOM 1792 O ASP A 118 -16.943 -9.902 5.302 1.00 0.00 O ATOM 1793 CB ASP A 118 -18.098 -13.098 5.974 1.00 0.00 C ATOM 1794 CG ASP A 118 -19.409 -12.327 5.929 1.00 0.00 C ATOM 1795 OD1 ASP A 118 -20.128 -12.141 4.911 1.00 0.00 O ATOM 1796 OD2 ASP A 118 -19.790 -11.875 7.042 1.00 0.00 O ATOM 0 H ASP A 118 -15.923 -13.984 5.931 1.00 0.00 H new ATOM 0 HA ASP A 118 -17.171 -12.007 4.354 1.00 0.00 H new ATOM 0 HB2 ASP A 118 -18.204 -14.030 5.418 1.00 0.00 H new ATOM 0 HB3 ASP A 118 -17.868 -13.366 7.005 1.00 0.00 H new ATOM 1801 N GLU A 119 -16.369 -10.940 7.258 1.00 0.00 N ATOM 1802 CA GLU A 119 -16.152 -9.782 8.068 1.00 0.00 C ATOM 1803 C GLU A 119 -15.311 -8.718 7.448 1.00 0.00 C ATOM 1804 O GLU A 119 -15.645 -7.535 7.421 1.00 0.00 O ATOM 1805 CB GLU A 119 -15.574 -10.176 9.438 1.00 0.00 C ATOM 1806 CG GLU A 119 -14.923 -9.037 10.225 1.00 0.00 C ATOM 1807 CD GLU A 119 -14.255 -9.582 11.479 1.00 0.00 C ATOM 1808 OE1 GLU A 119 -14.988 -10.132 12.344 1.00 0.00 O ATOM 1809 OE2 GLU A 119 -13.029 -9.331 11.621 1.00 0.00 O ATOM 0 H GLU A 119 -16.199 -11.811 7.760 1.00 0.00 H new ATOM 0 HA GLU A 119 -17.141 -9.339 8.183 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -16.375 -10.602 10.043 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -14.834 -10.962 9.289 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -14.186 -8.529 9.603 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -15.675 -8.296 10.497 1.00 0.00 H new ATOM 1816 N MET A 120 -14.247 -9.112 6.727 1.00 0.00 N ATOM 1817 CA MET A 120 -13.424 -8.288 5.897 1.00 0.00 C ATOM 1818 C MET A 120 -14.103 -7.473 4.850 1.00 0.00 C ATOM 1819 O MET A 120 -14.008 -6.247 4.815 1.00 0.00 O ATOM 1820 CB MET A 120 -12.318 -9.219 5.373 1.00 0.00 C ATOM 1821 CG MET A 120 -11.217 -8.440 4.651 1.00 0.00 C ATOM 1822 SD MET A 120 -9.593 -9.233 4.847 1.00 0.00 S ATOM 1823 CE MET A 120 -8.811 -7.678 4.329 1.00 0.00 C ATOM 0 H MET A 120 -13.939 -10.084 6.725 1.00 0.00 H new ATOM 0 HA MET A 120 -13.022 -7.469 6.494 1.00 0.00 H new ATOM 0 HB2 MET A 120 -11.885 -9.774 6.205 1.00 0.00 H new ATOM 0 HB3 MET A 120 -12.751 -9.952 4.692 1.00 0.00 H new ATOM 0 HG2 MET A 120 -11.460 -8.365 3.591 1.00 0.00 H new ATOM 0 HG3 MET A 120 -11.175 -7.423 5.041 1.00 0.00 H new ATOM 0 HE1 MET A 120 -7.727 -7.792 4.347 1.00 0.00 H new ATOM 0 HE2 MET A 120 -9.133 -7.428 3.318 1.00 0.00 H new ATOM 0 HE3 MET A 120 -9.103 -6.879 5.010 1.00 0.00 H new ATOM 1833 N ILE A 121 -14.910 -8.089 3.967 1.00 0.00 N ATOM 1834 CA ILE A 121 -15.707 -7.410 2.993 1.00 0.00 C ATOM 1835 C ILE A 121 -16.516 -6.269 3.505 1.00 0.00 C ATOM 1836 O ILE A 121 -16.333 -5.126 3.089 1.00 0.00 O ATOM 1837 CB ILE A 121 -16.520 -8.292 2.094 1.00 0.00 C ATOM 1838 CG1 ILE A 121 -15.715 -9.307 1.265 1.00 0.00 C ATOM 1839 CG2 ILE A 121 -17.286 -7.432 1.074 1.00 0.00 C ATOM 1840 CD1 ILE A 121 -14.805 -8.657 0.223 1.00 0.00 C ATOM 0 H ILE A 121 -15.011 -9.103 3.931 1.00 0.00 H new ATOM 0 HA ILE A 121 -14.929 -6.972 2.367 1.00 0.00 H new ATOM 0 HB ILE A 121 -17.164 -8.845 2.777 1.00 0.00 H new ATOM 0 HG12 ILE A 121 -15.109 -9.914 1.937 1.00 0.00 H new ATOM 0 HG13 ILE A 121 -16.406 -9.983 0.761 1.00 0.00 H new ATOM 0 HG21 ILE A 121 -17.875 -8.078 0.423 1.00 0.00 H new ATOM 0 HG22 ILE A 121 -17.949 -6.746 1.601 1.00 0.00 H new ATOM 0 HG23 ILE A 121 -16.577 -6.862 0.474 1.00 0.00 H new ATOM 0 HD11 ILE A 121 -14.268 -9.431 -0.325 1.00 0.00 H new ATOM 0 HD12 ILE A 121 -15.408 -8.073 -0.472 1.00 0.00 H new ATOM 0 HD13 ILE A 121 -14.090 -8.003 0.722 1.00 0.00 H new ATOM 1852 N ARG A 122 -17.363 -6.621 4.489 1.00 0.00 N ATOM 1853 CA ARG A 122 -18.170 -5.728 5.262 1.00 0.00 C ATOM 1854 C ARG A 122 -17.538 -4.491 5.801 1.00 0.00 C ATOM 1855 O ARG A 122 -18.122 -3.413 5.901 1.00 0.00 O ATOM 1856 CB ARG A 122 -18.894 -6.477 6.394 1.00 0.00 C ATOM 1857 CG ARG A 122 -19.703 -7.697 5.950 1.00 0.00 C ATOM 1858 CD ARG A 122 -20.372 -8.324 7.175 1.00 0.00 C ATOM 1859 NE ARG A 122 -21.091 -9.564 6.768 1.00 0.00 N ATOM 1860 CZ ARG A 122 -22.255 -9.634 6.060 1.00 0.00 C ATOM 1861 NH1 ARG A 122 -23.118 -8.578 5.990 1.00 0.00 N ATOM 1862 NH2 ARG A 122 -22.613 -10.825 5.497 1.00 0.00 N ATOM 0 H ARG A 122 -17.492 -7.595 4.762 1.00 0.00 H new ATOM 0 HA ARG A 122 -18.866 -5.350 4.513 1.00 0.00 H new ATOM 0 HB2 ARG A 122 -18.154 -6.798 7.128 1.00 0.00 H new ATOM 0 HB3 ARG A 122 -19.563 -5.781 6.900 1.00 0.00 H new ATOM 0 HG2 ARG A 122 -20.456 -7.403 5.219 1.00 0.00 H new ATOM 0 HG3 ARG A 122 -19.052 -8.423 5.463 1.00 0.00 H new ATOM 0 HD2 ARG A 122 -19.623 -8.557 7.932 1.00 0.00 H new ATOM 0 HD3 ARG A 122 -21.070 -7.617 7.623 1.00 0.00 H new ATOM 0 HE ARG A 122 -20.670 -10.450 7.047 1.00 0.00 H new ATOM 0 HH11 ARG A 122 -22.899 -7.708 6.475 1.00 0.00 H new ATOM 0 HH12 ARG A 122 -23.981 -8.660 5.453 1.00 0.00 H new ATOM 0 HH21 ARG A 122 -22.014 -11.643 5.609 1.00 0.00 H new ATOM 0 HH22 ARG A 122 -23.480 -10.897 4.964 1.00 0.00 H new ATOM 1876 N GLU A 123 -16.231 -4.495 6.116 1.00 0.00 N ATOM 1877 CA GLU A 123 -15.583 -3.339 6.655 1.00 0.00 C ATOM 1878 C GLU A 123 -15.418 -2.163 5.756 1.00 0.00 C ATOM 1879 O GLU A 123 -15.519 -1.028 6.219 1.00 0.00 O ATOM 1880 CB GLU A 123 -14.228 -3.789 7.228 1.00 0.00 C ATOM 1881 CG GLU A 123 -13.513 -2.619 7.906 1.00 0.00 C ATOM 1882 CD GLU A 123 -12.385 -3.012 8.849 1.00 0.00 C ATOM 1883 OE1 GLU A 123 -12.709 -3.659 9.881 1.00 0.00 O ATOM 1884 OE2 GLU A 123 -11.238 -2.530 8.646 1.00 0.00 O ATOM 0 H GLU A 123 -15.620 -5.303 5.997 1.00 0.00 H new ATOM 0 HA GLU A 123 -16.258 -2.949 7.417 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -14.381 -4.594 7.947 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -13.604 -4.189 6.429 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -13.109 -1.964 7.134 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -14.247 -2.039 8.465 1.00 0.00 H new ATOM 1891 N ALA A 124 -15.084 -2.456 4.486 1.00 0.00 N ATOM 1892 CA ALA A 124 -14.915 -1.487 3.449 1.00 0.00 C ATOM 1893 C ALA A 124 -16.191 -1.150 2.757 1.00 0.00 C ATOM 1894 O ALA A 124 -16.416 -0.025 2.312 1.00 0.00 O ATOM 1895 CB ALA A 124 -13.810 -1.813 2.431 1.00 0.00 C ATOM 0 H ALA A 124 -14.925 -3.412 4.169 1.00 0.00 H new ATOM 0 HA ALA A 124 -14.574 -0.601 3.984 1.00 0.00 H new ATOM 0 HB1 ALA A 124 -13.758 -1.021 1.684 1.00 0.00 H new ATOM 0 HB2 ALA A 124 -12.852 -1.890 2.946 1.00 0.00 H new ATOM 0 HB3 ALA A 124 -14.035 -2.760 1.940 1.00 0.00 H new ATOM 1901 N ASP A 125 -17.080 -2.153 2.649 1.00 0.00 N ATOM 1902 CA ASP A 125 -18.250 -2.116 1.827 1.00 0.00 C ATOM 1903 C ASP A 125 -19.265 -1.177 2.383 1.00 0.00 C ATOM 1904 O ASP A 125 -19.867 -1.410 3.430 1.00 0.00 O ATOM 1905 CB ASP A 125 -18.811 -3.509 1.493 1.00 0.00 C ATOM 1906 CG ASP A 125 -19.950 -3.417 0.488 1.00 0.00 C ATOM 1907 OD1 ASP A 125 -19.649 -2.946 -0.641 1.00 0.00 O ATOM 1908 OD2 ASP A 125 -21.084 -3.876 0.789 1.00 0.00 O ATOM 0 H ASP A 125 -16.979 -3.031 3.158 1.00 0.00 H new ATOM 0 HA ASP A 125 -17.948 -1.717 0.859 1.00 0.00 H new ATOM 0 HB2 ASP A 125 -18.016 -4.137 1.090 1.00 0.00 H new ATOM 0 HB3 ASP A 125 -19.165 -3.990 2.405 1.00 0.00 H new ATOM 1913 N ILE A 126 -19.308 0.027 1.786 1.00 0.00 N ATOM 1914 CA ILE A 126 -20.159 1.086 2.234 1.00 0.00 C ATOM 1915 C ILE A 126 -21.541 0.841 1.735 1.00 0.00 C ATOM 1916 O ILE A 126 -22.477 0.864 2.533 1.00 0.00 O ATOM 1917 CB ILE A 126 -19.629 2.444 1.879 1.00 0.00 C ATOM 1918 CG1 ILE A 126 -18.496 2.766 2.867 1.00 0.00 C ATOM 1919 CG2 ILE A 126 -20.777 3.444 2.094 1.00 0.00 C ATOM 1920 CD1 ILE A 126 -17.794 4.078 2.519 1.00 0.00 C ATOM 0 H ILE A 126 -18.740 0.271 0.975 1.00 0.00 H new ATOM 0 HA ILE A 126 -20.184 1.086 3.324 1.00 0.00 H new ATOM 0 HB ILE A 126 -19.264 2.490 0.853 1.00 0.00 H new ATOM 0 HG12 ILE A 126 -18.901 2.828 3.877 1.00 0.00 H new ATOM 0 HG13 ILE A 126 -17.770 1.953 2.864 1.00 0.00 H new ATOM 0 HG21 ILE A 126 -20.435 4.449 1.847 1.00 0.00 H new ATOM 0 HG22 ILE A 126 -21.616 3.178 1.451 1.00 0.00 H new ATOM 0 HG23 ILE A 126 -21.095 3.415 3.136 1.00 0.00 H new ATOM 0 HD11 ILE A 126 -17.000 4.269 3.241 1.00 0.00 H new ATOM 0 HD12 ILE A 126 -17.366 4.007 1.519 1.00 0.00 H new ATOM 0 HD13 ILE A 126 -18.515 4.895 2.548 1.00 0.00 H new ATOM 1932 N ASP A 127 -21.816 0.589 0.442 1.00 0.00 N ATOM 1933 CA ASP A 127 -23.088 0.672 -0.205 1.00 0.00 C ATOM 1934 C ASP A 127 -24.099 -0.287 0.324 1.00 0.00 C ATOM 1935 O ASP A 127 -24.972 0.004 1.140 1.00 0.00 O ATOM 1936 CB ASP A 127 -23.048 0.794 -1.737 1.00 0.00 C ATOM 1937 CG ASP A 127 -22.097 -0.170 -2.433 1.00 0.00 C ATOM 1938 OD1 ASP A 127 -21.940 -1.337 -1.984 1.00 0.00 O ATOM 1939 OD2 ASP A 127 -21.403 0.202 -3.416 1.00 0.00 O ATOM 0 H ASP A 127 -21.082 0.302 -0.205 1.00 0.00 H new ATOM 0 HA ASP A 127 -23.462 1.652 0.093 1.00 0.00 H new ATOM 0 HB2 ASP A 127 -24.054 0.633 -2.126 1.00 0.00 H new ATOM 0 HB3 ASP A 127 -22.764 1.813 -1.998 1.00 0.00 H new ATOM 1944 N GLY A 128 -24.125 -1.493 -0.271 1.00 0.00 N ATOM 1945 CA GLY A 128 -25.073 -2.520 0.029 1.00 0.00 C ATOM 1946 C GLY A 128 -24.800 -3.653 -0.900 1.00 0.00 C ATOM 1947 O GLY A 128 -25.529 -4.642 -0.954 1.00 0.00 O ATOM 0 H GLY A 128 -23.456 -1.764 -0.992 1.00 0.00 H new ATOM 0 HA2 GLY A 128 -24.978 -2.841 1.066 1.00 0.00 H new ATOM 0 HA3 GLY A 128 -26.092 -2.154 -0.099 1.00 0.00 H new ATOM 1951 N ASP A 129 -23.761 -3.668 -1.753 1.00 0.00 N ATOM 1952 CA ASP A 129 -23.727 -4.556 -2.874 1.00 0.00 C ATOM 1953 C ASP A 129 -22.890 -5.744 -2.549 1.00 0.00 C ATOM 1954 O ASP A 129 -23.088 -6.863 -3.019 1.00 0.00 O ATOM 1955 CB ASP A 129 -23.345 -3.848 -4.185 1.00 0.00 C ATOM 1956 CG ASP A 129 -21.921 -3.351 -4.396 1.00 0.00 C ATOM 1957 OD1 ASP A 129 -21.024 -3.488 -3.522 1.00 0.00 O ATOM 1958 OD2 ASP A 129 -21.677 -2.849 -5.526 1.00 0.00 O ATOM 0 H ASP A 129 -22.943 -3.065 -1.667 1.00 0.00 H new ATOM 0 HA ASP A 129 -24.737 -4.920 -3.066 1.00 0.00 H new ATOM 0 HB2 ASP A 129 -23.573 -4.533 -5.002 1.00 0.00 H new ATOM 0 HB3 ASP A 129 -24.007 -2.989 -4.294 1.00 0.00 H new ATOM 1963 N GLY A 130 -21.915 -5.576 -1.637 1.00 0.00 N ATOM 1964 CA GLY A 130 -21.104 -6.663 -1.185 1.00 0.00 C ATOM 1965 C GLY A 130 -19.762 -6.796 -1.819 1.00 0.00 C ATOM 1966 O GLY A 130 -18.947 -7.660 -1.497 1.00 0.00 O ATOM 0 H GLY A 130 -21.688 -4.678 -1.210 1.00 0.00 H new ATOM 0 HA2 GLY A 130 -20.965 -6.561 -0.109 1.00 0.00 H new ATOM 0 HA3 GLY A 130 -21.653 -7.590 -1.349 1.00 0.00 H new ATOM 1970 N GLN A 131 -19.372 -5.876 -2.719 1.00 0.00 N ATOM 1971 CA GLN A 131 -18.102 -5.805 -3.372 1.00 0.00 C ATOM 1972 C GLN A 131 -17.459 -4.485 -3.116 1.00 0.00 C ATOM 1973 O GLN A 131 -18.099 -3.449 -3.290 1.00 0.00 O ATOM 1974 CB GLN A 131 -18.049 -6.117 -4.877 1.00 0.00 C ATOM 1975 CG GLN A 131 -18.761 -7.442 -5.159 1.00 0.00 C ATOM 1976 CD GLN A 131 -18.653 -7.776 -6.639 1.00 0.00 C ATOM 1977 OE1 GLN A 131 -17.621 -7.713 -7.306 1.00 0.00 O ATOM 1978 NE2 GLN A 131 -19.802 -8.193 -7.236 1.00 0.00 N ATOM 0 H GLN A 131 -19.995 -5.123 -3.012 1.00 0.00 H new ATOM 0 HA GLN A 131 -17.552 -6.629 -2.916 1.00 0.00 H new ATOM 0 HB2 GLN A 131 -18.522 -5.313 -5.441 1.00 0.00 H new ATOM 0 HB3 GLN A 131 -17.012 -6.173 -5.209 1.00 0.00 H new ATOM 0 HG2 GLN A 131 -18.317 -8.239 -4.563 1.00 0.00 H new ATOM 0 HG3 GLN A 131 -19.809 -7.372 -4.867 1.00 0.00 H new ATOM 0 HE21 GLN A 131 -20.665 -8.250 -6.696 1.00 0.00 H new ATOM 0 HE22 GLN A 131 -19.800 -8.448 -8.224 1.00 0.00 H new ATOM 1987 N VAL A 132 -16.166 -4.562 -2.752 1.00 0.00 N ATOM 1988 CA VAL A 132 -15.332 -3.442 -2.444 1.00 0.00 C ATOM 1989 C VAL A 132 -14.886 -2.736 -3.677 1.00 0.00 C ATOM 1990 O VAL A 132 -14.329 -3.341 -4.592 1.00 0.00 O ATOM 1991 CB VAL A 132 -14.126 -3.784 -1.620 1.00 0.00 C ATOM 1992 CG1 VAL A 132 -13.525 -2.441 -1.173 1.00 0.00 C ATOM 1993 CG2 VAL A 132 -14.595 -4.540 -0.366 1.00 0.00 C ATOM 0 H VAL A 132 -15.677 -5.453 -2.668 1.00 0.00 H new ATOM 0 HA VAL A 132 -15.965 -2.789 -1.843 1.00 0.00 H new ATOM 0 HB VAL A 132 -13.411 -4.391 -2.175 1.00 0.00 H new ATOM 0 HG11 VAL A 132 -12.638 -2.623 -0.566 1.00 0.00 H new ATOM 0 HG12 VAL A 132 -13.250 -1.856 -2.050 1.00 0.00 H new ATOM 0 HG13 VAL A 132 -14.260 -1.891 -0.586 1.00 0.00 H new ATOM 0 HG21 VAL A 132 -13.732 -4.798 0.247 1.00 0.00 H new ATOM 0 HG22 VAL A 132 -15.272 -3.908 0.208 1.00 0.00 H new ATOM 0 HG23 VAL A 132 -15.114 -5.451 -0.663 1.00 0.00 H new ATOM 2003 N ASN A 133 -15.164 -1.432 -3.858 1.00 0.00 N ATOM 2004 CA ASN A 133 -14.800 -0.652 -5.000 1.00 0.00 C ATOM 2005 C ASN A 133 -13.705 0.268 -4.585 1.00 0.00 C ATOM 2006 O ASN A 133 -13.251 0.136 -3.449 1.00 0.00 O ATOM 2007 CB ASN A 133 -16.003 0.132 -5.552 1.00 0.00 C ATOM 2008 CG ASN A 133 -16.775 1.148 -4.722 1.00 0.00 C ATOM 2009 OD1 ASN A 133 -16.178 2.079 -4.185 1.00 0.00 O ATOM 2010 ND2 ASN A 133 -18.116 0.984 -4.566 1.00 0.00 N ATOM 0 H ASN A 133 -15.675 -0.889 -3.162 1.00 0.00 H new ATOM 0 HA ASN A 133 -14.462 -1.304 -5.805 1.00 0.00 H new ATOM 0 HB2 ASN A 133 -15.650 0.659 -6.438 1.00 0.00 H new ATOM 0 HB3 ASN A 133 -16.728 -0.609 -5.889 1.00 0.00 H new ATOM 0 HD21 ASN A 133 -18.647 1.641 -3.994 1.00 0.00 H new ATOM 0 HD22 ASN A 133 -18.591 0.204 -5.021 1.00 0.00 H new ATOM 2017 N TYR A 134 -13.256 1.148 -5.498 1.00 0.00 N ATOM 2018 CA TYR A 134 -12.149 2.047 -5.400 1.00 0.00 C ATOM 2019 C TYR A 134 -12.453 3.127 -4.419 1.00 0.00 C ATOM 2020 O TYR A 134 -11.660 3.337 -3.502 1.00 0.00 O ATOM 2021 CB TYR A 134 -11.750 2.631 -6.766 1.00 0.00 C ATOM 2022 CG TYR A 134 -10.451 3.357 -6.690 1.00 0.00 C ATOM 2023 CD1 TYR A 134 -9.270 2.770 -6.301 1.00 0.00 C ATOM 2024 CD2 TYR A 134 -10.360 4.711 -6.915 1.00 0.00 C ATOM 2025 CE1 TYR A 134 -8.028 3.359 -6.256 1.00 0.00 C ATOM 2026 CE2 TYR A 134 -9.161 5.377 -6.815 1.00 0.00 C ATOM 2027 CZ TYR A 134 -8.016 4.724 -6.424 1.00 0.00 C ATOM 2028 OH TYR A 134 -6.868 5.510 -6.194 1.00 0.00 O ATOM 0 H TYR A 134 -13.722 1.236 -6.401 1.00 0.00 H new ATOM 0 HA TYR A 134 -11.290 1.479 -5.043 1.00 0.00 H new ATOM 0 HB2 TYR A 134 -11.677 1.828 -7.499 1.00 0.00 H new ATOM 0 HB3 TYR A 134 -12.528 3.310 -7.114 1.00 0.00 H new ATOM 0 HD1 TYR A 134 -9.323 1.735 -5.998 1.00 0.00 H new ATOM 0 HD2 TYR A 134 -11.250 5.264 -7.176 1.00 0.00 H new ATOM 0 HE1 TYR A 134 -7.124 2.789 -6.099 1.00 0.00 H new ATOM 0 HE2 TYR A 134 -9.118 6.431 -7.048 1.00 0.00 H new ATOM 0 HH TYR A 134 -7.075 6.451 -6.373 1.00 0.00 H new ATOM 2038 N GLU A 135 -13.637 3.764 -4.450 1.00 0.00 N ATOM 2039 CA GLU A 135 -14.010 4.776 -3.511 1.00 0.00 C ATOM 2040 C GLU A 135 -14.195 4.226 -2.139 1.00 0.00 C ATOM 2041 O GLU A 135 -13.659 4.795 -1.189 1.00 0.00 O ATOM 2042 CB GLU A 135 -15.292 5.487 -3.974 1.00 0.00 C ATOM 2043 CG GLU A 135 -15.800 6.665 -3.140 1.00 0.00 C ATOM 2044 CD GLU A 135 -15.190 8.023 -3.455 1.00 0.00 C ATOM 2045 OE1 GLU A 135 -15.392 8.539 -4.586 1.00 0.00 O ATOM 2046 OE2 GLU A 135 -14.591 8.635 -2.530 1.00 0.00 O ATOM 0 H GLU A 135 -14.355 3.570 -5.148 1.00 0.00 H new ATOM 0 HA GLU A 135 -13.193 5.496 -3.468 1.00 0.00 H new ATOM 0 HB2 GLU A 135 -15.128 5.844 -4.991 1.00 0.00 H new ATOM 0 HB3 GLU A 135 -16.088 4.744 -4.022 1.00 0.00 H new ATOM 0 HG2 GLU A 135 -16.880 6.736 -3.269 1.00 0.00 H new ATOM 0 HG3 GLU A 135 -15.619 6.444 -2.088 1.00 0.00 H new ATOM 2053 N GLU A 136 -14.713 2.992 -2.003 1.00 0.00 N ATOM 2054 CA GLU A 136 -14.734 2.326 -0.738 1.00 0.00 C ATOM 2055 C GLU A 136 -13.409 2.010 -0.135 1.00 0.00 C ATOM 2056 O GLU A 136 -13.118 2.006 1.060 1.00 0.00 O ATOM 2057 CB GLU A 136 -15.686 1.125 -0.862 1.00 0.00 C ATOM 2058 CG GLU A 136 -17.174 1.476 -0.928 1.00 0.00 C ATOM 2059 CD GLU A 136 -17.998 0.269 -1.352 1.00 0.00 C ATOM 2060 OE1 GLU A 136 -17.485 -0.689 -1.990 1.00 0.00 O ATOM 2061 OE2 GLU A 136 -19.244 0.377 -1.199 1.00 0.00 O ATOM 0 H GLU A 136 -15.118 2.455 -2.770 1.00 0.00 H new ATOM 0 HA GLU A 136 -15.112 3.026 0.006 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -15.422 0.563 -1.758 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -15.523 0.463 -0.011 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -17.512 1.828 0.046 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -17.328 2.293 -1.633 1.00 0.00 H new ATOM 2068 N PHE A 137 -12.443 1.663 -1.004 1.00 0.00 N ATOM 2069 CA PHE A 137 -11.113 1.254 -0.673 1.00 0.00 C ATOM 2070 C PHE A 137 -10.383 2.497 -0.295 1.00 0.00 C ATOM 2071 O PHE A 137 -9.601 2.538 0.653 1.00 0.00 O ATOM 2072 CB PHE A 137 -10.509 0.668 -1.960 1.00 0.00 C ATOM 2073 CG PHE A 137 -9.175 0.081 -1.650 1.00 0.00 C ATOM 2074 CD1 PHE A 137 -9.113 -1.198 -1.149 1.00 0.00 C ATOM 2075 CD2 PHE A 137 -7.999 0.723 -1.959 1.00 0.00 C ATOM 2076 CE1 PHE A 137 -7.911 -1.862 -1.200 1.00 0.00 C ATOM 2077 CE2 PHE A 137 -6.800 0.055 -2.045 1.00 0.00 C ATOM 2078 CZ PHE A 137 -6.796 -1.292 -1.768 1.00 0.00 C ATOM 0 H PHE A 137 -12.604 1.669 -2.011 1.00 0.00 H new ATOM 0 HA PHE A 137 -11.066 0.522 0.134 1.00 0.00 H new ATOM 0 HB2 PHE A 137 -11.169 -0.096 -2.371 1.00 0.00 H new ATOM 0 HB3 PHE A 137 -10.411 1.446 -2.717 1.00 0.00 H new ATOM 0 HD1 PHE A 137 -9.988 -1.669 -0.726 1.00 0.00 H new ATOM 0 HD2 PHE A 137 -8.018 1.788 -2.140 1.00 0.00 H new ATOM 0 HE1 PHE A 137 -7.840 -2.856 -0.784 1.00 0.00 H new ATOM 0 HE2 PHE A 137 -5.892 0.571 -2.321 1.00 0.00 H new ATOM 0 HZ PHE A 137 -5.928 -1.894 -1.994 1.00 0.00 H new ATOM 2088 N VAL A 138 -10.620 3.663 -0.921 1.00 0.00 N ATOM 2089 CA VAL A 138 -9.954 4.871 -0.542 1.00 0.00 C ATOM 2090 C VAL A 138 -10.515 5.510 0.682 1.00 0.00 C ATOM 2091 O VAL A 138 -9.782 6.086 1.484 1.00 0.00 O ATOM 2092 CB VAL A 138 -9.925 5.876 -1.655 1.00 0.00 C ATOM 2093 CG1 VAL A 138 -9.329 7.220 -1.202 1.00 0.00 C ATOM 2094 CG2 VAL A 138 -9.020 5.270 -2.740 1.00 0.00 C ATOM 0 H VAL A 138 -11.277 3.770 -1.694 1.00 0.00 H new ATOM 0 HA VAL A 138 -8.936 4.556 -0.312 1.00 0.00 H new ATOM 0 HB VAL A 138 -10.937 6.078 -2.005 1.00 0.00 H new ATOM 0 HG11 VAL A 138 -9.327 7.918 -2.039 1.00 0.00 H new ATOM 0 HG12 VAL A 138 -9.930 7.629 -0.390 1.00 0.00 H new ATOM 0 HG13 VAL A 138 -8.307 7.066 -0.856 1.00 0.00 H new ATOM 0 HG21 VAL A 138 -8.955 5.956 -3.585 1.00 0.00 H new ATOM 0 HG22 VAL A 138 -8.023 5.103 -2.331 1.00 0.00 H new ATOM 0 HG23 VAL A 138 -9.439 4.321 -3.074 1.00 0.00 H new ATOM 2104 N GLN A 139 -11.800 5.313 1.025 1.00 0.00 N ATOM 2105 CA GLN A 139 -12.452 5.814 2.195 1.00 0.00 C ATOM 2106 C GLN A 139 -12.104 5.007 3.398 1.00 0.00 C ATOM 2107 O GLN A 139 -11.944 5.576 4.477 1.00 0.00 O ATOM 2108 CB GLN A 139 -13.980 5.760 2.025 1.00 0.00 C ATOM 2109 CG GLN A 139 -14.751 6.253 3.250 1.00 0.00 C ATOM 2110 CD GLN A 139 -14.382 7.668 3.670 1.00 0.00 C ATOM 2111 OE1 GLN A 139 -14.535 8.565 2.843 1.00 0.00 O ATOM 2112 NE2 GLN A 139 -13.842 7.847 4.906 1.00 0.00 N ATOM 0 H GLN A 139 -12.429 4.763 0.440 1.00 0.00 H new ATOM 0 HA GLN A 139 -12.115 6.842 2.329 1.00 0.00 H new ATOM 0 HB2 GLN A 139 -14.262 6.363 1.162 1.00 0.00 H new ATOM 0 HB3 GLN A 139 -14.277 4.734 1.808 1.00 0.00 H new ATOM 0 HG2 GLN A 139 -15.819 6.212 3.038 1.00 0.00 H new ATOM 0 HG3 GLN A 139 -14.566 5.575 4.083 1.00 0.00 H new ATOM 0 HE21 GLN A 139 -13.746 7.054 5.540 1.00 0.00 H new ATOM 0 HE22 GLN A 139 -13.533 8.774 5.198 1.00 0.00 H new ATOM 2121 N MET A 140 -11.823 3.704 3.223 1.00 0.00 N ATOM 2122 CA MET A 140 -11.340 2.802 4.222 1.00 0.00 C ATOM 2123 C MET A 140 -10.013 3.086 4.838 1.00 0.00 C ATOM 2124 O MET A 140 -9.755 2.831 6.013 1.00 0.00 O ATOM 2125 CB MET A 140 -11.336 1.422 3.544 1.00 0.00 C ATOM 2126 CG MET A 140 -10.730 0.271 4.350 1.00 0.00 C ATOM 2127 SD MET A 140 -8.948 0.122 4.024 1.00 0.00 S ATOM 2128 CE MET A 140 -8.772 -0.524 2.336 1.00 0.00 C ATOM 0 H MET A 140 -11.942 3.249 2.318 1.00 0.00 H new ATOM 0 HA MET A 140 -12.000 2.893 5.085 1.00 0.00 H new ATOM 0 HB2 MET A 140 -12.364 1.161 3.295 1.00 0.00 H new ATOM 0 HB3 MET A 140 -10.791 1.505 2.603 1.00 0.00 H new ATOM 0 HG2 MET A 140 -10.897 0.439 5.414 1.00 0.00 H new ATOM 0 HG3 MET A 140 -11.231 -0.662 4.092 1.00 0.00 H new ATOM 0 HE1 MET A 140 -7.832 -1.069 2.251 1.00 0.00 H new ATOM 0 HE2 MET A 140 -9.602 -1.196 2.115 1.00 0.00 H new ATOM 0 HE3 MET A 140 -8.777 0.304 1.627 1.00 0.00 H new ATOM 2138 N MET A 141 -9.101 3.646 4.024 1.00 0.00 N ATOM 2139 CA MET A 141 -7.698 3.701 4.294 1.00 0.00 C ATOM 2140 C MET A 141 -7.274 4.607 5.398 1.00 0.00 C ATOM 2141 O MET A 141 -6.461 4.208 6.231 1.00 0.00 O ATOM 2142 CB MET A 141 -7.048 4.084 2.954 1.00 0.00 C ATOM 2143 CG MET A 141 -5.571 3.695 2.880 1.00 0.00 C ATOM 2144 SD MET A 141 -5.171 1.953 3.217 1.00 0.00 S ATOM 2145 CE MET A 141 -5.453 1.390 1.514 1.00 0.00 C ATOM 0 H MET A 141 -9.354 4.081 3.136 1.00 0.00 H new ATOM 0 HA MET A 141 -7.374 2.731 4.672 1.00 0.00 H new ATOM 0 HB2 MET A 141 -7.588 3.598 2.141 1.00 0.00 H new ATOM 0 HB3 MET A 141 -7.144 5.159 2.803 1.00 0.00 H new ATOM 0 HG2 MET A 141 -5.203 3.943 1.885 1.00 0.00 H new ATOM 0 HG3 MET A 141 -5.020 4.314 3.587 1.00 0.00 H new ATOM 0 HE1 MET A 141 -5.268 0.318 1.450 1.00 0.00 H new ATOM 0 HE2 MET A 141 -6.484 1.598 1.228 1.00 0.00 H new ATOM 0 HE3 MET A 141 -4.776 1.915 0.840 1.00 0.00 H new ATOM 2155 N THR A 142 -7.764 5.860 5.407 1.00 0.00 N ATOM 2156 CA THR A 142 -7.584 6.826 6.445 1.00 0.00 C ATOM 2157 C THR A 142 -8.572 6.710 7.597 1.00 0.00 C ATOM 2158 O THR A 142 -8.166 6.336 8.730 1.00 0.00 O ATOM 2159 CB THR A 142 -7.733 8.265 6.050 1.00 0.00 C ATOM 2160 OG1 THR A 142 -6.731 8.619 5.107 1.00 0.00 O ATOM 2161 CG2 THR A 142 -7.397 9.339 7.097 1.00 0.00 C ATOM 0 H THR A 142 -8.324 6.221 4.635 1.00 0.00 H new ATOM 0 HA THR A 142 -6.557 6.582 6.718 1.00 0.00 H new ATOM 0 HB THR A 142 -8.784 8.277 5.762 1.00 0.00 H new ATOM 0 HG1 THR A 142 -6.838 9.560 4.854 1.00 0.00 H new ATOM 0 HG21 THR A 142 -7.552 10.328 6.666 1.00 0.00 H new ATOM 0 HG22 THR A 142 -8.044 9.216 7.965 1.00 0.00 H new ATOM 0 HG23 THR A 142 -6.356 9.236 7.403 1.00 0.00 H new TER 2169 THR A 142 ATOM 2170 N ARG B 1 -9.271 -1.313 10.034 1.00 0.00 N ATOM 2171 CA ARG B 1 -8.545 -1.967 11.146 1.00 0.00 C ATOM 2172 C ARG B 1 -7.418 -2.737 10.549 1.00 0.00 C ATOM 2173 O ARG B 1 -6.876 -2.376 9.506 1.00 0.00 O ATOM 2174 CB ARG B 1 -9.596 -2.770 11.932 1.00 0.00 C ATOM 2175 CG ARG B 1 -10.793 -1.983 12.470 1.00 0.00 C ATOM 2176 CD ARG B 1 -11.775 -2.749 13.359 1.00 0.00 C ATOM 2177 NE ARG B 1 -12.843 -1.768 13.702 1.00 0.00 N ATOM 2178 CZ ARG B 1 -13.978 -1.597 12.964 1.00 0.00 C ATOM 2179 NH1 ARG B 1 -14.090 -2.186 11.738 1.00 0.00 N ATOM 2180 NH2 ARG B 1 -14.925 -0.676 13.308 1.00 0.00 N ATOM 0 H1 ARG B 1 -9.518 -0.340 10.306 1.00 0.00 H new ATOM 0 H2 ARG B 1 -8.666 -1.293 9.188 1.00 0.00 H new ATOM 0 H3 ARG B 1 -10.140 -1.846 9.826 1.00 0.00 H new ATOM 0 HA ARG B 1 -8.076 -1.296 11.866 1.00 0.00 H new ATOM 0 HB2 ARG B 1 -9.972 -3.564 11.287 1.00 0.00 H new ATOM 0 HB3 ARG B 1 -9.098 -3.252 12.773 1.00 0.00 H new ATOM 0 HG2 ARG B 1 -10.414 -1.132 13.036 1.00 0.00 H new ATOM 0 HG3 ARG B 1 -11.345 -1.581 11.621 1.00 0.00 H new ATOM 0 HD2 ARG B 1 -12.187 -3.612 12.837 1.00 0.00 H new ATOM 0 HD3 ARG B 1 -11.283 -3.124 14.256 1.00 0.00 H new ATOM 0 HE ARG B 1 -12.719 -1.192 14.535 1.00 0.00 H new ATOM 0 HH11 ARG B 1 -13.325 -2.754 11.373 1.00 0.00 H new ATOM 0 HH12 ARG B 1 -14.938 -2.058 11.186 1.00 0.00 H new ATOM 0 HH21 ARG B 1 -14.794 -0.094 14.135 1.00 0.00 H new ATOM 0 HH22 ARG B 1 -15.764 -0.570 12.738 1.00 0.00 H new ATOM 2193 N ARG B 2 -6.926 -3.816 11.184 1.00 0.00 N ATOM 2194 CA ARG B 2 -5.725 -4.546 10.920 1.00 0.00 C ATOM 2195 C ARG B 2 -5.678 -5.247 9.607 1.00 0.00 C ATOM 2196 O ARG B 2 -4.667 -5.232 8.906 1.00 0.00 O ATOM 2197 CB ARG B 2 -5.621 -5.626 12.010 1.00 0.00 C ATOM 2198 CG ARG B 2 -4.314 -6.408 12.156 1.00 0.00 C ATOM 2199 CD ARG B 2 -4.383 -7.452 13.273 1.00 0.00 C ATOM 2200 NE ARG B 2 -3.029 -7.779 13.802 1.00 0.00 N ATOM 2201 CZ ARG B 2 -2.687 -8.919 14.471 1.00 0.00 C ATOM 2202 NH1 ARG B 2 -3.521 -9.980 14.673 1.00 0.00 N ATOM 2203 NH2 ARG B 2 -1.419 -9.116 14.937 1.00 0.00 N ATOM 0 H ARG B 2 -7.431 -4.220 11.973 1.00 0.00 H new ATOM 0 HA ARG B 2 -4.913 -3.819 10.907 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -5.827 -5.148 12.968 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -6.419 -6.348 11.835 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -4.082 -6.903 11.213 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -3.499 -5.714 12.360 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -5.010 -7.079 14.083 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -4.856 -8.359 12.896 1.00 0.00 H new ATOM 0 HE ARG B 2 -2.292 -7.090 13.651 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -4.475 -9.955 14.313 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -3.190 -10.798 15.184 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -0.704 -8.404 14.788 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -1.186 -9.976 15.434 1.00 0.00 H new ATOM 2217 N LYS B 3 -6.720 -5.975 9.167 1.00 0.00 N ATOM 2218 CA LYS B 3 -6.751 -6.903 8.079 1.00 0.00 C ATOM 2219 C LYS B 3 -6.595 -6.137 6.811 1.00 0.00 C ATOM 2220 O LYS B 3 -5.993 -6.620 5.853 1.00 0.00 O ATOM 2221 CB LYS B 3 -8.037 -7.748 8.067 1.00 0.00 C ATOM 2222 CG LYS B 3 -8.317 -8.653 9.269 1.00 0.00 C ATOM 2223 CD LYS B 3 -9.252 -9.774 8.810 1.00 0.00 C ATOM 2224 CE LYS B 3 -10.671 -9.803 9.381 1.00 0.00 C ATOM 2225 NZ LYS B 3 -10.511 -10.034 10.834 1.00 0.00 N ATOM 0 H LYS B 3 -7.631 -5.905 9.621 1.00 0.00 H new ATOM 0 HA LYS B 3 -5.931 -7.612 8.193 1.00 0.00 H new ATOM 0 HB2 LYS B 3 -8.882 -7.068 7.958 1.00 0.00 H new ATOM 0 HB3 LYS B 3 -8.016 -8.375 7.176 1.00 0.00 H new ATOM 0 HG2 LYS B 3 -7.387 -9.068 9.658 1.00 0.00 H new ATOM 0 HG3 LYS B 3 -8.774 -8.082 10.077 1.00 0.00 H new ATOM 0 HD2 LYS B 3 -9.330 -9.721 7.724 1.00 0.00 H new ATOM 0 HD3 LYS B 3 -8.776 -10.725 9.049 1.00 0.00 H new ATOM 0 HE2 LYS B 3 -11.190 -8.864 9.188 1.00 0.00 H new ATOM 0 HE3 LYS B 3 -11.262 -10.595 8.921 1.00 0.00 H new ATOM 0 HZ1 LYS B 3 -11.448 -10.116 11.278 1.00 0.00 H new ATOM 0 HZ2 LYS B 3 -9.977 -10.913 10.989 1.00 0.00 H new ATOM 0 HZ3 LYS B 3 -9.996 -9.236 11.258 1.00 0.00 H new ATOM 2239 N TRP B 4 -7.175 -4.924 6.772 1.00 0.00 N ATOM 2240 CA TRP B 4 -7.126 -4.117 5.593 1.00 0.00 C ATOM 2241 C TRP B 4 -5.833 -3.386 5.468 1.00 0.00 C ATOM 2242 O TRP B 4 -5.273 -3.340 4.374 1.00 0.00 O ATOM 2243 CB TRP B 4 -8.396 -3.255 5.494 1.00 0.00 C ATOM 2244 CG TRP B 4 -9.648 -3.936 4.997 1.00 0.00 C ATOM 2245 CD1 TRP B 4 -10.877 -4.087 5.572 1.00 0.00 C ATOM 2246 CD2 TRP B 4 -9.820 -4.276 3.609 1.00 0.00 C ATOM 2247 NE1 TRP B 4 -11.690 -4.813 4.743 1.00 0.00 N ATOM 2248 CE2 TRP B 4 -11.060 -4.921 3.525 1.00 0.00 C ATOM 2249 CE3 TRP B 4 -8.977 -4.208 2.533 1.00 0.00 C ATOM 2250 CZ2 TRP B 4 -11.547 -5.316 2.310 1.00 0.00 C ATOM 2251 CZ3 TRP B 4 -9.475 -4.530 1.293 1.00 0.00 C ATOM 2252 CH2 TRP B 4 -10.753 -5.033 1.224 1.00 0.00 C ATOM 0 H TRP B 4 -7.676 -4.503 7.554 1.00 0.00 H new ATOM 0 HA TRP B 4 -7.136 -4.753 4.708 1.00 0.00 H new ATOM 0 HB2 TRP B 4 -8.604 -2.843 6.481 1.00 0.00 H new ATOM 0 HB3 TRP B 4 -8.184 -2.413 4.835 1.00 0.00 H new ATOM 0 HD1 TRP B 4 -11.165 -3.693 6.536 1.00 0.00 H new ATOM 0 HE1 TRP B 4 -12.600 -5.204 4.985 1.00 0.00 H new ATOM 0 HE3 TRP B 4 -7.946 -3.909 2.655 1.00 0.00 H new ATOM 0 HZ2 TRP B 4 -12.497 -5.819 2.210 1.00 0.00 H new ATOM 0 HZ3 TRP B 4 -8.881 -4.392 0.401 1.00 0.00 H new ATOM 0 HH2 TRP B 4 -11.164 -5.220 0.243 1.00 0.00 H new ATOM 2263 N GLN B 5 -5.380 -2.726 6.549 1.00 0.00 N ATOM 2264 CA GLN B 5 -4.060 -2.187 6.656 1.00 0.00 C ATOM 2265 C GLN B 5 -2.913 -3.056 6.268 1.00 0.00 C ATOM 2266 O GLN B 5 -2.071 -2.681 5.454 1.00 0.00 O ATOM 2267 CB GLN B 5 -3.701 -1.911 8.125 1.00 0.00 C ATOM 2268 CG GLN B 5 -4.358 -0.678 8.749 1.00 0.00 C ATOM 2269 CD GLN B 5 -4.182 -0.686 10.260 1.00 0.00 C ATOM 2270 OE1 GLN B 5 -3.881 -1.661 10.946 1.00 0.00 O ATOM 2271 NE2 GLN B 5 -4.673 0.463 10.798 1.00 0.00 N ATOM 0 H GLN B 5 -5.953 -2.562 7.377 1.00 0.00 H new ATOM 0 HA GLN B 5 -4.147 -1.336 5.980 1.00 0.00 H new ATOM 0 HB2 GLN B 5 -3.975 -2.784 8.717 1.00 0.00 H new ATOM 0 HB3 GLN B 5 -2.619 -1.801 8.201 1.00 0.00 H new ATOM 0 HG2 GLN B 5 -3.917 0.227 8.331 1.00 0.00 H new ATOM 0 HG3 GLN B 5 -5.419 -0.660 8.501 1.00 0.00 H new ATOM 0 HE21 GLN B 5 -4.910 1.249 10.193 1.00 0.00 H new ATOM 0 HE22 GLN B 5 -4.804 0.539 11.807 1.00 0.00 H new ATOM 2280 N LYS B 6 -2.672 -4.165 6.989 1.00 0.00 N ATOM 2281 CA LYS B 6 -1.597 -5.081 6.766 1.00 0.00 C ATOM 2282 C LYS B 6 -1.283 -5.546 5.385 1.00 0.00 C ATOM 2283 O LYS B 6 -0.185 -5.405 4.849 1.00 0.00 O ATOM 2284 CB LYS B 6 -2.018 -6.369 7.493 1.00 0.00 C ATOM 2285 CG LYS B 6 -1.156 -7.619 7.302 1.00 0.00 C ATOM 2286 CD LYS B 6 -1.689 -8.791 8.130 1.00 0.00 C ATOM 2287 CE LYS B 6 -0.645 -9.905 8.215 1.00 0.00 C ATOM 2288 NZ LYS B 6 -1.260 -11.053 8.919 1.00 0.00 N ATOM 0 H LYS B 6 -3.263 -4.438 7.774 1.00 0.00 H new ATOM 0 HA LYS B 6 -0.714 -4.530 7.089 1.00 0.00 H new ATOM 0 HB2 LYS B 6 -2.058 -6.152 8.560 1.00 0.00 H new ATOM 0 HB3 LYS B 6 -3.033 -6.613 7.179 1.00 0.00 H new ATOM 0 HG2 LYS B 6 -1.138 -7.894 6.247 1.00 0.00 H new ATOM 0 HG3 LYS B 6 -0.128 -7.403 7.593 1.00 0.00 H new ATOM 0 HD2 LYS B 6 -1.946 -8.449 9.132 1.00 0.00 H new ATOM 0 HD3 LYS B 6 -2.604 -9.176 7.680 1.00 0.00 H new ATOM 0 HE2 LYS B 6 -0.319 -10.199 7.217 1.00 0.00 H new ATOM 0 HE3 LYS B 6 0.239 -9.559 8.750 1.00 0.00 H new ATOM 0 HZ1 LYS B 6 -0.652 -11.890 8.814 1.00 0.00 H new ATOM 0 HZ2 LYS B 6 -1.365 -10.825 9.928 1.00 0.00 H new ATOM 0 HZ3 LYS B 6 -2.195 -11.251 8.510 1.00 0.00 H new ATOM 2302 N THR B 7 -2.446 -5.802 4.759 1.00 0.00 N ATOM 2303 CA THR B 7 -2.654 -6.298 3.434 1.00 0.00 C ATOM 2304 C THR B 7 -2.364 -5.155 2.523 1.00 0.00 C ATOM 2305 O THR B 7 -1.537 -5.244 1.617 1.00 0.00 O ATOM 2306 CB THR B 7 -3.988 -6.828 2.999 1.00 0.00 C ATOM 2307 OG1 THR B 7 -4.225 -7.784 4.021 1.00 0.00 O ATOM 2308 CG2 THR B 7 -4.058 -7.536 1.635 1.00 0.00 C ATOM 0 H THR B 7 -3.334 -5.643 5.235 1.00 0.00 H new ATOM 0 HA THR B 7 -2.016 -7.181 3.405 1.00 0.00 H new ATOM 0 HB THR B 7 -4.697 -6.010 2.870 1.00 0.00 H new ATOM 0 HG1 THR B 7 -4.841 -7.408 4.684 1.00 0.00 H new ATOM 0 HG21 THR B 7 -5.080 -7.867 1.449 1.00 0.00 H new ATOM 0 HG22 THR B 7 -3.752 -6.844 0.850 1.00 0.00 H new ATOM 0 HG23 THR B 7 -3.392 -8.399 1.638 1.00 0.00 H new ATOM 2316 N GLY B 8 -3.210 -4.110 2.573 1.00 0.00 N ATOM 2317 CA GLY B 8 -3.115 -2.946 1.748 1.00 0.00 C ATOM 2318 C GLY B 8 -1.778 -2.291 1.678 1.00 0.00 C ATOM 2319 O GLY B 8 -1.235 -1.901 0.645 1.00 0.00 O ATOM 0 H GLY B 8 -3.998 -4.076 3.220 1.00 0.00 H new ATOM 0 HA2 GLY B 8 -3.415 -3.219 0.736 1.00 0.00 H new ATOM 0 HA3 GLY B 8 -3.836 -2.212 2.108 1.00 0.00 H new ATOM 2323 N HIS B 9 -0.991 -2.380 2.764 1.00 0.00 N ATOM 2324 CA HIS B 9 0.393 -2.037 2.871 1.00 0.00 C ATOM 2325 C HIS B 9 1.262 -2.885 2.007 1.00 0.00 C ATOM 2326 O HIS B 9 2.000 -2.464 1.118 1.00 0.00 O ATOM 2327 CB HIS B 9 0.885 -1.965 4.326 1.00 0.00 C ATOM 2328 CG HIS B 9 0.568 -0.718 5.097 1.00 0.00 C ATOM 2329 ND1 HIS B 9 0.020 -0.748 6.363 1.00 0.00 N ATOM 2330 CD2 HIS B 9 0.718 0.606 4.825 1.00 0.00 C ATOM 2331 CE1 HIS B 9 -0.071 0.554 6.743 1.00 0.00 C ATOM 2332 NE2 HIS B 9 0.336 1.441 5.855 1.00 0.00 N ATOM 0 H HIS B 9 -1.360 -2.725 3.650 1.00 0.00 H new ATOM 0 HA HIS B 9 0.479 -1.022 2.483 1.00 0.00 H new ATOM 0 HB2 HIS B 9 0.464 -2.813 4.867 1.00 0.00 H new ATOM 0 HB3 HIS B 9 1.967 -2.094 4.323 1.00 0.00 H new ATOM 0 HD2 HIS B 9 1.103 0.972 3.885 1.00 0.00 H new ATOM 0 HE1 HIS B 9 -0.452 0.844 7.711 1.00 0.00 H new ATOM 0 HE2 HIS B 9 0.361 2.459 5.914 1.00 0.00 H new ATOM 2340 N ALA B 10 1.254 -4.220 2.176 1.00 0.00 N ATOM 2341 CA ALA B 10 2.023 -5.139 1.396 1.00 0.00 C ATOM 2342 C ALA B 10 1.790 -5.209 -0.074 1.00 0.00 C ATOM 2343 O ALA B 10 2.688 -5.247 -0.914 1.00 0.00 O ATOM 2344 CB ALA B 10 1.602 -6.531 1.896 1.00 0.00 C ATOM 0 H ALA B 10 0.686 -4.679 2.888 1.00 0.00 H new ATOM 0 HA ALA B 10 3.055 -4.809 1.520 1.00 0.00 H new ATOM 0 HB1 ALA B 10 2.149 -7.296 1.345 1.00 0.00 H new ATOM 0 HB2 ALA B 10 1.826 -6.619 2.959 1.00 0.00 H new ATOM 0 HB3 ALA B 10 0.532 -6.666 1.738 1.00 0.00 H new ATOM 2350 N VAL B 11 0.515 -5.161 -0.501 1.00 0.00 N ATOM 2351 CA VAL B 11 0.043 -5.103 -1.850 1.00 0.00 C ATOM 2352 C VAL B 11 0.435 -3.852 -2.558 1.00 0.00 C ATOM 2353 O VAL B 11 0.664 -3.973 -3.760 1.00 0.00 O ATOM 2354 CB VAL B 11 -1.397 -5.517 -1.904 1.00 0.00 C ATOM 2355 CG1 VAL B 11 -2.275 -4.356 -1.407 1.00 0.00 C ATOM 2356 CG2 VAL B 11 -1.850 -6.015 -3.287 1.00 0.00 C ATOM 0 H VAL B 11 -0.258 -5.163 0.165 1.00 0.00 H new ATOM 0 HA VAL B 11 0.562 -5.842 -2.460 1.00 0.00 H new ATOM 0 HB VAL B 11 -1.513 -6.378 -1.246 1.00 0.00 H new ATOM 0 HG11 VAL B 11 -3.324 -4.651 -1.444 1.00 0.00 H new ATOM 0 HG12 VAL B 11 -2.004 -4.108 -0.381 1.00 0.00 H new ATOM 0 HG13 VAL B 11 -2.121 -3.485 -2.044 1.00 0.00 H new ATOM 0 HG21 VAL B 11 -2.902 -6.296 -3.246 1.00 0.00 H new ATOM 0 HG22 VAL B 11 -1.715 -5.221 -4.022 1.00 0.00 H new ATOM 0 HG23 VAL B 11 -1.254 -6.881 -3.575 1.00 0.00 H new ATOM 2366 N ARG B 12 0.581 -2.679 -1.915 1.00 0.00 N ATOM 2367 CA ARG B 12 1.007 -1.430 -2.465 1.00 0.00 C ATOM 2368 C ARG B 12 2.419 -1.614 -2.902 1.00 0.00 C ATOM 2369 O ARG B 12 2.864 -1.256 -3.992 1.00 0.00 O ATOM 2370 CB ARG B 12 0.767 -0.364 -1.383 1.00 0.00 C ATOM 2371 CG ARG B 12 1.010 1.033 -1.958 1.00 0.00 C ATOM 2372 CD ARG B 12 0.683 2.199 -1.024 1.00 0.00 C ATOM 2373 NE ARG B 12 1.396 3.312 -1.711 1.00 0.00 N ATOM 2374 CZ ARG B 12 1.250 4.622 -1.357 1.00 0.00 C ATOM 2375 NH1 ARG B 12 0.486 5.111 -0.337 1.00 0.00 N ATOM 2376 NH2 ARG B 12 1.866 5.571 -2.120 1.00 0.00 N ATOM 0 H ARG B 12 0.382 -2.601 -0.918 1.00 0.00 H new ATOM 0 HA ARG B 12 0.460 -1.093 -3.346 1.00 0.00 H new ATOM 0 HB2 ARG B 12 -0.254 -0.439 -1.008 1.00 0.00 H new ATOM 0 HB3 ARG B 12 1.431 -0.538 -0.536 1.00 0.00 H new ATOM 0 HG2 ARG B 12 2.057 1.108 -2.251 1.00 0.00 H new ATOM 0 HG3 ARG B 12 0.416 1.141 -2.866 1.00 0.00 H new ATOM 0 HD2 ARG B 12 -0.389 2.379 -0.947 1.00 0.00 H new ATOM 0 HD3 ARG B 12 1.052 2.034 -0.012 1.00 0.00 H new ATOM 0 HE ARG B 12 2.023 3.084 -2.483 1.00 0.00 H new ATOM 0 HH11 ARG B 12 -0.050 4.472 0.250 1.00 0.00 H new ATOM 0 HH12 ARG B 12 0.451 6.115 -0.162 1.00 0.00 H new ATOM 0 HH21 ARG B 12 2.418 5.293 -2.931 1.00 0.00 H new ATOM 0 HH22 ARG B 12 1.774 6.558 -1.879 1.00 0.00 H new ATOM 2390 N ALA B 13 3.226 -2.226 -2.017 1.00 0.00 N ATOM 2391 CA ALA B 13 4.598 -2.551 -2.256 1.00 0.00 C ATOM 2392 C ALA B 13 4.822 -3.432 -3.437 1.00 0.00 C ATOM 2393 O ALA B 13 5.798 -3.302 -4.175 1.00 0.00 O ATOM 2394 CB ALA B 13 5.211 -3.135 -0.972 1.00 0.00 C ATOM 0 H ALA B 13 2.906 -2.508 -1.090 1.00 0.00 H new ATOM 0 HA ALA B 13 5.109 -1.625 -2.517 1.00 0.00 H new ATOM 0 HB1 ALA B 13 6.257 -3.384 -1.149 1.00 0.00 H new ATOM 0 HB2 ALA B 13 5.144 -2.400 -0.170 1.00 0.00 H new ATOM 0 HB3 ALA B 13 4.667 -4.035 -0.686 1.00 0.00 H new ATOM 2400 N ILE B 14 3.888 -4.345 -3.755 1.00 0.00 N ATOM 2401 CA ILE B 14 3.897 -5.292 -4.827 1.00 0.00 C ATOM 2402 C ILE B 14 3.559 -4.589 -6.096 1.00 0.00 C ATOM 2403 O ILE B 14 4.303 -4.688 -7.071 1.00 0.00 O ATOM 2404 CB ILE B 14 3.007 -6.487 -4.650 1.00 0.00 C ATOM 2405 CG1 ILE B 14 3.647 -7.187 -3.439 1.00 0.00 C ATOM 2406 CG2 ILE B 14 3.006 -7.442 -5.856 1.00 0.00 C ATOM 2407 CD1 ILE B 14 2.707 -8.110 -2.664 1.00 0.00 C ATOM 0 H ILE B 14 3.036 -4.426 -3.200 1.00 0.00 H new ATOM 0 HA ILE B 14 4.906 -5.704 -4.846 1.00 0.00 H new ATOM 0 HB ILE B 14 1.963 -6.198 -4.531 1.00 0.00 H new ATOM 0 HG12 ILE B 14 4.503 -7.768 -3.783 1.00 0.00 H new ATOM 0 HG13 ILE B 14 4.031 -6.427 -2.758 1.00 0.00 H new ATOM 0 HG21 ILE B 14 2.340 -8.281 -5.655 1.00 0.00 H new ATOM 0 HG22 ILE B 14 2.660 -6.909 -6.742 1.00 0.00 H new ATOM 0 HG23 ILE B 14 4.016 -7.813 -6.027 1.00 0.00 H new ATOM 0 HD11 ILE B 14 3.245 -8.559 -1.829 1.00 0.00 H new ATOM 0 HD12 ILE B 14 1.863 -7.534 -2.285 1.00 0.00 H new ATOM 0 HD13 ILE B 14 2.342 -8.896 -3.325 1.00 0.00 H new ATOM 2419 N GLY B 15 2.411 -3.890 -6.055 1.00 0.00 N ATOM 2420 CA GLY B 15 1.605 -3.404 -7.131 1.00 0.00 C ATOM 2421 C GLY B 15 2.187 -2.207 -7.802 1.00 0.00 C ATOM 2422 O GLY B 15 2.102 -2.033 -9.017 1.00 0.00 O ATOM 0 H GLY B 15 2.002 -3.637 -5.156 1.00 0.00 H new ATOM 0 HA2 GLY B 15 1.474 -4.198 -7.866 1.00 0.00 H new ATOM 0 HA3 GLY B 15 0.614 -3.155 -6.751 1.00 0.00 H new ATOM 2426 N ARG B 16 2.813 -1.343 -6.984 1.00 0.00 N ATOM 2427 CA ARG B 16 3.361 -0.106 -7.448 1.00 0.00 C ATOM 2428 C ARG B 16 4.407 -0.223 -8.503 1.00 0.00 C ATOM 2429 O ARG B 16 4.435 0.676 -9.342 1.00 0.00 O ATOM 2430 CB ARG B 16 4.034 0.720 -6.339 1.00 0.00 C ATOM 2431 CG ARG B 16 5.217 0.073 -5.615 1.00 0.00 C ATOM 2432 CD ARG B 16 5.836 0.961 -4.534 1.00 0.00 C ATOM 2433 NE ARG B 16 6.369 2.235 -5.093 1.00 0.00 N ATOM 2434 CZ ARG B 16 7.619 2.460 -5.594 1.00 0.00 C ATOM 2435 NH1 ARG B 16 8.664 1.582 -5.583 1.00 0.00 N ATOM 2436 NH2 ARG B 16 7.854 3.745 -5.990 1.00 0.00 N ATOM 0 H ARG B 16 2.941 -1.505 -5.985 1.00 0.00 H new ATOM 0 HA ARG B 16 2.467 0.374 -7.847 1.00 0.00 H new ATOM 0 HB2 ARG B 16 4.375 1.659 -6.775 1.00 0.00 H new ATOM 0 HB3 ARG B 16 3.277 0.970 -5.596 1.00 0.00 H new ATOM 0 HG2 ARG B 16 4.887 -0.861 -5.160 1.00 0.00 H new ATOM 0 HG3 ARG B 16 5.984 -0.182 -6.346 1.00 0.00 H new ATOM 0 HD2 ARG B 16 5.086 1.184 -3.775 1.00 0.00 H new ATOM 0 HD3 ARG B 16 6.641 0.419 -4.037 1.00 0.00 H new ATOM 0 HE ARG B 16 5.728 3.028 -5.102 1.00 0.00 H new ATOM 0 HH11 ARG B 16 8.548 0.656 -5.172 1.00 0.00 H new ATOM 0 HH12 ARG B 16 9.561 1.852 -5.986 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.121 4.449 -5.899 1.00 0.00 H new ATOM 0 HH22 ARG B 16 8.762 4.001 -6.377 1.00 0.00 H new ATOM 2450 N LEU B 17 5.245 -1.274 -8.530 1.00 0.00 N ATOM 2451 CA LEU B 17 6.167 -1.501 -9.600 1.00 0.00 C ATOM 2452 C LEU B 17 5.443 -2.113 -10.749 1.00 0.00 C ATOM 2453 O LEU B 17 5.105 -3.295 -10.695 1.00 0.00 O ATOM 2454 CB LEU B 17 7.337 -2.393 -9.151 1.00 0.00 C ATOM 2455 CG LEU B 17 8.243 -1.838 -8.038 1.00 0.00 C ATOM 2456 CD1 LEU B 17 9.306 -2.877 -7.641 1.00 0.00 C ATOM 2457 CD2 LEU B 17 9.019 -0.550 -8.362 1.00 0.00 C ATOM 0 H LEU B 17 5.283 -1.980 -7.795 1.00 0.00 H new ATOM 0 HA LEU B 17 6.592 -0.546 -9.908 1.00 0.00 H new ATOM 0 HB2 LEU B 17 6.928 -3.345 -8.813 1.00 0.00 H new ATOM 0 HB3 LEU B 17 7.958 -2.603 -10.022 1.00 0.00 H new ATOM 0 HG LEU B 17 7.532 -1.605 -7.246 1.00 0.00 H new ATOM 0 HD11 LEU B 17 9.938 -2.468 -6.853 1.00 0.00 H new ATOM 0 HD12 LEU B 17 8.815 -3.780 -7.280 1.00 0.00 H new ATOM 0 HD13 LEU B 17 9.919 -3.120 -8.509 1.00 0.00 H new ATOM 0 HD21 LEU B 17 9.620 -0.261 -7.500 1.00 0.00 H new ATOM 0 HD22 LEU B 17 9.672 -0.724 -9.217 1.00 0.00 H new ATOM 0 HD23 LEU B 17 8.316 0.249 -8.599 1.00 0.00 H new ATOM 2469 N SER B 18 5.157 -1.315 -11.793 1.00 0.00 N ATOM 2470 CA SER B 18 4.271 -1.542 -12.892 1.00 0.00 C ATOM 2471 C SER B 18 4.972 -1.074 -14.121 1.00 0.00 C ATOM 2472 O SER B 18 5.283 -1.888 -14.989 1.00 0.00 O ATOM 2473 CB SER B 18 2.861 -0.947 -12.749 1.00 0.00 C ATOM 2474 OG SER B 18 1.974 -1.532 -13.692 1.00 0.00 O ATOM 0 H SER B 18 5.603 -0.401 -11.872 1.00 0.00 H new ATOM 0 HA SER B 18 4.057 -2.610 -12.938 1.00 0.00 H new ATOM 0 HB2 SER B 18 2.490 -1.117 -11.738 1.00 0.00 H new ATOM 0 HB3 SER B 18 2.899 0.132 -12.898 1.00 0.00 H new ATOM 0 HG SER B 18 1.069 -1.557 -13.318 1.00 0.00 H new ATOM 2480 N SER B 19 5.205 0.246 -14.235 1.00 0.00 N ATOM 2481 CA SER B 19 6.026 0.786 -15.274 1.00 0.00 C ATOM 2482 C SER B 19 7.542 0.763 -15.146 1.00 0.00 C ATOM 2483 O SER B 19 8.263 1.134 -16.110 1.00 0.00 O ATOM 2484 CB SER B 19 5.573 2.222 -15.589 1.00 0.00 C ATOM 2485 OG SER B 19 5.717 3.081 -14.467 1.00 0.00 O ATOM 2486 OXT SER B 19 8.072 0.390 -14.065 1.00 0.00 O ATOM 0 H SER B 19 4.820 0.946 -13.600 1.00 0.00 H new ATOM 0 HA SER B 19 5.857 0.069 -16.077 1.00 0.00 H new ATOM 0 HB2 SER B 19 6.157 2.612 -16.422 1.00 0.00 H new ATOM 0 HB3 SER B 19 4.531 2.212 -15.907 1.00 0.00 H new ATOM 0 HG SER B 19 5.421 3.984 -14.706 1.00 0.00 H new TER 2492 SER B 19 HETATM 2493 CA CA A 151 13.220 -14.166 5.305 1.00 0.00 CA HETATM 2494 CA CA A 152 19.598 -4.714 4.112 1.00 0.00 CA HETATM 2495 CA CA A 153 -13.715 -8.096 -9.825 1.00 0.00 CA HETATM 2496 CA CA A 154 -19.652 -1.656 -2.576 1.00 0.00 CA