USER MOD reduce.3.24.130724 H: found=0, std=0, add=1097, rem=0, adj=26 USER MOD reduce.3.24.130724 removed 1093 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD NoAdj : A 60 ASNHD21 : A 60 ASN OD1 : A 152 CACA :(metal ligand) USER MOD NoAdj : A 60 ASNHD22 : A 60 ASN OD1 : A 152 CACA :(metal ligand) USER MOD NoAdj : A 97 ASNHD21 : A 97 ASN OD1 : A 153 CACA :(metal ligand) USER MOD NoAdj : A 97 ASNHD22 : A 97 ASN OD1 : A 153 CACA :(metal ligand) USER MOD Set 1.1: A 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Set 1.2: A 124 MET CE :methyl -164:sc= 0 (180deg=-0.0138) USER MOD Set 2.1: A 94 LYS NZ :NH3+ -163:sc= 1.28 (180deg=0) USER MOD Set 2.2: A 107 HIS : no HE2:sc= 0.751 K(o=2,f=-9.1!) USER MOD Set 3.1: A 36 MET CE :methyl 170:sc= -0.163 (180deg=-0.383) USER MOD Set 3.2: A 51 MET CE :methyl 178:sc= 0 (180deg=-0.00453) USER MOD Set 3.3: A 71 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 ALA N :NH3+ -104:sc= 0.101 (180deg=0) USER MOD Single : A 3 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 5 THR OG1 : rot 180:sc= -0.218 USER MOD Single : A 8 GLN : amide:sc= -0.565 K(o=-0.56,f=-5.3!) USER MOD Single : A 13 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 17 SER OG : rot 180:sc= 0 USER MOD Single : A 21 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 28 THR OG1 : rot 180:sc= -0.0193 USER MOD Single : A 29 THR OG1 : rot 180:sc= 0.0107 USER MOD Single : A 30 LYS NZ :NH3+ 173:sc= -0.0301 (180deg=-0.107) USER MOD Single : A 34 THR OG1 : rot 180:sc= 0.0628 USER MOD Single : A 38 SER OG : rot 61:sc= 0.486 USER MOD Single : A 41 GLN : amide:sc= -0.0972 X(o=-0.097,f=-0.097) USER MOD Single : A 42 ASN : amide:sc=-0.00727 X(o=-0.0073,f=-0.025) USER MOD Single : A 44 THR OG1 : rot -52:sc= 0.401 USER MOD Single : A 49 GLN : amide:sc= -0.0105 X(o=-0.01,f=0) USER MOD Single : A 53 ASN : amide:sc= -0.18 K(o=-0.18,f=-2.8!) USER MOD Single : A 62 THR OG1 : rot 180:sc= 0 USER MOD Single : A 70 THR OG1 : rot 60:sc= 0.294 USER MOD Single : A 72 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 75 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 76 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 79 THR OG1 : rot -30:sc= 0.111 USER MOD Single : A 81 SER OG : rot 180:sc= 0.13 USER MOD Single : A 99 TYR OH : rot 180:sc= 0 USER MOD Single : A 101 SER OG : rot 180:sc= 0 USER MOD Single : A 110 THR OG1 : rot 180:sc= 0 USER MOD Single : A 111 ASN : amide:sc= 0 X(o=0,f=-0.4) USER MOD Single : A 115 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 117 THR OG1 : rot -69:sc= 1.08 USER MOD Single : A 135 GLN : amide:sc=-0.000941 X(o=-0.00094,f=-0.23) USER MOD Single : A 137 ASN : amide:sc= -0.0353 K(o=-0.035,f=-3.8!) USER MOD Single : A 138 TYR OH : rot 136:sc= 0 USER MOD Single : A 143 GLN : amide:sc= -0.293 X(o=-0.29,f=-0.044) USER MOD Single : A 144 MET CE :methyl -122:sc= 0 (180deg=-0.202) USER MOD Single : A 145 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 146 THR OG1 : rot 80:sc= 0.17 USER MOD Single : A 148 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 -8.106 15.853 13.376 1.00 0.00 N ATOM 2 CA ALA A 1 -7.752 15.362 12.026 1.00 0.00 C ATOM 3 C ALA A 1 -8.620 15.995 10.993 1.00 0.00 C ATOM 4 O ALA A 1 -9.680 16.534 11.306 1.00 0.00 O ATOM 5 CB ALA A 1 -7.816 13.828 11.937 1.00 0.00 C ATOM 0 H1 ALA A 1 -7.393 16.540 13.694 1.00 0.00 H new ATOM 0 H2 ALA A 1 -9.039 16.312 13.345 1.00 0.00 H new ATOM 0 H3 ALA A 1 -8.136 15.053 14.040 1.00 0.00 H new ATOM 0 HA ALA A 1 -6.719 15.650 11.833 1.00 0.00 H new ATOM 0 HB1 ALA A 1 -7.549 13.511 10.929 1.00 0.00 H new ATOM 0 HB2 ALA A 1 -7.118 13.393 12.652 1.00 0.00 H new ATOM 0 HB3 ALA A 1 -8.827 13.492 12.167 1.00 0.00 H new ATOM 10 N ASP A 2 -8.265 16.059 9.698 1.00 0.00 N ATOM 11 CA ASP A 2 -9.036 16.693 8.674 1.00 0.00 C ATOM 12 C ASP A 2 -10.037 15.750 8.100 1.00 0.00 C ATOM 13 O ASP A 2 -10.097 14.559 8.402 1.00 0.00 O ATOM 14 CB ASP A 2 -8.145 17.105 7.490 1.00 0.00 C ATOM 15 CG ASP A 2 -7.215 18.250 7.864 1.00 0.00 C ATOM 16 OD1 ASP A 2 -7.752 19.390 7.865 1.00 0.00 O ATOM 17 OD2 ASP A 2 -5.988 18.067 8.087 1.00 0.00 O ATOM 0 H ASP A 2 -7.399 15.649 9.348 1.00 0.00 H new ATOM 0 HA ASP A 2 -9.512 17.555 9.142 1.00 0.00 H new ATOM 0 HB2 ASP A 2 -7.556 16.249 7.161 1.00 0.00 H new ATOM 0 HB3 ASP A 2 -8.771 17.403 6.649 1.00 0.00 H new ATOM 22 N GLN A 3 -10.989 16.413 7.420 1.00 0.00 N ATOM 23 CA GLN A 3 -12.212 15.798 7.007 1.00 0.00 C ATOM 24 C GLN A 3 -12.360 15.993 5.537 1.00 0.00 C ATOM 25 O GLN A 3 -11.653 16.807 4.946 1.00 0.00 O ATOM 26 CB GLN A 3 -13.487 16.258 7.733 1.00 0.00 C ATOM 27 CG GLN A 3 -13.624 15.891 9.212 1.00 0.00 C ATOM 28 CD GLN A 3 -14.980 16.276 9.787 1.00 0.00 C ATOM 29 OE1 GLN A 3 -15.162 17.469 10.025 1.00 0.00 O ATOM 30 NE2 GLN A 3 -15.833 15.274 10.130 1.00 0.00 N ATOM 0 H GLN A 3 -10.908 17.394 7.152 1.00 0.00 H new ATOM 0 HA GLN A 3 -12.123 14.747 7.282 1.00 0.00 H new ATOM 0 HB2 GLN A 3 -13.551 17.343 7.647 1.00 0.00 H new ATOM 0 HB3 GLN A 3 -14.345 15.845 7.202 1.00 0.00 H new ATOM 0 HG2 GLN A 3 -13.474 14.818 9.332 1.00 0.00 H new ATOM 0 HG3 GLN A 3 -12.838 16.388 9.780 1.00 0.00 H new ATOM 0 HE21 GLN A 3 -15.606 14.308 9.894 1.00 0.00 H new ATOM 0 HE22 GLN A 3 -16.700 15.489 10.623 1.00 0.00 H new ATOM 39 N LEU A 4 -13.221 15.218 4.853 1.00 0.00 N ATOM 40 CA LEU A 4 -13.297 15.514 3.457 1.00 0.00 C ATOM 41 C LEU A 4 -13.990 16.756 3.012 1.00 0.00 C ATOM 42 O LEU A 4 -14.715 17.397 3.772 1.00 0.00 O ATOM 43 CB LEU A 4 -14.024 14.385 2.707 1.00 0.00 C ATOM 44 CG LEU A 4 -13.373 12.992 2.745 1.00 0.00 C ATOM 45 CD1 LEU A 4 -14.360 11.892 2.321 1.00 0.00 C ATOM 46 CD2 LEU A 4 -12.266 12.889 1.682 1.00 0.00 C ATOM 0 H LEU A 4 -13.807 14.465 5.214 1.00 0.00 H new ATOM 0 HA LEU A 4 -12.239 15.643 3.229 1.00 0.00 H new ATOM 0 HB2 LEU A 4 -15.031 14.300 3.116 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -14.127 14.683 1.664 1.00 0.00 H new ATOM 0 HG LEU A 4 -13.017 12.865 3.767 1.00 0.00 H new ATOM 0 HD11 LEU A 4 -13.863 10.923 2.361 1.00 0.00 H new ATOM 0 HD12 LEU A 4 -15.215 11.890 2.997 1.00 0.00 H new ATOM 0 HD13 LEU A 4 -14.703 12.083 1.304 1.00 0.00 H new ATOM 0 HD21 LEU A 4 -11.815 11.898 1.721 1.00 0.00 H new ATOM 0 HD22 LEU A 4 -12.694 13.054 0.693 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -11.503 13.643 1.877 1.00 0.00 H new ATOM 58 N THR A 5 -13.847 17.189 1.747 1.00 0.00 N ATOM 59 CA THR A 5 -14.600 18.230 1.120 1.00 0.00 C ATOM 60 C THR A 5 -15.901 17.703 0.621 1.00 0.00 C ATOM 61 O THR A 5 -16.057 16.512 0.356 1.00 0.00 O ATOM 62 CB THR A 5 -13.866 18.967 0.040 1.00 0.00 C ATOM 63 OG1 THR A 5 -13.655 18.209 -1.143 1.00 0.00 O ATOM 64 CG2 THR A 5 -12.501 19.383 0.613 1.00 0.00 C ATOM 0 H THR A 5 -13.155 16.781 1.118 1.00 0.00 H new ATOM 0 HA THR A 5 -14.780 18.973 1.897 1.00 0.00 H new ATOM 0 HB THR A 5 -14.482 19.817 -0.253 1.00 0.00 H new ATOM 0 HG1 THR A 5 -13.174 18.755 -1.800 1.00 0.00 H new ATOM 0 HG21 THR A 5 -11.937 19.924 -0.147 1.00 0.00 H new ATOM 0 HG22 THR A 5 -12.651 20.027 1.480 1.00 0.00 H new ATOM 0 HG23 THR A 5 -11.946 18.494 0.913 1.00 0.00 H new ATOM 72 N GLU A 6 -16.914 18.555 0.380 1.00 0.00 N ATOM 73 CA GLU A 6 -18.194 18.082 -0.046 1.00 0.00 C ATOM 74 C GLU A 6 -18.185 17.645 -1.471 1.00 0.00 C ATOM 75 O GLU A 6 -18.929 16.737 -1.838 1.00 0.00 O ATOM 76 CB GLU A 6 -19.176 19.261 0.063 1.00 0.00 C ATOM 77 CG GLU A 6 -19.331 19.825 1.476 1.00 0.00 C ATOM 78 CD GLU A 6 -20.027 21.175 1.591 1.00 0.00 C ATOM 79 OE1 GLU A 6 -19.765 22.064 0.738 1.00 0.00 O ATOM 80 OE2 GLU A 6 -20.992 21.234 2.399 1.00 0.00 O ATOM 0 H GLU A 6 -16.847 19.568 0.480 1.00 0.00 H new ATOM 0 HA GLU A 6 -18.472 17.231 0.575 1.00 0.00 H new ATOM 0 HB2 GLU A 6 -18.841 20.059 -0.599 1.00 0.00 H new ATOM 0 HB3 GLU A 6 -20.153 18.938 -0.296 1.00 0.00 H new ATOM 0 HG2 GLU A 6 -19.886 19.102 2.074 1.00 0.00 H new ATOM 0 HG3 GLU A 6 -18.339 19.912 1.920 1.00 0.00 H new ATOM 87 N GLU A 7 -17.234 18.134 -2.286 1.00 0.00 N ATOM 88 CA GLU A 7 -17.083 17.706 -3.642 1.00 0.00 C ATOM 89 C GLU A 7 -16.398 16.385 -3.696 1.00 0.00 C ATOM 90 O GLU A 7 -16.815 15.484 -4.423 1.00 0.00 O ATOM 91 CB GLU A 7 -16.214 18.650 -4.489 1.00 0.00 C ATOM 92 CG GLU A 7 -15.824 18.293 -5.925 1.00 0.00 C ATOM 93 CD GLU A 7 -14.646 19.033 -6.544 1.00 0.00 C ATOM 94 OE1 GLU A 7 -13.874 19.670 -5.779 1.00 0.00 O ATOM 95 OE2 GLU A 7 -14.477 19.008 -7.792 1.00 0.00 O ATOM 0 H GLU A 7 -16.557 18.840 -1.998 1.00 0.00 H new ATOM 0 HA GLU A 7 -18.097 17.677 -4.040 1.00 0.00 H new ATOM 0 HB2 GLU A 7 -16.731 19.609 -4.529 1.00 0.00 H new ATOM 0 HB3 GLU A 7 -15.287 18.810 -3.938 1.00 0.00 H new ATOM 0 HG2 GLU A 7 -15.604 17.226 -5.957 1.00 0.00 H new ATOM 0 HG3 GLU A 7 -16.695 18.458 -6.560 1.00 0.00 H new ATOM 102 N GLN A 8 -15.433 15.996 -2.844 1.00 0.00 N ATOM 103 CA GLN A 8 -15.010 14.632 -2.759 1.00 0.00 C ATOM 104 C GLN A 8 -16.004 13.677 -2.194 1.00 0.00 C ATOM 105 O GLN A 8 -16.090 12.485 -2.484 1.00 0.00 O ATOM 106 CB GLN A 8 -13.793 14.561 -1.822 1.00 0.00 C ATOM 107 CG GLN A 8 -12.522 15.233 -2.344 1.00 0.00 C ATOM 108 CD GLN A 8 -11.205 14.761 -1.743 1.00 0.00 C ATOM 109 OE1 GLN A 8 -11.124 13.944 -0.828 1.00 0.00 O ATOM 110 NE2 GLN A 8 -10.085 15.024 -2.468 1.00 0.00 N ATOM 0 H GLN A 8 -14.944 16.629 -2.211 1.00 0.00 H new ATOM 0 HA GLN A 8 -14.820 14.336 -3.791 1.00 0.00 H new ATOM 0 HB2 GLN A 8 -14.061 15.020 -0.870 1.00 0.00 H new ATOM 0 HB3 GLN A 8 -13.572 13.513 -1.620 1.00 0.00 H new ATOM 0 HG2 GLN A 8 -12.477 15.085 -3.423 1.00 0.00 H new ATOM 0 HG3 GLN A 8 -12.609 16.306 -2.173 1.00 0.00 H new ATOM 0 HE21 GLN A 8 -10.120 15.697 -3.234 1.00 0.00 H new ATOM 0 HE22 GLN A 8 -9.210 14.548 -2.246 1.00 0.00 H new ATOM 119 N ILE A 9 -16.906 14.111 -1.295 1.00 0.00 N ATOM 120 CA ILE A 9 -17.988 13.323 -0.791 1.00 0.00 C ATOM 121 C ILE A 9 -18.949 13.042 -1.895 1.00 0.00 C ATOM 122 O ILE A 9 -19.356 11.899 -2.094 1.00 0.00 O ATOM 123 CB ILE A 9 -18.607 13.960 0.418 1.00 0.00 C ATOM 124 CG1 ILE A 9 -17.628 13.762 1.587 1.00 0.00 C ATOM 125 CG2 ILE A 9 -20.016 13.367 0.581 1.00 0.00 C ATOM 126 CD1 ILE A 9 -18.171 13.917 3.007 1.00 0.00 C ATOM 0 H ILE A 9 -16.880 15.052 -0.902 1.00 0.00 H new ATOM 0 HA ILE A 9 -17.620 12.359 -0.439 1.00 0.00 H new ATOM 0 HB ILE A 9 -18.759 15.037 0.349 1.00 0.00 H new ATOM 0 HG12 ILE A 9 -17.200 12.763 1.500 1.00 0.00 H new ATOM 0 HG13 ILE A 9 -16.810 14.471 1.462 1.00 0.00 H new ATOM 0 HG21 ILE A 9 -20.498 13.809 1.453 1.00 0.00 H new ATOM 0 HG22 ILE A 9 -20.607 13.584 -0.309 1.00 0.00 H new ATOM 0 HG23 ILE A 9 -19.943 12.288 0.714 1.00 0.00 H new ATOM 0 HD11 ILE A 9 -17.367 13.749 3.724 1.00 0.00 H new ATOM 0 HD12 ILE A 9 -18.569 14.924 3.137 1.00 0.00 H new ATOM 0 HD13 ILE A 9 -18.965 13.189 3.175 1.00 0.00 H new ATOM 138 N ALA A 10 -19.360 14.093 -2.627 1.00 0.00 N ATOM 139 CA ALA A 10 -20.282 13.985 -3.715 1.00 0.00 C ATOM 140 C ALA A 10 -19.732 13.095 -4.776 1.00 0.00 C ATOM 141 O ALA A 10 -20.413 12.190 -5.257 1.00 0.00 O ATOM 142 CB ALA A 10 -20.673 15.399 -4.175 1.00 0.00 C ATOM 0 H ALA A 10 -19.041 15.047 -2.457 1.00 0.00 H new ATOM 0 HA ALA A 10 -21.209 13.499 -3.409 1.00 0.00 H new ATOM 0 HB1 ALA A 10 -21.376 15.330 -5.005 1.00 0.00 H new ATOM 0 HB2 ALA A 10 -21.139 15.935 -3.348 1.00 0.00 H new ATOM 0 HB3 ALA A 10 -19.781 15.936 -4.499 1.00 0.00 H new ATOM 148 N GLU A 11 -18.416 13.140 -5.051 1.00 0.00 N ATOM 149 CA GLU A 11 -17.679 12.202 -5.840 1.00 0.00 C ATOM 150 C GLU A 11 -17.623 10.809 -5.316 1.00 0.00 C ATOM 151 O GLU A 11 -17.944 9.868 -6.040 1.00 0.00 O ATOM 152 CB GLU A 11 -16.278 12.698 -6.236 1.00 0.00 C ATOM 153 CG GLU A 11 -15.553 11.789 -7.231 1.00 0.00 C ATOM 154 CD GLU A 11 -14.178 12.295 -7.644 1.00 0.00 C ATOM 155 OE1 GLU A 11 -13.268 12.532 -6.806 1.00 0.00 O ATOM 156 OE2 GLU A 11 -13.965 12.490 -8.871 1.00 0.00 O ATOM 0 H GLU A 11 -17.824 13.890 -4.694 1.00 0.00 H new ATOM 0 HA GLU A 11 -18.285 12.142 -6.744 1.00 0.00 H new ATOM 0 HB2 GLU A 11 -16.366 13.695 -6.668 1.00 0.00 H new ATOM 0 HB3 GLU A 11 -15.670 12.793 -5.336 1.00 0.00 H new ATOM 0 HG2 GLU A 11 -15.447 10.798 -6.791 1.00 0.00 H new ATOM 0 HG3 GLU A 11 -16.171 11.678 -8.122 1.00 0.00 H new ATOM 163 N PHE A 12 -17.285 10.533 -4.043 1.00 0.00 N ATOM 164 CA PHE A 12 -17.560 9.221 -3.544 1.00 0.00 C ATOM 165 C PHE A 12 -18.963 8.720 -3.547 1.00 0.00 C ATOM 166 O PHE A 12 -19.203 7.517 -3.471 1.00 0.00 O ATOM 167 CB PHE A 12 -17.036 9.231 -2.098 1.00 0.00 C ATOM 168 CG PHE A 12 -15.562 9.449 -2.090 1.00 0.00 C ATOM 169 CD1 PHE A 12 -14.707 9.029 -3.081 1.00 0.00 C ATOM 170 CD2 PHE A 12 -15.023 10.167 -1.049 1.00 0.00 C ATOM 171 CE1 PHE A 12 -13.344 9.195 -3.016 1.00 0.00 C ATOM 172 CE2 PHE A 12 -13.662 10.364 -1.016 1.00 0.00 C ATOM 173 CZ PHE A 12 -12.787 9.788 -1.907 1.00 0.00 C ATOM 0 H PHE A 12 -16.844 11.180 -3.389 1.00 0.00 H new ATOM 0 HA PHE A 12 -17.079 8.530 -4.237 1.00 0.00 H new ATOM 0 HB2 PHE A 12 -17.531 10.018 -1.529 1.00 0.00 H new ATOM 0 HB3 PHE A 12 -17.275 8.286 -1.610 1.00 0.00 H new ATOM 0 HD1 PHE A 12 -15.126 8.546 -3.951 1.00 0.00 H new ATOM 0 HD2 PHE A 12 -15.656 10.569 -0.272 1.00 0.00 H new ATOM 0 HE1 PHE A 12 -12.716 8.863 -3.829 1.00 0.00 H new ATOM 0 HE2 PHE A 12 -13.258 11.007 -0.248 1.00 0.00 H new ATOM 0 HZ PHE A 12 -11.719 9.801 -1.745 1.00 0.00 H new ATOM 183 N LYS A 13 -19.935 9.648 -3.603 1.00 0.00 N ATOM 184 CA LYS A 13 -21.313 9.267 -3.572 1.00 0.00 C ATOM 185 C LYS A 13 -21.852 8.737 -4.856 1.00 0.00 C ATOM 186 O LYS A 13 -22.572 7.744 -4.948 1.00 0.00 O ATOM 187 CB LYS A 13 -22.142 10.471 -3.095 1.00 0.00 C ATOM 188 CG LYS A 13 -23.581 10.114 -2.717 1.00 0.00 C ATOM 189 CD LYS A 13 -24.449 11.211 -2.097 1.00 0.00 C ATOM 190 CE LYS A 13 -24.622 12.478 -2.937 1.00 0.00 C ATOM 191 NZ LYS A 13 -25.397 12.274 -4.181 1.00 0.00 N ATOM 0 H LYS A 13 -19.770 10.652 -3.669 1.00 0.00 H new ATOM 0 HA LYS A 13 -21.389 8.429 -2.879 1.00 0.00 H new ATOM 0 HB2 LYS A 13 -21.650 10.921 -2.233 1.00 0.00 H new ATOM 0 HB3 LYS A 13 -22.159 11.225 -3.882 1.00 0.00 H new ATOM 0 HG2 LYS A 13 -24.084 9.756 -3.615 1.00 0.00 H new ATOM 0 HG3 LYS A 13 -23.546 9.279 -2.017 1.00 0.00 H new ATOM 0 HD2 LYS A 13 -25.436 10.795 -1.893 1.00 0.00 H new ATOM 0 HD3 LYS A 13 -24.016 11.491 -1.136 1.00 0.00 H new ATOM 0 HE2 LYS A 13 -25.118 13.237 -2.333 1.00 0.00 H new ATOM 0 HE3 LYS A 13 -23.637 12.868 -3.194 1.00 0.00 H new ATOM 0 HZ1 LYS A 13 -25.472 13.175 -4.695 1.00 0.00 H new ATOM 0 HZ2 LYS A 13 -24.915 11.573 -4.779 1.00 0.00 H new ATOM 0 HZ3 LYS A 13 -26.350 11.931 -3.944 1.00 0.00 H new ATOM 205 N GLU A 14 -21.477 9.466 -5.921 1.00 0.00 N ATOM 206 CA GLU A 14 -21.538 9.032 -7.282 1.00 0.00 C ATOM 207 C GLU A 14 -20.967 7.665 -7.444 1.00 0.00 C ATOM 208 O GLU A 14 -21.726 6.822 -7.921 1.00 0.00 O ATOM 209 CB GLU A 14 -20.855 10.057 -8.203 1.00 0.00 C ATOM 210 CG GLU A 14 -21.573 11.409 -8.212 1.00 0.00 C ATOM 211 CD GLU A 14 -22.845 11.343 -9.045 1.00 0.00 C ATOM 212 OE1 GLU A 14 -22.783 11.013 -10.259 1.00 0.00 O ATOM 213 OE2 GLU A 14 -23.937 11.563 -8.457 1.00 0.00 O ATOM 0 H GLU A 14 -21.110 10.413 -5.827 1.00 0.00 H new ATOM 0 HA GLU A 14 -22.586 8.969 -7.576 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -19.824 10.199 -7.880 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -20.820 9.661 -9.218 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -21.817 11.702 -7.191 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -20.910 12.175 -8.614 1.00 0.00 H new ATOM 220 N ALA A 15 -19.678 7.512 -7.091 1.00 0.00 N ATOM 221 CA ALA A 15 -19.018 6.256 -7.265 1.00 0.00 C ATOM 222 C ALA A 15 -19.430 5.142 -6.366 1.00 0.00 C ATOM 223 O ALA A 15 -19.329 3.962 -6.696 1.00 0.00 O ATOM 224 CB ALA A 15 -17.504 6.481 -7.106 1.00 0.00 C ATOM 0 H ALA A 15 -19.098 8.249 -6.690 1.00 0.00 H new ATOM 0 HA ALA A 15 -19.313 5.923 -8.260 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -16.980 5.534 -7.235 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -17.161 7.191 -7.858 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -17.297 6.877 -6.112 1.00 0.00 H new ATOM 230 N PHE A 16 -20.055 5.400 -5.203 1.00 0.00 N ATOM 231 CA PHE A 16 -20.812 4.470 -4.425 1.00 0.00 C ATOM 232 C PHE A 16 -21.887 3.712 -5.125 1.00 0.00 C ATOM 233 O PHE A 16 -21.976 2.491 -5.014 1.00 0.00 O ATOM 234 CB PHE A 16 -21.240 5.091 -3.084 1.00 0.00 C ATOM 235 CG PHE A 16 -21.815 4.226 -2.016 1.00 0.00 C ATOM 236 CD1 PHE A 16 -23.019 3.578 -2.164 1.00 0.00 C ATOM 237 CD2 PHE A 16 -21.044 4.105 -0.884 1.00 0.00 C ATOM 238 CE1 PHE A 16 -23.454 2.812 -1.108 1.00 0.00 C ATOM 239 CE2 PHE A 16 -21.463 3.329 0.171 1.00 0.00 C ATOM 240 CZ PHE A 16 -22.643 2.647 -0.010 1.00 0.00 C ATOM 0 H PHE A 16 -20.028 6.326 -4.777 1.00 0.00 H new ATOM 0 HA PHE A 16 -20.114 3.660 -4.213 1.00 0.00 H new ATOM 0 HB2 PHE A 16 -20.367 5.589 -2.663 1.00 0.00 H new ATOM 0 HB3 PHE A 16 -21.974 5.866 -3.304 1.00 0.00 H new ATOM 0 HD1 PHE A 16 -23.598 3.667 -3.071 1.00 0.00 H new ATOM 0 HD2 PHE A 16 -20.099 4.625 -0.823 1.00 0.00 H new ATOM 0 HE1 PHE A 16 -24.426 2.343 -1.141 1.00 0.00 H new ATOM 0 HE2 PHE A 16 -20.898 3.259 1.089 1.00 0.00 H new ATOM 0 HZ PHE A 16 -22.949 1.944 0.751 1.00 0.00 H new ATOM 250 N SER A 17 -22.752 4.439 -5.855 1.00 0.00 N ATOM 251 CA SER A 17 -23.867 3.873 -6.550 1.00 0.00 C ATOM 252 C SER A 17 -23.429 3.051 -7.712 1.00 0.00 C ATOM 253 O SER A 17 -24.252 2.346 -8.295 1.00 0.00 O ATOM 254 CB SER A 17 -24.618 5.056 -7.184 1.00 0.00 C ATOM 255 OG SER A 17 -25.111 5.939 -6.187 1.00 0.00 O ATOM 0 H SER A 17 -22.674 5.450 -5.965 1.00 0.00 H new ATOM 0 HA SER A 17 -24.445 3.268 -5.852 1.00 0.00 H new ATOM 0 HB2 SER A 17 -23.951 5.596 -7.856 1.00 0.00 H new ATOM 0 HB3 SER A 17 -25.446 4.684 -7.787 1.00 0.00 H new ATOM 0 HG SER A 17 -25.583 6.684 -6.614 1.00 0.00 H new ATOM 261 N LEU A 18 -22.141 3.038 -8.101 1.00 0.00 N ATOM 262 CA LEU A 18 -21.613 2.026 -8.963 1.00 0.00 C ATOM 263 C LEU A 18 -21.383 0.713 -8.298 1.00 0.00 C ATOM 264 O LEU A 18 -21.469 -0.325 -8.953 1.00 0.00 O ATOM 265 CB LEU A 18 -20.297 2.451 -9.636 1.00 0.00 C ATOM 266 CG LEU A 18 -20.406 3.799 -10.368 1.00 0.00 C ATOM 267 CD1 LEU A 18 -19.034 4.210 -10.929 1.00 0.00 C ATOM 268 CD2 LEU A 18 -21.417 3.734 -11.525 1.00 0.00 C ATOM 0 H LEU A 18 -21.457 3.738 -7.814 1.00 0.00 H new ATOM 0 HA LEU A 18 -22.396 1.901 -9.710 1.00 0.00 H new ATOM 0 HB2 LEU A 18 -19.513 2.516 -8.881 1.00 0.00 H new ATOM 0 HB3 LEU A 18 -19.993 1.682 -10.346 1.00 0.00 H new ATOM 0 HG LEU A 18 -20.751 4.536 -9.643 1.00 0.00 H new ATOM 0 HD11 LEU A 18 -19.123 5.166 -11.445 1.00 0.00 H new ATOM 0 HD12 LEU A 18 -18.320 4.305 -10.111 1.00 0.00 H new ATOM 0 HD13 LEU A 18 -18.685 3.451 -11.629 1.00 0.00 H new ATOM 0 HD21 LEU A 18 -21.467 4.704 -12.019 1.00 0.00 H new ATOM 0 HD22 LEU A 18 -21.100 2.977 -12.243 1.00 0.00 H new ATOM 0 HD23 LEU A 18 -22.401 3.474 -11.134 1.00 0.00 H new ATOM 280 N PHE A 19 -21.218 0.550 -6.973 1.00 0.00 N ATOM 281 CA PHE A 19 -21.133 -0.670 -6.232 1.00 0.00 C ATOM 282 C PHE A 19 -22.496 -1.228 -6.007 1.00 0.00 C ATOM 283 O PHE A 19 -22.687 -2.437 -6.129 1.00 0.00 O ATOM 284 CB PHE A 19 -20.493 -0.595 -4.835 1.00 0.00 C ATOM 285 CG PHE A 19 -19.032 -0.312 -4.916 1.00 0.00 C ATOM 286 CD1 PHE A 19 -18.683 0.980 -5.233 1.00 0.00 C ATOM 287 CD2 PHE A 19 -18.011 -1.220 -4.766 1.00 0.00 C ATOM 288 CE1 PHE A 19 -17.380 1.412 -5.310 1.00 0.00 C ATOM 289 CE2 PHE A 19 -16.705 -0.794 -4.707 1.00 0.00 C ATOM 290 CZ PHE A 19 -16.387 0.506 -5.023 1.00 0.00 C ATOM 0 H PHE A 19 -21.136 1.360 -6.359 1.00 0.00 H new ATOM 0 HA PHE A 19 -20.485 -1.282 -6.860 1.00 0.00 H new ATOM 0 HB2 PHE A 19 -20.983 0.184 -4.251 1.00 0.00 H new ATOM 0 HB3 PHE A 19 -20.653 -1.536 -4.310 1.00 0.00 H new ATOM 0 HD1 PHE A 19 -19.472 1.691 -5.431 1.00 0.00 H new ATOM 0 HD2 PHE A 19 -18.236 -2.274 -4.694 1.00 0.00 H new ATOM 0 HE1 PHE A 19 -17.145 2.429 -5.587 1.00 0.00 H new ATOM 0 HE2 PHE A 19 -15.927 -1.482 -4.412 1.00 0.00 H new ATOM 0 HZ PHE A 19 -15.353 0.816 -5.046 1.00 0.00 H new ATOM 300 N ASP A 20 -23.365 -0.281 -5.612 1.00 0.00 N ATOM 301 CA ASP A 20 -24.679 -0.541 -5.110 1.00 0.00 C ATOM 302 C ASP A 20 -25.617 -0.898 -6.211 1.00 0.00 C ATOM 303 O ASP A 20 -26.025 -0.042 -6.994 1.00 0.00 O ATOM 304 CB ASP A 20 -25.125 0.638 -4.229 1.00 0.00 C ATOM 305 CG ASP A 20 -26.217 0.358 -3.207 1.00 0.00 C ATOM 306 OD1 ASP A 20 -26.667 -0.818 -3.150 1.00 0.00 O ATOM 307 OD2 ASP A 20 -26.618 1.332 -2.517 1.00 0.00 O ATOM 0 H ASP A 20 -23.141 0.714 -5.644 1.00 0.00 H new ATOM 0 HA ASP A 20 -24.678 -1.422 -4.468 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -24.251 1.014 -3.697 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -25.469 1.439 -4.883 1.00 0.00 H new ATOM 312 N LYS A 21 -25.946 -2.193 -6.365 1.00 0.00 N ATOM 313 CA LYS A 21 -26.704 -2.803 -7.413 1.00 0.00 C ATOM 314 C LYS A 21 -28.162 -2.494 -7.428 1.00 0.00 C ATOM 315 O LYS A 21 -28.749 -2.026 -8.403 1.00 0.00 O ATOM 316 CB LYS A 21 -26.531 -4.327 -7.516 1.00 0.00 C ATOM 317 CG LYS A 21 -27.180 -4.957 -8.750 1.00 0.00 C ATOM 318 CD LYS A 21 -26.718 -6.412 -8.857 1.00 0.00 C ATOM 319 CE LYS A 21 -27.099 -7.098 -10.171 1.00 0.00 C ATOM 320 NZ LYS A 21 -28.547 -7.403 -10.185 1.00 0.00 N ATOM 0 H LYS A 21 -25.647 -2.885 -5.678 1.00 0.00 H new ATOM 0 HA LYS A 21 -26.257 -2.327 -8.286 1.00 0.00 H new ATOM 0 HB2 LYS A 21 -25.466 -4.559 -7.522 1.00 0.00 H new ATOM 0 HB3 LYS A 21 -26.953 -4.789 -6.623 1.00 0.00 H new ATOM 0 HG2 LYS A 21 -28.266 -4.910 -8.671 1.00 0.00 H new ATOM 0 HG3 LYS A 21 -26.901 -4.405 -9.647 1.00 0.00 H new ATOM 0 HD2 LYS A 21 -25.634 -6.446 -8.743 1.00 0.00 H new ATOM 0 HD3 LYS A 21 -27.143 -6.978 -8.028 1.00 0.00 H new ATOM 0 HE2 LYS A 21 -26.847 -6.453 -11.013 1.00 0.00 H new ATOM 0 HE3 LYS A 21 -26.525 -8.017 -10.290 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 -28.795 -7.868 -11.081 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 -28.776 -8.035 -9.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -29.089 -6.520 -10.092 1.00 0.00 H new ATOM 334 N ASP A 22 -28.774 -2.638 -6.239 1.00 0.00 N ATOM 335 CA ASP A 22 -30.155 -2.498 -5.895 1.00 0.00 C ATOM 336 C ASP A 22 -30.523 -1.113 -5.487 1.00 0.00 C ATOM 337 O ASP A 22 -31.566 -0.558 -5.828 1.00 0.00 O ATOM 338 CB ASP A 22 -30.645 -3.552 -4.888 1.00 0.00 C ATOM 339 CG ASP A 22 -29.730 -3.875 -3.716 1.00 0.00 C ATOM 340 OD1 ASP A 22 -28.690 -3.191 -3.522 1.00 0.00 O ATOM 341 OD2 ASP A 22 -30.082 -4.785 -2.919 1.00 0.00 O ATOM 0 H ASP A 22 -28.225 -2.885 -5.415 1.00 0.00 H new ATOM 0 HA ASP A 22 -30.694 -2.695 -6.822 1.00 0.00 H new ATOM 0 HB2 ASP A 22 -31.601 -3.216 -4.487 1.00 0.00 H new ATOM 0 HB3 ASP A 22 -30.835 -4.477 -5.433 1.00 0.00 H new ATOM 346 N GLY A 23 -29.527 -0.470 -4.852 1.00 0.00 N ATOM 347 CA GLY A 23 -29.622 0.859 -4.333 1.00 0.00 C ATOM 348 C GLY A 23 -30.204 0.923 -2.962 1.00 0.00 C ATOM 349 O GLY A 23 -31.042 1.775 -2.673 1.00 0.00 O ATOM 0 H GLY A 23 -28.614 -0.896 -4.693 1.00 0.00 H new ATOM 0 HA2 GLY A 23 -28.628 1.306 -4.318 1.00 0.00 H new ATOM 0 HA3 GLY A 23 -30.232 1.461 -5.006 1.00 0.00 H new ATOM 353 N ASP A 24 -29.812 0.045 -2.021 1.00 0.00 N ATOM 354 CA ASP A 24 -30.385 0.150 -0.716 1.00 0.00 C ATOM 355 C ASP A 24 -29.575 0.976 0.224 1.00 0.00 C ATOM 356 O ASP A 24 -29.960 1.154 1.378 1.00 0.00 O ATOM 357 CB ASP A 24 -30.659 -1.251 -0.144 1.00 0.00 C ATOM 358 CG ASP A 24 -29.504 -2.242 -0.134 1.00 0.00 C ATOM 359 OD1 ASP A 24 -28.413 -2.142 -0.757 1.00 0.00 O ATOM 360 OD2 ASP A 24 -29.647 -3.263 0.590 1.00 0.00 O ATOM 0 H ASP A 24 -29.132 -0.703 -2.152 1.00 0.00 H new ATOM 0 HA ASP A 24 -31.330 0.681 -0.826 1.00 0.00 H new ATOM 0 HB2 ASP A 24 -31.011 -1.133 0.881 1.00 0.00 H new ATOM 0 HB3 ASP A 24 -31.477 -1.693 -0.713 1.00 0.00 H new ATOM 365 N GLY A 25 -28.481 1.568 -0.287 1.00 0.00 N ATOM 366 CA GLY A 25 -27.571 2.393 0.446 1.00 0.00 C ATOM 367 C GLY A 25 -26.450 1.698 1.140 1.00 0.00 C ATOM 368 O GLY A 25 -25.646 2.336 1.817 1.00 0.00 O ATOM 0 H GLY A 25 -28.217 1.465 -1.267 1.00 0.00 H new ATOM 0 HA2 GLY A 25 -27.145 3.124 -0.241 1.00 0.00 H new ATOM 0 HA3 GLY A 25 -28.140 2.949 1.191 1.00 0.00 H new ATOM 372 N THR A 26 -26.228 0.408 0.832 1.00 0.00 N ATOM 373 CA THR A 26 -25.232 -0.374 1.496 1.00 0.00 C ATOM 374 C THR A 26 -24.573 -1.209 0.453 1.00 0.00 C ATOM 375 O THR A 26 -25.112 -1.683 -0.546 1.00 0.00 O ATOM 376 CB THR A 26 -25.629 -1.206 2.680 1.00 0.00 C ATOM 377 OG1 THR A 26 -27.024 -1.445 2.791 1.00 0.00 O ATOM 378 CG2 THR A 26 -25.363 -0.375 3.947 1.00 0.00 C ATOM 0 H THR A 26 -26.746 -0.099 0.114 1.00 0.00 H new ATOM 0 HA THR A 26 -24.571 0.349 1.974 1.00 0.00 H new ATOM 0 HB THR A 26 -25.079 -2.140 2.566 1.00 0.00 H new ATOM 0 HG1 THR A 26 -27.200 -1.994 3.584 1.00 0.00 H new ATOM 0 HG21 THR A 26 -25.642 -0.954 4.827 1.00 0.00 H new ATOM 0 HG22 THR A 26 -24.304 -0.122 4.000 1.00 0.00 H new ATOM 0 HG23 THR A 26 -25.954 0.540 3.912 1.00 0.00 H new ATOM 386 N ILE A 27 -23.266 -1.441 0.669 1.00 0.00 N ATOM 387 CA ILE A 27 -22.438 -2.376 -0.027 1.00 0.00 C ATOM 388 C ILE A 27 -22.329 -3.676 0.693 1.00 0.00 C ATOM 389 O ILE A 27 -21.725 -3.819 1.755 1.00 0.00 O ATOM 390 CB ILE A 27 -21.144 -1.867 -0.589 1.00 0.00 C ATOM 391 CG1 ILE A 27 -21.225 -0.415 -1.090 1.00 0.00 C ATOM 392 CG2 ILE A 27 -20.703 -2.732 -1.782 1.00 0.00 C ATOM 393 CD1 ILE A 27 -19.798 0.130 -1.131 1.00 0.00 C ATOM 0 H ILE A 27 -22.749 -0.934 1.387 1.00 0.00 H new ATOM 0 HA ILE A 27 -22.990 -2.563 -0.948 1.00 0.00 H new ATOM 0 HB ILE A 27 -20.431 -1.915 0.234 1.00 0.00 H new ATOM 0 HG12 ILE A 27 -21.681 -0.374 -2.079 1.00 0.00 H new ATOM 0 HG13 ILE A 27 -21.847 0.186 -0.427 1.00 0.00 H new ATOM 0 HG21 ILE A 27 -19.762 -2.351 -2.180 1.00 0.00 H new ATOM 0 HG22 ILE A 27 -20.567 -3.762 -1.454 1.00 0.00 H new ATOM 0 HG23 ILE A 27 -21.466 -2.696 -2.559 1.00 0.00 H new ATOM 0 HD11 ILE A 27 -19.812 1.162 -1.483 1.00 0.00 H new ATOM 0 HD12 ILE A 27 -19.366 0.093 -0.131 1.00 0.00 H new ATOM 0 HD13 ILE A 27 -19.196 -0.476 -1.809 1.00 0.00 H new ATOM 405 N THR A 28 -22.824 -4.797 0.138 1.00 0.00 N ATOM 406 CA THR A 28 -22.753 -6.157 0.576 1.00 0.00 C ATOM 407 C THR A 28 -21.457 -6.810 0.238 1.00 0.00 C ATOM 408 O THR A 28 -20.745 -6.401 -0.678 1.00 0.00 O ATOM 409 CB THR A 28 -23.895 -7.038 0.163 1.00 0.00 C ATOM 410 OG1 THR A 28 -23.924 -7.178 -1.250 1.00 0.00 O ATOM 411 CG2 THR A 28 -25.183 -6.348 0.644 1.00 0.00 C ATOM 0 H THR A 28 -23.344 -4.735 -0.737 1.00 0.00 H new ATOM 0 HA THR A 28 -22.832 -6.057 1.659 1.00 0.00 H new ATOM 0 HB THR A 28 -23.792 -8.033 0.595 1.00 0.00 H new ATOM 0 HG1 THR A 28 -24.673 -7.756 -1.506 1.00 0.00 H new ATOM 0 HG21 THR A 28 -26.046 -6.953 0.366 1.00 0.00 H new ATOM 0 HG22 THR A 28 -25.153 -6.236 1.728 1.00 0.00 H new ATOM 0 HG23 THR A 28 -25.264 -5.365 0.180 1.00 0.00 H new ATOM 419 N THR A 29 -21.157 -7.985 0.820 1.00 0.00 N ATOM 420 CA THR A 29 -20.076 -8.827 0.412 1.00 0.00 C ATOM 421 C THR A 29 -20.167 -9.305 -0.997 1.00 0.00 C ATOM 422 O THR A 29 -19.130 -9.544 -1.613 1.00 0.00 O ATOM 423 CB THR A 29 -19.852 -10.048 1.253 1.00 0.00 C ATOM 424 OG1 THR A 29 -21.098 -10.588 1.668 1.00 0.00 O ATOM 425 CG2 THR A 29 -19.195 -9.723 2.605 1.00 0.00 C ATOM 0 H THR A 29 -21.688 -8.363 1.605 1.00 0.00 H new ATOM 0 HA THR A 29 -19.238 -8.142 0.536 1.00 0.00 H new ATOM 0 HB THR A 29 -19.242 -10.704 0.632 1.00 0.00 H new ATOM 0 HG1 THR A 29 -20.943 -11.386 2.215 1.00 0.00 H new ATOM 0 HG21 THR A 29 -19.056 -10.643 3.173 1.00 0.00 H new ATOM 0 HG22 THR A 29 -18.227 -9.252 2.435 1.00 0.00 H new ATOM 0 HG23 THR A 29 -19.836 -9.043 3.167 1.00 0.00 H new ATOM 433 N LYS A 30 -21.395 -9.462 -1.523 1.00 0.00 N ATOM 434 CA LYS A 30 -21.573 -9.759 -2.911 1.00 0.00 C ATOM 435 C LYS A 30 -21.003 -8.659 -3.738 1.00 0.00 C ATOM 436 O LYS A 30 -20.178 -8.845 -4.632 1.00 0.00 O ATOM 437 CB LYS A 30 -23.061 -9.877 -3.280 1.00 0.00 C ATOM 438 CG LYS A 30 -23.724 -11.102 -2.648 1.00 0.00 C ATOM 439 CD LYS A 30 -25.248 -11.094 -2.776 1.00 0.00 C ATOM 440 CE LYS A 30 -25.894 -12.328 -2.143 1.00 0.00 C ATOM 441 NZ LYS A 30 -25.501 -12.577 -0.738 1.00 0.00 N ATOM 0 H LYS A 30 -22.261 -9.384 -0.990 1.00 0.00 H new ATOM 0 HA LYS A 30 -21.071 -10.707 -3.102 1.00 0.00 H new ATOM 0 HB2 LYS A 30 -23.585 -8.977 -2.958 1.00 0.00 H new ATOM 0 HB3 LYS A 30 -23.160 -9.932 -4.364 1.00 0.00 H new ATOM 0 HG2 LYS A 30 -23.331 -12.003 -3.118 1.00 0.00 H new ATOM 0 HG3 LYS A 30 -23.454 -11.149 -1.593 1.00 0.00 H new ATOM 0 HD2 LYS A 30 -25.645 -10.196 -2.302 1.00 0.00 H new ATOM 0 HD3 LYS A 30 -25.521 -11.045 -3.830 1.00 0.00 H new ATOM 0 HE2 LYS A 30 -26.978 -12.219 -2.189 1.00 0.00 H new ATOM 0 HE3 LYS A 30 -25.636 -13.203 -2.739 1.00 0.00 H new ATOM 0 HZ1 LYS A 30 -26.070 -13.357 -0.351 1.00 0.00 H new ATOM 0 HZ2 LYS A 30 -24.493 -12.832 -0.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 30 -25.663 -11.718 -0.175 1.00 0.00 H new ATOM 455 N GLU A 31 -21.557 -7.454 -3.513 1.00 0.00 N ATOM 456 CA GLU A 31 -21.404 -6.332 -4.386 1.00 0.00 C ATOM 457 C GLU A 31 -19.980 -5.895 -4.428 1.00 0.00 C ATOM 458 O GLU A 31 -19.445 -5.528 -5.473 1.00 0.00 O ATOM 459 CB GLU A 31 -22.293 -5.156 -3.949 1.00 0.00 C ATOM 460 CG GLU A 31 -23.782 -5.463 -4.119 1.00 0.00 C ATOM 461 CD GLU A 31 -24.697 -4.416 -3.502 1.00 0.00 C ATOM 462 OE1 GLU A 31 -24.462 -4.183 -2.286 1.00 0.00 O ATOM 463 OE2 GLU A 31 -25.650 -3.868 -4.118 1.00 0.00 O ATOM 0 H GLU A 31 -22.132 -7.254 -2.694 1.00 0.00 H new ATOM 0 HA GLU A 31 -21.715 -6.646 -5.382 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -22.090 -4.918 -2.905 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -22.037 -4.272 -4.533 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -24.007 -5.548 -5.182 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -23.998 -6.432 -3.669 1.00 0.00 H new ATOM 470 N LEU A 32 -19.247 -6.019 -3.307 1.00 0.00 N ATOM 471 CA LEU A 32 -17.829 -5.871 -3.194 1.00 0.00 C ATOM 472 C LEU A 32 -17.070 -6.937 -3.906 1.00 0.00 C ATOM 473 O LEU A 32 -16.181 -6.648 -4.706 1.00 0.00 O ATOM 474 CB LEU A 32 -17.345 -5.936 -1.736 1.00 0.00 C ATOM 475 CG LEU A 32 -17.524 -4.764 -0.756 1.00 0.00 C ATOM 476 CD1 LEU A 32 -17.120 -5.234 0.652 1.00 0.00 C ATOM 477 CD2 LEU A 32 -16.714 -3.511 -1.129 1.00 0.00 C ATOM 0 H LEU A 32 -19.681 -6.240 -2.411 1.00 0.00 H new ATOM 0 HA LEU A 32 -17.639 -4.894 -3.638 1.00 0.00 H new ATOM 0 HB2 LEU A 32 -17.833 -6.799 -1.283 1.00 0.00 H new ATOM 0 HB3 LEU A 32 -16.278 -6.154 -1.770 1.00 0.00 H new ATOM 0 HG LEU A 32 -18.573 -4.471 -0.797 1.00 0.00 H new ATOM 0 HD11 LEU A 32 -17.242 -4.413 1.359 1.00 0.00 H new ATOM 0 HD12 LEU A 32 -17.754 -6.068 0.953 1.00 0.00 H new ATOM 0 HD13 LEU A 32 -16.078 -5.554 0.644 1.00 0.00 H new ATOM 0 HD21 LEU A 32 -16.893 -2.729 -0.391 1.00 0.00 H new ATOM 0 HD22 LEU A 32 -15.652 -3.756 -1.148 1.00 0.00 H new ATOM 0 HD23 LEU A 32 -17.022 -3.158 -2.113 1.00 0.00 H new ATOM 489 N GLY A 33 -17.422 -8.210 -3.652 1.00 0.00 N ATOM 490 CA GLY A 33 -17.012 -9.375 -4.373 1.00 0.00 C ATOM 491 C GLY A 33 -16.943 -9.220 -5.853 1.00 0.00 C ATOM 492 O GLY A 33 -15.902 -9.458 -6.464 1.00 0.00 O ATOM 0 H GLY A 33 -18.045 -8.442 -2.878 1.00 0.00 H new ATOM 0 HA2 GLY A 33 -16.030 -9.679 -4.010 1.00 0.00 H new ATOM 0 HA3 GLY A 33 -17.702 -10.186 -4.142 1.00 0.00 H new ATOM 496 N THR A 34 -18.065 -8.857 -6.499 1.00 0.00 N ATOM 497 CA THR A 34 -17.999 -8.637 -7.911 1.00 0.00 C ATOM 498 C THR A 34 -16.973 -7.716 -8.477 1.00 0.00 C ATOM 499 O THR A 34 -16.343 -8.074 -9.471 1.00 0.00 O ATOM 500 CB THR A 34 -19.392 -8.241 -8.301 1.00 0.00 C ATOM 501 OG1 THR A 34 -20.428 -8.939 -7.626 1.00 0.00 O ATOM 502 CG2 THR A 34 -19.531 -8.431 -9.821 1.00 0.00 C ATOM 0 H THR A 34 -18.980 -8.720 -6.069 1.00 0.00 H new ATOM 0 HA THR A 34 -17.634 -9.564 -8.353 1.00 0.00 H new ATOM 0 HB THR A 34 -19.521 -7.201 -8.002 1.00 0.00 H new ATOM 0 HG1 THR A 34 -21.298 -8.616 -7.940 1.00 0.00 H new ATOM 0 HG21 THR A 34 -20.537 -8.150 -10.132 1.00 0.00 H new ATOM 0 HG22 THR A 34 -18.803 -7.803 -10.334 1.00 0.00 H new ATOM 0 HG23 THR A 34 -19.351 -9.476 -10.075 1.00 0.00 H new ATOM 510 N VAL A 35 -16.799 -6.519 -7.889 1.00 0.00 N ATOM 511 CA VAL A 35 -15.779 -5.553 -8.154 1.00 0.00 C ATOM 512 C VAL A 35 -14.377 -6.016 -7.952 1.00 0.00 C ATOM 513 O VAL A 35 -13.474 -5.895 -8.778 1.00 0.00 O ATOM 514 CB VAL A 35 -16.171 -4.356 -7.340 1.00 0.00 C ATOM 515 CG1 VAL A 35 -15.106 -3.329 -6.919 1.00 0.00 C ATOM 516 CG2 VAL A 35 -17.297 -3.561 -8.022 1.00 0.00 C ATOM 0 H VAL A 35 -17.435 -6.199 -7.158 1.00 0.00 H new ATOM 0 HA VAL A 35 -15.737 -5.321 -9.218 1.00 0.00 H new ATOM 0 HB VAL A 35 -16.458 -4.857 -6.416 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -15.576 -2.535 -6.338 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -14.345 -3.821 -6.313 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -14.641 -2.902 -7.808 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -17.558 -2.700 -7.407 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -16.960 -3.219 -9.001 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -18.172 -4.200 -8.142 1.00 0.00 H new ATOM 526 N MET A 36 -14.087 -6.699 -6.830 1.00 0.00 N ATOM 527 CA MET A 36 -12.869 -7.363 -6.483 1.00 0.00 C ATOM 528 C MET A 36 -12.521 -8.471 -7.416 1.00 0.00 C ATOM 529 O MET A 36 -11.371 -8.702 -7.785 1.00 0.00 O ATOM 530 CB MET A 36 -12.918 -7.954 -5.064 1.00 0.00 C ATOM 531 CG MET A 36 -12.996 -6.878 -3.979 1.00 0.00 C ATOM 532 SD MET A 36 -13.120 -7.617 -2.323 1.00 0.00 S ATOM 533 CE MET A 36 -13.365 -5.914 -1.740 1.00 0.00 C ATOM 0 H MET A 36 -14.782 -6.794 -6.089 1.00 0.00 H new ATOM 0 HA MET A 36 -12.108 -6.586 -6.546 1.00 0.00 H new ATOM 0 HB2 MET A 36 -13.782 -8.613 -4.979 1.00 0.00 H new ATOM 0 HB3 MET A 36 -12.032 -8.567 -4.899 1.00 0.00 H new ATOM 0 HG2 MET A 36 -12.112 -6.242 -4.030 1.00 0.00 H new ATOM 0 HG3 MET A 36 -13.860 -6.238 -4.160 1.00 0.00 H new ATOM 0 HE1 MET A 36 -13.670 -5.928 -0.694 1.00 0.00 H new ATOM 0 HE2 MET A 36 -12.433 -5.358 -1.838 1.00 0.00 H new ATOM 0 HE3 MET A 36 -14.139 -5.433 -2.338 1.00 0.00 H new ATOM 543 N ARG A 37 -13.505 -9.249 -7.902 1.00 0.00 N ATOM 544 CA ARG A 37 -13.240 -10.143 -8.986 1.00 0.00 C ATOM 545 C ARG A 37 -13.029 -9.496 -10.312 1.00 0.00 C ATOM 546 O ARG A 37 -12.341 -10.033 -11.178 1.00 0.00 O ATOM 547 CB ARG A 37 -14.538 -10.963 -9.076 1.00 0.00 C ATOM 548 CG ARG A 37 -14.739 -12.065 -8.033 1.00 0.00 C ATOM 549 CD ARG A 37 -13.536 -12.945 -7.687 1.00 0.00 C ATOM 550 NE ARG A 37 -13.101 -13.620 -8.942 1.00 0.00 N ATOM 551 CZ ARG A 37 -12.209 -14.654 -8.938 1.00 0.00 C ATOM 552 NH1 ARG A 37 -11.665 -15.261 -7.844 1.00 0.00 N ATOM 553 NH2 ARG A 37 -11.734 -15.080 -10.145 1.00 0.00 N ATOM 0 H ARG A 37 -14.464 -9.261 -7.554 1.00 0.00 H new ATOM 0 HA ARG A 37 -12.318 -10.690 -8.789 1.00 0.00 H new ATOM 0 HB2 ARG A 37 -15.379 -10.274 -9.006 1.00 0.00 H new ATOM 0 HB3 ARG A 37 -14.582 -11.420 -10.064 1.00 0.00 H new ATOM 0 HG2 ARG A 37 -15.087 -11.596 -7.113 1.00 0.00 H new ATOM 0 HG3 ARG A 37 -15.541 -12.715 -8.383 1.00 0.00 H new ATOM 0 HD2 ARG A 37 -12.726 -12.343 -7.275 1.00 0.00 H new ATOM 0 HD3 ARG A 37 -13.804 -13.681 -6.929 1.00 0.00 H new ATOM 0 HE ARG A 37 -13.482 -13.300 -9.832 1.00 0.00 H new ATOM 0 HH11 ARG A 37 -11.919 -14.947 -6.907 1.00 0.00 H new ATOM 0 HH12 ARG A 37 -11.005 -16.029 -7.963 1.00 0.00 H new ATOM 0 HH21 ARG A 37 -12.047 -14.629 -11.004 1.00 0.00 H new ATOM 0 HH22 ARG A 37 -11.066 -15.850 -10.187 1.00 0.00 H new ATOM 567 N SER A 38 -13.623 -8.320 -10.582 1.00 0.00 N ATOM 568 CA SER A 38 -13.388 -7.645 -11.820 1.00 0.00 C ATOM 569 C SER A 38 -12.058 -6.984 -11.938 1.00 0.00 C ATOM 570 O SER A 38 -11.572 -6.961 -13.067 1.00 0.00 O ATOM 571 CB SER A 38 -14.419 -6.593 -12.264 1.00 0.00 C ATOM 572 OG SER A 38 -15.701 -7.204 -12.267 1.00 0.00 O ATOM 0 H SER A 38 -14.261 -7.839 -9.948 1.00 0.00 H new ATOM 0 HA SER A 38 -13.465 -8.511 -12.478 1.00 0.00 H new ATOM 0 HB2 SER A 38 -14.406 -5.739 -11.587 1.00 0.00 H new ATOM 0 HB3 SER A 38 -14.175 -6.216 -13.257 1.00 0.00 H new ATOM 0 HG SER A 38 -15.919 -7.511 -11.362 1.00 0.00 H new ATOM 578 N LEU A 39 -11.505 -6.437 -10.840 1.00 0.00 N ATOM 579 CA LEU A 39 -10.225 -5.815 -10.697 1.00 0.00 C ATOM 580 C LEU A 39 -9.095 -6.785 -10.756 1.00 0.00 C ATOM 581 O LEU A 39 -7.949 -6.340 -10.769 1.00 0.00 O ATOM 582 CB LEU A 39 -10.091 -4.929 -9.447 1.00 0.00 C ATOM 583 CG LEU A 39 -11.019 -3.708 -9.336 1.00 0.00 C ATOM 584 CD1 LEU A 39 -11.288 -3.383 -7.856 1.00 0.00 C ATOM 585 CD2 LEU A 39 -10.303 -2.491 -9.945 1.00 0.00 C ATOM 0 H LEU A 39 -12.014 -6.432 -9.956 1.00 0.00 H new ATOM 0 HA LEU A 39 -10.161 -5.158 -11.565 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -10.256 -5.557 -8.571 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -9.062 -4.574 -9.396 1.00 0.00 H new ATOM 0 HG LEU A 39 -11.954 -3.926 -9.852 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -11.946 -2.517 -7.787 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -11.763 -4.239 -7.376 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -10.345 -3.163 -7.355 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -10.949 -1.616 -9.874 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -9.377 -2.304 -9.401 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -10.075 -2.690 -10.992 1.00 0.00 H new ATOM 597 N GLY A 40 -9.436 -8.085 -10.822 1.00 0.00 N ATOM 598 CA GLY A 40 -8.505 -9.170 -10.853 1.00 0.00 C ATOM 599 C GLY A 40 -8.020 -9.694 -9.545 1.00 0.00 C ATOM 600 O GLY A 40 -6.945 -10.287 -9.472 1.00 0.00 O ATOM 0 H GLY A 40 -10.408 -8.394 -10.855 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -8.967 -9.995 -11.396 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -7.637 -8.853 -11.432 1.00 0.00 H new ATOM 604 N GLN A 41 -8.675 -9.409 -8.405 1.00 0.00 N ATOM 605 CA GLN A 41 -8.344 -9.802 -7.070 1.00 0.00 C ATOM 606 C GLN A 41 -9.084 -11.075 -6.843 1.00 0.00 C ATOM 607 O GLN A 41 -10.106 -11.501 -7.378 1.00 0.00 O ATOM 608 CB GLN A 41 -8.758 -8.734 -6.044 1.00 0.00 C ATOM 609 CG GLN A 41 -8.198 -7.333 -6.297 1.00 0.00 C ATOM 610 CD GLN A 41 -6.691 -7.387 -6.496 1.00 0.00 C ATOM 611 OE1 GLN A 41 -6.185 -6.845 -7.478 1.00 0.00 O ATOM 612 NE2 GLN A 41 -5.930 -7.926 -5.506 1.00 0.00 N ATOM 0 H GLN A 41 -9.524 -8.844 -8.424 1.00 0.00 H new ATOM 0 HA GLN A 41 -7.268 -9.926 -6.947 1.00 0.00 H new ATOM 0 HB2 GLN A 41 -9.846 -8.674 -6.025 1.00 0.00 H new ATOM 0 HB3 GLN A 41 -8.439 -9.062 -5.054 1.00 0.00 H new ATOM 0 HG2 GLN A 41 -8.671 -6.900 -7.178 1.00 0.00 H new ATOM 0 HG3 GLN A 41 -8.436 -6.683 -5.455 1.00 0.00 H new ATOM 0 HE21 GLN A 41 -6.377 -8.369 -4.703 1.00 0.00 H new ATOM 0 HE22 GLN A 41 -4.913 -7.887 -5.566 1.00 0.00 H new ATOM 621 N ASN A 42 -8.557 -11.912 -5.931 1.00 0.00 N ATOM 622 CA ASN A 42 -8.982 -13.254 -5.677 1.00 0.00 C ATOM 623 C ASN A 42 -9.329 -13.473 -4.244 1.00 0.00 C ATOM 624 O ASN A 42 -8.707 -14.327 -3.615 1.00 0.00 O ATOM 625 CB ASN A 42 -7.877 -14.234 -6.105 1.00 0.00 C ATOM 626 CG ASN A 42 -7.502 -14.119 -7.575 1.00 0.00 C ATOM 627 OD1 ASN A 42 -8.403 -14.074 -8.411 1.00 0.00 O ATOM 628 ND2 ASN A 42 -6.171 -13.916 -7.768 1.00 0.00 N ATOM 0 H ASN A 42 -7.781 -11.631 -5.331 1.00 0.00 H new ATOM 0 HA ASN A 42 -9.885 -13.432 -6.260 1.00 0.00 H new ATOM 0 HB2 ASN A 42 -6.990 -14.058 -5.497 1.00 0.00 H new ATOM 0 HB3 ASN A 42 -8.206 -15.253 -5.901 1.00 0.00 H new ATOM 0 HD21 ASN A 42 -5.818 -13.696 -8.700 1.00 0.00 H new ATOM 0 HD22 ASN A 42 -5.525 -13.984 -6.981 1.00 0.00 H new ATOM 635 N PRO A 43 -10.303 -12.880 -3.620 1.00 0.00 N ATOM 636 CA PRO A 43 -10.473 -13.020 -2.203 1.00 0.00 C ATOM 637 C PRO A 43 -11.101 -14.325 -1.855 1.00 0.00 C ATOM 638 O PRO A 43 -11.587 -15.087 -2.690 1.00 0.00 O ATOM 639 CB PRO A 43 -11.492 -11.937 -1.857 1.00 0.00 C ATOM 640 CG PRO A 43 -12.157 -11.526 -3.181 1.00 0.00 C ATOM 641 CD PRO A 43 -11.069 -11.805 -4.230 1.00 0.00 C ATOM 0 HA PRO A 43 -9.517 -12.952 -1.683 1.00 0.00 H new ATOM 0 HB2 PRO A 43 -12.233 -12.312 -1.151 1.00 0.00 H new ATOM 0 HB3 PRO A 43 -11.006 -11.083 -1.385 1.00 0.00 H new ATOM 0 HG2 PRO A 43 -13.059 -12.106 -3.374 1.00 0.00 H new ATOM 0 HG3 PRO A 43 -12.449 -10.476 -3.175 1.00 0.00 H new ATOM 0 HD2 PRO A 43 -11.497 -12.105 -5.187 1.00 0.00 H new ATOM 0 HD3 PRO A 43 -10.453 -10.926 -4.418 1.00 0.00 H new ATOM 649 N THR A 44 -11.020 -14.659 -0.554 1.00 0.00 N ATOM 650 CA THR A 44 -11.796 -15.671 0.092 1.00 0.00 C ATOM 651 C THR A 44 -12.939 -15.042 0.813 1.00 0.00 C ATOM 652 O THR A 44 -12.967 -13.819 0.939 1.00 0.00 O ATOM 653 CB THR A 44 -11.035 -16.630 0.958 1.00 0.00 C ATOM 654 OG1 THR A 44 -10.164 -15.917 1.824 1.00 0.00 O ATOM 655 CG2 THR A 44 -10.124 -17.558 0.136 1.00 0.00 C ATOM 0 H THR A 44 -10.374 -14.194 0.084 1.00 0.00 H new ATOM 0 HA THR A 44 -12.167 -16.314 -0.706 1.00 0.00 H new ATOM 0 HB THR A 44 -11.785 -17.208 1.497 1.00 0.00 H new ATOM 0 HG1 THR A 44 -9.614 -15.299 1.299 1.00 0.00 H new ATOM 0 HG21 THR A 44 -9.594 -18.234 0.806 1.00 0.00 H new ATOM 0 HG22 THR A 44 -10.729 -18.138 -0.561 1.00 0.00 H new ATOM 0 HG23 THR A 44 -9.403 -16.960 -0.421 1.00 0.00 H new ATOM 663 N GLU A 45 -13.923 -15.823 1.294 1.00 0.00 N ATOM 664 CA GLU A 45 -15.010 -15.295 2.057 1.00 0.00 C ATOM 665 C GLU A 45 -14.672 -14.778 3.413 1.00 0.00 C ATOM 666 O GLU A 45 -15.170 -13.747 3.863 1.00 0.00 O ATOM 667 CB GLU A 45 -16.047 -16.425 2.178 1.00 0.00 C ATOM 668 CG GLU A 45 -17.353 -16.072 2.893 1.00 0.00 C ATOM 669 CD GLU A 45 -18.337 -15.444 1.916 1.00 0.00 C ATOM 670 OE1 GLU A 45 -18.084 -14.302 1.446 1.00 0.00 O ATOM 671 OE2 GLU A 45 -19.341 -16.123 1.570 1.00 0.00 O ATOM 0 H GLU A 45 -13.965 -16.832 1.152 1.00 0.00 H new ATOM 0 HA GLU A 45 -15.375 -14.414 1.528 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -16.290 -16.775 1.175 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -15.584 -17.260 2.704 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -17.789 -16.969 3.333 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -17.152 -15.381 3.712 1.00 0.00 H new ATOM 678 N ALA A 46 -13.729 -15.449 4.100 1.00 0.00 N ATOM 679 CA ALA A 46 -13.214 -14.937 5.331 1.00 0.00 C ATOM 680 C ALA A 46 -12.397 -13.693 5.263 1.00 0.00 C ATOM 681 O ALA A 46 -12.329 -12.970 6.256 1.00 0.00 O ATOM 682 CB ALA A 46 -12.335 -16.070 5.886 1.00 0.00 C ATOM 0 H ALA A 46 -13.326 -16.339 3.806 1.00 0.00 H new ATOM 0 HA ALA A 46 -14.067 -14.645 5.944 1.00 0.00 H new ATOM 0 HB1 ALA A 46 -11.898 -15.760 6.835 1.00 0.00 H new ATOM 0 HB2 ALA A 46 -12.944 -16.961 6.041 1.00 0.00 H new ATOM 0 HB3 ALA A 46 -11.539 -16.294 5.176 1.00 0.00 H new ATOM 688 N GLU A 47 -11.816 -13.373 4.093 1.00 0.00 N ATOM 689 CA GLU A 47 -11.159 -12.115 3.915 1.00 0.00 C ATOM 690 C GLU A 47 -12.180 -11.037 3.791 1.00 0.00 C ATOM 691 O GLU A 47 -12.167 -9.994 4.443 1.00 0.00 O ATOM 692 CB GLU A 47 -10.156 -12.173 2.750 1.00 0.00 C ATOM 693 CG GLU A 47 -8.943 -13.085 2.940 1.00 0.00 C ATOM 694 CD GLU A 47 -8.101 -13.219 1.679 1.00 0.00 C ATOM 695 OE1 GLU A 47 -8.688 -13.733 0.690 1.00 0.00 O ATOM 696 OE2 GLU A 47 -6.875 -12.940 1.606 1.00 0.00 O ATOM 0 H GLU A 47 -11.801 -13.981 3.274 1.00 0.00 H new ATOM 0 HA GLU A 47 -10.556 -11.878 4.792 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -10.689 -12.496 1.856 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -9.796 -11.162 2.559 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -8.322 -12.693 3.746 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -9.282 -14.073 3.251 1.00 0.00 H new ATOM 703 N LEU A 48 -13.179 -11.259 2.917 1.00 0.00 N ATOM 704 CA LEU A 48 -14.323 -10.413 2.776 1.00 0.00 C ATOM 705 C LEU A 48 -15.178 -10.161 3.969 1.00 0.00 C ATOM 706 O LEU A 48 -15.596 -9.020 4.164 1.00 0.00 O ATOM 707 CB LEU A 48 -15.213 -10.920 1.629 1.00 0.00 C ATOM 708 CG LEU A 48 -14.899 -10.521 0.178 1.00 0.00 C ATOM 709 CD1 LEU A 48 -15.656 -11.472 -0.765 1.00 0.00 C ATOM 710 CD2 LEU A 48 -15.322 -9.055 -0.014 1.00 0.00 C ATOM 0 H LEU A 48 -13.190 -12.059 2.284 1.00 0.00 H new ATOM 0 HA LEU A 48 -13.868 -9.443 2.578 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -15.210 -12.009 1.674 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -16.232 -10.595 1.841 1.00 0.00 H new ATOM 0 HG LEU A 48 -13.836 -10.604 -0.048 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -15.444 -11.203 -1.800 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -15.334 -12.497 -0.583 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -16.727 -11.391 -0.581 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -15.110 -8.746 -1.037 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -16.390 -8.956 0.181 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -14.767 -8.422 0.679 1.00 0.00 H new ATOM 722 N GLN A 49 -15.358 -11.131 4.884 1.00 0.00 N ATOM 723 CA GLN A 49 -16.068 -11.006 6.119 1.00 0.00 C ATOM 724 C GLN A 49 -15.283 -10.131 7.034 1.00 0.00 C ATOM 725 O GLN A 49 -15.776 -9.192 7.658 1.00 0.00 O ATOM 726 CB GLN A 49 -16.263 -12.348 6.846 1.00 0.00 C ATOM 727 CG GLN A 49 -16.995 -12.263 8.187 1.00 0.00 C ATOM 728 CD GLN A 49 -17.124 -13.529 9.021 1.00 0.00 C ATOM 729 OE1 GLN A 49 -16.183 -14.106 9.564 1.00 0.00 O ATOM 730 NE2 GLN A 49 -18.417 -13.881 9.252 1.00 0.00 N ATOM 0 H GLN A 49 -14.980 -12.069 4.750 1.00 0.00 H new ATOM 0 HA GLN A 49 -17.049 -10.599 5.875 1.00 0.00 H new ATOM 0 HB2 GLN A 49 -16.816 -13.021 6.191 1.00 0.00 H new ATOM 0 HB3 GLN A 49 -15.284 -12.798 7.013 1.00 0.00 H new ATOM 0 HG2 GLN A 49 -16.488 -11.514 8.796 1.00 0.00 H new ATOM 0 HG3 GLN A 49 -18.000 -11.889 7.994 1.00 0.00 H new ATOM 0 HE21 GLN A 49 -19.173 -13.381 8.784 1.00 0.00 H new ATOM 0 HE22 GLN A 49 -18.631 -14.645 9.893 1.00 0.00 H new ATOM 739 N ASP A 50 -14.001 -10.435 7.306 1.00 0.00 N ATOM 740 CA ASP A 50 -13.176 -9.886 8.337 1.00 0.00 C ATOM 741 C ASP A 50 -12.809 -8.496 7.946 1.00 0.00 C ATOM 742 O ASP A 50 -12.629 -7.666 8.835 1.00 0.00 O ATOM 743 CB ASP A 50 -11.912 -10.758 8.422 1.00 0.00 C ATOM 744 CG ASP A 50 -10.979 -10.498 9.596 1.00 0.00 C ATOM 745 OD1 ASP A 50 -11.517 -10.295 10.718 1.00 0.00 O ATOM 746 OD2 ASP A 50 -9.726 -10.556 9.482 1.00 0.00 O ATOM 0 H ASP A 50 -13.498 -11.129 6.752 1.00 0.00 H new ATOM 0 HA ASP A 50 -13.686 -9.867 9.300 1.00 0.00 H new ATOM 0 HB2 ASP A 50 -12.221 -11.803 8.458 1.00 0.00 H new ATOM 0 HB3 ASP A 50 -11.345 -10.625 7.501 1.00 0.00 H new ATOM 751 N MET A 51 -12.707 -8.170 6.645 1.00 0.00 N ATOM 752 CA MET A 51 -12.496 -6.817 6.230 1.00 0.00 C ATOM 753 C MET A 51 -13.564 -5.864 6.642 1.00 0.00 C ATOM 754 O MET A 51 -13.316 -4.764 7.133 1.00 0.00 O ATOM 755 CB MET A 51 -12.274 -6.700 4.713 1.00 0.00 C ATOM 756 CG MET A 51 -10.843 -7.080 4.328 1.00 0.00 C ATOM 757 SD MET A 51 -10.369 -7.371 2.597 1.00 0.00 S ATOM 758 CE MET A 51 -11.497 -6.289 1.674 1.00 0.00 C ATOM 0 H MET A 51 -12.771 -8.842 5.881 1.00 0.00 H new ATOM 0 HA MET A 51 -11.588 -6.527 6.759 1.00 0.00 H new ATOM 0 HB2 MET A 51 -12.977 -7.348 4.190 1.00 0.00 H new ATOM 0 HB3 MET A 51 -12.480 -5.679 4.391 1.00 0.00 H new ATOM 0 HG2 MET A 51 -10.193 -6.290 4.706 1.00 0.00 H new ATOM 0 HG3 MET A 51 -10.597 -7.987 4.880 1.00 0.00 H new ATOM 0 HE1 MET A 51 -11.276 -6.357 0.609 1.00 0.00 H new ATOM 0 HE2 MET A 51 -12.526 -6.600 1.851 1.00 0.00 H new ATOM 0 HE3 MET A 51 -11.367 -5.259 2.007 1.00 0.00 H new ATOM 768 N ILE A 52 -14.804 -6.358 6.475 1.00 0.00 N ATOM 769 CA ILE A 52 -15.923 -5.602 6.944 1.00 0.00 C ATOM 770 C ILE A 52 -15.937 -5.484 8.430 1.00 0.00 C ATOM 771 O ILE A 52 -16.155 -4.401 8.971 1.00 0.00 O ATOM 772 CB ILE A 52 -17.231 -6.126 6.431 1.00 0.00 C ATOM 773 CG1 ILE A 52 -17.269 -6.071 4.894 1.00 0.00 C ATOM 774 CG2 ILE A 52 -18.453 -5.349 6.950 1.00 0.00 C ATOM 775 CD1 ILE A 52 -18.493 -6.784 4.321 1.00 0.00 C ATOM 0 H ILE A 52 -15.028 -7.249 6.032 1.00 0.00 H new ATOM 0 HA ILE A 52 -15.799 -4.600 6.534 1.00 0.00 H new ATOM 0 HB ILE A 52 -17.292 -7.150 6.799 1.00 0.00 H new ATOM 0 HG12 ILE A 52 -17.272 -5.030 4.569 1.00 0.00 H new ATOM 0 HG13 ILE A 52 -16.364 -6.528 4.493 1.00 0.00 H new ATOM 0 HG21 ILE A 52 -19.363 -5.784 6.537 1.00 0.00 H new ATOM 0 HG22 ILE A 52 -18.485 -5.405 8.038 1.00 0.00 H new ATOM 0 HG23 ILE A 52 -18.378 -4.306 6.643 1.00 0.00 H new ATOM 0 HD11 ILE A 52 -18.476 -6.718 3.233 1.00 0.00 H new ATOM 0 HD12 ILE A 52 -18.478 -7.832 4.622 1.00 0.00 H new ATOM 0 HD13 ILE A 52 -19.400 -6.311 4.699 1.00 0.00 H new ATOM 787 N ASN A 53 -15.712 -6.565 9.197 1.00 0.00 N ATOM 788 CA ASN A 53 -15.821 -6.622 10.622 1.00 0.00 C ATOM 789 C ASN A 53 -14.943 -5.618 11.285 1.00 0.00 C ATOM 790 O ASN A 53 -15.210 -5.073 12.355 1.00 0.00 O ATOM 791 CB ASN A 53 -15.457 -8.028 11.130 1.00 0.00 C ATOM 792 CG ASN A 53 -16.644 -8.959 10.929 1.00 0.00 C ATOM 793 OD1 ASN A 53 -17.709 -8.503 10.518 1.00 0.00 O ATOM 794 ND2 ASN A 53 -16.418 -10.279 11.167 1.00 0.00 N ATOM 0 H ASN A 53 -15.435 -7.460 8.794 1.00 0.00 H new ATOM 0 HA ASN A 53 -16.856 -6.393 10.876 1.00 0.00 H new ATOM 0 HB2 ASN A 53 -14.588 -8.407 10.593 1.00 0.00 H new ATOM 0 HB3 ASN A 53 -15.187 -7.987 12.185 1.00 0.00 H new ATOM 0 HD21 ASN A 53 -17.159 -10.961 11.004 1.00 0.00 H new ATOM 0 HD22 ASN A 53 -15.508 -10.587 11.508 1.00 0.00 H new ATOM 801 N GLU A 54 -13.886 -5.162 10.588 1.00 0.00 N ATOM 802 CA GLU A 54 -12.964 -4.179 11.064 1.00 0.00 C ATOM 803 C GLU A 54 -13.510 -2.798 11.195 1.00 0.00 C ATOM 804 O GLU A 54 -13.132 -2.067 12.108 1.00 0.00 O ATOM 805 CB GLU A 54 -11.652 -4.198 10.262 1.00 0.00 C ATOM 806 CG GLU A 54 -10.451 -3.591 10.990 1.00 0.00 C ATOM 807 CD GLU A 54 -9.092 -3.683 10.312 1.00 0.00 C ATOM 808 OE1 GLU A 54 -8.971 -4.281 9.209 1.00 0.00 O ATOM 809 OE2 GLU A 54 -8.163 -3.004 10.826 1.00 0.00 O ATOM 0 H GLU A 54 -13.665 -5.495 9.649 1.00 0.00 H new ATOM 0 HA GLU A 54 -12.752 -4.482 12.090 1.00 0.00 H new ATOM 0 HB2 GLU A 54 -11.417 -5.229 9.999 1.00 0.00 H new ATOM 0 HB3 GLU A 54 -11.805 -3.658 9.328 1.00 0.00 H new ATOM 0 HG2 GLU A 54 -10.665 -2.538 11.170 1.00 0.00 H new ATOM 0 HG3 GLU A 54 -10.372 -4.071 11.965 1.00 0.00 H new ATOM 816 N VAL A 55 -14.304 -2.453 10.166 1.00 0.00 N ATOM 817 CA VAL A 55 -14.797 -1.121 9.997 1.00 0.00 C ATOM 818 C VAL A 55 -16.202 -0.921 10.451 1.00 0.00 C ATOM 819 O VAL A 55 -16.715 0.194 10.536 1.00 0.00 O ATOM 820 CB VAL A 55 -14.544 -0.573 8.623 1.00 0.00 C ATOM 821 CG1 VAL A 55 -13.031 -0.386 8.418 1.00 0.00 C ATOM 822 CG2 VAL A 55 -15.119 -1.499 7.538 1.00 0.00 C ATOM 0 H VAL A 55 -14.608 -3.105 9.443 1.00 0.00 H new ATOM 0 HA VAL A 55 -14.199 -0.520 10.682 1.00 0.00 H new ATOM 0 HB VAL A 55 -15.046 0.390 8.536 1.00 0.00 H new ATOM 0 HG11 VAL A 55 -12.845 0.012 7.420 1.00 0.00 H new ATOM 0 HG12 VAL A 55 -12.646 0.310 9.164 1.00 0.00 H new ATOM 0 HG13 VAL A 55 -12.528 -1.347 8.525 1.00 0.00 H new ATOM 0 HG21 VAL A 55 -14.919 -1.074 6.554 1.00 0.00 H new ATOM 0 HG22 VAL A 55 -14.650 -2.480 7.611 1.00 0.00 H new ATOM 0 HG23 VAL A 55 -16.195 -1.599 7.678 1.00 0.00 H new ATOM 832 N ASP A 56 -16.943 -2.016 10.696 1.00 0.00 N ATOM 833 CA ASP A 56 -18.277 -2.113 11.204 1.00 0.00 C ATOM 834 C ASP A 56 -18.182 -1.860 12.670 1.00 0.00 C ATOM 835 O ASP A 56 -18.090 -2.745 13.519 1.00 0.00 O ATOM 836 CB ASP A 56 -18.924 -3.447 10.795 1.00 0.00 C ATOM 837 CG ASP A 56 -20.430 -3.366 11.000 1.00 0.00 C ATOM 838 OD1 ASP A 56 -21.119 -2.329 10.805 1.00 0.00 O ATOM 839 OD2 ASP A 56 -20.974 -4.386 11.503 1.00 0.00 O ATOM 0 H ASP A 56 -16.557 -2.943 10.515 1.00 0.00 H new ATOM 0 HA ASP A 56 -18.954 -1.372 10.778 1.00 0.00 H new ATOM 0 HB2 ASP A 56 -18.700 -3.667 9.751 1.00 0.00 H new ATOM 0 HB3 ASP A 56 -18.509 -4.262 11.389 1.00 0.00 H new ATOM 844 N ALA A 57 -18.195 -0.555 12.993 1.00 0.00 N ATOM 845 CA ALA A 57 -18.505 -0.245 14.355 1.00 0.00 C ATOM 846 C ALA A 57 -19.939 -0.474 14.688 1.00 0.00 C ATOM 847 O ALA A 57 -20.285 -0.922 15.780 1.00 0.00 O ATOM 848 CB ALA A 57 -18.075 1.224 14.505 1.00 0.00 C ATOM 0 H ALA A 57 -18.008 0.230 12.370 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.986 -0.896 15.058 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.273 1.559 15.523 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -17.009 1.315 14.294 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -18.637 1.841 13.804 1.00 0.00 H new ATOM 854 N ASP A 58 -20.914 -0.121 13.831 1.00 0.00 N ATOM 855 CA ASP A 58 -22.339 -0.086 13.944 1.00 0.00 C ATOM 856 C ASP A 58 -23.142 -1.338 14.021 1.00 0.00 C ATOM 857 O ASP A 58 -24.071 -1.469 14.817 1.00 0.00 O ATOM 858 CB ASP A 58 -22.902 0.977 12.985 1.00 0.00 C ATOM 859 CG ASP A 58 -22.511 0.559 11.575 1.00 0.00 C ATOM 860 OD1 ASP A 58 -23.163 -0.321 10.952 1.00 0.00 O ATOM 861 OD2 ASP A 58 -21.633 1.214 10.952 1.00 0.00 O ATOM 0 H ASP A 58 -20.645 0.193 12.899 1.00 0.00 H new ATOM 0 HA ASP A 58 -22.486 0.193 14.987 1.00 0.00 H new ATOM 0 HB2 ASP A 58 -23.986 1.046 13.080 1.00 0.00 H new ATOM 0 HB3 ASP A 58 -22.498 1.961 13.221 1.00 0.00 H new ATOM 866 N GLY A 59 -22.667 -2.390 13.330 1.00 0.00 N ATOM 867 CA GLY A 59 -23.265 -3.685 13.428 1.00 0.00 C ATOM 868 C GLY A 59 -24.249 -4.086 12.384 1.00 0.00 C ATOM 869 O GLY A 59 -25.143 -4.889 12.648 1.00 0.00 O ATOM 0 H GLY A 59 -21.865 -2.343 12.701 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -22.463 -4.423 13.431 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -23.761 -3.750 14.396 1.00 0.00 H new ATOM 873 N ASN A 60 -24.147 -3.651 11.115 1.00 0.00 N ATOM 874 CA ASN A 60 -24.887 -4.259 10.053 1.00 0.00 C ATOM 875 C ASN A 60 -24.207 -5.378 9.343 1.00 0.00 C ATOM 876 O ASN A 60 -24.789 -6.271 8.729 1.00 0.00 O ATOM 877 CB ASN A 60 -25.338 -3.291 8.946 1.00 0.00 C ATOM 878 CG ASN A 60 -24.346 -2.221 8.513 1.00 0.00 C ATOM 879 OD1 ASN A 60 -23.138 -2.318 8.723 1.00 0.00 O ATOM 880 ND2 ASN A 60 -24.887 -1.099 7.968 1.00 0.00 N ATOM 0 H ASN A 60 -23.551 -2.876 10.824 1.00 0.00 H new ATOM 0 HA ASN A 60 -25.737 -4.638 10.620 1.00 0.00 H new ATOM 0 HB2 ASN A 60 -25.603 -3.881 8.069 1.00 0.00 H new ATOM 0 HB3 ASN A 60 -26.247 -2.793 9.282 1.00 0.00 H new ATOM 0 HD21 ASN A 60 -24.287 -0.311 7.723 1.00 0.00 H new ATOM 0 HD22 ASN A 60 -25.892 -1.045 7.804 1.00 0.00 H new ATOM 887 N GLY A 61 -22.865 -5.315 9.279 1.00 0.00 N ATOM 888 CA GLY A 61 -22.026 -6.209 8.543 1.00 0.00 C ATOM 889 C GLY A 61 -22.034 -5.974 7.072 1.00 0.00 C ATOM 890 O GLY A 61 -21.827 -6.909 6.299 1.00 0.00 O ATOM 0 H GLY A 61 -22.334 -4.596 9.771 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -21.004 -6.117 8.910 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -22.344 -7.233 8.739 1.00 0.00 H new ATOM 894 N THR A 62 -22.311 -4.698 6.748 1.00 0.00 N ATOM 895 CA THR A 62 -22.353 -4.093 5.453 1.00 0.00 C ATOM 896 C THR A 62 -21.784 -2.717 5.498 1.00 0.00 C ATOM 897 O THR A 62 -21.698 -2.092 6.555 1.00 0.00 O ATOM 898 CB THR A 62 -23.687 -4.076 4.767 1.00 0.00 C ATOM 899 OG1 THR A 62 -24.676 -3.469 5.584 1.00 0.00 O ATOM 900 CG2 THR A 62 -24.246 -5.457 4.382 1.00 0.00 C ATOM 0 H THR A 62 -22.529 -4.018 7.477 1.00 0.00 H new ATOM 0 HA THR A 62 -21.739 -4.751 4.838 1.00 0.00 H new ATOM 0 HB THR A 62 -23.488 -3.515 3.854 1.00 0.00 H new ATOM 0 HG1 THR A 62 -25.535 -3.469 5.113 1.00 0.00 H new ATOM 0 HG21 THR A 62 -25.212 -5.335 3.893 1.00 0.00 H new ATOM 0 HG22 THR A 62 -23.554 -5.952 3.701 1.00 0.00 H new ATOM 0 HG23 THR A 62 -24.368 -6.063 5.280 1.00 0.00 H new ATOM 908 N ILE A 63 -21.321 -2.286 4.312 1.00 0.00 N ATOM 909 CA ILE A 63 -20.483 -1.127 4.300 1.00 0.00 C ATOM 910 C ILE A 63 -21.392 -0.075 3.762 1.00 0.00 C ATOM 911 O ILE A 63 -21.834 -0.041 2.615 1.00 0.00 O ATOM 912 CB ILE A 63 -19.233 -1.314 3.493 1.00 0.00 C ATOM 913 CG1 ILE A 63 -18.279 -2.064 4.438 1.00 0.00 C ATOM 914 CG2 ILE A 63 -18.699 0.051 3.024 1.00 0.00 C ATOM 915 CD1 ILE A 63 -16.852 -2.272 3.934 1.00 0.00 C ATOM 0 H ILE A 63 -21.512 -2.712 3.405 1.00 0.00 H new ATOM 0 HA ILE A 63 -20.084 -0.874 5.282 1.00 0.00 H new ATOM 0 HB ILE A 63 -19.378 -1.882 2.574 1.00 0.00 H new ATOM 0 HG12 ILE A 63 -18.233 -1.519 5.381 1.00 0.00 H new ATOM 0 HG13 ILE A 63 -18.711 -3.041 4.655 1.00 0.00 H new ATOM 0 HG21 ILE A 63 -17.791 -0.095 2.439 1.00 0.00 H new ATOM 0 HG22 ILE A 63 -19.452 0.544 2.409 1.00 0.00 H new ATOM 0 HG23 ILE A 63 -18.475 0.672 3.892 1.00 0.00 H new ATOM 0 HD11 ILE A 63 -16.276 -2.811 4.686 1.00 0.00 H new ATOM 0 HD12 ILE A 63 -16.873 -2.849 3.010 1.00 0.00 H new ATOM 0 HD13 ILE A 63 -16.388 -1.304 3.746 1.00 0.00 H new ATOM 927 N ASP A 64 -21.870 0.754 4.707 1.00 0.00 N ATOM 928 CA ASP A 64 -22.513 2.016 4.510 1.00 0.00 C ATOM 929 C ASP A 64 -21.553 3.080 4.103 1.00 0.00 C ATOM 930 O ASP A 64 -20.374 2.880 3.818 1.00 0.00 O ATOM 931 CB ASP A 64 -23.413 2.384 5.702 1.00 0.00 C ATOM 932 CG ASP A 64 -22.735 2.173 7.048 1.00 0.00 C ATOM 933 OD1 ASP A 64 -22.491 0.998 7.429 1.00 0.00 O ATOM 934 OD2 ASP A 64 -22.570 3.181 7.786 1.00 0.00 O ATOM 0 H ASP A 64 -21.799 0.518 5.697 1.00 0.00 H new ATOM 0 HA ASP A 64 -23.189 1.922 3.660 1.00 0.00 H new ATOM 0 HB2 ASP A 64 -23.715 3.428 5.613 1.00 0.00 H new ATOM 0 HB3 ASP A 64 -24.323 1.785 5.662 1.00 0.00 H new ATOM 939 N PHE A 65 -22.111 4.295 3.951 1.00 0.00 N ATOM 940 CA PHE A 65 -21.498 5.444 3.360 1.00 0.00 C ATOM 941 C PHE A 65 -20.286 5.922 4.083 1.00 0.00 C ATOM 942 O PHE A 65 -19.194 5.959 3.518 1.00 0.00 O ATOM 943 CB PHE A 65 -22.474 6.573 2.990 1.00 0.00 C ATOM 944 CG PHE A 65 -21.785 7.664 2.244 1.00 0.00 C ATOM 945 CD1 PHE A 65 -21.654 7.449 0.892 1.00 0.00 C ATOM 946 CD2 PHE A 65 -21.504 8.853 2.875 1.00 0.00 C ATOM 947 CE1 PHE A 65 -20.936 8.422 0.236 1.00 0.00 C ATOM 948 CE2 PHE A 65 -20.768 9.774 2.167 1.00 0.00 C ATOM 949 CZ PHE A 65 -20.455 9.556 0.846 1.00 0.00 C ATOM 0 H PHE A 65 -23.062 4.487 4.265 1.00 0.00 H new ATOM 0 HA PHE A 65 -21.133 5.077 2.401 1.00 0.00 H new ATOM 0 HB2 PHE A 65 -23.285 6.171 2.383 1.00 0.00 H new ATOM 0 HB3 PHE A 65 -22.925 6.978 3.896 1.00 0.00 H new ATOM 0 HD1 PHE A 65 -22.077 6.592 0.390 1.00 0.00 H new ATOM 0 HD2 PHE A 65 -21.845 9.054 3.880 1.00 0.00 H new ATOM 0 HE1 PHE A 65 -20.739 8.287 -0.817 1.00 0.00 H new ATOM 0 HE2 PHE A 65 -20.432 10.678 2.654 1.00 0.00 H new ATOM 0 HZ PHE A 65 -19.845 10.260 0.300 1.00 0.00 H new ATOM 959 N PRO A 66 -20.281 6.279 5.333 1.00 0.00 N ATOM 960 CA PRO A 66 -19.042 6.663 5.944 1.00 0.00 C ATOM 961 C PRO A 66 -18.029 5.604 6.218 1.00 0.00 C ATOM 962 O PRO A 66 -16.878 5.934 6.500 1.00 0.00 O ATOM 963 CB PRO A 66 -19.399 7.268 7.300 1.00 0.00 C ATOM 964 CG PRO A 66 -20.745 6.589 7.598 1.00 0.00 C ATOM 965 CD PRO A 66 -21.418 6.461 6.222 1.00 0.00 C ATOM 0 HA PRO A 66 -18.569 7.321 5.215 1.00 0.00 H new ATOM 0 HB2 PRO A 66 -18.650 7.043 8.059 1.00 0.00 H new ATOM 0 HB3 PRO A 66 -19.489 8.353 7.253 1.00 0.00 H new ATOM 0 HG2 PRO A 66 -20.604 5.614 8.064 1.00 0.00 H new ATOM 0 HG3 PRO A 66 -21.349 7.185 8.282 1.00 0.00 H new ATOM 0 HD2 PRO A 66 -22.104 5.615 6.183 1.00 0.00 H new ATOM 0 HD3 PRO A 66 -21.994 7.351 5.967 1.00 0.00 H new ATOM 973 N GLU A 67 -18.428 4.320 6.197 1.00 0.00 N ATOM 974 CA GLU A 67 -17.614 3.146 6.270 1.00 0.00 C ATOM 975 C GLU A 67 -16.918 2.965 4.965 1.00 0.00 C ATOM 976 O GLU A 67 -15.842 2.372 4.897 1.00 0.00 O ATOM 977 CB GLU A 67 -18.527 1.955 6.605 1.00 0.00 C ATOM 978 CG GLU A 67 -17.860 0.783 7.328 1.00 0.00 C ATOM 979 CD GLU A 67 -18.999 0.129 8.096 1.00 0.00 C ATOM 980 OE1 GLU A 67 -19.602 0.767 9.000 1.00 0.00 O ATOM 981 OE2 GLU A 67 -19.434 -1.026 7.843 1.00 0.00 O ATOM 0 H GLU A 67 -19.417 4.083 6.122 1.00 0.00 H new ATOM 0 HA GLU A 67 -16.853 3.228 7.046 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -19.350 2.316 7.222 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -18.962 1.584 5.677 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -17.402 0.088 6.624 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -17.071 1.124 7.998 1.00 0.00 H new ATOM 988 N PHE A 68 -17.549 3.463 3.887 1.00 0.00 N ATOM 989 CA PHE A 68 -17.036 3.453 2.552 1.00 0.00 C ATOM 990 C PHE A 68 -15.818 4.311 2.535 1.00 0.00 C ATOM 991 O PHE A 68 -14.723 3.880 2.177 1.00 0.00 O ATOM 992 CB PHE A 68 -18.069 3.782 1.461 1.00 0.00 C ATOM 993 CG PHE A 68 -17.580 3.950 0.063 1.00 0.00 C ATOM 994 CD1 PHE A 68 -17.243 2.870 -0.718 1.00 0.00 C ATOM 995 CD2 PHE A 68 -17.364 5.174 -0.525 1.00 0.00 C ATOM 996 CE1 PHE A 68 -17.110 2.972 -2.083 1.00 0.00 C ATOM 997 CE2 PHE A 68 -17.150 5.306 -1.877 1.00 0.00 C ATOM 998 CZ PHE A 68 -16.987 4.203 -2.683 1.00 0.00 C ATOM 0 H PHE A 68 -18.470 3.897 3.951 1.00 0.00 H new ATOM 0 HA PHE A 68 -16.764 2.433 2.280 1.00 0.00 H new ATOM 0 HB2 PHE A 68 -18.818 2.990 1.460 1.00 0.00 H new ATOM 0 HB3 PHE A 68 -18.578 4.702 1.750 1.00 0.00 H new ATOM 0 HD1 PHE A 68 -17.078 1.913 -0.246 1.00 0.00 H new ATOM 0 HD2 PHE A 68 -17.362 6.059 0.094 1.00 0.00 H new ATOM 0 HE1 PHE A 68 -17.102 2.078 -2.689 1.00 0.00 H new ATOM 0 HE2 PHE A 68 -17.109 6.293 -2.314 1.00 0.00 H new ATOM 0 HZ PHE A 68 -16.773 4.300 -3.737 1.00 0.00 H new ATOM 1008 N LEU A 69 -15.943 5.494 3.163 1.00 0.00 N ATOM 1009 CA LEU A 69 -14.898 6.461 3.293 1.00 0.00 C ATOM 1010 C LEU A 69 -13.739 5.949 4.077 1.00 0.00 C ATOM 1011 O LEU A 69 -12.617 6.333 3.750 1.00 0.00 O ATOM 1012 CB LEU A 69 -15.425 7.665 4.092 1.00 0.00 C ATOM 1013 CG LEU A 69 -16.594 8.448 3.471 1.00 0.00 C ATOM 1014 CD1 LEU A 69 -17.137 9.674 4.224 1.00 0.00 C ATOM 1015 CD2 LEU A 69 -16.418 8.705 1.965 1.00 0.00 C ATOM 0 H LEU A 69 -16.815 5.790 3.601 1.00 0.00 H new ATOM 0 HA LEU A 69 -14.584 6.713 2.280 1.00 0.00 H new ATOM 0 HB2 LEU A 69 -15.737 7.311 5.075 1.00 0.00 H new ATOM 0 HB3 LEU A 69 -14.598 8.357 4.250 1.00 0.00 H new ATOM 0 HG LEU A 69 -17.409 7.737 3.605 1.00 0.00 H new ATOM 0 HD11 LEU A 69 -17.957 10.115 3.658 1.00 0.00 H new ATOM 0 HD12 LEU A 69 -17.498 9.368 5.206 1.00 0.00 H new ATOM 0 HD13 LEU A 69 -16.341 10.410 4.343 1.00 0.00 H new ATOM 0 HD21 LEU A 69 -17.276 9.261 1.588 1.00 0.00 H new ATOM 0 HD22 LEU A 69 -15.509 9.283 1.798 1.00 0.00 H new ATOM 0 HD23 LEU A 69 -16.344 7.753 1.440 1.00 0.00 H new ATOM 1027 N THR A 70 -13.967 5.137 5.125 1.00 0.00 N ATOM 1028 CA THR A 70 -13.032 4.449 5.960 1.00 0.00 C ATOM 1029 C THR A 70 -12.262 3.412 5.216 1.00 0.00 C ATOM 1030 O THR A 70 -11.114 3.084 5.510 1.00 0.00 O ATOM 1031 CB THR A 70 -13.677 3.899 7.198 1.00 0.00 C ATOM 1032 OG1 THR A 70 -14.457 4.767 8.007 1.00 0.00 O ATOM 1033 CG2 THR A 70 -12.638 3.408 8.220 1.00 0.00 C ATOM 0 H THR A 70 -14.924 4.942 5.419 1.00 0.00 H new ATOM 0 HA THR A 70 -12.306 5.192 6.290 1.00 0.00 H new ATOM 0 HB THR A 70 -14.312 3.147 6.731 1.00 0.00 H new ATOM 0 HG1 THR A 70 -15.202 5.125 7.480 1.00 0.00 H new ATOM 0 HG21 THR A 70 -13.149 3.018 9.100 1.00 0.00 H new ATOM 0 HG22 THR A 70 -12.033 2.619 7.773 1.00 0.00 H new ATOM 0 HG23 THR A 70 -11.995 4.238 8.512 1.00 0.00 H new ATOM 1041 N MET A 71 -12.939 2.759 4.255 1.00 0.00 N ATOM 1042 CA MET A 71 -12.449 1.727 3.396 1.00 0.00 C ATOM 1043 C MET A 71 -11.688 2.312 2.256 1.00 0.00 C ATOM 1044 O MET A 71 -10.683 1.757 1.817 1.00 0.00 O ATOM 1045 CB MET A 71 -13.503 0.743 2.861 1.00 0.00 C ATOM 1046 CG MET A 71 -12.892 -0.300 1.924 1.00 0.00 C ATOM 1047 SD MET A 71 -14.075 -1.640 1.593 1.00 0.00 S ATOM 1048 CE MET A 71 -13.541 -2.817 2.869 1.00 0.00 C ATOM 0 H MET A 71 -13.917 2.975 4.064 1.00 0.00 H new ATOM 0 HA MET A 71 -11.800 1.132 4.038 1.00 0.00 H new ATOM 0 HB2 MET A 71 -13.986 0.239 3.698 1.00 0.00 H new ATOM 0 HB3 MET A 71 -14.279 1.296 2.331 1.00 0.00 H new ATOM 0 HG2 MET A 71 -12.600 0.173 0.987 1.00 0.00 H new ATOM 0 HG3 MET A 71 -11.986 -0.710 2.370 1.00 0.00 H new ATOM 0 HE1 MET A 71 -14.160 -3.713 2.819 1.00 0.00 H new ATOM 0 HE2 MET A 71 -12.498 -3.086 2.702 1.00 0.00 H new ATOM 0 HE3 MET A 71 -13.644 -2.359 3.853 1.00 0.00 H new ATOM 1058 N MET A 72 -11.991 3.544 1.809 1.00 0.00 N ATOM 1059 CA MET A 72 -11.268 4.244 0.793 1.00 0.00 C ATOM 1060 C MET A 72 -10.006 4.822 1.334 1.00 0.00 C ATOM 1061 O MET A 72 -8.962 4.818 0.684 1.00 0.00 O ATOM 1062 CB MET A 72 -12.086 5.494 0.427 1.00 0.00 C ATOM 1063 CG MET A 72 -11.712 6.023 -0.959 1.00 0.00 C ATOM 1064 SD MET A 72 -11.686 4.866 -2.362 1.00 0.00 S ATOM 1065 CE MET A 72 -13.433 5.096 -2.798 1.00 0.00 C ATOM 0 H MET A 72 -12.779 4.078 2.175 1.00 0.00 H new ATOM 0 HA MET A 72 -11.082 3.548 -0.025 1.00 0.00 H new ATOM 0 HB2 MET A 72 -13.149 5.254 0.451 1.00 0.00 H new ATOM 0 HB3 MET A 72 -11.917 6.272 1.172 1.00 0.00 H new ATOM 0 HG2 MET A 72 -12.409 6.824 -1.205 1.00 0.00 H new ATOM 0 HG3 MET A 72 -10.722 6.473 -0.884 1.00 0.00 H new ATOM 0 HE1 MET A 72 -13.678 4.474 -3.659 1.00 0.00 H new ATOM 0 HE2 MET A 72 -14.060 4.810 -1.953 1.00 0.00 H new ATOM 0 HE3 MET A 72 -13.612 6.143 -3.044 1.00 0.00 H new ATOM 1075 N ALA A 73 -10.016 5.284 2.598 1.00 0.00 N ATOM 1076 CA ALA A 73 -8.874 5.606 3.396 1.00 0.00 C ATOM 1077 C ALA A 73 -7.894 4.516 3.666 1.00 0.00 C ATOM 1078 O ALA A 73 -6.700 4.761 3.830 1.00 0.00 O ATOM 1079 CB ALA A 73 -9.289 6.320 4.694 1.00 0.00 C ATOM 0 H ALA A 73 -10.890 5.444 3.098 1.00 0.00 H new ATOM 0 HA ALA A 73 -8.309 6.283 2.755 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -8.401 6.553 5.281 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -9.815 7.243 4.449 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -9.946 5.671 5.272 1.00 0.00 H new ATOM 1085 N ARG A 74 -8.317 3.240 3.624 1.00 0.00 N ATOM 1086 CA ARG A 74 -7.419 2.142 3.443 1.00 0.00 C ATOM 1087 C ARG A 74 -6.893 1.942 2.063 1.00 0.00 C ATOM 1088 O ARG A 74 -5.694 1.784 1.838 1.00 0.00 O ATOM 1089 CB ARG A 74 -8.219 0.929 3.946 1.00 0.00 C ATOM 1090 CG ARG A 74 -8.429 0.743 5.450 1.00 0.00 C ATOM 1091 CD ARG A 74 -7.237 0.372 6.335 1.00 0.00 C ATOM 1092 NE ARG A 74 -7.622 0.422 7.774 1.00 0.00 N ATOM 1093 CZ ARG A 74 -8.049 -0.637 8.522 1.00 0.00 C ATOM 1094 NH1 ARG A 74 -8.500 -1.795 7.959 1.00 0.00 N ATOM 1095 NH2 ARG A 74 -8.042 -0.591 9.887 1.00 0.00 N ATOM 0 H ARG A 74 -9.295 2.967 3.717 1.00 0.00 H new ATOM 0 HA ARG A 74 -6.495 2.322 3.992 1.00 0.00 H new ATOM 0 HB2 ARG A 74 -9.204 0.970 3.480 1.00 0.00 H new ATOM 0 HB3 ARG A 74 -7.726 0.032 3.571 1.00 0.00 H new ATOM 0 HG2 ARG A 74 -8.849 1.671 5.839 1.00 0.00 H new ATOM 0 HG3 ARG A 74 -9.187 -0.029 5.581 1.00 0.00 H new ATOM 0 HD2 ARG A 74 -6.885 -0.628 6.081 1.00 0.00 H new ATOM 0 HD3 ARG A 74 -6.411 1.058 6.149 1.00 0.00 H new ATOM 0 HE ARG A 74 -7.561 1.327 8.241 1.00 0.00 H new ATOM 0 HH11 ARG A 74 -8.527 -1.892 6.944 1.00 0.00 H new ATOM 0 HH12 ARG A 74 -8.811 -2.564 8.553 1.00 0.00 H new ATOM 0 HH21 ARG A 74 -7.713 0.247 10.367 1.00 0.00 H new ATOM 0 HH22 ARG A 74 -8.366 -1.394 10.426 1.00 0.00 H new ATOM 1109 N LYS A 75 -7.796 2.046 1.071 1.00 0.00 N ATOM 1110 CA LYS A 75 -7.437 1.680 -0.264 1.00 0.00 C ATOM 1111 C LYS A 75 -6.618 2.612 -1.088 1.00 0.00 C ATOM 1112 O LYS A 75 -5.989 2.270 -2.089 1.00 0.00 O ATOM 1113 CB LYS A 75 -8.644 1.111 -1.028 1.00 0.00 C ATOM 1114 CG LYS A 75 -9.225 -0.205 -0.505 1.00 0.00 C ATOM 1115 CD LYS A 75 -8.270 -1.359 -0.815 1.00 0.00 C ATOM 1116 CE LYS A 75 -8.999 -2.657 -0.461 1.00 0.00 C ATOM 1117 NZ LYS A 75 -8.123 -3.775 -0.878 1.00 0.00 N ATOM 0 H LYS A 75 -8.754 2.376 1.188 1.00 0.00 H new ATOM 0 HA LYS A 75 -6.696 0.900 -0.086 1.00 0.00 H new ATOM 0 HB2 LYS A 75 -9.436 1.860 -1.021 1.00 0.00 H new ATOM 0 HB3 LYS A 75 -8.352 0.965 -2.068 1.00 0.00 H new ATOM 0 HG2 LYS A 75 -9.390 -0.137 0.570 1.00 0.00 H new ATOM 0 HG3 LYS A 75 -10.195 -0.392 -0.965 1.00 0.00 H new ATOM 0 HD2 LYS A 75 -7.987 -1.352 -1.867 1.00 0.00 H new ATOM 0 HD3 LYS A 75 -7.351 -1.264 -0.237 1.00 0.00 H new ATOM 0 HE2 LYS A 75 -9.202 -2.705 0.609 1.00 0.00 H new ATOM 0 HE3 LYS A 75 -9.961 -2.710 -0.971 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 -8.584 -4.680 -0.654 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 -7.952 -3.718 -1.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 -7.217 -3.714 -0.371 1.00 0.00 H new ATOM 1131 N MET A 76 -6.702 3.900 -0.712 1.00 0.00 N ATOM 1132 CA MET A 76 -5.978 4.962 -1.339 1.00 0.00 C ATOM 1133 C MET A 76 -4.544 4.832 -0.955 1.00 0.00 C ATOM 1134 O MET A 76 -3.609 5.294 -1.608 1.00 0.00 O ATOM 1135 CB MET A 76 -6.596 6.355 -1.130 1.00 0.00 C ATOM 1136 CG MET A 76 -7.935 6.593 -1.830 1.00 0.00 C ATOM 1137 SD MET A 76 -8.006 6.461 -3.642 1.00 0.00 S ATOM 1138 CE MET A 76 -7.031 7.883 -4.211 1.00 0.00 C ATOM 0 H MET A 76 -7.295 4.214 0.056 1.00 0.00 H new ATOM 0 HA MET A 76 -6.049 4.863 -2.422 1.00 0.00 H new ATOM 0 HB2 MET A 76 -6.731 6.517 -0.061 1.00 0.00 H new ATOM 0 HB3 MET A 76 -5.885 7.105 -1.478 1.00 0.00 H new ATOM 0 HG2 MET A 76 -8.654 5.885 -1.418 1.00 0.00 H new ATOM 0 HG3 MET A 76 -8.278 7.591 -1.557 1.00 0.00 H new ATOM 0 HE1 MET A 76 -7.010 7.897 -5.301 1.00 0.00 H new ATOM 0 HE2 MET A 76 -7.484 8.804 -3.845 1.00 0.00 H new ATOM 0 HE3 MET A 76 -6.013 7.802 -3.830 1.00 0.00 H new ATOM 1148 N LYS A 77 -4.257 4.340 0.263 1.00 0.00 N ATOM 1149 CA LYS A 77 -2.931 4.161 0.768 1.00 0.00 C ATOM 1150 C LYS A 77 -2.468 2.773 0.486 1.00 0.00 C ATOM 1151 O LYS A 77 -1.491 2.657 -0.252 1.00 0.00 O ATOM 1152 CB LYS A 77 -2.797 4.209 2.299 1.00 0.00 C ATOM 1153 CG LYS A 77 -3.215 5.532 2.945 1.00 0.00 C ATOM 1154 CD LYS A 77 -2.580 6.761 2.289 1.00 0.00 C ATOM 1155 CE LYS A 77 -3.070 8.074 2.902 1.00 0.00 C ATOM 1156 NZ LYS A 77 -2.690 9.245 2.080 1.00 0.00 N ATOM 0 H LYS A 77 -4.979 4.055 0.924 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.377 4.972 0.294 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -3.399 3.407 2.726 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -1.760 4.005 2.564 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -4.300 5.624 2.896 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.944 5.513 4.001 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -1.496 6.701 2.386 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.805 6.756 1.222 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.154 8.042 3.008 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -2.655 8.184 3.904 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -3.041 10.114 2.531 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -1.654 9.291 1.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -3.107 9.154 1.132 1.00 0.00 H new ATOM 1170 N ASP A 78 -3.050 1.747 1.133 1.00 0.00 N ATOM 1171 CA ASP A 78 -2.581 0.396 1.114 1.00 0.00 C ATOM 1172 C ASP A 78 -3.051 -0.284 -0.126 1.00 0.00 C ATOM 1173 O ASP A 78 -3.821 -1.238 -0.222 1.00 0.00 O ATOM 1174 CB ASP A 78 -3.002 -0.247 2.446 1.00 0.00 C ATOM 1175 CG ASP A 78 -2.119 -1.424 2.836 1.00 0.00 C ATOM 1176 OD1 ASP A 78 -0.868 -1.279 2.787 1.00 0.00 O ATOM 1177 OD2 ASP A 78 -2.688 -2.392 3.406 1.00 0.00 O ATOM 0 H ASP A 78 -3.891 1.866 1.698 1.00 0.00 H new ATOM 0 HA ASP A 78 -1.496 0.313 1.058 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -2.967 0.505 3.234 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -4.036 -0.583 2.371 1.00 0.00 H new ATOM 1182 N THR A 79 -2.572 0.280 -1.249 1.00 0.00 N ATOM 1183 CA THR A 79 -3.029 -0.070 -2.558 1.00 0.00 C ATOM 1184 C THR A 79 -2.515 -1.368 -3.079 1.00 0.00 C ATOM 1185 O THR A 79 -3.061 -1.878 -4.056 1.00 0.00 O ATOM 1186 CB THR A 79 -2.719 1.003 -3.560 1.00 0.00 C ATOM 1187 OG1 THR A 79 -3.564 0.960 -4.701 1.00 0.00 O ATOM 1188 CG2 THR A 79 -1.243 1.158 -3.963 1.00 0.00 C ATOM 0 H THR A 79 -1.848 0.998 -1.247 1.00 0.00 H new ATOM 0 HA THR A 79 -4.106 -0.180 -2.432 1.00 0.00 H new ATOM 0 HB THR A 79 -2.942 1.911 -3.000 1.00 0.00 H new ATOM 0 HG1 THR A 79 -3.839 0.035 -4.870 1.00 0.00 H new ATOM 0 HG21 THR A 79 -1.147 1.964 -4.691 1.00 0.00 H new ATOM 0 HG22 THR A 79 -0.648 1.393 -3.081 1.00 0.00 H new ATOM 0 HG23 THR A 79 -0.886 0.227 -4.404 1.00 0.00 H new ATOM 1196 N ASP A 80 -1.355 -1.854 -2.603 1.00 0.00 N ATOM 1197 CA ASP A 80 -0.700 -3.056 -3.017 1.00 0.00 C ATOM 1198 C ASP A 80 0.057 -3.655 -1.882 1.00 0.00 C ATOM 1199 O ASP A 80 1.052 -3.094 -1.426 1.00 0.00 O ATOM 1200 CB ASP A 80 0.380 -2.760 -4.071 1.00 0.00 C ATOM 1201 CG ASP A 80 1.019 -3.992 -4.696 1.00 0.00 C ATOM 1202 OD1 ASP A 80 0.518 -5.134 -4.515 1.00 0.00 O ATOM 1203 OD2 ASP A 80 2.040 -3.769 -5.400 1.00 0.00 O ATOM 0 H ASP A 80 -0.836 -1.368 -1.872 1.00 0.00 H new ATOM 0 HA ASP A 80 -1.483 -3.712 -3.398 1.00 0.00 H new ATOM 0 HB2 ASP A 80 -0.062 -2.156 -4.863 1.00 0.00 H new ATOM 0 HB3 ASP A 80 1.162 -2.157 -3.609 1.00 0.00 H new ATOM 1208 N SER A 81 -0.344 -4.847 -1.404 1.00 0.00 N ATOM 1209 CA SER A 81 0.434 -5.763 -0.630 1.00 0.00 C ATOM 1210 C SER A 81 0.785 -5.287 0.738 1.00 0.00 C ATOM 1211 O SER A 81 0.018 -4.613 1.424 1.00 0.00 O ATOM 1212 CB SER A 81 1.571 -6.292 -1.520 1.00 0.00 C ATOM 1213 OG SER A 81 2.139 -7.493 -1.019 1.00 0.00 O ATOM 0 H SER A 81 -1.287 -5.196 -1.573 1.00 0.00 H new ATOM 0 HA SER A 81 -0.169 -6.626 -0.347 1.00 0.00 H new ATOM 0 HB2 SER A 81 1.190 -6.466 -2.526 1.00 0.00 H new ATOM 0 HB3 SER A 81 2.348 -5.532 -1.601 1.00 0.00 H new ATOM 0 HG SER A 81 2.855 -7.791 -1.618 1.00 0.00 H new ATOM 1219 N GLU A 82 2.076 -5.464 1.071 1.00 0.00 N ATOM 1220 CA GLU A 82 2.770 -4.880 2.177 1.00 0.00 C ATOM 1221 C GLU A 82 3.893 -4.046 1.666 1.00 0.00 C ATOM 1222 O GLU A 82 4.987 -4.016 2.228 1.00 0.00 O ATOM 1223 CB GLU A 82 3.287 -5.930 3.174 1.00 0.00 C ATOM 1224 CG GLU A 82 2.167 -6.886 3.591 1.00 0.00 C ATOM 1225 CD GLU A 82 2.774 -8.058 4.349 1.00 0.00 C ATOM 1226 OE1 GLU A 82 3.999 -8.348 4.294 1.00 0.00 O ATOM 1227 OE2 GLU A 82 1.966 -8.759 5.016 1.00 0.00 O ATOM 0 H GLU A 82 2.685 -6.068 0.518 1.00 0.00 H new ATOM 0 HA GLU A 82 2.062 -4.258 2.725 1.00 0.00 H new ATOM 0 HB2 GLU A 82 4.103 -6.494 2.723 1.00 0.00 H new ATOM 0 HB3 GLU A 82 3.692 -5.432 4.055 1.00 0.00 H new ATOM 0 HG2 GLU A 82 1.442 -6.367 4.218 1.00 0.00 H new ATOM 0 HG3 GLU A 82 1.630 -7.243 2.712 1.00 0.00 H new ATOM 1234 N GLU A 83 3.775 -3.447 0.467 1.00 0.00 N ATOM 1235 CA GLU A 83 4.655 -2.605 -0.281 1.00 0.00 C ATOM 1236 C GLU A 83 4.606 -1.200 0.212 1.00 0.00 C ATOM 1237 O GLU A 83 5.624 -0.613 0.575 1.00 0.00 O ATOM 1238 CB GLU A 83 4.201 -2.585 -1.751 1.00 0.00 C ATOM 1239 CG GLU A 83 4.564 -3.860 -2.514 1.00 0.00 C ATOM 1240 CD GLU A 83 6.074 -4.044 -2.575 1.00 0.00 C ATOM 1241 OE1 GLU A 83 6.873 -3.225 -3.102 1.00 0.00 O ATOM 1242 OE2 GLU A 83 6.520 -5.023 -1.920 1.00 0.00 O ATOM 0 H GLU A 83 2.912 -3.583 -0.059 1.00 0.00 H new ATOM 0 HA GLU A 83 5.666 -2.998 -0.173 1.00 0.00 H new ATOM 0 HB2 GLU A 83 3.121 -2.443 -1.789 1.00 0.00 H new ATOM 0 HB3 GLU A 83 4.653 -1.729 -2.252 1.00 0.00 H new ATOM 0 HG2 GLU A 83 4.108 -4.722 -2.028 1.00 0.00 H new ATOM 0 HG3 GLU A 83 4.158 -3.812 -3.524 1.00 0.00 H new ATOM 1249 N GLU A 84 3.392 -0.638 0.356 1.00 0.00 N ATOM 1250 CA GLU A 84 3.148 0.702 0.792 1.00 0.00 C ATOM 1251 C GLU A 84 3.630 1.042 2.161 1.00 0.00 C ATOM 1252 O GLU A 84 4.139 2.142 2.374 1.00 0.00 O ATOM 1253 CB GLU A 84 1.723 1.156 0.436 1.00 0.00 C ATOM 1254 CG GLU A 84 1.481 1.090 -1.073 1.00 0.00 C ATOM 1255 CD GLU A 84 2.126 2.316 -1.706 1.00 0.00 C ATOM 1256 OE1 GLU A 84 1.787 3.457 -1.294 1.00 0.00 O ATOM 1257 OE2 GLU A 84 2.894 2.089 -2.679 1.00 0.00 O ATOM 0 H GLU A 84 2.532 -1.149 0.156 1.00 0.00 H new ATOM 0 HA GLU A 84 3.812 1.337 0.206 1.00 0.00 H new ATOM 0 HB2 GLU A 84 0.998 0.525 0.951 1.00 0.00 H new ATOM 0 HB3 GLU A 84 1.565 2.175 0.788 1.00 0.00 H new ATOM 0 HG2 GLU A 84 1.908 0.177 -1.488 1.00 0.00 H new ATOM 0 HG3 GLU A 84 0.412 1.068 -1.287 1.00 0.00 H new ATOM 1264 N ILE A 85 3.530 0.067 3.081 1.00 0.00 N ATOM 1265 CA ILE A 85 4.101 0.214 4.384 1.00 0.00 C ATOM 1266 C ILE A 85 5.583 0.359 4.451 1.00 0.00 C ATOM 1267 O ILE A 85 6.183 1.288 4.989 1.00 0.00 O ATOM 1268 CB ILE A 85 3.675 -0.804 5.399 1.00 0.00 C ATOM 1269 CG1 ILE A 85 4.178 -2.254 5.298 1.00 0.00 C ATOM 1270 CG2 ILE A 85 2.147 -0.810 5.220 1.00 0.00 C ATOM 1271 CD1 ILE A 85 3.593 -3.203 6.343 1.00 0.00 C ATOM 0 H ILE A 85 3.055 -0.822 2.924 1.00 0.00 H new ATOM 0 HA ILE A 85 3.664 1.176 4.650 1.00 0.00 H new ATOM 0 HB ILE A 85 4.101 -0.506 6.357 1.00 0.00 H new ATOM 0 HG12 ILE A 85 3.943 -2.638 4.305 1.00 0.00 H new ATOM 0 HG13 ILE A 85 5.264 -2.256 5.392 1.00 0.00 H new ATOM 0 HG21 ILE A 85 1.702 -1.524 5.914 1.00 0.00 H new ATOM 0 HG22 ILE A 85 1.753 0.186 5.422 1.00 0.00 H new ATOM 0 HG23 ILE A 85 1.902 -1.097 4.197 1.00 0.00 H new ATOM 0 HD11 ILE A 85 4.003 -4.202 6.197 1.00 0.00 H new ATOM 0 HD12 ILE A 85 3.850 -2.848 7.341 1.00 0.00 H new ATOM 0 HD13 ILE A 85 2.509 -3.236 6.238 1.00 0.00 H new ATOM 1283 N ARG A 86 6.324 -0.615 3.894 1.00 0.00 N ATOM 1284 CA ARG A 86 7.741 -0.643 3.707 1.00 0.00 C ATOM 1285 C ARG A 86 8.313 0.627 3.178 1.00 0.00 C ATOM 1286 O ARG A 86 9.219 1.219 3.761 1.00 0.00 O ATOM 1287 CB ARG A 86 8.078 -1.944 2.960 1.00 0.00 C ATOM 1288 CG ARG A 86 9.565 -2.259 3.139 1.00 0.00 C ATOM 1289 CD ARG A 86 10.007 -3.366 2.180 1.00 0.00 C ATOM 1290 NE ARG A 86 9.902 -2.736 0.833 1.00 0.00 N ATOM 1291 CZ ARG A 86 9.070 -3.249 -0.119 1.00 0.00 C ATOM 1292 NH1 ARG A 86 8.152 -4.245 0.057 1.00 0.00 N ATOM 1293 NH2 ARG A 86 8.821 -2.443 -1.193 1.00 0.00 N ATOM 0 H ARG A 86 5.885 -1.465 3.541 1.00 0.00 H new ATOM 0 HA ARG A 86 8.264 -0.678 4.663 1.00 0.00 H new ATOM 0 HB2 ARG A 86 7.472 -2.765 3.344 1.00 0.00 H new ATOM 0 HB3 ARG A 86 7.841 -1.841 1.901 1.00 0.00 H new ATOM 0 HG2 ARG A 86 10.155 -1.360 2.960 1.00 0.00 H new ATOM 0 HG3 ARG A 86 9.755 -2.566 4.168 1.00 0.00 H new ATOM 0 HD2 ARG A 86 11.025 -3.693 2.390 1.00 0.00 H new ATOM 0 HD3 ARG A 86 9.367 -4.244 2.261 1.00 0.00 H new ATOM 0 HE ARG A 86 10.460 -1.909 0.620 1.00 0.00 H new ATOM 0 HH11 ARG A 86 8.040 -4.680 0.973 1.00 0.00 H new ATOM 0 HH12 ARG A 86 7.578 -4.554 -0.728 1.00 0.00 H new ATOM 0 HH21 ARG A 86 9.249 -1.519 -1.247 1.00 0.00 H new ATOM 0 HH22 ARG A 86 8.207 -2.765 -1.941 1.00 0.00 H new ATOM 1307 N GLU A 87 7.667 1.145 2.118 1.00 0.00 N ATOM 1308 CA GLU A 87 8.092 2.378 1.532 1.00 0.00 C ATOM 1309 C GLU A 87 7.562 3.627 2.149 1.00 0.00 C ATOM 1310 O GLU A 87 8.122 4.709 1.981 1.00 0.00 O ATOM 1311 CB GLU A 87 7.872 2.431 0.010 1.00 0.00 C ATOM 1312 CG GLU A 87 8.295 1.147 -0.707 1.00 0.00 C ATOM 1313 CD GLU A 87 9.793 0.887 -0.654 1.00 0.00 C ATOM 1314 OE1 GLU A 87 10.519 1.713 -1.269 1.00 0.00 O ATOM 1315 OE2 GLU A 87 10.156 -0.174 -0.079 1.00 0.00 O ATOM 0 H GLU A 87 6.858 0.715 1.670 1.00 0.00 H new ATOM 0 HA GLU A 87 9.159 2.365 1.754 1.00 0.00 H new ATOM 0 HB2 GLU A 87 6.818 2.621 -0.191 1.00 0.00 H new ATOM 0 HB3 GLU A 87 8.432 3.271 -0.402 1.00 0.00 H new ATOM 0 HG2 GLU A 87 7.772 0.302 -0.260 1.00 0.00 H new ATOM 0 HG3 GLU A 87 7.981 1.202 -1.749 1.00 0.00 H new ATOM 1322 N ALA A 88 6.490 3.534 2.956 1.00 0.00 N ATOM 1323 CA ALA A 88 6.070 4.656 3.738 1.00 0.00 C ATOM 1324 C ALA A 88 7.027 4.987 4.830 1.00 0.00 C ATOM 1325 O ALA A 88 7.218 6.176 5.084 1.00 0.00 O ATOM 1326 CB ALA A 88 4.744 4.358 4.458 1.00 0.00 C ATOM 0 H ALA A 88 5.921 2.695 3.067 1.00 0.00 H new ATOM 0 HA ALA A 88 5.990 5.478 3.026 1.00 0.00 H new ATOM 0 HB1 ALA A 88 4.446 5.226 5.046 1.00 0.00 H new ATOM 0 HB2 ALA A 88 3.972 4.136 3.721 1.00 0.00 H new ATOM 0 HB3 ALA A 88 4.873 3.500 5.118 1.00 0.00 H new ATOM 1332 N PHE A 89 7.642 3.965 5.452 1.00 0.00 N ATOM 1333 CA PHE A 89 8.648 4.116 6.456 1.00 0.00 C ATOM 1334 C PHE A 89 9.771 4.865 5.824 1.00 0.00 C ATOM 1335 O PHE A 89 10.218 5.898 6.318 1.00 0.00 O ATOM 1336 CB PHE A 89 9.051 2.771 7.083 1.00 0.00 C ATOM 1337 CG PHE A 89 9.781 2.990 8.363 1.00 0.00 C ATOM 1338 CD1 PHE A 89 11.006 3.609 8.444 1.00 0.00 C ATOM 1339 CD2 PHE A 89 9.100 2.820 9.545 1.00 0.00 C ATOM 1340 CE1 PHE A 89 11.443 4.096 9.654 1.00 0.00 C ATOM 1341 CE2 PHE A 89 9.515 3.249 10.783 1.00 0.00 C ATOM 1342 CZ PHE A 89 10.710 3.930 10.805 1.00 0.00 C ATOM 0 H PHE A 89 7.428 2.989 5.245 1.00 0.00 H new ATOM 0 HA PHE A 89 8.278 4.684 7.310 1.00 0.00 H new ATOM 0 HB2 PHE A 89 8.162 2.166 7.263 1.00 0.00 H new ATOM 0 HB3 PHE A 89 9.680 2.214 6.389 1.00 0.00 H new ATOM 0 HD1 PHE A 89 11.622 3.712 7.563 1.00 0.00 H new ATOM 0 HD2 PHE A 89 8.153 2.303 9.496 1.00 0.00 H new ATOM 0 HE1 PHE A 89 12.385 4.622 9.701 1.00 0.00 H new ATOM 0 HE2 PHE A 89 8.941 3.064 11.679 1.00 0.00 H new ATOM 0 HZ PHE A 89 11.076 4.338 11.736 1.00 0.00 H new ATOM 1352 N ARG A 90 10.178 4.500 4.594 1.00 0.00 N ATOM 1353 CA ARG A 90 11.347 5.012 3.950 1.00 0.00 C ATOM 1354 C ARG A 90 11.114 6.360 3.359 1.00 0.00 C ATOM 1355 O ARG A 90 11.988 7.211 3.524 1.00 0.00 O ATOM 1356 CB ARG A 90 11.753 3.903 2.965 1.00 0.00 C ATOM 1357 CG ARG A 90 13.026 4.135 2.149 1.00 0.00 C ATOM 1358 CD ARG A 90 14.383 3.991 2.842 1.00 0.00 C ATOM 1359 NE ARG A 90 14.597 5.280 3.559 1.00 0.00 N ATOM 1360 CZ ARG A 90 15.871 5.749 3.693 1.00 0.00 C ATOM 1361 NH1 ARG A 90 16.952 5.099 3.170 1.00 0.00 N ATOM 1362 NH2 ARG A 90 16.014 6.994 4.235 1.00 0.00 N ATOM 0 H ARG A 90 9.672 3.821 4.026 1.00 0.00 H new ATOM 0 HA ARG A 90 12.173 5.215 4.632 1.00 0.00 H new ATOM 0 HB2 ARG A 90 11.874 2.977 3.527 1.00 0.00 H new ATOM 0 HB3 ARG A 90 10.928 3.748 2.270 1.00 0.00 H new ATOM 0 HG2 ARG A 90 13.010 3.442 1.308 1.00 0.00 H new ATOM 0 HG3 ARG A 90 12.973 5.141 1.734 1.00 0.00 H new ATOM 0 HD2 ARG A 90 14.383 3.150 3.536 1.00 0.00 H new ATOM 0 HD3 ARG A 90 15.177 3.807 2.118 1.00 0.00 H new ATOM 0 HE ARG A 90 13.808 5.800 3.941 1.00 0.00 H new ATOM 0 HH11 ARG A 90 16.823 4.228 2.656 1.00 0.00 H new ATOM 0 HH12 ARG A 90 17.888 5.485 3.294 1.00 0.00 H new ATOM 0 HH21 ARG A 90 15.190 7.525 4.517 1.00 0.00 H new ATOM 0 HH22 ARG A 90 16.945 7.393 4.358 1.00 0.00 H new ATOM 1376 N VAL A 91 9.917 6.754 2.890 1.00 0.00 N ATOM 1377 CA VAL A 91 9.599 8.093 2.503 1.00 0.00 C ATOM 1378 C VAL A 91 9.659 8.997 3.685 1.00 0.00 C ATOM 1379 O VAL A 91 10.059 10.154 3.561 1.00 0.00 O ATOM 1380 CB VAL A 91 8.268 8.163 1.814 1.00 0.00 C ATOM 1381 CG1 VAL A 91 7.387 9.383 2.129 1.00 0.00 C ATOM 1382 CG2 VAL A 91 8.551 8.048 0.306 1.00 0.00 C ATOM 0 H VAL A 91 9.135 6.109 2.775 1.00 0.00 H new ATOM 0 HA VAL A 91 10.343 8.430 1.782 1.00 0.00 H new ATOM 0 HB VAL A 91 7.661 7.344 2.199 1.00 0.00 H new ATOM 0 HG11 VAL A 91 6.455 9.313 1.568 1.00 0.00 H new ATOM 0 HG12 VAL A 91 7.168 9.407 3.196 1.00 0.00 H new ATOM 0 HG13 VAL A 91 7.913 10.295 1.846 1.00 0.00 H new ATOM 0 HG21 VAL A 91 7.612 8.093 -0.245 1.00 0.00 H new ATOM 0 HG22 VAL A 91 9.195 8.870 -0.007 1.00 0.00 H new ATOM 0 HG23 VAL A 91 9.047 7.099 0.100 1.00 0.00 H new ATOM 1392 N PHE A 92 9.367 8.496 4.899 1.00 0.00 N ATOM 1393 CA PHE A 92 9.403 9.369 6.031 1.00 0.00 C ATOM 1394 C PHE A 92 10.772 9.463 6.613 1.00 0.00 C ATOM 1395 O PHE A 92 11.257 10.583 6.766 1.00 0.00 O ATOM 1396 CB PHE A 92 8.489 8.874 7.165 1.00 0.00 C ATOM 1397 CG PHE A 92 7.034 8.989 6.860 1.00 0.00 C ATOM 1398 CD1 PHE A 92 6.580 10.206 6.409 1.00 0.00 C ATOM 1399 CD2 PHE A 92 6.140 7.966 7.069 1.00 0.00 C ATOM 1400 CE1 PHE A 92 5.250 10.411 6.128 1.00 0.00 C ATOM 1401 CE2 PHE A 92 4.826 8.125 6.696 1.00 0.00 C ATOM 1402 CZ PHE A 92 4.387 9.346 6.241 1.00 0.00 C ATOM 0 H PHE A 92 9.116 7.527 5.094 1.00 0.00 H new ATOM 0 HA PHE A 92 9.070 10.337 5.657 1.00 0.00 H new ATOM 0 HB2 PHE A 92 8.724 7.832 7.380 1.00 0.00 H new ATOM 0 HB3 PHE A 92 8.707 9.443 8.069 1.00 0.00 H new ATOM 0 HD1 PHE A 92 7.281 11.016 6.273 1.00 0.00 H new ATOM 0 HD2 PHE A 92 6.468 7.043 7.524 1.00 0.00 H new ATOM 0 HE1 PHE A 92 4.892 11.384 5.826 1.00 0.00 H new ATOM 0 HE2 PHE A 92 4.141 7.293 6.760 1.00 0.00 H new ATOM 0 HZ PHE A 92 3.349 9.471 5.968 1.00 0.00 H new ATOM 1412 N ASP A 93 11.510 8.364 6.850 1.00 0.00 N ATOM 1413 CA ASP A 93 12.864 8.281 7.302 1.00 0.00 C ATOM 1414 C ASP A 93 13.822 8.901 6.344 1.00 0.00 C ATOM 1415 O ASP A 93 14.078 8.410 5.246 1.00 0.00 O ATOM 1416 CB ASP A 93 13.274 6.838 7.643 1.00 0.00 C ATOM 1417 CG ASP A 93 14.600 6.720 8.380 1.00 0.00 C ATOM 1418 OD1 ASP A 93 15.278 7.759 8.603 1.00 0.00 O ATOM 1419 OD2 ASP A 93 14.986 5.537 8.576 1.00 0.00 O ATOM 0 H ASP A 93 11.112 7.435 6.709 1.00 0.00 H new ATOM 0 HA ASP A 93 12.911 8.861 8.224 1.00 0.00 H new ATOM 0 HB2 ASP A 93 12.492 6.385 8.252 1.00 0.00 H new ATOM 0 HB3 ASP A 93 13.333 6.262 6.720 1.00 0.00 H new ATOM 1424 N LYS A 94 14.393 10.060 6.719 1.00 0.00 N ATOM 1425 CA LYS A 94 15.231 10.866 5.885 1.00 0.00 C ATOM 1426 C LYS A 94 16.622 10.400 5.624 1.00 0.00 C ATOM 1427 O LYS A 94 17.127 10.278 4.509 1.00 0.00 O ATOM 1428 CB LYS A 94 15.080 12.348 6.267 1.00 0.00 C ATOM 1429 CG LYS A 94 15.617 13.324 5.218 1.00 0.00 C ATOM 1430 CD LYS A 94 15.263 14.780 5.532 1.00 0.00 C ATOM 1431 CE LYS A 94 15.806 15.795 4.524 1.00 0.00 C ATOM 1432 NZ LYS A 94 15.119 15.738 3.215 1.00 0.00 N ATOM 0 H LYS A 94 14.264 10.455 7.651 1.00 0.00 H new ATOM 0 HA LYS A 94 14.846 10.731 4.874 1.00 0.00 H new ATOM 0 HB2 LYS A 94 14.025 12.562 6.439 1.00 0.00 H new ATOM 0 HB3 LYS A 94 15.599 12.523 7.209 1.00 0.00 H new ATOM 0 HG2 LYS A 94 16.700 13.223 5.154 1.00 0.00 H new ATOM 0 HG3 LYS A 94 15.214 13.059 4.241 1.00 0.00 H new ATOM 0 HD2 LYS A 94 14.178 14.876 5.577 1.00 0.00 H new ATOM 0 HD3 LYS A 94 15.646 15.029 6.522 1.00 0.00 H new ATOM 0 HE2 LYS A 94 15.704 16.798 4.937 1.00 0.00 H new ATOM 0 HE3 LYS A 94 16.871 15.617 4.377 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 15.696 16.223 2.499 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 14.984 14.745 2.937 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 14.193 16.206 3.288 1.00 0.00 H new ATOM 1446 N ASP A 95 17.312 10.084 6.734 1.00 0.00 N ATOM 1447 CA ASP A 95 18.605 9.513 6.953 1.00 0.00 C ATOM 1448 C ASP A 95 18.729 8.054 6.678 1.00 0.00 C ATOM 1449 O ASP A 95 19.582 7.568 5.936 1.00 0.00 O ATOM 1450 CB ASP A 95 19.217 9.884 8.315 1.00 0.00 C ATOM 1451 CG ASP A 95 18.072 9.682 9.297 1.00 0.00 C ATOM 1452 OD1 ASP A 95 17.807 8.572 9.830 1.00 0.00 O ATOM 1453 OD2 ASP A 95 17.299 10.664 9.461 1.00 0.00 O ATOM 0 H ASP A 95 16.874 10.266 7.637 1.00 0.00 H new ATOM 0 HA ASP A 95 19.203 9.993 6.178 1.00 0.00 H new ATOM 0 HB2 ASP A 95 20.068 9.248 8.557 1.00 0.00 H new ATOM 0 HB3 ASP A 95 19.575 10.913 8.325 1.00 0.00 H new ATOM 1458 N GLY A 96 17.778 7.287 7.240 1.00 0.00 N ATOM 1459 CA GLY A 96 17.754 5.860 7.157 1.00 0.00 C ATOM 1460 C GLY A 96 18.243 5.172 8.385 1.00 0.00 C ATOM 1461 O GLY A 96 18.925 4.163 8.217 1.00 0.00 O ATOM 0 H GLY A 96 16.998 7.674 7.771 1.00 0.00 H new ATOM 0 HA2 GLY A 96 16.734 5.536 6.953 1.00 0.00 H new ATOM 0 HA3 GLY A 96 18.364 5.545 6.310 1.00 0.00 H new ATOM 1465 N ASN A 97 17.958 5.631 9.617 1.00 0.00 N ATOM 1466 CA ASN A 97 18.344 4.967 10.823 1.00 0.00 C ATOM 1467 C ASN A 97 17.336 4.001 11.342 1.00 0.00 C ATOM 1468 O ASN A 97 17.533 3.154 12.212 1.00 0.00 O ATOM 1469 CB ASN A 97 18.729 5.986 11.909 1.00 0.00 C ATOM 1470 CG ASN A 97 17.592 6.833 12.462 1.00 0.00 C ATOM 1471 OD1 ASN A 97 16.531 7.108 11.904 1.00 0.00 O ATOM 1472 ND2 ASN A 97 17.991 7.462 13.599 1.00 0.00 N ATOM 0 H ASN A 97 17.441 6.495 9.779 1.00 0.00 H new ATOM 0 HA ASN A 97 19.216 4.368 10.559 1.00 0.00 H new ATOM 0 HB2 ASN A 97 19.191 5.448 12.737 1.00 0.00 H new ATOM 0 HB3 ASN A 97 19.487 6.654 11.500 1.00 0.00 H new ATOM 0 HD21 ASN A 97 17.404 8.186 14.014 1.00 0.00 H new ATOM 0 HD22 ASN A 97 18.877 7.210 14.037 1.00 0.00 H new ATOM 1479 N GLY A 98 16.193 3.920 10.637 1.00 0.00 N ATOM 1480 CA GLY A 98 15.100 3.018 10.826 1.00 0.00 C ATOM 1481 C GLY A 98 14.071 3.530 11.773 1.00 0.00 C ATOM 1482 O GLY A 98 13.184 2.900 12.349 1.00 0.00 O ATOM 0 H GLY A 98 16.020 4.552 9.856 1.00 0.00 H new ATOM 0 HA2 GLY A 98 14.631 2.820 9.862 1.00 0.00 H new ATOM 0 HA3 GLY A 98 15.483 2.067 11.196 1.00 0.00 H new ATOM 1486 N TYR A 99 14.185 4.843 12.041 1.00 0.00 N ATOM 1487 CA TYR A 99 13.333 5.585 12.918 1.00 0.00 C ATOM 1488 C TYR A 99 12.957 6.825 12.182 1.00 0.00 C ATOM 1489 O TYR A 99 13.570 7.349 11.253 1.00 0.00 O ATOM 1490 CB TYR A 99 13.961 6.065 14.237 1.00 0.00 C ATOM 1491 CG TYR A 99 14.387 4.897 15.059 1.00 0.00 C ATOM 1492 CD1 TYR A 99 15.553 4.268 14.691 1.00 0.00 C ATOM 1493 CD2 TYR A 99 13.633 4.391 16.091 1.00 0.00 C ATOM 1494 CE1 TYR A 99 15.974 3.128 15.335 1.00 0.00 C ATOM 1495 CE2 TYR A 99 14.136 3.376 16.871 1.00 0.00 C ATOM 1496 CZ TYR A 99 15.269 2.724 16.444 1.00 0.00 C ATOM 1497 OH TYR A 99 15.805 1.678 17.224 1.00 0.00 O ATOM 0 H TYR A 99 14.914 5.420 11.621 1.00 0.00 H new ATOM 0 HA TYR A 99 12.521 4.909 13.187 1.00 0.00 H new ATOM 0 HB2 TYR A 99 14.819 6.704 14.028 1.00 0.00 H new ATOM 0 HB3 TYR A 99 13.242 6.667 14.793 1.00 0.00 H new ATOM 0 HD1 TYR A 99 16.146 4.675 13.885 1.00 0.00 H new ATOM 0 HD2 TYR A 99 12.649 4.789 16.289 1.00 0.00 H new ATOM 0 HE1 TYR A 99 16.828 2.570 14.982 1.00 0.00 H new ATOM 0 HE2 TYR A 99 13.653 3.098 17.796 1.00 0.00 H new ATOM 0 HH TYR A 99 15.207 1.493 17.978 1.00 0.00 H new ATOM 1507 N ILE A 100 11.770 7.289 12.610 1.00 0.00 N ATOM 1508 CA ILE A 100 11.065 8.477 12.237 1.00 0.00 C ATOM 1509 C ILE A 100 11.045 9.298 13.480 1.00 0.00 C ATOM 1510 O ILE A 100 10.397 8.846 14.423 1.00 0.00 O ATOM 1511 CB ILE A 100 9.667 8.196 11.773 1.00 0.00 C ATOM 1512 CG1 ILE A 100 9.736 7.443 10.434 1.00 0.00 C ATOM 1513 CG2 ILE A 100 8.781 9.449 11.668 1.00 0.00 C ATOM 1514 CD1 ILE A 100 8.558 6.530 10.096 1.00 0.00 C ATOM 0 H ILE A 100 11.241 6.762 13.305 1.00 0.00 H new ATOM 0 HA ILE A 100 11.549 8.976 11.397 1.00 0.00 H new ATOM 0 HB ILE A 100 9.184 7.579 12.531 1.00 0.00 H new ATOM 0 HG12 ILE A 100 9.836 8.178 9.635 1.00 0.00 H new ATOM 0 HG13 ILE A 100 10.645 6.841 10.429 1.00 0.00 H new ATOM 0 HG21 ILE A 100 7.786 9.164 11.326 1.00 0.00 H new ATOM 0 HG22 ILE A 100 8.706 9.925 12.646 1.00 0.00 H new ATOM 0 HG23 ILE A 100 9.222 10.148 10.957 1.00 0.00 H new ATOM 0 HD11 ILE A 100 8.729 6.059 9.128 1.00 0.00 H new ATOM 0 HD12 ILE A 100 8.462 5.761 10.862 1.00 0.00 H new ATOM 0 HD13 ILE A 100 7.641 7.118 10.056 1.00 0.00 H new ATOM 1526 N SER A 101 11.466 10.574 13.520 1.00 0.00 N ATOM 1527 CA SER A 101 11.140 11.503 14.557 1.00 0.00 C ATOM 1528 C SER A 101 9.966 12.276 14.062 1.00 0.00 C ATOM 1529 O SER A 101 9.735 12.296 12.854 1.00 0.00 O ATOM 1530 CB SER A 101 12.385 12.345 14.884 1.00 0.00 C ATOM 1531 OG SER A 101 12.947 13.122 13.836 1.00 0.00 O ATOM 0 H SER A 101 12.061 10.977 12.796 1.00 0.00 H new ATOM 0 HA SER A 101 10.861 11.037 15.502 1.00 0.00 H new ATOM 0 HB2 SER A 101 12.130 13.019 15.702 1.00 0.00 H new ATOM 0 HB3 SER A 101 13.158 11.672 15.255 1.00 0.00 H new ATOM 0 HG SER A 101 13.728 13.609 14.172 1.00 0.00 H new ATOM 1537 N ALA A 102 9.314 13.011 14.979 1.00 0.00 N ATOM 1538 CA ALA A 102 8.266 13.884 14.548 1.00 0.00 C ATOM 1539 C ALA A 102 8.618 14.861 13.479 1.00 0.00 C ATOM 1540 O ALA A 102 7.878 15.165 12.545 1.00 0.00 O ATOM 1541 CB ALA A 102 7.683 14.655 15.744 1.00 0.00 C ATOM 0 H ALA A 102 9.501 13.005 15.982 1.00 0.00 H new ATOM 0 HA ALA A 102 7.537 13.208 14.101 1.00 0.00 H new ATOM 0 HB1 ALA A 102 6.887 15.315 15.399 1.00 0.00 H new ATOM 0 HB2 ALA A 102 7.280 13.949 16.470 1.00 0.00 H new ATOM 0 HB3 ALA A 102 8.468 15.248 16.212 1.00 0.00 H new ATOM 1547 N ALA A 103 9.827 15.450 13.480 1.00 0.00 N ATOM 1548 CA ALA A 103 10.385 16.247 12.432 1.00 0.00 C ATOM 1549 C ALA A 103 10.421 15.677 11.056 1.00 0.00 C ATOM 1550 O ALA A 103 10.183 16.388 10.081 1.00 0.00 O ATOM 1551 CB ALA A 103 11.797 16.542 12.967 1.00 0.00 C ATOM 0 H ALA A 103 10.461 15.362 14.274 1.00 0.00 H new ATOM 0 HA ALA A 103 9.747 17.112 12.250 1.00 0.00 H new ATOM 0 HB1 ALA A 103 12.338 17.155 12.247 1.00 0.00 H new ATOM 0 HB2 ALA A 103 11.723 17.076 13.915 1.00 0.00 H new ATOM 0 HB3 ALA A 103 12.332 15.604 13.120 1.00 0.00 H new ATOM 1557 N GLU A 104 10.759 14.386 10.894 1.00 0.00 N ATOM 1558 CA GLU A 104 10.770 13.708 9.635 1.00 0.00 C ATOM 1559 C GLU A 104 9.377 13.483 9.155 1.00 0.00 C ATOM 1560 O GLU A 104 9.138 13.698 7.968 1.00 0.00 O ATOM 1561 CB GLU A 104 11.511 12.368 9.779 1.00 0.00 C ATOM 1562 CG GLU A 104 12.989 12.531 10.139 1.00 0.00 C ATOM 1563 CD GLU A 104 13.735 11.219 10.336 1.00 0.00 C ATOM 1564 OE1 GLU A 104 13.644 10.634 11.448 1.00 0.00 O ATOM 1565 OE2 GLU A 104 14.512 10.824 9.426 1.00 0.00 O ATOM 0 H GLU A 104 11.036 13.789 11.673 1.00 0.00 H new ATOM 0 HA GLU A 104 11.288 14.325 8.901 1.00 0.00 H new ATOM 0 HB2 GLU A 104 11.021 11.770 10.547 1.00 0.00 H new ATOM 0 HB3 GLU A 104 11.431 11.814 8.844 1.00 0.00 H new ATOM 0 HG2 GLU A 104 13.482 13.101 9.351 1.00 0.00 H new ATOM 0 HG3 GLU A 104 13.065 13.119 11.053 1.00 0.00 H new ATOM 1572 N LEU A 105 8.433 13.108 10.036 1.00 0.00 N ATOM 1573 CA LEU A 105 7.035 13.081 9.732 1.00 0.00 C ATOM 1574 C LEU A 105 6.505 14.418 9.347 1.00 0.00 C ATOM 1575 O LEU A 105 5.705 14.526 8.418 1.00 0.00 O ATOM 1576 CB LEU A 105 6.273 12.317 10.829 1.00 0.00 C ATOM 1577 CG LEU A 105 4.737 12.396 10.852 1.00 0.00 C ATOM 1578 CD1 LEU A 105 4.221 11.710 9.576 1.00 0.00 C ATOM 1579 CD2 LEU A 105 4.068 11.794 12.099 1.00 0.00 C ATOM 0 H LEU A 105 8.648 12.815 10.989 1.00 0.00 H new ATOM 0 HA LEU A 105 6.863 12.507 8.821 1.00 0.00 H new ATOM 0 HB2 LEU A 105 6.549 11.265 10.752 1.00 0.00 H new ATOM 0 HB3 LEU A 105 6.637 12.672 11.793 1.00 0.00 H new ATOM 0 HG LEU A 105 4.466 13.451 10.892 1.00 0.00 H new ATOM 0 HD11 LEU A 105 3.132 11.747 9.558 1.00 0.00 H new ATOM 0 HD12 LEU A 105 4.616 12.225 8.701 1.00 0.00 H new ATOM 0 HD13 LEU A 105 4.549 10.671 9.564 1.00 0.00 H new ATOM 0 HD21 LEU A 105 2.986 11.900 12.018 1.00 0.00 H new ATOM 0 HD22 LEU A 105 4.325 10.737 12.175 1.00 0.00 H new ATOM 0 HD23 LEU A 105 4.418 12.318 12.988 1.00 0.00 H new ATOM 1591 N ARG A 106 6.989 15.522 9.944 1.00 0.00 N ATOM 1592 CA ARG A 106 6.595 16.830 9.522 1.00 0.00 C ATOM 1593 C ARG A 106 7.010 17.344 8.186 1.00 0.00 C ATOM 1594 O ARG A 106 6.246 17.802 7.337 1.00 0.00 O ATOM 1595 CB ARG A 106 6.876 17.757 10.717 1.00 0.00 C ATOM 1596 CG ARG A 106 6.122 19.086 10.641 1.00 0.00 C ATOM 1597 CD ARG A 106 6.704 20.129 11.598 1.00 0.00 C ATOM 1598 NE ARG A 106 5.730 21.256 11.566 1.00 0.00 N ATOM 1599 CZ ARG A 106 5.288 21.935 12.665 1.00 0.00 C ATOM 1600 NH1 ARG A 106 5.856 21.790 13.897 1.00 0.00 N ATOM 1601 NH2 ARG A 106 4.293 22.844 12.449 1.00 0.00 N ATOM 0 H ARG A 106 7.653 15.509 10.718 1.00 0.00 H new ATOM 0 HA ARG A 106 5.536 16.783 9.270 1.00 0.00 H new ATOM 0 HB2 ARG A 106 6.602 17.244 11.639 1.00 0.00 H new ATOM 0 HB3 ARG A 106 7.946 17.957 10.770 1.00 0.00 H new ATOM 0 HG2 ARG A 106 6.161 19.468 9.621 1.00 0.00 H new ATOM 0 HG3 ARG A 106 5.071 18.921 10.879 1.00 0.00 H new ATOM 0 HD2 ARG A 106 6.811 19.726 12.605 1.00 0.00 H new ATOM 0 HD3 ARG A 106 7.694 20.452 11.277 1.00 0.00 H new ATOM 0 HE ARG A 106 5.367 21.541 10.657 1.00 0.00 H new ATOM 0 HH11 ARG A 106 6.643 21.154 14.024 1.00 0.00 H new ATOM 0 HH12 ARG A 106 5.493 22.318 14.691 1.00 0.00 H new ATOM 0 HH21 ARG A 106 3.924 22.983 11.508 1.00 0.00 H new ATOM 0 HH22 ARG A 106 3.918 23.385 13.228 1.00 0.00 H new ATOM 1615 N HIS A 107 8.311 17.228 7.869 1.00 0.00 N ATOM 1616 CA HIS A 107 9.025 17.567 6.676 1.00 0.00 C ATOM 1617 C HIS A 107 8.412 16.956 5.463 1.00 0.00 C ATOM 1618 O HIS A 107 8.415 17.515 4.368 1.00 0.00 O ATOM 1619 CB HIS A 107 10.392 16.884 6.848 1.00 0.00 C ATOM 1620 CG HIS A 107 11.356 17.038 5.709 1.00 0.00 C ATOM 1621 ND1 HIS A 107 11.813 18.237 5.202 1.00 0.00 N ATOM 1622 CD2 HIS A 107 11.874 16.097 4.875 1.00 0.00 C ATOM 1623 CE1 HIS A 107 12.563 17.964 4.101 1.00 0.00 C ATOM 1624 NE2 HIS A 107 12.605 16.668 3.853 1.00 0.00 N ATOM 0 H HIS A 107 8.954 16.837 8.557 1.00 0.00 H new ATOM 0 HA HIS A 107 9.046 18.649 6.546 1.00 0.00 H new ATOM 0 HB2 HIS A 107 10.861 17.278 7.750 1.00 0.00 H new ATOM 0 HB3 HIS A 107 10.225 15.820 7.014 1.00 0.00 H new ATOM 0 HD1 HIS A 107 11.622 19.163 5.585 1.00 0.00 H new ATOM 0 HD2 HIS A 107 11.731 15.034 4.997 1.00 0.00 H new ATOM 0 HE1 HIS A 107 13.062 18.713 3.504 1.00 0.00 H new ATOM 1632 N VAL A 108 7.860 15.736 5.593 1.00 0.00 N ATOM 1633 CA VAL A 108 7.248 15.037 4.506 1.00 0.00 C ATOM 1634 C VAL A 108 5.885 15.564 4.216 1.00 0.00 C ATOM 1635 O VAL A 108 5.460 15.519 3.063 1.00 0.00 O ATOM 1636 CB VAL A 108 7.303 13.545 4.657 1.00 0.00 C ATOM 1637 CG1 VAL A 108 6.472 12.683 3.692 1.00 0.00 C ATOM 1638 CG2 VAL A 108 8.792 13.180 4.536 1.00 0.00 C ATOM 0 H VAL A 108 7.839 15.223 6.475 1.00 0.00 H new ATOM 0 HA VAL A 108 7.848 15.239 3.619 1.00 0.00 H new ATOM 0 HB VAL A 108 6.838 13.312 5.615 1.00 0.00 H new ATOM 0 HG11 VAL A 108 6.617 11.629 3.929 1.00 0.00 H new ATOM 0 HG12 VAL A 108 5.417 12.936 3.795 1.00 0.00 H new ATOM 0 HG13 VAL A 108 6.792 12.872 2.667 1.00 0.00 H new ATOM 0 HG21 VAL A 108 8.912 12.101 4.637 1.00 0.00 H new ATOM 0 HG22 VAL A 108 9.166 13.497 3.563 1.00 0.00 H new ATOM 0 HG23 VAL A 108 9.355 13.682 5.323 1.00 0.00 H new ATOM 1648 N MET A 109 5.168 16.005 5.265 1.00 0.00 N ATOM 1649 CA MET A 109 3.916 16.654 5.031 1.00 0.00 C ATOM 1650 C MET A 109 4.023 18.049 4.519 1.00 0.00 C ATOM 1651 O MET A 109 3.067 18.423 3.841 1.00 0.00 O ATOM 1652 CB MET A 109 3.107 16.614 6.339 1.00 0.00 C ATOM 1653 CG MET A 109 2.888 15.183 6.833 1.00 0.00 C ATOM 1654 SD MET A 109 1.512 14.392 5.947 1.00 0.00 S ATOM 1655 CE MET A 109 0.310 14.729 7.265 1.00 0.00 C ATOM 0 H MET A 109 5.442 15.917 6.243 1.00 0.00 H new ATOM 0 HA MET A 109 3.413 16.110 4.232 1.00 0.00 H new ATOM 0 HB2 MET A 109 3.629 17.186 7.106 1.00 0.00 H new ATOM 0 HB3 MET A 109 2.142 17.096 6.183 1.00 0.00 H new ATOM 0 HG2 MET A 109 3.799 14.602 6.691 1.00 0.00 H new ATOM 0 HG3 MET A 109 2.679 15.192 7.903 1.00 0.00 H new ATOM 0 HE1 MET A 109 -0.665 14.336 6.977 1.00 0.00 H new ATOM 0 HE2 MET A 109 0.637 14.249 8.187 1.00 0.00 H new ATOM 0 HE3 MET A 109 0.235 15.805 7.423 1.00 0.00 H new ATOM 1665 N THR A 110 5.071 18.859 4.756 1.00 0.00 N ATOM 1666 CA THR A 110 5.372 20.123 4.159 1.00 0.00 C ATOM 1667 C THR A 110 5.896 20.079 2.765 1.00 0.00 C ATOM 1668 O THR A 110 5.449 20.843 1.912 1.00 0.00 O ATOM 1669 CB THR A 110 6.442 20.759 4.997 1.00 0.00 C ATOM 1670 OG1 THR A 110 6.020 20.800 6.352 1.00 0.00 O ATOM 1671 CG2 THR A 110 6.456 22.253 4.632 1.00 0.00 C ATOM 0 H THR A 110 5.781 18.597 5.440 1.00 0.00 H new ATOM 0 HA THR A 110 4.427 20.665 4.114 1.00 0.00 H new ATOM 0 HB THR A 110 7.378 20.220 4.849 1.00 0.00 H new ATOM 0 HG1 THR A 110 6.719 21.214 6.900 1.00 0.00 H new ATOM 0 HG21 THR A 110 7.221 22.763 5.217 1.00 0.00 H new ATOM 0 HG22 THR A 110 6.676 22.366 3.570 1.00 0.00 H new ATOM 0 HG23 THR A 110 5.481 22.690 4.850 1.00 0.00 H new ATOM 1679 N ASN A 111 6.686 19.032 2.469 1.00 0.00 N ATOM 1680 CA ASN A 111 6.969 18.638 1.124 1.00 0.00 C ATOM 1681 C ASN A 111 5.691 18.510 0.368 1.00 0.00 C ATOM 1682 O ASN A 111 5.536 19.047 -0.727 1.00 0.00 O ATOM 1683 CB ASN A 111 7.771 17.334 0.977 1.00 0.00 C ATOM 1684 CG ASN A 111 9.231 17.561 1.344 1.00 0.00 C ATOM 1685 OD1 ASN A 111 9.847 18.599 1.579 1.00 0.00 O ATOM 1686 ND2 ASN A 111 9.943 16.430 1.592 1.00 0.00 N ATOM 0 H ASN A 111 7.136 18.449 3.175 1.00 0.00 H new ATOM 0 HA ASN A 111 7.607 19.424 0.720 1.00 0.00 H new ATOM 0 HB2 ASN A 111 7.344 16.563 1.619 1.00 0.00 H new ATOM 0 HB3 ASN A 111 7.700 16.970 -0.048 1.00 0.00 H new ATOM 0 HD21 ASN A 111 10.899 16.496 1.941 1.00 0.00 H new ATOM 0 HD22 ASN A 111 9.521 15.516 1.429 1.00 0.00 H new ATOM 1693 N LEU A 112 4.694 17.741 0.840 1.00 0.00 N ATOM 1694 CA LEU A 112 3.496 17.468 0.108 1.00 0.00 C ATOM 1695 C LEU A 112 2.632 18.681 0.049 1.00 0.00 C ATOM 1696 O LEU A 112 1.737 18.826 -0.782 1.00 0.00 O ATOM 1697 CB LEU A 112 2.629 16.435 0.846 1.00 0.00 C ATOM 1698 CG LEU A 112 3.137 14.983 0.859 1.00 0.00 C ATOM 1699 CD1 LEU A 112 2.591 14.122 2.009 1.00 0.00 C ATOM 1700 CD2 LEU A 112 3.037 14.232 -0.480 1.00 0.00 C ATOM 0 H LEU A 112 4.722 17.296 1.757 1.00 0.00 H new ATOM 0 HA LEU A 112 3.812 17.124 -0.877 1.00 0.00 H new ATOM 0 HB2 LEU A 112 2.515 16.764 1.879 1.00 0.00 H new ATOM 0 HB3 LEU A 112 1.636 16.443 0.397 1.00 0.00 H new ATOM 0 HG LEU A 112 4.201 15.131 1.044 1.00 0.00 H new ATOM 0 HD11 LEU A 112 3.003 13.115 1.937 1.00 0.00 H new ATOM 0 HD12 LEU A 112 2.878 14.564 2.963 1.00 0.00 H new ATOM 0 HD13 LEU A 112 1.504 14.075 1.944 1.00 0.00 H new ATOM 0 HD21 LEU A 112 3.422 13.219 -0.359 1.00 0.00 H new ATOM 0 HD22 LEU A 112 1.995 14.189 -0.796 1.00 0.00 H new ATOM 0 HD23 LEU A 112 3.624 14.755 -1.235 1.00 0.00 H new ATOM 1712 N GLY A 113 2.896 19.666 0.926 1.00 0.00 N ATOM 1713 CA GLY A 113 2.069 20.823 1.079 1.00 0.00 C ATOM 1714 C GLY A 113 0.775 20.561 1.770 1.00 0.00 C ATOM 1715 O GLY A 113 -0.250 21.188 1.505 1.00 0.00 O ATOM 0 H GLY A 113 3.706 19.658 1.545 1.00 0.00 H new ATOM 0 HA2 GLY A 113 2.620 21.579 1.638 1.00 0.00 H new ATOM 0 HA3 GLY A 113 1.864 21.242 0.094 1.00 0.00 H new ATOM 1719 N GLU A 114 0.804 19.577 2.686 1.00 0.00 N ATOM 1720 CA GLU A 114 -0.202 19.359 3.678 1.00 0.00 C ATOM 1721 C GLU A 114 0.063 20.353 4.756 1.00 0.00 C ATOM 1722 O GLU A 114 1.182 20.538 5.233 1.00 0.00 O ATOM 1723 CB GLU A 114 -0.154 17.948 4.288 1.00 0.00 C ATOM 1724 CG GLU A 114 -0.423 16.769 3.351 1.00 0.00 C ATOM 1725 CD GLU A 114 -1.638 16.964 2.455 1.00 0.00 C ATOM 1726 OE1 GLU A 114 -2.770 17.056 3.001 1.00 0.00 O ATOM 1727 OE2 GLU A 114 -1.490 16.953 1.204 1.00 0.00 O ATOM 0 H GLU A 114 1.566 18.901 2.737 1.00 0.00 H new ATOM 0 HA GLU A 114 -1.185 19.464 3.219 1.00 0.00 H new ATOM 0 HB2 GLU A 114 0.831 17.807 4.734 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -0.880 17.906 5.100 1.00 0.00 H new ATOM 0 HG2 GLU A 114 0.455 16.605 2.727 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -0.563 15.867 3.947 1.00 0.00 H new ATOM 1734 N LYS A 115 -0.912 21.136 5.252 1.00 0.00 N ATOM 1735 CA LYS A 115 -0.580 22.094 6.261 1.00 0.00 C ATOM 1736 C LYS A 115 -0.817 21.464 7.590 1.00 0.00 C ATOM 1737 O LYS A 115 -1.946 21.169 7.978 1.00 0.00 O ATOM 1738 CB LYS A 115 -1.414 23.380 6.142 1.00 0.00 C ATOM 1739 CG LYS A 115 -0.974 24.383 7.211 1.00 0.00 C ATOM 1740 CD LYS A 115 0.396 24.968 6.863 1.00 0.00 C ATOM 1741 CE LYS A 115 0.730 26.200 7.708 1.00 0.00 C ATOM 1742 NZ LYS A 115 0.132 27.454 7.198 1.00 0.00 N ATOM 0 H LYS A 115 -1.892 21.111 4.969 1.00 0.00 H new ATOM 0 HA LYS A 115 0.465 22.381 6.139 1.00 0.00 H new ATOM 0 HB2 LYS A 115 -1.290 23.814 5.150 1.00 0.00 H new ATOM 0 HB3 LYS A 115 -2.473 23.150 6.260 1.00 0.00 H new ATOM 0 HG2 LYS A 115 -1.709 25.184 7.291 1.00 0.00 H new ATOM 0 HG3 LYS A 115 -0.930 23.892 8.183 1.00 0.00 H new ATOM 0 HD2 LYS A 115 1.163 24.208 7.013 1.00 0.00 H new ATOM 0 HD3 LYS A 115 0.417 25.237 5.807 1.00 0.00 H new ATOM 0 HE2 LYS A 115 0.386 26.033 8.729 1.00 0.00 H new ATOM 0 HE3 LYS A 115 1.813 26.316 7.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 115 0.400 28.244 7.819 1.00 0.00 H new ATOM 0 HZ2 LYS A 115 0.479 27.637 6.235 1.00 0.00 H new ATOM 0 HZ3 LYS A 115 -0.904 27.363 7.181 1.00 0.00 H new ATOM 1756 N LEU A 116 0.300 21.208 8.295 1.00 0.00 N ATOM 1757 CA LEU A 116 0.399 20.449 9.503 1.00 0.00 C ATOM 1758 C LEU A 116 0.852 21.369 10.584 1.00 0.00 C ATOM 1759 O LEU A 116 1.823 22.099 10.388 1.00 0.00 O ATOM 1760 CB LEU A 116 1.125 19.102 9.348 1.00 0.00 C ATOM 1761 CG LEU A 116 0.747 17.999 10.351 1.00 0.00 C ATOM 1762 CD1 LEU A 116 -0.678 17.467 10.123 1.00 0.00 C ATOM 1763 CD2 LEU A 116 1.644 16.749 10.359 1.00 0.00 C ATOM 0 H LEU A 116 1.208 21.562 7.993 1.00 0.00 H new ATOM 0 HA LEU A 116 -0.578 20.073 9.807 1.00 0.00 H new ATOM 0 HB2 LEU A 116 0.937 18.727 8.342 1.00 0.00 H new ATOM 0 HB3 LEU A 116 2.197 19.281 9.426 1.00 0.00 H new ATOM 0 HG LEU A 116 0.863 18.525 11.299 1.00 0.00 H new ATOM 0 HD11 LEU A 116 -0.898 16.690 10.856 1.00 0.00 H new ATOM 0 HD12 LEU A 116 -1.393 18.283 10.233 1.00 0.00 H new ATOM 0 HD13 LEU A 116 -0.755 17.050 9.119 1.00 0.00 H new ATOM 0 HD21 LEU A 116 1.279 16.044 11.106 1.00 0.00 H new ATOM 0 HD22 LEU A 116 1.623 16.280 9.375 1.00 0.00 H new ATOM 0 HD23 LEU A 116 2.667 17.037 10.602 1.00 0.00 H new ATOM 1775 N THR A 117 0.225 21.379 11.774 1.00 0.00 N ATOM 1776 CA THR A 117 0.589 22.097 12.956 1.00 0.00 C ATOM 1777 C THR A 117 1.587 21.345 13.768 1.00 0.00 C ATOM 1778 O THR A 117 1.853 20.193 13.430 1.00 0.00 O ATOM 1779 CB THR A 117 -0.490 22.657 13.834 1.00 0.00 C ATOM 1780 OG1 THR A 117 -1.347 21.626 14.304 1.00 0.00 O ATOM 1781 CG2 THR A 117 -1.332 23.737 13.135 1.00 0.00 C ATOM 0 H THR A 117 -0.621 20.828 11.920 1.00 0.00 H new ATOM 0 HA THR A 117 1.022 22.999 12.523 1.00 0.00 H new ATOM 0 HB THR A 117 0.021 23.127 14.674 1.00 0.00 H new ATOM 0 HG1 THR A 117 -1.876 21.275 13.558 1.00 0.00 H new ATOM 0 HG21 THR A 117 -2.096 24.103 13.821 1.00 0.00 H new ATOM 0 HG22 THR A 117 -0.687 24.563 12.835 1.00 0.00 H new ATOM 0 HG23 THR A 117 -1.811 23.311 12.253 1.00 0.00 H new ATOM 1789 N ASP A 118 2.130 21.886 14.873 1.00 0.00 N ATOM 1790 CA ASP A 118 2.920 21.215 15.858 1.00 0.00 C ATOM 1791 C ASP A 118 2.194 20.172 16.635 1.00 0.00 C ATOM 1792 O ASP A 118 2.732 19.129 17.003 1.00 0.00 O ATOM 1793 CB ASP A 118 3.413 22.300 16.830 1.00 0.00 C ATOM 1794 CG ASP A 118 4.299 23.300 16.101 1.00 0.00 C ATOM 1795 OD1 ASP A 118 3.974 23.942 15.067 1.00 0.00 O ATOM 1796 OD2 ASP A 118 5.486 23.421 16.506 1.00 0.00 O ATOM 0 H ASP A 118 2.005 22.874 15.094 1.00 0.00 H new ATOM 0 HA ASP A 118 3.721 20.687 15.341 1.00 0.00 H new ATOM 0 HB2 ASP A 118 2.561 22.815 17.274 1.00 0.00 H new ATOM 0 HB3 ASP A 118 3.968 21.840 17.647 1.00 0.00 H new ATOM 1801 N GLU A 119 0.929 20.431 17.014 1.00 0.00 N ATOM 1802 CA GLU A 119 0.133 19.610 17.872 1.00 0.00 C ATOM 1803 C GLU A 119 -0.339 18.324 17.286 1.00 0.00 C ATOM 1804 O GLU A 119 -0.366 17.275 17.928 1.00 0.00 O ATOM 1805 CB GLU A 119 -1.046 20.421 18.438 1.00 0.00 C ATOM 1806 CG GLU A 119 -0.649 21.491 19.456 1.00 0.00 C ATOM 1807 CD GLU A 119 0.466 21.061 20.398 1.00 0.00 C ATOM 1808 OE1 GLU A 119 0.199 20.166 21.244 1.00 0.00 O ATOM 1809 OE2 GLU A 119 1.614 21.562 20.261 1.00 0.00 O ATOM 0 H GLU A 119 0.433 21.265 16.701 1.00 0.00 H new ATOM 0 HA GLU A 119 0.807 19.305 18.673 1.00 0.00 H new ATOM 0 HB2 GLU A 119 -1.571 20.901 17.612 1.00 0.00 H new ATOM 0 HB3 GLU A 119 -1.751 19.735 18.907 1.00 0.00 H new ATOM 0 HG2 GLU A 119 -0.335 22.388 18.922 1.00 0.00 H new ATOM 0 HG3 GLU A 119 -1.525 21.761 20.045 1.00 0.00 H new ATOM 1816 N GLU A 120 -0.712 18.442 16.000 1.00 0.00 N ATOM 1817 CA GLU A 120 -1.034 17.453 15.017 1.00 0.00 C ATOM 1818 C GLU A 120 0.079 16.473 14.872 1.00 0.00 C ATOM 1819 O GLU A 120 -0.259 15.290 14.866 1.00 0.00 O ATOM 1820 CB GLU A 120 -1.305 17.988 13.601 1.00 0.00 C ATOM 1821 CG GLU A 120 -2.704 18.605 13.657 1.00 0.00 C ATOM 1822 CD GLU A 120 -3.140 19.501 12.507 1.00 0.00 C ATOM 1823 OE1 GLU A 120 -2.435 20.478 12.139 1.00 0.00 O ATOM 1824 OE2 GLU A 120 -4.248 19.251 11.962 1.00 0.00 O ATOM 0 H GLU A 120 -0.799 19.374 15.594 1.00 0.00 H new ATOM 0 HA GLU A 120 -1.954 17.012 15.400 1.00 0.00 H new ATOM 0 HB2 GLU A 120 -0.560 18.730 13.313 1.00 0.00 H new ATOM 0 HB3 GLU A 120 -1.259 17.187 12.863 1.00 0.00 H new ATOM 0 HG2 GLU A 120 -3.424 17.791 13.737 1.00 0.00 H new ATOM 0 HG3 GLU A 120 -2.776 19.185 14.577 1.00 0.00 H new ATOM 1831 N VAL A 121 1.354 16.795 14.590 1.00 0.00 N ATOM 1832 CA VAL A 121 2.380 15.824 14.367 1.00 0.00 C ATOM 1833 C VAL A 121 2.800 15.141 15.623 1.00 0.00 C ATOM 1834 O VAL A 121 3.087 13.949 15.535 1.00 0.00 O ATOM 1835 CB VAL A 121 3.533 16.393 13.595 1.00 0.00 C ATOM 1836 CG1 VAL A 121 4.121 17.606 14.336 1.00 0.00 C ATOM 1837 CG2 VAL A 121 4.693 15.423 13.314 1.00 0.00 C ATOM 0 H VAL A 121 1.681 17.758 14.515 1.00 0.00 H new ATOM 0 HA VAL A 121 1.948 15.045 13.739 1.00 0.00 H new ATOM 0 HB VAL A 121 3.097 16.655 12.631 1.00 0.00 H new ATOM 0 HG11 VAL A 121 4.957 18.010 13.766 1.00 0.00 H new ATOM 0 HG12 VAL A 121 3.353 18.372 14.447 1.00 0.00 H new ATOM 0 HG13 VAL A 121 4.470 17.297 15.321 1.00 0.00 H new ATOM 0 HG21 VAL A 121 5.471 15.939 12.751 1.00 0.00 H new ATOM 0 HG22 VAL A 121 5.105 15.066 14.258 1.00 0.00 H new ATOM 0 HG23 VAL A 121 4.327 14.576 12.734 1.00 0.00 H new ATOM 1847 N ASP A 122 2.599 15.843 16.753 1.00 0.00 N ATOM 1848 CA ASP A 122 2.703 15.249 18.049 1.00 0.00 C ATOM 1849 C ASP A 122 1.700 14.219 18.442 1.00 0.00 C ATOM 1850 O ASP A 122 1.959 13.147 18.987 1.00 0.00 O ATOM 1851 CB ASP A 122 2.853 16.363 19.099 1.00 0.00 C ATOM 1852 CG ASP A 122 3.302 15.814 20.446 1.00 0.00 C ATOM 1853 OD1 ASP A 122 4.439 15.302 20.622 1.00 0.00 O ATOM 1854 OD2 ASP A 122 2.411 15.920 21.331 1.00 0.00 O ATOM 0 H ASP A 122 2.361 16.835 16.767 1.00 0.00 H new ATOM 0 HA ASP A 122 3.598 14.629 17.994 1.00 0.00 H new ATOM 0 HB2 ASP A 122 3.576 17.099 18.747 1.00 0.00 H new ATOM 0 HB3 ASP A 122 1.902 16.882 19.217 1.00 0.00 H new ATOM 1859 N GLU A 123 0.437 14.439 18.035 1.00 0.00 N ATOM 1860 CA GLU A 123 -0.639 13.501 18.112 1.00 0.00 C ATOM 1861 C GLU A 123 -0.429 12.267 17.303 1.00 0.00 C ATOM 1862 O GLU A 123 -0.614 11.173 17.835 1.00 0.00 O ATOM 1863 CB GLU A 123 -1.959 14.179 17.708 1.00 0.00 C ATOM 1864 CG GLU A 123 -3.196 13.359 18.080 1.00 0.00 C ATOM 1865 CD GLU A 123 -4.447 14.014 17.511 1.00 0.00 C ATOM 1866 OE1 GLU A 123 -4.788 15.203 17.748 1.00 0.00 O ATOM 1867 OE2 GLU A 123 -5.133 13.278 16.752 1.00 0.00 O ATOM 0 H GLU A 123 0.150 15.329 17.626 1.00 0.00 H new ATOM 0 HA GLU A 123 -0.682 13.176 19.151 1.00 0.00 H new ATOM 0 HB2 GLU A 123 -2.020 15.155 18.188 1.00 0.00 H new ATOM 0 HB3 GLU A 123 -1.956 14.353 16.632 1.00 0.00 H new ATOM 0 HG2 GLU A 123 -3.099 12.344 17.694 1.00 0.00 H new ATOM 0 HG3 GLU A 123 -3.278 13.281 19.164 1.00 0.00 H new ATOM 1874 N MET A 124 0.044 12.396 16.051 1.00 0.00 N ATOM 1875 CA MET A 124 0.370 11.283 15.214 1.00 0.00 C ATOM 1876 C MET A 124 1.502 10.528 15.821 1.00 0.00 C ATOM 1877 O MET A 124 1.490 9.298 15.824 1.00 0.00 O ATOM 1878 CB MET A 124 0.718 11.846 13.826 1.00 0.00 C ATOM 1879 CG MET A 124 -0.525 12.461 13.179 1.00 0.00 C ATOM 1880 SD MET A 124 -0.130 13.541 11.771 1.00 0.00 S ATOM 1881 CE MET A 124 -0.333 12.194 10.569 1.00 0.00 C ATOM 0 H MET A 124 0.204 13.300 15.608 1.00 0.00 H new ATOM 0 HA MET A 124 -0.461 10.584 15.115 1.00 0.00 H new ATOM 0 HB2 MET A 124 1.500 12.600 13.917 1.00 0.00 H new ATOM 0 HB3 MET A 124 1.112 11.052 13.192 1.00 0.00 H new ATOM 0 HG2 MET A 124 -1.186 11.662 12.843 1.00 0.00 H new ATOM 0 HG3 MET A 124 -1.072 13.034 13.928 1.00 0.00 H new ATOM 0 HE1 MET A 124 0.121 12.481 9.621 1.00 0.00 H new ATOM 0 HE2 MET A 124 0.153 11.294 10.946 1.00 0.00 H new ATOM 0 HE3 MET A 124 -1.395 11.998 10.419 1.00 0.00 H new ATOM 1891 N ILE A 125 2.553 11.167 16.366 1.00 0.00 N ATOM 1892 CA ILE A 125 3.741 10.564 16.886 1.00 0.00 C ATOM 1893 C ILE A 125 3.390 9.857 18.149 1.00 0.00 C ATOM 1894 O ILE A 125 3.982 8.848 18.529 1.00 0.00 O ATOM 1895 CB ILE A 125 4.919 11.489 16.976 1.00 0.00 C ATOM 1896 CG1 ILE A 125 6.180 10.873 16.347 1.00 0.00 C ATOM 1897 CG2 ILE A 125 5.237 12.017 18.385 1.00 0.00 C ATOM 1898 CD1 ILE A 125 6.204 10.891 14.819 1.00 0.00 C ATOM 0 H ILE A 125 2.572 12.183 16.449 1.00 0.00 H new ATOM 0 HA ILE A 125 4.109 9.826 16.173 1.00 0.00 H new ATOM 0 HB ILE A 125 4.607 12.359 16.398 1.00 0.00 H new ATOM 0 HG12 ILE A 125 7.054 11.410 16.717 1.00 0.00 H new ATOM 0 HG13 ILE A 125 6.272 9.841 16.686 1.00 0.00 H new ATOM 0 HG21 ILE A 125 6.104 12.676 18.340 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.380 12.571 18.768 1.00 0.00 H new ATOM 0 HG23 ILE A 125 5.452 11.179 19.048 1.00 0.00 H new ATOM 0 HD11 ILE A 125 7.129 10.437 14.464 1.00 0.00 H new ATOM 0 HD12 ILE A 125 5.353 10.328 14.435 1.00 0.00 H new ATOM 0 HD13 ILE A 125 6.147 11.921 14.466 1.00 0.00 H new ATOM 1910 N ARG A 126 2.421 10.333 18.952 1.00 0.00 N ATOM 1911 CA ARG A 126 2.033 9.644 20.144 1.00 0.00 C ATOM 1912 C ARG A 126 1.290 8.387 19.846 1.00 0.00 C ATOM 1913 O ARG A 126 1.559 7.373 20.488 1.00 0.00 O ATOM 1914 CB ARG A 126 1.160 10.567 21.010 1.00 0.00 C ATOM 1915 CG ARG A 126 0.880 10.025 22.413 1.00 0.00 C ATOM 1916 CD ARG A 126 0.888 11.142 23.458 1.00 0.00 C ATOM 1917 NE ARG A 126 -0.001 12.277 23.081 1.00 0.00 N ATOM 1918 CZ ARG A 126 0.444 13.479 22.611 1.00 0.00 C ATOM 1919 NH1 ARG A 126 1.774 13.767 22.714 1.00 0.00 N ATOM 1920 NH2 ARG A 126 -0.446 14.343 22.040 1.00 0.00 N ATOM 0 H ARG A 126 1.906 11.196 18.776 1.00 0.00 H new ATOM 0 HA ARG A 126 2.942 9.371 20.681 1.00 0.00 H new ATOM 0 HB2 ARG A 126 1.651 11.536 21.098 1.00 0.00 H new ATOM 0 HB3 ARG A 126 0.211 10.735 20.501 1.00 0.00 H new ATOM 0 HG2 ARG A 126 -0.087 9.522 22.424 1.00 0.00 H new ATOM 0 HG3 ARG A 126 1.630 9.278 22.672 1.00 0.00 H new ATOM 0 HD2 ARG A 126 0.570 10.739 24.420 1.00 0.00 H new ATOM 0 HD3 ARG A 126 1.906 11.509 23.587 1.00 0.00 H new ATOM 0 HE ARG A 126 -1.008 12.147 23.181 1.00 0.00 H new ATOM 0 HH11 ARG A 126 2.411 13.091 23.135 1.00 0.00 H new ATOM 0 HH12 ARG A 126 2.131 14.659 22.370 1.00 0.00 H new ATOM 0 HH21 ARG A 126 -1.431 14.087 21.968 1.00 0.00 H new ATOM 0 HH22 ARG A 126 -0.126 15.244 21.685 1.00 0.00 H new ATOM 1934 N GLU A 127 0.569 8.413 18.711 1.00 0.00 N ATOM 1935 CA GLU A 127 -0.249 7.253 18.541 1.00 0.00 C ATOM 1936 C GLU A 127 0.514 6.189 17.829 1.00 0.00 C ATOM 1937 O GLU A 127 0.260 4.995 17.976 1.00 0.00 O ATOM 1938 CB GLU A 127 -1.452 7.710 17.698 1.00 0.00 C ATOM 1939 CG GLU A 127 -2.404 6.585 17.287 1.00 0.00 C ATOM 1940 CD GLU A 127 -3.157 5.966 18.456 1.00 0.00 C ATOM 1941 OE1 GLU A 127 -3.892 6.662 19.207 1.00 0.00 O ATOM 1942 OE2 GLU A 127 -3.006 4.743 18.715 1.00 0.00 O ATOM 0 H GLU A 127 0.544 9.137 17.992 1.00 0.00 H new ATOM 0 HA GLU A 127 -0.568 6.837 19.497 1.00 0.00 H new ATOM 0 HB2 GLU A 127 -2.013 8.455 18.262 1.00 0.00 H new ATOM 0 HB3 GLU A 127 -1.083 8.203 16.799 1.00 0.00 H new ATOM 0 HG2 GLU A 127 -3.124 6.975 16.567 1.00 0.00 H new ATOM 0 HG3 GLU A 127 -1.835 5.806 16.779 1.00 0.00 H new ATOM 1949 N ALA A 128 1.595 6.567 17.122 1.00 0.00 N ATOM 1950 CA ALA A 128 2.646 5.749 16.603 1.00 0.00 C ATOM 1951 C ALA A 128 3.556 5.258 17.676 1.00 0.00 C ATOM 1952 O ALA A 128 3.751 4.052 17.817 1.00 0.00 O ATOM 1953 CB ALA A 128 3.278 6.602 15.489 1.00 0.00 C ATOM 0 H ALA A 128 1.745 7.549 16.892 1.00 0.00 H new ATOM 0 HA ALA A 128 2.307 4.805 16.177 1.00 0.00 H new ATOM 0 HB1 ALA A 128 4.099 6.051 15.031 1.00 0.00 H new ATOM 0 HB2 ALA A 128 2.526 6.828 14.733 1.00 0.00 H new ATOM 0 HB3 ALA A 128 3.657 7.532 15.913 1.00 0.00 H new ATOM 1959 N ASP A 129 4.150 6.058 18.580 1.00 0.00 N ATOM 1960 CA ASP A 129 5.146 5.598 19.497 1.00 0.00 C ATOM 1961 C ASP A 129 4.689 4.641 20.544 1.00 0.00 C ATOM 1962 O ASP A 129 3.824 4.926 21.370 1.00 0.00 O ATOM 1963 CB ASP A 129 5.934 6.732 20.175 1.00 0.00 C ATOM 1964 CG ASP A 129 7.019 6.303 21.152 1.00 0.00 C ATOM 1965 OD1 ASP A 129 7.717 5.306 20.827 1.00 0.00 O ATOM 1966 OD2 ASP A 129 7.085 6.937 22.239 1.00 0.00 O ATOM 0 H ASP A 129 3.932 7.050 18.676 1.00 0.00 H new ATOM 0 HA ASP A 129 5.801 5.042 18.827 1.00 0.00 H new ATOM 0 HB2 ASP A 129 6.394 7.342 19.398 1.00 0.00 H new ATOM 0 HB3 ASP A 129 5.228 7.371 20.705 1.00 0.00 H new ATOM 1971 N ILE A 130 5.260 3.426 20.630 1.00 0.00 N ATOM 1972 CA ILE A 130 4.882 2.449 21.603 1.00 0.00 C ATOM 1973 C ILE A 130 5.838 2.627 22.731 1.00 0.00 C ATOM 1974 O ILE A 130 5.433 2.980 23.838 1.00 0.00 O ATOM 1975 CB ILE A 130 4.793 1.058 21.048 1.00 0.00 C ATOM 1976 CG1 ILE A 130 3.715 1.105 19.953 1.00 0.00 C ATOM 1977 CG2 ILE A 130 4.468 0.036 22.150 1.00 0.00 C ATOM 1978 CD1 ILE A 130 3.603 -0.199 19.164 1.00 0.00 C ATOM 0 H ILE A 130 6.005 3.115 20.006 1.00 0.00 H new ATOM 0 HA ILE A 130 3.862 2.599 21.956 1.00 0.00 H new ATOM 0 HB ILE A 130 5.745 0.731 20.630 1.00 0.00 H new ATOM 0 HG12 ILE A 130 2.751 1.330 20.410 1.00 0.00 H new ATOM 0 HG13 ILE A 130 3.940 1.920 19.265 1.00 0.00 H new ATOM 0 HG21 ILE A 130 4.410 -0.962 21.715 1.00 0.00 H new ATOM 0 HG22 ILE A 130 5.251 0.057 22.908 1.00 0.00 H new ATOM 0 HG23 ILE A 130 3.512 0.288 22.609 1.00 0.00 H new ATOM 0 HD11 ILE A 130 2.825 -0.101 18.407 1.00 0.00 H new ATOM 0 HD12 ILE A 130 4.555 -0.414 18.680 1.00 0.00 H new ATOM 0 HD13 ILE A 130 3.349 -1.014 19.842 1.00 0.00 H new ATOM 1990 N ASP A 131 7.162 2.408 22.630 1.00 0.00 N ATOM 1991 CA ASP A 131 8.095 2.377 23.712 1.00 0.00 C ATOM 1992 C ASP A 131 8.609 3.569 24.444 1.00 0.00 C ATOM 1993 O ASP A 131 9.348 3.467 25.422 1.00 0.00 O ATOM 1994 CB ASP A 131 9.185 1.328 23.433 1.00 0.00 C ATOM 1995 CG ASP A 131 10.241 1.866 22.479 1.00 0.00 C ATOM 1996 OD1 ASP A 131 10.054 2.942 21.850 1.00 0.00 O ATOM 1997 OD2 ASP A 131 11.273 1.167 22.297 1.00 0.00 O ATOM 0 H ASP A 131 7.609 2.241 21.729 1.00 0.00 H new ATOM 0 HA ASP A 131 7.387 2.130 24.503 1.00 0.00 H new ATOM 0 HB2 ASP A 131 9.656 1.032 24.370 1.00 0.00 H new ATOM 0 HB3 ASP A 131 8.731 0.433 23.008 1.00 0.00 H new ATOM 2002 N GLY A 132 8.288 4.802 24.013 1.00 0.00 N ATOM 2003 CA GLY A 132 8.461 5.991 24.790 1.00 0.00 C ATOM 2004 C GLY A 132 9.593 6.901 24.460 1.00 0.00 C ATOM 2005 O GLY A 132 9.801 7.944 25.079 1.00 0.00 O ATOM 0 H GLY A 132 7.893 4.978 23.089 1.00 0.00 H new ATOM 0 HA2 GLY A 132 7.540 6.570 24.719 1.00 0.00 H new ATOM 0 HA3 GLY A 132 8.570 5.692 25.833 1.00 0.00 H new ATOM 2009 N ASP A 133 10.442 6.556 23.476 1.00 0.00 N ATOM 2010 CA ASP A 133 11.529 7.363 23.015 1.00 0.00 C ATOM 2011 C ASP A 133 11.147 8.478 22.104 1.00 0.00 C ATOM 2012 O ASP A 133 11.923 9.348 21.712 1.00 0.00 O ATOM 2013 CB ASP A 133 12.655 6.576 22.323 1.00 0.00 C ATOM 2014 CG ASP A 133 12.271 5.754 21.101 1.00 0.00 C ATOM 2015 OD1 ASP A 133 11.098 5.866 20.655 1.00 0.00 O ATOM 2016 OD2 ASP A 133 13.003 4.865 20.588 1.00 0.00 O ATOM 0 H ASP A 133 10.366 5.670 22.977 1.00 0.00 H new ATOM 0 HA ASP A 133 11.891 7.779 23.955 1.00 0.00 H new ATOM 0 HB2 ASP A 133 13.430 7.283 22.026 1.00 0.00 H new ATOM 0 HB3 ASP A 133 13.100 5.904 23.057 1.00 0.00 H new ATOM 2021 N GLY A 134 9.870 8.735 21.769 1.00 0.00 N ATOM 2022 CA GLY A 134 9.472 9.825 20.933 1.00 0.00 C ATOM 2023 C GLY A 134 9.657 9.705 19.459 1.00 0.00 C ATOM 2024 O GLY A 134 9.270 10.556 18.660 1.00 0.00 O ATOM 0 H GLY A 134 9.088 8.165 22.091 1.00 0.00 H new ATOM 0 HA2 GLY A 134 8.415 10.014 21.118 1.00 0.00 H new ATOM 0 HA3 GLY A 134 10.017 10.710 21.263 1.00 0.00 H new ATOM 2028 N GLN A 135 10.152 8.529 19.034 1.00 0.00 N ATOM 2029 CA GLN A 135 10.380 8.113 17.684 1.00 0.00 C ATOM 2030 C GLN A 135 9.537 6.909 17.441 1.00 0.00 C ATOM 2031 O GLN A 135 9.184 6.220 18.397 1.00 0.00 O ATOM 2032 CB GLN A 135 11.867 7.834 17.411 1.00 0.00 C ATOM 2033 CG GLN A 135 12.645 9.071 17.867 1.00 0.00 C ATOM 2034 CD GLN A 135 13.965 9.179 17.117 1.00 0.00 C ATOM 2035 OE1 GLN A 135 14.056 9.359 15.904 1.00 0.00 O ATOM 2036 NE2 GLN A 135 15.090 8.928 17.838 1.00 0.00 N ATOM 0 H GLN A 135 10.417 7.803 19.699 1.00 0.00 H new ATOM 0 HA GLN A 135 10.104 8.911 16.995 1.00 0.00 H new ATOM 0 HB2 GLN A 135 12.199 6.948 17.953 1.00 0.00 H new ATOM 0 HB3 GLN A 135 12.035 7.641 16.351 1.00 0.00 H new ATOM 0 HG2 GLN A 135 12.048 9.967 17.695 1.00 0.00 H new ATOM 0 HG3 GLN A 135 12.833 9.014 18.939 1.00 0.00 H new ATOM 0 HE21 GLN A 135 15.027 8.777 18.845 1.00 0.00 H new ATOM 0 HE22 GLN A 135 15.997 8.891 17.372 1.00 0.00 H new ATOM 2045 N VAL A 136 9.314 6.717 16.128 1.00 0.00 N ATOM 2046 CA VAL A 136 8.500 5.653 15.629 1.00 0.00 C ATOM 2047 C VAL A 136 9.480 4.746 14.966 1.00 0.00 C ATOM 2048 O VAL A 136 10.129 5.108 13.986 1.00 0.00 O ATOM 2049 CB VAL A 136 7.444 6.142 14.683 1.00 0.00 C ATOM 2050 CG1 VAL A 136 6.501 4.988 14.303 1.00 0.00 C ATOM 2051 CG2 VAL A 136 6.631 7.226 15.410 1.00 0.00 C ATOM 0 H VAL A 136 9.707 7.313 15.399 1.00 0.00 H new ATOM 0 HA VAL A 136 7.934 5.153 16.415 1.00 0.00 H new ATOM 0 HB VAL A 136 7.907 6.535 13.778 1.00 0.00 H new ATOM 0 HG11 VAL A 136 5.738 5.353 13.616 1.00 0.00 H new ATOM 0 HG12 VAL A 136 7.073 4.194 13.822 1.00 0.00 H new ATOM 0 HG13 VAL A 136 6.023 4.598 15.202 1.00 0.00 H new ATOM 0 HG21 VAL A 136 5.853 7.603 14.747 1.00 0.00 H new ATOM 0 HG22 VAL A 136 6.172 6.800 16.302 1.00 0.00 H new ATOM 0 HG23 VAL A 136 7.291 8.045 15.697 1.00 0.00 H new ATOM 2061 N ASN A 137 9.629 3.473 15.375 1.00 0.00 N ATOM 2062 CA ASN A 137 10.350 2.440 14.699 1.00 0.00 C ATOM 2063 C ASN A 137 9.451 1.617 13.842 1.00 0.00 C ATOM 2064 O ASN A 137 8.283 1.961 13.671 1.00 0.00 O ATOM 2065 CB ASN A 137 11.343 1.733 15.638 1.00 0.00 C ATOM 2066 CG ASN A 137 10.714 0.586 16.416 1.00 0.00 C ATOM 2067 OD1 ASN A 137 10.301 -0.454 15.906 1.00 0.00 O ATOM 2068 ND2 ASN A 137 10.727 0.755 17.765 1.00 0.00 N ATOM 0 H ASN A 137 9.213 3.143 16.246 1.00 0.00 H new ATOM 0 HA ASN A 137 11.026 2.863 13.956 1.00 0.00 H new ATOM 0 HB2 ASN A 137 12.179 1.352 15.052 1.00 0.00 H new ATOM 0 HB3 ASN A 137 11.751 2.460 16.340 1.00 0.00 H new ATOM 0 HD21 ASN A 137 10.390 0.011 18.375 1.00 0.00 H new ATOM 0 HD22 ASN A 137 11.074 1.626 18.167 1.00 0.00 H new ATOM 2075 N TYR A 138 10.013 0.552 13.242 1.00 0.00 N ATOM 2076 CA TYR A 138 9.344 -0.099 12.159 1.00 0.00 C ATOM 2077 C TYR A 138 8.168 -0.870 12.652 1.00 0.00 C ATOM 2078 O TYR A 138 7.090 -0.799 12.064 1.00 0.00 O ATOM 2079 CB TYR A 138 10.332 -0.994 11.392 1.00 0.00 C ATOM 2080 CG TYR A 138 9.761 -1.502 10.114 1.00 0.00 C ATOM 2081 CD1 TYR A 138 9.007 -2.652 10.146 1.00 0.00 C ATOM 2082 CD2 TYR A 138 9.953 -0.792 8.952 1.00 0.00 C ATOM 2083 CE1 TYR A 138 8.440 -3.121 8.985 1.00 0.00 C ATOM 2084 CE2 TYR A 138 9.208 -1.163 7.857 1.00 0.00 C ATOM 2085 CZ TYR A 138 8.534 -2.361 7.843 1.00 0.00 C ATOM 2086 OH TYR A 138 7.720 -2.599 6.716 1.00 0.00 O ATOM 0 H TYR A 138 10.913 0.148 13.500 1.00 0.00 H new ATOM 0 HA TYR A 138 8.968 0.656 11.468 1.00 0.00 H new ATOM 0 HB2 TYR A 138 11.241 -0.431 11.182 1.00 0.00 H new ATOM 0 HB3 TYR A 138 10.617 -1.838 12.020 1.00 0.00 H new ATOM 0 HD1 TYR A 138 8.862 -3.182 11.076 1.00 0.00 H new ATOM 0 HD2 TYR A 138 10.660 0.023 8.901 1.00 0.00 H new ATOM 0 HE1 TYR A 138 7.928 -4.072 8.970 1.00 0.00 H new ATOM 0 HE2 TYR A 138 9.152 -0.507 7.001 1.00 0.00 H new ATOM 0 HH TYR A 138 7.385 -1.746 6.369 1.00 0.00 H new ATOM 2096 N GLU A 139 8.228 -1.562 13.804 1.00 0.00 N ATOM 2097 CA GLU A 139 7.133 -2.301 14.351 1.00 0.00 C ATOM 2098 C GLU A 139 6.074 -1.339 14.766 1.00 0.00 C ATOM 2099 O GLU A 139 4.887 -1.616 14.603 1.00 0.00 O ATOM 2100 CB GLU A 139 7.503 -3.110 15.606 1.00 0.00 C ATOM 2101 CG GLU A 139 6.426 -3.864 16.389 1.00 0.00 C ATOM 2102 CD GLU A 139 6.993 -4.807 17.441 1.00 0.00 C ATOM 2103 OE1 GLU A 139 7.692 -5.771 17.029 1.00 0.00 O ATOM 2104 OE2 GLU A 139 6.827 -4.521 18.657 1.00 0.00 O ATOM 0 H GLU A 139 9.071 -1.608 14.376 1.00 0.00 H new ATOM 0 HA GLU A 139 6.811 -2.995 13.575 1.00 0.00 H new ATOM 0 HB2 GLU A 139 8.255 -3.841 15.308 1.00 0.00 H new ATOM 0 HB3 GLU A 139 7.985 -2.423 16.301 1.00 0.00 H new ATOM 0 HG2 GLU A 139 5.768 -3.143 16.875 1.00 0.00 H new ATOM 0 HG3 GLU A 139 5.813 -4.435 15.692 1.00 0.00 H new ATOM 2111 N GLU A 140 6.379 -0.184 15.385 1.00 0.00 N ATOM 2112 CA GLU A 140 5.460 0.822 15.819 1.00 0.00 C ATOM 2113 C GLU A 140 4.754 1.437 14.660 1.00 0.00 C ATOM 2114 O GLU A 140 3.598 1.748 14.942 1.00 0.00 O ATOM 2115 CB GLU A 140 6.333 1.856 16.550 1.00 0.00 C ATOM 2116 CG GLU A 140 7.158 1.209 17.664 1.00 0.00 C ATOM 2117 CD GLU A 140 7.872 2.221 18.548 1.00 0.00 C ATOM 2118 OE1 GLU A 140 8.598 3.043 17.928 1.00 0.00 O ATOM 2119 OE2 GLU A 140 7.839 2.229 19.807 1.00 0.00 O ATOM 0 H GLU A 140 7.345 0.064 15.598 1.00 0.00 H new ATOM 0 HA GLU A 140 4.679 0.417 16.462 1.00 0.00 H new ATOM 0 HB2 GLU A 140 7.000 2.340 15.836 1.00 0.00 H new ATOM 0 HB3 GLU A 140 5.699 2.635 16.972 1.00 0.00 H new ATOM 0 HG2 GLU A 140 6.503 0.595 18.282 1.00 0.00 H new ATOM 0 HG3 GLU A 140 7.895 0.541 17.219 1.00 0.00 H new ATOM 2126 N PHE A 141 5.399 1.598 13.491 1.00 0.00 N ATOM 2127 CA PHE A 141 4.847 2.186 12.310 1.00 0.00 C ATOM 2128 C PHE A 141 3.825 1.279 11.716 1.00 0.00 C ATOM 2129 O PHE A 141 2.656 1.578 11.479 1.00 0.00 O ATOM 2130 CB PHE A 141 5.946 2.461 11.270 1.00 0.00 C ATOM 2131 CG PHE A 141 5.498 3.114 10.008 1.00 0.00 C ATOM 2132 CD1 PHE A 141 5.084 4.425 10.000 1.00 0.00 C ATOM 2133 CD2 PHE A 141 5.264 2.357 8.884 1.00 0.00 C ATOM 2134 CE1 PHE A 141 4.505 5.019 8.902 1.00 0.00 C ATOM 2135 CE2 PHE A 141 4.635 2.894 7.785 1.00 0.00 C ATOM 2136 CZ PHE A 141 4.289 4.225 7.801 1.00 0.00 C ATOM 0 H PHE A 141 6.366 1.299 13.363 1.00 0.00 H new ATOM 0 HA PHE A 141 4.381 3.131 12.590 1.00 0.00 H new ATOM 0 HB2 PHE A 141 6.707 3.090 11.732 1.00 0.00 H new ATOM 0 HB3 PHE A 141 6.425 1.515 11.017 1.00 0.00 H new ATOM 0 HD1 PHE A 141 5.219 5.015 10.895 1.00 0.00 H new ATOM 0 HD2 PHE A 141 5.579 1.324 8.864 1.00 0.00 H new ATOM 0 HE1 PHE A 141 4.232 6.064 8.905 1.00 0.00 H new ATOM 0 HE2 PHE A 141 4.416 2.280 6.924 1.00 0.00 H new ATOM 0 HZ PHE A 141 3.834 4.659 6.923 1.00 0.00 H new ATOM 2146 N VAL A 142 4.215 0.028 11.413 1.00 0.00 N ATOM 2147 CA VAL A 142 3.372 -1.040 10.973 1.00 0.00 C ATOM 2148 C VAL A 142 2.225 -1.299 11.889 1.00 0.00 C ATOM 2149 O VAL A 142 1.083 -1.265 11.431 1.00 0.00 O ATOM 2150 CB VAL A 142 4.309 -2.150 10.600 1.00 0.00 C ATOM 2151 CG1 VAL A 142 3.524 -3.413 10.208 1.00 0.00 C ATOM 2152 CG2 VAL A 142 5.282 -1.716 9.491 1.00 0.00 C ATOM 0 H VAL A 142 5.192 -0.257 11.481 1.00 0.00 H new ATOM 0 HA VAL A 142 2.784 -0.819 10.082 1.00 0.00 H new ATOM 0 HB VAL A 142 4.913 -2.392 11.474 1.00 0.00 H new ATOM 0 HG11 VAL A 142 4.222 -4.207 9.941 1.00 0.00 H new ATOM 0 HG12 VAL A 142 2.911 -3.736 11.050 1.00 0.00 H new ATOM 0 HG13 VAL A 142 2.882 -3.192 9.355 1.00 0.00 H new ATOM 0 HG21 VAL A 142 5.946 -2.544 9.245 1.00 0.00 H new ATOM 0 HG22 VAL A 142 4.718 -1.428 8.604 1.00 0.00 H new ATOM 0 HG23 VAL A 142 5.872 -0.867 9.837 1.00 0.00 H new ATOM 2162 N GLN A 143 2.384 -1.563 13.198 1.00 0.00 N ATOM 2163 CA GLN A 143 1.309 -1.816 14.106 1.00 0.00 C ATOM 2164 C GLN A 143 0.321 -0.709 14.247 1.00 0.00 C ATOM 2165 O GLN A 143 -0.877 -0.918 14.432 1.00 0.00 O ATOM 2166 CB GLN A 143 1.798 -2.308 15.478 1.00 0.00 C ATOM 2167 CG GLN A 143 2.477 -3.674 15.586 1.00 0.00 C ATOM 2168 CD GLN A 143 1.779 -4.863 14.940 1.00 0.00 C ATOM 2169 OE1 GLN A 143 2.345 -5.804 14.387 1.00 0.00 O ATOM 2170 NE2 GLN A 143 0.422 -4.830 15.015 1.00 0.00 N ATOM 0 H GLN A 143 3.301 -1.602 13.643 1.00 0.00 H new ATOM 0 HA GLN A 143 0.758 -2.627 13.630 1.00 0.00 H new ATOM 0 HB2 GLN A 143 2.496 -1.564 15.863 1.00 0.00 H new ATOM 0 HB3 GLN A 143 0.939 -2.316 16.148 1.00 0.00 H new ATOM 0 HG2 GLN A 143 3.472 -3.590 15.148 1.00 0.00 H new ATOM 0 HG3 GLN A 143 2.613 -3.899 16.644 1.00 0.00 H new ATOM 0 HE21 GLN A 143 -0.045 -4.048 15.474 1.00 0.00 H new ATOM 0 HE22 GLN A 143 -0.130 -5.587 14.612 1.00 0.00 H new ATOM 2179 N MET A 144 0.792 0.538 14.074 1.00 0.00 N ATOM 2180 CA MET A 144 -0.061 1.672 13.896 1.00 0.00 C ATOM 2181 C MET A 144 -1.033 1.583 12.770 1.00 0.00 C ATOM 2182 O MET A 144 -2.175 2.037 12.816 1.00 0.00 O ATOM 2183 CB MET A 144 0.813 2.932 13.790 1.00 0.00 C ATOM 2184 CG MET A 144 0.038 4.229 13.549 1.00 0.00 C ATOM 2185 SD MET A 144 -0.354 4.638 11.822 1.00 0.00 S ATOM 2186 CE MET A 144 1.323 5.139 11.341 1.00 0.00 C ATOM 0 H MET A 144 1.787 0.764 14.057 1.00 0.00 H new ATOM 0 HA MET A 144 -0.705 1.713 14.775 1.00 0.00 H new ATOM 0 HB2 MET A 144 1.391 3.035 14.709 1.00 0.00 H new ATOM 0 HB3 MET A 144 1.527 2.795 12.978 1.00 0.00 H new ATOM 0 HG2 MET A 144 -0.897 4.175 14.106 1.00 0.00 H new ATOM 0 HG3 MET A 144 0.614 5.053 13.971 1.00 0.00 H new ATOM 0 HE1 MET A 144 1.305 6.166 10.975 1.00 0.00 H new ATOM 0 HE2 MET A 144 1.984 5.073 12.205 1.00 0.00 H new ATOM 0 HE3 MET A 144 1.688 4.480 10.554 1.00 0.00 H new ATOM 2196 N MET A 145 -0.622 1.043 11.609 1.00 0.00 N ATOM 2197 CA MET A 145 -1.351 0.944 10.382 1.00 0.00 C ATOM 2198 C MET A 145 -2.410 -0.089 10.561 1.00 0.00 C ATOM 2199 O MET A 145 -3.516 0.077 10.049 1.00 0.00 O ATOM 2200 CB MET A 145 -0.439 0.857 9.147 1.00 0.00 C ATOM 2201 CG MET A 145 0.308 2.172 8.913 1.00 0.00 C ATOM 2202 SD MET A 145 1.112 2.224 7.283 1.00 0.00 S ATOM 2203 CE MET A 145 -0.316 2.729 6.282 1.00 0.00 C ATOM 0 H MET A 145 0.310 0.638 11.523 1.00 0.00 H new ATOM 0 HA MET A 145 -1.882 1.866 10.145 1.00 0.00 H new ATOM 0 HB2 MET A 145 0.279 0.047 9.279 1.00 0.00 H new ATOM 0 HB3 MET A 145 -1.036 0.614 8.268 1.00 0.00 H new ATOM 0 HG2 MET A 145 -0.390 3.005 8.999 1.00 0.00 H new ATOM 0 HG3 MET A 145 1.059 2.305 9.691 1.00 0.00 H new ATOM 0 HE1 MET A 145 -0.016 2.815 5.238 1.00 0.00 H new ATOM 0 HE2 MET A 145 -1.106 1.983 6.372 1.00 0.00 H new ATOM 0 HE3 MET A 145 -0.685 3.692 6.634 1.00 0.00 H new ATOM 2213 N THR A 146 -2.023 -1.089 11.374 1.00 0.00 N ATOM 2214 CA THR A 146 -2.871 -2.180 11.741 1.00 0.00 C ATOM 2215 C THR A 146 -3.920 -1.842 12.743 1.00 0.00 C ATOM 2216 O THR A 146 -5.064 -2.259 12.565 1.00 0.00 O ATOM 2217 CB THR A 146 -2.043 -3.339 12.211 1.00 0.00 C ATOM 2218 OG1 THR A 146 -1.043 -3.564 11.228 1.00 0.00 O ATOM 2219 CG2 THR A 146 -2.897 -4.618 12.240 1.00 0.00 C ATOM 0 H THR A 146 -1.092 -1.140 11.788 1.00 0.00 H new ATOM 0 HA THR A 146 -3.417 -2.449 10.837 1.00 0.00 H new ATOM 0 HB THR A 146 -1.639 -3.121 13.200 1.00 0.00 H new ATOM 0 HG1 THR A 146 -0.315 -2.919 11.349 1.00 0.00 H new ATOM 0 HG21 THR A 146 -2.288 -5.455 12.582 1.00 0.00 H new ATOM 0 HG22 THR A 146 -3.738 -4.479 12.920 1.00 0.00 H new ATOM 0 HG23 THR A 146 -3.272 -4.828 11.238 1.00 0.00 H new ATOM 2227 N ALA A 147 -3.629 -1.134 13.849 1.00 0.00 N ATOM 2228 CA ALA A 147 -4.598 -0.756 14.831 1.00 0.00 C ATOM 2229 C ALA A 147 -5.928 -0.205 14.447 1.00 0.00 C ATOM 2230 O ALA A 147 -6.940 -0.738 14.899 1.00 0.00 O ATOM 2231 CB ALA A 147 -3.740 0.198 15.679 1.00 0.00 C ATOM 0 H ALA A 147 -2.686 -0.813 14.067 1.00 0.00 H new ATOM 0 HA ALA A 147 -5.016 -1.641 15.310 1.00 0.00 H new ATOM 0 HB1 ALA A 147 -4.338 0.593 16.500 1.00 0.00 H new ATOM 0 HB2 ALA A 147 -2.884 -0.343 16.081 1.00 0.00 H new ATOM 0 HB3 ALA A 147 -3.389 1.022 15.057 1.00 0.00 H new ATOM 2237 N LYS A 148 -5.970 0.891 13.668 1.00 0.00 N ATOM 2238 CA LYS A 148 -7.185 1.534 13.277 1.00 0.00 C ATOM 2239 C LYS A 148 -7.142 2.258 11.939 1.00 0.00 C ATOM 2240 O LYS A 148 -8.061 2.069 11.097 1.00 0.00 O ATOM 2241 CB LYS A 148 -7.688 2.485 14.376 1.00 0.00 C ATOM 2242 CG LYS A 148 -9.090 3.029 14.097 1.00 0.00 C ATOM 2243 CD LYS A 148 -9.676 3.788 15.289 1.00 0.00 C ATOM 2244 CE LYS A 148 -11.035 4.398 14.939 1.00 0.00 C ATOM 2245 NZ LYS A 148 -11.470 5.310 16.020 1.00 0.00 N ATOM 2246 OXT LYS A 148 -6.145 2.975 11.659 1.00 0.00 O ATOM 0 H LYS A 148 -5.133 1.343 13.299 1.00 0.00 H new ATOM 0 HA LYS A 148 -7.888 0.713 13.138 1.00 0.00 H new ATOM 0 HB2 LYS A 148 -7.691 1.959 15.331 1.00 0.00 H new ATOM 0 HB3 LYS A 148 -6.993 3.319 14.474 1.00 0.00 H new ATOM 0 HG2 LYS A 148 -9.053 3.691 13.232 1.00 0.00 H new ATOM 0 HG3 LYS A 148 -9.751 2.202 13.837 1.00 0.00 H new ATOM 0 HD2 LYS A 148 -9.785 3.112 16.137 1.00 0.00 H new ATOM 0 HD3 LYS A 148 -8.988 4.576 15.596 1.00 0.00 H new ATOM 0 HE2 LYS A 148 -10.968 4.942 13.997 1.00 0.00 H new ATOM 0 HE3 LYS A 148 -11.773 3.608 14.799 1.00 0.00 H new ATOM 0 HZ1 LYS A 148 -12.394 5.721 15.777 1.00 0.00 H new ATOM 0 HZ2 LYS A 148 -11.551 4.779 16.910 1.00 0.00 H new ATOM 0 HZ3 LYS A 148 -10.771 6.072 16.134 1.00 0.00 H new TER 2260 LYS A 148 HETATM 2261 CA CA A 151 -26.722 -2.956 -2.071 1.00 0.00 CA HETATM 2262 CA CA A 152 -21.536 -0.593 9.093 1.00 0.00 CA HETATM 2263 CA CA A 153 15.517 8.980 10.779 1.00 0.00 CA HETATM 2264 CA CA A 154 9.492 4.162 19.838 1.00 0.00 CA