USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=23 USER MOD reduce.3.24.130724 removed 949 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 18 ASN : amide:sc= 0 X(o=0,f=-0.079) USER MOD Set 1.2: A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot -25:sc= 0.12 USER MOD Single : A 8 MET CE :methyl -159:sc= -0.467 (180deg=-1.13) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 27:sc= -0.2 USER MOD Single : A 21 LYS NZ :NH3+ -123:sc= -1.03 (180deg=-2.94!) USER MOD Single : A 22 THR OG1 : rot 39:sc= -0.883 USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ -173:sc= -0.839 (180deg=-1.14) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 118:sc= 1.33 USER MOD Single : A 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 44 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 47 ASN : amide:sc= 0.19 K(o=0.19,f=-1.3!) USER MOD Single : A 50 ASN :FLIP amide:sc= 0 F(o=-0.96,f=0) USER MOD Single : A 54 ASN : amide:sc= 0 X(o=0,f=0.5) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -99:sc= 0.234 USER MOD Single : A 71 SER OG : rot 2:sc= -0.197 USER MOD Single : A 77 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 THR OG1 : rot 32:sc= 0.37 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 99 THR OG1 : rot -76:sc= 1.23 USER MOD Single : A 102 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 108 TYR OH : rot 180:sc= 0 USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 112 SER OG : rot 180:sc= 0 USER MOD Single : A 115 ASN : amide:sc= -1.98 K(o=-2,f=-19!) USER MOD Single : A 117 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 119 GLN : amide:sc= 0 K(o=0,f=-1.3!) USER MOD Single : A 121 THR OG1 : rot -61:sc= 1.26 USER MOD Single : A 131 TYR OH : rot 176:sc= 1.03 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -8.113 -22.337 2.610 1.00 0.00 N ATOM 49 CA SER A 6 -7.789 -22.450 1.193 1.00 0.00 C ATOM 50 C SER A 6 -6.837 -21.338 0.762 1.00 0.00 C ATOM 51 O SER A 6 -7.041 -20.694 -0.266 1.00 0.00 O ATOM 52 CB SER A 6 -9.065 -22.399 0.350 1.00 0.00 C ATOM 53 OG SER A 6 -9.813 -21.228 0.628 1.00 0.00 O ATOM 0 HA SER A 6 -7.295 -23.409 1.035 1.00 0.00 H new ATOM 0 HB2 SER A 6 -8.807 -22.427 -0.709 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.674 -23.280 0.553 1.00 0.00 H new ATOM 0 HG SER A 6 -9.605 -20.914 1.533 1.00 0.00 H new ATOM 59 N GLY A 7 -5.795 -21.119 1.558 1.00 0.00 N ATOM 60 CA GLY A 7 -4.826 -20.084 1.244 1.00 0.00 C ATOM 61 C GLY A 7 -5.450 -18.704 1.187 1.00 0.00 C ATOM 62 O GLY A 7 -6.470 -18.503 0.529 1.00 0.00 O ATOM 0 H GLY A 7 -5.604 -21.639 2.414 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.035 -20.091 1.994 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.358 -20.308 0.285 1.00 0.00 H new ATOM 66 N MET A 8 -4.837 -17.750 1.881 1.00 0.00 N ATOM 67 CA MET A 8 -5.340 -16.382 1.907 1.00 0.00 C ATOM 68 C MET A 8 -4.194 -15.384 2.045 1.00 0.00 C ATOM 69 O MET A 8 -3.356 -15.506 2.940 1.00 0.00 O ATOM 70 CB MET A 8 -6.330 -16.201 3.059 1.00 0.00 C ATOM 71 CG MET A 8 -6.713 -14.751 3.310 1.00 0.00 C ATOM 72 SD MET A 8 -8.366 -14.581 4.009 1.00 0.00 S ATOM 73 CE MET A 8 -9.334 -14.308 2.527 1.00 0.00 C ATOM 0 H MET A 8 -3.992 -17.900 2.432 1.00 0.00 H new ATOM 0 HA MET A 8 -5.853 -16.192 0.964 1.00 0.00 H new ATOM 0 HB2 MET A 8 -7.232 -16.775 2.845 1.00 0.00 H new ATOM 0 HB3 MET A 8 -5.896 -16.616 3.969 1.00 0.00 H new ATOM 0 HG2 MET A 8 -5.988 -14.300 3.987 1.00 0.00 H new ATOM 0 HG3 MET A 8 -6.660 -14.198 2.372 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.275 -13.825 2.791 1.00 0.00 H new ATOM 0 HE2 MET A 8 -8.778 -13.668 1.842 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.539 -15.264 2.045 1.00 0.00 H new ATOM 83 N LEU A 9 -4.163 -14.399 1.155 1.00 0.00 N ATOM 84 CA LEU A 9 -3.119 -13.380 1.177 1.00 0.00 C ATOM 85 C LEU A 9 -3.663 -12.054 1.701 1.00 0.00 C ATOM 86 O LEU A 9 -4.415 -11.365 1.011 1.00 0.00 O ATOM 87 CB LEU A 9 -2.537 -13.187 -0.224 1.00 0.00 C ATOM 88 CG LEU A 9 -1.293 -12.302 -0.318 1.00 0.00 C ATOM 89 CD1 LEU A 9 -0.040 -13.109 -0.014 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.197 -11.662 -1.695 1.00 0.00 C ATOM 0 H LEU A 9 -4.849 -14.284 0.409 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.330 -13.719 1.848 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.292 -14.168 -0.632 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.311 -12.760 -0.862 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.378 -11.508 0.424 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.835 -12.463 -0.086 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.107 -13.519 0.994 1.00 0.00 H new ATOM 0 HD13 LEU A 9 0.051 -13.924 -0.732 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.306 -11.036 -1.744 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.135 -12.441 -2.455 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.081 -11.050 -1.874 1.00 0.00 H new ATOM 102 N ARG A 10 -3.277 -11.704 2.923 1.00 0.00 N ATOM 103 CA ARG A 10 -3.725 -10.460 3.539 1.00 0.00 C ATOM 104 C ARG A 10 -2.761 -9.320 3.226 1.00 0.00 C ATOM 105 O ARG A 10 -1.551 -9.447 3.415 1.00 0.00 O ATOM 106 CB ARG A 10 -3.853 -10.633 5.053 1.00 0.00 C ATOM 107 CG ARG A 10 -5.229 -11.101 5.499 1.00 0.00 C ATOM 108 CD ARG A 10 -5.498 -10.738 6.951 1.00 0.00 C ATOM 109 NE ARG A 10 -6.639 -11.469 7.495 1.00 0.00 N ATOM 110 CZ ARG A 10 -7.089 -11.310 8.735 1.00 0.00 C ATOM 111 NH1 ARG A 10 -6.499 -10.450 9.553 1.00 0.00 N ATOM 112 NH2 ARG A 10 -8.133 -12.012 9.158 1.00 0.00 N ATOM 0 H ARG A 10 -2.655 -12.264 3.507 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.702 -10.210 3.125 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.107 -11.351 5.392 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.626 -9.684 5.539 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -5.991 -10.651 4.863 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.306 -12.181 5.373 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.612 -10.952 7.548 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.683 -9.667 7.029 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.116 -12.138 6.891 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -5.697 -9.908 9.231 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -6.847 -10.330 10.504 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.590 -12.674 8.531 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -8.478 -11.890 10.110 1.00 0.00 H new ATOM 126 N VAL A 11 -3.305 -8.206 2.745 1.00 0.00 N ATOM 127 CA VAL A 11 -2.493 -7.044 2.406 1.00 0.00 C ATOM 128 C VAL A 11 -2.938 -5.815 3.192 1.00 0.00 C ATOM 129 O VAL A 11 -3.839 -5.090 2.770 1.00 0.00 O ATOM 130 CB VAL A 11 -2.563 -6.730 0.900 1.00 0.00 C ATOM 131 CG1 VAL A 11 -1.687 -5.533 0.563 1.00 0.00 C ATOM 132 CG2 VAL A 11 -2.156 -7.947 0.083 1.00 0.00 C ATOM 0 H VAL A 11 -4.304 -8.084 2.582 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.464 -7.288 2.671 1.00 0.00 H new ATOM 0 HB VAL A 11 -3.593 -6.479 0.646 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.749 -5.326 -0.505 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -2.030 -4.662 1.122 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.653 -5.752 0.831 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.211 -7.707 -0.979 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.135 -8.232 0.338 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -2.830 -8.775 0.304 1.00 0.00 H new ATOM 142 N ILE A 12 -2.300 -5.587 4.335 1.00 0.00 N ATOM 143 CA ILE A 12 -2.629 -4.445 5.178 1.00 0.00 C ATOM 144 C ILE A 12 -1.969 -3.172 4.661 1.00 0.00 C ATOM 145 O ILE A 12 -0.797 -3.175 4.287 1.00 0.00 O ATOM 146 CB ILE A 12 -2.195 -4.679 6.637 1.00 0.00 C ATOM 147 CG1 ILE A 12 -2.728 -6.022 7.142 1.00 0.00 C ATOM 148 CG2 ILE A 12 -2.683 -3.543 7.524 1.00 0.00 C ATOM 149 CD1 ILE A 12 -1.883 -6.634 8.237 1.00 0.00 C ATOM 0 H ILE A 12 -1.552 -6.178 4.698 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.712 -4.329 5.144 1.00 0.00 H new ATOM 0 HB ILE A 12 -1.106 -4.703 6.677 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.744 -5.885 7.512 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.785 -6.719 6.306 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.368 -3.723 8.552 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -2.260 -2.601 7.175 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.771 -3.490 7.482 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.320 -7.583 8.546 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.873 -6.804 7.865 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.847 -5.956 9.090 1.00 0.00 H new ATOM 161 N VAL A 13 -2.731 -2.082 4.645 1.00 0.00 N ATOM 162 CA VAL A 13 -2.219 -0.799 4.177 1.00 0.00 C ATOM 163 C VAL A 13 -2.108 0.200 5.324 1.00 0.00 C ATOM 164 O VAL A 13 -3.061 0.914 5.632 1.00 0.00 O ATOM 165 CB VAL A 13 -3.119 -0.204 3.078 1.00 0.00 C ATOM 166 CG1 VAL A 13 -2.541 1.107 2.567 1.00 0.00 C ATOM 167 CG2 VAL A 13 -3.298 -1.197 1.940 1.00 0.00 C ATOM 0 H VAL A 13 -3.704 -2.062 4.950 1.00 0.00 H new ATOM 0 HA VAL A 13 -1.228 -0.985 3.764 1.00 0.00 H new ATOM 0 HB VAL A 13 -4.100 0.001 3.507 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -3.190 1.513 1.791 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -2.470 1.819 3.390 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -1.548 0.930 2.154 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -3.937 -0.760 1.173 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -2.326 -1.436 1.510 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -3.760 -2.108 2.321 1.00 0.00 H new ATOM 177 N GLU A 14 -0.936 0.244 5.951 1.00 0.00 N ATOM 178 CA GLU A 14 -0.701 1.156 7.064 1.00 0.00 C ATOM 179 C GLU A 14 -1.011 2.595 6.664 1.00 0.00 C ATOM 180 O GLU A 14 -2.039 3.150 7.050 1.00 0.00 O ATOM 181 CB GLU A 14 0.749 1.048 7.542 1.00 0.00 C ATOM 182 CG GLU A 14 1.022 -0.186 8.385 1.00 0.00 C ATOM 183 CD GLU A 14 -0.091 -0.477 9.372 1.00 0.00 C ATOM 184 OE1 GLU A 14 -1.037 -1.205 9.003 1.00 0.00 O ATOM 185 OE2 GLU A 14 -0.017 0.024 10.514 1.00 0.00 O ATOM 0 H GLU A 14 -0.136 -0.340 5.707 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.367 0.873 7.879 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.409 1.038 6.674 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.998 1.936 8.122 1.00 0.00 H new ATOM 0 HG2 GLU A 14 1.155 -1.047 7.730 1.00 0.00 H new ATOM 0 HG3 GLU A 14 1.958 -0.051 8.928 1.00 0.00 H new ATOM 192 N SER A 15 -0.113 3.193 5.887 1.00 0.00 N ATOM 193 CA SER A 15 -0.287 4.570 5.437 1.00 0.00 C ATOM 194 C SER A 15 0.822 4.969 4.469 1.00 0.00 C ATOM 195 O SER A 15 1.867 4.323 4.404 1.00 0.00 O ATOM 196 CB SER A 15 -0.302 5.522 6.635 1.00 0.00 C ATOM 197 OG SER A 15 0.815 5.298 7.478 1.00 0.00 O ATOM 0 H SER A 15 0.742 2.746 5.556 1.00 0.00 H new ATOM 0 HA SER A 15 -1.242 4.639 4.916 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.295 6.554 6.284 1.00 0.00 H new ATOM 0 HB3 SER A 15 -1.223 5.384 7.202 1.00 0.00 H new ATOM 0 HG SER A 15 0.783 5.920 8.235 1.00 0.00 H new ATOM 203 N ALA A 16 0.585 6.039 3.717 1.00 0.00 N ATOM 204 CA ALA A 16 1.563 6.527 2.753 1.00 0.00 C ATOM 205 C ALA A 16 2.074 7.911 3.142 1.00 0.00 C ATOM 206 O ALA A 16 1.464 8.601 3.959 1.00 0.00 O ATOM 207 CB ALA A 16 0.959 6.558 1.357 1.00 0.00 C ATOM 0 H ALA A 16 -0.276 6.584 3.757 1.00 0.00 H new ATOM 0 HA ALA A 16 2.411 5.842 2.754 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.701 6.925 0.648 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.650 5.552 1.072 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.093 7.219 1.350 1.00 0.00 H new ATOM 213 N SER A 17 3.196 8.310 2.551 1.00 0.00 N ATOM 214 CA SER A 17 3.791 9.610 2.839 1.00 0.00 C ATOM 215 C SER A 17 4.715 10.047 1.706 1.00 0.00 C ATOM 216 O SER A 17 5.071 9.251 0.839 1.00 0.00 O ATOM 217 CB SER A 17 4.568 9.558 4.156 1.00 0.00 C ATOM 218 OG SER A 17 3.699 9.693 5.267 1.00 0.00 O ATOM 0 H SER A 17 3.711 7.752 1.870 1.00 0.00 H new ATOM 0 HA SER A 17 2.986 10.339 2.929 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.108 8.614 4.226 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.313 10.354 4.174 1.00 0.00 H new ATOM 0 HG SER A 17 2.805 9.373 5.024 1.00 0.00 H new ATOM 224 N ASN A 18 5.098 11.320 1.722 1.00 0.00 N ATOM 225 CA ASN A 18 5.980 11.865 0.697 1.00 0.00 C ATOM 226 C ASN A 18 5.304 11.842 -0.671 1.00 0.00 C ATOM 227 O ASN A 18 5.921 11.482 -1.674 1.00 0.00 O ATOM 228 CB ASN A 18 7.287 11.072 0.645 1.00 0.00 C ATOM 229 CG ASN A 18 8.025 11.086 1.970 1.00 0.00 C ATOM 230 OD1 ASN A 18 8.201 12.138 2.584 1.00 0.00 O ATOM 231 ND2 ASN A 18 8.461 9.914 2.416 1.00 0.00 N ATOM 0 H ASN A 18 4.811 11.993 2.433 1.00 0.00 H new ATOM 0 HA ASN A 18 6.201 12.900 0.956 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.072 10.041 0.363 1.00 0.00 H new ATOM 0 HB3 ASN A 18 7.930 11.488 -0.131 1.00 0.00 H new ATOM 0 HD21 ASN A 18 8.965 9.861 3.301 1.00 0.00 H new ATOM 0 HD22 ASN A 18 8.292 9.067 1.873 1.00 0.00 H new ATOM 238 N ILE A 19 4.033 12.229 -0.703 1.00 0.00 N ATOM 239 CA ILE A 19 3.274 12.254 -1.947 1.00 0.00 C ATOM 240 C ILE A 19 3.484 13.568 -2.692 1.00 0.00 C ATOM 241 O ILE A 19 3.515 14.647 -2.102 1.00 0.00 O ATOM 242 CB ILE A 19 1.768 12.058 -1.691 1.00 0.00 C ATOM 243 CG1 ILE A 19 1.515 10.710 -1.013 1.00 0.00 C ATOM 244 CG2 ILE A 19 0.992 12.153 -2.997 1.00 0.00 C ATOM 245 CD1 ILE A 19 0.054 10.318 -0.972 1.00 0.00 C ATOM 0 H ILE A 19 3.508 12.529 0.118 1.00 0.00 H new ATOM 0 HA ILE A 19 3.641 11.429 -2.558 1.00 0.00 H new ATOM 0 HB ILE A 19 1.422 12.849 -1.026 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.075 9.937 -1.539 1.00 0.00 H new ATOM 0 HG13 ILE A 19 1.902 10.747 0.005 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.071 12.012 -2.800 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.151 13.134 -3.444 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.339 11.381 -3.683 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -0.050 9.352 -0.478 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.509 11.071 -0.420 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -0.333 10.248 -1.989 1.00 0.00 H new ATOM 257 N PRO A 20 3.631 13.476 -4.023 1.00 0.00 N ATOM 258 CA PRO A 20 3.839 14.647 -4.879 1.00 0.00 C ATOM 259 C PRO A 20 2.593 15.521 -4.978 1.00 0.00 C ATOM 260 O PRO A 20 1.587 15.121 -5.564 1.00 0.00 O ATOM 261 CB PRO A 20 4.174 14.036 -6.242 1.00 0.00 C ATOM 262 CG PRO A 20 3.535 12.690 -6.220 1.00 0.00 C ATOM 263 CD PRO A 20 3.606 12.221 -4.793 1.00 0.00 C ATOM 0 HA PRO A 20 4.617 15.304 -4.489 1.00 0.00 H new ATOM 0 HB2 PRO A 20 3.784 14.646 -7.056 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.252 13.961 -6.388 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.502 12.743 -6.562 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.056 12.000 -6.884 1.00 0.00 H new ATOM 0 HD2 PRO A 20 2.747 11.605 -4.529 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.497 11.620 -4.611 1.00 0.00 H new ATOM 271 N LYS A 21 2.667 16.716 -4.402 1.00 0.00 N ATOM 272 CA LYS A 21 1.545 17.648 -4.427 1.00 0.00 C ATOM 273 C LYS A 21 1.166 18.004 -5.861 1.00 0.00 C ATOM 274 O LYS A 21 1.714 17.452 -6.815 1.00 0.00 O ATOM 275 CB LYS A 21 1.895 18.919 -3.650 1.00 0.00 C ATOM 276 CG LYS A 21 2.718 18.660 -2.400 1.00 0.00 C ATOM 277 CD LYS A 21 2.787 19.892 -1.513 1.00 0.00 C ATOM 278 CE LYS A 21 1.420 20.251 -0.950 1.00 0.00 C ATOM 279 NZ LYS A 21 0.689 21.201 -1.834 1.00 0.00 N ATOM 0 H LYS A 21 3.492 17.062 -3.912 1.00 0.00 H new ATOM 0 HA LYS A 21 0.691 17.164 -3.954 1.00 0.00 H new ATOM 0 HB2 LYS A 21 2.446 19.595 -4.304 1.00 0.00 H new ATOM 0 HB3 LYS A 21 0.973 19.429 -3.369 1.00 0.00 H new ATOM 0 HG2 LYS A 21 2.282 17.832 -1.841 1.00 0.00 H new ATOM 0 HG3 LYS A 21 3.726 18.357 -2.683 1.00 0.00 H new ATOM 0 HD2 LYS A 21 3.484 19.713 -0.694 1.00 0.00 H new ATOM 0 HD3 LYS A 21 3.178 20.733 -2.086 1.00 0.00 H new ATOM 0 HE2 LYS A 21 0.829 19.344 -0.824 1.00 0.00 H new ATOM 0 HE3 LYS A 21 1.539 20.693 0.039 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 0.440 22.055 -1.295 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 1.294 21.463 -2.638 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 -0.179 20.749 -2.187 1.00 0.00 H new ATOM 293 N THR A 22 0.226 18.933 -6.006 1.00 0.00 N ATOM 294 CA THR A 22 -0.227 19.363 -7.323 1.00 0.00 C ATOM 295 C THR A 22 -0.401 20.877 -7.377 1.00 0.00 C ATOM 296 O THR A 22 -1.080 21.465 -6.535 1.00 0.00 O ATOM 297 CB THR A 22 -1.558 18.691 -7.708 1.00 0.00 C ATOM 298 OG1 THR A 22 -2.442 18.676 -6.582 1.00 0.00 O ATOM 299 CG2 THR A 22 -1.325 17.269 -8.195 1.00 0.00 C ATOM 0 H THR A 22 -0.236 19.402 -5.227 1.00 0.00 H new ATOM 0 HA THR A 22 0.542 19.062 -8.035 1.00 0.00 H new ATOM 0 HB THR A 22 -2.010 19.266 -8.517 1.00 0.00 H new ATOM 0 HG1 THR A 22 -2.357 19.518 -6.088 1.00 0.00 H new ATOM 0 HG21 THR A 22 -2.279 16.815 -8.461 1.00 0.00 H new ATOM 0 HG22 THR A 22 -0.675 17.286 -9.070 1.00 0.00 H new ATOM 0 HG23 THR A 22 -0.854 16.686 -7.404 1.00 0.00 H new ATOM 356 N LYS A 26 -4.008 19.710 -3.305 1.00 0.00 N ATOM 357 CA LYS A 26 -3.625 18.408 -2.772 1.00 0.00 C ATOM 358 C LYS A 26 -4.463 17.297 -3.397 1.00 0.00 C ATOM 359 O LYS A 26 -5.685 17.256 -3.260 1.00 0.00 O ATOM 360 CB LYS A 26 -3.788 18.390 -1.251 1.00 0.00 C ATOM 361 CG LYS A 26 -2.662 19.089 -0.510 1.00 0.00 C ATOM 362 CD LYS A 26 -2.685 18.765 0.975 1.00 0.00 C ATOM 363 CE LYS A 26 -1.504 19.392 1.701 1.00 0.00 C ATOM 364 NZ LYS A 26 -1.794 20.790 2.126 1.00 0.00 N ATOM 0 HA LYS A 26 -2.578 18.234 -3.022 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.733 18.865 -0.990 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.847 17.356 -0.913 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.704 18.788 -0.934 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.748 20.167 -0.649 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -3.616 19.126 1.413 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.666 17.684 1.113 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -1.254 18.791 2.575 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.631 19.384 1.049 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.965 21.183 2.617 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -2.008 21.370 1.290 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -2.612 20.795 2.769 1.00 0.00 H new ATOM 378 N PRO A 27 -3.791 16.373 -4.100 1.00 0.00 N ATOM 379 CA PRO A 27 -4.454 15.243 -4.758 1.00 0.00 C ATOM 380 C PRO A 27 -4.999 14.229 -3.759 1.00 0.00 C ATOM 381 O PRO A 27 -4.593 14.207 -2.597 1.00 0.00 O ATOM 382 CB PRO A 27 -3.338 14.618 -5.599 1.00 0.00 C ATOM 383 CG PRO A 27 -2.078 15.003 -4.903 1.00 0.00 C ATOM 384 CD PRO A 27 -2.333 16.359 -4.305 1.00 0.00 C ATOM 0 HA PRO A 27 -5.319 15.561 -5.340 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -3.444 13.535 -5.655 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.356 14.993 -6.622 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -1.822 14.278 -4.131 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.241 15.035 -5.601 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.794 16.492 -3.367 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.013 17.159 -4.973 1.00 0.00 H new ATOM 392 N ASP A 28 -5.921 13.390 -4.218 1.00 0.00 N ATOM 393 CA ASP A 28 -6.522 12.371 -3.365 1.00 0.00 C ATOM 394 C ASP A 28 -5.910 11.001 -3.641 1.00 0.00 C ATOM 395 O ASP A 28 -6.296 10.299 -4.576 1.00 0.00 O ATOM 396 CB ASP A 28 -8.035 12.321 -3.581 1.00 0.00 C ATOM 397 CG ASP A 28 -8.633 13.696 -3.805 1.00 0.00 C ATOM 398 OD1 ASP A 28 -8.310 14.323 -4.835 1.00 0.00 O ATOM 399 OD2 ASP A 28 -9.424 14.146 -2.949 1.00 0.00 O ATOM 0 H ASP A 28 -6.269 13.395 -5.177 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.320 12.636 -2.327 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.256 11.688 -4.440 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.508 11.859 -2.714 1.00 0.00 H new ATOM 404 N PRO A 29 -4.932 10.611 -2.810 1.00 0.00 N ATOM 405 CA PRO A 29 -4.246 9.322 -2.945 1.00 0.00 C ATOM 406 C PRO A 29 -5.149 8.145 -2.593 1.00 0.00 C ATOM 407 O PRO A 29 -6.000 8.246 -1.708 1.00 0.00 O ATOM 408 CB PRO A 29 -3.092 9.429 -1.945 1.00 0.00 C ATOM 409 CG PRO A 29 -3.559 10.414 -0.931 1.00 0.00 C ATOM 410 CD PRO A 29 -4.421 11.397 -1.674 1.00 0.00 C ATOM 0 HA PRO A 29 -3.925 9.136 -3.970 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -2.874 8.464 -1.488 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.177 9.766 -2.432 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -4.123 9.921 -0.139 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.715 10.915 -0.457 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -5.231 11.774 -1.049 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.848 12.262 -2.009 1.00 0.00 H new ATOM 418 N ILE A 30 -4.959 7.030 -3.291 1.00 0.00 N ATOM 419 CA ILE A 30 -5.756 5.834 -3.050 1.00 0.00 C ATOM 420 C ILE A 30 -4.995 4.576 -3.455 1.00 0.00 C ATOM 421 O ILE A 30 -4.555 4.444 -4.597 1.00 0.00 O ATOM 422 CB ILE A 30 -7.090 5.882 -3.818 1.00 0.00 C ATOM 423 CG1 ILE A 30 -7.951 4.667 -3.466 1.00 0.00 C ATOM 424 CG2 ILE A 30 -6.837 5.943 -5.316 1.00 0.00 C ATOM 425 CD1 ILE A 30 -9.437 4.932 -3.556 1.00 0.00 C ATOM 0 H ILE A 30 -4.260 6.930 -4.027 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.963 5.803 -1.980 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.629 6.783 -3.524 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.696 3.845 -4.135 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.709 4.341 -2.454 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.790 5.976 -5.845 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.260 6.837 -5.551 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.280 5.059 -5.627 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -9.985 4.027 -3.293 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.706 5.732 -2.867 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.693 5.228 -4.573 1.00 0.00 H new ATOM 437 N VAL A 31 -4.844 3.653 -2.510 1.00 0.00 N ATOM 438 CA VAL A 31 -4.139 2.403 -2.769 1.00 0.00 C ATOM 439 C VAL A 31 -5.029 1.413 -3.513 1.00 0.00 C ATOM 440 O VAL A 31 -6.175 1.182 -3.128 1.00 0.00 O ATOM 441 CB VAL A 31 -3.650 1.754 -1.461 1.00 0.00 C ATOM 442 CG1 VAL A 31 -2.893 0.467 -1.753 1.00 0.00 C ATOM 443 CG2 VAL A 31 -2.782 2.726 -0.676 1.00 0.00 C ATOM 0 H VAL A 31 -5.200 3.747 -1.559 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.277 2.649 -3.389 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.519 1.506 -0.852 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.555 0.023 -0.817 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.550 -0.232 -2.270 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.030 0.687 -2.382 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.445 2.251 0.245 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.917 3.008 -1.276 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.361 3.617 -0.434 1.00 0.00 H new ATOM 453 N SER A 32 -4.493 0.831 -4.581 1.00 0.00 N ATOM 454 CA SER A 32 -5.239 -0.132 -5.382 1.00 0.00 C ATOM 455 C SER A 32 -4.439 -1.417 -5.572 1.00 0.00 C ATOM 456 O SER A 32 -3.518 -1.473 -6.387 1.00 0.00 O ATOM 457 CB SER A 32 -5.592 0.469 -6.743 1.00 0.00 C ATOM 458 OG SER A 32 -6.411 1.617 -6.598 1.00 0.00 O ATOM 0 H SER A 32 -3.545 1.010 -4.912 1.00 0.00 H new ATOM 0 HA SER A 32 -6.159 -0.373 -4.850 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.678 0.735 -7.274 1.00 0.00 H new ATOM 0 HB3 SER A 32 -6.108 -0.275 -7.350 1.00 0.00 H new ATOM 0 HG SER A 32 -6.621 1.983 -7.483 1.00 0.00 H new ATOM 464 N VAL A 33 -4.797 -2.448 -4.813 1.00 0.00 N ATOM 465 CA VAL A 33 -4.114 -3.733 -4.898 1.00 0.00 C ATOM 466 C VAL A 33 -4.825 -4.671 -5.867 1.00 0.00 C ATOM 467 O VAL A 33 -6.054 -4.747 -5.884 1.00 0.00 O ATOM 468 CB VAL A 33 -4.021 -4.412 -3.519 1.00 0.00 C ATOM 469 CG1 VAL A 33 -3.295 -5.744 -3.626 1.00 0.00 C ATOM 470 CG2 VAL A 33 -3.329 -3.497 -2.520 1.00 0.00 C ATOM 0 H VAL A 33 -5.556 -2.418 -4.132 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.107 -3.532 -5.264 1.00 0.00 H new ATOM 0 HB VAL A 33 -5.032 -4.605 -3.160 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.239 -6.208 -2.641 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -3.837 -6.400 -4.307 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.287 -5.579 -4.007 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.272 -3.993 -1.551 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.322 -3.270 -2.871 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -3.896 -2.571 -2.421 1.00 0.00 H new ATOM 480 N ILE A 34 -4.044 -5.383 -6.673 1.00 0.00 N ATOM 481 CA ILE A 34 -4.600 -6.317 -7.644 1.00 0.00 C ATOM 482 C ILE A 34 -3.932 -7.684 -7.537 1.00 0.00 C ATOM 483 O ILE A 34 -2.726 -7.816 -7.750 1.00 0.00 O ATOM 484 CB ILE A 34 -4.442 -5.793 -9.084 1.00 0.00 C ATOM 485 CG1 ILE A 34 -5.267 -4.519 -9.279 1.00 0.00 C ATOM 486 CG2 ILE A 34 -4.860 -6.859 -10.085 1.00 0.00 C ATOM 487 CD1 ILE A 34 -4.514 -3.253 -8.933 1.00 0.00 C ATOM 0 H ILE A 34 -3.025 -5.331 -6.673 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.661 -6.415 -7.416 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.392 -5.554 -9.255 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -5.596 -4.464 -10.317 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.164 -4.579 -8.663 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.743 -6.473 -11.098 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.234 -7.742 -9.958 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.903 -7.126 -9.917 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.160 -2.390 -9.095 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.208 -3.286 -7.887 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.631 -3.170 -9.567 1.00 0.00 H new ATOM 499 N PHE A 35 -4.723 -8.699 -7.206 1.00 0.00 N ATOM 500 CA PHE A 35 -4.209 -10.057 -7.072 1.00 0.00 C ATOM 501 C PHE A 35 -5.299 -11.083 -7.366 1.00 0.00 C ATOM 502 O PHE A 35 -6.432 -10.953 -6.902 1.00 0.00 O ATOM 503 CB PHE A 35 -3.652 -10.277 -5.663 1.00 0.00 C ATOM 504 CG PHE A 35 -2.844 -11.535 -5.528 1.00 0.00 C ATOM 505 CD1 PHE A 35 -1.479 -11.527 -5.767 1.00 0.00 C ATOM 506 CD2 PHE A 35 -3.449 -12.727 -5.161 1.00 0.00 C ATOM 507 CE1 PHE A 35 -0.734 -12.684 -5.644 1.00 0.00 C ATOM 508 CE2 PHE A 35 -2.708 -13.887 -5.036 1.00 0.00 C ATOM 509 CZ PHE A 35 -1.349 -13.865 -5.277 1.00 0.00 C ATOM 0 H PHE A 35 -5.723 -8.607 -7.026 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.406 -10.188 -7.798 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -3.031 -9.424 -5.389 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -4.480 -10.308 -4.955 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.992 -10.606 -6.053 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -4.512 -12.750 -4.971 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.329 -12.665 -5.835 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.192 -14.809 -4.750 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.768 -14.770 -5.179 1.00 0.00 H new ATOM 519 N LYS A 36 -4.948 -12.104 -8.141 1.00 0.00 N ATOM 520 CA LYS A 36 -5.895 -13.154 -8.498 1.00 0.00 C ATOM 521 C LYS A 36 -7.143 -12.564 -9.147 1.00 0.00 C ATOM 522 O LYS A 36 -8.265 -12.848 -8.728 1.00 0.00 O ATOM 523 CB LYS A 36 -6.285 -13.960 -7.257 1.00 0.00 C ATOM 524 CG LYS A 36 -5.147 -14.788 -6.687 1.00 0.00 C ATOM 525 CD LYS A 36 -5.107 -16.179 -7.298 1.00 0.00 C ATOM 526 CE LYS A 36 -3.708 -16.772 -7.243 1.00 0.00 C ATOM 527 NZ LYS A 36 -3.462 -17.718 -8.367 1.00 0.00 N ATOM 0 H LYS A 36 -4.015 -12.227 -8.534 1.00 0.00 H new ATOM 0 HA LYS A 36 -5.412 -13.816 -9.217 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.646 -13.276 -6.489 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -7.114 -14.622 -7.509 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -4.200 -14.281 -6.872 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -5.260 -14.868 -5.606 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.801 -16.831 -6.767 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -5.443 -16.132 -8.334 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -2.972 -15.969 -7.276 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -3.571 -17.291 -6.295 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -2.545 -18.190 -8.229 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -4.218 -18.432 -8.392 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -3.450 -17.194 -9.265 1.00 0.00 H new ATOM 541 N ASP A 37 -6.939 -11.745 -10.173 1.00 0.00 N ATOM 542 CA ASP A 37 -8.048 -11.117 -10.882 1.00 0.00 C ATOM 543 C ASP A 37 -9.032 -10.485 -9.902 1.00 0.00 C ATOM 544 O ASP A 37 -10.245 -10.550 -10.099 1.00 0.00 O ATOM 545 CB ASP A 37 -8.768 -12.144 -11.757 1.00 0.00 C ATOM 546 CG ASP A 37 -7.911 -12.625 -12.911 1.00 0.00 C ATOM 547 OD1 ASP A 37 -7.787 -11.882 -13.907 1.00 0.00 O ATOM 548 OD2 ASP A 37 -7.364 -13.743 -12.818 1.00 0.00 O ATOM 0 H ASP A 37 -6.016 -11.500 -10.532 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.642 -10.330 -11.518 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -9.060 -12.997 -11.145 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -9.685 -11.704 -12.148 1.00 0.00 H new ATOM 553 N GLU A 38 -8.500 -9.877 -8.846 1.00 0.00 N ATOM 554 CA GLU A 38 -9.332 -9.236 -7.835 1.00 0.00 C ATOM 555 C GLU A 38 -8.848 -7.817 -7.552 1.00 0.00 C ATOM 556 O GLU A 38 -7.878 -7.613 -6.823 1.00 0.00 O ATOM 557 CB GLU A 38 -9.326 -10.056 -6.543 1.00 0.00 C ATOM 558 CG GLU A 38 -10.594 -9.903 -5.720 1.00 0.00 C ATOM 559 CD GLU A 38 -11.825 -10.410 -6.446 1.00 0.00 C ATOM 560 OE1 GLU A 38 -11.834 -11.592 -6.847 1.00 0.00 O ATOM 561 OE2 GLU A 38 -12.780 -9.622 -6.613 1.00 0.00 O ATOM 0 H GLU A 38 -7.497 -9.815 -8.669 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.351 -9.184 -8.219 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -9.189 -11.108 -6.791 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -8.471 -9.757 -5.937 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.481 -10.445 -4.781 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -10.733 -8.852 -5.466 1.00 0.00 H new ATOM 568 N LYS A 39 -9.532 -6.838 -8.136 1.00 0.00 N ATOM 569 CA LYS A 39 -9.174 -5.437 -7.948 1.00 0.00 C ATOM 570 C LYS A 39 -9.726 -4.907 -6.628 1.00 0.00 C ATOM 571 O LYS A 39 -10.928 -4.681 -6.492 1.00 0.00 O ATOM 572 CB LYS A 39 -9.704 -4.593 -9.109 1.00 0.00 C ATOM 573 CG LYS A 39 -9.011 -3.249 -9.251 1.00 0.00 C ATOM 574 CD LYS A 39 -9.008 -2.773 -10.694 1.00 0.00 C ATOM 575 CE LYS A 39 -7.944 -3.486 -11.514 1.00 0.00 C ATOM 576 NZ LYS A 39 -8.169 -3.321 -12.977 1.00 0.00 N ATOM 0 H LYS A 39 -10.337 -6.989 -8.743 1.00 0.00 H new ATOM 0 HA LYS A 39 -8.087 -5.367 -7.922 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.587 -5.153 -10.037 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -10.772 -4.428 -8.969 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -9.513 -2.512 -8.625 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.985 -3.328 -8.891 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -9.988 -2.947 -11.138 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.831 -1.698 -10.723 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -6.961 -3.096 -11.251 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -7.943 -4.547 -11.264 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.423 -3.821 -13.502 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -9.096 -3.716 -13.232 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -8.145 -2.310 -13.220 1.00 0.00 H new ATOM 590 N LYS A 40 -8.839 -4.710 -5.658 1.00 0.00 N ATOM 591 CA LYS A 40 -9.236 -4.204 -4.349 1.00 0.00 C ATOM 592 C LYS A 40 -8.469 -2.932 -4.002 1.00 0.00 C ATOM 593 O LYS A 40 -7.238 -2.913 -4.019 1.00 0.00 O ATOM 594 CB LYS A 40 -8.996 -5.266 -3.275 1.00 0.00 C ATOM 595 CG LYS A 40 -9.984 -6.419 -3.327 1.00 0.00 C ATOM 596 CD LYS A 40 -9.784 -7.379 -2.167 1.00 0.00 C ATOM 597 CE LYS A 40 -10.375 -8.747 -2.467 1.00 0.00 C ATOM 598 NZ LYS A 40 -11.807 -8.833 -2.066 1.00 0.00 N ATOM 0 H LYS A 40 -7.840 -4.893 -5.754 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.299 -3.967 -4.386 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.985 -5.659 -3.385 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.050 -4.796 -2.293 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -11.001 -6.028 -3.306 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -9.868 -6.956 -4.269 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.719 -7.480 -1.956 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -10.249 -6.969 -1.270 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.283 -8.956 -3.533 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -9.804 -9.512 -1.941 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -12.173 -9.781 -2.287 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -11.893 -8.658 -1.044 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -12.357 -8.120 -2.586 1.00 0.00 H new ATOM 612 N LYS A 41 -9.203 -1.871 -3.687 1.00 0.00 N ATOM 613 CA LYS A 41 -8.593 -0.595 -3.332 1.00 0.00 C ATOM 614 C LYS A 41 -9.007 -0.165 -1.929 1.00 0.00 C ATOM 615 O LYS A 41 -9.961 -0.698 -1.360 1.00 0.00 O ATOM 616 CB LYS A 41 -8.989 0.482 -4.345 1.00 0.00 C ATOM 617 CG LYS A 41 -10.487 0.577 -4.578 1.00 0.00 C ATOM 618 CD LYS A 41 -11.163 1.431 -3.518 1.00 0.00 C ATOM 619 CE LYS A 41 -12.624 1.684 -3.855 1.00 0.00 C ATOM 620 NZ LYS A 41 -13.201 2.783 -3.032 1.00 0.00 N ATOM 0 H LYS A 41 -10.223 -1.869 -3.670 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.510 -0.721 -3.349 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.622 1.448 -3.998 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.495 0.275 -5.294 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.677 1.001 -5.564 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.921 -0.423 -4.572 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -11.092 0.935 -2.550 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -10.639 2.383 -3.427 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.715 1.936 -4.912 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -13.197 0.771 -3.695 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -14.198 2.925 -3.292 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -13.138 2.532 -2.025 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -12.671 3.661 -3.204 1.00 0.00 H new ATOM 634 N THR A 42 -8.285 0.804 -1.374 1.00 0.00 N ATOM 635 CA THR A 42 -8.577 1.306 -0.038 1.00 0.00 C ATOM 636 C THR A 42 -9.392 2.593 -0.100 1.00 0.00 C ATOM 637 O THR A 42 -9.615 3.148 -1.176 1.00 0.00 O ATOM 638 CB THR A 42 -7.285 1.568 0.759 1.00 0.00 C ATOM 639 OG1 THR A 42 -6.541 2.629 0.150 1.00 0.00 O ATOM 640 CG2 THR A 42 -6.428 0.313 0.827 1.00 0.00 C ATOM 0 H THR A 42 -7.493 1.257 -1.830 1.00 0.00 H new ATOM 0 HA THR A 42 -9.158 0.535 0.469 1.00 0.00 H new ATOM 0 HB THR A 42 -7.561 1.855 1.774 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.461 3.376 0.780 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.521 0.522 1.394 1.00 0.00 H new ATOM 0 HG22 THR A 42 -6.988 -0.484 1.317 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.160 0.000 -0.182 1.00 0.00 H new ATOM 648 N LYS A 43 -9.835 3.063 1.061 1.00 0.00 N ATOM 649 CA LYS A 43 -10.625 4.287 1.140 1.00 0.00 C ATOM 650 C LYS A 43 -9.793 5.498 0.732 1.00 0.00 C ATOM 651 O LYS A 43 -8.679 5.692 1.218 1.00 0.00 O ATOM 652 CB LYS A 43 -11.164 4.480 2.560 1.00 0.00 C ATOM 653 CG LYS A 43 -10.075 4.621 3.609 1.00 0.00 C ATOM 654 CD LYS A 43 -10.661 4.794 5.001 1.00 0.00 C ATOM 655 CE LYS A 43 -10.940 6.257 5.309 1.00 0.00 C ATOM 656 NZ LYS A 43 -9.730 6.956 5.824 1.00 0.00 N ATOM 0 H LYS A 43 -9.661 2.615 1.961 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.463 4.194 0.449 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -11.796 5.368 2.582 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.798 3.631 2.818 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.434 3.740 3.590 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -9.446 5.478 3.369 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -11.585 4.221 5.082 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -9.970 4.390 5.741 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -11.292 6.757 4.407 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -11.741 6.327 6.045 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -9.961 7.950 6.022 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -9.409 6.495 6.699 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -8.974 6.912 5.111 1.00 0.00 H new ATOM 670 N LYS A 44 -10.342 6.312 -0.164 1.00 0.00 N ATOM 671 CA LYS A 44 -9.653 7.507 -0.636 1.00 0.00 C ATOM 672 C LYS A 44 -9.536 8.544 0.477 1.00 0.00 C ATOM 673 O LYS A 44 -10.496 8.800 1.203 1.00 0.00 O ATOM 674 CB LYS A 44 -10.393 8.109 -1.833 1.00 0.00 C ATOM 675 CG LYS A 44 -11.449 9.130 -1.444 1.00 0.00 C ATOM 676 CD LYS A 44 -12.071 9.782 -2.668 1.00 0.00 C ATOM 677 CE LYS A 44 -12.998 8.823 -3.399 1.00 0.00 C ATOM 678 NZ LYS A 44 -14.319 8.705 -2.721 1.00 0.00 N ATOM 0 H LYS A 44 -11.263 6.165 -0.578 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.649 7.218 -0.946 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.669 8.582 -2.497 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.866 7.306 -2.398 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.227 8.644 -0.855 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.001 9.896 -0.811 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -12.628 10.669 -2.366 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -11.284 10.115 -3.344 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.144 9.168 -4.422 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -12.531 7.840 -3.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -14.922 8.043 -3.249 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -14.182 8.351 -1.753 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -14.776 9.638 -2.687 1.00 0.00 H new ATOM 692 N VAL A 45 -8.354 9.139 0.604 1.00 0.00 N ATOM 693 CA VAL A 45 -8.113 10.150 1.626 1.00 0.00 C ATOM 694 C VAL A 45 -8.167 11.554 1.034 1.00 0.00 C ATOM 695 O VAL A 45 -7.411 11.882 0.120 1.00 0.00 O ATOM 696 CB VAL A 45 -6.748 9.944 2.309 1.00 0.00 C ATOM 697 CG1 VAL A 45 -6.422 11.119 3.217 1.00 0.00 C ATOM 698 CG2 VAL A 45 -6.734 8.637 3.087 1.00 0.00 C ATOM 0 H VAL A 45 -7.548 8.938 0.012 1.00 0.00 H new ATOM 0 HA VAL A 45 -8.902 10.042 2.370 1.00 0.00 H new ATOM 0 HB VAL A 45 -5.980 9.889 1.538 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.454 10.955 3.691 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.387 12.035 2.628 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.191 11.210 3.984 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.762 8.507 3.563 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.512 8.660 3.850 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.918 7.806 2.406 1.00 0.00 H new ATOM 708 N ASP A 46 -9.064 12.379 1.562 1.00 0.00 N ATOM 709 CA ASP A 46 -9.216 13.749 1.087 1.00 0.00 C ATOM 710 C ASP A 46 -7.857 14.427 0.940 1.00 0.00 C ATOM 711 O ASP A 46 -6.832 13.877 1.341 1.00 0.00 O ATOM 712 CB ASP A 46 -10.097 14.550 2.048 1.00 0.00 C ATOM 713 CG ASP A 46 -11.575 14.283 1.837 1.00 0.00 C ATOM 714 OD1 ASP A 46 -12.116 14.728 0.803 1.00 0.00 O ATOM 715 OD2 ASP A 46 -12.189 13.629 2.705 1.00 0.00 O ATOM 0 H ASP A 46 -9.697 12.123 2.320 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.694 13.717 0.108 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -9.829 14.302 3.075 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -9.900 15.614 1.916 1.00 0.00 H new ATOM 720 N ASN A 47 -7.858 15.623 0.360 1.00 0.00 N ATOM 721 CA ASN A 47 -6.625 16.374 0.157 1.00 0.00 C ATOM 722 C ASN A 47 -5.658 16.157 1.318 1.00 0.00 C ATOM 723 O ASN A 47 -5.819 16.742 2.389 1.00 0.00 O ATOM 724 CB ASN A 47 -6.931 17.866 0.006 1.00 0.00 C ATOM 725 CG ASN A 47 -8.175 18.281 0.768 1.00 0.00 C ATOM 726 OD1 ASN A 47 -9.296 18.102 0.293 1.00 0.00 O ATOM 727 ND2 ASN A 47 -7.981 18.838 1.958 1.00 0.00 N ATOM 0 H ASN A 47 -8.698 16.092 0.023 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.155 16.012 -0.757 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -6.080 18.447 0.362 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -7.059 18.103 -1.050 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -8.780 19.137 2.518 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -7.033 18.967 2.312 1.00 0.00 H new ATOM 734 N GLU A 48 -4.655 15.314 1.096 1.00 0.00 N ATOM 735 CA GLU A 48 -3.663 15.020 2.124 1.00 0.00 C ATOM 736 C GLU A 48 -2.440 14.337 1.520 1.00 0.00 C ATOM 737 O GLU A 48 -2.562 13.360 0.779 1.00 0.00 O ATOM 738 CB GLU A 48 -4.271 14.132 3.211 1.00 0.00 C ATOM 739 CG GLU A 48 -3.280 13.724 4.289 1.00 0.00 C ATOM 740 CD GLU A 48 -2.616 14.916 4.952 1.00 0.00 C ATOM 741 OE1 GLU A 48 -3.208 16.015 4.928 1.00 0.00 O ATOM 742 OE2 GLU A 48 -1.504 14.748 5.495 1.00 0.00 O ATOM 0 H GLU A 48 -4.508 14.823 0.214 1.00 0.00 H new ATOM 0 HA GLU A 48 -3.348 15.964 2.569 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -5.104 14.660 3.676 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -4.681 13.235 2.748 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.795 13.132 5.046 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.515 13.084 3.850 1.00 0.00 H new ATOM 749 N LEU A 49 -1.261 14.859 1.840 1.00 0.00 N ATOM 750 CA LEU A 49 -0.013 14.301 1.329 1.00 0.00 C ATOM 751 C LEU A 49 0.303 12.969 2.001 1.00 0.00 C ATOM 752 O LEU A 49 0.637 11.990 1.335 1.00 0.00 O ATOM 753 CB LEU A 49 1.138 15.284 1.553 1.00 0.00 C ATOM 754 CG LEU A 49 1.430 16.248 0.403 1.00 0.00 C ATOM 755 CD1 LEU A 49 0.134 16.782 -0.189 1.00 0.00 C ATOM 756 CD2 LEU A 49 2.312 17.393 0.878 1.00 0.00 C ATOM 0 H LEU A 49 -1.143 15.667 2.451 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.132 14.128 0.259 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.920 15.870 2.446 1.00 0.00 H new ATOM 0 HB3 LEU A 49 2.043 14.712 1.760 1.00 0.00 H new ATOM 0 HG LEU A 49 1.964 15.703 -0.376 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.362 17.466 -1.006 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.463 15.952 -0.567 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.427 17.311 0.581 1.00 0.00 H new ATOM 0 HD21 LEU A 49 2.510 18.069 0.046 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.805 17.937 1.675 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.255 16.995 1.253 1.00 0.00 H new ATOM 768 N ASN A 50 0.193 12.939 3.325 1.00 0.00 N ATOM 769 CA ASN A 50 0.466 11.726 4.088 1.00 0.00 C ATOM 770 C ASN A 50 -0.828 11.114 4.617 1.00 0.00 C ATOM 771 O ASN A 50 -1.203 11.298 5.775 1.00 0.00 O ATOM 772 CB ASN A 50 1.411 12.032 5.251 1.00 0.00 C ATOM 773 CG ASN A 50 2.349 13.184 4.946 1.00 0.00 C ATOM 774 OD1 ASN A 50 3.241 12.983 3.983 1.00 0.00 O flip ATOM 775 ND2 ASN A 50 2.271 14.243 5.569 1.00 0.00 N flip ATOM 0 H ASN A 50 -0.083 13.741 3.892 1.00 0.00 H new ATOM 0 HA ASN A 50 0.942 11.007 3.422 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.825 12.269 6.139 1.00 0.00 H new ATOM 0 HB3 ASN A 50 1.996 11.142 5.484 1.00 0.00 H new ATOM 0 HD21 ASN A 50 1.570 14.353 6.301 1.00 0.00 H new ATOM 0 HD22 ASN A 50 2.908 15.010 5.353 1.00 0.00 H new ATOM 782 N PRO A 51 -1.527 10.367 3.749 1.00 0.00 N ATOM 783 CA PRO A 51 -2.789 9.711 4.106 1.00 0.00 C ATOM 784 C PRO A 51 -2.586 8.560 5.085 1.00 0.00 C ATOM 785 O PRO A 51 -1.460 8.123 5.321 1.00 0.00 O ATOM 786 CB PRO A 51 -3.308 9.188 2.765 1.00 0.00 C ATOM 787 CG PRO A 51 -2.089 9.020 1.926 1.00 0.00 C ATOM 788 CD PRO A 51 -1.140 10.105 2.353 1.00 0.00 C ATOM 0 HA PRO A 51 -3.476 10.393 4.607 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -3.838 8.243 2.887 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.008 9.889 2.311 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.647 8.035 2.073 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.330 9.107 0.866 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.101 9.783 2.278 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.243 10.996 1.733 1.00 0.00 H new ATOM 796 N VAL A 52 -3.685 8.072 5.653 1.00 0.00 N ATOM 797 CA VAL A 52 -3.628 6.970 6.606 1.00 0.00 C ATOM 798 C VAL A 52 -4.862 6.081 6.493 1.00 0.00 C ATOM 799 O VAL A 52 -5.956 6.466 6.905 1.00 0.00 O ATOM 800 CB VAL A 52 -3.510 7.484 8.053 1.00 0.00 C ATOM 801 CG1 VAL A 52 -3.528 6.323 9.035 1.00 0.00 C ATOM 802 CG2 VAL A 52 -2.248 8.316 8.221 1.00 0.00 C ATOM 0 H VAL A 52 -4.625 8.423 5.469 1.00 0.00 H new ATOM 0 HA VAL A 52 -2.740 6.387 6.362 1.00 0.00 H new ATOM 0 HB VAL A 52 -4.369 8.121 8.265 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.444 6.705 10.052 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.463 5.773 8.931 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -2.690 5.658 8.827 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.181 8.671 9.249 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.376 7.705 7.990 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.282 9.170 7.544 1.00 0.00 H new ATOM 812 N TRP A 53 -4.678 4.892 5.932 1.00 0.00 N ATOM 813 CA TRP A 53 -5.777 3.947 5.765 1.00 0.00 C ATOM 814 C TRP A 53 -5.833 2.966 6.930 1.00 0.00 C ATOM 815 O TRP A 53 -6.889 2.754 7.525 1.00 0.00 O ATOM 816 CB TRP A 53 -5.626 3.186 4.447 1.00 0.00 C ATOM 817 CG TRP A 53 -5.519 4.083 3.252 1.00 0.00 C ATOM 818 CD1 TRP A 53 -6.550 4.645 2.554 1.00 0.00 C ATOM 819 CD2 TRP A 53 -4.314 4.520 2.613 1.00 0.00 C ATOM 820 NE1 TRP A 53 -6.058 5.405 1.520 1.00 0.00 N ATOM 821 CE2 TRP A 53 -4.689 5.345 1.535 1.00 0.00 C ATOM 822 CE3 TRP A 53 -2.955 4.296 2.849 1.00 0.00 C ATOM 823 CZ2 TRP A 53 -3.754 5.944 0.696 1.00 0.00 C ATOM 824 CZ3 TRP A 53 -2.028 4.891 2.015 1.00 0.00 C ATOM 825 CH2 TRP A 53 -2.430 5.708 0.950 1.00 0.00 C ATOM 0 H TRP A 53 -3.779 4.559 5.585 1.00 0.00 H new ATOM 0 HA TRP A 53 -6.709 4.511 5.745 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -4.738 2.555 4.500 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -6.481 2.523 4.319 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -7.597 4.512 2.781 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -6.621 5.929 0.850 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -2.635 3.669 3.668 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -4.062 6.573 -0.126 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -0.975 4.723 2.187 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -1.681 6.160 0.317 1.00 0.00 H new ATOM 836 N ASN A 54 -4.689 2.369 7.252 1.00 0.00 N ATOM 837 CA ASN A 54 -4.609 1.409 8.347 1.00 0.00 C ATOM 838 C ASN A 54 -5.714 0.363 8.234 1.00 0.00 C ATOM 839 O ASN A 54 -6.316 -0.027 9.234 1.00 0.00 O ATOM 840 CB ASN A 54 -4.709 2.130 9.693 1.00 0.00 C ATOM 841 CG ASN A 54 -3.910 1.437 10.780 1.00 0.00 C ATOM 842 OD1 ASN A 54 -4.169 0.282 11.116 1.00 0.00 O ATOM 843 ND2 ASN A 54 -2.931 2.143 11.335 1.00 0.00 N ATOM 0 H ASN A 54 -3.805 2.533 6.770 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.646 0.903 8.285 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -4.353 3.154 9.581 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -5.755 2.187 9.995 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -2.359 1.730 12.071 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -2.752 3.098 11.025 1.00 0.00 H new ATOM 850 N GLU A 55 -5.973 -0.088 7.011 1.00 0.00 N ATOM 851 CA GLU A 55 -7.005 -1.089 6.768 1.00 0.00 C ATOM 852 C GLU A 55 -6.389 -2.474 6.595 1.00 0.00 C ATOM 853 O GLU A 55 -5.174 -2.643 6.703 1.00 0.00 O ATOM 854 CB GLU A 55 -7.821 -0.722 5.527 1.00 0.00 C ATOM 855 CG GLU A 55 -7.094 -0.991 4.220 1.00 0.00 C ATOM 856 CD GLU A 55 -6.910 -2.471 3.948 1.00 0.00 C ATOM 857 OE1 GLU A 55 -7.890 -3.124 3.531 1.00 0.00 O ATOM 858 OE2 GLU A 55 -5.787 -2.978 4.153 1.00 0.00 O ATOM 0 H GLU A 55 -5.482 0.224 6.173 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.666 -1.110 7.634 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.754 -1.285 5.537 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -8.085 0.334 5.575 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -7.652 -0.541 3.399 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -6.118 -0.506 4.245 1.00 0.00 H new ATOM 865 N ILE A 56 -7.236 -3.462 6.325 1.00 0.00 N ATOM 866 CA ILE A 56 -6.775 -4.832 6.136 1.00 0.00 C ATOM 867 C ILE A 56 -7.451 -5.478 4.931 1.00 0.00 C ATOM 868 O ILE A 56 -8.674 -5.612 4.889 1.00 0.00 O ATOM 869 CB ILE A 56 -7.044 -5.693 7.384 1.00 0.00 C ATOM 870 CG1 ILE A 56 -6.518 -4.992 8.638 1.00 0.00 C ATOM 871 CG2 ILE A 56 -6.403 -7.065 7.229 1.00 0.00 C ATOM 872 CD1 ILE A 56 -7.050 -5.579 9.926 1.00 0.00 C ATOM 0 H ILE A 56 -8.244 -3.339 6.232 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.700 -4.783 5.963 1.00 0.00 H new ATOM 0 HB ILE A 56 -8.121 -5.826 7.490 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.429 -5.047 8.646 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.784 -3.936 8.592 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.602 -7.662 8.119 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -6.821 -7.565 6.356 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.326 -6.951 7.101 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.635 -5.033 10.773 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -8.137 -5.500 9.940 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.762 -6.628 9.994 1.00 0.00 H new ATOM 884 N LEU A 57 -6.646 -5.877 3.952 1.00 0.00 N ATOM 885 CA LEU A 57 -7.165 -6.512 2.746 1.00 0.00 C ATOM 886 C LEU A 57 -7.034 -8.029 2.829 1.00 0.00 C ATOM 887 O LEU A 57 -6.216 -8.550 3.586 1.00 0.00 O ATOM 888 CB LEU A 57 -6.425 -5.991 1.513 1.00 0.00 C ATOM 889 CG LEU A 57 -6.435 -4.475 1.314 1.00 0.00 C ATOM 890 CD1 LEU A 57 -5.305 -4.050 0.389 1.00 0.00 C ATOM 891 CD2 LEU A 57 -7.778 -4.018 0.763 1.00 0.00 C ATOM 0 H LEU A 57 -5.632 -5.772 3.970 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.222 -6.262 2.660 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.388 -6.323 1.569 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -6.861 -6.456 0.629 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.282 -4.000 2.283 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.328 -2.968 0.259 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.349 -4.343 0.824 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.426 -4.534 -0.580 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -7.767 -2.936 0.628 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -7.961 -4.502 -0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -8.569 -4.288 1.462 1.00 0.00 H new ATOM 903 N GLU A 58 -7.845 -8.732 2.043 1.00 0.00 N ATOM 904 CA GLU A 58 -7.818 -10.190 2.028 1.00 0.00 C ATOM 905 C GLU A 58 -8.047 -10.723 0.617 1.00 0.00 C ATOM 906 O GLU A 58 -8.995 -10.328 -0.062 1.00 0.00 O ATOM 907 CB GLU A 58 -8.879 -10.752 2.976 1.00 0.00 C ATOM 908 CG GLU A 58 -8.954 -10.022 4.307 1.00 0.00 C ATOM 909 CD GLU A 58 -10.041 -10.570 5.212 1.00 0.00 C ATOM 910 OE1 GLU A 58 -10.071 -11.799 5.426 1.00 0.00 O ATOM 911 OE2 GLU A 58 -10.861 -9.768 5.706 1.00 0.00 O ATOM 0 H GLU A 58 -8.528 -8.316 1.410 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.833 -10.513 2.365 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.853 -10.702 2.489 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.668 -11.805 3.160 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -7.992 -10.098 4.814 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -9.136 -8.963 4.126 1.00 0.00 H new ATOM 918 N PHE A 59 -7.171 -11.623 0.181 1.00 0.00 N ATOM 919 CA PHE A 59 -7.276 -12.210 -1.150 1.00 0.00 C ATOM 920 C PHE A 59 -7.393 -13.729 -1.066 1.00 0.00 C ATOM 921 O PHE A 59 -6.504 -14.403 -0.544 1.00 0.00 O ATOM 922 CB PHE A 59 -6.061 -11.826 -1.997 1.00 0.00 C ATOM 923 CG PHE A 59 -6.052 -10.383 -2.412 1.00 0.00 C ATOM 924 CD1 PHE A 59 -5.566 -9.406 -1.558 1.00 0.00 C ATOM 925 CD2 PHE A 59 -6.530 -10.003 -3.656 1.00 0.00 C ATOM 926 CE1 PHE A 59 -5.556 -8.077 -1.938 1.00 0.00 C ATOM 927 CE2 PHE A 59 -6.522 -8.676 -4.041 1.00 0.00 C ATOM 928 CZ PHE A 59 -6.035 -7.711 -3.180 1.00 0.00 C ATOM 0 H PHE A 59 -6.381 -11.961 0.730 1.00 0.00 H new ATOM 0 HA PHE A 59 -8.177 -11.819 -1.623 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.153 -12.039 -1.433 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.037 -12.452 -2.889 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -5.191 -9.686 -0.585 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -6.913 -10.753 -4.332 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -5.174 -7.325 -1.264 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -6.896 -8.393 -5.014 1.00 0.00 H new ATOM 0 HZ PHE A 59 -6.029 -6.673 -3.478 1.00 0.00 H new ATOM 938 N ASP A 60 -8.494 -14.261 -1.583 1.00 0.00 N ATOM 939 CA ASP A 60 -8.728 -15.701 -1.568 1.00 0.00 C ATOM 940 C ASP A 60 -7.906 -16.396 -2.649 1.00 0.00 C ATOM 941 O ASP A 60 -7.889 -15.968 -3.803 1.00 0.00 O ATOM 942 CB ASP A 60 -10.215 -16.000 -1.770 1.00 0.00 C ATOM 943 CG ASP A 60 -10.645 -17.283 -1.087 1.00 0.00 C ATOM 944 OD1 ASP A 60 -10.227 -18.367 -1.545 1.00 0.00 O ATOM 945 OD2 ASP A 60 -11.400 -17.204 -0.096 1.00 0.00 O ATOM 0 H ASP A 60 -9.239 -13.717 -2.018 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.417 -16.085 -0.596 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.806 -15.170 -1.382 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.427 -16.071 -2.837 1.00 0.00 H new ATOM 950 N LEU A 61 -7.224 -17.470 -2.266 1.00 0.00 N ATOM 951 CA LEU A 61 -6.398 -18.225 -3.202 1.00 0.00 C ATOM 952 C LEU A 61 -7.131 -19.467 -3.696 1.00 0.00 C ATOM 953 O LEU A 61 -6.894 -19.939 -4.809 1.00 0.00 O ATOM 954 CB LEU A 61 -5.079 -18.627 -2.539 1.00 0.00 C ATOM 955 CG LEU A 61 -4.248 -17.487 -1.950 1.00 0.00 C ATOM 956 CD1 LEU A 61 -3.025 -18.033 -1.231 1.00 0.00 C ATOM 957 CD2 LEU A 61 -3.836 -16.509 -3.041 1.00 0.00 C ATOM 0 H LEU A 61 -7.227 -17.837 -1.314 1.00 0.00 H new ATOM 0 HA LEU A 61 -6.187 -17.586 -4.059 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.298 -19.339 -1.743 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.470 -19.150 -3.276 1.00 0.00 H new ATOM 0 HG LEU A 61 -4.862 -16.953 -1.224 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.446 -17.207 -0.819 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.342 -18.693 -0.423 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.408 -18.592 -1.935 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.245 -15.704 -2.604 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.241 -17.030 -3.791 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.727 -16.092 -3.511 1.00 0.00 H new ATOM 969 N ARG A 62 -8.024 -19.992 -2.863 1.00 0.00 N ATOM 970 CA ARG A 62 -8.794 -21.179 -3.216 1.00 0.00 C ATOM 971 C ARG A 62 -7.900 -22.415 -3.253 1.00 0.00 C ATOM 972 O ARG A 62 -8.097 -23.312 -4.071 1.00 0.00 O ATOM 973 CB ARG A 62 -9.473 -20.987 -4.573 1.00 0.00 C ATOM 974 CG ARG A 62 -10.179 -19.649 -4.718 1.00 0.00 C ATOM 975 CD ARG A 62 -10.333 -19.255 -6.179 1.00 0.00 C ATOM 976 NE ARG A 62 -11.271 -20.124 -6.884 1.00 0.00 N ATOM 977 CZ ARG A 62 -11.898 -19.775 -8.002 1.00 0.00 C ATOM 978 NH1 ARG A 62 -11.687 -18.582 -8.539 1.00 0.00 N ATOM 979 NH2 ARG A 62 -12.737 -20.622 -8.586 1.00 0.00 N ATOM 0 H ARG A 62 -8.232 -19.614 -1.939 1.00 0.00 H new ATOM 0 HA ARG A 62 -9.558 -21.327 -2.453 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.725 -21.080 -5.360 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -10.197 -21.788 -4.724 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.162 -19.702 -4.249 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -9.615 -18.880 -4.190 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -10.678 -18.223 -6.242 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -9.361 -19.297 -6.670 1.00 0.00 H new ATOM 0 HE ARG A 62 -11.455 -21.050 -6.497 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -11.042 -17.929 -8.094 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -12.170 -18.317 -9.397 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -12.901 -21.542 -8.176 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -13.218 -20.353 -9.444 1.00 0.00 H new ATOM 993 N GLY A 63 -6.916 -22.454 -2.359 1.00 0.00 N ATOM 994 CA GLY A 63 -6.007 -23.584 -2.306 1.00 0.00 C ATOM 995 C GLY A 63 -4.798 -23.398 -3.203 1.00 0.00 C ATOM 996 O GLY A 63 -3.877 -24.214 -3.191 1.00 0.00 O ATOM 0 H GLY A 63 -6.733 -21.724 -1.671 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.674 -23.731 -1.278 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.539 -24.488 -2.601 1.00 0.00 H new ATOM 1000 N ILE A 64 -4.803 -22.322 -3.983 1.00 0.00 N ATOM 1001 CA ILE A 64 -3.699 -22.032 -4.889 1.00 0.00 C ATOM 1002 C ILE A 64 -2.536 -21.381 -4.149 1.00 0.00 C ATOM 1003 O ILE A 64 -2.625 -20.249 -3.674 1.00 0.00 O ATOM 1004 CB ILE A 64 -4.142 -21.109 -6.039 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -5.190 -21.807 -6.908 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -2.943 -20.693 -6.877 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -4.658 -23.020 -7.639 1.00 0.00 C ATOM 0 H ILE A 64 -5.559 -21.637 -4.006 1.00 0.00 H new ATOM 0 HA ILE A 64 -3.374 -22.986 -5.304 1.00 0.00 H new ATOM 0 HB ILE A 64 -4.591 -20.212 -5.612 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -6.028 -22.110 -6.280 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.579 -21.095 -7.636 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.273 -20.041 -7.686 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.228 -20.160 -6.250 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.467 -21.579 -7.297 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -5.455 -23.464 -8.235 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -3.839 -22.720 -8.293 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.296 -23.751 -6.916 1.00 0.00 H new ATOM 1019 N PRO A 65 -1.415 -22.111 -4.049 1.00 0.00 N ATOM 1020 CA PRO A 65 -0.211 -21.624 -3.369 1.00 0.00 C ATOM 1021 C PRO A 65 0.474 -20.500 -4.139 1.00 0.00 C ATOM 1022 O PRO A 65 -0.026 -20.044 -5.168 1.00 0.00 O ATOM 1023 CB PRO A 65 0.690 -22.860 -3.314 1.00 0.00 C ATOM 1024 CG PRO A 65 0.241 -23.707 -4.454 1.00 0.00 C ATOM 1025 CD PRO A 65 -1.237 -23.469 -4.591 1.00 0.00 C ATOM 0 HA PRO A 65 -0.438 -21.201 -2.390 1.00 0.00 H new ATOM 0 HB2 PRO A 65 1.741 -22.588 -3.412 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.584 -23.385 -2.365 1.00 0.00 H new ATOM 0 HG2 PRO A 65 0.766 -23.438 -5.370 1.00 0.00 H new ATOM 0 HG3 PRO A 65 0.451 -24.760 -4.264 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -1.560 -23.533 -5.630 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.816 -24.204 -4.032 1.00 0.00 H new ATOM 1033 N LEU A 66 1.621 -20.057 -3.635 1.00 0.00 N ATOM 1034 CA LEU A 66 2.375 -18.986 -4.276 1.00 0.00 C ATOM 1035 C LEU A 66 3.629 -19.532 -4.951 1.00 0.00 C ATOM 1036 O LEU A 66 4.209 -20.519 -4.500 1.00 0.00 O ATOM 1037 CB LEU A 66 2.759 -17.920 -3.248 1.00 0.00 C ATOM 1038 CG LEU A 66 1.597 -17.182 -2.582 1.00 0.00 C ATOM 1039 CD1 LEU A 66 2.115 -16.193 -1.549 1.00 0.00 C ATOM 1040 CD2 LEU A 66 0.749 -16.470 -3.625 1.00 0.00 C ATOM 0 H LEU A 66 2.049 -20.423 -2.784 1.00 0.00 H new ATOM 0 HA LEU A 66 1.741 -18.535 -5.039 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.357 -18.393 -2.469 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.398 -17.185 -3.738 1.00 0.00 H new ATOM 0 HG LEU A 66 0.971 -17.915 -2.072 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.274 -15.677 -1.085 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.679 -16.727 -0.784 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.764 -15.465 -2.036 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.073 -15.950 -3.133 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.364 -15.749 -4.163 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.348 -17.200 -4.328 1.00 0.00 H new ATOM 1052 N ASP A 67 4.043 -18.881 -6.033 1.00 0.00 N ATOM 1053 CA ASP A 67 5.231 -19.299 -6.769 1.00 0.00 C ATOM 1054 C ASP A 67 6.221 -18.146 -6.902 1.00 0.00 C ATOM 1055 O ASP A 67 5.936 -17.019 -6.496 1.00 0.00 O ATOM 1056 CB ASP A 67 4.842 -19.816 -8.155 1.00 0.00 C ATOM 1057 CG ASP A 67 5.953 -20.616 -8.807 1.00 0.00 C ATOM 1058 OD1 ASP A 67 6.816 -21.141 -8.072 1.00 0.00 O ATOM 1059 OD2 ASP A 67 5.959 -20.717 -10.051 1.00 0.00 O ATOM 0 H ASP A 67 3.574 -18.062 -6.420 1.00 0.00 H new ATOM 0 HA ASP A 67 5.710 -20.103 -6.211 1.00 0.00 H new ATOM 0 HB2 ASP A 67 3.951 -20.439 -8.071 1.00 0.00 H new ATOM 0 HB3 ASP A 67 4.582 -18.972 -8.795 1.00 0.00 H new ATOM 1064 N PHE A 68 7.387 -18.437 -7.471 1.00 0.00 N ATOM 1065 CA PHE A 68 8.421 -17.425 -7.655 1.00 0.00 C ATOM 1066 C PHE A 68 7.934 -16.311 -8.577 1.00 0.00 C ATOM 1067 O PHE A 68 8.600 -15.289 -8.739 1.00 0.00 O ATOM 1068 CB PHE A 68 9.689 -18.060 -8.229 1.00 0.00 C ATOM 1069 CG PHE A 68 10.641 -18.554 -7.178 1.00 0.00 C ATOM 1070 CD1 PHE A 68 10.222 -19.457 -6.214 1.00 0.00 C ATOM 1071 CD2 PHE A 68 11.955 -18.115 -7.154 1.00 0.00 C ATOM 1072 CE1 PHE A 68 11.096 -19.912 -5.245 1.00 0.00 C ATOM 1073 CE2 PHE A 68 12.834 -18.568 -6.187 1.00 0.00 C ATOM 1074 CZ PHE A 68 12.404 -19.468 -5.232 1.00 0.00 C ATOM 0 H PHE A 68 7.639 -19.365 -7.812 1.00 0.00 H new ATOM 0 HA PHE A 68 8.649 -16.992 -6.681 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.409 -18.893 -8.874 1.00 0.00 H new ATOM 0 HB3 PHE A 68 10.200 -17.329 -8.856 1.00 0.00 H new ATOM 0 HD1 PHE A 68 9.201 -19.809 -6.220 1.00 0.00 H new ATOM 0 HD2 PHE A 68 12.297 -17.411 -7.899 1.00 0.00 H new ATOM 0 HE1 PHE A 68 10.757 -20.614 -4.498 1.00 0.00 H new ATOM 0 HE2 PHE A 68 13.856 -18.218 -6.179 1.00 0.00 H new ATOM 0 HZ PHE A 68 13.089 -19.824 -4.477 1.00 0.00 H new ATOM 1084 N SER A 69 6.767 -16.518 -9.180 1.00 0.00 N ATOM 1085 CA SER A 69 6.192 -15.534 -10.090 1.00 0.00 C ATOM 1086 C SER A 69 5.147 -14.681 -9.377 1.00 0.00 C ATOM 1087 O SER A 69 4.635 -13.711 -9.936 1.00 0.00 O ATOM 1088 CB SER A 69 5.561 -16.231 -11.296 1.00 0.00 C ATOM 1089 OG SER A 69 4.326 -16.834 -10.949 1.00 0.00 O ATOM 0 H SER A 69 6.202 -17.358 -9.055 1.00 0.00 H new ATOM 0 HA SER A 69 6.994 -14.882 -10.435 1.00 0.00 H new ATOM 0 HB2 SER A 69 5.404 -15.508 -12.097 1.00 0.00 H new ATOM 0 HB3 SER A 69 6.244 -16.989 -11.680 1.00 0.00 H new ATOM 0 HG SER A 69 3.942 -17.271 -11.738 1.00 0.00 H new ATOM 1095 N SER A 70 4.835 -15.050 -8.139 1.00 0.00 N ATOM 1096 CA SER A 70 3.848 -14.322 -7.350 1.00 0.00 C ATOM 1097 C SER A 70 4.321 -12.899 -7.068 1.00 0.00 C ATOM 1098 O SER A 70 5.493 -12.670 -6.770 1.00 0.00 O ATOM 1099 CB SER A 70 3.577 -15.053 -6.033 1.00 0.00 C ATOM 1100 OG SER A 70 4.773 -15.230 -5.293 1.00 0.00 O ATOM 0 H SER A 70 5.251 -15.849 -7.661 1.00 0.00 H new ATOM 0 HA SER A 70 2.924 -14.272 -7.926 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.859 -14.486 -5.440 1.00 0.00 H new ATOM 0 HB3 SER A 70 3.125 -16.024 -6.238 1.00 0.00 H new ATOM 0 HG SER A 70 5.109 -16.141 -5.427 1.00 0.00 H new ATOM 1106 N SER A 71 3.399 -11.946 -7.163 1.00 0.00 N ATOM 1107 CA SER A 71 3.721 -10.545 -6.922 1.00 0.00 C ATOM 1108 C SER A 71 2.451 -9.710 -6.794 1.00 0.00 C ATOM 1109 O SER A 71 1.411 -10.049 -7.361 1.00 0.00 O ATOM 1110 CB SER A 71 4.593 -9.998 -8.054 1.00 0.00 C ATOM 1111 OG SER A 71 5.889 -10.569 -8.021 1.00 0.00 O ATOM 0 H SER A 71 2.423 -12.119 -7.405 1.00 0.00 H new ATOM 0 HA SER A 71 4.273 -10.481 -5.984 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.123 -10.210 -9.014 1.00 0.00 H new ATOM 0 HB3 SER A 71 4.668 -8.914 -7.968 1.00 0.00 H new ATOM 0 HG SER A 71 5.943 -11.216 -7.287 1.00 0.00 H new ATOM 1117 N LEU A 72 2.542 -8.616 -6.045 1.00 0.00 N ATOM 1118 CA LEU A 72 1.400 -7.731 -5.841 1.00 0.00 C ATOM 1119 C LEU A 72 1.602 -6.406 -6.569 1.00 0.00 C ATOM 1120 O LEU A 72 2.690 -5.833 -6.545 1.00 0.00 O ATOM 1121 CB LEU A 72 1.187 -7.478 -4.347 1.00 0.00 C ATOM 1122 CG LEU A 72 -0.232 -7.089 -3.929 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -1.144 -8.305 -3.939 1.00 0.00 C ATOM 1124 CD2 LEU A 72 -0.222 -6.438 -2.554 1.00 0.00 C ATOM 0 H LEU A 72 3.394 -8.321 -5.569 1.00 0.00 H new ATOM 0 HA LEU A 72 0.515 -8.218 -6.251 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.471 -8.378 -3.802 1.00 0.00 H new ATOM 0 HB3 LEU A 72 1.867 -6.687 -4.032 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.618 -6.367 -4.649 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.149 -8.008 -3.639 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.175 -8.728 -4.943 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.763 -9.051 -3.242 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -1.240 -6.167 -2.272 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.183 -7.138 -1.823 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.398 -5.542 -2.580 1.00 0.00 H new ATOM 1136 N GLY A 73 0.544 -5.924 -7.214 1.00 0.00 N ATOM 1137 CA GLY A 73 0.625 -4.669 -7.938 1.00 0.00 C ATOM 1138 C GLY A 73 0.035 -3.511 -7.159 1.00 0.00 C ATOM 1139 O GLY A 73 -1.183 -3.407 -7.016 1.00 0.00 O ATOM 0 H GLY A 73 -0.368 -6.380 -7.248 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.668 -4.453 -8.169 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.101 -4.767 -8.889 1.00 0.00 H new ATOM 1143 N ILE A 74 0.900 -2.639 -6.652 1.00 0.00 N ATOM 1144 CA ILE A 74 0.457 -1.483 -5.883 1.00 0.00 C ATOM 1145 C ILE A 74 0.444 -0.223 -6.741 1.00 0.00 C ATOM 1146 O ILE A 74 1.496 0.324 -7.075 1.00 0.00 O ATOM 1147 CB ILE A 74 1.357 -1.245 -4.655 1.00 0.00 C ATOM 1148 CG1 ILE A 74 1.403 -2.499 -3.779 1.00 0.00 C ATOM 1149 CG2 ILE A 74 0.857 -0.051 -3.855 1.00 0.00 C ATOM 1150 CD1 ILE A 74 0.038 -2.974 -3.332 1.00 0.00 C ATOM 0 H ILE A 74 1.912 -2.711 -6.760 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.556 -1.699 -5.545 1.00 0.00 H new ATOM 0 HB ILE A 74 2.368 -1.028 -5.000 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.895 -3.300 -4.331 1.00 0.00 H new ATOM 0 HG13 ILE A 74 2.014 -2.296 -2.900 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.503 0.104 -2.991 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.871 0.840 -4.483 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.162 -0.240 -3.517 1.00 0.00 H new ATOM 0 HD11 ILE A 74 0.147 -3.866 -2.715 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.448 -2.189 -2.752 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.570 -3.209 -4.206 1.00 0.00 H new ATOM 1162 N ILE A 75 -0.752 0.234 -7.094 1.00 0.00 N ATOM 1163 CA ILE A 75 -0.902 1.432 -7.911 1.00 0.00 C ATOM 1164 C ILE A 75 -1.627 2.533 -7.145 1.00 0.00 C ATOM 1165 O ILE A 75 -2.758 2.350 -6.693 1.00 0.00 O ATOM 1166 CB ILE A 75 -1.672 1.134 -9.211 1.00 0.00 C ATOM 1167 CG1 ILE A 75 -1.068 -0.079 -9.921 1.00 0.00 C ATOM 1168 CG2 ILE A 75 -1.660 2.350 -10.125 1.00 0.00 C ATOM 1169 CD1 ILE A 75 -1.991 -0.702 -10.944 1.00 0.00 C ATOM 0 H ILE A 75 -1.632 -0.207 -6.827 1.00 0.00 H new ATOM 0 HA ILE A 75 0.103 1.770 -8.163 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.707 0.905 -8.958 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.143 0.222 -10.413 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.803 -0.830 -9.177 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.208 2.123 -11.039 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.132 3.191 -9.618 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.631 2.608 -10.374 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.497 -1.556 -11.407 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.906 -1.034 -10.454 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.236 0.034 -11.709 1.00 0.00 H new ATOM 1181 N VAL A 76 -0.969 3.680 -7.002 1.00 0.00 N ATOM 1182 CA VAL A 76 -1.551 4.813 -6.293 1.00 0.00 C ATOM 1183 C VAL A 76 -1.768 5.995 -7.231 1.00 0.00 C ATOM 1184 O VAL A 76 -0.815 6.555 -7.774 1.00 0.00 O ATOM 1185 CB VAL A 76 -0.659 5.259 -5.120 1.00 0.00 C ATOM 1186 CG1 VAL A 76 -1.250 6.482 -4.435 1.00 0.00 C ATOM 1187 CG2 VAL A 76 -0.474 4.120 -4.129 1.00 0.00 C ATOM 0 H VAL A 76 -0.032 3.848 -7.368 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.513 4.482 -5.902 1.00 0.00 H new ATOM 0 HB VAL A 76 0.321 5.531 -5.514 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.606 6.783 -3.609 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.326 7.299 -5.152 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -2.242 6.241 -4.053 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.159 4.453 -3.306 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -1.445 3.815 -3.739 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -0.003 3.274 -4.630 1.00 0.00 H new ATOM 1197 N LYS A 77 -3.028 6.372 -7.418 1.00 0.00 N ATOM 1198 CA LYS A 77 -3.373 7.489 -8.288 1.00 0.00 C ATOM 1199 C LYS A 77 -4.388 8.409 -7.618 1.00 0.00 C ATOM 1200 O LYS A 77 -4.877 8.118 -6.526 1.00 0.00 O ATOM 1201 CB LYS A 77 -3.934 6.974 -9.616 1.00 0.00 C ATOM 1202 CG LYS A 77 -2.886 6.344 -10.516 1.00 0.00 C ATOM 1203 CD LYS A 77 -3.366 6.257 -11.955 1.00 0.00 C ATOM 1204 CE LYS A 77 -4.564 5.329 -12.088 1.00 0.00 C ATOM 1205 NZ LYS A 77 -4.983 5.163 -13.507 1.00 0.00 N ATOM 0 H LYS A 77 -3.829 5.919 -6.977 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.465 8.060 -8.481 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -4.713 6.240 -9.411 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -4.406 7.801 -10.146 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -1.968 6.930 -10.473 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.644 5.346 -10.151 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.634 7.252 -12.311 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -2.555 5.899 -12.589 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -4.317 4.355 -11.666 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.397 5.726 -11.508 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -5.802 4.524 -13.555 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -5.243 6.089 -13.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -4.197 4.760 -14.056 1.00 0.00 H new ATOM 1219 N ASP A 78 -4.701 9.518 -8.278 1.00 0.00 N ATOM 1220 CA ASP A 78 -5.661 10.480 -7.746 1.00 0.00 C ATOM 1221 C ASP A 78 -7.082 10.115 -8.162 1.00 0.00 C ATOM 1222 O ASP A 78 -7.457 10.260 -9.325 1.00 0.00 O ATOM 1223 CB ASP A 78 -5.322 11.891 -8.229 1.00 0.00 C ATOM 1224 CG ASP A 78 -6.532 12.803 -8.247 1.00 0.00 C ATOM 1225 OD1 ASP A 78 -7.068 13.101 -7.159 1.00 0.00 O ATOM 1226 OD2 ASP A 78 -6.944 13.220 -9.350 1.00 0.00 O ATOM 0 H ASP A 78 -4.305 9.774 -9.182 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.601 10.453 -6.658 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -4.557 12.320 -7.581 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -4.897 11.836 -9.231 1.00 0.00 H new ATOM 1231 N PHE A 79 -7.869 9.638 -7.203 1.00 0.00 N ATOM 1232 CA PHE A 79 -9.250 9.250 -7.469 1.00 0.00 C ATOM 1233 C PHE A 79 -9.877 10.159 -8.521 1.00 0.00 C ATOM 1234 O PHE A 79 -10.288 9.701 -9.587 1.00 0.00 O ATOM 1235 CB PHE A 79 -10.073 9.299 -6.180 1.00 0.00 C ATOM 1236 CG PHE A 79 -11.509 8.901 -6.371 1.00 0.00 C ATOM 1237 CD1 PHE A 79 -12.435 9.812 -6.853 1.00 0.00 C ATOM 1238 CD2 PHE A 79 -11.932 7.617 -6.068 1.00 0.00 C ATOM 1239 CE1 PHE A 79 -13.757 9.449 -7.030 1.00 0.00 C ATOM 1240 CE2 PHE A 79 -13.253 7.249 -6.243 1.00 0.00 C ATOM 1241 CZ PHE A 79 -14.167 8.166 -6.723 1.00 0.00 C ATOM 0 H PHE A 79 -7.574 9.511 -6.235 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.247 8.229 -7.851 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -9.617 8.640 -5.442 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -10.035 10.309 -5.772 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -12.120 10.817 -7.093 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -11.222 6.896 -5.691 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -14.469 10.168 -7.408 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -13.570 6.245 -6.004 1.00 0.00 H new ATOM 0 HZ PHE A 79 -15.200 7.881 -6.858 1.00 0.00 H new ATOM 1378 N ILE A 88 0.519 9.022 -9.703 1.00 0.00 N ATOM 1379 CA ILE A 88 1.387 9.379 -8.588 1.00 0.00 C ATOM 1380 C ILE A 88 2.598 8.456 -8.516 1.00 0.00 C ATOM 1381 O ILE A 88 3.741 8.908 -8.583 1.00 0.00 O ATOM 1382 CB ILE A 88 0.632 9.322 -7.247 1.00 0.00 C ATOM 1383 CG1 ILE A 88 -0.620 10.201 -7.303 1.00 0.00 C ATOM 1384 CG2 ILE A 88 1.541 9.759 -6.108 1.00 0.00 C ATOM 1385 CD1 ILE A 88 -1.544 10.012 -6.120 1.00 0.00 C ATOM 0 HA ILE A 88 1.723 10.401 -8.764 1.00 0.00 H new ATOM 0 HB ILE A 88 0.323 8.293 -7.065 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.318 11.247 -7.354 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.167 9.982 -8.220 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.993 9.713 -5.167 1.00 0.00 H new ATOM 0 HG22 ILE A 88 2.405 9.096 -6.057 1.00 0.00 H new ATOM 0 HG23 ILE A 88 1.877 10.781 -6.283 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -2.410 10.666 -6.226 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.876 8.975 -6.080 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.013 10.259 -5.201 1.00 0.00 H new ATOM 1397 N GLY A 89 2.340 7.159 -8.381 1.00 0.00 N ATOM 1398 CA GLY A 89 3.419 6.192 -8.305 1.00 0.00 C ATOM 1399 C GLY A 89 2.927 4.763 -8.424 1.00 0.00 C ATOM 1400 O GLY A 89 1.722 4.508 -8.394 1.00 0.00 O ATOM 0 H GLY A 89 1.403 6.761 -8.323 1.00 0.00 H new ATOM 0 HA2 GLY A 89 4.139 6.392 -9.099 1.00 0.00 H new ATOM 0 HA3 GLY A 89 3.946 6.314 -7.359 1.00 0.00 H new ATOM 1404 N THR A 90 3.860 3.827 -8.563 1.00 0.00 N ATOM 1405 CA THR A 90 3.515 2.416 -8.691 1.00 0.00 C ATOM 1406 C THR A 90 4.670 1.525 -8.247 1.00 0.00 C ATOM 1407 O THR A 90 5.794 1.665 -8.728 1.00 0.00 O ATOM 1408 CB THR A 90 3.135 2.060 -10.140 1.00 0.00 C ATOM 1409 OG1 THR A 90 4.260 2.253 -11.004 1.00 0.00 O ATOM 1410 CG2 THR A 90 1.970 2.913 -10.619 1.00 0.00 C ATOM 0 H THR A 90 4.861 4.020 -8.590 1.00 0.00 H new ATOM 0 HA THR A 90 2.655 2.241 -8.044 1.00 0.00 H new ATOM 0 HB THR A 90 2.833 1.013 -10.166 1.00 0.00 H new ATOM 0 HG1 THR A 90 5.087 2.069 -10.511 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.720 2.644 -11.645 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.106 2.742 -9.977 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.249 3.966 -10.578 1.00 0.00 H new ATOM 1418 N ALA A 91 4.385 0.609 -7.328 1.00 0.00 N ATOM 1419 CA ALA A 91 5.400 -0.307 -6.821 1.00 0.00 C ATOM 1420 C ALA A 91 4.928 -1.754 -6.914 1.00 0.00 C ATOM 1421 O ALA A 91 3.833 -2.092 -6.464 1.00 0.00 O ATOM 1422 CB ALA A 91 5.757 0.043 -5.384 1.00 0.00 C ATOM 0 H ALA A 91 3.459 0.481 -6.919 1.00 0.00 H new ATOM 0 HA ALA A 91 6.291 -0.202 -7.440 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.516 -0.649 -5.019 1.00 0.00 H new ATOM 0 HB2 ALA A 91 6.144 1.061 -5.343 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.867 -0.032 -4.759 1.00 0.00 H new ATOM 1428 N THR A 92 5.762 -2.607 -7.502 1.00 0.00 N ATOM 1429 CA THR A 92 5.430 -4.017 -7.656 1.00 0.00 C ATOM 1430 C THR A 92 6.120 -4.864 -6.592 1.00 0.00 C ATOM 1431 O THR A 92 7.348 -4.913 -6.525 1.00 0.00 O ATOM 1432 CB THR A 92 5.828 -4.539 -9.049 1.00 0.00 C ATOM 1433 OG1 THR A 92 5.189 -3.759 -10.066 1.00 0.00 O ATOM 1434 CG2 THR A 92 5.442 -6.002 -9.209 1.00 0.00 C ATOM 0 H THR A 92 6.673 -2.345 -7.879 1.00 0.00 H new ATOM 0 HA THR A 92 4.350 -4.102 -7.540 1.00 0.00 H new ATOM 0 HB THR A 92 6.910 -4.451 -9.150 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.449 -4.096 -10.949 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.733 -6.349 -10.201 1.00 0.00 H new ATOM 0 HG22 THR A 92 5.952 -6.598 -8.452 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.364 -6.109 -9.089 1.00 0.00 H new ATOM 1442 N VAL A 93 5.323 -5.529 -5.763 1.00 0.00 N ATOM 1443 CA VAL A 93 5.857 -6.376 -4.703 1.00 0.00 C ATOM 1444 C VAL A 93 6.033 -7.812 -5.183 1.00 0.00 C ATOM 1445 O VAL A 93 5.176 -8.354 -5.880 1.00 0.00 O ATOM 1446 CB VAL A 93 4.943 -6.369 -3.464 1.00 0.00 C ATOM 1447 CG1 VAL A 93 5.550 -7.203 -2.347 1.00 0.00 C ATOM 1448 CG2 VAL A 93 4.688 -4.943 -2.998 1.00 0.00 C ATOM 0 H VAL A 93 4.304 -5.498 -5.805 1.00 0.00 H new ATOM 0 HA VAL A 93 6.829 -5.965 -4.430 1.00 0.00 H new ATOM 0 HB VAL A 93 3.986 -6.814 -3.738 1.00 0.00 H new ATOM 0 HG11 VAL A 93 4.890 -7.186 -1.480 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.675 -8.231 -2.687 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.521 -6.791 -2.072 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.040 -4.957 -2.121 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.635 -4.469 -2.741 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.205 -4.380 -3.797 1.00 0.00 H new ATOM 1458 N ALA A 94 7.151 -8.424 -4.805 1.00 0.00 N ATOM 1459 CA ALA A 94 7.438 -9.799 -5.194 1.00 0.00 C ATOM 1460 C ALA A 94 7.186 -10.761 -4.038 1.00 0.00 C ATOM 1461 O ALA A 94 7.927 -10.774 -3.055 1.00 0.00 O ATOM 1462 CB ALA A 94 8.875 -9.920 -5.680 1.00 0.00 C ATOM 0 H ALA A 94 7.872 -7.989 -4.230 1.00 0.00 H new ATOM 0 HA ALA A 94 6.766 -10.068 -6.009 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.076 -10.952 -5.967 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.024 -9.268 -6.541 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.555 -9.627 -4.880 1.00 0.00 H new ATOM 1468 N LEU A 95 6.136 -11.565 -4.163 1.00 0.00 N ATOM 1469 CA LEU A 95 5.785 -12.532 -3.128 1.00 0.00 C ATOM 1470 C LEU A 95 6.617 -13.803 -3.265 1.00 0.00 C ATOM 1471 O LEU A 95 6.414 -14.773 -2.534 1.00 0.00 O ATOM 1472 CB LEU A 95 4.296 -12.872 -3.203 1.00 0.00 C ATOM 1473 CG LEU A 95 3.335 -11.682 -3.201 1.00 0.00 C ATOM 1474 CD1 LEU A 95 1.911 -12.146 -3.464 1.00 0.00 C ATOM 1475 CD2 LEU A 95 3.418 -10.931 -1.880 1.00 0.00 C ATOM 0 H LEU A 95 5.513 -11.567 -4.970 1.00 0.00 H new ATOM 0 HA LEU A 95 6.000 -12.083 -2.158 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.122 -13.453 -4.109 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.048 -13.515 -2.359 1.00 0.00 H new ATOM 0 HG LEU A 95 3.628 -11.002 -4.001 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.241 -11.286 -3.459 1.00 0.00 H new ATOM 0 HD12 LEU A 95 1.862 -12.638 -4.435 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.607 -12.847 -2.686 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.728 -10.088 -1.897 1.00 0.00 H new ATOM 0 HD22 LEU A 95 3.152 -11.602 -1.063 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.434 -10.565 -1.733 1.00 0.00 H new ATOM 1487 N LYS A 96 7.554 -13.792 -4.207 1.00 0.00 N ATOM 1488 CA LYS A 96 8.420 -14.942 -4.439 1.00 0.00 C ATOM 1489 C LYS A 96 9.163 -15.330 -3.165 1.00 0.00 C ATOM 1490 O LYS A 96 9.543 -16.487 -2.985 1.00 0.00 O ATOM 1491 CB LYS A 96 9.422 -14.634 -5.554 1.00 0.00 C ATOM 1492 CG LYS A 96 10.567 -13.739 -5.112 1.00 0.00 C ATOM 1493 CD LYS A 96 11.720 -13.780 -6.102 1.00 0.00 C ATOM 1494 CE LYS A 96 12.954 -13.084 -5.548 1.00 0.00 C ATOM 1495 NZ LYS A 96 13.803 -12.516 -6.631 1.00 0.00 N ATOM 0 H LYS A 96 7.733 -12.999 -4.823 1.00 0.00 H new ATOM 0 HA LYS A 96 7.794 -15.781 -4.743 1.00 0.00 H new ATOM 0 HB2 LYS A 96 9.830 -15.571 -5.934 1.00 0.00 H new ATOM 0 HB3 LYS A 96 8.897 -14.156 -6.381 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.210 -12.714 -5.009 1.00 0.00 H new ATOM 0 HG3 LYS A 96 10.918 -14.054 -4.129 1.00 0.00 H new ATOM 0 HD2 LYS A 96 11.961 -14.816 -6.339 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.418 -13.302 -7.034 1.00 0.00 H new ATOM 0 HE2 LYS A 96 12.648 -12.287 -4.871 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.539 -13.793 -4.962 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 14.634 -12.050 -6.213 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 14.116 -13.280 -7.263 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 13.253 -11.820 -7.174 1.00 0.00 H new ATOM 1509 N ASP A 97 9.366 -14.356 -2.284 1.00 0.00 N ATOM 1510 CA ASP A 97 10.062 -14.597 -1.025 1.00 0.00 C ATOM 1511 C ASP A 97 9.134 -15.257 -0.010 1.00 0.00 C ATOM 1512 O ASP A 97 9.580 -16.016 0.852 1.00 0.00 O ATOM 1513 CB ASP A 97 10.606 -13.284 -0.460 1.00 0.00 C ATOM 1514 CG ASP A 97 11.743 -12.723 -1.292 1.00 0.00 C ATOM 1515 OD1 ASP A 97 12.411 -13.512 -1.992 1.00 0.00 O ATOM 1516 OD2 ASP A 97 11.966 -11.495 -1.241 1.00 0.00 O ATOM 0 H ASP A 97 9.059 -13.393 -2.418 1.00 0.00 H new ATOM 0 HA ASP A 97 10.895 -15.272 -1.221 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.800 -12.552 -0.410 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.952 -13.447 0.561 1.00 0.00 H new ATOM 1521 N LEU A 98 7.844 -14.962 -0.116 1.00 0.00 N ATOM 1522 CA LEU A 98 6.853 -15.526 0.794 1.00 0.00 C ATOM 1523 C LEU A 98 6.560 -16.981 0.446 1.00 0.00 C ATOM 1524 O LEU A 98 6.176 -17.773 1.309 1.00 0.00 O ATOM 1525 CB LEU A 98 5.561 -14.707 0.744 1.00 0.00 C ATOM 1526 CG LEU A 98 5.683 -13.236 1.142 1.00 0.00 C ATOM 1527 CD1 LEU A 98 4.486 -12.445 0.637 1.00 0.00 C ATOM 1528 CD2 LEU A 98 5.813 -13.102 2.653 1.00 0.00 C ATOM 0 H LEU A 98 7.459 -14.335 -0.823 1.00 0.00 H new ATOM 0 HA LEU A 98 7.261 -15.489 1.804 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.162 -14.757 -0.269 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.829 -15.180 1.398 1.00 0.00 H new ATOM 0 HG LEU A 98 6.583 -12.828 0.681 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.590 -11.400 0.930 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.436 -12.514 -0.450 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.572 -12.853 1.068 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.899 -12.048 2.919 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.931 -13.527 3.133 1.00 0.00 H new ATOM 0 HD23 LEU A 98 6.702 -13.635 2.990 1.00 0.00 H new ATOM 1540 N THR A 99 6.745 -17.330 -0.823 1.00 0.00 N ATOM 1541 CA THR A 99 6.501 -18.691 -1.286 1.00 0.00 C ATOM 1542 C THR A 99 6.990 -19.713 -0.266 1.00 0.00 C ATOM 1543 O THR A 99 8.020 -19.519 0.378 1.00 0.00 O ATOM 1544 CB THR A 99 7.194 -18.957 -2.635 1.00 0.00 C ATOM 1545 OG1 THR A 99 8.613 -18.828 -2.492 1.00 0.00 O ATOM 1546 CG2 THR A 99 6.695 -17.991 -3.699 1.00 0.00 C ATOM 0 H THR A 99 7.063 -16.689 -1.549 1.00 0.00 H new ATOM 0 HA THR A 99 5.423 -18.795 -1.413 1.00 0.00 H new ATOM 0 HB THR A 99 6.953 -19.973 -2.948 1.00 0.00 H new ATOM 0 HG1 THR A 99 8.852 -17.879 -2.445 1.00 0.00 H new ATOM 0 HG21 THR A 99 7.199 -18.198 -4.643 1.00 0.00 H new ATOM 0 HG22 THR A 99 5.620 -18.114 -3.827 1.00 0.00 H new ATOM 0 HG23 THR A 99 6.909 -16.968 -3.390 1.00 0.00 H new ATOM 1554 N GLY A 100 6.244 -20.805 -0.125 1.00 0.00 N ATOM 1555 CA GLY A 100 6.618 -21.842 0.818 1.00 0.00 C ATOM 1556 C GLY A 100 5.421 -22.619 1.331 1.00 0.00 C ATOM 1557 O GLY A 100 4.335 -22.550 0.755 1.00 0.00 O ATOM 0 H GLY A 100 5.387 -20.989 -0.647 1.00 0.00 H new ATOM 0 HA2 GLY A 100 7.315 -22.529 0.339 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.142 -21.391 1.660 1.00 0.00 H new ATOM 1561 N ASP A 101 5.619 -23.360 2.415 1.00 0.00 N ATOM 1562 CA ASP A 101 4.548 -24.153 3.006 1.00 0.00 C ATOM 1563 C ASP A 101 4.340 -23.781 4.471 1.00 0.00 C ATOM 1564 O ASP A 101 3.901 -24.605 5.273 1.00 0.00 O ATOM 1565 CB ASP A 101 4.862 -25.645 2.885 1.00 0.00 C ATOM 1566 CG ASP A 101 3.624 -26.510 3.014 1.00 0.00 C ATOM 1567 OD1 ASP A 101 3.181 -26.745 4.157 1.00 0.00 O ATOM 1568 OD2 ASP A 101 3.098 -26.953 1.971 1.00 0.00 O ATOM 0 H ASP A 101 6.512 -23.428 2.903 1.00 0.00 H new ATOM 0 HA ASP A 101 3.628 -23.938 2.462 1.00 0.00 H new ATOM 0 HB2 ASP A 101 5.337 -25.836 1.923 1.00 0.00 H new ATOM 0 HB3 ASP A 101 5.580 -25.926 3.656 1.00 0.00 H new ATOM 1573 N GLN A 102 4.660 -22.537 4.811 1.00 0.00 N ATOM 1574 CA GLN A 102 4.510 -22.058 6.180 1.00 0.00 C ATOM 1575 C GLN A 102 4.198 -20.565 6.203 1.00 0.00 C ATOM 1576 O GLN A 102 4.917 -19.761 5.609 1.00 0.00 O ATOM 1577 CB GLN A 102 5.782 -22.337 6.983 1.00 0.00 C ATOM 1578 CG GLN A 102 5.903 -23.779 7.449 1.00 0.00 C ATOM 1579 CD GLN A 102 7.303 -24.126 7.916 1.00 0.00 C ATOM 1580 OE1 GLN A 102 7.991 -24.941 7.300 1.00 0.00 O ATOM 1581 NE2 GLN A 102 7.733 -23.507 9.010 1.00 0.00 N ATOM 0 H GLN A 102 5.024 -21.843 4.158 1.00 0.00 H new ATOM 0 HA GLN A 102 3.676 -22.592 6.636 1.00 0.00 H new ATOM 0 HB2 GLN A 102 6.649 -22.087 6.372 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.804 -21.680 7.852 1.00 0.00 H new ATOM 0 HG2 GLN A 102 5.199 -23.954 8.262 1.00 0.00 H new ATOM 0 HG3 GLN A 102 5.620 -24.445 6.634 1.00 0.00 H new ATOM 0 HE21 GLN A 102 7.129 -22.839 9.489 1.00 0.00 H new ATOM 0 HE22 GLN A 102 8.667 -23.700 9.371 1.00 0.00 H new ATOM 1590 N SER A 103 3.121 -20.201 6.892 1.00 0.00 N ATOM 1591 CA SER A 103 2.711 -18.805 6.988 1.00 0.00 C ATOM 1592 C SER A 103 3.923 -17.892 7.143 1.00 0.00 C ATOM 1593 O SER A 103 4.783 -18.123 7.993 1.00 0.00 O ATOM 1594 CB SER A 103 1.758 -18.612 8.170 1.00 0.00 C ATOM 1595 OG SER A 103 1.553 -17.236 8.440 1.00 0.00 O ATOM 0 H SER A 103 2.517 -20.853 7.392 1.00 0.00 H new ATOM 0 HA SER A 103 2.194 -18.539 6.066 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.803 -19.089 7.953 1.00 0.00 H new ATOM 0 HB3 SER A 103 2.166 -19.103 9.054 1.00 0.00 H new ATOM 0 HG SER A 103 0.940 -17.139 9.198 1.00 0.00 H new ATOM 1601 N ARG A 104 3.984 -16.855 6.315 1.00 0.00 N ATOM 1602 CA ARG A 104 5.091 -15.907 6.358 1.00 0.00 C ATOM 1603 C ARG A 104 4.603 -14.488 6.083 1.00 0.00 C ATOM 1604 O ARG A 104 4.056 -14.204 5.017 1.00 0.00 O ATOM 1605 CB ARG A 104 6.163 -16.296 5.338 1.00 0.00 C ATOM 1606 CG ARG A 104 7.554 -15.795 5.695 1.00 0.00 C ATOM 1607 CD ARG A 104 8.504 -15.900 4.513 1.00 0.00 C ATOM 1608 NE ARG A 104 8.872 -17.284 4.227 1.00 0.00 N ATOM 1609 CZ ARG A 104 9.796 -17.954 4.907 1.00 0.00 C ATOM 1610 NH1 ARG A 104 10.442 -17.369 5.907 1.00 0.00 N ATOM 1611 NH2 ARG A 104 10.075 -19.211 4.588 1.00 0.00 N ATOM 0 H ARG A 104 3.280 -16.650 5.606 1.00 0.00 H new ATOM 0 HA ARG A 104 5.523 -15.936 7.358 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.189 -17.382 5.247 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.883 -15.901 4.361 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.495 -14.758 6.025 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.947 -16.373 6.531 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.036 -15.460 3.632 1.00 0.00 H new ATOM 0 HD3 ARG A 104 9.404 -15.321 4.719 1.00 0.00 H new ATOM 0 HE ARG A 104 8.394 -17.762 3.464 1.00 0.00 H new ATOM 0 HH11 ARG A 104 10.230 -16.403 6.155 1.00 0.00 H new ATOM 0 HH12 ARG A 104 11.151 -17.885 6.428 1.00 0.00 H new ATOM 0 HH21 ARG A 104 9.580 -19.664 3.820 1.00 0.00 H new ATOM 0 HH22 ARG A 104 10.785 -19.724 5.111 1.00 0.00 H new ATOM 1625 N SER A 105 4.804 -13.600 7.052 1.00 0.00 N ATOM 1626 CA SER A 105 4.380 -12.211 6.916 1.00 0.00 C ATOM 1627 C SER A 105 5.578 -11.269 6.984 1.00 0.00 C ATOM 1628 O SER A 105 6.145 -11.043 8.054 1.00 0.00 O ATOM 1629 CB SER A 105 3.373 -11.854 8.010 1.00 0.00 C ATOM 1630 OG SER A 105 2.463 -12.918 8.233 1.00 0.00 O ATOM 0 H SER A 105 5.258 -13.818 7.939 1.00 0.00 H new ATOM 0 HA SER A 105 3.904 -12.095 5.942 1.00 0.00 H new ATOM 0 HB2 SER A 105 3.902 -11.624 8.935 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.825 -10.956 7.725 1.00 0.00 H new ATOM 0 HG SER A 105 1.831 -12.665 8.938 1.00 0.00 H new ATOM 1636 N LEU A 106 5.958 -10.721 5.835 1.00 0.00 N ATOM 1637 CA LEU A 106 7.089 -9.802 5.762 1.00 0.00 C ATOM 1638 C LEU A 106 6.611 -8.362 5.602 1.00 0.00 C ATOM 1639 O LEU A 106 5.941 -8.009 4.632 1.00 0.00 O ATOM 1640 CB LEU A 106 8.004 -10.180 4.597 1.00 0.00 C ATOM 1641 CG LEU A 106 8.678 -11.549 4.689 1.00 0.00 C ATOM 1642 CD1 LEU A 106 9.186 -11.988 3.325 1.00 0.00 C ATOM 1643 CD2 LEU A 106 9.817 -11.515 5.698 1.00 0.00 C ATOM 0 H LEU A 106 5.500 -10.897 4.941 1.00 0.00 H new ATOM 0 HA LEU A 106 7.648 -9.878 6.694 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.420 -10.146 3.677 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.781 -9.420 4.510 1.00 0.00 H new ATOM 0 HG LEU A 106 7.938 -12.274 5.028 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.662 -12.965 3.411 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.350 -12.052 2.629 1.00 0.00 H new ATOM 0 HD13 LEU A 106 9.910 -11.262 2.956 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.286 -12.498 5.751 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.556 -10.777 5.387 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.426 -11.246 6.679 1.00 0.00 H new ATOM 1655 N PRO A 107 6.964 -7.510 6.576 1.00 0.00 N ATOM 1656 CA PRO A 107 6.585 -6.094 6.564 1.00 0.00 C ATOM 1657 C PRO A 107 7.310 -5.308 5.477 1.00 0.00 C ATOM 1658 O PRO A 107 8.497 -5.005 5.604 1.00 0.00 O ATOM 1659 CB PRO A 107 7.006 -5.602 7.951 1.00 0.00 C ATOM 1660 CG PRO A 107 8.100 -6.526 8.364 1.00 0.00 C ATOM 1661 CD PRO A 107 7.763 -7.862 7.762 1.00 0.00 C ATOM 0 HA PRO A 107 5.524 -5.958 6.352 1.00 0.00 H new ATOM 0 HB2 PRO A 107 7.352 -4.569 7.917 1.00 0.00 H new ATOM 0 HB3 PRO A 107 6.173 -5.636 8.653 1.00 0.00 H new ATOM 0 HG2 PRO A 107 9.067 -6.170 8.008 1.00 0.00 H new ATOM 0 HG3 PRO A 107 8.165 -6.593 9.450 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.660 -8.419 7.491 1.00 0.00 H new ATOM 0 HD3 PRO A 107 7.199 -8.485 8.456 1.00 0.00 H new ATOM 1669 N TYR A 108 6.590 -4.980 4.410 1.00 0.00 N ATOM 1670 CA TYR A 108 7.167 -4.231 3.300 1.00 0.00 C ATOM 1671 C TYR A 108 6.970 -2.731 3.495 1.00 0.00 C ATOM 1672 O TYR A 108 5.890 -2.195 3.242 1.00 0.00 O ATOM 1673 CB TYR A 108 6.536 -4.672 1.978 1.00 0.00 C ATOM 1674 CG TYR A 108 6.960 -6.054 1.536 1.00 0.00 C ATOM 1675 CD1 TYR A 108 8.107 -6.240 0.774 1.00 0.00 C ATOM 1676 CD2 TYR A 108 6.213 -7.174 1.879 1.00 0.00 C ATOM 1677 CE1 TYR A 108 8.498 -7.501 0.367 1.00 0.00 C ATOM 1678 CE2 TYR A 108 6.597 -8.439 1.478 1.00 0.00 C ATOM 1679 CZ TYR A 108 7.740 -8.597 0.722 1.00 0.00 C ATOM 1680 OH TYR A 108 8.125 -9.855 0.319 1.00 0.00 O ATOM 0 H TYR A 108 5.606 -5.221 4.290 1.00 0.00 H new ATOM 0 HA TYR A 108 8.237 -4.438 3.272 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.451 -4.649 2.077 1.00 0.00 H new ATOM 0 HB3 TYR A 108 6.801 -3.954 1.202 1.00 0.00 H new ATOM 0 HD1 TYR A 108 8.703 -5.384 0.495 1.00 0.00 H new ATOM 0 HD2 TYR A 108 5.317 -7.054 2.469 1.00 0.00 H new ATOM 0 HE1 TYR A 108 9.392 -7.628 -0.226 1.00 0.00 H new ATOM 0 HE2 TYR A 108 6.006 -9.299 1.755 1.00 0.00 H new ATOM 0 HH TYR A 108 7.484 -10.516 0.653 1.00 0.00 H new ATOM 1690 N LYS A 109 8.022 -2.057 3.946 1.00 0.00 N ATOM 1691 CA LYS A 109 7.969 -0.618 4.175 1.00 0.00 C ATOM 1692 C LYS A 109 9.081 0.096 3.412 1.00 0.00 C ATOM 1693 O LYS A 109 9.982 -0.543 2.866 1.00 0.00 O ATOM 1694 CB LYS A 109 8.086 -0.313 5.670 1.00 0.00 C ATOM 1695 CG LYS A 109 7.449 -1.368 6.557 1.00 0.00 C ATOM 1696 CD LYS A 109 6.946 -0.771 7.861 1.00 0.00 C ATOM 1697 CE LYS A 109 6.644 -1.851 8.889 1.00 0.00 C ATOM 1698 NZ LYS A 109 7.837 -2.175 9.719 1.00 0.00 N ATOM 0 H LYS A 109 8.923 -2.485 4.160 1.00 0.00 H new ATOM 0 HA LYS A 109 7.009 -0.253 3.810 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.140 -0.218 5.932 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.619 0.651 5.873 1.00 0.00 H new ATOM 0 HG2 LYS A 109 6.620 -1.838 6.027 1.00 0.00 H new ATOM 0 HG3 LYS A 109 8.176 -2.152 6.771 1.00 0.00 H new ATOM 0 HD2 LYS A 109 7.693 -0.086 8.261 1.00 0.00 H new ATOM 0 HD3 LYS A 109 6.046 -0.186 7.671 1.00 0.00 H new ATOM 0 HE2 LYS A 109 5.831 -1.520 9.535 1.00 0.00 H new ATOM 0 HE3 LYS A 109 6.300 -2.751 8.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 7.591 -2.915 10.407 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 8.605 -2.515 9.105 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 8.150 -1.322 10.225 1.00 0.00 H new ATOM 1712 N LEU A 110 9.012 1.422 3.378 1.00 0.00 N ATOM 1713 CA LEU A 110 10.014 2.222 2.683 1.00 0.00 C ATOM 1714 C LEU A 110 10.027 1.904 1.191 1.00 0.00 C ATOM 1715 O LEU A 110 11.056 2.033 0.528 1.00 0.00 O ATOM 1716 CB LEU A 110 11.400 1.972 3.281 1.00 0.00 C ATOM 1717 CG LEU A 110 11.540 2.228 4.782 1.00 0.00 C ATOM 1718 CD1 LEU A 110 12.705 1.434 5.352 1.00 0.00 C ATOM 1719 CD2 LEU A 110 11.719 3.714 5.055 1.00 0.00 C ATOM 0 H LEU A 110 8.273 1.966 3.823 1.00 0.00 H new ATOM 0 HA LEU A 110 9.754 3.273 2.809 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.678 0.937 3.082 1.00 0.00 H new ATOM 0 HB3 LEU A 110 12.119 2.602 2.757 1.00 0.00 H new ATOM 0 HG LEU A 110 10.626 1.897 5.275 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.789 1.629 6.421 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.534 0.370 5.189 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.627 1.734 4.855 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.817 3.878 6.128 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.617 4.071 4.550 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.852 4.259 4.683 1.00 0.00 H new ATOM 1731 N ILE A 111 8.876 1.491 0.671 1.00 0.00 N ATOM 1732 CA ILE A 111 8.754 1.158 -0.743 1.00 0.00 C ATOM 1733 C ILE A 111 8.839 2.408 -1.612 1.00 0.00 C ATOM 1734 O ILE A 111 8.085 3.363 -1.420 1.00 0.00 O ATOM 1735 CB ILE A 111 7.429 0.431 -1.038 1.00 0.00 C ATOM 1736 CG1 ILE A 111 7.273 -0.784 -0.121 1.00 0.00 C ATOM 1737 CG2 ILE A 111 7.369 0.009 -2.499 1.00 0.00 C ATOM 1738 CD1 ILE A 111 5.895 -1.405 -0.170 1.00 0.00 C ATOM 0 H ILE A 111 8.015 1.379 1.207 1.00 0.00 H new ATOM 0 HA ILE A 111 9.585 0.494 -0.983 1.00 0.00 H new ATOM 0 HB ILE A 111 6.605 1.118 -0.844 1.00 0.00 H new ATOM 0 HG12 ILE A 111 8.012 -1.536 -0.399 1.00 0.00 H new ATOM 0 HG13 ILE A 111 7.492 -0.486 0.904 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.426 -0.503 -2.691 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.439 0.891 -3.136 1.00 0.00 H new ATOM 0 HG23 ILE A 111 8.199 -0.663 -2.718 1.00 0.00 H new ATOM 0 HD11 ILE A 111 5.857 -2.260 0.504 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.153 -0.668 0.137 1.00 0.00 H new ATOM 0 HD13 ILE A 111 5.680 -1.735 -1.187 1.00 0.00 H new ATOM 1750 N SER A 112 9.761 2.396 -2.569 1.00 0.00 N ATOM 1751 CA SER A 112 9.946 3.530 -3.467 1.00 0.00 C ATOM 1752 C SER A 112 9.014 3.428 -4.670 1.00 0.00 C ATOM 1753 O SER A 112 9.230 2.617 -5.572 1.00 0.00 O ATOM 1754 CB SER A 112 11.400 3.602 -3.939 1.00 0.00 C ATOM 1755 OG SER A 112 12.183 4.389 -3.058 1.00 0.00 O ATOM 0 H SER A 112 10.392 1.613 -2.743 1.00 0.00 H new ATOM 0 HA SER A 112 9.704 4.440 -2.918 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.816 2.596 -4.001 1.00 0.00 H new ATOM 0 HB3 SER A 112 11.439 4.025 -4.943 1.00 0.00 H new ATOM 0 HG SER A 112 13.108 4.418 -3.380 1.00 0.00 H new ATOM 1761 N LEU A 113 7.975 4.256 -4.678 1.00 0.00 N ATOM 1762 CA LEU A 113 7.008 4.261 -5.770 1.00 0.00 C ATOM 1763 C LEU A 113 7.587 4.939 -7.007 1.00 0.00 C ATOM 1764 O LEU A 113 8.347 5.902 -6.902 1.00 0.00 O ATOM 1765 CB LEU A 113 5.725 4.973 -5.338 1.00 0.00 C ATOM 1766 CG LEU A 113 4.945 4.318 -4.196 1.00 0.00 C ATOM 1767 CD1 LEU A 113 3.847 5.245 -3.700 1.00 0.00 C ATOM 1768 CD2 LEU A 113 4.361 2.987 -4.645 1.00 0.00 C ATOM 0 H LEU A 113 7.781 4.933 -3.940 1.00 0.00 H new ATOM 0 HA LEU A 113 6.775 3.226 -6.021 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.980 5.990 -5.040 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.067 5.050 -6.203 1.00 0.00 H new ATOM 0 HG LEU A 113 5.633 4.130 -3.371 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.303 4.763 -2.888 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.290 6.173 -3.339 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.160 5.465 -4.517 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.810 2.535 -3.821 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.687 3.151 -5.486 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.167 2.320 -4.951 1.00 0.00 H new ATOM 1780 N LEU A 114 7.221 4.431 -8.179 1.00 0.00 N ATOM 1781 CA LEU A 114 7.703 4.989 -9.438 1.00 0.00 C ATOM 1782 C LEU A 114 6.538 5.346 -10.356 1.00 0.00 C ATOM 1783 O LEU A 114 5.404 4.930 -10.126 1.00 0.00 O ATOM 1784 CB LEU A 114 8.632 3.995 -10.137 1.00 0.00 C ATOM 1785 CG LEU A 114 9.551 3.181 -9.226 1.00 0.00 C ATOM 1786 CD1 LEU A 114 9.992 1.901 -9.918 1.00 0.00 C ATOM 1787 CD2 LEU A 114 10.759 4.008 -8.810 1.00 0.00 C ATOM 0 H LEU A 114 6.593 3.634 -8.284 1.00 0.00 H new ATOM 0 HA LEU A 114 8.258 5.900 -9.215 1.00 0.00 H new ATOM 0 HB2 LEU A 114 8.021 3.302 -10.716 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.251 4.544 -10.847 1.00 0.00 H new ATOM 0 HG LEU A 114 8.994 2.911 -8.329 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.645 1.335 -9.254 1.00 0.00 H new ATOM 0 HD12 LEU A 114 9.116 1.300 -10.164 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.531 2.149 -10.833 1.00 0.00 H new ATOM 0 HD21 LEU A 114 11.402 3.412 -8.162 1.00 0.00 H new ATOM 0 HD22 LEU A 114 11.317 4.309 -9.697 1.00 0.00 H new ATOM 0 HD23 LEU A 114 10.425 4.896 -8.273 1.00 0.00 H new ATOM 1799 N ASN A 115 6.828 6.117 -11.399 1.00 0.00 N ATOM 1800 CA ASN A 115 5.805 6.529 -12.353 1.00 0.00 C ATOM 1801 C ASN A 115 5.810 5.623 -13.581 1.00 0.00 C ATOM 1802 O ASN A 115 6.549 4.640 -13.635 1.00 0.00 O ATOM 1803 CB ASN A 115 6.028 7.982 -12.777 1.00 0.00 C ATOM 1804 CG ASN A 115 7.342 8.176 -13.509 1.00 0.00 C ATOM 1805 OD1 ASN A 115 7.956 7.213 -13.971 1.00 0.00 O ATOM 1806 ND2 ASN A 115 7.780 9.424 -13.618 1.00 0.00 N ATOM 0 H ASN A 115 7.763 6.469 -11.605 1.00 0.00 H new ATOM 0 HA ASN A 115 4.834 6.445 -11.865 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.207 8.300 -13.420 1.00 0.00 H new ATOM 0 HB3 ASN A 115 6.009 8.622 -11.895 1.00 0.00 H new ATOM 0 HD21 ASN A 115 8.658 9.616 -14.100 1.00 0.00 H new ATOM 0 HD22 ASN A 115 7.238 10.191 -13.220 1.00 0.00 H new ATOM 1813 N GLU A 116 4.982 5.962 -14.564 1.00 0.00 N ATOM 1814 CA GLU A 116 4.892 5.179 -15.790 1.00 0.00 C ATOM 1815 C GLU A 116 6.262 5.035 -16.446 1.00 0.00 C ATOM 1816 O GLU A 116 6.522 4.067 -17.162 1.00 0.00 O ATOM 1817 CB GLU A 116 3.913 5.832 -16.768 1.00 0.00 C ATOM 1818 CG GLU A 116 4.399 7.162 -17.319 1.00 0.00 C ATOM 1819 CD GLU A 116 3.802 7.484 -18.675 1.00 0.00 C ATOM 1820 OE1 GLU A 116 3.541 6.539 -19.448 1.00 0.00 O ATOM 1821 OE2 GLU A 116 3.596 8.682 -18.964 1.00 0.00 O ATOM 0 H GLU A 116 4.364 6.773 -14.535 1.00 0.00 H new ATOM 0 HA GLU A 116 4.527 4.186 -15.530 1.00 0.00 H new ATOM 0 HB2 GLU A 116 3.732 5.149 -17.598 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.958 5.984 -16.266 1.00 0.00 H new ATOM 0 HG2 GLU A 116 4.146 7.956 -16.617 1.00 0.00 H new ATOM 0 HG3 GLU A 116 5.486 7.142 -17.400 1.00 0.00 H new ATOM 1828 N LYS A 117 7.136 6.004 -16.197 1.00 0.00 N ATOM 1829 CA LYS A 117 8.480 5.988 -16.761 1.00 0.00 C ATOM 1830 C LYS A 117 9.435 5.201 -15.868 1.00 0.00 C ATOM 1831 O LYS A 117 10.506 4.783 -16.305 1.00 0.00 O ATOM 1832 CB LYS A 117 8.996 7.417 -16.943 1.00 0.00 C ATOM 1833 CG LYS A 117 8.276 8.189 -18.035 1.00 0.00 C ATOM 1834 CD LYS A 117 8.715 7.739 -19.419 1.00 0.00 C ATOM 1835 CE LYS A 117 7.744 8.208 -20.491 1.00 0.00 C ATOM 1836 NZ LYS A 117 7.808 7.353 -21.709 1.00 0.00 N ATOM 0 H LYS A 117 6.937 6.812 -15.607 1.00 0.00 H new ATOM 0 HA LYS A 117 8.433 5.499 -17.734 1.00 0.00 H new ATOM 0 HB2 LYS A 117 8.892 7.955 -16.001 1.00 0.00 H new ATOM 0 HB3 LYS A 117 10.060 7.383 -17.175 1.00 0.00 H new ATOM 0 HG2 LYS A 117 7.200 8.050 -17.931 1.00 0.00 H new ATOM 0 HG3 LYS A 117 8.473 9.255 -17.919 1.00 0.00 H new ATOM 0 HD2 LYS A 117 9.710 8.130 -19.631 1.00 0.00 H new ATOM 0 HD3 LYS A 117 8.788 6.652 -19.443 1.00 0.00 H new ATOM 0 HE2 LYS A 117 6.730 8.197 -20.092 1.00 0.00 H new ATOM 0 HE3 LYS A 117 7.970 9.240 -20.759 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 7.132 7.705 -22.416 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 8.769 7.383 -22.104 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 7.568 6.373 -21.458 1.00 0.00 H new ATOM 1850 N GLY A 118 9.038 5.001 -14.615 1.00 0.00 N ATOM 1851 CA GLY A 118 9.869 4.264 -13.682 1.00 0.00 C ATOM 1852 C GLY A 118 10.799 5.167 -12.896 1.00 0.00 C ATOM 1853 O GLY A 118 11.825 4.717 -12.385 1.00 0.00 O ATOM 0 H GLY A 118 8.155 5.337 -14.230 1.00 0.00 H new ATOM 0 HA2 GLY A 118 9.232 3.713 -12.990 1.00 0.00 H new ATOM 0 HA3 GLY A 118 10.458 3.528 -14.228 1.00 0.00 H new ATOM 1857 N GLN A 119 10.441 6.443 -12.800 1.00 0.00 N ATOM 1858 CA GLN A 119 11.253 7.411 -12.072 1.00 0.00 C ATOM 1859 C GLN A 119 10.856 7.457 -10.600 1.00 0.00 C ATOM 1860 O GLN A 119 9.713 7.170 -10.246 1.00 0.00 O ATOM 1861 CB GLN A 119 11.109 8.800 -12.695 1.00 0.00 C ATOM 1862 CG GLN A 119 11.685 8.900 -14.099 1.00 0.00 C ATOM 1863 CD GLN A 119 13.145 9.308 -14.103 1.00 0.00 C ATOM 1864 OE1 GLN A 119 13.967 8.721 -13.399 1.00 0.00 O ATOM 1865 NE2 GLN A 119 13.476 10.317 -14.900 1.00 0.00 N ATOM 0 H GLN A 119 9.595 6.831 -13.217 1.00 0.00 H new ATOM 0 HA GLN A 119 12.295 7.097 -12.139 1.00 0.00 H new ATOM 0 HB2 GLN A 119 10.053 9.068 -12.725 1.00 0.00 H new ATOM 0 HB3 GLN A 119 11.605 9.529 -12.055 1.00 0.00 H new ATOM 0 HG2 GLN A 119 11.579 7.938 -14.600 1.00 0.00 H new ATOM 0 HG3 GLN A 119 11.108 9.624 -14.674 1.00 0.00 H new ATOM 0 HE21 GLN A 119 12.762 10.775 -15.466 1.00 0.00 H new ATOM 0 HE22 GLN A 119 14.444 10.634 -14.946 1.00 0.00 H new ATOM 1874 N ASP A 120 11.808 7.820 -9.747 1.00 0.00 N ATOM 1875 CA ASP A 120 11.558 7.905 -8.313 1.00 0.00 C ATOM 1876 C ASP A 120 10.572 9.026 -7.999 1.00 0.00 C ATOM 1877 O ASP A 120 10.970 10.160 -7.728 1.00 0.00 O ATOM 1878 CB ASP A 120 12.868 8.134 -7.558 1.00 0.00 C ATOM 1879 CG ASP A 120 12.703 7.994 -6.057 1.00 0.00 C ATOM 1880 OD1 ASP A 120 12.182 6.950 -5.613 1.00 0.00 O ATOM 1881 OD2 ASP A 120 13.095 8.929 -5.327 1.00 0.00 O ATOM 0 H ASP A 120 12.760 8.060 -10.024 1.00 0.00 H new ATOM 0 HA ASP A 120 11.122 6.960 -7.988 1.00 0.00 H new ATOM 0 HB2 ASP A 120 13.615 7.420 -7.907 1.00 0.00 H new ATOM 0 HB3 ASP A 120 13.247 9.130 -7.788 1.00 0.00 H new ATOM 1886 N THR A 121 9.283 8.702 -8.037 1.00 0.00 N ATOM 1887 CA THR A 121 8.240 9.682 -7.759 1.00 0.00 C ATOM 1888 C THR A 121 8.518 10.426 -6.458 1.00 0.00 C ATOM 1889 O THR A 121 8.215 11.612 -6.333 1.00 0.00 O ATOM 1890 CB THR A 121 6.854 9.016 -7.670 1.00 0.00 C ATOM 1891 OG1 THR A 121 6.834 8.067 -6.598 1.00 0.00 O ATOM 1892 CG2 THR A 121 6.503 8.321 -8.977 1.00 0.00 C ATOM 0 H THR A 121 8.936 7.768 -8.258 1.00 0.00 H new ATOM 0 HA THR A 121 8.242 10.391 -8.587 1.00 0.00 H new ATOM 0 HB THR A 121 6.113 9.793 -7.480 1.00 0.00 H new ATOM 0 HG1 THR A 121 7.504 7.372 -6.764 1.00 0.00 H new ATOM 0 HG21 THR A 121 5.520 7.858 -8.890 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.490 9.052 -9.786 1.00 0.00 H new ATOM 0 HG23 THR A 121 7.247 7.555 -9.193 1.00 0.00 H new ATOM 1900 N GLY A 122 9.099 9.722 -5.491 1.00 0.00 N ATOM 1901 CA GLY A 122 9.408 10.334 -4.211 1.00 0.00 C ATOM 1902 C GLY A 122 8.338 10.074 -3.170 1.00 0.00 C ATOM 1903 O GLY A 122 8.205 10.827 -2.206 1.00 0.00 O ATOM 0 H GLY A 122 9.361 8.739 -5.571 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.362 9.951 -3.850 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.526 11.409 -4.345 1.00 0.00 H new ATOM 1907 N ALA A 123 7.571 9.006 -3.366 1.00 0.00 N ATOM 1908 CA ALA A 123 6.506 8.649 -2.436 1.00 0.00 C ATOM 1909 C ALA A 123 6.725 7.254 -1.861 1.00 0.00 C ATOM 1910 O ALA A 123 7.121 6.332 -2.575 1.00 0.00 O ATOM 1911 CB ALA A 123 5.153 8.732 -3.126 1.00 0.00 C ATOM 0 H ALA A 123 7.667 8.373 -4.160 1.00 0.00 H new ATOM 0 HA ALA A 123 6.524 9.361 -1.610 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.367 8.463 -2.420 1.00 0.00 H new ATOM 0 HB2 ALA A 123 4.988 9.749 -3.482 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.133 8.044 -3.971 1.00 0.00 H new ATOM 1917 N THR A 124 6.465 7.105 -0.566 1.00 0.00 N ATOM 1918 CA THR A 124 6.635 5.823 0.105 1.00 0.00 C ATOM 1919 C THR A 124 5.334 5.366 0.755 1.00 0.00 C ATOM 1920 O THR A 124 4.533 6.185 1.206 1.00 0.00 O ATOM 1921 CB THR A 124 7.736 5.893 1.180 1.00 0.00 C ATOM 1922 OG1 THR A 124 7.303 6.712 2.272 1.00 0.00 O ATOM 1923 CG2 THR A 124 9.025 6.453 0.599 1.00 0.00 C ATOM 0 H THR A 124 6.136 7.857 0.039 1.00 0.00 H new ATOM 0 HA THR A 124 6.929 5.103 -0.659 1.00 0.00 H new ATOM 0 HB THR A 124 7.928 4.882 1.539 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.008 6.750 2.952 1.00 0.00 H new ATOM 0 HG21 THR A 124 9.788 6.493 1.377 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.368 5.811 -0.212 1.00 0.00 H new ATOM 0 HG23 THR A 124 8.845 7.457 0.216 1.00 0.00 H new ATOM 1931 N ILE A 125 5.130 4.054 0.802 1.00 0.00 N ATOM 1932 CA ILE A 125 3.927 3.488 1.399 1.00 0.00 C ATOM 1933 C ILE A 125 4.240 2.200 2.153 1.00 0.00 C ATOM 1934 O ILE A 125 4.892 1.301 1.621 1.00 0.00 O ATOM 1935 CB ILE A 125 2.852 3.199 0.334 1.00 0.00 C ATOM 1936 CG1 ILE A 125 1.641 2.517 0.973 1.00 0.00 C ATOM 1937 CG2 ILE A 125 3.428 2.336 -0.778 1.00 0.00 C ATOM 1938 CD1 ILE A 125 0.395 2.571 0.116 1.00 0.00 C ATOM 0 H ILE A 125 5.783 3.363 0.433 1.00 0.00 H new ATOM 0 HA ILE A 125 3.543 4.231 2.098 1.00 0.00 H new ATOM 0 HB ILE A 125 2.526 4.145 -0.099 1.00 0.00 H new ATOM 0 HG12 ILE A 125 1.887 1.475 1.177 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.433 2.989 1.933 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.657 2.140 -1.523 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.262 2.857 -1.248 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.778 1.392 -0.361 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.423 2.068 0.632 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.124 3.611 -0.067 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.585 2.073 -0.835 1.00 0.00 H new ATOM 1950 N ASP A 126 3.769 2.117 3.392 1.00 0.00 N ATOM 1951 CA ASP A 126 3.995 0.937 4.218 1.00 0.00 C ATOM 1952 C ASP A 126 2.908 -0.107 3.985 1.00 0.00 C ATOM 1953 O ASP A 126 1.716 0.202 4.029 1.00 0.00 O ATOM 1954 CB ASP A 126 4.039 1.324 5.697 1.00 0.00 C ATOM 1955 CG ASP A 126 3.956 0.120 6.614 1.00 0.00 C ATOM 1956 OD1 ASP A 126 3.997 -1.019 6.103 1.00 0.00 O ATOM 1957 OD2 ASP A 126 3.850 0.316 7.843 1.00 0.00 O ATOM 0 H ASP A 126 3.228 2.853 3.847 1.00 0.00 H new ATOM 0 HA ASP A 126 4.955 0.505 3.935 1.00 0.00 H new ATOM 0 HB2 ASP A 126 4.961 1.868 5.900 1.00 0.00 H new ATOM 0 HB3 ASP A 126 3.214 2.002 5.917 1.00 0.00 H new ATOM 1962 N LEU A 127 3.325 -1.344 3.737 1.00 0.00 N ATOM 1963 CA LEU A 127 2.386 -2.434 3.496 1.00 0.00 C ATOM 1964 C LEU A 127 2.879 -3.728 4.135 1.00 0.00 C ATOM 1965 O LEU A 127 4.062 -4.061 4.056 1.00 0.00 O ATOM 1966 CB LEU A 127 2.186 -2.638 1.993 1.00 0.00 C ATOM 1967 CG LEU A 127 1.787 -1.397 1.194 1.00 0.00 C ATOM 1968 CD1 LEU A 127 2.247 -1.520 -0.250 1.00 0.00 C ATOM 1969 CD2 LEU A 127 0.282 -1.181 1.260 1.00 0.00 C ATOM 0 H LEU A 127 4.307 -1.617 3.698 1.00 0.00 H new ATOM 0 HA LEU A 127 1.432 -2.166 3.950 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.111 -3.033 1.574 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.420 -3.400 1.849 1.00 0.00 H new ATOM 0 HG LEU A 127 2.278 -0.531 1.637 1.00 0.00 H new ATOM 0 HD11 LEU A 127 1.954 -0.627 -0.803 1.00 0.00 H new ATOM 0 HD12 LEU A 127 3.332 -1.625 -0.279 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.786 -2.396 -0.705 1.00 0.00 H new ATOM 0 HD21 LEU A 127 0.016 -0.293 0.686 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.229 -2.049 0.843 1.00 0.00 H new ATOM 0 HD23 LEU A 127 -0.021 -1.046 2.298 1.00 0.00 H new ATOM 1981 N VAL A 128 1.963 -4.456 4.767 1.00 0.00 N ATOM 1982 CA VAL A 128 2.304 -5.716 5.417 1.00 0.00 C ATOM 1983 C VAL A 128 1.555 -6.882 4.782 1.00 0.00 C ATOM 1984 O VAL A 128 0.385 -7.120 5.084 1.00 0.00 O ATOM 1985 CB VAL A 128 1.985 -5.674 6.923 1.00 0.00 C ATOM 1986 CG1 VAL A 128 2.477 -6.940 7.609 1.00 0.00 C ATOM 1987 CG2 VAL A 128 2.598 -4.438 7.563 1.00 0.00 C ATOM 0 H VAL A 128 0.980 -4.195 4.842 1.00 0.00 H new ATOM 0 HA VAL A 128 3.376 -5.861 5.284 1.00 0.00 H new ATOM 0 HB VAL A 128 0.903 -5.620 7.046 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.243 -6.892 8.672 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.986 -7.807 7.168 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.556 -7.029 7.479 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.363 -4.425 8.627 1.00 0.00 H new ATOM 0 HG22 VAL A 128 3.680 -4.458 7.431 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.192 -3.544 7.090 1.00 0.00 H new ATOM 1997 N ILE A 129 2.236 -7.606 3.900 1.00 0.00 N ATOM 1998 CA ILE A 129 1.636 -8.749 3.224 1.00 0.00 C ATOM 1999 C ILE A 129 1.924 -10.045 3.973 1.00 0.00 C ATOM 2000 O ILE A 129 3.059 -10.304 4.373 1.00 0.00 O ATOM 2001 CB ILE A 129 2.148 -8.880 1.777 1.00 0.00 C ATOM 2002 CG1 ILE A 129 2.178 -7.509 1.098 1.00 0.00 C ATOM 2003 CG2 ILE A 129 1.276 -9.847 0.992 1.00 0.00 C ATOM 2004 CD1 ILE A 129 3.193 -7.411 -0.020 1.00 0.00 C ATOM 0 H ILE A 129 3.204 -7.421 3.637 1.00 0.00 H new ATOM 0 HA ILE A 129 0.560 -8.575 3.206 1.00 0.00 H new ATOM 0 HB ILE A 129 3.164 -9.275 1.801 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.188 -7.288 0.699 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.398 -6.747 1.846 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.651 -9.929 -0.028 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.301 -10.828 1.467 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.250 -9.479 0.973 1.00 0.00 H new ATOM 0 HD11 ILE A 129 3.159 -6.412 -0.456 1.00 0.00 H new ATOM 0 HD12 ILE A 129 4.191 -7.600 0.377 1.00 0.00 H new ATOM 0 HD13 ILE A 129 2.962 -8.150 -0.787 1.00 0.00 H new ATOM 2016 N GLY A 130 0.889 -10.859 4.158 1.00 0.00 N ATOM 2017 CA GLY A 130 1.052 -12.120 4.857 1.00 0.00 C ATOM 2018 C GLY A 130 0.563 -13.302 4.043 1.00 0.00 C ATOM 2019 O GLY A 130 -0.615 -13.379 3.694 1.00 0.00 O ATOM 0 H GLY A 130 -0.060 -10.667 3.836 1.00 0.00 H new ATOM 0 HA2 GLY A 130 2.104 -12.262 5.102 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.507 -12.082 5.800 1.00 0.00 H new ATOM 2023 N TYR A 131 1.470 -14.223 3.738 1.00 0.00 N ATOM 2024 CA TYR A 131 1.125 -15.405 2.955 1.00 0.00 C ATOM 2025 C TYR A 131 0.752 -16.571 3.866 1.00 0.00 C ATOM 2026 O TYR A 131 1.301 -16.721 4.958 1.00 0.00 O ATOM 2027 CB TYR A 131 2.294 -15.802 2.052 1.00 0.00 C ATOM 2028 CG TYR A 131 2.209 -17.224 1.543 1.00 0.00 C ATOM 2029 CD1 TYR A 131 1.117 -17.651 0.798 1.00 0.00 C ATOM 2030 CD2 TYR A 131 3.220 -18.139 1.808 1.00 0.00 C ATOM 2031 CE1 TYR A 131 1.035 -18.949 0.331 1.00 0.00 C ATOM 2032 CE2 TYR A 131 3.147 -19.438 1.345 1.00 0.00 C ATOM 2033 CZ TYR A 131 2.053 -19.839 0.607 1.00 0.00 C ATOM 2034 OH TYR A 131 1.976 -21.132 0.144 1.00 0.00 O ATOM 0 H TYR A 131 2.449 -14.175 4.020 1.00 0.00 H new ATOM 0 HA TYR A 131 0.262 -15.161 2.335 1.00 0.00 H new ATOM 0 HB2 TYR A 131 2.332 -15.122 1.201 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.226 -15.677 2.602 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.319 -16.957 0.580 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.078 -17.829 2.386 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.179 -19.265 -0.247 1.00 0.00 H new ATOM 0 HE2 TYR A 131 3.942 -20.136 1.560 1.00 0.00 H new ATOM 0 HH TYR A 131 2.801 -21.610 0.369 1.00 0.00 H new ATOM 2044 N ASP A 132 -0.184 -17.394 3.407 1.00 0.00 N ATOM 2045 CA ASP A 132 -0.631 -18.549 4.178 1.00 0.00 C ATOM 2046 C ASP A 132 -0.893 -19.743 3.266 1.00 0.00 C ATOM 2047 O ASP A 132 -1.769 -19.714 2.401 1.00 0.00 O ATOM 2048 CB ASP A 132 -1.896 -18.205 4.965 1.00 0.00 C ATOM 2049 CG ASP A 132 -2.040 -19.037 6.224 1.00 0.00 C ATOM 2050 OD1 ASP A 132 -1.527 -18.609 7.279 1.00 0.00 O ATOM 2051 OD2 ASP A 132 -2.664 -20.117 6.154 1.00 0.00 O ATOM 0 H ASP A 132 -0.648 -17.283 2.505 1.00 0.00 H new ATOM 0 HA ASP A 132 0.161 -18.816 4.877 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -1.878 -17.148 5.232 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -2.768 -18.359 4.330 1.00 0.00 H new ATOM 2056 N PRO A 133 -0.116 -20.818 3.460 1.00 0.00 N ATOM 2057 CA PRO A 133 -0.244 -22.042 2.664 1.00 0.00 C ATOM 2058 C PRO A 133 -1.534 -22.798 2.967 1.00 0.00 C ATOM 2059 O PRO A 133 -1.922 -22.974 4.122 1.00 0.00 O ATOM 2060 CB PRO A 133 0.972 -22.870 3.086 1.00 0.00 C ATOM 2061 CG PRO A 133 1.305 -22.383 4.454 1.00 0.00 C ATOM 2062 CD PRO A 133 0.949 -20.923 4.472 1.00 0.00 C ATOM 0 HA PRO A 133 -0.282 -21.830 1.595 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.743 -23.936 3.090 1.00 0.00 H new ATOM 0 HB3 PRO A 133 1.807 -22.726 2.400 1.00 0.00 H new ATOM 0 HG2 PRO A 133 0.743 -22.931 5.211 1.00 0.00 H new ATOM 0 HG3 PRO A 133 2.363 -22.529 4.674 1.00 0.00 H new ATOM 0 HD2 PRO A 133 0.601 -20.606 5.455 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.805 -20.298 4.220 1.00 0.00 H new ATOM 2070 N PRO A 134 -2.215 -23.257 1.906 1.00 0.00 N ATOM 2071 CA PRO A 134 -3.471 -24.002 2.034 1.00 0.00 C ATOM 2072 C PRO A 134 -3.262 -25.392 2.625 1.00 0.00 C ATOM 2073 O PRO A 134 -2.275 -26.063 2.325 1.00 0.00 O ATOM 2074 CB PRO A 134 -3.971 -24.104 0.591 1.00 0.00 C ATOM 2075 CG PRO A 134 -2.742 -24.000 -0.244 1.00 0.00 C ATOM 2076 CD PRO A 134 -1.812 -23.084 0.501 1.00 0.00 C ATOM 0 HA PRO A 134 -4.171 -23.509 2.708 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -4.489 -25.047 0.417 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -4.676 -23.306 0.359 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -2.288 -24.980 -0.394 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -2.974 -23.602 -1.232 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -0.768 -23.358 0.346 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -1.922 -22.049 0.176 1.00 0.00 H new