USER MOD reduce.3.24.130724 H: found=0, std=0, add=946, rem=0, adj=24 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= -0.261 X(o=-0.26,f=0) USER MOD Set 1.2: A 124 THR OG1 : rot 180:sc= 0 USER MOD Single : A 6 SER OG : rot 180:sc= 0 USER MOD Single : A 8 MET CE :methyl -164:sc= -0.401 (180deg=-0.681) USER MOD Single : A 15 SER OG : rot 180:sc= 0 USER MOD Single : A 17 SER OG : rot 15:sc= 0.86 USER MOD Single : A 21 LYS NZ :NH3+ 163:sc= -0.0124 (180deg=-0.173) USER MOD Single : A 22 THR OG1 : rot 180:sc= 0 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 40 LYS NZ :NH3+ -115:sc= -0.199! (180deg=-2.53!) USER MOD Single : A 41 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 119:sc= 1.61 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= -1.33! C(o=-1.3!,f=-1.9!) USER MOD Single : A 50 ASN : amide:sc= -0.98 K(o=-0.98,f=-4.3!) USER MOD Single : A 54 ASN : amide:sc= -0.191 K(o=-0.19,f=-4!) USER MOD Single : A 69 SER OG : rot 180:sc= 0 USER MOD Single : A 70 SER OG : rot -41:sc= 0.262 USER MOD Single : A 71 SER OG : rot 180:sc= 0 USER MOD Single : A 77 LYS NZ :NH3+ 162:sc= -0.0148 (180deg=-0.208) USER MOD Single : A 90 THR OG1 : rot 180:sc= 0 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 -99:sc= 0.81 USER MOD Single : A 102 GLN : amide:sc= -0.524 X(o=-0.52,f=-0.67) USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 105 SER OG : rot 43:sc= 0.296 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= -2.27! C(o=-2.3!,f=-13!) USER MOD Single : A 117 LYS NZ :NH3+ -153:sc= -0.0616 (180deg=-0.55) USER MOD Single : A 119 GLN : amide:sc= -0.2 X(o=-0.2,f=-0.2) USER MOD Single : A 121 THR OG1 : rot -70:sc= 1 USER MOD Single : A 131 TYR OH : rot 156:sc= 1.27 USER MOD ----------------------------------------------------------------- ATOM 48 N SER A 6 -8.288 -22.392 2.418 1.00 0.00 N ATOM 49 CA SER A 6 -8.026 -22.518 0.989 1.00 0.00 C ATOM 50 C SER A 6 -7.083 -21.418 0.510 1.00 0.00 C ATOM 51 O SER A 6 -7.304 -20.806 -0.534 1.00 0.00 O ATOM 52 CB SER A 6 -9.336 -22.461 0.201 1.00 0.00 C ATOM 53 OG SER A 6 -10.112 -23.627 0.415 1.00 0.00 O ATOM 0 HA SER A 6 -7.549 -23.483 0.817 1.00 0.00 H new ATOM 0 HB2 SER A 6 -9.906 -21.581 0.500 1.00 0.00 H new ATOM 0 HB3 SER A 6 -9.120 -22.354 -0.862 1.00 0.00 H new ATOM 0 HG SER A 6 -10.944 -23.565 -0.098 1.00 0.00 H new ATOM 59 N GLY A 7 -6.029 -21.174 1.283 1.00 0.00 N ATOM 60 CA GLY A 7 -5.067 -20.148 0.923 1.00 0.00 C ATOM 61 C GLY A 7 -5.674 -18.759 0.923 1.00 0.00 C ATOM 62 O GLY A 7 -6.732 -18.536 0.334 1.00 0.00 O ATOM 0 H GLY A 7 -5.824 -21.668 2.152 1.00 0.00 H new ATOM 0 HA2 GLY A 7 -4.232 -20.176 1.622 1.00 0.00 H new ATOM 0 HA3 GLY A 7 -4.662 -20.364 -0.066 1.00 0.00 H new ATOM 66 N MET A 8 -5.004 -17.822 1.586 1.00 0.00 N ATOM 67 CA MET A 8 -5.484 -16.447 1.661 1.00 0.00 C ATOM 68 C MET A 8 -4.323 -15.475 1.839 1.00 0.00 C ATOM 69 O MET A 8 -3.467 -15.666 2.703 1.00 0.00 O ATOM 70 CB MET A 8 -6.476 -16.293 2.815 1.00 0.00 C ATOM 71 CG MET A 8 -6.683 -14.851 3.249 1.00 0.00 C ATOM 72 SD MET A 8 -8.311 -14.571 3.974 1.00 0.00 S ATOM 73 CE MET A 8 -9.310 -14.380 2.500 1.00 0.00 C ATOM 0 H MET A 8 -4.127 -17.990 2.079 1.00 0.00 H new ATOM 0 HA MET A 8 -5.989 -16.213 0.724 1.00 0.00 H new ATOM 0 HB2 MET A 8 -7.436 -16.716 2.517 1.00 0.00 H new ATOM 0 HB3 MET A 8 -6.123 -16.873 3.667 1.00 0.00 H new ATOM 0 HG2 MET A 8 -5.915 -14.580 3.974 1.00 0.00 H new ATOM 0 HG3 MET A 8 -6.555 -14.195 2.388 1.00 0.00 H new ATOM 0 HE1 MET A 8 -10.265 -13.926 2.764 1.00 0.00 H new ATOM 0 HE2 MET A 8 -8.789 -13.740 1.788 1.00 0.00 H new ATOM 0 HE3 MET A 8 -9.485 -15.357 2.050 1.00 0.00 H new ATOM 83 N LEU A 9 -4.299 -14.432 1.016 1.00 0.00 N ATOM 84 CA LEU A 9 -3.242 -13.429 1.083 1.00 0.00 C ATOM 85 C LEU A 9 -3.777 -12.109 1.631 1.00 0.00 C ATOM 86 O LEU A 9 -4.584 -11.439 0.986 1.00 0.00 O ATOM 87 CB LEU A 9 -2.633 -13.209 -0.303 1.00 0.00 C ATOM 88 CG LEU A 9 -1.493 -12.192 -0.381 1.00 0.00 C ATOM 89 CD1 LEU A 9 -0.153 -12.873 -0.152 1.00 0.00 C ATOM 90 CD2 LEU A 9 -1.508 -11.477 -1.724 1.00 0.00 C ATOM 0 H LEU A 9 -4.999 -14.259 0.295 1.00 0.00 H new ATOM 0 HA LEU A 9 -2.470 -13.795 1.759 1.00 0.00 H new ATOM 0 HB2 LEU A 9 -2.265 -14.166 -0.673 1.00 0.00 H new ATOM 0 HB3 LEU A 9 -3.425 -12.889 -0.980 1.00 0.00 H new ATOM 0 HG LEU A 9 -1.639 -11.451 0.405 1.00 0.00 H new ATOM 0 HD11 LEU A 9 0.646 -12.134 -0.211 1.00 0.00 H new ATOM 0 HD12 LEU A 9 -0.145 -13.338 0.834 1.00 0.00 H new ATOM 0 HD13 LEU A 9 0.002 -13.637 -0.914 1.00 0.00 H new ATOM 0 HD21 LEU A 9 -0.690 -10.757 -1.762 1.00 0.00 H new ATOM 0 HD22 LEU A 9 -1.388 -12.206 -2.526 1.00 0.00 H new ATOM 0 HD23 LEU A 9 -2.457 -10.955 -1.848 1.00 0.00 H new ATOM 102 N ARG A 10 -3.322 -11.742 2.824 1.00 0.00 N ATOM 103 CA ARG A 10 -3.754 -10.502 3.458 1.00 0.00 C ATOM 104 C ARG A 10 -2.773 -9.371 3.165 1.00 0.00 C ATOM 105 O ARG A 10 -1.560 -9.535 3.300 1.00 0.00 O ATOM 106 CB ARG A 10 -3.886 -10.697 4.970 1.00 0.00 C ATOM 107 CG ARG A 10 -5.270 -11.150 5.406 1.00 0.00 C ATOM 108 CD ARG A 10 -5.582 -10.700 6.825 1.00 0.00 C ATOM 109 NE ARG A 10 -6.789 -11.333 7.347 1.00 0.00 N ATOM 110 CZ ARG A 10 -7.379 -10.969 8.480 1.00 0.00 C ATOM 111 NH1 ARG A 10 -6.876 -9.980 9.205 1.00 0.00 N ATOM 112 NH2 ARG A 10 -8.476 -11.594 8.890 1.00 0.00 N ATOM 0 H ARG A 10 -2.654 -12.285 3.371 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.727 -10.232 3.046 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.152 -11.432 5.299 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -3.645 -9.760 5.471 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -6.018 -10.748 4.723 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -5.334 -12.236 5.345 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -4.739 -10.937 7.474 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.704 -9.617 6.843 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.202 -12.097 6.812 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -6.034 -9.496 8.893 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -7.331 -9.703 10.075 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.867 -12.355 8.335 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -8.928 -11.313 9.760 1.00 0.00 H new ATOM 126 N VAL A 11 -3.306 -8.222 2.762 1.00 0.00 N ATOM 127 CA VAL A 11 -2.479 -7.063 2.450 1.00 0.00 C ATOM 128 C VAL A 11 -2.895 -5.851 3.276 1.00 0.00 C ATOM 129 O VAL A 11 -3.863 -5.165 2.946 1.00 0.00 O ATOM 130 CB VAL A 11 -2.559 -6.702 0.954 1.00 0.00 C ATOM 131 CG1 VAL A 11 -1.680 -5.500 0.647 1.00 0.00 C ATOM 132 CG2 VAL A 11 -2.164 -7.895 0.097 1.00 0.00 C ATOM 0 H VAL A 11 -4.308 -8.069 2.644 1.00 0.00 H new ATOM 0 HA VAL A 11 -1.452 -7.332 2.697 1.00 0.00 H new ATOM 0 HB VAL A 11 -3.589 -6.438 0.716 1.00 0.00 H new ATOM 0 HG11 VAL A 11 -1.749 -5.260 -0.414 1.00 0.00 H new ATOM 0 HG12 VAL A 11 -2.014 -4.645 1.235 1.00 0.00 H new ATOM 0 HG13 VAL A 11 -0.645 -5.732 0.900 1.00 0.00 H new ATOM 0 HG21 VAL A 11 -2.226 -7.623 -0.957 1.00 0.00 H new ATOM 0 HG22 VAL A 11 -1.143 -8.192 0.335 1.00 0.00 H new ATOM 0 HG23 VAL A 11 -2.840 -8.726 0.297 1.00 0.00 H new ATOM 142 N ILE A 12 -2.158 -5.594 4.351 1.00 0.00 N ATOM 143 CA ILE A 12 -2.450 -4.464 5.225 1.00 0.00 C ATOM 144 C ILE A 12 -1.732 -3.204 4.752 1.00 0.00 C ATOM 145 O ILE A 12 -0.545 -3.238 4.428 1.00 0.00 O ATOM 146 CB ILE A 12 -2.043 -4.758 6.681 1.00 0.00 C ATOM 147 CG1 ILE A 12 -2.618 -6.102 7.132 1.00 0.00 C ATOM 148 CG2 ILE A 12 -2.514 -3.639 7.598 1.00 0.00 C ATOM 149 CD1 ILE A 12 -1.886 -6.708 8.309 1.00 0.00 C ATOM 0 H ILE A 12 -1.354 -6.153 4.638 1.00 0.00 H new ATOM 0 HA ILE A 12 -3.527 -4.303 5.184 1.00 0.00 H new ATOM 0 HB ILE A 12 -0.956 -4.813 6.736 1.00 0.00 H new ATOM 0 HG12 ILE A 12 -3.667 -5.969 7.396 1.00 0.00 H new ATOM 0 HG13 ILE A 12 -2.586 -6.801 6.296 1.00 0.00 H new ATOM 0 HG21 ILE A 12 -2.219 -3.861 8.624 1.00 0.00 H new ATOM 0 HG22 ILE A 12 -2.061 -2.698 7.286 1.00 0.00 H new ATOM 0 HG23 ILE A 12 -3.599 -3.556 7.542 1.00 0.00 H new ATOM 0 HD11 ILE A 12 -2.348 -7.659 8.574 1.00 0.00 H new ATOM 0 HD12 ILE A 12 -0.842 -6.873 8.042 1.00 0.00 H new ATOM 0 HD13 ILE A 12 -1.940 -6.029 9.160 1.00 0.00 H new ATOM 161 N VAL A 13 -2.460 -2.093 4.718 1.00 0.00 N ATOM 162 CA VAL A 13 -1.892 -0.820 4.288 1.00 0.00 C ATOM 163 C VAL A 13 -1.921 0.204 5.417 1.00 0.00 C ATOM 164 O VAL A 13 -2.975 0.745 5.750 1.00 0.00 O ATOM 165 CB VAL A 13 -2.648 -0.250 3.073 1.00 0.00 C ATOM 166 CG1 VAL A 13 -1.926 0.969 2.519 1.00 0.00 C ATOM 167 CG2 VAL A 13 -2.813 -1.316 2.001 1.00 0.00 C ATOM 0 H VAL A 13 -3.444 -2.048 4.983 1.00 0.00 H new ATOM 0 HA VAL A 13 -0.858 -1.015 4.004 1.00 0.00 H new ATOM 0 HB VAL A 13 -3.641 0.062 3.398 1.00 0.00 H new ATOM 0 HG11 VAL A 13 -2.475 1.358 1.661 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -1.865 1.737 3.290 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -0.920 0.686 2.209 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -3.349 -0.896 1.150 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.831 -1.661 1.677 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -3.377 -2.156 2.407 1.00 0.00 H new ATOM 177 N GLU A 14 -0.757 0.464 6.003 1.00 0.00 N ATOM 178 CA GLU A 14 -0.649 1.423 7.096 1.00 0.00 C ATOM 179 C GLU A 14 -0.962 2.836 6.612 1.00 0.00 C ATOM 180 O GLU A 14 -2.029 3.380 6.898 1.00 0.00 O ATOM 181 CB GLU A 14 0.753 1.381 7.706 1.00 0.00 C ATOM 182 CG GLU A 14 1.049 0.096 8.462 1.00 0.00 C ATOM 183 CD GLU A 14 0.198 -0.057 9.707 1.00 0.00 C ATOM 184 OE1 GLU A 14 0.238 0.847 10.568 1.00 0.00 O ATOM 185 OE2 GLU A 14 -0.508 -1.081 9.822 1.00 0.00 O ATOM 0 H GLU A 14 0.125 0.024 5.739 1.00 0.00 H new ATOM 0 HA GLU A 14 -1.377 1.148 7.859 1.00 0.00 H new ATOM 0 HB2 GLU A 14 1.490 1.503 6.912 1.00 0.00 H new ATOM 0 HB3 GLU A 14 0.871 2.227 8.383 1.00 0.00 H new ATOM 0 HG2 GLU A 14 0.879 -0.756 7.804 1.00 0.00 H new ATOM 0 HG3 GLU A 14 2.102 0.078 8.742 1.00 0.00 H new ATOM 192 N SER A 15 -0.024 3.426 5.878 1.00 0.00 N ATOM 193 CA SER A 15 -0.197 4.777 5.357 1.00 0.00 C ATOM 194 C SER A 15 0.938 5.141 4.405 1.00 0.00 C ATOM 195 O SER A 15 1.941 4.434 4.317 1.00 0.00 O ATOM 196 CB SER A 15 -0.257 5.785 6.507 1.00 0.00 C ATOM 197 OG SER A 15 0.794 5.567 7.432 1.00 0.00 O ATOM 0 H SER A 15 0.864 2.989 5.631 1.00 0.00 H new ATOM 0 HA SER A 15 -1.136 4.810 4.804 1.00 0.00 H new ATOM 0 HB2 SER A 15 -0.192 6.798 6.110 1.00 0.00 H new ATOM 0 HB3 SER A 15 -1.217 5.703 7.017 1.00 0.00 H new ATOM 0 HG SER A 15 0.734 6.225 8.156 1.00 0.00 H new ATOM 203 N ALA A 16 0.771 6.251 3.693 1.00 0.00 N ATOM 204 CA ALA A 16 1.781 6.712 2.748 1.00 0.00 C ATOM 205 C ALA A 16 2.290 8.100 3.123 1.00 0.00 C ATOM 206 O ALA A 16 1.687 8.792 3.943 1.00 0.00 O ATOM 207 CB ALA A 16 1.218 6.718 1.335 1.00 0.00 C ATOM 0 H ALA A 16 -0.054 6.848 3.753 1.00 0.00 H new ATOM 0 HA ALA A 16 2.623 6.021 2.788 1.00 0.00 H new ATOM 0 HB1 ALA A 16 1.983 7.064 0.640 1.00 0.00 H new ATOM 0 HB2 ALA A 16 0.910 5.709 1.062 1.00 0.00 H new ATOM 0 HB3 ALA A 16 0.357 7.385 1.289 1.00 0.00 H new ATOM 213 N SER A 17 3.403 8.500 2.516 1.00 0.00 N ATOM 214 CA SER A 17 3.995 9.804 2.790 1.00 0.00 C ATOM 215 C SER A 17 4.896 10.244 1.639 1.00 0.00 C ATOM 216 O SER A 17 5.313 9.429 0.817 1.00 0.00 O ATOM 217 CB SER A 17 4.797 9.761 4.092 1.00 0.00 C ATOM 218 OG SER A 17 3.941 9.803 5.220 1.00 0.00 O ATOM 0 H SER A 17 3.912 7.940 1.832 1.00 0.00 H new ATOM 0 HA SER A 17 3.187 10.528 2.894 1.00 0.00 H new ATOM 0 HB2 SER A 17 5.399 8.853 4.122 1.00 0.00 H new ATOM 0 HB3 SER A 17 5.488 10.603 4.125 1.00 0.00 H new ATOM 0 HG SER A 17 3.021 9.612 4.940 1.00 0.00 H new ATOM 224 N ASN A 18 5.191 11.539 1.588 1.00 0.00 N ATOM 225 CA ASN A 18 6.042 12.088 0.539 1.00 0.00 C ATOM 226 C ASN A 18 5.365 11.976 -0.824 1.00 0.00 C ATOM 227 O ASN A 18 6.008 11.652 -1.823 1.00 0.00 O ATOM 228 CB ASN A 18 7.389 11.363 0.513 1.00 0.00 C ATOM 229 CG ASN A 18 8.069 11.358 1.868 1.00 0.00 C ATOM 230 OD1 ASN A 18 8.758 12.311 2.232 1.00 0.00 O ATOM 231 ND2 ASN A 18 7.878 10.283 2.623 1.00 0.00 N ATOM 0 H ASN A 18 4.853 12.227 2.261 1.00 0.00 H new ATOM 0 HA ASN A 18 6.210 13.143 0.757 1.00 0.00 H new ATOM 0 HB2 ASN A 18 7.239 10.336 0.181 1.00 0.00 H new ATOM 0 HB3 ASN A 18 8.042 11.842 -0.217 1.00 0.00 H new ATOM 0 HD21 ASN A 18 8.310 10.224 3.545 1.00 0.00 H new ATOM 0 HD22 ASN A 18 7.299 9.516 2.281 1.00 0.00 H new ATOM 238 N ILE A 19 4.064 12.247 -0.857 1.00 0.00 N ATOM 239 CA ILE A 19 3.301 12.178 -2.097 1.00 0.00 C ATOM 240 C ILE A 19 3.492 13.440 -2.930 1.00 0.00 C ATOM 241 O ILE A 19 3.409 14.563 -2.431 1.00 0.00 O ATOM 242 CB ILE A 19 1.799 11.979 -1.823 1.00 0.00 C ATOM 243 CG1 ILE A 19 1.547 10.597 -1.217 1.00 0.00 C ATOM 244 CG2 ILE A 19 0.999 12.156 -3.105 1.00 0.00 C ATOM 245 CD1 ILE A 19 0.104 10.151 -1.309 1.00 0.00 C ATOM 0 H ILE A 19 3.517 12.516 -0.039 1.00 0.00 H new ATOM 0 HA ILE A 19 3.677 11.319 -2.652 1.00 0.00 H new ATOM 0 HB ILE A 19 1.472 12.733 -1.107 1.00 0.00 H new ATOM 0 HG12 ILE A 19 2.178 9.866 -1.724 1.00 0.00 H new ATOM 0 HG13 ILE A 19 1.850 10.608 -0.170 1.00 0.00 H new ATOM 0 HG21 ILE A 19 -0.061 12.012 -2.895 1.00 0.00 H new ATOM 0 HG22 ILE A 19 1.158 13.160 -3.498 1.00 0.00 H new ATOM 0 HG23 ILE A 19 1.326 11.422 -3.842 1.00 0.00 H new ATOM 0 HD11 ILE A 19 -0.001 9.163 -0.860 1.00 0.00 H new ATOM 0 HD12 ILE A 19 -0.531 10.860 -0.778 1.00 0.00 H new ATOM 0 HD13 ILE A 19 -0.197 10.108 -2.356 1.00 0.00 H new ATOM 257 N PRO A 20 3.753 13.255 -4.233 1.00 0.00 N ATOM 258 CA PRO A 20 3.958 14.368 -5.165 1.00 0.00 C ATOM 259 C PRO A 20 2.674 15.146 -5.431 1.00 0.00 C ATOM 260 O PRO A 20 1.826 14.715 -6.213 1.00 0.00 O ATOM 261 CB PRO A 20 4.439 13.676 -6.443 1.00 0.00 C ATOM 262 CG PRO A 20 3.884 12.297 -6.359 1.00 0.00 C ATOM 263 CD PRO A 20 3.866 11.946 -4.897 1.00 0.00 C ATOM 0 HA PRO A 20 4.659 15.104 -4.773 1.00 0.00 H new ATOM 0 HB2 PRO A 20 4.080 14.194 -7.333 1.00 0.00 H new ATOM 0 HB3 PRO A 20 5.527 13.662 -6.500 1.00 0.00 H new ATOM 0 HG2 PRO A 20 2.881 12.254 -6.783 1.00 0.00 H new ATOM 0 HG3 PRO A 20 4.499 11.594 -6.922 1.00 0.00 H new ATOM 0 HD2 PRO A 20 3.026 11.296 -4.650 1.00 0.00 H new ATOM 0 HD3 PRO A 20 4.774 11.421 -4.599 1.00 0.00 H new ATOM 271 N LYS A 21 2.537 16.294 -4.777 1.00 0.00 N ATOM 272 CA LYS A 21 1.357 17.135 -4.945 1.00 0.00 C ATOM 273 C LYS A 21 1.156 17.505 -6.411 1.00 0.00 C ATOM 274 O LYS A 21 1.927 17.092 -7.278 1.00 0.00 O ATOM 275 CB LYS A 21 1.485 18.404 -4.100 1.00 0.00 C ATOM 276 CG LYS A 21 2.608 19.323 -4.550 1.00 0.00 C ATOM 277 CD LYS A 21 3.008 20.293 -3.451 1.00 0.00 C ATOM 278 CE LYS A 21 4.047 19.684 -2.521 1.00 0.00 C ATOM 279 NZ LYS A 21 5.380 19.573 -3.176 1.00 0.00 N ATOM 0 H LYS A 21 3.229 16.664 -4.125 1.00 0.00 H new ATOM 0 HA LYS A 21 0.488 16.569 -4.610 1.00 0.00 H new ATOM 0 HB2 LYS A 21 0.543 18.951 -4.136 1.00 0.00 H new ATOM 0 HB3 LYS A 21 1.651 18.123 -3.060 1.00 0.00 H new ATOM 0 HG2 LYS A 21 3.472 18.727 -4.843 1.00 0.00 H new ATOM 0 HG3 LYS A 21 2.292 19.881 -5.432 1.00 0.00 H new ATOM 0 HD2 LYS A 21 3.406 21.205 -3.896 1.00 0.00 H new ATOM 0 HD3 LYS A 21 2.126 20.578 -2.877 1.00 0.00 H new ATOM 0 HE2 LYS A 21 4.133 20.295 -1.623 1.00 0.00 H new ATOM 0 HE3 LYS A 21 3.715 18.696 -2.203 1.00 0.00 H new ATOM 0 HZ1 LYS A 21 6.112 19.433 -2.451 1.00 0.00 H new ATOM 0 HZ2 LYS A 21 5.380 18.764 -3.829 1.00 0.00 H new ATOM 0 HZ3 LYS A 21 5.580 20.445 -3.706 1.00 0.00 H new ATOM 293 N THR A 22 0.117 18.288 -6.681 1.00 0.00 N ATOM 294 CA THR A 22 -0.185 18.715 -8.042 1.00 0.00 C ATOM 295 C THR A 22 -0.260 20.235 -8.138 1.00 0.00 C ATOM 296 O THR A 22 -0.028 20.941 -7.156 1.00 0.00 O ATOM 297 CB THR A 22 -1.514 18.115 -8.537 1.00 0.00 C ATOM 298 OG1 THR A 22 -1.805 18.591 -9.856 1.00 0.00 O ATOM 299 CG2 THR A 22 -2.655 18.478 -7.599 1.00 0.00 C ATOM 0 H THR A 22 -0.530 18.640 -5.975 1.00 0.00 H new ATOM 0 HA THR A 22 0.626 18.353 -8.674 1.00 0.00 H new ATOM 0 HB THR A 22 -1.412 17.030 -8.556 1.00 0.00 H new ATOM 0 HG1 THR A 22 -2.651 18.204 -10.164 1.00 0.00 H new ATOM 0 HG21 THR A 22 -3.583 18.043 -7.970 1.00 0.00 H new ATOM 0 HG22 THR A 22 -2.445 18.089 -6.603 1.00 0.00 H new ATOM 0 HG23 THR A 22 -2.756 19.562 -7.552 1.00 0.00 H new ATOM 356 N LYS A 26 -3.486 19.623 -3.169 1.00 0.00 N ATOM 357 CA LYS A 26 -3.324 18.295 -2.590 1.00 0.00 C ATOM 358 C LYS A 26 -4.366 17.329 -3.146 1.00 0.00 C ATOM 359 O LYS A 26 -5.555 17.418 -2.841 1.00 0.00 O ATOM 360 CB LYS A 26 -3.438 18.363 -1.066 1.00 0.00 C ATOM 361 CG LYS A 26 -2.443 19.314 -0.423 1.00 0.00 C ATOM 362 CD LYS A 26 -2.353 19.095 1.078 1.00 0.00 C ATOM 363 CE LYS A 26 -1.010 19.551 1.627 1.00 0.00 C ATOM 364 NZ LYS A 26 -1.045 19.722 3.106 1.00 0.00 N ATOM 0 HA LYS A 26 -2.333 17.927 -2.858 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -4.448 18.673 -0.799 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -3.292 17.364 -0.654 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -1.460 19.172 -0.872 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.740 20.343 -0.624 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -3.155 19.641 1.575 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -2.499 18.038 1.302 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -0.244 18.822 1.364 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -0.727 20.494 1.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -0.111 20.033 3.442 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -1.759 20.436 3.356 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -1.290 18.816 3.555 1.00 0.00 H new ATOM 378 N PRO A 27 -3.910 16.382 -3.980 1.00 0.00 N ATOM 379 CA PRO A 27 -4.787 15.379 -4.593 1.00 0.00 C ATOM 380 C PRO A 27 -5.314 14.371 -3.578 1.00 0.00 C ATOM 381 O PRO A 27 -5.054 14.487 -2.381 1.00 0.00 O ATOM 382 CB PRO A 27 -3.876 14.688 -5.611 1.00 0.00 C ATOM 383 CG PRO A 27 -2.498 14.881 -5.079 1.00 0.00 C ATOM 384 CD PRO A 27 -2.505 16.216 -4.387 1.00 0.00 C ATOM 0 HA PRO A 27 -5.677 15.829 -5.033 1.00 0.00 H new ATOM 0 HB2 PRO A 27 -4.119 13.630 -5.705 1.00 0.00 H new ATOM 0 HB3 PRO A 27 -3.983 15.129 -6.602 1.00 0.00 H new ATOM 0 HG2 PRO A 27 -2.232 14.083 -4.385 1.00 0.00 H new ATOM 0 HG3 PRO A 27 -1.763 14.862 -5.884 1.00 0.00 H new ATOM 0 HD2 PRO A 27 -1.834 16.227 -3.528 1.00 0.00 H new ATOM 0 HD3 PRO A 27 -2.183 17.016 -5.054 1.00 0.00 H new ATOM 392 N ASP A 28 -6.055 13.382 -4.065 1.00 0.00 N ATOM 393 CA ASP A 28 -6.618 12.351 -3.199 1.00 0.00 C ATOM 394 C ASP A 28 -5.971 10.998 -3.474 1.00 0.00 C ATOM 395 O ASP A 28 -6.362 10.268 -4.386 1.00 0.00 O ATOM 396 CB ASP A 28 -8.131 12.257 -3.401 1.00 0.00 C ATOM 397 CG ASP A 28 -8.814 13.607 -3.299 1.00 0.00 C ATOM 398 OD1 ASP A 28 -8.848 14.331 -4.316 1.00 0.00 O ATOM 399 OD2 ASP A 28 -9.314 13.939 -2.204 1.00 0.00 O ATOM 0 H ASP A 28 -6.280 13.272 -5.054 1.00 0.00 H new ATOM 0 HA ASP A 28 -6.413 12.628 -2.165 1.00 0.00 H new ATOM 0 HB2 ASP A 28 -8.338 11.822 -4.379 1.00 0.00 H new ATOM 0 HB3 ASP A 28 -8.553 11.582 -2.656 1.00 0.00 H new ATOM 404 N PRO A 29 -4.955 10.653 -2.669 1.00 0.00 N ATOM 405 CA PRO A 29 -4.231 9.386 -2.807 1.00 0.00 C ATOM 406 C PRO A 29 -5.082 8.186 -2.408 1.00 0.00 C ATOM 407 O PRO A 29 -5.888 8.265 -1.480 1.00 0.00 O ATOM 408 CB PRO A 29 -3.050 9.546 -1.846 1.00 0.00 C ATOM 409 CG PRO A 29 -3.517 10.533 -0.832 1.00 0.00 C ATOM 410 CD PRO A 29 -4.435 11.474 -1.563 1.00 0.00 C ATOM 0 HA PRO A 29 -3.936 9.195 -3.839 1.00 0.00 H new ATOM 0 HB2 PRO A 29 -2.786 8.596 -1.381 1.00 0.00 H new ATOM 0 HB3 PRO A 29 -2.162 9.904 -2.367 1.00 0.00 H new ATOM 0 HG2 PRO A 29 -4.038 10.036 -0.014 1.00 0.00 H new ATOM 0 HG3 PRO A 29 -2.676 11.070 -0.394 1.00 0.00 H new ATOM 0 HD2 PRO A 29 -5.237 11.834 -0.919 1.00 0.00 H new ATOM 0 HD3 PRO A 29 -3.902 12.351 -1.930 1.00 0.00 H new ATOM 418 N ILE A 30 -4.899 7.075 -3.115 1.00 0.00 N ATOM 419 CA ILE A 30 -5.650 5.858 -2.833 1.00 0.00 C ATOM 420 C ILE A 30 -4.867 4.619 -3.253 1.00 0.00 C ATOM 421 O ILE A 30 -4.283 4.579 -4.336 1.00 0.00 O ATOM 422 CB ILE A 30 -7.013 5.859 -3.550 1.00 0.00 C ATOM 423 CG1 ILE A 30 -7.632 4.460 -3.517 1.00 0.00 C ATOM 424 CG2 ILE A 30 -6.856 6.341 -4.984 1.00 0.00 C ATOM 425 CD1 ILE A 30 -9.107 4.444 -3.851 1.00 0.00 C ATOM 0 H ILE A 30 -4.237 6.993 -3.887 1.00 0.00 H new ATOM 0 HA ILE A 30 -5.816 5.832 -1.756 1.00 0.00 H new ATOM 0 HB ILE A 30 -7.681 6.544 -3.028 1.00 0.00 H new ATOM 0 HG12 ILE A 30 -7.101 3.820 -4.222 1.00 0.00 H new ATOM 0 HG13 ILE A 30 -7.488 4.031 -2.525 1.00 0.00 H new ATOM 0 HG21 ILE A 30 -7.828 6.336 -5.478 1.00 0.00 H new ATOM 0 HG22 ILE A 30 -6.453 7.354 -4.985 1.00 0.00 H new ATOM 0 HG23 ILE A 30 -6.174 5.679 -5.518 1.00 0.00 H new ATOM 0 HD11 ILE A 30 -9.479 3.420 -3.808 1.00 0.00 H new ATOM 0 HD12 ILE A 30 -9.650 5.057 -3.132 1.00 0.00 H new ATOM 0 HD13 ILE A 30 -9.257 4.843 -4.854 1.00 0.00 H new ATOM 437 N VAL A 31 -4.861 3.608 -2.390 1.00 0.00 N ATOM 438 CA VAL A 31 -4.152 2.366 -2.673 1.00 0.00 C ATOM 439 C VAL A 31 -5.035 1.394 -3.448 1.00 0.00 C ATOM 440 O VAL A 31 -6.217 1.234 -3.142 1.00 0.00 O ATOM 441 CB VAL A 31 -3.673 1.685 -1.377 1.00 0.00 C ATOM 442 CG1 VAL A 31 -3.138 0.292 -1.672 1.00 0.00 C ATOM 443 CG2 VAL A 31 -2.616 2.536 -0.689 1.00 0.00 C ATOM 0 H VAL A 31 -5.339 3.625 -1.489 1.00 0.00 H new ATOM 0 HA VAL A 31 -3.285 2.628 -3.279 1.00 0.00 H new ATOM 0 HB VAL A 31 -4.524 1.586 -0.703 1.00 0.00 H new ATOM 0 HG11 VAL A 31 -2.804 -0.174 -0.745 1.00 0.00 H new ATOM 0 HG12 VAL A 31 -3.927 -0.314 -2.119 1.00 0.00 H new ATOM 0 HG13 VAL A 31 -2.299 0.363 -2.364 1.00 0.00 H new ATOM 0 HG21 VAL A 31 -2.288 2.041 0.225 1.00 0.00 H new ATOM 0 HG22 VAL A 31 -1.764 2.667 -1.356 1.00 0.00 H new ATOM 0 HG23 VAL A 31 -3.037 3.511 -0.442 1.00 0.00 H new ATOM 453 N SER A 32 -4.454 0.746 -4.452 1.00 0.00 N ATOM 454 CA SER A 32 -5.189 -0.209 -5.273 1.00 0.00 C ATOM 455 C SER A 32 -4.375 -1.481 -5.487 1.00 0.00 C ATOM 456 O SER A 32 -3.454 -1.514 -6.303 1.00 0.00 O ATOM 457 CB SER A 32 -5.543 0.415 -6.624 1.00 0.00 C ATOM 458 OG SER A 32 -6.362 1.560 -6.458 1.00 0.00 O ATOM 0 H SER A 32 -3.476 0.865 -4.717 1.00 0.00 H new ATOM 0 HA SER A 32 -6.108 -0.470 -4.748 1.00 0.00 H new ATOM 0 HB2 SER A 32 -4.630 0.691 -7.151 1.00 0.00 H new ATOM 0 HB3 SER A 32 -6.059 -0.319 -7.243 1.00 0.00 H new ATOM 0 HG SER A 32 -6.573 1.941 -7.336 1.00 0.00 H new ATOM 464 N VAL A 33 -4.721 -2.529 -4.746 1.00 0.00 N ATOM 465 CA VAL A 33 -4.025 -3.806 -4.853 1.00 0.00 C ATOM 466 C VAL A 33 -4.726 -4.733 -5.839 1.00 0.00 C ATOM 467 O VAL A 33 -5.955 -4.753 -5.922 1.00 0.00 O ATOM 468 CB VAL A 33 -3.926 -4.508 -3.486 1.00 0.00 C ATOM 469 CG1 VAL A 33 -3.172 -5.823 -3.615 1.00 0.00 C ATOM 470 CG2 VAL A 33 -3.257 -3.598 -2.467 1.00 0.00 C ATOM 0 H VAL A 33 -5.480 -2.519 -4.064 1.00 0.00 H new ATOM 0 HA VAL A 33 -3.020 -3.589 -5.215 1.00 0.00 H new ATOM 0 HB VAL A 33 -4.935 -4.728 -3.136 1.00 0.00 H new ATOM 0 HG11 VAL A 33 -3.112 -6.305 -2.639 1.00 0.00 H new ATOM 0 HG12 VAL A 33 -3.697 -6.477 -4.311 1.00 0.00 H new ATOM 0 HG13 VAL A 33 -2.166 -5.630 -3.987 1.00 0.00 H new ATOM 0 HG21 VAL A 33 -3.195 -4.110 -1.507 1.00 0.00 H new ATOM 0 HG22 VAL A 33 -2.253 -3.345 -2.809 1.00 0.00 H new ATOM 0 HG23 VAL A 33 -3.842 -2.685 -2.354 1.00 0.00 H new ATOM 480 N ILE A 34 -3.938 -5.500 -6.585 1.00 0.00 N ATOM 481 CA ILE A 34 -4.484 -6.432 -7.564 1.00 0.00 C ATOM 482 C ILE A 34 -3.793 -7.789 -7.477 1.00 0.00 C ATOM 483 O ILE A 34 -2.589 -7.900 -7.706 1.00 0.00 O ATOM 484 CB ILE A 34 -4.342 -5.888 -8.998 1.00 0.00 C ATOM 485 CG1 ILE A 34 -5.190 -4.626 -9.174 1.00 0.00 C ATOM 486 CG2 ILE A 34 -4.747 -6.950 -10.010 1.00 0.00 C ATOM 487 CD1 ILE A 34 -4.473 -3.356 -8.773 1.00 0.00 C ATOM 0 H ILE A 34 -2.919 -5.494 -6.530 1.00 0.00 H new ATOM 0 HA ILE A 34 -5.542 -6.550 -7.331 1.00 0.00 H new ATOM 0 HB ILE A 34 -3.298 -5.629 -9.171 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -5.497 -4.547 -10.217 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -6.099 -4.723 -8.581 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -4.641 -6.551 -11.019 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.106 -7.824 -9.897 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -5.785 -7.237 -9.840 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -5.133 -2.502 -8.924 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -4.190 -3.414 -7.722 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -3.578 -3.235 -9.384 1.00 0.00 H new ATOM 499 N PHE A 35 -4.565 -8.819 -7.145 1.00 0.00 N ATOM 500 CA PHE A 35 -4.028 -10.170 -7.029 1.00 0.00 C ATOM 501 C PHE A 35 -5.121 -11.210 -7.253 1.00 0.00 C ATOM 502 O PHE A 35 -6.226 -11.091 -6.724 1.00 0.00 O ATOM 503 CB PHE A 35 -3.391 -10.371 -5.652 1.00 0.00 C ATOM 504 CG PHE A 35 -2.639 -11.664 -5.523 1.00 0.00 C ATOM 505 CD1 PHE A 35 -1.317 -11.756 -5.928 1.00 0.00 C ATOM 506 CD2 PHE A 35 -3.253 -12.789 -4.995 1.00 0.00 C ATOM 507 CE1 PHE A 35 -0.623 -12.945 -5.811 1.00 0.00 C ATOM 508 CE2 PHE A 35 -2.564 -13.981 -4.875 1.00 0.00 C ATOM 509 CZ PHE A 35 -1.247 -14.059 -5.283 1.00 0.00 C ATOM 0 H PHE A 35 -5.564 -8.744 -6.952 1.00 0.00 H new ATOM 0 HA PHE A 35 -3.265 -10.299 -7.797 1.00 0.00 H new ATOM 0 HB2 PHE A 35 -2.711 -9.543 -5.450 1.00 0.00 H new ATOM 0 HB3 PHE A 35 -4.171 -10.336 -4.891 1.00 0.00 H new ATOM 0 HD1 PHE A 35 -0.823 -10.888 -6.340 1.00 0.00 H new ATOM 0 HD2 PHE A 35 -4.283 -12.733 -4.673 1.00 0.00 H new ATOM 0 HE1 PHE A 35 0.407 -13.004 -6.132 1.00 0.00 H new ATOM 0 HE2 PHE A 35 -3.055 -14.850 -4.463 1.00 0.00 H new ATOM 0 HZ PHE A 35 -0.706 -14.989 -5.190 1.00 0.00 H new ATOM 519 N LYS A 36 -4.804 -12.231 -8.042 1.00 0.00 N ATOM 520 CA LYS A 36 -5.756 -13.295 -8.338 1.00 0.00 C ATOM 521 C LYS A 36 -6.976 -12.745 -9.071 1.00 0.00 C ATOM 522 O LYS A 36 -8.115 -13.035 -8.705 1.00 0.00 O ATOM 523 CB LYS A 36 -6.195 -13.989 -7.046 1.00 0.00 C ATOM 524 CG LYS A 36 -5.092 -14.799 -6.387 1.00 0.00 C ATOM 525 CD LYS A 36 -5.084 -16.236 -6.881 1.00 0.00 C ATOM 526 CE LYS A 36 -3.690 -16.841 -6.812 1.00 0.00 C ATOM 527 NZ LYS A 36 -2.887 -16.525 -8.024 1.00 0.00 N ATOM 0 H LYS A 36 -3.894 -12.344 -8.488 1.00 0.00 H new ATOM 0 HA LYS A 36 -5.262 -14.021 -8.984 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -6.552 -13.237 -6.342 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -7.037 -14.646 -7.264 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -4.127 -14.337 -6.594 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -5.226 -14.786 -5.305 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -5.771 -16.832 -6.280 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -5.447 -16.271 -7.908 1.00 0.00 H new ATOM 0 HE2 LYS A 36 -3.175 -16.466 -5.928 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -3.769 -17.922 -6.701 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 -1.944 -16.955 -7.938 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -3.365 -16.905 -8.866 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 -2.790 -15.494 -8.117 1.00 0.00 H new ATOM 541 N ASP A 37 -6.729 -11.951 -10.107 1.00 0.00 N ATOM 542 CA ASP A 37 -7.807 -11.362 -10.893 1.00 0.00 C ATOM 543 C ASP A 37 -8.798 -10.629 -9.994 1.00 0.00 C ATOM 544 O ASP A 37 -9.999 -10.617 -10.259 1.00 0.00 O ATOM 545 CB ASP A 37 -8.532 -12.445 -11.695 1.00 0.00 C ATOM 546 CG ASP A 37 -7.637 -13.093 -12.733 1.00 0.00 C ATOM 547 OD1 ASP A 37 -6.842 -12.368 -13.367 1.00 0.00 O ATOM 548 OD2 ASP A 37 -7.732 -14.325 -12.911 1.00 0.00 O ATOM 0 H ASP A 37 -5.792 -11.700 -10.422 1.00 0.00 H new ATOM 0 HA ASP A 37 -7.368 -10.641 -11.583 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -8.905 -13.209 -11.013 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -9.399 -12.008 -12.189 1.00 0.00 H new ATOM 553 N GLU A 38 -8.285 -10.021 -8.929 1.00 0.00 N ATOM 554 CA GLU A 38 -9.125 -9.288 -7.990 1.00 0.00 C ATOM 555 C GLU A 38 -8.547 -7.904 -7.708 1.00 0.00 C ATOM 556 O GLU A 38 -7.376 -7.768 -7.353 1.00 0.00 O ATOM 557 CB GLU A 38 -9.268 -10.069 -6.682 1.00 0.00 C ATOM 558 CG GLU A 38 -10.454 -11.019 -6.667 1.00 0.00 C ATOM 559 CD GLU A 38 -10.131 -12.365 -7.284 1.00 0.00 C ATOM 560 OE1 GLU A 38 -9.387 -13.145 -6.653 1.00 0.00 O ATOM 561 OE2 GLU A 38 -10.623 -12.639 -8.399 1.00 0.00 O ATOM 0 H GLU A 38 -7.292 -10.022 -8.695 1.00 0.00 H new ATOM 0 HA GLU A 38 -10.109 -9.166 -8.442 1.00 0.00 H new ATOM 0 HB2 GLU A 38 -8.355 -10.638 -6.507 1.00 0.00 H new ATOM 0 HB3 GLU A 38 -9.367 -9.364 -5.857 1.00 0.00 H new ATOM 0 HG2 GLU A 38 -10.785 -11.165 -5.639 1.00 0.00 H new ATOM 0 HG3 GLU A 38 -11.285 -10.566 -7.208 1.00 0.00 H new ATOM 568 N LYS A 39 -9.376 -6.879 -7.870 1.00 0.00 N ATOM 569 CA LYS A 39 -8.950 -5.504 -7.633 1.00 0.00 C ATOM 570 C LYS A 39 -9.558 -4.961 -6.343 1.00 0.00 C ATOM 571 O LYS A 39 -10.772 -4.784 -6.243 1.00 0.00 O ATOM 572 CB LYS A 39 -9.350 -4.614 -8.812 1.00 0.00 C ATOM 573 CG LYS A 39 -8.666 -3.258 -8.809 1.00 0.00 C ATOM 574 CD LYS A 39 -8.866 -2.530 -10.128 1.00 0.00 C ATOM 575 CE LYS A 39 -7.918 -3.047 -11.199 1.00 0.00 C ATOM 576 NZ LYS A 39 -8.339 -2.627 -12.564 1.00 0.00 N ATOM 0 H LYS A 39 -10.348 -6.974 -8.165 1.00 0.00 H new ATOM 0 HA LYS A 39 -7.865 -5.498 -7.533 1.00 0.00 H new ATOM 0 HB2 LYS A 39 -9.113 -5.129 -9.743 1.00 0.00 H new ATOM 0 HB3 LYS A 39 -10.430 -4.467 -8.796 1.00 0.00 H new ATOM 0 HG2 LYS A 39 -9.061 -2.652 -7.994 1.00 0.00 H new ATOM 0 HG3 LYS A 39 -7.600 -3.387 -8.622 1.00 0.00 H new ATOM 0 HD2 LYS A 39 -9.896 -2.655 -10.461 1.00 0.00 H new ATOM 0 HD3 LYS A 39 -8.705 -1.462 -9.983 1.00 0.00 H new ATOM 0 HE2 LYS A 39 -6.911 -2.679 -11.001 1.00 0.00 H new ATOM 0 HE3 LYS A 39 -7.875 -4.135 -11.151 1.00 0.00 H new ATOM 0 HZ1 LYS A 39 -7.667 -3.000 -13.265 1.00 0.00 H new ATOM 0 HZ2 LYS A 39 -9.289 -2.999 -12.764 1.00 0.00 H new ATOM 0 HZ3 LYS A 39 -8.355 -1.589 -12.618 1.00 0.00 H new ATOM 590 N LYS A 40 -8.705 -4.697 -5.359 1.00 0.00 N ATOM 591 CA LYS A 40 -9.156 -4.171 -4.076 1.00 0.00 C ATOM 592 C LYS A 40 -8.382 -2.911 -3.702 1.00 0.00 C ATOM 593 O LYS A 40 -7.151 -2.915 -3.663 1.00 0.00 O ATOM 594 CB LYS A 40 -8.991 -5.228 -2.982 1.00 0.00 C ATOM 595 CG LYS A 40 -9.823 -6.478 -3.213 1.00 0.00 C ATOM 596 CD LYS A 40 -9.562 -7.527 -2.145 1.00 0.00 C ATOM 597 CE LYS A 40 -10.428 -8.760 -2.351 1.00 0.00 C ATOM 598 NZ LYS A 40 -9.804 -9.723 -3.300 1.00 0.00 N ATOM 0 H LYS A 40 -7.697 -4.839 -5.426 1.00 0.00 H new ATOM 0 HA LYS A 40 -10.211 -3.914 -4.168 1.00 0.00 H new ATOM 0 HB2 LYS A 40 -7.940 -5.509 -2.915 1.00 0.00 H new ATOM 0 HB3 LYS A 40 -9.266 -4.791 -2.022 1.00 0.00 H new ATOM 0 HG2 LYS A 40 -10.881 -6.216 -3.216 1.00 0.00 H new ATOM 0 HG3 LYS A 40 -9.594 -6.892 -4.195 1.00 0.00 H new ATOM 0 HD2 LYS A 40 -8.510 -7.813 -2.164 1.00 0.00 H new ATOM 0 HD3 LYS A 40 -9.760 -7.103 -1.161 1.00 0.00 H new ATOM 0 HE2 LYS A 40 -10.595 -9.251 -1.392 1.00 0.00 H new ATOM 0 HE3 LYS A 40 -11.405 -8.459 -2.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 40 -10.393 -9.800 -4.154 1.00 0.00 H new ATOM 0 HZ2 LYS A 40 -8.856 -9.386 -3.563 1.00 0.00 H new ATOM 0 HZ3 LYS A 40 -9.727 -10.656 -2.847 1.00 0.00 H new ATOM 612 N LYS A 41 -9.110 -1.835 -3.425 1.00 0.00 N ATOM 613 CA LYS A 41 -8.493 -0.568 -3.051 1.00 0.00 C ATOM 614 C LYS A 41 -8.974 -0.113 -1.677 1.00 0.00 C ATOM 615 O LYS A 41 -9.964 -0.625 -1.153 1.00 0.00 O ATOM 616 CB LYS A 41 -8.808 0.505 -4.095 1.00 0.00 C ATOM 617 CG LYS A 41 -10.289 0.633 -4.408 1.00 0.00 C ATOM 618 CD LYS A 41 -10.519 1.222 -5.789 1.00 0.00 C ATOM 619 CE LYS A 41 -11.992 1.200 -6.166 1.00 0.00 C ATOM 620 NZ LYS A 41 -12.209 1.621 -7.578 1.00 0.00 N ATOM 0 H LYS A 41 -10.129 -1.815 -3.452 1.00 0.00 H new ATOM 0 HA LYS A 41 -7.414 -0.717 -3.008 1.00 0.00 H new ATOM 0 HB2 LYS A 41 -8.436 1.466 -3.740 1.00 0.00 H new ATOM 0 HB3 LYS A 41 -8.269 0.275 -5.014 1.00 0.00 H new ATOM 0 HG2 LYS A 41 -10.761 -0.348 -4.347 1.00 0.00 H new ATOM 0 HG3 LYS A 41 -10.767 1.264 -3.658 1.00 0.00 H new ATOM 0 HD2 LYS A 41 -10.151 2.248 -5.814 1.00 0.00 H new ATOM 0 HD3 LYS A 41 -9.945 0.660 -6.526 1.00 0.00 H new ATOM 0 HE2 LYS A 41 -12.389 0.195 -6.021 1.00 0.00 H new ATOM 0 HE3 LYS A 41 -12.547 1.861 -5.500 1.00 0.00 H new ATOM 0 HZ1 LYS A 41 -13.225 1.593 -7.796 1.00 0.00 H new ATOM 0 HZ2 LYS A 41 -11.853 2.589 -7.710 1.00 0.00 H new ATOM 0 HZ3 LYS A 41 -11.700 0.975 -8.215 1.00 0.00 H new ATOM 634 N THR A 42 -8.269 0.854 -1.098 1.00 0.00 N ATOM 635 CA THR A 42 -8.625 1.379 0.214 1.00 0.00 C ATOM 636 C THR A 42 -9.463 2.646 0.091 1.00 0.00 C ATOM 637 O THR A 42 -9.684 3.152 -1.009 1.00 0.00 O ATOM 638 CB THR A 42 -7.372 1.685 1.055 1.00 0.00 C ATOM 639 OG1 THR A 42 -6.527 2.607 0.357 1.00 0.00 O ATOM 640 CG2 THR A 42 -6.599 0.411 1.360 1.00 0.00 C ATOM 0 H THR A 42 -7.448 1.290 -1.518 1.00 0.00 H new ATOM 0 HA THR A 42 -9.210 0.608 0.715 1.00 0.00 H new ATOM 0 HB THR A 42 -7.694 2.129 1.997 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.425 3.424 0.889 1.00 0.00 H new ATOM 0 HG21 THR A 42 -5.718 0.653 1.955 1.00 0.00 H new ATOM 0 HG22 THR A 42 -7.236 -0.276 1.917 1.00 0.00 H new ATOM 0 HG23 THR A 42 -6.288 -0.058 0.427 1.00 0.00 H new ATOM 648 N LYS A 43 -9.928 3.155 1.227 1.00 0.00 N ATOM 649 CA LYS A 43 -10.741 4.365 1.247 1.00 0.00 C ATOM 650 C LYS A 43 -9.916 5.582 0.841 1.00 0.00 C ATOM 651 O LYS A 43 -8.894 5.886 1.457 1.00 0.00 O ATOM 652 CB LYS A 43 -11.336 4.581 2.641 1.00 0.00 C ATOM 653 CG LYS A 43 -10.360 5.194 3.630 1.00 0.00 C ATOM 654 CD LYS A 43 -10.959 5.279 5.024 1.00 0.00 C ATOM 655 CE LYS A 43 -10.658 4.029 5.837 1.00 0.00 C ATOM 656 NZ LYS A 43 -11.660 3.816 6.918 1.00 0.00 N ATOM 0 H LYS A 43 -9.755 2.748 2.146 1.00 0.00 H new ATOM 0 HA LYS A 43 -11.551 4.241 0.528 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -12.210 5.227 2.558 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -11.683 3.624 3.031 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -9.448 4.597 3.660 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -10.077 6.191 3.293 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -10.562 6.154 5.539 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -12.038 5.415 4.950 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -10.645 3.161 5.178 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -9.663 4.111 6.275 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -11.420 2.955 7.449 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -11.655 4.633 7.562 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -12.606 3.712 6.499 1.00 0.00 H new ATOM 670 N LYS A 44 -10.366 6.276 -0.199 1.00 0.00 N ATOM 671 CA LYS A 44 -9.671 7.462 -0.686 1.00 0.00 C ATOM 672 C LYS A 44 -9.646 8.554 0.378 1.00 0.00 C ATOM 673 O LYS A 44 -10.689 8.953 0.897 1.00 0.00 O ATOM 674 CB LYS A 44 -10.346 7.987 -1.955 1.00 0.00 C ATOM 675 CG LYS A 44 -11.537 8.888 -1.682 1.00 0.00 C ATOM 676 CD LYS A 44 -12.189 9.358 -2.972 1.00 0.00 C ATOM 677 CE LYS A 44 -13.477 10.119 -2.701 1.00 0.00 C ATOM 678 NZ LYS A 44 -14.605 9.203 -2.374 1.00 0.00 N ATOM 0 H LYS A 44 -11.209 6.037 -0.721 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.643 7.182 -0.917 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.613 8.537 -2.545 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.672 7.141 -2.560 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -12.269 8.352 -1.078 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -11.215 9.752 -1.100 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -11.496 9.997 -3.519 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -12.400 8.499 -3.608 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -13.322 10.813 -1.875 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -13.736 10.717 -3.575 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -15.465 9.761 -2.196 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -14.770 8.557 -3.172 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -14.369 8.651 -1.525 1.00 0.00 H new ATOM 692 N VAL A 45 -8.449 9.034 0.699 1.00 0.00 N ATOM 693 CA VAL A 45 -8.288 10.082 1.699 1.00 0.00 C ATOM 694 C VAL A 45 -8.382 11.466 1.066 1.00 0.00 C ATOM 695 O VAL A 45 -7.685 11.764 0.096 1.00 0.00 O ATOM 696 CB VAL A 45 -6.940 9.956 2.434 1.00 0.00 C ATOM 697 CG1 VAL A 45 -6.751 11.110 3.406 1.00 0.00 C ATOM 698 CG2 VAL A 45 -6.851 8.620 3.155 1.00 0.00 C ATOM 0 H VAL A 45 -7.576 8.713 0.280 1.00 0.00 H new ATOM 0 HA VAL A 45 -9.098 9.959 2.418 1.00 0.00 H new ATOM 0 HB VAL A 45 -6.138 10.000 1.697 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -5.793 11.003 3.916 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -6.768 12.053 2.859 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -7.556 11.102 4.141 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -5.893 8.547 3.669 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -7.659 8.544 3.882 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -6.937 7.810 2.431 1.00 0.00 H new ATOM 708 N ASP A 46 -9.247 12.307 1.621 1.00 0.00 N ATOM 709 CA ASP A 46 -9.431 13.661 1.112 1.00 0.00 C ATOM 710 C ASP A 46 -8.086 14.323 0.830 1.00 0.00 C ATOM 711 O ASP A 46 -7.041 13.831 1.253 1.00 0.00 O ATOM 712 CB ASP A 46 -10.228 14.501 2.112 1.00 0.00 C ATOM 713 CG ASP A 46 -9.394 14.927 3.304 1.00 0.00 C ATOM 714 OD1 ASP A 46 -8.508 15.791 3.130 1.00 0.00 O ATOM 715 OD2 ASP A 46 -9.625 14.397 4.411 1.00 0.00 O ATOM 0 H ASP A 46 -9.832 12.075 2.424 1.00 0.00 H new ATOM 0 HA ASP A 46 -9.988 13.599 0.177 1.00 0.00 H new ATOM 0 HB2 ASP A 46 -10.617 15.386 1.609 1.00 0.00 H new ATOM 0 HB3 ASP A 46 -11.088 13.928 2.460 1.00 0.00 H new ATOM 720 N ASN A 47 -8.121 15.442 0.113 1.00 0.00 N ATOM 721 CA ASN A 47 -6.905 16.170 -0.227 1.00 0.00 C ATOM 722 C ASN A 47 -5.881 16.076 0.900 1.00 0.00 C ATOM 723 O ASN A 47 -6.006 16.750 1.922 1.00 0.00 O ATOM 724 CB ASN A 47 -7.228 17.638 -0.516 1.00 0.00 C ATOM 725 CG ASN A 47 -7.662 18.390 0.727 1.00 0.00 C ATOM 726 OD1 ASN A 47 -6.848 19.028 1.396 1.00 0.00 O ATOM 727 ND2 ASN A 47 -8.950 18.318 1.043 1.00 0.00 N ATOM 0 H ASN A 47 -8.979 15.864 -0.243 1.00 0.00 H new ATOM 0 HA ASN A 47 -6.478 15.716 -1.121 1.00 0.00 H new ATOM 0 HB2 ASN A 47 -6.350 18.123 -0.943 1.00 0.00 H new ATOM 0 HB3 ASN A 47 -8.018 17.693 -1.265 1.00 0.00 H new ATOM 0 HD21 ASN A 47 -9.300 18.803 1.869 1.00 0.00 H new ATOM 0 HD22 ASN A 47 -9.589 17.778 0.460 1.00 0.00 H new ATOM 734 N GLU A 48 -4.869 15.236 0.705 1.00 0.00 N ATOM 735 CA GLU A 48 -3.825 15.054 1.706 1.00 0.00 C ATOM 736 C GLU A 48 -2.611 14.352 1.104 1.00 0.00 C ATOM 737 O GLU A 48 -2.748 13.421 0.309 1.00 0.00 O ATOM 738 CB GLU A 48 -4.358 14.247 2.891 1.00 0.00 C ATOM 739 CG GLU A 48 -3.286 13.857 3.894 1.00 0.00 C ATOM 740 CD GLU A 48 -2.585 15.059 4.496 1.00 0.00 C ATOM 741 OE1 GLU A 48 -3.258 16.086 4.724 1.00 0.00 O ATOM 742 OE2 GLU A 48 -1.362 14.973 4.738 1.00 0.00 O ATOM 0 H GLU A 48 -4.750 14.672 -0.136 1.00 0.00 H new ATOM 0 HA GLU A 48 -3.518 16.039 2.056 1.00 0.00 H new ATOM 0 HB2 GLU A 48 -5.125 14.830 3.401 1.00 0.00 H new ATOM 0 HB3 GLU A 48 -4.840 13.343 2.517 1.00 0.00 H new ATOM 0 HG2 GLU A 48 -3.738 13.267 4.692 1.00 0.00 H new ATOM 0 HG3 GLU A 48 -2.550 13.220 3.404 1.00 0.00 H new ATOM 749 N LEU A 49 -1.422 14.806 1.487 1.00 0.00 N ATOM 750 CA LEU A 49 -0.183 14.223 0.985 1.00 0.00 C ATOM 751 C LEU A 49 0.136 12.918 1.706 1.00 0.00 C ATOM 752 O LEU A 49 0.492 11.921 1.079 1.00 0.00 O ATOM 753 CB LEU A 49 0.974 15.210 1.157 1.00 0.00 C ATOM 754 CG LEU A 49 1.257 16.125 -0.035 1.00 0.00 C ATOM 755 CD1 LEU A 49 -0.043 16.616 -0.653 1.00 0.00 C ATOM 756 CD2 LEU A 49 2.125 17.301 0.391 1.00 0.00 C ATOM 0 H LEU A 49 -1.290 15.576 2.143 1.00 0.00 H new ATOM 0 HA LEU A 49 -0.315 14.008 -0.075 1.00 0.00 H new ATOM 0 HB2 LEU A 49 0.768 15.833 2.027 1.00 0.00 H new ATOM 0 HB3 LEU A 49 1.879 14.644 1.378 1.00 0.00 H new ATOM 0 HG LEU A 49 1.799 15.552 -0.788 1.00 0.00 H new ATOM 0 HD11 LEU A 49 0.179 17.266 -1.500 1.00 0.00 H new ATOM 0 HD12 LEU A 49 -0.629 15.762 -0.994 1.00 0.00 H new ATOM 0 HD13 LEU A 49 -0.612 17.172 0.092 1.00 0.00 H new ATOM 0 HD21 LEU A 49 2.317 17.942 -0.469 1.00 0.00 H new ATOM 0 HD22 LEU A 49 1.609 17.873 1.162 1.00 0.00 H new ATOM 0 HD23 LEU A 49 3.071 16.931 0.786 1.00 0.00 H new ATOM 768 N ASN A 50 0.003 12.930 3.029 1.00 0.00 N ATOM 769 CA ASN A 50 0.275 11.747 3.836 1.00 0.00 C ATOM 770 C ASN A 50 -1.020 11.136 4.361 1.00 0.00 C ATOM 771 O ASN A 50 -1.421 11.357 5.504 1.00 0.00 O ATOM 772 CB ASN A 50 1.196 12.102 5.005 1.00 0.00 C ATOM 773 CG ASN A 50 2.473 12.781 4.550 1.00 0.00 C ATOM 774 OD1 ASN A 50 2.865 12.677 3.388 1.00 0.00 O ATOM 775 ND2 ASN A 50 3.129 13.482 5.468 1.00 0.00 N ATOM 0 H ASN A 50 -0.292 13.747 3.564 1.00 0.00 H new ATOM 0 HA ASN A 50 0.771 11.012 3.202 1.00 0.00 H new ATOM 0 HB2 ASN A 50 0.666 12.758 5.696 1.00 0.00 H new ATOM 0 HB3 ASN A 50 1.446 11.195 5.555 1.00 0.00 H new ATOM 0 HD21 ASN A 50 3.995 13.961 5.221 1.00 0.00 H new ATOM 0 HD22 ASN A 50 2.767 13.541 6.420 1.00 0.00 H new ATOM 782 N PRO A 51 -1.692 10.349 3.507 1.00 0.00 N ATOM 783 CA PRO A 51 -2.952 9.690 3.863 1.00 0.00 C ATOM 784 C PRO A 51 -2.755 8.577 4.887 1.00 0.00 C ATOM 785 O PRO A 51 -1.648 8.067 5.059 1.00 0.00 O ATOM 786 CB PRO A 51 -3.438 9.111 2.532 1.00 0.00 C ATOM 787 CG PRO A 51 -2.199 8.929 1.723 1.00 0.00 C ATOM 788 CD PRO A 51 -1.273 10.042 2.129 1.00 0.00 C ATOM 0 HA PRO A 51 -3.656 10.381 4.326 1.00 0.00 H new ATOM 0 HB2 PRO A 51 -3.958 8.164 2.678 1.00 0.00 H new ATOM 0 HB3 PRO A 51 -4.137 9.786 2.039 1.00 0.00 H new ATOM 0 HG2 PRO A 51 -1.747 7.956 1.915 1.00 0.00 H new ATOM 0 HG3 PRO A 51 -2.419 8.974 0.656 1.00 0.00 H new ATOM 0 HD2 PRO A 51 -0.229 9.732 2.086 1.00 0.00 H new ATOM 0 HD3 PRO A 51 -1.375 10.908 1.475 1.00 0.00 H new ATOM 796 N VAL A 52 -3.836 8.205 5.565 1.00 0.00 N ATOM 797 CA VAL A 52 -3.782 7.152 6.572 1.00 0.00 C ATOM 798 C VAL A 52 -4.990 6.227 6.466 1.00 0.00 C ATOM 799 O VAL A 52 -6.112 6.618 6.787 1.00 0.00 O ATOM 800 CB VAL A 52 -3.721 7.737 7.995 1.00 0.00 C ATOM 801 CG1 VAL A 52 -3.959 6.649 9.031 1.00 0.00 C ATOM 802 CG2 VAL A 52 -2.385 8.426 8.231 1.00 0.00 C ATOM 0 H VAL A 52 -4.760 8.617 5.435 1.00 0.00 H new ATOM 0 HA VAL A 52 -2.873 6.581 6.383 1.00 0.00 H new ATOM 0 HB VAL A 52 -4.511 8.481 8.097 1.00 0.00 H new ATOM 0 HG11 VAL A 52 -3.912 7.082 10.030 1.00 0.00 H new ATOM 0 HG12 VAL A 52 -4.942 6.205 8.873 1.00 0.00 H new ATOM 0 HG13 VAL A 52 -3.194 5.879 8.933 1.00 0.00 H new ATOM 0 HG21 VAL A 52 -2.359 8.834 9.242 1.00 0.00 H new ATOM 0 HG22 VAL A 52 -1.577 7.704 8.110 1.00 0.00 H new ATOM 0 HG23 VAL A 52 -2.260 9.234 7.511 1.00 0.00 H new ATOM 812 N TRP A 53 -4.751 5.002 6.014 1.00 0.00 N ATOM 813 CA TRP A 53 -5.821 4.021 5.866 1.00 0.00 C ATOM 814 C TRP A 53 -5.839 3.053 7.044 1.00 0.00 C ATOM 815 O TRP A 53 -6.874 2.851 7.676 1.00 0.00 O ATOM 816 CB TRP A 53 -5.653 3.247 4.557 1.00 0.00 C ATOM 817 CG TRP A 53 -5.567 4.133 3.350 1.00 0.00 C ATOM 818 CD1 TRP A 53 -6.611 4.640 2.630 1.00 0.00 C ATOM 819 CD2 TRP A 53 -4.373 4.612 2.723 1.00 0.00 C ATOM 820 NE1 TRP A 53 -6.137 5.407 1.593 1.00 0.00 N ATOM 821 CE2 TRP A 53 -4.768 5.406 1.628 1.00 0.00 C ATOM 822 CE3 TRP A 53 -3.009 4.450 2.980 1.00 0.00 C ATOM 823 CZ2 TRP A 53 -3.847 6.034 0.794 1.00 0.00 C ATOM 824 CZ3 TRP A 53 -2.096 5.073 2.151 1.00 0.00 C ATOM 825 CH2 TRP A 53 -2.518 5.858 1.069 1.00 0.00 C ATOM 0 H TRP A 53 -3.827 4.664 5.744 1.00 0.00 H new ATOM 0 HA TRP A 53 -6.770 4.556 5.845 1.00 0.00 H new ATOM 0 HB2 TRP A 53 -4.751 2.638 4.617 1.00 0.00 H new ATOM 0 HB3 TRP A 53 -6.493 2.563 4.437 1.00 0.00 H new ATOM 0 HD1 TRP A 53 -7.655 4.464 2.844 1.00 0.00 H new ATOM 0 HE1 TRP A 53 -6.712 5.898 0.908 1.00 0.00 H new ATOM 0 HE3 TRP A 53 -2.674 3.848 3.812 1.00 0.00 H new ATOM 0 HZ2 TRP A 53 -4.170 6.639 -0.041 1.00 0.00 H new ATOM 0 HZ3 TRP A 53 -1.039 4.953 2.340 1.00 0.00 H new ATOM 0 HH2 TRP A 53 -1.780 6.333 0.440 1.00 0.00 H new ATOM 836 N ASN A 54 -4.686 2.458 7.333 1.00 0.00 N ATOM 837 CA ASN A 54 -4.571 1.510 8.435 1.00 0.00 C ATOM 838 C ASN A 54 -5.672 0.456 8.364 1.00 0.00 C ATOM 839 O ASN A 54 -6.331 0.166 9.362 1.00 0.00 O ATOM 840 CB ASN A 54 -4.639 2.245 9.776 1.00 0.00 C ATOM 841 CG ASN A 54 -3.338 2.945 10.118 1.00 0.00 C ATOM 842 OD1 ASN A 54 -2.268 2.553 9.652 1.00 0.00 O ATOM 843 ND2 ASN A 54 -3.423 3.986 10.938 1.00 0.00 N ATOM 0 H ASN A 54 -3.819 2.616 6.820 1.00 0.00 H new ATOM 0 HA ASN A 54 -3.607 1.008 8.351 1.00 0.00 H new ATOM 0 HB2 ASN A 54 -5.445 2.978 9.745 1.00 0.00 H new ATOM 0 HB3 ASN A 54 -4.884 1.534 10.565 1.00 0.00 H new ATOM 0 HD21 ASN A 54 -2.580 4.495 11.205 1.00 0.00 H new ATOM 0 HD22 ASN A 54 -4.331 4.277 11.301 1.00 0.00 H new ATOM 850 N GLU A 55 -5.862 -0.114 7.179 1.00 0.00 N ATOM 851 CA GLU A 55 -6.883 -1.135 6.978 1.00 0.00 C ATOM 852 C GLU A 55 -6.247 -2.482 6.647 1.00 0.00 C ATOM 853 O GLU A 55 -5.026 -2.592 6.531 1.00 0.00 O ATOM 854 CB GLU A 55 -7.838 -0.721 5.857 1.00 0.00 C ATOM 855 CG GLU A 55 -7.274 -0.943 4.464 1.00 0.00 C ATOM 856 CD GLU A 55 -5.789 -0.650 4.382 1.00 0.00 C ATOM 857 OE1 GLU A 55 -5.397 0.507 4.637 1.00 0.00 O ATOM 858 OE2 GLU A 55 -5.018 -1.580 4.062 1.00 0.00 O ATOM 0 H GLU A 55 -5.323 0.114 6.344 1.00 0.00 H new ATOM 0 HA GLU A 55 -7.446 -1.236 7.906 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -8.767 -1.282 5.957 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -8.088 0.333 5.975 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -7.454 -1.975 4.164 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -7.805 -0.308 3.755 1.00 0.00 H new ATOM 865 N ILE A 56 -7.083 -3.504 6.496 1.00 0.00 N ATOM 866 CA ILE A 56 -6.603 -4.843 6.178 1.00 0.00 C ATOM 867 C ILE A 56 -7.354 -5.427 4.987 1.00 0.00 C ATOM 868 O ILE A 56 -8.577 -5.313 4.893 1.00 0.00 O ATOM 869 CB ILE A 56 -6.750 -5.794 7.380 1.00 0.00 C ATOM 870 CG1 ILE A 56 -6.157 -5.156 8.639 1.00 0.00 C ATOM 871 CG2 ILE A 56 -6.076 -7.126 7.087 1.00 0.00 C ATOM 872 CD1 ILE A 56 -6.643 -5.790 9.923 1.00 0.00 C ATOM 0 H ILE A 56 -8.096 -3.430 6.589 1.00 0.00 H new ATOM 0 HA ILE A 56 -5.546 -4.748 5.928 1.00 0.00 H new ATOM 0 HB ILE A 56 -7.811 -5.976 7.553 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -5.070 -5.229 8.596 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -6.405 -4.095 8.650 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -6.188 -7.787 7.946 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -6.540 -7.584 6.213 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -5.016 -6.962 6.891 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -6.182 -5.288 10.774 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -7.727 -5.694 9.989 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -6.371 -6.845 9.933 1.00 0.00 H new ATOM 884 N LEU A 57 -6.615 -6.055 4.079 1.00 0.00 N ATOM 885 CA LEU A 57 -7.211 -6.661 2.893 1.00 0.00 C ATOM 886 C LEU A 57 -7.036 -8.176 2.908 1.00 0.00 C ATOM 887 O LEU A 57 -6.188 -8.704 3.627 1.00 0.00 O ATOM 888 CB LEU A 57 -6.583 -6.076 1.627 1.00 0.00 C ATOM 889 CG LEU A 57 -6.393 -4.558 1.612 1.00 0.00 C ATOM 890 CD1 LEU A 57 -5.268 -4.171 0.664 1.00 0.00 C ATOM 891 CD2 LEU A 57 -7.688 -3.862 1.218 1.00 0.00 C ATOM 0 H LEU A 57 -5.602 -6.158 4.141 1.00 0.00 H new ATOM 0 HA LEU A 57 -8.278 -6.438 2.899 1.00 0.00 H new ATOM 0 HB2 LEU A 57 -5.611 -6.545 1.477 1.00 0.00 H new ATOM 0 HB3 LEU A 57 -7.205 -6.353 0.776 1.00 0.00 H new ATOM 0 HG LEU A 57 -6.122 -4.235 2.617 1.00 0.00 H new ATOM 0 HD11 LEU A 57 -5.147 -3.088 0.666 1.00 0.00 H new ATOM 0 HD12 LEU A 57 -4.340 -4.640 0.990 1.00 0.00 H new ATOM 0 HD13 LEU A 57 -5.510 -4.507 -0.344 1.00 0.00 H new ATOM 0 HD21 LEU A 57 -7.534 -2.783 1.213 1.00 0.00 H new ATOM 0 HD22 LEU A 57 -7.990 -4.190 0.223 1.00 0.00 H new ATOM 0 HD23 LEU A 57 -8.469 -4.113 1.935 1.00 0.00 H new ATOM 903 N GLU A 58 -7.841 -8.868 2.109 1.00 0.00 N ATOM 904 CA GLU A 58 -7.773 -10.322 2.030 1.00 0.00 C ATOM 905 C GLU A 58 -8.098 -10.807 0.620 1.00 0.00 C ATOM 906 O GLU A 58 -9.048 -10.337 -0.006 1.00 0.00 O ATOM 907 CB GLU A 58 -8.738 -10.956 3.034 1.00 0.00 C ATOM 908 CG GLU A 58 -8.826 -10.204 4.352 1.00 0.00 C ATOM 909 CD GLU A 58 -10.103 -10.505 5.111 1.00 0.00 C ATOM 910 OE1 GLU A 58 -10.336 -11.688 5.436 1.00 0.00 O ATOM 911 OE2 GLU A 58 -10.870 -9.556 5.382 1.00 0.00 O ATOM 0 H GLU A 58 -8.548 -8.445 1.507 1.00 0.00 H new ATOM 0 HA GLU A 58 -6.755 -10.625 2.274 1.00 0.00 H new ATOM 0 HB2 GLU A 58 -9.731 -11.008 2.588 1.00 0.00 H new ATOM 0 HB3 GLU A 58 -8.423 -11.981 3.230 1.00 0.00 H new ATOM 0 HG2 GLU A 58 -7.969 -10.465 4.973 1.00 0.00 H new ATOM 0 HG3 GLU A 58 -8.766 -9.133 4.160 1.00 0.00 H new ATOM 918 N PHE A 59 -7.303 -11.750 0.126 1.00 0.00 N ATOM 919 CA PHE A 59 -7.504 -12.298 -1.210 1.00 0.00 C ATOM 920 C PHE A 59 -7.644 -13.816 -1.160 1.00 0.00 C ATOM 921 O PHE A 59 -6.840 -14.504 -0.530 1.00 0.00 O ATOM 922 CB PHE A 59 -6.339 -11.912 -2.123 1.00 0.00 C ATOM 923 CG PHE A 59 -6.306 -10.450 -2.469 1.00 0.00 C ATOM 924 CD1 PHE A 59 -7.073 -9.954 -3.511 1.00 0.00 C ATOM 925 CD2 PHE A 59 -5.510 -9.573 -1.750 1.00 0.00 C ATOM 926 CE1 PHE A 59 -7.044 -8.610 -3.831 1.00 0.00 C ATOM 927 CE2 PHE A 59 -5.478 -8.227 -2.066 1.00 0.00 C ATOM 928 CZ PHE A 59 -6.247 -7.745 -3.107 1.00 0.00 C ATOM 0 H PHE A 59 -6.513 -12.151 0.631 1.00 0.00 H new ATOM 0 HA PHE A 59 -8.426 -11.879 -1.612 1.00 0.00 H new ATOM 0 HB2 PHE A 59 -5.402 -12.183 -1.637 1.00 0.00 H new ATOM 0 HB3 PHE A 59 -6.401 -12.493 -3.043 1.00 0.00 H new ATOM 0 HD1 PHE A 59 -7.700 -10.625 -4.079 1.00 0.00 H new ATOM 0 HD2 PHE A 59 -4.908 -9.945 -0.934 1.00 0.00 H new ATOM 0 HE1 PHE A 59 -7.644 -8.236 -4.647 1.00 0.00 H new ATOM 0 HE2 PHE A 59 -4.852 -7.553 -1.499 1.00 0.00 H new ATOM 0 HZ PHE A 59 -6.225 -6.694 -3.354 1.00 0.00 H new ATOM 938 N ASP A 60 -8.670 -14.332 -1.827 1.00 0.00 N ATOM 939 CA ASP A 60 -8.917 -15.769 -1.860 1.00 0.00 C ATOM 940 C ASP A 60 -8.062 -16.443 -2.929 1.00 0.00 C ATOM 941 O ASP A 60 -8.042 -16.014 -4.084 1.00 0.00 O ATOM 942 CB ASP A 60 -10.398 -16.048 -2.122 1.00 0.00 C ATOM 943 CG ASP A 60 -10.856 -17.360 -1.514 1.00 0.00 C ATOM 944 OD1 ASP A 60 -10.193 -18.389 -1.759 1.00 0.00 O ATOM 945 OD2 ASP A 60 -11.877 -17.356 -0.795 1.00 0.00 O ATOM 0 H ASP A 60 -9.345 -13.776 -2.353 1.00 0.00 H new ATOM 0 HA ASP A 60 -8.644 -16.182 -0.889 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -10.996 -15.233 -1.714 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -10.577 -16.067 -3.197 1.00 0.00 H new ATOM 950 N LEU A 61 -7.358 -17.498 -2.538 1.00 0.00 N ATOM 951 CA LEU A 61 -6.500 -18.231 -3.463 1.00 0.00 C ATOM 952 C LEU A 61 -7.219 -19.457 -4.017 1.00 0.00 C ATOM 953 O LEU A 61 -6.955 -19.889 -5.139 1.00 0.00 O ATOM 954 CB LEU A 61 -5.208 -18.657 -2.762 1.00 0.00 C ATOM 955 CG LEU A 61 -4.466 -17.560 -1.998 1.00 0.00 C ATOM 956 CD1 LEU A 61 -3.271 -18.141 -1.258 1.00 0.00 C ATOM 957 CD2 LEU A 61 -4.025 -16.455 -2.945 1.00 0.00 C ATOM 0 H LEU A 61 -7.364 -17.866 -1.587 1.00 0.00 H new ATOM 0 HA LEU A 61 -6.255 -17.570 -4.294 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -5.444 -19.461 -2.065 1.00 0.00 H new ATOM 0 HB3 LEU A 61 -4.532 -19.072 -3.510 1.00 0.00 H new ATOM 0 HG LEU A 61 -5.147 -17.130 -1.264 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -2.755 -17.346 -0.720 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -3.613 -18.896 -0.550 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.587 -18.598 -1.973 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.499 -15.683 -2.383 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -3.360 -16.869 -3.703 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -4.900 -16.019 -3.428 1.00 0.00 H new ATOM 969 N ARG A 62 -8.131 -20.011 -3.224 1.00 0.00 N ATOM 970 CA ARG A 62 -8.889 -21.186 -3.636 1.00 0.00 C ATOM 971 C ARG A 62 -7.994 -22.421 -3.686 1.00 0.00 C ATOM 972 O ARG A 62 -8.126 -23.260 -4.575 1.00 0.00 O ATOM 973 CB ARG A 62 -9.529 -20.952 -5.005 1.00 0.00 C ATOM 974 CG ARG A 62 -10.212 -19.600 -5.136 1.00 0.00 C ATOM 975 CD ARG A 62 -10.293 -19.154 -6.587 1.00 0.00 C ATOM 976 NE ARG A 62 -11.046 -20.098 -7.408 1.00 0.00 N ATOM 977 CZ ARG A 62 -11.434 -19.843 -8.653 1.00 0.00 C ATOM 978 NH1 ARG A 62 -11.142 -18.679 -9.216 1.00 0.00 N ATOM 979 NH2 ARG A 62 -12.116 -20.753 -9.336 1.00 0.00 N ATOM 0 H ARG A 62 -8.363 -19.665 -2.293 1.00 0.00 H new ATOM 0 HA ARG A 62 -9.674 -21.357 -2.899 1.00 0.00 H new ATOM 0 HB2 ARG A 62 -8.762 -21.038 -5.775 1.00 0.00 H new ATOM 0 HB3 ARG A 62 -10.260 -21.738 -5.194 1.00 0.00 H new ATOM 0 HG2 ARG A 62 -11.216 -19.656 -4.715 1.00 0.00 H new ATOM 0 HG3 ARG A 62 -9.664 -18.857 -4.556 1.00 0.00 H new ATOM 0 HD2 ARG A 62 -10.764 -18.172 -6.639 1.00 0.00 H new ATOM 0 HD3 ARG A 62 -9.286 -19.046 -6.990 1.00 0.00 H new ATOM 0 HE ARG A 62 -11.287 -21.003 -7.004 1.00 0.00 H new ATOM 0 HH11 ARG A 62 -10.618 -17.977 -8.693 1.00 0.00 H new ATOM 0 HH12 ARG A 62 -11.441 -18.486 -10.172 1.00 0.00 H new ATOM 0 HH21 ARG A 62 -12.343 -21.649 -8.906 1.00 0.00 H new ATOM 0 HH22 ARG A 62 -12.413 -20.556 -10.292 1.00 0.00 H new ATOM 993 N GLY A 63 -7.082 -22.523 -2.724 1.00 0.00 N ATOM 994 CA GLY A 63 -6.178 -23.658 -2.677 1.00 0.00 C ATOM 995 C GLY A 63 -4.949 -23.457 -3.542 1.00 0.00 C ATOM 996 O GLY A 63 -4.052 -24.300 -3.563 1.00 0.00 O ATOM 0 H GLY A 63 -6.953 -21.841 -1.977 1.00 0.00 H new ATOM 0 HA2 GLY A 63 -5.869 -23.830 -1.646 1.00 0.00 H new ATOM 0 HA3 GLY A 63 -6.707 -24.553 -3.005 1.00 0.00 H new ATOM 1000 N ILE A 64 -4.910 -22.339 -4.259 1.00 0.00 N ATOM 1001 CA ILE A 64 -3.783 -22.031 -5.131 1.00 0.00 C ATOM 1002 C ILE A 64 -2.640 -21.394 -4.347 1.00 0.00 C ATOM 1003 O ILE A 64 -2.734 -20.262 -3.873 1.00 0.00 O ATOM 1004 CB ILE A 64 -4.197 -21.085 -6.273 1.00 0.00 C ATOM 1005 CG1 ILE A 64 -5.308 -21.719 -7.113 1.00 0.00 C ATOM 1006 CG2 ILE A 64 -2.995 -20.747 -7.143 1.00 0.00 C ATOM 1007 CD1 ILE A 64 -4.813 -22.790 -8.059 1.00 0.00 C ATOM 0 H ILE A 64 -5.645 -21.632 -4.253 1.00 0.00 H new ATOM 0 HA ILE A 64 -3.446 -22.976 -5.557 1.00 0.00 H new ATOM 0 HB ILE A 64 -4.578 -20.161 -5.839 1.00 0.00 H new ATOM 0 HG12 ILE A 64 -6.055 -22.151 -6.447 1.00 0.00 H new ATOM 0 HG13 ILE A 64 -5.807 -20.939 -7.689 1.00 0.00 H new ATOM 0 HG21 ILE A 64 -3.304 -20.078 -7.946 1.00 0.00 H new ATOM 0 HG22 ILE A 64 -2.233 -20.259 -6.536 1.00 0.00 H new ATOM 0 HG23 ILE A 64 -2.587 -21.663 -7.571 1.00 0.00 H new ATOM 0 HD11 ILE A 64 -5.654 -23.195 -8.622 1.00 0.00 H new ATOM 0 HD12 ILE A 64 -4.088 -22.359 -8.749 1.00 0.00 H new ATOM 0 HD13 ILE A 64 -4.340 -23.589 -7.488 1.00 0.00 H new ATOM 1019 N PRO A 65 -1.531 -22.137 -4.209 1.00 0.00 N ATOM 1020 CA PRO A 65 -0.347 -21.665 -3.485 1.00 0.00 C ATOM 1021 C PRO A 65 0.377 -20.546 -4.227 1.00 0.00 C ATOM 1022 O PRO A 65 -0.042 -20.132 -5.309 1.00 0.00 O ATOM 1023 CB PRO A 65 0.538 -22.911 -3.401 1.00 0.00 C ATOM 1024 CG PRO A 65 0.121 -23.750 -4.559 1.00 0.00 C ATOM 1025 CD PRO A 65 -1.349 -23.495 -4.748 1.00 0.00 C ATOM 0 HA PRO A 65 -0.604 -21.243 -2.514 1.00 0.00 H new ATOM 0 HB2 PRO A 65 1.595 -22.651 -3.461 1.00 0.00 H new ATOM 0 HB3 PRO A 65 0.392 -23.437 -2.458 1.00 0.00 H new ATOM 0 HG2 PRO A 65 0.681 -23.484 -5.455 1.00 0.00 H new ATOM 0 HG3 PRO A 65 0.312 -24.805 -4.365 1.00 0.00 H new ATOM 0 HD2 PRO A 65 -1.635 -23.552 -5.798 1.00 0.00 H new ATOM 0 HD3 PRO A 65 -1.956 -24.225 -4.212 1.00 0.00 H new ATOM 1033 N LEU A 66 1.465 -20.062 -3.639 1.00 0.00 N ATOM 1034 CA LEU A 66 2.249 -18.990 -4.245 1.00 0.00 C ATOM 1035 C LEU A 66 3.483 -19.548 -4.947 1.00 0.00 C ATOM 1036 O LEU A 66 3.923 -20.662 -4.659 1.00 0.00 O ATOM 1037 CB LEU A 66 2.669 -17.975 -3.181 1.00 0.00 C ATOM 1038 CG LEU A 66 1.538 -17.179 -2.529 1.00 0.00 C ATOM 1039 CD1 LEU A 66 2.090 -16.229 -1.478 1.00 0.00 C ATOM 1040 CD2 LEU A 66 0.749 -16.413 -3.581 1.00 0.00 C ATOM 0 H LEU A 66 1.825 -20.394 -2.744 1.00 0.00 H new ATOM 0 HA LEU A 66 1.625 -18.492 -4.987 1.00 0.00 H new ATOM 0 HB2 LEU A 66 3.213 -18.504 -2.398 1.00 0.00 H new ATOM 0 HB3 LEU A 66 3.367 -17.271 -3.634 1.00 0.00 H new ATOM 0 HG LEU A 66 0.864 -17.880 -2.037 1.00 0.00 H new ATOM 0 HD11 LEU A 66 1.270 -15.671 -1.025 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.609 -16.800 -0.708 1.00 0.00 H new ATOM 0 HD13 LEU A 66 2.787 -15.534 -1.946 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -0.052 -15.852 -3.099 1.00 0.00 H new ATOM 0 HD22 LEU A 66 1.412 -15.723 -4.102 1.00 0.00 H new ATOM 0 HD23 LEU A 66 0.320 -17.115 -4.297 1.00 0.00 H new ATOM 1052 N ASP A 67 4.038 -18.767 -5.866 1.00 0.00 N ATOM 1053 CA ASP A 67 5.224 -19.181 -6.607 1.00 0.00 C ATOM 1054 C ASP A 67 6.209 -18.025 -6.748 1.00 0.00 C ATOM 1055 O ASP A 67 5.884 -16.878 -6.440 1.00 0.00 O ATOM 1056 CB ASP A 67 4.831 -19.703 -7.990 1.00 0.00 C ATOM 1057 CG ASP A 67 5.967 -20.435 -8.677 1.00 0.00 C ATOM 1058 OD1 ASP A 67 6.540 -21.357 -8.059 1.00 0.00 O ATOM 1059 OD2 ASP A 67 6.284 -20.087 -9.834 1.00 0.00 O ATOM 0 H ASP A 67 3.686 -17.843 -6.116 1.00 0.00 H new ATOM 0 HA ASP A 67 5.709 -19.982 -6.049 1.00 0.00 H new ATOM 0 HB2 ASP A 67 3.977 -20.373 -7.893 1.00 0.00 H new ATOM 0 HB3 ASP A 67 4.511 -18.868 -8.613 1.00 0.00 H new ATOM 1064 N PHE A 68 7.414 -18.334 -7.213 1.00 0.00 N ATOM 1065 CA PHE A 68 8.448 -17.321 -7.392 1.00 0.00 C ATOM 1066 C PHE A 68 7.985 -16.238 -8.363 1.00 0.00 C ATOM 1067 O PHE A 68 8.563 -15.152 -8.420 1.00 0.00 O ATOM 1068 CB PHE A 68 9.738 -17.963 -7.905 1.00 0.00 C ATOM 1069 CG PHE A 68 10.372 -18.904 -6.921 1.00 0.00 C ATOM 1070 CD1 PHE A 68 10.745 -18.463 -5.661 1.00 0.00 C ATOM 1071 CD2 PHE A 68 10.596 -20.230 -7.255 1.00 0.00 C ATOM 1072 CE1 PHE A 68 11.328 -19.326 -4.753 1.00 0.00 C ATOM 1073 CE2 PHE A 68 11.178 -21.098 -6.350 1.00 0.00 C ATOM 1074 CZ PHE A 68 11.545 -20.645 -5.098 1.00 0.00 C ATOM 0 H PHE A 68 7.699 -19.278 -7.473 1.00 0.00 H new ATOM 0 HA PHE A 68 8.641 -16.859 -6.424 1.00 0.00 H new ATOM 0 HB2 PHE A 68 9.523 -18.504 -8.827 1.00 0.00 H new ATOM 0 HB3 PHE A 68 10.451 -17.177 -8.155 1.00 0.00 H new ATOM 0 HD1 PHE A 68 10.578 -17.432 -5.386 1.00 0.00 H new ATOM 0 HD2 PHE A 68 10.313 -20.589 -8.233 1.00 0.00 H new ATOM 0 HE1 PHE A 68 11.614 -18.969 -3.775 1.00 0.00 H new ATOM 0 HE2 PHE A 68 11.346 -22.130 -6.622 1.00 0.00 H new ATOM 0 HZ PHE A 68 12.001 -21.321 -4.390 1.00 0.00 H new ATOM 1084 N SER A 69 6.939 -16.542 -9.124 1.00 0.00 N ATOM 1085 CA SER A 69 6.401 -15.597 -10.096 1.00 0.00 C ATOM 1086 C SER A 69 5.367 -14.681 -9.447 1.00 0.00 C ATOM 1087 O SER A 69 5.205 -13.528 -9.847 1.00 0.00 O ATOM 1088 CB SER A 69 5.770 -16.345 -11.271 1.00 0.00 C ATOM 1089 OG SER A 69 5.664 -15.509 -12.410 1.00 0.00 O ATOM 0 H SER A 69 6.447 -17.435 -9.087 1.00 0.00 H new ATOM 0 HA SER A 69 7.224 -14.985 -10.465 1.00 0.00 H new ATOM 0 HB2 SER A 69 6.372 -17.221 -11.514 1.00 0.00 H new ATOM 0 HB3 SER A 69 4.781 -16.706 -10.988 1.00 0.00 H new ATOM 0 HG SER A 69 5.259 -16.011 -13.148 1.00 0.00 H new ATOM 1095 N SER A 70 4.670 -15.203 -8.443 1.00 0.00 N ATOM 1096 CA SER A 70 3.649 -14.435 -7.741 1.00 0.00 C ATOM 1097 C SER A 70 4.180 -13.062 -7.342 1.00 0.00 C ATOM 1098 O SER A 70 5.374 -12.895 -7.090 1.00 0.00 O ATOM 1099 CB SER A 70 3.175 -15.192 -6.499 1.00 0.00 C ATOM 1100 OG SER A 70 4.207 -15.281 -5.532 1.00 0.00 O ATOM 0 H SER A 70 4.794 -16.155 -8.098 1.00 0.00 H new ATOM 0 HA SER A 70 2.805 -14.296 -8.417 1.00 0.00 H new ATOM 0 HB2 SER A 70 2.311 -14.686 -6.068 1.00 0.00 H new ATOM 0 HB3 SER A 70 2.850 -16.193 -6.781 1.00 0.00 H new ATOM 0 HG SER A 70 5.058 -15.474 -5.978 1.00 0.00 H new ATOM 1106 N SER A 71 3.285 -12.081 -7.286 1.00 0.00 N ATOM 1107 CA SER A 71 3.663 -10.721 -6.921 1.00 0.00 C ATOM 1108 C SER A 71 2.429 -9.838 -6.761 1.00 0.00 C ATOM 1109 O SER A 71 1.384 -10.098 -7.357 1.00 0.00 O ATOM 1110 CB SER A 71 4.595 -10.127 -7.979 1.00 0.00 C ATOM 1111 OG SER A 71 4.081 -10.331 -9.284 1.00 0.00 O ATOM 0 H SER A 71 2.293 -12.203 -7.489 1.00 0.00 H new ATOM 0 HA SER A 71 4.187 -10.760 -5.966 1.00 0.00 H new ATOM 0 HB2 SER A 71 4.723 -9.060 -7.798 1.00 0.00 H new ATOM 0 HB3 SER A 71 5.581 -10.584 -7.898 1.00 0.00 H new ATOM 0 HG SER A 71 4.694 -9.941 -9.942 1.00 0.00 H new ATOM 1117 N LEU A 72 2.558 -8.794 -5.950 1.00 0.00 N ATOM 1118 CA LEU A 72 1.454 -7.871 -5.710 1.00 0.00 C ATOM 1119 C LEU A 72 1.677 -6.552 -6.443 1.00 0.00 C ATOM 1120 O LEU A 72 2.790 -6.028 -6.474 1.00 0.00 O ATOM 1121 CB LEU A 72 1.296 -7.614 -4.210 1.00 0.00 C ATOM 1122 CG LEU A 72 -0.009 -6.944 -3.778 1.00 0.00 C ATOM 1123 CD1 LEU A 72 -1.085 -7.988 -3.521 1.00 0.00 C ATOM 1124 CD2 LEU A 72 0.215 -6.089 -2.539 1.00 0.00 C ATOM 0 H LEU A 72 3.416 -8.565 -5.448 1.00 0.00 H new ATOM 0 HA LEU A 72 0.541 -8.328 -6.093 1.00 0.00 H new ATOM 0 HB2 LEU A 72 1.382 -8.567 -3.687 1.00 0.00 H new ATOM 0 HB3 LEU A 72 2.128 -6.992 -3.879 1.00 0.00 H new ATOM 0 HG LEU A 72 -0.347 -6.295 -4.586 1.00 0.00 H new ATOM 0 HD11 LEU A 72 -2.006 -7.493 -3.215 1.00 0.00 H new ATOM 0 HD12 LEU A 72 -1.265 -8.557 -4.433 1.00 0.00 H new ATOM 0 HD13 LEU A 72 -0.756 -8.663 -2.731 1.00 0.00 H new ATOM 0 HD21 LEU A 72 -0.724 -5.620 -2.246 1.00 0.00 H new ATOM 0 HD22 LEU A 72 0.577 -6.716 -1.724 1.00 0.00 H new ATOM 0 HD23 LEU A 72 0.953 -5.317 -2.758 1.00 0.00 H new ATOM 1136 N GLY A 73 0.610 -6.019 -7.030 1.00 0.00 N ATOM 1137 CA GLY A 73 0.710 -4.765 -7.753 1.00 0.00 C ATOM 1138 C GLY A 73 0.102 -3.605 -6.989 1.00 0.00 C ATOM 1139 O GLY A 73 -1.109 -3.563 -6.772 1.00 0.00 O ATOM 0 H GLY A 73 -0.322 -6.433 -7.018 1.00 0.00 H new ATOM 0 HA2 GLY A 73 1.759 -4.551 -7.959 1.00 0.00 H new ATOM 0 HA3 GLY A 73 0.210 -4.864 -8.716 1.00 0.00 H new ATOM 1143 N ILE A 74 0.944 -2.663 -6.579 1.00 0.00 N ATOM 1144 CA ILE A 74 0.483 -1.498 -5.835 1.00 0.00 C ATOM 1145 C ILE A 74 0.471 -0.252 -6.714 1.00 0.00 C ATOM 1146 O ILE A 74 1.524 0.274 -7.076 1.00 0.00 O ATOM 1147 CB ILE A 74 1.365 -1.233 -4.600 1.00 0.00 C ATOM 1148 CG1 ILE A 74 1.436 -2.482 -3.719 1.00 0.00 C ATOM 1149 CG2 ILE A 74 0.827 -0.050 -3.809 1.00 0.00 C ATOM 1150 CD1 ILE A 74 0.087 -2.937 -3.207 1.00 0.00 C ATOM 0 H ILE A 74 1.949 -2.684 -6.750 1.00 0.00 H new ATOM 0 HA ILE A 74 -0.533 -1.717 -5.506 1.00 0.00 H new ATOM 0 HB ILE A 74 2.373 -0.992 -4.937 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.892 -3.292 -4.287 1.00 0.00 H new ATOM 0 HG13 ILE A 74 2.089 -2.281 -2.870 1.00 0.00 H new ATOM 0 HG21 ILE A 74 1.461 0.125 -2.940 1.00 0.00 H new ATOM 0 HG22 ILE A 74 0.824 0.839 -4.440 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -0.190 -0.265 -3.480 1.00 0.00 H new ATOM 0 HD11 ILE A 74 0.213 -3.827 -2.590 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -0.363 -2.143 -2.611 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -0.563 -3.170 -4.051 1.00 0.00 H new ATOM 1162 N ILE A 75 -0.725 0.215 -7.053 1.00 0.00 N ATOM 1163 CA ILE A 75 -0.874 1.401 -7.887 1.00 0.00 C ATOM 1164 C ILE A 75 -1.565 2.527 -7.125 1.00 0.00 C ATOM 1165 O ILE A 75 -2.746 2.432 -6.792 1.00 0.00 O ATOM 1166 CB ILE A 75 -1.676 1.093 -9.165 1.00 0.00 C ATOM 1167 CG1 ILE A 75 -1.038 -0.070 -9.927 1.00 0.00 C ATOM 1168 CG2 ILE A 75 -1.761 2.330 -10.048 1.00 0.00 C ATOM 1169 CD1 ILE A 75 -1.965 -0.715 -10.933 1.00 0.00 C ATOM 0 H ILE A 75 -1.606 -0.210 -6.763 1.00 0.00 H new ATOM 0 HA ILE A 75 0.131 1.718 -8.166 1.00 0.00 H new ATOM 0 HB ILE A 75 -2.688 0.804 -8.880 1.00 0.00 H new ATOM 0 HG12 ILE A 75 -0.148 0.290 -10.444 1.00 0.00 H new ATOM 0 HG13 ILE A 75 -0.709 -0.825 -9.213 1.00 0.00 H new ATOM 0 HG21 ILE A 75 -2.331 2.097 -10.947 1.00 0.00 H new ATOM 0 HG22 ILE A 75 -2.257 3.133 -9.503 1.00 0.00 H new ATOM 0 HG23 ILE A 75 -0.756 2.647 -10.327 1.00 0.00 H new ATOM 0 HD11 ILE A 75 -1.446 -1.531 -11.435 1.00 0.00 H new ATOM 0 HD12 ILE A 75 -2.844 -1.105 -10.420 1.00 0.00 H new ATOM 0 HD13 ILE A 75 -2.274 0.026 -11.670 1.00 0.00 H new ATOM 1181 N VAL A 76 -0.820 3.594 -6.853 1.00 0.00 N ATOM 1182 CA VAL A 76 -1.361 4.740 -6.132 1.00 0.00 C ATOM 1183 C VAL A 76 -1.712 5.874 -7.088 1.00 0.00 C ATOM 1184 O VAL A 76 -0.830 6.556 -7.611 1.00 0.00 O ATOM 1185 CB VAL A 76 -0.367 5.261 -5.078 1.00 0.00 C ATOM 1186 CG1 VAL A 76 -0.924 6.491 -4.379 1.00 0.00 C ATOM 1187 CG2 VAL A 76 -0.038 4.169 -4.071 1.00 0.00 C ATOM 0 H VAL A 76 0.160 3.688 -7.121 1.00 0.00 H new ATOM 0 HA VAL A 76 -2.266 4.399 -5.629 1.00 0.00 H new ATOM 0 HB VAL A 76 0.555 5.547 -5.584 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -0.207 6.844 -3.638 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -1.104 7.276 -5.113 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -1.861 6.235 -3.884 1.00 0.00 H new ATOM 0 HG21 VAL A 76 0.666 4.554 -3.333 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -0.951 3.850 -3.569 1.00 0.00 H new ATOM 0 HG23 VAL A 76 0.408 3.319 -4.588 1.00 0.00 H new ATOM 1197 N LYS A 77 -3.006 6.072 -7.314 1.00 0.00 N ATOM 1198 CA LYS A 77 -3.476 7.126 -8.206 1.00 0.00 C ATOM 1199 C LYS A 77 -4.443 8.058 -7.484 1.00 0.00 C ATOM 1200 O LYS A 77 -4.845 7.795 -6.351 1.00 0.00 O ATOM 1201 CB LYS A 77 -4.158 6.516 -9.433 1.00 0.00 C ATOM 1202 CG LYS A 77 -3.192 5.849 -10.397 1.00 0.00 C ATOM 1203 CD LYS A 77 -3.842 4.681 -11.119 1.00 0.00 C ATOM 1204 CE LYS A 77 -4.704 5.154 -12.280 1.00 0.00 C ATOM 1205 NZ LYS A 77 -3.880 5.668 -13.408 1.00 0.00 N ATOM 0 H LYS A 77 -3.749 5.516 -6.891 1.00 0.00 H new ATOM 0 HA LYS A 77 -2.612 7.707 -8.529 1.00 0.00 H new ATOM 0 HB2 LYS A 77 -4.893 5.782 -9.102 1.00 0.00 H new ATOM 0 HB3 LYS A 77 -4.704 7.298 -9.961 1.00 0.00 H new ATOM 0 HG2 LYS A 77 -2.842 6.579 -11.126 1.00 0.00 H new ATOM 0 HG3 LYS A 77 -2.316 5.499 -9.851 1.00 0.00 H new ATOM 0 HD2 LYS A 77 -3.071 4.005 -11.489 1.00 0.00 H new ATOM 0 HD3 LYS A 77 -4.454 4.113 -10.418 1.00 0.00 H new ATOM 0 HE2 LYS A 77 -5.326 4.330 -12.630 1.00 0.00 H new ATOM 0 HE3 LYS A 77 -5.378 5.938 -11.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 -4.455 5.693 -14.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 -3.547 6.628 -13.185 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 -3.062 5.043 -13.553 1.00 0.00 H new ATOM 1219 N ASP A 78 -4.814 9.148 -8.149 1.00 0.00 N ATOM 1220 CA ASP A 78 -5.736 10.118 -7.571 1.00 0.00 C ATOM 1221 C ASP A 78 -7.166 9.848 -8.030 1.00 0.00 C ATOM 1222 O ASP A 78 -7.502 10.046 -9.197 1.00 0.00 O ATOM 1223 CB ASP A 78 -5.323 11.539 -7.958 1.00 0.00 C ATOM 1224 CG ASP A 78 -4.724 11.609 -9.349 1.00 0.00 C ATOM 1225 OD1 ASP A 78 -5.160 10.831 -10.224 1.00 0.00 O ATOM 1226 OD2 ASP A 78 -3.819 12.443 -9.564 1.00 0.00 O ATOM 0 H ASP A 78 -4.490 9.381 -9.088 1.00 0.00 H new ATOM 0 HA ASP A 78 -5.696 10.019 -6.486 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -6.193 12.194 -7.907 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -4.599 11.914 -7.234 1.00 0.00 H new ATOM 1231 N PHE A 79 -8.003 9.395 -7.103 1.00 0.00 N ATOM 1232 CA PHE A 79 -9.397 9.095 -7.412 1.00 0.00 C ATOM 1233 C PHE A 79 -9.981 10.142 -8.356 1.00 0.00 C ATOM 1234 O PHE A 79 -10.736 9.814 -9.271 1.00 0.00 O ATOM 1235 CB PHE A 79 -10.224 9.033 -6.126 1.00 0.00 C ATOM 1236 CG PHE A 79 -11.552 8.352 -6.300 1.00 0.00 C ATOM 1237 CD1 PHE A 79 -11.619 6.993 -6.561 1.00 0.00 C ATOM 1238 CD2 PHE A 79 -12.732 9.071 -6.203 1.00 0.00 C ATOM 1239 CE1 PHE A 79 -12.840 6.364 -6.723 1.00 0.00 C ATOM 1240 CE2 PHE A 79 -13.955 8.448 -6.363 1.00 0.00 C ATOM 1241 CZ PHE A 79 -14.009 7.093 -6.623 1.00 0.00 C ATOM 0 H PHE A 79 -7.741 9.227 -6.132 1.00 0.00 H new ATOM 0 HA PHE A 79 -9.434 8.124 -7.906 1.00 0.00 H new ATOM 0 HB2 PHE A 79 -9.653 8.507 -5.361 1.00 0.00 H new ATOM 0 HB3 PHE A 79 -10.389 10.046 -5.760 1.00 0.00 H new ATOM 0 HD1 PHE A 79 -10.708 6.419 -6.639 1.00 0.00 H new ATOM 0 HD2 PHE A 79 -12.696 10.131 -6.000 1.00 0.00 H new ATOM 0 HE1 PHE A 79 -12.879 5.304 -6.927 1.00 0.00 H new ATOM 0 HE2 PHE A 79 -14.868 9.020 -6.285 1.00 0.00 H new ATOM 0 HZ PHE A 79 -14.964 6.604 -6.748 1.00 0.00 H new ATOM 1378 N ILE A 88 0.345 8.909 -9.671 1.00 0.00 N ATOM 1379 CA ILE A 88 1.234 9.378 -8.616 1.00 0.00 C ATOM 1380 C ILE A 88 2.473 8.496 -8.509 1.00 0.00 C ATOM 1381 O ILE A 88 3.602 8.982 -8.569 1.00 0.00 O ATOM 1382 CB ILE A 88 0.520 9.409 -7.251 1.00 0.00 C ATOM 1383 CG1 ILE A 88 -0.705 10.323 -7.313 1.00 0.00 C ATOM 1384 CG2 ILE A 88 1.478 9.870 -6.163 1.00 0.00 C ATOM 1385 CD1 ILE A 88 -1.632 10.171 -6.127 1.00 0.00 C ATOM 0 HA ILE A 88 1.534 10.391 -8.883 1.00 0.00 H new ATOM 0 HB ILE A 88 0.185 8.400 -7.009 1.00 0.00 H new ATOM 0 HG12 ILE A 88 -0.373 11.359 -7.374 1.00 0.00 H new ATOM 0 HG13 ILE A 88 -1.260 10.112 -8.227 1.00 0.00 H new ATOM 0 HG21 ILE A 88 0.959 9.887 -5.205 1.00 0.00 H new ATOM 0 HG22 ILE A 88 2.322 9.183 -6.107 1.00 0.00 H new ATOM 0 HG23 ILE A 88 1.840 10.871 -6.397 1.00 0.00 H new ATOM 0 HD11 ILE A 88 -2.478 10.849 -6.238 1.00 0.00 H new ATOM 0 HD12 ILE A 88 -1.994 9.144 -6.077 1.00 0.00 H new ATOM 0 HD13 ILE A 88 -1.093 10.411 -5.211 1.00 0.00 H new ATOM 1397 N GLY A 89 2.255 7.194 -8.351 1.00 0.00 N ATOM 1398 CA GLY A 89 3.363 6.263 -8.240 1.00 0.00 C ATOM 1399 C GLY A 89 2.904 4.842 -7.984 1.00 0.00 C ATOM 1400 O GLY A 89 1.931 4.615 -7.263 1.00 0.00 O ATOM 0 H GLY A 89 1.330 6.767 -8.298 1.00 0.00 H new ATOM 0 HA2 GLY A 89 3.951 6.292 -9.158 1.00 0.00 H new ATOM 0 HA3 GLY A 89 4.020 6.580 -7.430 1.00 0.00 H new ATOM 1404 N THR A 90 3.603 3.879 -8.577 1.00 0.00 N ATOM 1405 CA THR A 90 3.260 2.473 -8.412 1.00 0.00 C ATOM 1406 C THR A 90 4.378 1.713 -7.707 1.00 0.00 C ATOM 1407 O THR A 90 5.430 2.276 -7.406 1.00 0.00 O ATOM 1408 CB THR A 90 2.974 1.801 -9.768 1.00 0.00 C ATOM 1409 OG1 THR A 90 4.189 1.664 -10.513 1.00 0.00 O ATOM 1410 CG2 THR A 90 1.969 2.612 -10.572 1.00 0.00 C ATOM 0 H THR A 90 4.411 4.048 -9.176 1.00 0.00 H new ATOM 0 HA THR A 90 2.358 2.438 -7.800 1.00 0.00 H new ATOM 0 HB THR A 90 2.552 0.814 -9.578 1.00 0.00 H new ATOM 0 HG1 THR A 90 3.999 1.234 -11.373 1.00 0.00 H new ATOM 0 HG21 THR A 90 1.783 2.118 -11.526 1.00 0.00 H new ATOM 0 HG22 THR A 90 1.035 2.690 -10.015 1.00 0.00 H new ATOM 0 HG23 THR A 90 2.368 3.610 -10.752 1.00 0.00 H new ATOM 1418 N ALA A 91 4.144 0.431 -7.448 1.00 0.00 N ATOM 1419 CA ALA A 91 5.133 -0.407 -6.781 1.00 0.00 C ATOM 1420 C ALA A 91 4.748 -1.880 -6.859 1.00 0.00 C ATOM 1421 O ALA A 91 3.613 -2.253 -6.559 1.00 0.00 O ATOM 1422 CB ALA A 91 5.296 0.022 -5.330 1.00 0.00 C ATOM 0 H ALA A 91 3.278 -0.050 -7.690 1.00 0.00 H new ATOM 0 HA ALA A 91 6.086 -0.280 -7.295 1.00 0.00 H new ATOM 0 HB1 ALA A 91 6.037 -0.612 -4.844 1.00 0.00 H new ATOM 0 HB2 ALA A 91 5.626 1.060 -5.292 1.00 0.00 H new ATOM 0 HB3 ALA A 91 4.341 -0.074 -4.813 1.00 0.00 H new ATOM 1428 N THR A 92 5.699 -2.715 -7.265 1.00 0.00 N ATOM 1429 CA THR A 92 5.458 -4.148 -7.385 1.00 0.00 C ATOM 1430 C THR A 92 6.186 -4.921 -6.291 1.00 0.00 C ATOM 1431 O THR A 92 7.410 -4.855 -6.180 1.00 0.00 O ATOM 1432 CB THR A 92 5.907 -4.680 -8.759 1.00 0.00 C ATOM 1433 OG1 THR A 92 5.264 -3.942 -9.804 1.00 0.00 O ATOM 1434 CG2 THR A 92 5.580 -6.158 -8.900 1.00 0.00 C ATOM 0 H THR A 92 6.644 -2.424 -7.516 1.00 0.00 H new ATOM 0 HA THR A 92 4.384 -4.298 -7.279 1.00 0.00 H new ATOM 0 HB THR A 92 6.987 -4.554 -8.837 1.00 0.00 H new ATOM 0 HG1 THR A 92 5.556 -4.285 -10.674 1.00 0.00 H new ATOM 0 HG21 THR A 92 5.906 -6.511 -9.878 1.00 0.00 H new ATOM 0 HG22 THR A 92 6.095 -6.720 -8.121 1.00 0.00 H new ATOM 0 HG23 THR A 92 4.504 -6.304 -8.802 1.00 0.00 H new ATOM 1442 N VAL A 93 5.425 -5.654 -5.485 1.00 0.00 N ATOM 1443 CA VAL A 93 5.998 -6.441 -4.400 1.00 0.00 C ATOM 1444 C VAL A 93 6.149 -7.904 -4.803 1.00 0.00 C ATOM 1445 O VAL A 93 5.160 -8.611 -4.992 1.00 0.00 O ATOM 1446 CB VAL A 93 5.134 -6.357 -3.128 1.00 0.00 C ATOM 1447 CG1 VAL A 93 5.784 -7.127 -1.988 1.00 0.00 C ATOM 1448 CG2 VAL A 93 4.902 -4.905 -2.737 1.00 0.00 C ATOM 0 H VAL A 93 4.410 -5.719 -5.563 1.00 0.00 H new ATOM 0 HA VAL A 93 6.982 -6.021 -4.190 1.00 0.00 H new ATOM 0 HB VAL A 93 4.166 -6.813 -3.337 1.00 0.00 H new ATOM 0 HG11 VAL A 93 5.159 -7.056 -1.098 1.00 0.00 H new ATOM 0 HG12 VAL A 93 5.894 -8.174 -2.272 1.00 0.00 H new ATOM 0 HG13 VAL A 93 6.766 -6.704 -1.776 1.00 0.00 H new ATOM 0 HG21 VAL A 93 4.290 -4.864 -1.836 1.00 0.00 H new ATOM 0 HG22 VAL A 93 5.860 -4.422 -2.547 1.00 0.00 H new ATOM 0 HG23 VAL A 93 4.390 -4.387 -3.548 1.00 0.00 H new ATOM 1458 N ALA A 94 7.394 -8.351 -4.933 1.00 0.00 N ATOM 1459 CA ALA A 94 7.674 -9.731 -5.311 1.00 0.00 C ATOM 1460 C ALA A 94 7.360 -10.688 -4.166 1.00 0.00 C ATOM 1461 O ALA A 94 8.051 -10.701 -3.146 1.00 0.00 O ATOM 1462 CB ALA A 94 9.127 -9.876 -5.739 1.00 0.00 C ATOM 0 H ALA A 94 8.224 -7.778 -4.782 1.00 0.00 H new ATOM 0 HA ALA A 94 7.031 -9.989 -6.152 1.00 0.00 H new ATOM 0 HB1 ALA A 94 9.322 -10.911 -6.019 1.00 0.00 H new ATOM 0 HB2 ALA A 94 9.321 -9.227 -6.593 1.00 0.00 H new ATOM 0 HB3 ALA A 94 9.780 -9.594 -4.913 1.00 0.00 H new ATOM 1468 N LEU A 95 6.314 -11.489 -4.341 1.00 0.00 N ATOM 1469 CA LEU A 95 5.908 -12.450 -3.321 1.00 0.00 C ATOM 1470 C LEU A 95 6.760 -13.713 -3.394 1.00 0.00 C ATOM 1471 O LEU A 95 6.507 -14.688 -2.685 1.00 0.00 O ATOM 1472 CB LEU A 95 4.430 -12.807 -3.489 1.00 0.00 C ATOM 1473 CG LEU A 95 3.444 -11.642 -3.406 1.00 0.00 C ATOM 1474 CD1 LEU A 95 2.088 -12.049 -3.960 1.00 0.00 C ATOM 1475 CD2 LEU A 95 3.312 -11.157 -1.969 1.00 0.00 C ATOM 0 H LEU A 95 5.732 -11.492 -5.179 1.00 0.00 H new ATOM 0 HA LEU A 95 6.056 -11.991 -2.344 1.00 0.00 H new ATOM 0 HB2 LEU A 95 4.303 -13.296 -4.455 1.00 0.00 H new ATOM 0 HB3 LEU A 95 4.164 -13.537 -2.724 1.00 0.00 H new ATOM 0 HG LEU A 95 3.829 -10.822 -4.012 1.00 0.00 H new ATOM 0 HD11 LEU A 95 1.400 -11.207 -3.892 1.00 0.00 H new ATOM 0 HD12 LEU A 95 2.196 -12.347 -5.003 1.00 0.00 H new ATOM 0 HD13 LEU A 95 1.695 -12.886 -3.382 1.00 0.00 H new ATOM 0 HD21 LEU A 95 2.606 -10.327 -1.928 1.00 0.00 H new ATOM 0 HD22 LEU A 95 2.951 -11.972 -1.342 1.00 0.00 H new ATOM 0 HD23 LEU A 95 4.285 -10.824 -1.607 1.00 0.00 H new ATOM 1487 N LYS A 96 7.772 -13.689 -4.255 1.00 0.00 N ATOM 1488 CA LYS A 96 8.665 -14.831 -4.419 1.00 0.00 C ATOM 1489 C LYS A 96 9.375 -15.158 -3.109 1.00 0.00 C ATOM 1490 O LYS A 96 9.992 -16.215 -2.974 1.00 0.00 O ATOM 1491 CB LYS A 96 9.696 -14.545 -5.513 1.00 0.00 C ATOM 1492 CG LYS A 96 10.794 -13.590 -5.079 1.00 0.00 C ATOM 1493 CD LYS A 96 11.989 -13.653 -6.016 1.00 0.00 C ATOM 1494 CE LYS A 96 13.007 -12.569 -5.694 1.00 0.00 C ATOM 1495 NZ LYS A 96 12.661 -11.274 -6.342 1.00 0.00 N ATOM 0 H LYS A 96 7.995 -12.891 -4.850 1.00 0.00 H new ATOM 0 HA LYS A 96 8.064 -15.692 -4.711 1.00 0.00 H new ATOM 0 HB2 LYS A 96 10.148 -15.485 -5.829 1.00 0.00 H new ATOM 0 HB3 LYS A 96 9.186 -14.128 -6.381 1.00 0.00 H new ATOM 0 HG2 LYS A 96 10.404 -12.573 -5.053 1.00 0.00 H new ATOM 0 HG3 LYS A 96 11.112 -13.835 -4.066 1.00 0.00 H new ATOM 0 HD2 LYS A 96 12.462 -14.632 -5.939 1.00 0.00 H new ATOM 0 HD3 LYS A 96 11.651 -13.542 -7.046 1.00 0.00 H new ATOM 0 HE2 LYS A 96 13.062 -12.432 -4.614 1.00 0.00 H new ATOM 0 HE3 LYS A 96 13.995 -12.889 -6.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 96 13.378 -10.561 -6.099 1.00 0.00 H new ATOM 0 HZ2 LYS A 96 12.633 -11.399 -7.374 1.00 0.00 H new ATOM 0 HZ3 LYS A 96 11.729 -10.956 -6.007 1.00 0.00 H new ATOM 1509 N ASP A 97 9.284 -14.246 -2.147 1.00 0.00 N ATOM 1510 CA ASP A 97 9.916 -14.440 -0.848 1.00 0.00 C ATOM 1511 C ASP A 97 8.956 -15.112 0.129 1.00 0.00 C ATOM 1512 O ASP A 97 9.353 -15.975 0.912 1.00 0.00 O ATOM 1513 CB ASP A 97 10.385 -13.099 -0.280 1.00 0.00 C ATOM 1514 CG ASP A 97 11.442 -12.442 -1.146 1.00 0.00 C ATOM 1515 OD1 ASP A 97 12.314 -13.166 -1.669 1.00 0.00 O ATOM 1516 OD2 ASP A 97 11.397 -11.203 -1.300 1.00 0.00 O ATOM 0 H ASP A 97 8.779 -13.365 -2.243 1.00 0.00 H new ATOM 0 HA ASP A 97 10.780 -15.090 -0.986 1.00 0.00 H new ATOM 0 HB2 ASP A 97 9.530 -12.429 -0.184 1.00 0.00 H new ATOM 0 HB3 ASP A 97 10.784 -13.252 0.723 1.00 0.00 H new ATOM 1521 N LEU A 98 7.691 -14.710 0.078 1.00 0.00 N ATOM 1522 CA LEU A 98 6.673 -15.272 0.959 1.00 0.00 C ATOM 1523 C LEU A 98 6.408 -16.736 0.620 1.00 0.00 C ATOM 1524 O LEU A 98 5.995 -17.518 1.477 1.00 0.00 O ATOM 1525 CB LEU A 98 5.376 -14.469 0.850 1.00 0.00 C ATOM 1526 CG LEU A 98 5.457 -13.002 1.275 1.00 0.00 C ATOM 1527 CD1 LEU A 98 4.237 -12.237 0.787 1.00 0.00 C ATOM 1528 CD2 LEU A 98 5.588 -12.892 2.787 1.00 0.00 C ATOM 0 H LEU A 98 7.345 -13.997 -0.564 1.00 0.00 H new ATOM 0 HA LEU A 98 7.043 -15.216 1.983 1.00 0.00 H new ATOM 0 HB2 LEU A 98 5.034 -14.509 -0.184 1.00 0.00 H new ATOM 0 HB3 LEU A 98 4.616 -14.961 1.457 1.00 0.00 H new ATOM 0 HG LEU A 98 6.343 -12.560 0.820 1.00 0.00 H new ATOM 0 HD11 LEU A 98 4.312 -11.195 1.099 1.00 0.00 H new ATOM 0 HD12 LEU A 98 4.187 -12.288 -0.301 1.00 0.00 H new ATOM 0 HD13 LEU A 98 3.336 -12.679 1.213 1.00 0.00 H new ATOM 0 HD21 LEU A 98 5.644 -11.841 3.072 1.00 0.00 H new ATOM 0 HD22 LEU A 98 4.721 -13.351 3.262 1.00 0.00 H new ATOM 0 HD23 LEU A 98 6.493 -13.405 3.112 1.00 0.00 H new ATOM 1540 N THR A 99 6.650 -17.101 -0.635 1.00 0.00 N ATOM 1541 CA THR A 99 6.439 -18.470 -1.087 1.00 0.00 C ATOM 1542 C THR A 99 6.955 -19.473 -0.062 1.00 0.00 C ATOM 1543 O THR A 99 7.914 -19.200 0.660 1.00 0.00 O ATOM 1544 CB THR A 99 7.133 -18.729 -2.437 1.00 0.00 C ATOM 1545 OG1 THR A 99 8.522 -18.391 -2.347 1.00 0.00 O ATOM 1546 CG2 THR A 99 6.480 -17.919 -3.547 1.00 0.00 C ATOM 0 H THR A 99 6.993 -16.467 -1.357 1.00 0.00 H new ATOM 0 HA THR A 99 5.364 -18.600 -1.209 1.00 0.00 H new ATOM 0 HB THR A 99 7.031 -19.788 -2.674 1.00 0.00 H new ATOM 0 HG1 THR A 99 8.668 -17.501 -2.731 1.00 0.00 H new ATOM 0 HG21 THR A 99 6.988 -18.119 -4.490 1.00 0.00 H new ATOM 0 HG22 THR A 99 5.430 -18.200 -3.633 1.00 0.00 H new ATOM 0 HG23 THR A 99 6.553 -16.857 -3.314 1.00 0.00 H new ATOM 1554 N GLY A 100 6.314 -20.636 -0.004 1.00 0.00 N ATOM 1555 CA GLY A 100 6.724 -21.663 0.936 1.00 0.00 C ATOM 1556 C GLY A 100 5.555 -22.486 1.442 1.00 0.00 C ATOM 1557 O GLY A 100 4.428 -22.330 0.972 1.00 0.00 O ATOM 0 H GLY A 100 5.518 -20.886 -0.591 1.00 0.00 H new ATOM 0 HA2 GLY A 100 7.448 -22.322 0.457 1.00 0.00 H new ATOM 0 HA3 GLY A 100 7.229 -21.196 1.782 1.00 0.00 H new ATOM 1561 N ASP A 101 5.824 -23.365 2.401 1.00 0.00 N ATOM 1562 CA ASP A 101 4.786 -24.216 2.971 1.00 0.00 C ATOM 1563 C ASP A 101 4.492 -23.821 4.415 1.00 0.00 C ATOM 1564 O ASP A 101 4.283 -24.680 5.272 1.00 0.00 O ATOM 1565 CB ASP A 101 5.209 -25.684 2.906 1.00 0.00 C ATOM 1566 CG ASP A 101 4.023 -26.624 2.813 1.00 0.00 C ATOM 1567 OD1 ASP A 101 3.459 -26.761 1.707 1.00 0.00 O ATOM 1568 OD2 ASP A 101 3.659 -27.223 3.847 1.00 0.00 O ATOM 0 H ASP A 101 6.752 -23.507 2.800 1.00 0.00 H new ATOM 0 HA ASP A 101 3.877 -24.082 2.385 1.00 0.00 H new ATOM 0 HB2 ASP A 101 5.857 -25.835 2.043 1.00 0.00 H new ATOM 0 HB3 ASP A 101 5.795 -25.930 3.791 1.00 0.00 H new ATOM 1573 N GLN A 102 4.480 -22.518 4.677 1.00 0.00 N ATOM 1574 CA GLN A 102 4.214 -22.011 6.018 1.00 0.00 C ATOM 1575 C GLN A 102 3.848 -20.531 5.977 1.00 0.00 C ATOM 1576 O GLN A 102 4.354 -19.779 5.144 1.00 0.00 O ATOM 1577 CB GLN A 102 5.432 -22.223 6.917 1.00 0.00 C ATOM 1578 CG GLN A 102 6.534 -21.199 6.701 1.00 0.00 C ATOM 1579 CD GLN A 102 7.756 -21.466 7.557 1.00 0.00 C ATOM 1580 OE1 GLN A 102 7.662 -22.083 8.618 1.00 0.00 O ATOM 1581 NE2 GLN A 102 8.913 -21.001 7.100 1.00 0.00 N ATOM 0 H GLN A 102 4.651 -21.795 3.979 1.00 0.00 H new ATOM 0 HA GLN A 102 3.369 -22.564 6.428 1.00 0.00 H new ATOM 0 HB2 GLN A 102 5.114 -22.188 7.959 1.00 0.00 H new ATOM 0 HB3 GLN A 102 5.835 -23.220 6.740 1.00 0.00 H new ATOM 0 HG2 GLN A 102 6.824 -21.200 5.650 1.00 0.00 H new ATOM 0 HG3 GLN A 102 6.149 -20.204 6.925 1.00 0.00 H new ATOM 0 HE21 GLN A 102 8.945 -20.495 6.215 1.00 0.00 H new ATOM 0 HE22 GLN A 102 9.769 -21.150 7.634 1.00 0.00 H new ATOM 1590 N SER A 103 2.966 -20.120 6.882 1.00 0.00 N ATOM 1591 CA SER A 103 2.529 -18.730 6.947 1.00 0.00 C ATOM 1592 C SER A 103 3.715 -17.798 7.183 1.00 0.00 C ATOM 1593 O SER A 103 4.437 -17.933 8.170 1.00 0.00 O ATOM 1594 CB SER A 103 1.496 -18.550 8.061 1.00 0.00 C ATOM 1595 OG SER A 103 1.339 -17.181 8.395 1.00 0.00 O ATOM 0 H SER A 103 2.540 -20.729 7.580 1.00 0.00 H new ATOM 0 HA SER A 103 2.072 -18.474 5.991 1.00 0.00 H new ATOM 0 HB2 SER A 103 0.538 -18.962 7.743 1.00 0.00 H new ATOM 0 HB3 SER A 103 1.807 -19.110 8.943 1.00 0.00 H new ATOM 0 HG SER A 103 0.673 -17.093 9.108 1.00 0.00 H new ATOM 1601 N ARG A 104 3.907 -16.854 6.268 1.00 0.00 N ATOM 1602 CA ARG A 104 5.005 -15.900 6.374 1.00 0.00 C ATOM 1603 C ARG A 104 4.530 -14.486 6.055 1.00 0.00 C ATOM 1604 O ARG A 104 4.052 -14.215 4.953 1.00 0.00 O ATOM 1605 CB ARG A 104 6.143 -16.293 5.430 1.00 0.00 C ATOM 1606 CG ARG A 104 7.341 -15.360 5.499 1.00 0.00 C ATOM 1607 CD ARG A 104 8.599 -16.028 4.965 1.00 0.00 C ATOM 1608 NE ARG A 104 9.159 -16.982 5.918 1.00 0.00 N ATOM 1609 CZ ARG A 104 10.107 -17.859 5.609 1.00 0.00 C ATOM 1610 NH1 ARG A 104 10.600 -17.901 4.379 1.00 0.00 N ATOM 1611 NH2 ARG A 104 10.566 -18.695 6.532 1.00 0.00 N ATOM 0 H ARG A 104 3.317 -16.729 5.445 1.00 0.00 H new ATOM 0 HA ARG A 104 5.371 -15.918 7.401 1.00 0.00 H new ATOM 0 HB2 ARG A 104 6.468 -17.306 5.668 1.00 0.00 H new ATOM 0 HB3 ARG A 104 5.766 -16.311 4.408 1.00 0.00 H new ATOM 0 HG2 ARG A 104 7.134 -14.458 4.923 1.00 0.00 H new ATOM 0 HG3 ARG A 104 7.503 -15.049 6.531 1.00 0.00 H new ATOM 0 HD2 ARG A 104 8.368 -16.541 4.031 1.00 0.00 H new ATOM 0 HD3 ARG A 104 9.344 -15.266 4.734 1.00 0.00 H new ATOM 0 HE ARG A 104 8.802 -16.974 6.874 1.00 0.00 H new ATOM 0 HH11 ARG A 104 10.251 -17.259 3.668 1.00 0.00 H new ATOM 0 HH12 ARG A 104 11.328 -18.576 4.144 1.00 0.00 H new ATOM 0 HH21 ARG A 104 10.191 -18.664 7.480 1.00 0.00 H new ATOM 0 HH22 ARG A 104 11.294 -19.368 6.293 1.00 0.00 H new ATOM 1625 N SER A 105 4.664 -13.588 7.026 1.00 0.00 N ATOM 1626 CA SER A 105 4.244 -12.203 6.850 1.00 0.00 C ATOM 1627 C SER A 105 5.429 -11.253 6.998 1.00 0.00 C ATOM 1628 O SER A 105 5.915 -11.016 8.105 1.00 0.00 O ATOM 1629 CB SER A 105 3.158 -11.844 7.866 1.00 0.00 C ATOM 1630 OG SER A 105 3.547 -12.209 9.179 1.00 0.00 O ATOM 0 H SER A 105 5.060 -13.795 7.943 1.00 0.00 H new ATOM 0 HA SER A 105 3.839 -12.097 5.844 1.00 0.00 H new ATOM 0 HB2 SER A 105 2.959 -10.773 7.827 1.00 0.00 H new ATOM 0 HB3 SER A 105 2.229 -12.351 7.604 1.00 0.00 H new ATOM 0 HG SER A 105 4.487 -11.969 9.320 1.00 0.00 H new ATOM 1636 N LEU A 106 5.889 -10.713 5.875 1.00 0.00 N ATOM 1637 CA LEU A 106 7.018 -9.788 5.878 1.00 0.00 C ATOM 1638 C LEU A 106 6.547 -8.355 5.655 1.00 0.00 C ATOM 1639 O LEU A 106 5.948 -8.024 4.632 1.00 0.00 O ATOM 1640 CB LEU A 106 8.026 -10.180 4.797 1.00 0.00 C ATOM 1641 CG LEU A 106 8.711 -11.536 4.977 1.00 0.00 C ATOM 1642 CD1 LEU A 106 9.289 -12.022 3.657 1.00 0.00 C ATOM 1643 CD2 LEU A 106 9.799 -11.447 6.037 1.00 0.00 C ATOM 0 H LEU A 106 5.498 -10.899 4.951 1.00 0.00 H new ATOM 0 HA LEU A 106 7.501 -9.845 6.854 1.00 0.00 H new ATOM 0 HB2 LEU A 106 7.515 -10.179 3.834 1.00 0.00 H new ATOM 0 HB3 LEU A 106 8.796 -9.410 4.750 1.00 0.00 H new ATOM 0 HG LEU A 106 7.965 -12.257 5.310 1.00 0.00 H new ATOM 0 HD11 LEU A 106 9.772 -12.988 3.805 1.00 0.00 H new ATOM 0 HD12 LEU A 106 8.488 -12.125 2.925 1.00 0.00 H new ATOM 0 HD13 LEU A 106 10.022 -11.302 3.293 1.00 0.00 H new ATOM 0 HD21 LEU A 106 10.276 -12.421 6.152 1.00 0.00 H new ATOM 0 HD22 LEU A 106 10.544 -10.712 5.733 1.00 0.00 H new ATOM 0 HD23 LEU A 106 9.358 -11.145 6.987 1.00 0.00 H new ATOM 1655 N PRO A 107 6.826 -7.481 6.634 1.00 0.00 N ATOM 1656 CA PRO A 107 6.443 -6.068 6.567 1.00 0.00 C ATOM 1657 C PRO A 107 7.243 -5.300 5.520 1.00 0.00 C ATOM 1658 O PRO A 107 8.433 -5.040 5.701 1.00 0.00 O ATOM 1659 CB PRO A 107 6.761 -5.547 7.970 1.00 0.00 C ATOM 1660 CG PRO A 107 7.825 -6.457 8.480 1.00 0.00 C ATOM 1661 CD PRO A 107 7.538 -7.806 7.882 1.00 0.00 C ATOM 0 HA PRO A 107 5.400 -5.942 6.277 1.00 0.00 H new ATOM 0 HB2 PRO A 107 7.105 -4.513 7.940 1.00 0.00 H new ATOM 0 HB3 PRO A 107 5.879 -5.571 8.610 1.00 0.00 H new ATOM 0 HG2 PRO A 107 8.814 -6.103 8.188 1.00 0.00 H new ATOM 0 HG3 PRO A 107 7.811 -6.502 9.569 1.00 0.00 H new ATOM 0 HD2 PRO A 107 8.455 -8.363 7.688 1.00 0.00 H new ATOM 0 HD3 PRO A 107 6.927 -8.418 8.546 1.00 0.00 H new ATOM 1669 N TYR A 108 6.582 -4.938 4.426 1.00 0.00 N ATOM 1670 CA TYR A 108 7.232 -4.201 3.349 1.00 0.00 C ATOM 1671 C TYR A 108 7.024 -2.699 3.514 1.00 0.00 C ATOM 1672 O TYR A 108 5.956 -2.170 3.206 1.00 0.00 O ATOM 1673 CB TYR A 108 6.692 -4.656 1.992 1.00 0.00 C ATOM 1674 CG TYR A 108 7.137 -6.046 1.598 1.00 0.00 C ATOM 1675 CD1 TYR A 108 6.388 -7.163 1.949 1.00 0.00 C ATOM 1676 CD2 TYR A 108 8.306 -6.243 0.874 1.00 0.00 C ATOM 1677 CE1 TYR A 108 6.791 -8.435 1.592 1.00 0.00 C ATOM 1678 CE2 TYR A 108 8.716 -7.512 0.511 1.00 0.00 C ATOM 1679 CZ TYR A 108 7.956 -8.604 0.873 1.00 0.00 C ATOM 1680 OH TYR A 108 8.360 -9.869 0.514 1.00 0.00 O ATOM 0 H TYR A 108 5.596 -5.143 4.262 1.00 0.00 H new ATOM 0 HA TYR A 108 8.301 -4.409 3.395 1.00 0.00 H new ATOM 0 HB2 TYR A 108 5.603 -4.625 2.015 1.00 0.00 H new ATOM 0 HB3 TYR A 108 7.015 -3.950 1.227 1.00 0.00 H new ATOM 0 HD1 TYR A 108 5.475 -7.034 2.511 1.00 0.00 H new ATOM 0 HD2 TYR A 108 8.905 -5.390 0.590 1.00 0.00 H new ATOM 0 HE1 TYR A 108 6.198 -9.292 1.874 1.00 0.00 H new ATOM 0 HE2 TYR A 108 9.627 -7.648 -0.053 1.00 0.00 H new ATOM 0 HH TYR A 108 9.199 -9.814 0.011 1.00 0.00 H new ATOM 1690 N LYS A 109 8.055 -2.016 4.001 1.00 0.00 N ATOM 1691 CA LYS A 109 7.989 -0.574 4.206 1.00 0.00 C ATOM 1692 C LYS A 109 9.118 0.134 3.464 1.00 0.00 C ATOM 1693 O LYS A 109 10.065 -0.503 3.001 1.00 0.00 O ATOM 1694 CB LYS A 109 8.063 -0.246 5.699 1.00 0.00 C ATOM 1695 CG LYS A 109 7.328 -1.244 6.578 1.00 0.00 C ATOM 1696 CD LYS A 109 6.911 -0.622 7.900 1.00 0.00 C ATOM 1697 CE LYS A 109 6.554 -1.685 8.928 1.00 0.00 C ATOM 1698 NZ LYS A 109 7.747 -2.137 9.696 1.00 0.00 N ATOM 0 H LYS A 109 8.946 -2.438 4.261 1.00 0.00 H new ATOM 0 HA LYS A 109 7.038 -0.220 3.808 1.00 0.00 H new ATOM 0 HB2 LYS A 109 9.109 -0.208 6.003 1.00 0.00 H new ATOM 0 HB3 LYS A 109 7.647 0.748 5.865 1.00 0.00 H new ATOM 0 HG2 LYS A 109 6.446 -1.611 6.054 1.00 0.00 H new ATOM 0 HG3 LYS A 109 7.969 -2.105 6.766 1.00 0.00 H new ATOM 0 HD2 LYS A 109 7.721 -0.001 8.283 1.00 0.00 H new ATOM 0 HD3 LYS A 109 6.055 0.034 7.741 1.00 0.00 H new ATOM 0 HE2 LYS A 109 5.808 -1.288 9.616 1.00 0.00 H new ATOM 0 HE3 LYS A 109 6.101 -2.539 8.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 109 7.462 -2.861 10.386 1.00 0.00 H new ATOM 0 HZ2 LYS A 109 8.449 -2.539 9.042 1.00 0.00 H new ATOM 0 HZ3 LYS A 109 8.165 -1.327 10.197 1.00 0.00 H new ATOM 1712 N LEU A 110 9.012 1.453 3.354 1.00 0.00 N ATOM 1713 CA LEU A 110 10.026 2.248 2.669 1.00 0.00 C ATOM 1714 C LEU A 110 10.068 1.911 1.182 1.00 0.00 C ATOM 1715 O LEU A 110 11.124 1.972 0.552 1.00 0.00 O ATOM 1716 CB LEU A 110 11.400 2.009 3.297 1.00 0.00 C ATOM 1717 CG LEU A 110 11.492 2.218 4.809 1.00 0.00 C ATOM 1718 CD1 LEU A 110 12.640 1.407 5.391 1.00 0.00 C ATOM 1719 CD2 LEU A 110 11.661 3.695 5.135 1.00 0.00 C ATOM 0 H LEU A 110 8.234 1.995 3.730 1.00 0.00 H new ATOM 0 HA LEU A 110 9.762 3.300 2.777 1.00 0.00 H new ATOM 0 HB2 LEU A 110 11.707 0.988 3.072 1.00 0.00 H new ATOM 0 HB3 LEU A 110 12.118 2.672 2.814 1.00 0.00 H new ATOM 0 HG LEU A 110 10.563 1.871 5.261 1.00 0.00 H new ATOM 0 HD11 LEU A 110 12.690 1.568 6.468 1.00 0.00 H new ATOM 0 HD12 LEU A 110 12.476 0.348 5.190 1.00 0.00 H new ATOM 0 HD13 LEU A 110 13.577 1.723 4.933 1.00 0.00 H new ATOM 0 HD21 LEU A 110 11.725 3.824 6.215 1.00 0.00 H new ATOM 0 HD22 LEU A 110 12.574 4.068 4.671 1.00 0.00 H new ATOM 0 HD23 LEU A 110 10.806 4.252 4.753 1.00 0.00 H new ATOM 1731 N ILE A 111 8.913 1.559 0.628 1.00 0.00 N ATOM 1732 CA ILE A 111 8.818 1.216 -0.786 1.00 0.00 C ATOM 1733 C ILE A 111 8.908 2.462 -1.661 1.00 0.00 C ATOM 1734 O ILE A 111 8.148 3.414 -1.484 1.00 0.00 O ATOM 1735 CB ILE A 111 7.504 0.477 -1.099 1.00 0.00 C ATOM 1736 CG1 ILE A 111 7.399 -0.799 -0.260 1.00 0.00 C ATOM 1737 CG2 ILE A 111 7.421 0.149 -2.582 1.00 0.00 C ATOM 1738 CD1 ILE A 111 6.014 -1.407 -0.257 1.00 0.00 C ATOM 0 H ILE A 111 8.030 1.504 1.136 1.00 0.00 H new ATOM 0 HA ILE A 111 9.658 0.557 -1.008 1.00 0.00 H new ATOM 0 HB ILE A 111 6.668 1.128 -0.843 1.00 0.00 H new ATOM 0 HG12 ILE A 111 8.109 -1.534 -0.640 1.00 0.00 H new ATOM 0 HG13 ILE A 111 7.691 -0.575 0.766 1.00 0.00 H new ATOM 0 HG21 ILE A 111 6.487 -0.373 -2.787 1.00 0.00 H new ATOM 0 HG22 ILE A 111 7.456 1.072 -3.161 1.00 0.00 H new ATOM 0 HG23 ILE A 111 8.261 -0.487 -2.862 1.00 0.00 H new ATOM 0 HD11 ILE A 111 6.013 -2.308 0.357 1.00 0.00 H new ATOM 0 HD12 ILE A 111 5.302 -0.689 0.151 1.00 0.00 H new ATOM 0 HD13 ILE A 111 5.727 -1.663 -1.277 1.00 0.00 H new ATOM 1750 N SER A 112 9.842 2.448 -2.607 1.00 0.00 N ATOM 1751 CA SER A 112 10.033 3.578 -3.509 1.00 0.00 C ATOM 1752 C SER A 112 9.062 3.506 -4.683 1.00 0.00 C ATOM 1753 O SER A 112 9.185 2.644 -5.555 1.00 0.00 O ATOM 1754 CB SER A 112 11.473 3.608 -4.025 1.00 0.00 C ATOM 1755 OG SER A 112 12.306 4.369 -3.168 1.00 0.00 O ATOM 0 H SER A 112 10.478 1.667 -2.769 1.00 0.00 H new ATOM 0 HA SER A 112 9.835 4.494 -2.952 1.00 0.00 H new ATOM 0 HB2 SER A 112 11.857 2.591 -4.101 1.00 0.00 H new ATOM 0 HB3 SER A 112 11.494 4.032 -5.029 1.00 0.00 H new ATOM 0 HG SER A 112 13.221 4.371 -3.519 1.00 0.00 H new ATOM 1761 N LEU A 113 8.095 4.416 -4.699 1.00 0.00 N ATOM 1762 CA LEU A 113 7.100 4.458 -5.766 1.00 0.00 C ATOM 1763 C LEU A 113 7.677 5.099 -7.024 1.00 0.00 C ATOM 1764 O LEU A 113 8.435 6.067 -6.948 1.00 0.00 O ATOM 1765 CB LEU A 113 5.863 5.231 -5.307 1.00 0.00 C ATOM 1766 CG LEU A 113 5.140 4.674 -4.080 1.00 0.00 C ATOM 1767 CD1 LEU A 113 4.158 5.696 -3.529 1.00 0.00 C ATOM 1768 CD2 LEU A 113 4.424 3.377 -4.426 1.00 0.00 C ATOM 0 H LEU A 113 7.978 5.135 -3.985 1.00 0.00 H new ATOM 0 HA LEU A 113 6.813 3.433 -6.002 1.00 0.00 H new ATOM 0 HB2 LEU A 113 6.159 6.258 -5.094 1.00 0.00 H new ATOM 0 HB3 LEU A 113 5.155 5.269 -6.135 1.00 0.00 H new ATOM 0 HG LEU A 113 5.882 4.462 -3.310 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.653 5.282 -2.656 1.00 0.00 H new ATOM 0 HD12 LEU A 113 4.696 6.600 -3.242 1.00 0.00 H new ATOM 0 HD13 LEU A 113 3.420 5.940 -4.293 1.00 0.00 H new ATOM 0 HD21 LEU A 113 3.915 2.995 -3.541 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.693 3.564 -5.213 1.00 0.00 H new ATOM 0 HD23 LEU A 113 5.150 2.642 -4.773 1.00 0.00 H new ATOM 1780 N LEU A 114 7.312 4.555 -8.179 1.00 0.00 N ATOM 1781 CA LEU A 114 7.792 5.076 -9.455 1.00 0.00 C ATOM 1782 C LEU A 114 6.625 5.444 -10.366 1.00 0.00 C ATOM 1783 O LEU A 114 5.550 4.852 -10.284 1.00 0.00 O ATOM 1784 CB LEU A 114 8.686 4.045 -10.145 1.00 0.00 C ATOM 1785 CG LEU A 114 9.682 3.311 -9.246 1.00 0.00 C ATOM 1786 CD1 LEU A 114 10.154 2.027 -9.909 1.00 0.00 C ATOM 1787 CD2 LEU A 114 10.864 4.209 -8.915 1.00 0.00 C ATOM 0 H LEU A 114 6.686 3.754 -8.259 1.00 0.00 H new ATOM 0 HA LEU A 114 8.373 5.977 -9.256 1.00 0.00 H new ATOM 0 HB2 LEU A 114 8.047 3.304 -10.626 1.00 0.00 H new ATOM 0 HB3 LEU A 114 9.243 4.548 -10.936 1.00 0.00 H new ATOM 0 HG LEU A 114 9.178 3.050 -8.315 1.00 0.00 H new ATOM 0 HD11 LEU A 114 10.862 1.519 -9.255 1.00 0.00 H new ATOM 0 HD12 LEU A 114 9.299 1.377 -10.093 1.00 0.00 H new ATOM 0 HD13 LEU A 114 10.640 2.264 -10.855 1.00 0.00 H new ATOM 0 HD21 LEU A 114 11.562 3.670 -8.275 1.00 0.00 H new ATOM 0 HD22 LEU A 114 11.368 4.501 -9.836 1.00 0.00 H new ATOM 0 HD23 LEU A 114 10.510 5.100 -8.397 1.00 0.00 H new ATOM 1799 N ASN A 115 6.846 6.425 -11.235 1.00 0.00 N ATOM 1800 CA ASN A 115 5.813 6.872 -12.163 1.00 0.00 C ATOM 1801 C ASN A 115 5.712 5.929 -13.359 1.00 0.00 C ATOM 1802 O ASN A 115 6.396 4.908 -13.415 1.00 0.00 O ATOM 1803 CB ASN A 115 6.110 8.294 -12.644 1.00 0.00 C ATOM 1804 CG ASN A 115 7.593 8.537 -12.847 1.00 0.00 C ATOM 1805 OD1 ASN A 115 8.317 7.663 -13.324 1.00 0.00 O ATOM 1806 ND2 ASN A 115 8.052 9.730 -12.486 1.00 0.00 N ATOM 0 H ASN A 115 7.731 6.926 -11.316 1.00 0.00 H new ATOM 0 HA ASN A 115 4.859 6.866 -11.636 1.00 0.00 H new ATOM 0 HB2 ASN A 115 5.583 8.475 -13.581 1.00 0.00 H new ATOM 0 HB3 ASN A 115 5.723 9.009 -11.917 1.00 0.00 H new ATOM 0 HD21 ASN A 115 9.041 9.952 -12.600 1.00 0.00 H new ATOM 0 HD22 ASN A 115 7.415 10.424 -12.095 1.00 0.00 H new ATOM 1813 N GLU A 116 4.856 6.282 -14.312 1.00 0.00 N ATOM 1814 CA GLU A 116 4.666 5.467 -15.507 1.00 0.00 C ATOM 1815 C GLU A 116 5.952 5.393 -16.325 1.00 0.00 C ATOM 1816 O GLU A 116 6.090 4.548 -17.210 1.00 0.00 O ATOM 1817 CB GLU A 116 3.535 6.037 -16.365 1.00 0.00 C ATOM 1818 CG GLU A 116 3.840 7.409 -16.941 1.00 0.00 C ATOM 1819 CD GLU A 116 2.831 7.840 -17.989 1.00 0.00 C ATOM 1820 OE1 GLU A 116 2.994 7.448 -19.164 1.00 0.00 O ATOM 1821 OE2 GLU A 116 1.881 8.567 -17.634 1.00 0.00 O ATOM 0 H GLU A 116 4.283 7.126 -14.281 1.00 0.00 H new ATOM 0 HA GLU A 116 4.399 4.459 -15.190 1.00 0.00 H new ATOM 0 HB2 GLU A 116 3.328 5.347 -17.183 1.00 0.00 H new ATOM 0 HB3 GLU A 116 2.629 6.099 -15.762 1.00 0.00 H new ATOM 0 HG2 GLU A 116 3.856 8.142 -16.134 1.00 0.00 H new ATOM 0 HG3 GLU A 116 4.836 7.400 -17.383 1.00 0.00 H new ATOM 1828 N LYS A 117 6.891 6.283 -16.022 1.00 0.00 N ATOM 1829 CA LYS A 117 8.166 6.320 -16.727 1.00 0.00 C ATOM 1830 C LYS A 117 9.171 5.369 -16.084 1.00 0.00 C ATOM 1831 O LYS A 117 10.015 4.788 -16.766 1.00 0.00 O ATOM 1832 CB LYS A 117 8.728 7.743 -16.734 1.00 0.00 C ATOM 1833 CG LYS A 117 7.722 8.792 -17.178 1.00 0.00 C ATOM 1834 CD LYS A 117 6.832 9.233 -16.027 1.00 0.00 C ATOM 1835 CE LYS A 117 6.369 10.671 -16.201 1.00 0.00 C ATOM 1836 NZ LYS A 117 7.505 11.631 -16.139 1.00 0.00 N ATOM 0 H LYS A 117 6.792 6.989 -15.292 1.00 0.00 H new ATOM 0 HA LYS A 117 7.994 5.999 -17.754 1.00 0.00 H new ATOM 0 HB2 LYS A 117 9.080 7.990 -15.733 1.00 0.00 H new ATOM 0 HB3 LYS A 117 9.594 7.779 -17.395 1.00 0.00 H new ATOM 0 HG2 LYS A 117 8.250 9.656 -17.583 1.00 0.00 H new ATOM 0 HG3 LYS A 117 7.106 8.389 -17.982 1.00 0.00 H new ATOM 0 HD2 LYS A 117 5.965 8.576 -15.963 1.00 0.00 H new ATOM 0 HD3 LYS A 117 7.376 9.136 -15.087 1.00 0.00 H new ATOM 0 HE2 LYS A 117 5.858 10.775 -17.158 1.00 0.00 H new ATOM 0 HE3 LYS A 117 5.644 10.916 -15.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 7.161 12.555 -15.806 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 8.227 11.273 -15.481 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 7.922 11.737 -17.086 1.00 0.00 H new ATOM 1850 N GLY A 118 9.073 5.214 -14.768 1.00 0.00 N ATOM 1851 CA GLY A 118 9.979 4.331 -14.055 1.00 0.00 C ATOM 1852 C GLY A 118 10.988 5.090 -13.217 1.00 0.00 C ATOM 1853 O GLY A 118 12.001 4.531 -12.798 1.00 0.00 O ATOM 0 H GLY A 118 8.383 5.684 -14.182 1.00 0.00 H new ATOM 0 HA2 GLY A 118 9.402 3.667 -13.411 1.00 0.00 H new ATOM 0 HA3 GLY A 118 10.507 3.701 -14.771 1.00 0.00 H new ATOM 1857 N GLN A 119 10.711 6.366 -12.972 1.00 0.00 N ATOM 1858 CA GLN A 119 11.604 7.203 -12.179 1.00 0.00 C ATOM 1859 C GLN A 119 11.163 7.240 -10.720 1.00 0.00 C ATOM 1860 O GLN A 119 10.055 6.820 -10.385 1.00 0.00 O ATOM 1861 CB GLN A 119 11.646 8.622 -12.748 1.00 0.00 C ATOM 1862 CG GLN A 119 12.484 8.748 -14.010 1.00 0.00 C ATOM 1863 CD GLN A 119 13.920 8.309 -13.802 1.00 0.00 C ATOM 1864 OE1 GLN A 119 14.694 8.981 -13.120 1.00 0.00 O ATOM 1865 NE2 GLN A 119 14.285 7.177 -14.391 1.00 0.00 N ATOM 0 H GLN A 119 9.876 6.843 -13.311 1.00 0.00 H new ATOM 0 HA GLN A 119 12.603 6.771 -12.226 1.00 0.00 H new ATOM 0 HB2 GLN A 119 10.629 8.948 -12.964 1.00 0.00 H new ATOM 0 HB3 GLN A 119 12.043 9.297 -11.990 1.00 0.00 H new ATOM 0 HG2 GLN A 119 12.035 8.147 -14.801 1.00 0.00 H new ATOM 0 HG3 GLN A 119 12.470 9.784 -14.349 1.00 0.00 H new ATOM 0 HE21 GLN A 119 13.611 6.651 -14.948 1.00 0.00 H new ATOM 0 HE22 GLN A 119 15.240 6.833 -14.287 1.00 0.00 H new ATOM 1874 N ASP A 120 12.037 7.745 -9.855 1.00 0.00 N ATOM 1875 CA ASP A 120 11.737 7.837 -8.431 1.00 0.00 C ATOM 1876 C ASP A 120 10.855 9.047 -8.139 1.00 0.00 C ATOM 1877 O ASP A 120 11.337 10.178 -8.069 1.00 0.00 O ATOM 1878 CB ASP A 120 13.031 7.926 -7.621 1.00 0.00 C ATOM 1879 CG ASP A 120 14.030 8.891 -8.229 1.00 0.00 C ATOM 1880 OD1 ASP A 120 13.594 9.864 -8.879 1.00 0.00 O ATOM 1881 OD2 ASP A 120 15.248 8.673 -8.056 1.00 0.00 O ATOM 0 H ASP A 120 12.958 8.097 -10.115 1.00 0.00 H new ATOM 0 HA ASP A 120 11.196 6.937 -8.139 1.00 0.00 H new ATOM 0 HB2 ASP A 120 12.798 8.241 -6.604 1.00 0.00 H new ATOM 0 HB3 ASP A 120 13.482 6.936 -7.552 1.00 0.00 H new ATOM 1886 N THR A 121 9.559 8.802 -7.970 1.00 0.00 N ATOM 1887 CA THR A 121 8.610 9.870 -7.687 1.00 0.00 C ATOM 1888 C THR A 121 8.936 10.561 -6.368 1.00 0.00 C ATOM 1889 O THR A 121 8.830 11.782 -6.253 1.00 0.00 O ATOM 1890 CB THR A 121 7.165 9.338 -7.632 1.00 0.00 C ATOM 1891 OG1 THR A 121 7.008 8.464 -6.508 1.00 0.00 O ATOM 1892 CG2 THR A 121 6.812 8.595 -8.912 1.00 0.00 C ATOM 0 H THR A 121 9.143 7.872 -8.024 1.00 0.00 H new ATOM 0 HA THR A 121 8.693 10.590 -8.501 1.00 0.00 H new ATOM 0 HB THR A 121 6.492 10.189 -7.528 1.00 0.00 H new ATOM 0 HG1 THR A 121 7.504 7.634 -6.667 1.00 0.00 H new ATOM 0 HG21 THR A 121 5.787 8.229 -8.849 1.00 0.00 H new ATOM 0 HG22 THR A 121 6.905 9.271 -9.762 1.00 0.00 H new ATOM 0 HG23 THR A 121 7.491 7.752 -9.043 1.00 0.00 H new ATOM 1900 N GLY A 122 9.334 9.773 -5.375 1.00 0.00 N ATOM 1901 CA GLY A 122 9.670 10.327 -4.076 1.00 0.00 C ATOM 1902 C GLY A 122 8.608 10.044 -3.032 1.00 0.00 C ATOM 1903 O GLY A 122 8.584 10.674 -1.975 1.00 0.00 O ATOM 0 H GLY A 122 9.430 8.760 -5.446 1.00 0.00 H new ATOM 0 HA2 GLY A 122 10.622 9.913 -3.743 1.00 0.00 H new ATOM 0 HA3 GLY A 122 9.806 11.405 -4.168 1.00 0.00 H new ATOM 1907 N ALA A 123 7.726 9.095 -3.329 1.00 0.00 N ATOM 1908 CA ALA A 123 6.657 8.730 -2.408 1.00 0.00 C ATOM 1909 C ALA A 123 6.880 7.335 -1.834 1.00 0.00 C ATOM 1910 O ALA A 123 7.163 6.388 -2.567 1.00 0.00 O ATOM 1911 CB ALA A 123 5.309 8.805 -3.109 1.00 0.00 C ATOM 0 H ALA A 123 7.731 8.565 -4.201 1.00 0.00 H new ATOM 0 HA ALA A 123 6.664 9.440 -1.581 1.00 0.00 H new ATOM 0 HB1 ALA A 123 4.519 8.530 -2.410 1.00 0.00 H new ATOM 0 HB2 ALA A 123 5.140 9.821 -3.465 1.00 0.00 H new ATOM 0 HB3 ALA A 123 5.300 8.118 -3.955 1.00 0.00 H new ATOM 1917 N THR A 124 6.752 7.216 -0.516 1.00 0.00 N ATOM 1918 CA THR A 124 6.942 5.937 0.158 1.00 0.00 C ATOM 1919 C THR A 124 5.664 5.490 0.858 1.00 0.00 C ATOM 1920 O THR A 124 4.978 6.294 1.490 1.00 0.00 O ATOM 1921 CB THR A 124 8.081 6.010 1.191 1.00 0.00 C ATOM 1922 OG1 THR A 124 7.677 6.805 2.312 1.00 0.00 O ATOM 1923 CG2 THR A 124 9.338 6.602 0.571 1.00 0.00 C ATOM 0 H THR A 124 6.518 7.990 0.106 1.00 0.00 H new ATOM 0 HA THR A 124 7.205 5.211 -0.611 1.00 0.00 H new ATOM 0 HB THR A 124 8.302 4.996 1.526 1.00 0.00 H new ATOM 0 HG1 THR A 124 8.407 6.845 2.965 1.00 0.00 H new ATOM 0 HG21 THR A 124 10.129 6.643 1.320 1.00 0.00 H new ATOM 0 HG22 THR A 124 9.661 5.979 -0.263 1.00 0.00 H new ATOM 0 HG23 THR A 124 9.127 7.609 0.211 1.00 0.00 H new ATOM 1931 N ILE A 125 5.350 4.204 0.742 1.00 0.00 N ATOM 1932 CA ILE A 125 4.155 3.651 1.366 1.00 0.00 C ATOM 1933 C ILE A 125 4.463 2.337 2.076 1.00 0.00 C ATOM 1934 O ILE A 125 5.140 1.467 1.528 1.00 0.00 O ATOM 1935 CB ILE A 125 3.039 3.412 0.331 1.00 0.00 C ATOM 1936 CG1 ILE A 125 1.822 2.770 1.001 1.00 0.00 C ATOM 1937 CG2 ILE A 125 3.548 2.537 -0.805 1.00 0.00 C ATOM 1938 CD1 ILE A 125 0.585 2.767 0.130 1.00 0.00 C ATOM 0 H ILE A 125 5.907 3.526 0.222 1.00 0.00 H new ATOM 0 HA ILE A 125 3.812 4.384 2.096 1.00 0.00 H new ATOM 0 HB ILE A 125 2.737 4.373 -0.085 1.00 0.00 H new ATOM 0 HG12 ILE A 125 2.067 1.744 1.274 1.00 0.00 H new ATOM 0 HG13 ILE A 125 1.604 3.303 1.927 1.00 0.00 H new ATOM 0 HG21 ILE A 125 2.748 2.377 -1.528 1.00 0.00 H new ATOM 0 HG22 ILE A 125 4.387 3.030 -1.296 1.00 0.00 H new ATOM 0 HG23 ILE A 125 3.874 1.576 -0.406 1.00 0.00 H new ATOM 0 HD11 ILE A 125 -0.238 2.297 0.668 1.00 0.00 H new ATOM 0 HD12 ILE A 125 0.315 3.793 -0.122 1.00 0.00 H new ATOM 0 HD13 ILE A 125 0.785 2.209 -0.785 1.00 0.00 H new ATOM 1950 N ASP A 126 3.962 2.200 3.298 1.00 0.00 N ATOM 1951 CA ASP A 126 4.181 0.991 4.084 1.00 0.00 C ATOM 1952 C ASP A 126 3.094 -0.043 3.805 1.00 0.00 C ATOM 1953 O ASP A 126 1.928 0.304 3.611 1.00 0.00 O ATOM 1954 CB ASP A 126 4.214 1.325 5.576 1.00 0.00 C ATOM 1955 CG ASP A 126 5.100 2.517 5.883 1.00 0.00 C ATOM 1956 OD1 ASP A 126 4.690 3.656 5.578 1.00 0.00 O ATOM 1957 OD2 ASP A 126 6.204 2.309 6.429 1.00 0.00 O ATOM 0 H ASP A 126 3.401 2.911 3.767 1.00 0.00 H new ATOM 0 HA ASP A 126 5.143 0.568 3.794 1.00 0.00 H new ATOM 0 HB2 ASP A 126 3.201 1.530 5.922 1.00 0.00 H new ATOM 0 HB3 ASP A 126 4.571 0.458 6.132 1.00 0.00 H new ATOM 1962 N LEU A 127 3.484 -1.313 3.787 1.00 0.00 N ATOM 1963 CA LEU A 127 2.543 -2.398 3.531 1.00 0.00 C ATOM 1964 C LEU A 127 2.991 -3.681 4.223 1.00 0.00 C ATOM 1965 O LEU A 127 4.185 -3.965 4.314 1.00 0.00 O ATOM 1966 CB LEU A 127 2.407 -2.637 2.026 1.00 0.00 C ATOM 1967 CG LEU A 127 2.041 -1.415 1.183 1.00 0.00 C ATOM 1968 CD1 LEU A 127 2.330 -1.676 -0.288 1.00 0.00 C ATOM 1969 CD2 LEU A 127 0.578 -1.047 1.383 1.00 0.00 C ATOM 0 H LEU A 127 4.445 -1.617 3.947 1.00 0.00 H new ATOM 0 HA LEU A 127 1.573 -2.108 3.935 1.00 0.00 H new ATOM 0 HB2 LEU A 127 3.350 -3.040 1.656 1.00 0.00 H new ATOM 0 HB3 LEU A 127 1.648 -3.404 1.867 1.00 0.00 H new ATOM 0 HG LEU A 127 2.654 -0.575 1.510 1.00 0.00 H new ATOM 0 HD11 LEU A 127 2.063 -0.796 -0.873 1.00 0.00 H new ATOM 0 HD12 LEU A 127 3.391 -1.890 -0.418 1.00 0.00 H new ATOM 0 HD13 LEU A 127 1.743 -2.529 -0.628 1.00 0.00 H new ATOM 0 HD21 LEU A 127 0.336 -0.175 0.775 1.00 0.00 H new ATOM 0 HD22 LEU A 127 -0.052 -1.885 1.084 1.00 0.00 H new ATOM 0 HD23 LEU A 127 0.401 -0.817 2.434 1.00 0.00 H new ATOM 1981 N VAL A 128 2.024 -4.455 4.707 1.00 0.00 N ATOM 1982 CA VAL A 128 2.318 -5.710 5.388 1.00 0.00 C ATOM 1983 C VAL A 128 1.540 -6.866 4.770 1.00 0.00 C ATOM 1984 O VAL A 128 0.367 -7.075 5.082 1.00 0.00 O ATOM 1985 CB VAL A 128 1.985 -5.626 6.889 1.00 0.00 C ATOM 1986 CG1 VAL A 128 2.408 -6.901 7.603 1.00 0.00 C ATOM 1987 CG2 VAL A 128 2.649 -4.409 7.515 1.00 0.00 C ATOM 0 H VAL A 128 1.030 -4.234 4.640 1.00 0.00 H new ATOM 0 HA VAL A 128 3.386 -5.891 5.270 1.00 0.00 H new ATOM 0 HB VAL A 128 0.906 -5.519 6.998 1.00 0.00 H new ATOM 0 HG11 VAL A 128 2.165 -6.823 8.663 1.00 0.00 H new ATOM 0 HG12 VAL A 128 1.881 -7.752 7.171 1.00 0.00 H new ATOM 0 HG13 VAL A 128 3.482 -7.043 7.487 1.00 0.00 H new ATOM 0 HG21 VAL A 128 2.403 -4.366 8.576 1.00 0.00 H new ATOM 0 HG22 VAL A 128 3.730 -4.483 7.396 1.00 0.00 H new ATOM 0 HG23 VAL A 128 2.291 -3.505 7.022 1.00 0.00 H new ATOM 1997 N ILE A 129 2.200 -7.614 3.892 1.00 0.00 N ATOM 1998 CA ILE A 129 1.571 -8.750 3.231 1.00 0.00 C ATOM 1999 C ILE A 129 1.833 -10.044 3.994 1.00 0.00 C ATOM 2000 O ILE A 129 2.941 -10.281 4.472 1.00 0.00 O ATOM 2001 CB ILE A 129 2.073 -8.909 1.784 1.00 0.00 C ATOM 2002 CG1 ILE A 129 2.128 -7.548 1.087 1.00 0.00 C ATOM 2003 CG2 ILE A 129 1.178 -9.868 1.014 1.00 0.00 C ATOM 2004 CD1 ILE A 129 3.147 -7.481 -0.029 1.00 0.00 C ATOM 0 H ILE A 129 3.170 -7.453 3.622 1.00 0.00 H new ATOM 0 HA ILE A 129 0.499 -8.551 3.215 1.00 0.00 H new ATOM 0 HB ILE A 129 3.080 -9.324 1.809 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.143 -7.316 0.683 1.00 0.00 H new ATOM 0 HG13 ILE A 129 2.359 -6.780 1.825 1.00 0.00 H new ATOM 0 HG21 ILE A 129 1.546 -9.969 -0.007 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.186 -10.843 1.501 1.00 0.00 H new ATOM 0 HG23 ILE A 129 0.160 -9.480 0.995 1.00 0.00 H new ATOM 0 HD11 ILE A 129 3.131 -6.488 -0.478 1.00 0.00 H new ATOM 0 HD12 ILE A 129 4.140 -7.681 0.373 1.00 0.00 H new ATOM 0 HD13 ILE A 129 2.905 -8.226 -0.787 1.00 0.00 H new ATOM 2016 N GLY A 130 0.805 -10.881 4.101 1.00 0.00 N ATOM 2017 CA GLY A 130 0.945 -12.142 4.805 1.00 0.00 C ATOM 2018 C GLY A 130 0.528 -13.328 3.958 1.00 0.00 C ATOM 2019 O GLY A 130 -0.589 -13.369 3.442 1.00 0.00 O ATOM 0 H GLY A 130 -0.122 -10.708 3.713 1.00 0.00 H new ATOM 0 HA2 GLY A 130 1.982 -12.268 5.116 1.00 0.00 H new ATOM 0 HA3 GLY A 130 0.341 -12.117 5.712 1.00 0.00 H new ATOM 2023 N TYR A 131 1.428 -14.294 3.813 1.00 0.00 N ATOM 2024 CA TYR A 131 1.149 -15.485 3.019 1.00 0.00 C ATOM 2025 C TYR A 131 0.643 -16.622 3.901 1.00 0.00 C ATOM 2026 O TYR A 131 1.070 -16.772 5.046 1.00 0.00 O ATOM 2027 CB TYR A 131 2.406 -15.928 2.268 1.00 0.00 C ATOM 2028 CG TYR A 131 2.337 -17.350 1.759 1.00 0.00 C ATOM 2029 CD1 TYR A 131 1.286 -17.770 0.953 1.00 0.00 C ATOM 2030 CD2 TYR A 131 3.323 -18.274 2.084 1.00 0.00 C ATOM 2031 CE1 TYR A 131 1.218 -19.068 0.486 1.00 0.00 C ATOM 2032 CE2 TYR A 131 3.264 -19.574 1.620 1.00 0.00 C ATOM 2033 CZ TYR A 131 2.210 -19.966 0.821 1.00 0.00 C ATOM 2034 OH TYR A 131 2.147 -21.261 0.358 1.00 0.00 O ATOM 0 H TYR A 131 2.357 -14.276 4.235 1.00 0.00 H new ATOM 0 HA TYR A 131 0.371 -15.236 2.297 1.00 0.00 H new ATOM 0 HB2 TYR A 131 2.571 -15.257 1.425 1.00 0.00 H new ATOM 0 HB3 TYR A 131 3.268 -15.829 2.928 1.00 0.00 H new ATOM 0 HD1 TYR A 131 0.509 -17.069 0.687 1.00 0.00 H new ATOM 0 HD2 TYR A 131 4.149 -17.971 2.710 1.00 0.00 H new ATOM 0 HE1 TYR A 131 0.393 -19.378 -0.138 1.00 0.00 H new ATOM 0 HE2 TYR A 131 4.039 -20.279 1.881 1.00 0.00 H new ATOM 0 HH TYR A 131 3.048 -21.646 0.340 1.00 0.00 H new ATOM 2044 N ASP A 132 -0.270 -17.420 3.359 1.00 0.00 N ATOM 2045 CA ASP A 132 -0.835 -18.546 4.095 1.00 0.00 C ATOM 2046 C ASP A 132 -1.139 -19.710 3.157 1.00 0.00 C ATOM 2047 O ASP A 132 -2.000 -19.625 2.281 1.00 0.00 O ATOM 2048 CB ASP A 132 -2.108 -18.117 4.826 1.00 0.00 C ATOM 2049 CG ASP A 132 -2.640 -19.199 5.745 1.00 0.00 C ATOM 2050 OD1 ASP A 132 -3.404 -20.063 5.265 1.00 0.00 O ATOM 2051 OD2 ASP A 132 -2.292 -19.182 6.944 1.00 0.00 O ATOM 0 H ASP A 132 -0.635 -17.309 2.413 1.00 0.00 H new ATOM 0 HA ASP A 132 -0.099 -18.876 4.828 1.00 0.00 H new ATOM 0 HB2 ASP A 132 -1.904 -17.218 5.408 1.00 0.00 H new ATOM 0 HB3 ASP A 132 -2.873 -17.857 4.095 1.00 0.00 H new ATOM 2056 N PRO A 133 -0.416 -20.824 3.343 1.00 0.00 N ATOM 2057 CA PRO A 133 -0.591 -22.027 2.523 1.00 0.00 C ATOM 2058 C PRO A 133 -1.919 -22.726 2.794 1.00 0.00 C ATOM 2059 O PRO A 133 -2.385 -22.806 3.931 1.00 0.00 O ATOM 2060 CB PRO A 133 0.579 -22.918 2.948 1.00 0.00 C ATOM 2061 CG PRO A 133 0.913 -22.472 4.329 1.00 0.00 C ATOM 2062 CD PRO A 133 0.626 -20.996 4.368 1.00 0.00 C ATOM 0 HA PRO A 133 -0.604 -21.796 1.458 1.00 0.00 H new ATOM 0 HB2 PRO A 133 0.301 -23.972 2.929 1.00 0.00 H new ATOM 0 HB3 PRO A 133 1.430 -22.800 2.277 1.00 0.00 H new ATOM 0 HG2 PRO A 133 0.314 -23.006 5.067 1.00 0.00 H new ATOM 0 HG3 PRO A 133 1.959 -22.673 4.562 1.00 0.00 H new ATOM 0 HD2 PRO A 133 0.278 -20.680 5.352 1.00 0.00 H new ATOM 0 HD3 PRO A 133 1.515 -20.408 4.140 1.00 0.00 H new ATOM 2070 N PRO A 134 -2.544 -23.244 1.727 1.00 0.00 N ATOM 2071 CA PRO A 134 -3.827 -23.946 1.825 1.00 0.00 C ATOM 2072 C PRO A 134 -3.698 -25.294 2.526 1.00 0.00 C ATOM 2073 O PRO A 134 -2.659 -25.949 2.447 1.00 0.00 O ATOM 2074 CB PRO A 134 -4.237 -24.141 0.363 1.00 0.00 C ATOM 2075 CG PRO A 134 -2.955 -24.130 -0.395 1.00 0.00 C ATOM 2076 CD PRO A 134 -2.047 -23.185 0.342 1.00 0.00 C ATOM 0 HA PRO A 134 -4.553 -23.387 2.415 1.00 0.00 H new ATOM 0 HB2 PRO A 134 -4.771 -25.081 0.224 1.00 0.00 H new ATOM 0 HB3 PRO A 134 -4.901 -23.344 0.029 1.00 0.00 H new ATOM 0 HG2 PRO A 134 -2.522 -25.129 -0.444 1.00 0.00 H new ATOM 0 HG3 PRO A 134 -3.112 -23.800 -1.422 1.00 0.00 H new ATOM 0 HD2 PRO A 134 -1.004 -23.496 0.276 1.00 0.00 H new ATOM 0 HD3 PRO A 134 -2.105 -22.175 -0.063 1.00 0.00 H new