USER MOD reduce.3.24.130724 H: found=0, std=0, add=954, rem=0, adj=17 USER MOD reduce.3.24.130724 removed 957 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 9 HIS : no HE2:sc= -4.69! C(o=-4.1!,f=-11!) USER MOD Set 1.2: A 65 TYR OH : rot 36:sc= 0.548 USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 6 TYR OH : rot 180:sc= -0.153 USER MOD Single : A 10 THR OG1 : rot 180:sc= 0 USER MOD Single : A 14 GLN : amide:sc= -0.0638 X(o=-0.064,f=-0.18) USER MOD Single : A 17 LYS NZ :NH3+ -157:sc= -0.204 (180deg=-0.953) USER MOD Single : A 19 LYS NZ :NH3+ -177:sc= 0.0323 (180deg=0.0307) USER MOD Single : A 21 ASN : amide:sc= 0.673 K(o=0.67,f=0) USER MOD Single : A 24 LYS NZ :NH3+ -160:sc= -0.0656 (180deg=-0.195) USER MOD Single : A 27 LYS NZ :NH3+ -168:sc= 0 (180deg=-0.124) USER MOD Single : A 32 GLN : amide:sc= -0.338 X(o=-0.34,f=-0.01) USER MOD Single : A 34 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 42 THR OG1 : rot 13:sc= 0.111! USER MOD Single : A 53 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 60 LYS NZ :NH3+ -144:sc= -0.259 (180deg=-1.91!) USER MOD Single : A 69 GLN : amide:sc= -3.69 K(o=-3.7,f=-4.6!) USER MOD Single : A 70 MET CE :methyl 143:sc= -1.07 (180deg=-2.45!) USER MOD Single : A 79 ASN : amide:sc= -4.87! C(o=-4.9!,f=-15!) USER MOD Single : A 88 THR OG1 : rot 36:sc= -0.761 USER MOD Single : A 92 THR OG1 : rot 180:sc= 0.00343 USER MOD Single : A 99 MET CE :methyl 170:sc= -0.0337 (180deg=-0.162) USER MOD Single : A 105 SER OG : rot 180:sc= 0 USER MOD Single : A 111 HIS : no HD1:sc= -0.0677 X(o=-0.068,f=0) USER MOD Single : A 116 SER OG : rot 73:sc= -4.32! USER MOD ----------------------------------------------------------------- ATOM 1 N SER A 2 -1.241 7.960 -12.272 1.00 0.00 N ATOM 2 CA SER A 2 -0.148 8.919 -11.962 1.00 0.00 C ATOM 3 C SER A 2 0.468 8.631 -10.597 1.00 0.00 C ATOM 4 O SER A 2 1.649 8.892 -10.370 1.00 0.00 O ATOM 5 CB SER A 2 -0.721 10.337 -11.994 1.00 0.00 C ATOM 6 OG SER A 2 0.313 11.304 -12.054 1.00 0.00 O ATOM 0 HA SER A 2 0.641 8.815 -12.706 1.00 0.00 H new ATOM 0 HB2 SER A 2 -1.377 10.448 -12.857 1.00 0.00 H new ATOM 0 HB3 SER A 2 -1.330 10.506 -11.106 1.00 0.00 H new ATOM 0 HG SER A 2 -0.079 12.202 -12.075 1.00 0.00 H new ATOM 14 N ILE A 3 -0.340 8.088 -9.691 1.00 0.00 N ATOM 15 CA ILE A 3 0.130 7.766 -8.348 1.00 0.00 C ATOM 16 C ILE A 3 0.904 6.448 -8.343 1.00 0.00 C ATOM 17 O ILE A 3 1.265 5.931 -9.401 1.00 0.00 O ATOM 18 CB ILE A 3 -1.037 7.699 -7.333 1.00 0.00 C ATOM 19 CG1 ILE A 3 -1.822 6.388 -7.462 1.00 0.00 C ATOM 20 CG2 ILE A 3 -1.965 8.891 -7.518 1.00 0.00 C ATOM 21 CD1 ILE A 3 -2.560 6.243 -8.775 1.00 0.00 C ATOM 0 H ILE A 3 -1.320 7.862 -9.862 1.00 0.00 H new ATOM 0 HA ILE A 3 0.799 8.570 -8.041 1.00 0.00 H new ATOM 0 HB ILE A 3 -0.609 7.732 -6.331 1.00 0.00 H new ATOM 0 HG12 ILE A 3 -1.133 5.551 -7.349 1.00 0.00 H new ATOM 0 HG13 ILE A 3 -2.539 6.323 -6.644 1.00 0.00 H new ATOM 0 HG21 ILE A 3 -2.781 8.832 -6.798 1.00 0.00 H new ATOM 0 HG22 ILE A 3 -1.408 9.814 -7.359 1.00 0.00 H new ATOM 0 HG23 ILE A 3 -2.372 8.882 -8.529 1.00 0.00 H new ATOM 0 HD11 ILE A 3 -3.091 5.291 -8.791 1.00 0.00 H new ATOM 0 HD12 ILE A 3 -3.275 7.059 -8.883 1.00 0.00 H new ATOM 0 HD13 ILE A 3 -1.847 6.274 -9.599 1.00 0.00 H new ATOM 33 N GLU A 4 1.163 5.911 -7.154 1.00 0.00 N ATOM 34 CA GLU A 4 1.900 4.657 -7.038 1.00 0.00 C ATOM 35 C GLU A 4 1.541 3.906 -5.759 1.00 0.00 C ATOM 36 O GLU A 4 1.083 4.499 -4.778 1.00 0.00 O ATOM 37 CB GLU A 4 3.406 4.925 -7.075 1.00 0.00 C ATOM 38 CG GLU A 4 4.196 3.853 -7.807 1.00 0.00 C ATOM 39 CD GLU A 4 4.632 4.291 -9.191 1.00 0.00 C ATOM 40 OE1 GLU A 4 5.598 5.076 -9.289 1.00 0.00 O ATOM 41 OE2 GLU A 4 4.004 3.851 -10.177 1.00 0.00 O ATOM 0 H GLU A 4 0.876 6.320 -6.265 1.00 0.00 H new ATOM 0 HA GLU A 4 1.619 4.031 -7.885 1.00 0.00 H new ATOM 0 HB2 GLU A 4 3.584 5.887 -7.555 1.00 0.00 H new ATOM 0 HB3 GLU A 4 3.778 5.005 -6.053 1.00 0.00 H new ATOM 0 HG2 GLU A 4 5.076 3.591 -7.219 1.00 0.00 H new ATOM 0 HG3 GLU A 4 3.588 2.952 -7.890 1.00 0.00 H new ATOM 48 N TRP A 5 1.758 2.594 -5.781 1.00 0.00 N ATOM 49 CA TRP A 5 1.466 1.744 -4.632 1.00 0.00 C ATOM 50 C TRP A 5 2.717 1.535 -3.786 1.00 0.00 C ATOM 51 O TRP A 5 3.532 0.658 -4.069 1.00 0.00 O ATOM 52 CB TRP A 5 0.922 0.392 -5.095 1.00 0.00 C ATOM 53 CG TRP A 5 -0.502 0.451 -5.559 1.00 0.00 C ATOM 54 CD1 TRP A 5 -0.940 0.677 -6.832 1.00 0.00 C ATOM 55 CD2 TRP A 5 -1.671 0.283 -4.754 1.00 0.00 C ATOM 56 NE1 TRP A 5 -2.313 0.657 -6.868 1.00 0.00 N ATOM 57 CE2 TRP A 5 -2.786 0.416 -5.603 1.00 0.00 C ATOM 58 CE3 TRP A 5 -1.887 0.029 -3.398 1.00 0.00 C ATOM 59 CZ2 TRP A 5 -4.095 0.306 -5.139 1.00 0.00 C ATOM 60 CZ3 TRP A 5 -3.185 -0.080 -2.937 1.00 0.00 C ATOM 61 CH2 TRP A 5 -4.274 0.058 -3.807 1.00 0.00 C ATOM 0 H TRP A 5 2.137 2.095 -6.586 1.00 0.00 H new ATOM 0 HA TRP A 5 0.711 2.242 -4.024 1.00 0.00 H new ATOM 0 HB2 TRP A 5 1.546 0.016 -5.906 1.00 0.00 H new ATOM 0 HB3 TRP A 5 1.000 -0.323 -4.276 1.00 0.00 H new ATOM 0 HD1 TRP A 5 -0.301 0.847 -7.686 1.00 0.00 H new ATOM 0 HE1 TRP A 5 -2.887 0.798 -7.699 1.00 0.00 H new ATOM 0 HE3 TRP A 5 -1.053 -0.080 -2.721 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 -4.937 0.413 -5.807 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 -3.363 -0.275 -1.890 1.00 0.00 H new ATOM 0 HH2 TRP A 5 -5.277 -0.034 -3.417 1.00 0.00 H new ATOM 72 N TYR A 6 2.864 2.349 -2.747 1.00 0.00 N ATOM 73 CA TYR A 6 4.017 2.256 -1.861 1.00 0.00 C ATOM 74 C TYR A 6 3.806 1.181 -0.801 1.00 0.00 C ATOM 75 O TYR A 6 2.914 1.291 0.040 1.00 0.00 O ATOM 76 CB TYR A 6 4.281 3.606 -1.196 1.00 0.00 C ATOM 77 CG TYR A 6 5.076 4.556 -2.061 1.00 0.00 C ATOM 78 CD1 TYR A 6 4.445 5.386 -2.978 1.00 0.00 C ATOM 79 CD2 TYR A 6 6.460 4.615 -1.965 1.00 0.00 C ATOM 80 CE1 TYR A 6 5.171 6.252 -3.773 1.00 0.00 C ATOM 81 CE2 TYR A 6 7.193 5.476 -2.756 1.00 0.00 C ATOM 82 CZ TYR A 6 6.546 6.292 -3.658 1.00 0.00 C ATOM 83 OH TYR A 6 7.273 7.152 -4.450 1.00 0.00 O ATOM 0 H TYR A 6 2.199 3.081 -2.498 1.00 0.00 H new ATOM 0 HA TYR A 6 4.884 1.978 -2.460 1.00 0.00 H new ATOM 0 HB2 TYR A 6 3.328 4.070 -0.941 1.00 0.00 H new ATOM 0 HB3 TYR A 6 4.817 3.443 -0.261 1.00 0.00 H new ATOM 0 HD1 TYR A 6 3.370 5.354 -3.071 1.00 0.00 H new ATOM 0 HD2 TYR A 6 6.971 3.977 -1.260 1.00 0.00 H new ATOM 0 HE1 TYR A 6 4.666 6.894 -4.480 1.00 0.00 H new ATOM 0 HE2 TYR A 6 8.269 5.510 -2.668 1.00 0.00 H new ATOM 0 HH TYR A 6 8.227 7.058 -4.245 1.00 0.00 H new ATOM 93 N ALA A 7 4.630 0.140 -0.850 1.00 0.00 N ATOM 94 CA ALA A 7 4.535 -0.955 0.106 1.00 0.00 C ATOM 95 C ALA A 7 5.665 -0.896 1.127 1.00 0.00 C ATOM 96 O ALA A 7 6.829 -0.712 0.768 1.00 0.00 O ATOM 97 CB ALA A 7 4.546 -2.293 -0.620 1.00 0.00 C ATOM 0 H ALA A 7 5.371 0.032 -1.542 1.00 0.00 H new ATOM 0 HA ALA A 7 3.592 -0.852 0.643 1.00 0.00 H new ATOM 0 HB1 ALA A 7 4.474 -3.102 0.107 1.00 0.00 H new ATOM 0 HB2 ALA A 7 3.698 -2.343 -1.303 1.00 0.00 H new ATOM 0 HB3 ALA A 7 5.473 -2.393 -1.184 1.00 0.00 H new ATOM 103 N VAL A 8 5.315 -1.050 2.399 1.00 0.00 N ATOM 104 CA VAL A 8 6.302 -1.013 3.473 1.00 0.00 C ATOM 105 C VAL A 8 6.175 -2.236 4.375 1.00 0.00 C ATOM 106 O VAL A 8 5.148 -2.916 4.376 1.00 0.00 O ATOM 107 CB VAL A 8 6.158 0.261 4.330 1.00 0.00 C ATOM 108 CG1 VAL A 8 7.383 0.450 5.213 1.00 0.00 C ATOM 109 CG2 VAL A 8 5.938 1.480 3.445 1.00 0.00 C ATOM 0 H VAL A 8 4.356 -1.202 2.712 1.00 0.00 H new ATOM 0 HA VAL A 8 7.284 -1.012 3.000 1.00 0.00 H new ATOM 0 HB VAL A 8 5.286 0.147 4.974 1.00 0.00 H new ATOM 0 HG11 VAL A 8 7.265 1.354 5.811 1.00 0.00 H new ATOM 0 HG12 VAL A 8 7.492 -0.410 5.873 1.00 0.00 H new ATOM 0 HG13 VAL A 8 8.271 0.542 4.588 1.00 0.00 H new ATOM 0 HG21 VAL A 8 5.839 2.369 4.068 1.00 0.00 H new ATOM 0 HG22 VAL A 8 6.788 1.601 2.774 1.00 0.00 H new ATOM 0 HG23 VAL A 8 5.029 1.345 2.859 1.00 0.00 H new ATOM 119 N HIS A 9 7.229 -2.511 5.140 1.00 0.00 N ATOM 120 CA HIS A 9 7.239 -3.654 6.046 1.00 0.00 C ATOM 121 C HIS A 9 6.705 -3.264 7.421 1.00 0.00 C ATOM 122 O HIS A 9 6.680 -2.086 7.778 1.00 0.00 O ATOM 123 CB HIS A 9 8.656 -4.213 6.178 1.00 0.00 C ATOM 124 CG HIS A 9 9.107 -4.985 4.978 1.00 0.00 C ATOM 125 ND1 HIS A 9 9.552 -6.289 5.044 1.00 0.00 N ATOM 126 CD2 HIS A 9 9.176 -4.633 3.671 1.00 0.00 C ATOM 127 CE1 HIS A 9 9.876 -6.704 3.833 1.00 0.00 C ATOM 128 NE2 HIS A 9 9.657 -5.718 2.982 1.00 0.00 N ATOM 0 H HIS A 9 8.086 -1.958 5.150 1.00 0.00 H new ATOM 0 HA HIS A 9 6.589 -4.423 5.628 1.00 0.00 H new ATOM 0 HB2 HIS A 9 9.348 -3.389 6.352 1.00 0.00 H new ATOM 0 HB3 HIS A 9 8.703 -4.859 7.055 1.00 0.00 H new ATOM 0 HD1 HIS A 9 9.620 -6.846 5.896 1.00 0.00 H new ATOM 0 HD2 HIS A 9 8.903 -3.677 3.250 1.00 0.00 H new ATOM 0 HE1 HIS A 9 10.256 -7.683 3.581 1.00 0.00 H new ATOM 137 N THR A 10 6.279 -4.263 8.190 1.00 0.00 N ATOM 138 CA THR A 10 5.746 -4.024 9.527 1.00 0.00 C ATOM 139 C THR A 10 5.962 -5.240 10.424 1.00 0.00 C ATOM 140 O THR A 10 6.608 -6.210 10.028 1.00 0.00 O ATOM 141 CB THR A 10 4.256 -3.689 9.454 1.00 0.00 C ATOM 142 OG1 THR A 10 3.515 -4.795 8.973 1.00 0.00 O ATOM 143 CG2 THR A 10 3.951 -2.508 8.558 1.00 0.00 C ATOM 0 H THR A 10 6.293 -5.244 7.910 1.00 0.00 H new ATOM 0 HA THR A 10 6.280 -3.177 9.957 1.00 0.00 H new ATOM 0 HB THR A 10 3.968 -3.435 10.474 1.00 0.00 H new ATOM 0 HG1 THR A 10 2.564 -4.560 8.936 1.00 0.00 H new ATOM 0 HG21 THR A 10 2.877 -2.324 8.551 1.00 0.00 H new ATOM 0 HG22 THR A 10 4.468 -1.624 8.932 1.00 0.00 H new ATOM 0 HG23 THR A 10 4.289 -2.724 7.544 1.00 0.00 H new ATOM 151 N LEU A 11 5.413 -5.181 11.634 1.00 0.00 N ATOM 152 CA LEU A 11 5.544 -6.276 12.588 1.00 0.00 C ATOM 153 C LEU A 11 4.464 -7.329 12.359 1.00 0.00 C ATOM 154 O LEU A 11 3.308 -6.998 12.098 1.00 0.00 O ATOM 155 CB LEU A 11 5.461 -5.744 14.020 1.00 0.00 C ATOM 156 CG LEU A 11 6.414 -6.408 15.016 1.00 0.00 C ATOM 157 CD1 LEU A 11 6.029 -7.863 15.231 1.00 0.00 C ATOM 158 CD2 LEU A 11 7.850 -6.299 14.529 1.00 0.00 C ATOM 0 H LEU A 11 4.873 -4.386 11.976 1.00 0.00 H new ATOM 0 HA LEU A 11 6.517 -6.743 12.438 1.00 0.00 H new ATOM 0 HB2 LEU A 11 5.664 -4.673 14.005 1.00 0.00 H new ATOM 0 HB3 LEU A 11 4.440 -5.870 14.379 1.00 0.00 H new ATOM 0 HG LEU A 11 6.335 -5.889 15.971 1.00 0.00 H new ATOM 0 HD11 LEU A 11 6.717 -8.320 15.942 1.00 0.00 H new ATOM 0 HD12 LEU A 11 5.013 -7.917 15.623 1.00 0.00 H new ATOM 0 HD13 LEU A 11 6.080 -8.397 14.282 1.00 0.00 H new ATOM 0 HD21 LEU A 11 8.515 -6.776 15.249 1.00 0.00 H new ATOM 0 HD22 LEU A 11 7.945 -6.794 13.563 1.00 0.00 H new ATOM 0 HD23 LEU A 11 8.120 -5.248 14.426 1.00 0.00 H new ATOM 170 N VAL A 12 4.849 -8.596 12.460 1.00 0.00 N ATOM 171 CA VAL A 12 3.913 -9.697 12.265 1.00 0.00 C ATOM 172 C VAL A 12 2.883 -9.749 13.388 1.00 0.00 C ATOM 173 O VAL A 12 3.237 -9.861 14.563 1.00 0.00 O ATOM 174 CB VAL A 12 4.645 -11.050 12.192 1.00 0.00 C ATOM 175 CG1 VAL A 12 3.682 -12.157 11.789 1.00 0.00 C ATOM 176 CG2 VAL A 12 5.815 -10.974 11.224 1.00 0.00 C ATOM 0 H VAL A 12 5.803 -8.886 12.676 1.00 0.00 H new ATOM 0 HA VAL A 12 3.405 -9.516 11.318 1.00 0.00 H new ATOM 0 HB VAL A 12 5.037 -11.283 13.182 1.00 0.00 H new ATOM 0 HG11 VAL A 12 4.217 -13.106 11.743 1.00 0.00 H new ATOM 0 HG12 VAL A 12 2.881 -12.228 12.525 1.00 0.00 H new ATOM 0 HG13 VAL A 12 3.257 -11.932 10.811 1.00 0.00 H new ATOM 0 HG21 VAL A 12 6.319 -11.940 11.186 1.00 0.00 H new ATOM 0 HG22 VAL A 12 5.449 -10.717 10.230 1.00 0.00 H new ATOM 0 HG23 VAL A 12 6.517 -10.211 11.561 1.00 0.00 H new ATOM 186 N GLY A 13 1.609 -9.664 13.021 1.00 0.00 N ATOM 187 CA GLY A 13 0.548 -9.703 14.010 1.00 0.00 C ATOM 188 C GLY A 13 0.078 -8.319 14.410 1.00 0.00 C ATOM 189 O GLY A 13 -1.074 -8.136 14.803 1.00 0.00 O ATOM 0 H GLY A 13 1.292 -9.569 12.056 1.00 0.00 H new ATOM 0 HA2 GLY A 13 -0.295 -10.269 13.612 1.00 0.00 H new ATOM 0 HA3 GLY A 13 0.899 -10.234 14.895 1.00 0.00 H new ATOM 193 N GLN A 14 0.971 -7.339 14.312 1.00 0.00 N ATOM 194 CA GLN A 14 0.642 -5.963 14.667 1.00 0.00 C ATOM 195 C GLN A 14 0.151 -5.180 13.451 1.00 0.00 C ATOM 196 O GLN A 14 -0.425 -4.101 13.591 1.00 0.00 O ATOM 197 CB GLN A 14 1.861 -5.268 15.277 1.00 0.00 C ATOM 198 CG GLN A 14 1.517 -4.010 16.057 1.00 0.00 C ATOM 199 CD GLN A 14 1.327 -4.277 17.537 1.00 0.00 C ATOM 200 OE1 GLN A 14 2.183 -4.876 18.187 1.00 0.00 O ATOM 201 NE2 GLN A 14 0.199 -3.829 18.080 1.00 0.00 N ATOM 0 H GLN A 14 1.929 -7.473 13.989 1.00 0.00 H new ATOM 0 HA GLN A 14 -0.162 -5.990 15.402 1.00 0.00 H new ATOM 0 HB2 GLN A 14 2.374 -5.966 15.938 1.00 0.00 H new ATOM 0 HB3 GLN A 14 2.559 -5.012 14.480 1.00 0.00 H new ATOM 0 HG2 GLN A 14 2.311 -3.275 15.923 1.00 0.00 H new ATOM 0 HG3 GLN A 14 0.605 -3.572 15.650 1.00 0.00 H new ATOM 0 HE21 GLN A 14 -0.484 -3.337 17.504 1.00 0.00 H new ATOM 0 HE22 GLN A 14 0.017 -3.977 19.073 1.00 0.00 H new ATOM 210 N GLU A 15 0.381 -5.725 12.258 1.00 0.00 N ATOM 211 CA GLU A 15 -0.039 -5.071 11.022 1.00 0.00 C ATOM 212 C GLU A 15 -1.520 -4.703 11.072 1.00 0.00 C ATOM 213 O GLU A 15 -1.903 -3.586 10.725 1.00 0.00 O ATOM 214 CB GLU A 15 0.231 -5.984 9.824 1.00 0.00 C ATOM 215 CG GLU A 15 -0.160 -5.368 8.490 1.00 0.00 C ATOM 216 CD GLU A 15 -1.522 -5.832 8.010 1.00 0.00 C ATOM 217 OE1 GLU A 15 -1.833 -7.030 8.176 1.00 0.00 O ATOM 218 OE2 GLU A 15 -2.278 -4.996 7.470 1.00 0.00 O ATOM 0 H GLU A 15 0.856 -6.617 12.122 1.00 0.00 H new ATOM 0 HA GLU A 15 0.539 -4.153 10.912 1.00 0.00 H new ATOM 0 HB2 GLU A 15 1.291 -6.236 9.802 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -0.316 -6.917 9.958 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -0.162 -4.282 8.582 1.00 0.00 H new ATOM 0 HG3 GLU A 15 0.591 -5.623 7.742 1.00 0.00 H new ATOM 225 N GLU A 16 -2.347 -5.649 11.507 1.00 0.00 N ATOM 226 CA GLU A 16 -3.784 -5.421 11.603 1.00 0.00 C ATOM 227 C GLU A 16 -4.089 -4.263 12.548 1.00 0.00 C ATOM 228 O GLU A 16 -5.076 -3.548 12.372 1.00 0.00 O ATOM 229 CB GLU A 16 -4.492 -6.691 12.081 1.00 0.00 C ATOM 230 CG GLU A 16 -5.647 -7.115 11.189 1.00 0.00 C ATOM 231 CD GLU A 16 -6.108 -8.533 11.463 1.00 0.00 C ATOM 232 OE1 GLU A 16 -5.281 -9.461 11.331 1.00 0.00 O ATOM 233 OE2 GLU A 16 -7.293 -8.716 11.810 1.00 0.00 O ATOM 0 H GLU A 16 -2.047 -6.579 11.798 1.00 0.00 H new ATOM 0 HA GLU A 16 -4.154 -5.161 10.611 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -3.767 -7.503 12.134 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -4.865 -6.530 13.093 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -6.483 -6.431 11.335 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -5.344 -7.031 10.145 1.00 0.00 H new ATOM 240 N LYS A 17 -3.235 -4.083 13.551 1.00 0.00 N ATOM 241 CA LYS A 17 -3.413 -3.011 14.523 1.00 0.00 C ATOM 242 C LYS A 17 -2.785 -1.714 14.022 1.00 0.00 C ATOM 243 O LYS A 17 -3.257 -0.621 14.340 1.00 0.00 O ATOM 244 CB LYS A 17 -2.796 -3.406 15.869 1.00 0.00 C ATOM 245 CG LYS A 17 -3.701 -3.124 17.057 1.00 0.00 C ATOM 246 CD LYS A 17 -4.672 -4.268 17.301 1.00 0.00 C ATOM 247 CE LYS A 17 -4.096 -5.291 18.268 1.00 0.00 C ATOM 248 NZ LYS A 17 -3.198 -6.259 17.582 1.00 0.00 N ATOM 0 H LYS A 17 -2.413 -4.666 13.711 1.00 0.00 H new ATOM 0 HA LYS A 17 -4.482 -2.848 14.656 1.00 0.00 H new ATOM 0 HB2 LYS A 17 -2.554 -4.469 15.851 1.00 0.00 H new ATOM 0 HB3 LYS A 17 -1.858 -2.868 16.001 1.00 0.00 H new ATOM 0 HG2 LYS A 17 -3.094 -2.964 17.948 1.00 0.00 H new ATOM 0 HG3 LYS A 17 -4.258 -2.204 16.881 1.00 0.00 H new ATOM 0 HD2 LYS A 17 -5.607 -3.874 17.700 1.00 0.00 H new ATOM 0 HD3 LYS A 17 -4.909 -4.754 16.354 1.00 0.00 H new ATOM 0 HE2 LYS A 17 -3.543 -4.777 19.054 1.00 0.00 H new ATOM 0 HE3 LYS A 17 -4.910 -5.831 18.752 1.00 0.00 H new ATOM 0 HZ1 LYS A 17 -3.138 -7.134 18.142 1.00 0.00 H new ATOM 0 HZ2 LYS A 17 -3.578 -6.477 16.639 1.00 0.00 H new ATOM 0 HZ3 LYS A 17 -2.249 -5.844 17.485 1.00 0.00 H new ATOM 262 N ALA A 18 -1.721 -1.842 13.235 1.00 0.00 N ATOM 263 CA ALA A 18 -1.031 -0.680 12.690 1.00 0.00 C ATOM 264 C ALA A 18 -1.935 0.098 11.739 1.00 0.00 C ATOM 265 O ALA A 18 -1.821 1.318 11.619 1.00 0.00 O ATOM 266 CB ALA A 18 0.241 -1.110 11.977 1.00 0.00 C ATOM 0 H ALA A 18 -1.319 -2.739 12.961 1.00 0.00 H new ATOM 0 HA ALA A 18 -0.766 -0.023 13.518 1.00 0.00 H new ATOM 0 HB1 ALA A 18 0.747 -0.232 11.574 1.00 0.00 H new ATOM 0 HB2 ALA A 18 0.900 -1.617 12.682 1.00 0.00 H new ATOM 0 HB3 ALA A 18 -0.010 -1.789 11.162 1.00 0.00 H new ATOM 272 N LYS A 19 -2.831 -0.615 11.065 1.00 0.00 N ATOM 273 CA LYS A 19 -3.755 0.009 10.124 1.00 0.00 C ATOM 274 C LYS A 19 -4.608 1.065 10.816 1.00 0.00 C ATOM 275 O LYS A 19 -4.734 2.191 10.332 1.00 0.00 O ATOM 276 CB LYS A 19 -4.654 -1.051 9.483 1.00 0.00 C ATOM 277 CG LYS A 19 -5.071 -0.715 8.060 1.00 0.00 C ATOM 278 CD LYS A 19 -6.562 -0.924 7.850 1.00 0.00 C ATOM 279 CE LYS A 19 -7.324 0.391 7.917 1.00 0.00 C ATOM 280 NZ LYS A 19 -8.445 0.433 6.937 1.00 0.00 N ATOM 0 H LYS A 19 -2.937 -1.626 11.153 1.00 0.00 H new ATOM 0 HA LYS A 19 -3.168 0.497 9.346 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -4.131 -2.007 9.483 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -5.547 -1.176 10.095 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -4.814 0.321 7.840 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -4.514 -1.338 7.360 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -6.732 -1.395 6.882 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -6.945 -1.607 8.608 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -7.716 0.532 8.924 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -6.640 1.217 7.722 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -8.907 1.364 6.978 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -8.074 0.273 5.979 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -9.137 -0.308 7.169 1.00 0.00 H new ATOM 294 N ALA A 20 -5.197 0.695 11.948 1.00 0.00 N ATOM 295 CA ALA A 20 -6.040 1.611 12.705 1.00 0.00 C ATOM 296 C ALA A 20 -5.227 2.774 13.263 1.00 0.00 C ATOM 297 O ALA A 20 -5.574 3.939 13.061 1.00 0.00 O ATOM 298 CB ALA A 20 -6.745 0.869 13.832 1.00 0.00 C ATOM 0 H ALA A 20 -5.106 -0.233 12.361 1.00 0.00 H new ATOM 0 HA ALA A 20 -6.790 2.019 12.027 1.00 0.00 H new ATOM 0 HB1 ALA A 20 -7.372 1.565 14.390 1.00 0.00 H new ATOM 0 HB2 ALA A 20 -7.366 0.077 13.414 1.00 0.00 H new ATOM 0 HB3 ALA A 20 -6.003 0.433 14.501 1.00 0.00 H new ATOM 304 N ASN A 21 -4.145 2.452 13.963 1.00 0.00 N ATOM 305 CA ASN A 21 -3.283 3.472 14.548 1.00 0.00 C ATOM 306 C ASN A 21 -2.698 4.370 13.465 1.00 0.00 C ATOM 307 O ASN A 21 -2.452 5.555 13.690 1.00 0.00 O ATOM 308 CB ASN A 21 -2.156 2.820 15.351 1.00 0.00 C ATOM 309 CG ASN A 21 -2.626 2.310 16.699 1.00 0.00 C ATOM 310 OD1 ASN A 21 -2.448 2.969 17.722 1.00 0.00 O ATOM 311 ND2 ASN A 21 -3.231 1.127 16.706 1.00 0.00 N ATOM 0 H ASN A 21 -3.844 1.493 14.139 1.00 0.00 H new ATOM 0 HA ASN A 21 -3.887 4.084 15.218 1.00 0.00 H new ATOM 0 HB2 ASN A 21 -1.738 1.992 14.778 1.00 0.00 H new ATOM 0 HB3 ASN A 21 -1.354 3.543 15.499 1.00 0.00 H new ATOM 0 HD21 ASN A 21 -3.569 0.732 17.584 1.00 0.00 H new ATOM 0 HD22 ASN A 21 -3.358 0.614 15.834 1.00 0.00 H new ATOM 318 N LEU A 22 -2.477 3.797 12.286 1.00 0.00 N ATOM 319 CA LEU A 22 -1.920 4.543 11.164 1.00 0.00 C ATOM 320 C LEU A 22 -3.005 5.350 10.457 1.00 0.00 C ATOM 321 O LEU A 22 -2.932 6.576 10.384 1.00 0.00 O ATOM 322 CB LEU A 22 -1.250 3.589 10.173 1.00 0.00 C ATOM 323 CG LEU A 22 -0.701 4.248 8.905 1.00 0.00 C ATOM 324 CD1 LEU A 22 0.744 4.681 9.109 1.00 0.00 C ATOM 325 CD2 LEU A 22 -0.813 3.298 7.720 1.00 0.00 C ATOM 0 H LEU A 22 -2.676 2.817 12.083 1.00 0.00 H new ATOM 0 HA LEU A 22 -1.173 5.234 11.553 1.00 0.00 H new ATOM 0 HB2 LEU A 22 -0.432 3.078 10.681 1.00 0.00 H new ATOM 0 HB3 LEU A 22 -1.972 2.825 9.883 1.00 0.00 H new ATOM 0 HG LEU A 22 -1.297 5.135 8.693 1.00 0.00 H new ATOM 0 HD11 LEU A 22 1.116 5.147 8.197 1.00 0.00 H new ATOM 0 HD12 LEU A 22 0.797 5.396 9.930 1.00 0.00 H new ATOM 0 HD13 LEU A 22 1.355 3.810 9.347 1.00 0.00 H new ATOM 0 HD21 LEU A 22 -0.418 3.782 6.827 1.00 0.00 H new ATOM 0 HD22 LEU A 22 -0.242 2.392 7.924 1.00 0.00 H new ATOM 0 HD23 LEU A 22 -1.859 3.038 7.560 1.00 0.00 H new ATOM 337 N GLU A 23 -4.011 4.651 9.938 1.00 0.00 N ATOM 338 CA GLU A 23 -5.116 5.297 9.231 1.00 0.00 C ATOM 339 C GLU A 23 -5.648 6.497 10.011 1.00 0.00 C ATOM 340 O GLU A 23 -6.049 7.502 9.424 1.00 0.00 O ATOM 341 CB GLU A 23 -6.245 4.294 8.984 1.00 0.00 C ATOM 342 CG GLU A 23 -7.416 4.872 8.209 1.00 0.00 C ATOM 343 CD GLU A 23 -8.735 4.219 8.571 1.00 0.00 C ATOM 344 OE1 GLU A 23 -9.204 4.418 9.712 1.00 0.00 O ATOM 345 OE2 GLU A 23 -9.300 3.508 7.713 1.00 0.00 O ATOM 0 H GLU A 23 -4.085 3.635 9.993 1.00 0.00 H new ATOM 0 HA GLU A 23 -4.736 5.655 8.274 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -5.846 3.439 8.438 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -6.604 3.921 9.943 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -7.481 5.943 8.401 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -7.236 4.750 7.141 1.00 0.00 H new ATOM 352 N LYS A 24 -5.647 6.387 11.336 1.00 0.00 N ATOM 353 CA LYS A 24 -6.126 7.467 12.190 1.00 0.00 C ATOM 354 C LYS A 24 -5.216 8.684 12.081 1.00 0.00 C ATOM 355 O LYS A 24 -5.687 9.811 11.918 1.00 0.00 O ATOM 356 CB LYS A 24 -6.210 7.004 13.644 1.00 0.00 C ATOM 357 CG LYS A 24 -7.213 7.786 14.475 1.00 0.00 C ATOM 358 CD LYS A 24 -7.499 7.099 15.802 1.00 0.00 C ATOM 359 CE LYS A 24 -7.027 7.938 16.978 1.00 0.00 C ATOM 360 NZ LYS A 24 -5.561 8.195 16.926 1.00 0.00 N ATOM 0 H LYS A 24 -5.320 5.563 11.840 1.00 0.00 H new ATOM 0 HA LYS A 24 -7.124 7.748 11.853 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -6.478 5.948 13.665 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -5.225 7.092 14.102 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -6.829 8.789 14.660 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -8.142 7.898 13.915 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -8.569 6.913 15.893 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -7.004 6.128 15.824 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -7.562 8.888 16.984 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -7.273 7.428 17.909 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -5.221 8.460 17.873 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -5.069 7.335 16.609 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -5.368 8.970 16.260 1.00 0.00 H new ATOM 374 N ARG A 25 -3.911 8.452 12.171 1.00 0.00 N ATOM 375 CA ARG A 25 -2.936 9.531 12.079 1.00 0.00 C ATOM 376 C ARG A 25 -3.003 10.202 10.712 1.00 0.00 C ATOM 377 O ARG A 25 -2.892 11.423 10.601 1.00 0.00 O ATOM 378 CB ARG A 25 -1.524 8.996 12.337 1.00 0.00 C ATOM 379 CG ARG A 25 -0.983 9.348 13.714 1.00 0.00 C ATOM 380 CD ARG A 25 -0.542 8.108 14.478 1.00 0.00 C ATOM 381 NE ARG A 25 -1.483 7.753 15.537 1.00 0.00 N ATOM 382 CZ ARG A 25 -1.724 8.515 16.602 1.00 0.00 C ATOM 383 NH1 ARG A 25 -1.093 9.674 16.754 1.00 0.00 N ATOM 384 NH2 ARG A 25 -2.596 8.117 17.518 1.00 0.00 N ATOM 0 H ARG A 25 -3.505 7.526 12.308 1.00 0.00 H new ATOM 0 HA ARG A 25 -3.175 10.274 12.840 1.00 0.00 H new ATOM 0 HB2 ARG A 25 -1.529 7.912 12.224 1.00 0.00 H new ATOM 0 HB3 ARG A 25 -0.850 9.393 11.578 1.00 0.00 H new ATOM 0 HG2 ARG A 25 -0.140 10.031 13.610 1.00 0.00 H new ATOM 0 HG3 ARG A 25 -1.750 9.873 14.283 1.00 0.00 H new ATOM 0 HD2 ARG A 25 -0.443 7.272 13.786 1.00 0.00 H new ATOM 0 HD3 ARG A 25 0.443 8.281 14.912 1.00 0.00 H new ATOM 0 HE ARG A 25 -1.985 6.869 15.456 1.00 0.00 H new ATOM 0 HH11 ARG A 25 -0.420 9.984 16.053 1.00 0.00 H new ATOM 0 HH12 ARG A 25 -1.281 10.254 17.572 1.00 0.00 H new ATOM 0 HH21 ARG A 25 -3.082 7.227 17.407 1.00 0.00 H new ATOM 0 HH22 ARG A 25 -2.781 8.701 18.334 1.00 0.00 H new ATOM 398 N ILE A 26 -3.189 9.396 9.670 1.00 0.00 N ATOM 399 CA ILE A 26 -3.275 9.913 8.310 1.00 0.00 C ATOM 400 C ILE A 26 -4.476 10.842 8.156 1.00 0.00 C ATOM 401 O ILE A 26 -4.452 11.771 7.348 1.00 0.00 O ATOM 402 CB ILE A 26 -3.380 8.769 7.279 1.00 0.00 C ATOM 403 CG1 ILE A 26 -2.227 7.780 7.462 1.00 0.00 C ATOM 404 CG2 ILE A 26 -3.382 9.326 5.862 1.00 0.00 C ATOM 405 CD1 ILE A 26 -0.867 8.376 7.172 1.00 0.00 C ATOM 0 H ILE A 26 -3.283 8.383 9.743 1.00 0.00 H new ATOM 0 HA ILE A 26 -2.359 10.473 8.121 1.00 0.00 H new ATOM 0 HB ILE A 26 -4.320 8.241 7.443 1.00 0.00 H new ATOM 0 HG12 ILE A 26 -2.240 7.405 8.485 1.00 0.00 H new ATOM 0 HG13 ILE A 26 -2.386 6.923 6.807 1.00 0.00 H new ATOM 0 HG21 ILE A 26 -3.457 8.505 5.149 1.00 0.00 H new ATOM 0 HG22 ILE A 26 -4.233 9.995 5.735 1.00 0.00 H new ATOM 0 HG23 ILE A 26 -2.458 9.877 5.686 1.00 0.00 H new ATOM 0 HD11 ILE A 26 -0.098 7.618 7.322 1.00 0.00 H new ATOM 0 HD12 ILE A 26 -0.835 8.725 6.140 1.00 0.00 H new ATOM 0 HD13 ILE A 26 -0.686 9.215 7.845 1.00 0.00 H new ATOM 417 N LYS A 27 -5.522 10.586 8.936 1.00 0.00 N ATOM 418 CA LYS A 27 -6.730 11.401 8.884 1.00 0.00 C ATOM 419 C LYS A 27 -6.680 12.512 9.929 1.00 0.00 C ATOM 420 O LYS A 27 -7.253 13.584 9.737 1.00 0.00 O ATOM 421 CB LYS A 27 -7.969 10.532 9.106 1.00 0.00 C ATOM 422 CG LYS A 27 -9.273 11.239 8.780 1.00 0.00 C ATOM 423 CD LYS A 27 -10.405 10.763 9.677 1.00 0.00 C ATOM 424 CE LYS A 27 -10.841 9.351 9.321 1.00 0.00 C ATOM 425 NZ LYS A 27 -11.565 9.304 8.020 1.00 0.00 N ATOM 0 H LYS A 27 -5.557 9.822 9.610 1.00 0.00 H new ATOM 0 HA LYS A 27 -6.788 11.857 7.896 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -7.888 9.635 8.492 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -7.992 10.206 10.146 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -9.143 12.315 8.896 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -9.534 11.060 7.737 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -10.083 10.794 10.718 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -11.253 11.441 9.585 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -9.966 8.702 9.273 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -11.485 8.960 10.109 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -12.019 8.375 7.909 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -12.290 10.049 7.999 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -10.891 9.455 7.242 1.00 0.00 H new ATOM 439 N ALA A 28 -5.993 12.246 11.035 1.00 0.00 N ATOM 440 CA ALA A 28 -5.871 13.222 12.112 1.00 0.00 C ATOM 441 C ALA A 28 -5.012 14.409 11.685 1.00 0.00 C ATOM 442 O ALA A 28 -5.354 15.561 11.948 1.00 0.00 O ATOM 443 CB ALA A 28 -5.286 12.567 13.354 1.00 0.00 C ATOM 0 H ALA A 28 -5.512 11.363 11.209 1.00 0.00 H new ATOM 0 HA ALA A 28 -6.869 13.594 12.345 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -5.201 13.307 14.150 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -5.939 11.757 13.680 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -4.299 12.167 13.123 1.00 0.00 H new ATOM 449 N PHE A 29 -3.895 14.118 11.026 1.00 0.00 N ATOM 450 CA PHE A 29 -2.988 15.163 10.564 1.00 0.00 C ATOM 451 C PHE A 29 -3.500 15.794 9.271 1.00 0.00 C ATOM 452 O PHE A 29 -3.262 16.973 9.009 1.00 0.00 O ATOM 453 CB PHE A 29 -1.586 14.591 10.346 1.00 0.00 C ATOM 454 CG PHE A 29 -0.804 14.420 11.618 1.00 0.00 C ATOM 455 CD1 PHE A 29 -0.136 15.494 12.184 1.00 0.00 C ATOM 456 CD2 PHE A 29 -0.737 13.187 12.245 1.00 0.00 C ATOM 457 CE1 PHE A 29 0.584 15.341 13.353 1.00 0.00 C ATOM 458 CE2 PHE A 29 -0.018 13.029 13.414 1.00 0.00 C ATOM 459 CZ PHE A 29 0.644 14.107 13.969 1.00 0.00 C ATOM 0 H PHE A 29 -3.596 13.169 10.800 1.00 0.00 H new ATOM 0 HA PHE A 29 -2.942 15.936 11.331 1.00 0.00 H new ATOM 0 HB2 PHE A 29 -1.670 13.625 9.848 1.00 0.00 H new ATOM 0 HB3 PHE A 29 -1.034 15.249 9.675 1.00 0.00 H new ATOM 0 HD1 PHE A 29 -0.179 16.461 11.706 1.00 0.00 H new ATOM 0 HD2 PHE A 29 -1.252 12.340 11.816 1.00 0.00 H new ATOM 0 HE1 PHE A 29 1.100 16.186 13.785 1.00 0.00 H new ATOM 0 HE2 PHE A 29 0.027 12.063 13.894 1.00 0.00 H new ATOM 0 HZ PHE A 29 1.207 13.985 14.882 1.00 0.00 H new ATOM 469 N GLY A 30 -4.201 15.001 8.468 1.00 0.00 N ATOM 470 CA GLY A 30 -4.735 15.500 7.215 1.00 0.00 C ATOM 471 C GLY A 30 -3.861 15.142 6.028 1.00 0.00 C ATOM 472 O GLY A 30 -3.277 16.019 5.392 1.00 0.00 O ATOM 0 H GLY A 30 -4.409 14.022 8.663 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -5.735 15.093 7.062 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -4.837 16.584 7.273 1.00 0.00 H new ATOM 476 N LEU A 31 -3.771 13.849 5.730 1.00 0.00 N ATOM 477 CA LEU A 31 -2.963 13.377 4.613 1.00 0.00 C ATOM 478 C LEU A 31 -3.796 12.533 3.652 1.00 0.00 C ATOM 479 O LEU A 31 -3.259 11.711 2.909 1.00 0.00 O ATOM 480 CB LEU A 31 -1.773 12.560 5.124 1.00 0.00 C ATOM 481 CG LEU A 31 -1.069 13.141 6.353 1.00 0.00 C ATOM 482 CD1 LEU A 31 -0.529 12.025 7.237 1.00 0.00 C ATOM 483 CD2 LEU A 31 0.051 14.079 5.928 1.00 0.00 C ATOM 0 H LEU A 31 -4.248 13.111 6.247 1.00 0.00 H new ATOM 0 HA LEU A 31 -2.593 14.250 4.074 1.00 0.00 H new ATOM 0 HB2 LEU A 31 -2.118 11.554 5.363 1.00 0.00 H new ATOM 0 HB3 LEU A 31 -1.045 12.464 4.319 1.00 0.00 H new ATOM 0 HG LEU A 31 -1.796 13.712 6.931 1.00 0.00 H new ATOM 0 HD11 LEU A 31 -0.032 12.457 8.106 1.00 0.00 H new ATOM 0 HD12 LEU A 31 -1.352 11.392 7.568 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.185 11.426 6.671 1.00 0.00 H new ATOM 0 HD21 LEU A 31 0.542 14.484 6.813 1.00 0.00 H new ATOM 0 HD22 LEU A 31 0.778 13.530 5.329 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -0.363 14.896 5.337 1.00 0.00 H new ATOM 495 N GLN A 32 -5.109 12.740 3.671 1.00 0.00 N ATOM 496 CA GLN A 32 -6.012 11.997 2.798 1.00 0.00 C ATOM 497 C GLN A 32 -5.902 12.474 1.349 1.00 0.00 C ATOM 498 O GLN A 32 -6.460 11.857 0.443 1.00 0.00 O ATOM 499 CB GLN A 32 -7.456 12.137 3.286 1.00 0.00 C ATOM 500 CG GLN A 32 -8.266 10.857 3.161 1.00 0.00 C ATOM 501 CD GLN A 32 -9.597 10.938 3.883 1.00 0.00 C ATOM 502 OE1 GLN A 32 -10.658 10.863 3.264 1.00 0.00 O ATOM 503 NE2 GLN A 32 -9.546 11.091 5.201 1.00 0.00 N ATOM 0 H GLN A 32 -5.571 13.415 4.280 1.00 0.00 H new ATOM 0 HA GLN A 32 -5.721 10.947 2.833 1.00 0.00 H new ATOM 0 HB2 GLN A 32 -7.449 12.453 4.329 1.00 0.00 H new ATOM 0 HB3 GLN A 32 -7.948 12.926 2.717 1.00 0.00 H new ATOM 0 HG2 GLN A 32 -8.441 10.643 2.107 1.00 0.00 H new ATOM 0 HG3 GLN A 32 -7.688 10.025 3.563 1.00 0.00 H new ATOM 0 HE21 GLN A 32 -8.644 11.148 5.673 1.00 0.00 H new ATOM 0 HE22 GLN A 32 -10.409 11.151 5.741 1.00 0.00 H new ATOM 512 N ASP A 33 -5.182 13.572 1.136 1.00 0.00 N ATOM 513 CA ASP A 33 -5.005 14.121 -0.203 1.00 0.00 C ATOM 514 C ASP A 33 -3.932 13.354 -0.969 1.00 0.00 C ATOM 515 O ASP A 33 -3.980 13.259 -2.195 1.00 0.00 O ATOM 516 CB ASP A 33 -4.633 15.602 -0.124 1.00 0.00 C ATOM 517 CG ASP A 33 -5.541 16.380 0.809 1.00 0.00 C ATOM 518 OD1 ASP A 33 -5.351 16.282 2.039 1.00 0.00 O ATOM 519 OD2 ASP A 33 -6.440 17.087 0.310 1.00 0.00 O ATOM 0 H ASP A 33 -4.713 14.098 1.873 1.00 0.00 H new ATOM 0 HA ASP A 33 -5.949 14.019 -0.738 1.00 0.00 H new ATOM 0 HB2 ASP A 33 -3.602 15.697 0.216 1.00 0.00 H new ATOM 0 HB3 ASP A 33 -4.682 16.039 -1.121 1.00 0.00 H new ATOM 524 N LYS A 34 -2.962 12.810 -0.237 1.00 0.00 N ATOM 525 CA LYS A 34 -1.879 12.052 -0.852 1.00 0.00 C ATOM 526 C LYS A 34 -2.236 10.572 -0.944 1.00 0.00 C ATOM 527 O LYS A 34 -2.146 9.967 -2.012 1.00 0.00 O ATOM 528 CB LYS A 34 -0.586 12.232 -0.054 1.00 0.00 C ATOM 529 CG LYS A 34 0.378 13.228 -0.677 1.00 0.00 C ATOM 530 CD LYS A 34 0.153 14.631 -0.138 1.00 0.00 C ATOM 531 CE LYS A 34 -0.951 15.349 -0.896 1.00 0.00 C ATOM 532 NZ LYS A 34 -1.082 16.770 -0.469 1.00 0.00 N ATOM 0 H LYS A 34 -2.905 12.881 0.779 1.00 0.00 H new ATOM 0 HA LYS A 34 -1.728 12.433 -1.862 1.00 0.00 H new ATOM 0 HB2 LYS A 34 -0.834 12.561 0.955 1.00 0.00 H new ATOM 0 HB3 LYS A 34 -0.089 11.267 0.039 1.00 0.00 H new ATOM 0 HG2 LYS A 34 1.404 12.919 -0.474 1.00 0.00 H new ATOM 0 HG3 LYS A 34 0.253 13.229 -1.760 1.00 0.00 H new ATOM 0 HD2 LYS A 34 -0.105 14.578 0.920 1.00 0.00 H new ATOM 0 HD3 LYS A 34 1.078 15.203 -0.212 1.00 0.00 H new ATOM 0 HE2 LYS A 34 -0.743 15.309 -1.965 1.00 0.00 H new ATOM 0 HE3 LYS A 34 -1.897 14.833 -0.735 1.00 0.00 H new ATOM 0 HZ1 LYS A 34 -1.845 17.226 -1.009 1.00 0.00 H new ATOM 0 HZ2 LYS A 34 -1.305 16.808 0.546 1.00 0.00 H new ATOM 0 HZ3 LYS A 34 -0.187 17.270 -0.646 1.00 0.00 H new ATOM 546 N ILE A 35 -2.646 9.995 0.182 1.00 0.00 N ATOM 547 CA ILE A 35 -3.021 8.588 0.225 1.00 0.00 C ATOM 548 C ILE A 35 -4.434 8.386 -0.308 1.00 0.00 C ATOM 549 O ILE A 35 -5.372 9.055 0.126 1.00 0.00 O ATOM 550 CB ILE A 35 -2.938 8.025 1.657 1.00 0.00 C ATOM 551 CG1 ILE A 35 -1.591 8.380 2.289 1.00 0.00 C ATOM 552 CG2 ILE A 35 -3.145 6.518 1.647 1.00 0.00 C ATOM 553 CD1 ILE A 35 -1.443 7.889 3.713 1.00 0.00 C ATOM 0 H ILE A 35 -2.726 10.481 1.075 1.00 0.00 H new ATOM 0 HA ILE A 35 -2.314 8.051 -0.407 1.00 0.00 H new ATOM 0 HB ILE A 35 -3.729 8.476 2.256 1.00 0.00 H new ATOM 0 HG12 ILE A 35 -0.791 7.956 1.682 1.00 0.00 H new ATOM 0 HG13 ILE A 35 -1.465 9.463 2.272 1.00 0.00 H new ATOM 0 HG21 ILE A 35 -3.083 6.136 2.666 1.00 0.00 H new ATOM 0 HG22 ILE A 35 -4.126 6.288 1.232 1.00 0.00 H new ATOM 0 HG23 ILE A 35 -2.374 6.049 1.036 1.00 0.00 H new ATOM 0 HD11 ILE A 35 -0.464 8.176 4.097 1.00 0.00 H new ATOM 0 HD12 ILE A 35 -2.221 8.333 4.334 1.00 0.00 H new ATOM 0 HD13 ILE A 35 -1.537 6.803 3.735 1.00 0.00 H new ATOM 565 N PHE A 36 -4.580 7.467 -1.256 1.00 0.00 N ATOM 566 CA PHE A 36 -5.880 7.187 -1.853 1.00 0.00 C ATOM 567 C PHE A 36 -6.359 5.781 -1.504 1.00 0.00 C ATOM 568 O PHE A 36 -7.471 5.602 -1.005 1.00 0.00 O ATOM 569 CB PHE A 36 -5.812 7.351 -3.372 1.00 0.00 C ATOM 570 CG PHE A 36 -5.110 8.605 -3.806 1.00 0.00 C ATOM 571 CD1 PHE A 36 -5.717 9.843 -3.659 1.00 0.00 C ATOM 572 CD2 PHE A 36 -3.843 8.546 -4.360 1.00 0.00 C ATOM 573 CE1 PHE A 36 -5.072 10.998 -4.058 1.00 0.00 C ATOM 574 CE2 PHE A 36 -3.191 9.698 -4.759 1.00 0.00 C ATOM 575 CZ PHE A 36 -3.807 10.926 -4.608 1.00 0.00 C ATOM 0 H PHE A 36 -3.815 6.904 -1.627 1.00 0.00 H new ATOM 0 HA PHE A 36 -6.595 7.902 -1.445 1.00 0.00 H new ATOM 0 HB2 PHE A 36 -5.299 6.490 -3.800 1.00 0.00 H new ATOM 0 HB3 PHE A 36 -6.825 7.352 -3.775 1.00 0.00 H new ATOM 0 HD1 PHE A 36 -6.705 9.905 -3.228 1.00 0.00 H new ATOM 0 HD2 PHE A 36 -3.358 7.589 -4.482 1.00 0.00 H new ATOM 0 HE1 PHE A 36 -5.556 11.956 -3.940 1.00 0.00 H new ATOM 0 HE2 PHE A 36 -2.202 9.638 -5.188 1.00 0.00 H new ATOM 0 HZ PHE A 36 -3.300 11.827 -4.919 1.00 0.00 H new ATOM 585 N GLN A 37 -5.521 4.784 -1.774 1.00 0.00 N ATOM 586 CA GLN A 37 -5.878 3.398 -1.490 1.00 0.00 C ATOM 587 C GLN A 37 -5.002 2.811 -0.389 1.00 0.00 C ATOM 588 O GLN A 37 -3.893 3.283 -0.141 1.00 0.00 O ATOM 589 CB GLN A 37 -5.760 2.547 -2.755 1.00 0.00 C ATOM 590 CG GLN A 37 -6.364 3.200 -3.987 1.00 0.00 C ATOM 591 CD GLN A 37 -7.442 2.349 -4.631 1.00 0.00 C ATOM 592 OE1 GLN A 37 -8.539 2.202 -4.092 1.00 0.00 O ATOM 593 NE2 GLN A 37 -7.133 1.783 -5.791 1.00 0.00 N ATOM 0 H GLN A 37 -4.596 4.909 -2.186 1.00 0.00 H new ATOM 0 HA GLN A 37 -6.912 3.388 -1.144 1.00 0.00 H new ATOM 0 HB2 GLN A 37 -4.707 2.337 -2.945 1.00 0.00 H new ATOM 0 HB3 GLN A 37 -6.250 1.589 -2.585 1.00 0.00 H new ATOM 0 HG2 GLN A 37 -6.786 4.166 -3.711 1.00 0.00 H new ATOM 0 HG3 GLN A 37 -5.576 3.393 -4.715 1.00 0.00 H new ATOM 0 HE21 GLN A 37 -6.211 1.932 -6.202 1.00 0.00 H new ATOM 0 HE22 GLN A 37 -7.817 1.199 -6.272 1.00 0.00 H new ATOM 602 N VAL A 38 -5.512 1.770 0.263 1.00 0.00 N ATOM 603 CA VAL A 38 -4.787 1.100 1.337 1.00 0.00 C ATOM 604 C VAL A 38 -5.209 -0.363 1.439 1.00 0.00 C ATOM 605 O VAL A 38 -5.904 -0.756 2.377 1.00 0.00 O ATOM 606 CB VAL A 38 -5.022 1.791 2.694 1.00 0.00 C ATOM 607 CG1 VAL A 38 -4.076 1.236 3.747 1.00 0.00 C ATOM 608 CG2 VAL A 38 -4.860 3.299 2.563 1.00 0.00 C ATOM 0 H VAL A 38 -6.429 1.371 0.064 1.00 0.00 H new ATOM 0 HA VAL A 38 -3.726 1.158 1.095 1.00 0.00 H new ATOM 0 HB VAL A 38 -6.044 1.586 3.012 1.00 0.00 H new ATOM 0 HG11 VAL A 38 -4.257 1.736 4.698 1.00 0.00 H new ATOM 0 HG12 VAL A 38 -4.247 0.166 3.861 1.00 0.00 H new ATOM 0 HG13 VAL A 38 -3.045 1.408 3.437 1.00 0.00 H new ATOM 0 HG21 VAL A 38 -5.030 3.769 3.532 1.00 0.00 H new ATOM 0 HG22 VAL A 38 -3.851 3.528 2.221 1.00 0.00 H new ATOM 0 HG23 VAL A 38 -5.583 3.681 1.843 1.00 0.00 H new ATOM 618 N LEU A 39 -4.789 -1.162 0.463 1.00 0.00 N ATOM 619 CA LEU A 39 -5.128 -2.580 0.433 1.00 0.00 C ATOM 620 C LEU A 39 -4.138 -3.402 1.255 1.00 0.00 C ATOM 621 O LEU A 39 -2.965 -3.047 1.375 1.00 0.00 O ATOM 622 CB LEU A 39 -5.149 -3.089 -1.009 1.00 0.00 C ATOM 623 CG LEU A 39 -6.495 -2.958 -1.725 1.00 0.00 C ATOM 624 CD1 LEU A 39 -7.543 -3.837 -1.057 1.00 0.00 C ATOM 625 CD2 LEU A 39 -6.949 -1.506 -1.747 1.00 0.00 C ATOM 0 H LEU A 39 -4.212 -0.851 -0.319 1.00 0.00 H new ATOM 0 HA LEU A 39 -6.119 -2.696 0.872 1.00 0.00 H new ATOM 0 HB2 LEU A 39 -4.397 -2.545 -1.581 1.00 0.00 H new ATOM 0 HB3 LEU A 39 -4.854 -4.138 -1.012 1.00 0.00 H new ATOM 0 HG LEU A 39 -6.371 -3.294 -2.754 1.00 0.00 H new ATOM 0 HD11 LEU A 39 -8.494 -3.731 -1.580 1.00 0.00 H new ATOM 0 HD12 LEU A 39 -7.222 -4.878 -1.095 1.00 0.00 H new ATOM 0 HD13 LEU A 39 -7.664 -3.532 -0.018 1.00 0.00 H new ATOM 0 HD21 LEU A 39 -7.908 -1.432 -2.260 1.00 0.00 H new ATOM 0 HD22 LEU A 39 -7.056 -1.143 -0.725 1.00 0.00 H new ATOM 0 HD23 LEU A 39 -6.209 -0.901 -2.272 1.00 0.00 H new ATOM 637 N ILE A 40 -4.624 -4.508 1.812 1.00 0.00 N ATOM 638 CA ILE A 40 -3.791 -5.391 2.616 1.00 0.00 C ATOM 639 C ILE A 40 -3.482 -6.683 1.862 1.00 0.00 C ATOM 640 O ILE A 40 -4.383 -7.319 1.315 1.00 0.00 O ATOM 641 CB ILE A 40 -4.470 -5.740 3.955 1.00 0.00 C ATOM 642 CG1 ILE A 40 -5.915 -6.184 3.717 1.00 0.00 C ATOM 643 CG2 ILE A 40 -4.424 -4.549 4.898 1.00 0.00 C ATOM 644 CD1 ILE A 40 -6.586 -6.746 4.951 1.00 0.00 C ATOM 0 H ILE A 40 -5.593 -4.813 1.720 1.00 0.00 H new ATOM 0 HA ILE A 40 -2.863 -4.857 2.819 1.00 0.00 H new ATOM 0 HB ILE A 40 -3.928 -6.565 4.418 1.00 0.00 H new ATOM 0 HG12 ILE A 40 -6.493 -5.334 3.355 1.00 0.00 H new ATOM 0 HG13 ILE A 40 -5.930 -6.938 2.930 1.00 0.00 H new ATOM 0 HG21 ILE A 40 -4.907 -4.811 5.839 1.00 0.00 H new ATOM 0 HG22 ILE A 40 -3.386 -4.275 5.087 1.00 0.00 H new ATOM 0 HG23 ILE A 40 -4.945 -3.706 4.445 1.00 0.00 H new ATOM 0 HD11 ILE A 40 -7.607 -7.040 4.708 1.00 0.00 H new ATOM 0 HD12 ILE A 40 -6.032 -7.616 5.302 1.00 0.00 H new ATOM 0 HD13 ILE A 40 -6.603 -5.987 5.733 1.00 0.00 H new ATOM 656 N PRO A 41 -2.201 -7.090 1.818 1.00 0.00 N ATOM 657 CA PRO A 41 -1.783 -8.312 1.121 1.00 0.00 C ATOM 658 C PRO A 41 -2.373 -9.574 1.743 1.00 0.00 C ATOM 659 O PRO A 41 -1.667 -10.345 2.394 1.00 0.00 O ATOM 660 CB PRO A 41 -0.259 -8.311 1.267 1.00 0.00 C ATOM 661 CG PRO A 41 0.016 -7.440 2.443 1.00 0.00 C ATOM 662 CD PRO A 41 -1.059 -6.393 2.438 1.00 0.00 C ATOM 0 HA PRO A 41 -2.126 -8.318 0.086 1.00 0.00 H new ATOM 0 HB2 PRO A 41 0.123 -9.320 1.425 1.00 0.00 H new ATOM 0 HB3 PRO A 41 0.223 -7.925 0.369 1.00 0.00 H new ATOM 0 HG2 PRO A 41 -0.003 -8.015 3.369 1.00 0.00 H new ATOM 0 HG3 PRO A 41 1.004 -6.986 2.370 1.00 0.00 H new ATOM 0 HD2 PRO A 41 -1.294 -6.052 3.446 1.00 0.00 H new ATOM 0 HD3 PRO A 41 -0.763 -5.514 1.865 1.00 0.00 H new ATOM 670 N THR A 42 -3.668 -9.782 1.533 1.00 0.00 N ATOM 671 CA THR A 42 -4.350 -10.954 2.071 1.00 0.00 C ATOM 672 C THR A 42 -5.473 -11.406 1.141 1.00 0.00 C ATOM 673 O THR A 42 -6.301 -10.602 0.714 1.00 0.00 O ATOM 674 CB THR A 42 -4.914 -10.649 3.460 1.00 0.00 C ATOM 675 OG1 THR A 42 -6.061 -9.823 3.366 1.00 0.00 O ATOM 676 CG2 THR A 42 -3.922 -9.954 4.368 1.00 0.00 C ATOM 0 H THR A 42 -4.266 -9.155 0.995 1.00 0.00 H new ATOM 0 HA THR A 42 -3.622 -11.762 2.151 1.00 0.00 H new ATOM 0 HB THR A 42 -5.161 -11.619 3.891 1.00 0.00 H new ATOM 0 HG1 THR A 42 -6.371 -9.798 2.437 1.00 0.00 H new ATOM 0 HG21 THR A 42 -4.385 -9.767 5.337 1.00 0.00 H new ATOM 0 HG22 THR A 42 -3.045 -10.587 4.501 1.00 0.00 H new ATOM 0 HG23 THR A 42 -3.621 -9.007 3.921 1.00 0.00 H new ATOM 684 N GLU A 43 -5.493 -12.700 0.835 1.00 0.00 N ATOM 685 CA GLU A 43 -6.515 -13.261 -0.043 1.00 0.00 C ATOM 686 C GLU A 43 -7.814 -13.494 0.719 1.00 0.00 C ATOM 687 O GLU A 43 -7.799 -13.899 1.882 1.00 0.00 O ATOM 688 CB GLU A 43 -6.030 -14.575 -0.654 1.00 0.00 C ATOM 689 CG GLU A 43 -6.819 -15.004 -1.880 1.00 0.00 C ATOM 690 CD GLU A 43 -5.991 -15.829 -2.847 1.00 0.00 C ATOM 691 OE1 GLU A 43 -4.992 -16.434 -2.405 1.00 0.00 O ATOM 692 OE2 GLU A 43 -6.343 -15.869 -4.045 1.00 0.00 O ATOM 0 H GLU A 43 -4.815 -13.379 1.181 1.00 0.00 H new ATOM 0 HA GLU A 43 -6.703 -12.545 -0.843 1.00 0.00 H new ATOM 0 HB2 GLU A 43 -4.979 -14.474 -0.926 1.00 0.00 H new ATOM 0 HB3 GLU A 43 -6.090 -15.360 0.099 1.00 0.00 H new ATOM 0 HG2 GLU A 43 -7.687 -15.583 -1.565 1.00 0.00 H new ATOM 0 HG3 GLU A 43 -7.196 -14.119 -2.393 1.00 0.00 H new ATOM 699 N GLU A 44 -8.935 -13.239 0.056 1.00 0.00 N ATOM 700 CA GLU A 44 -10.246 -13.418 0.669 1.00 0.00 C ATOM 701 C GLU A 44 -10.845 -14.773 0.299 1.00 0.00 C ATOM 702 O GLU A 44 -10.653 -15.265 -0.814 1.00 0.00 O ATOM 703 CB GLU A 44 -11.191 -12.297 0.237 1.00 0.00 C ATOM 704 CG GLU A 44 -11.112 -11.061 1.119 1.00 0.00 C ATOM 705 CD GLU A 44 -12.387 -10.243 1.092 1.00 0.00 C ATOM 706 OE1 GLU A 44 -13.331 -10.589 1.834 1.00 0.00 O ATOM 707 OE2 GLU A 44 -12.443 -9.253 0.330 1.00 0.00 O ATOM 0 H GLU A 44 -8.963 -12.907 -0.908 1.00 0.00 H new ATOM 0 HA GLU A 44 -10.118 -13.382 1.751 1.00 0.00 H new ATOM 0 HB2 GLU A 44 -10.961 -12.015 -0.791 1.00 0.00 H new ATOM 0 HB3 GLU A 44 -12.214 -12.673 0.243 1.00 0.00 H new ATOM 0 HG2 GLU A 44 -10.901 -11.364 2.145 1.00 0.00 H new ATOM 0 HG3 GLU A 44 -10.279 -10.439 0.792 1.00 0.00 H new ATOM 714 N VAL A 45 -11.573 -15.365 1.239 1.00 0.00 N ATOM 715 CA VAL A 45 -12.207 -16.660 1.016 1.00 0.00 C ATOM 716 C VAL A 45 -13.495 -16.782 1.821 1.00 0.00 C ATOM 717 O VAL A 45 -13.474 -16.759 3.051 1.00 0.00 O ATOM 718 CB VAL A 45 -11.267 -17.820 1.392 1.00 0.00 C ATOM 719 CG1 VAL A 45 -10.118 -17.923 0.400 1.00 0.00 C ATOM 720 CG2 VAL A 45 -10.743 -17.643 2.809 1.00 0.00 C ATOM 0 H VAL A 45 -11.739 -14.969 2.164 1.00 0.00 H new ATOM 0 HA VAL A 45 -12.437 -16.722 -0.048 1.00 0.00 H new ATOM 0 HB VAL A 45 -11.834 -18.750 1.351 1.00 0.00 H new ATOM 0 HG11 VAL A 45 -9.465 -18.749 0.684 1.00 0.00 H new ATOM 0 HG12 VAL A 45 -10.515 -18.101 -0.599 1.00 0.00 H new ATOM 0 HG13 VAL A 45 -9.549 -16.993 0.404 1.00 0.00 H new ATOM 0 HG21 VAL A 45 -10.080 -18.472 3.058 1.00 0.00 H new ATOM 0 HG22 VAL A 45 -10.193 -16.705 2.879 1.00 0.00 H new ATOM 0 HG23 VAL A 45 -11.580 -17.625 3.507 1.00 0.00 H new ATOM 730 N VAL A 46 -14.615 -16.911 1.119 1.00 0.00 N ATOM 731 CA VAL A 46 -15.914 -17.031 1.771 1.00 0.00 C ATOM 732 C VAL A 46 -16.326 -18.492 1.918 1.00 0.00 C ATOM 733 O VAL A 46 -16.142 -19.296 1.005 1.00 0.00 O ATOM 734 CB VAL A 46 -17.007 -16.278 0.989 1.00 0.00 C ATOM 735 CG1 VAL A 46 -16.746 -14.779 1.015 1.00 0.00 C ATOM 736 CG2 VAL A 46 -17.090 -16.790 -0.441 1.00 0.00 C ATOM 0 H VAL A 46 -14.650 -16.935 0.100 1.00 0.00 H new ATOM 0 HA VAL A 46 -15.811 -16.585 2.760 1.00 0.00 H new ATOM 0 HB VAL A 46 -17.967 -16.463 1.471 1.00 0.00 H new ATOM 0 HG11 VAL A 46 -17.528 -14.264 0.458 1.00 0.00 H new ATOM 0 HG12 VAL A 46 -16.744 -14.428 2.047 1.00 0.00 H new ATOM 0 HG13 VAL A 46 -15.778 -14.570 0.559 1.00 0.00 H new ATOM 0 HG21 VAL A 46 -17.867 -16.246 -0.978 1.00 0.00 H new ATOM 0 HG22 VAL A 46 -16.132 -16.638 -0.938 1.00 0.00 H new ATOM 0 HG23 VAL A 46 -17.330 -17.853 -0.433 1.00 0.00 H new ATOM 746 N GLU A 47 -16.887 -18.827 3.075 1.00 0.00 N ATOM 747 CA GLU A 47 -17.329 -20.189 3.349 1.00 0.00 C ATOM 748 C GLU A 47 -18.593 -20.185 4.204 1.00 0.00 C ATOM 749 O GLU A 47 -18.596 -19.667 5.321 1.00 0.00 O ATOM 750 CB GLU A 47 -16.221 -20.977 4.051 1.00 0.00 C ATOM 751 CG GLU A 47 -15.533 -21.992 3.153 1.00 0.00 C ATOM 752 CD GLU A 47 -14.572 -22.885 3.912 1.00 0.00 C ATOM 753 OE1 GLU A 47 -13.757 -22.351 4.693 1.00 0.00 O ATOM 754 OE2 GLU A 47 -14.633 -24.119 3.724 1.00 0.00 O ATOM 0 H GLU A 47 -17.047 -18.172 3.840 1.00 0.00 H new ATOM 0 HA GLU A 47 -17.557 -20.671 2.398 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -15.476 -20.279 4.433 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -16.644 -21.494 4.912 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -16.287 -22.609 2.664 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -14.991 -21.467 2.366 1.00 0.00 H new ATOM 761 N LEU A 48 -19.663 -20.766 3.675 1.00 0.00 N ATOM 762 CA LEU A 48 -20.932 -20.829 4.389 1.00 0.00 C ATOM 763 C LEU A 48 -21.419 -22.268 4.512 1.00 0.00 C ATOM 764 O LEU A 48 -21.155 -23.099 3.643 1.00 0.00 O ATOM 765 CB LEU A 48 -21.987 -19.982 3.675 1.00 0.00 C ATOM 766 CG LEU A 48 -23.301 -19.805 4.439 1.00 0.00 C ATOM 767 CD1 LEU A 48 -23.273 -18.526 5.260 1.00 0.00 C ATOM 768 CD2 LEU A 48 -24.479 -19.797 3.476 1.00 0.00 C ATOM 0 H LEU A 48 -19.677 -21.201 2.752 1.00 0.00 H new ATOM 0 HA LEU A 48 -20.774 -20.432 5.392 1.00 0.00 H new ATOM 0 HB2 LEU A 48 -21.565 -18.997 3.475 1.00 0.00 H new ATOM 0 HB3 LEU A 48 -22.204 -20.438 2.709 1.00 0.00 H new ATOM 0 HG LEU A 48 -23.420 -20.647 5.121 1.00 0.00 H new ATOM 0 HD11 LEU A 48 -24.216 -18.417 5.796 1.00 0.00 H new ATOM 0 HD12 LEU A 48 -22.452 -18.571 5.975 1.00 0.00 H new ATOM 0 HD13 LEU A 48 -23.131 -17.672 4.598 1.00 0.00 H new ATOM 0 HD21 LEU A 48 -25.406 -19.670 4.036 1.00 0.00 H new ATOM 0 HD22 LEU A 48 -24.366 -18.974 2.770 1.00 0.00 H new ATOM 0 HD23 LEU A 48 -24.510 -20.741 2.931 1.00 0.00 H new ATOM 780 N ARG A 49 -22.133 -22.555 5.596 1.00 0.00 N ATOM 781 CA ARG A 49 -22.659 -23.894 5.832 1.00 0.00 C ATOM 782 C ARG A 49 -24.179 -23.868 5.954 1.00 0.00 C ATOM 783 O ARG A 49 -24.874 -24.697 5.370 1.00 0.00 O ATOM 784 CB ARG A 49 -22.046 -24.491 7.102 1.00 0.00 C ATOM 785 CG ARG A 49 -20.693 -25.144 6.875 1.00 0.00 C ATOM 786 CD ARG A 49 -20.205 -25.860 8.125 1.00 0.00 C ATOM 787 NE ARG A 49 -21.082 -26.969 8.496 1.00 0.00 N ATOM 788 CZ ARG A 49 -21.106 -27.520 9.707 1.00 0.00 C ATOM 789 NH1 ARG A 49 -20.305 -27.071 10.666 1.00 0.00 N ATOM 790 NH2 ARG A 49 -21.935 -28.524 9.962 1.00 0.00 N ATOM 0 H ARG A 49 -22.360 -21.878 6.324 1.00 0.00 H new ATOM 0 HA ARG A 49 -22.390 -24.517 4.979 1.00 0.00 H new ATOM 0 HB2 ARG A 49 -21.940 -23.704 7.849 1.00 0.00 H new ATOM 0 HB3 ARG A 49 -22.733 -25.231 7.514 1.00 0.00 H new ATOM 0 HG2 ARG A 49 -20.764 -25.854 6.051 1.00 0.00 H new ATOM 0 HG3 ARG A 49 -19.967 -24.386 6.581 1.00 0.00 H new ATOM 0 HD2 ARG A 49 -19.196 -26.236 7.957 1.00 0.00 H new ATOM 0 HD3 ARG A 49 -20.148 -25.151 8.951 1.00 0.00 H new ATOM 0 HE ARG A 49 -21.712 -27.342 7.786 1.00 0.00 H new ATOM 0 HH11 ARG A 49 -19.666 -26.299 10.477 1.00 0.00 H new ATOM 0 HH12 ARG A 49 -20.329 -27.498 11.592 1.00 0.00 H new ATOM 0 HH21 ARG A 49 -22.554 -28.873 9.230 1.00 0.00 H new ATOM 0 HH22 ARG A 49 -21.954 -28.947 10.890 1.00 0.00 H new ATOM 804 N GLU A 50 -24.687 -22.907 6.719 1.00 0.00 N ATOM 805 CA GLU A 50 -26.124 -22.769 6.920 1.00 0.00 C ATOM 806 C GLU A 50 -26.573 -21.333 6.665 1.00 0.00 C ATOM 807 O GLU A 50 -25.754 -20.455 6.401 1.00 0.00 O ATOM 808 CB GLU A 50 -26.504 -23.193 8.340 1.00 0.00 C ATOM 809 CG GLU A 50 -27.750 -24.059 8.406 1.00 0.00 C ATOM 810 CD GLU A 50 -27.840 -24.856 9.692 1.00 0.00 C ATOM 811 OE1 GLU A 50 -27.258 -25.960 9.748 1.00 0.00 O ATOM 812 OE2 GLU A 50 -28.490 -24.376 10.644 1.00 0.00 O ATOM 0 H GLU A 50 -24.124 -22.212 7.210 1.00 0.00 H new ATOM 0 HA GLU A 50 -26.631 -23.420 6.207 1.00 0.00 H new ATOM 0 HB2 GLU A 50 -25.670 -23.738 8.782 1.00 0.00 H new ATOM 0 HB3 GLU A 50 -26.660 -22.301 8.947 1.00 0.00 H new ATOM 0 HG2 GLU A 50 -28.633 -23.426 8.313 1.00 0.00 H new ATOM 0 HG3 GLU A 50 -27.757 -24.743 7.558 1.00 0.00 H new ATOM 819 N GLY A 51 -27.880 -21.104 6.745 1.00 0.00 N ATOM 820 CA GLY A 51 -28.414 -19.775 6.522 1.00 0.00 C ATOM 821 C GLY A 51 -28.538 -18.975 7.804 1.00 0.00 C ATOM 822 O GLY A 51 -29.060 -19.468 8.803 1.00 0.00 O ATOM 0 H GLY A 51 -28.578 -21.816 6.960 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -27.769 -19.240 5.825 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -29.394 -19.855 6.052 1.00 0.00 H new ATOM 826 N GLY A 52 -28.054 -17.736 7.776 1.00 0.00 N ATOM 827 CA GLY A 52 -28.122 -16.886 8.951 1.00 0.00 C ATOM 828 C GLY A 52 -26.753 -16.575 9.521 1.00 0.00 C ATOM 829 O GLY A 52 -26.459 -15.426 9.854 1.00 0.00 O ATOM 0 H GLY A 52 -27.616 -17.306 6.961 1.00 0.00 H new ATOM 0 HA2 GLY A 52 -28.625 -15.954 8.693 1.00 0.00 H new ATOM 0 HA3 GLY A 52 -28.728 -17.374 9.714 1.00 0.00 H new ATOM 833 N LYS A 53 -25.913 -17.599 9.634 1.00 0.00 N ATOM 834 CA LYS A 53 -24.567 -17.428 10.168 1.00 0.00 C ATOM 835 C LYS A 53 -23.520 -17.628 9.077 1.00 0.00 C ATOM 836 O LYS A 53 -23.520 -18.643 8.381 1.00 0.00 O ATOM 837 CB LYS A 53 -24.321 -18.413 11.314 1.00 0.00 C ATOM 838 CG LYS A 53 -25.223 -18.186 12.514 1.00 0.00 C ATOM 839 CD LYS A 53 -25.060 -19.287 13.549 1.00 0.00 C ATOM 840 CE LYS A 53 -26.029 -20.433 13.301 1.00 0.00 C ATOM 841 NZ LYS A 53 -25.666 -21.646 14.084 1.00 0.00 N ATOM 0 H LYS A 53 -26.141 -18.556 9.363 1.00 0.00 H new ATOM 0 HA LYS A 53 -24.480 -16.410 10.548 1.00 0.00 H new ATOM 0 HB2 LYS A 53 -24.467 -19.429 10.947 1.00 0.00 H new ATOM 0 HB3 LYS A 53 -23.281 -18.336 11.632 1.00 0.00 H new ATOM 0 HG2 LYS A 53 -24.992 -17.222 12.967 1.00 0.00 H new ATOM 0 HG3 LYS A 53 -26.262 -18.144 12.187 1.00 0.00 H new ATOM 0 HD2 LYS A 53 -24.037 -19.662 13.524 1.00 0.00 H new ATOM 0 HD3 LYS A 53 -25.226 -18.878 14.546 1.00 0.00 H new ATOM 0 HE2 LYS A 53 -27.039 -20.119 13.566 1.00 0.00 H new ATOM 0 HE3 LYS A 53 -26.039 -20.676 12.239 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 -26.350 -22.404 13.887 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 -24.713 -21.961 13.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 -25.681 -21.421 15.099 1.00 0.00 H new ATOM 855 N LYS A 54 -22.630 -16.651 8.932 1.00 0.00 N ATOM 856 CA LYS A 54 -21.578 -16.721 7.925 1.00 0.00 C ATOM 857 C LYS A 54 -20.240 -16.273 8.503 1.00 0.00 C ATOM 858 O LYS A 54 -20.169 -15.290 9.239 1.00 0.00 O ATOM 859 CB LYS A 54 -21.942 -15.855 6.717 1.00 0.00 C ATOM 860 CG LYS A 54 -22.198 -14.398 7.069 1.00 0.00 C ATOM 861 CD LYS A 54 -23.266 -13.787 6.175 1.00 0.00 C ATOM 862 CE LYS A 54 -24.588 -13.631 6.909 1.00 0.00 C ATOM 863 NZ LYS A 54 -24.846 -12.217 7.297 1.00 0.00 N ATOM 0 H LYS A 54 -22.617 -15.803 9.498 1.00 0.00 H new ATOM 0 HA LYS A 54 -21.484 -17.759 7.605 1.00 0.00 H new ATOM 0 HB2 LYS A 54 -21.135 -15.907 5.986 1.00 0.00 H new ATOM 0 HB3 LYS A 54 -22.831 -16.267 6.240 1.00 0.00 H new ATOM 0 HG2 LYS A 54 -22.509 -14.324 8.111 1.00 0.00 H new ATOM 0 HG3 LYS A 54 -21.272 -13.831 6.971 1.00 0.00 H new ATOM 0 HD2 LYS A 54 -22.930 -12.813 5.819 1.00 0.00 H new ATOM 0 HD3 LYS A 54 -23.409 -14.416 5.296 1.00 0.00 H new ATOM 0 HE2 LYS A 54 -25.400 -13.987 6.274 1.00 0.00 H new ATOM 0 HE3 LYS A 54 -24.584 -14.257 7.801 1.00 0.00 H new ATOM 0 HZ1 LYS A 54 -25.757 -12.154 7.795 1.00 0.00 H new ATOM 0 HZ2 LYS A 54 -24.085 -11.885 7.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 54 -24.876 -11.623 6.444 1.00 0.00 H new ATOM 877 N GLU A 55 -19.182 -16.999 8.161 1.00 0.00 N ATOM 878 CA GLU A 55 -17.843 -16.677 8.645 1.00 0.00 C ATOM 879 C GLU A 55 -16.867 -16.537 7.481 1.00 0.00 C ATOM 880 O GLU A 55 -16.595 -17.502 6.766 1.00 0.00 O ATOM 881 CB GLU A 55 -17.353 -17.757 9.612 1.00 0.00 C ATOM 882 CG GLU A 55 -16.606 -17.203 10.813 1.00 0.00 C ATOM 883 CD GLU A 55 -16.306 -18.265 11.853 1.00 0.00 C ATOM 884 OE1 GLU A 55 -15.758 -19.323 11.478 1.00 0.00 O ATOM 885 OE2 GLU A 55 -16.618 -18.038 13.040 1.00 0.00 O ATOM 0 H GLU A 55 -19.224 -17.815 7.550 1.00 0.00 H new ATOM 0 HA GLU A 55 -17.892 -15.725 9.173 1.00 0.00 H new ATOM 0 HB2 GLU A 55 -18.208 -18.335 9.962 1.00 0.00 H new ATOM 0 HB3 GLU A 55 -16.701 -18.445 9.075 1.00 0.00 H new ATOM 0 HG2 GLU A 55 -15.671 -16.752 10.479 1.00 0.00 H new ATOM 0 HG3 GLU A 55 -17.197 -16.409 11.270 1.00 0.00 H new ATOM 892 N VAL A 56 -16.344 -15.330 7.293 1.00 0.00 N ATOM 893 CA VAL A 56 -15.401 -15.065 6.215 1.00 0.00 C ATOM 894 C VAL A 56 -14.006 -14.770 6.758 1.00 0.00 C ATOM 895 O VAL A 56 -13.850 -14.011 7.715 1.00 0.00 O ATOM 896 CB VAL A 56 -15.861 -13.881 5.342 1.00 0.00 C ATOM 897 CG1 VAL A 56 -17.184 -14.201 4.662 1.00 0.00 C ATOM 898 CG2 VAL A 56 -15.973 -12.610 6.174 1.00 0.00 C ATOM 0 H VAL A 56 -16.558 -14.520 7.874 1.00 0.00 H new ATOM 0 HA VAL A 56 -15.365 -15.966 5.603 1.00 0.00 H new ATOM 0 HB VAL A 56 -15.112 -13.714 4.568 1.00 0.00 H new ATOM 0 HG11 VAL A 56 -17.493 -13.354 4.050 1.00 0.00 H new ATOM 0 HG12 VAL A 56 -17.065 -15.081 4.030 1.00 0.00 H new ATOM 0 HG13 VAL A 56 -17.944 -14.398 5.418 1.00 0.00 H new ATOM 0 HG21 VAL A 56 -16.299 -11.787 5.538 1.00 0.00 H new ATOM 0 HG22 VAL A 56 -16.699 -12.761 6.973 1.00 0.00 H new ATOM 0 HG23 VAL A 56 -15.001 -12.372 6.607 1.00 0.00 H new ATOM 908 N VAL A 57 -12.997 -15.373 6.140 1.00 0.00 N ATOM 909 CA VAL A 57 -11.614 -15.175 6.557 1.00 0.00 C ATOM 910 C VAL A 57 -10.739 -14.783 5.372 1.00 0.00 C ATOM 911 O VAL A 57 -11.223 -14.657 4.246 1.00 0.00 O ATOM 912 CB VAL A 57 -11.036 -16.445 7.210 1.00 0.00 C ATOM 913 CG1 VAL A 57 -11.723 -16.722 8.539 1.00 0.00 C ATOM 914 CG2 VAL A 57 -11.170 -17.637 6.273 1.00 0.00 C ATOM 0 H VAL A 57 -13.111 -16.004 5.347 1.00 0.00 H new ATOM 0 HA VAL A 57 -11.615 -14.369 7.290 1.00 0.00 H new ATOM 0 HB VAL A 57 -9.976 -16.282 7.402 1.00 0.00 H new ATOM 0 HG11 VAL A 57 -11.302 -17.623 8.986 1.00 0.00 H new ATOM 0 HG12 VAL A 57 -11.569 -15.878 9.211 1.00 0.00 H new ATOM 0 HG13 VAL A 57 -12.791 -16.864 8.374 1.00 0.00 H new ATOM 0 HG21 VAL A 57 -10.756 -18.524 6.752 1.00 0.00 H new ATOM 0 HG22 VAL A 57 -12.223 -17.805 6.046 1.00 0.00 H new ATOM 0 HG23 VAL A 57 -10.627 -17.437 5.349 1.00 0.00 H new ATOM 924 N ARG A 58 -9.450 -14.588 5.628 1.00 0.00 N ATOM 925 CA ARG A 58 -8.515 -14.209 4.575 1.00 0.00 C ATOM 926 C ARG A 58 -7.088 -14.609 4.938 1.00 0.00 C ATOM 927 O ARG A 58 -6.658 -14.447 6.080 1.00 0.00 O ATOM 928 CB ARG A 58 -8.586 -12.702 4.319 1.00 0.00 C ATOM 929 CG ARG A 58 -8.235 -11.859 5.534 1.00 0.00 C ATOM 930 CD ARG A 58 -9.442 -11.647 6.434 1.00 0.00 C ATOM 931 NE ARG A 58 -9.079 -11.658 7.848 1.00 0.00 N ATOM 932 CZ ARG A 58 -8.521 -10.627 8.479 1.00 0.00 C ATOM 933 NH1 ARG A 58 -8.258 -9.504 7.824 1.00 0.00 N ATOM 934 NH2 ARG A 58 -8.224 -10.721 9.768 1.00 0.00 N ATOM 0 H ARG A 58 -9.030 -14.686 6.552 1.00 0.00 H new ATOM 0 HA ARG A 58 -8.799 -14.740 3.666 1.00 0.00 H new ATOM 0 HB2 ARG A 58 -7.908 -12.449 3.504 1.00 0.00 H new ATOM 0 HB3 ARG A 58 -9.592 -12.446 3.988 1.00 0.00 H new ATOM 0 HG2 ARG A 58 -7.440 -12.346 6.099 1.00 0.00 H new ATOM 0 HG3 ARG A 58 -7.849 -10.893 5.208 1.00 0.00 H new ATOM 0 HD2 ARG A 58 -9.915 -10.696 6.189 1.00 0.00 H new ATOM 0 HD3 ARG A 58 -10.178 -12.428 6.243 1.00 0.00 H new ATOM 0 HE ARG A 58 -9.264 -12.506 8.384 1.00 0.00 H new ATOM 0 HH11 ARG A 58 -8.483 -9.427 6.832 1.00 0.00 H new ATOM 0 HH12 ARG A 58 -7.830 -8.717 8.312 1.00 0.00 H new ATOM 0 HH21 ARG A 58 -8.423 -11.583 10.276 1.00 0.00 H new ATOM 0 HH22 ARG A 58 -7.796 -9.931 10.252 1.00 0.00 H new ATOM 948 N LYS A 59 -6.359 -15.131 3.957 1.00 0.00 N ATOM 949 CA LYS A 59 -4.979 -15.553 4.170 1.00 0.00 C ATOM 950 C LYS A 59 -4.006 -14.476 3.701 1.00 0.00 C ATOM 951 O LYS A 59 -4.105 -13.983 2.578 1.00 0.00 O ATOM 952 CB LYS A 59 -4.703 -16.865 3.432 1.00 0.00 C ATOM 953 CG LYS A 59 -5.060 -16.820 1.956 1.00 0.00 C ATOM 954 CD LYS A 59 -4.218 -17.796 1.151 1.00 0.00 C ATOM 955 CE LYS A 59 -4.503 -19.236 1.544 1.00 0.00 C ATOM 956 NZ LYS A 59 -5.796 -19.719 0.983 1.00 0.00 N ATOM 0 H LYS A 59 -6.701 -15.272 3.006 1.00 0.00 H new ATOM 0 HA LYS A 59 -4.833 -15.711 5.239 1.00 0.00 H new ATOM 0 HB2 LYS A 59 -3.647 -17.114 3.534 1.00 0.00 H new ATOM 0 HB3 LYS A 59 -5.267 -17.666 3.909 1.00 0.00 H new ATOM 0 HG2 LYS A 59 -6.116 -17.057 1.828 1.00 0.00 H new ATOM 0 HG3 LYS A 59 -4.912 -15.809 1.575 1.00 0.00 H new ATOM 0 HD2 LYS A 59 -4.420 -17.661 0.088 1.00 0.00 H new ATOM 0 HD3 LYS A 59 -3.161 -17.579 1.305 1.00 0.00 H new ATOM 0 HE2 LYS A 59 -3.693 -19.875 1.192 1.00 0.00 H new ATOM 0 HE3 LYS A 59 -4.525 -19.318 2.631 1.00 0.00 H new ATOM 0 HZ1 LYS A 59 -5.954 -20.705 1.274 1.00 0.00 H new ATOM 0 HZ2 LYS A 59 -6.572 -19.125 1.338 1.00 0.00 H new ATOM 0 HZ3 LYS A 59 -5.766 -19.665 -0.055 1.00 0.00 H new ATOM 970 N LYS A 60 -3.068 -14.115 4.568 1.00 0.00 N ATOM 971 CA LYS A 60 -2.081 -13.092 4.244 1.00 0.00 C ATOM 972 C LYS A 60 -0.999 -13.645 3.321 1.00 0.00 C ATOM 973 O LYS A 60 -0.174 -14.459 3.734 1.00 0.00 O ATOM 974 CB LYS A 60 -1.444 -12.544 5.522 1.00 0.00 C ATOM 975 CG LYS A 60 -0.953 -13.626 6.471 1.00 0.00 C ATOM 976 CD LYS A 60 0.519 -13.449 6.807 1.00 0.00 C ATOM 977 CE LYS A 60 0.862 -14.067 8.154 1.00 0.00 C ATOM 978 NZ LYS A 60 2.190 -14.741 8.135 1.00 0.00 N ATOM 0 H LYS A 60 -2.970 -14.515 5.501 1.00 0.00 H new ATOM 0 HA LYS A 60 -2.595 -12.283 3.725 1.00 0.00 H new ATOM 0 HB2 LYS A 60 -0.606 -11.901 5.253 1.00 0.00 H new ATOM 0 HB3 LYS A 60 -2.171 -11.920 6.041 1.00 0.00 H new ATOM 0 HG2 LYS A 60 -1.542 -13.601 7.388 1.00 0.00 H new ATOM 0 HG3 LYS A 60 -1.108 -14.606 6.019 1.00 0.00 H new ATOM 0 HD2 LYS A 60 1.129 -13.909 6.029 1.00 0.00 H new ATOM 0 HD3 LYS A 60 0.765 -12.387 6.819 1.00 0.00 H new ATOM 0 HE2 LYS A 60 0.860 -13.292 8.920 1.00 0.00 H new ATOM 0 HE3 LYS A 60 0.093 -14.789 8.429 1.00 0.00 H new ATOM 0 HZ1 LYS A 60 2.155 -15.593 8.730 1.00 0.00 H new ATOM 0 HZ2 LYS A 60 2.429 -15.010 7.159 1.00 0.00 H new ATOM 0 HZ3 LYS A 60 2.914 -14.091 8.503 1.00 0.00 H new ATOM 992 N LEU A 61 -1.004 -13.191 2.071 1.00 0.00 N ATOM 993 CA LEU A 61 -0.018 -13.637 1.093 1.00 0.00 C ATOM 994 C LEU A 61 1.350 -13.036 1.400 1.00 0.00 C ATOM 995 O LEU A 61 2.353 -13.747 1.453 1.00 0.00 O ATOM 996 CB LEU A 61 -0.456 -13.247 -0.321 1.00 0.00 C ATOM 997 CG LEU A 61 -1.944 -13.452 -0.618 1.00 0.00 C ATOM 998 CD1 LEU A 61 -2.666 -12.116 -0.688 1.00 0.00 C ATOM 999 CD2 LEU A 61 -2.128 -14.228 -1.917 1.00 0.00 C ATOM 0 H LEU A 61 -1.679 -12.516 1.712 1.00 0.00 H new ATOM 0 HA LEU A 61 0.056 -14.723 1.152 1.00 0.00 H new ATOM 0 HB2 LEU A 61 -0.210 -12.198 -0.485 1.00 0.00 H new ATOM 0 HB3 LEU A 61 0.125 -13.827 -1.038 1.00 0.00 H new ATOM 0 HG LEU A 61 -2.378 -14.033 0.195 1.00 0.00 H new ATOM 0 HD11 LEU A 61 -3.722 -12.284 -0.900 1.00 0.00 H new ATOM 0 HD12 LEU A 61 -2.565 -11.598 0.265 1.00 0.00 H new ATOM 0 HD13 LEU A 61 -2.229 -11.507 -1.480 1.00 0.00 H new ATOM 0 HD21 LEU A 61 -3.192 -14.364 -2.112 1.00 0.00 H new ATOM 0 HD22 LEU A 61 -1.677 -13.673 -2.739 1.00 0.00 H new ATOM 0 HD23 LEU A 61 -1.647 -15.202 -1.830 1.00 0.00 H new ATOM 1011 N PHE A 62 1.380 -11.724 1.611 1.00 0.00 N ATOM 1012 CA PHE A 62 2.621 -11.025 1.925 1.00 0.00 C ATOM 1013 C PHE A 62 2.645 -10.624 3.399 1.00 0.00 C ATOM 1014 O PHE A 62 2.057 -9.615 3.785 1.00 0.00 O ATOM 1015 CB PHE A 62 2.781 -9.788 1.037 1.00 0.00 C ATOM 1016 CG PHE A 62 2.587 -10.067 -0.427 1.00 0.00 C ATOM 1017 CD1 PHE A 62 1.316 -10.225 -0.953 1.00 0.00 C ATOM 1018 CD2 PHE A 62 3.679 -10.173 -1.274 1.00 0.00 C ATOM 1019 CE1 PHE A 62 1.136 -10.483 -2.300 1.00 0.00 C ATOM 1020 CE2 PHE A 62 3.505 -10.431 -2.620 1.00 0.00 C ATOM 1021 CZ PHE A 62 2.233 -10.586 -3.133 1.00 0.00 C ATOM 0 H PHE A 62 0.557 -11.122 1.570 1.00 0.00 H new ATOM 0 HA PHE A 62 3.455 -11.700 1.731 1.00 0.00 H new ATOM 0 HB2 PHE A 62 2.063 -9.030 1.352 1.00 0.00 H new ATOM 0 HB3 PHE A 62 3.775 -9.368 1.189 1.00 0.00 H new ATOM 0 HD1 PHE A 62 0.456 -10.146 -0.305 1.00 0.00 H new ATOM 0 HD2 PHE A 62 4.676 -10.053 -0.878 1.00 0.00 H new ATOM 0 HE1 PHE A 62 0.140 -10.604 -2.700 1.00 0.00 H new ATOM 0 HE2 PHE A 62 4.364 -10.511 -3.270 1.00 0.00 H new ATOM 0 HZ PHE A 62 2.096 -10.788 -4.185 1.00 0.00 H new ATOM 1031 N PRO A 63 3.320 -11.420 4.251 1.00 0.00 N ATOM 1032 CA PRO A 63 3.401 -11.143 5.691 1.00 0.00 C ATOM 1033 C PRO A 63 4.134 -9.841 5.998 1.00 0.00 C ATOM 1034 O PRO A 63 5.172 -9.542 5.407 1.00 0.00 O ATOM 1035 CB PRO A 63 4.180 -12.340 6.249 1.00 0.00 C ATOM 1036 CG PRO A 63 4.918 -12.900 5.082 1.00 0.00 C ATOM 1037 CD PRO A 63 4.044 -12.650 3.886 1.00 0.00 C ATOM 0 HA PRO A 63 2.411 -11.020 6.131 1.00 0.00 H new ATOM 0 HB2 PRO A 63 4.866 -12.031 7.038 1.00 0.00 H new ATOM 0 HB3 PRO A 63 3.508 -13.080 6.683 1.00 0.00 H new ATOM 0 HG2 PRO A 63 5.888 -12.417 4.965 1.00 0.00 H new ATOM 0 HG3 PRO A 63 5.106 -13.966 5.213 1.00 0.00 H new ATOM 0 HD2 PRO A 63 4.632 -12.517 2.978 1.00 0.00 H new ATOM 0 HD3 PRO A 63 3.362 -13.480 3.705 1.00 0.00 H new ATOM 1045 N GLY A 64 3.584 -9.071 6.934 1.00 0.00 N ATOM 1046 CA GLY A 64 4.192 -7.811 7.316 1.00 0.00 C ATOM 1047 C GLY A 64 4.281 -6.831 6.163 1.00 0.00 C ATOM 1048 O GLY A 64 5.145 -5.957 6.152 1.00 0.00 O ATOM 0 H GLY A 64 2.725 -9.300 7.435 1.00 0.00 H new ATOM 0 HA2 GLY A 64 3.613 -7.363 8.124 1.00 0.00 H new ATOM 0 HA3 GLY A 64 5.192 -7.999 7.706 1.00 0.00 H new ATOM 1052 N TYR A 65 3.385 -6.974 5.189 1.00 0.00 N ATOM 1053 CA TYR A 65 3.374 -6.088 4.029 1.00 0.00 C ATOM 1054 C TYR A 65 2.082 -5.278 3.969 1.00 0.00 C ATOM 1055 O TYR A 65 1.015 -5.766 4.346 1.00 0.00 O ATOM 1056 CB TYR A 65 3.539 -6.898 2.742 1.00 0.00 C ATOM 1057 CG TYR A 65 4.982 -7.128 2.351 1.00 0.00 C ATOM 1058 CD1 TYR A 65 5.732 -6.116 1.762 1.00 0.00 C ATOM 1059 CD2 TYR A 65 5.592 -8.356 2.569 1.00 0.00 C ATOM 1060 CE1 TYR A 65 7.050 -6.324 1.402 1.00 0.00 C ATOM 1061 CE2 TYR A 65 6.911 -8.570 2.213 1.00 0.00 C ATOM 1062 CZ TYR A 65 7.635 -7.551 1.629 1.00 0.00 C ATOM 1063 OH TYR A 65 8.946 -7.762 1.273 1.00 0.00 O ATOM 0 H TYR A 65 2.660 -7.692 5.180 1.00 0.00 H new ATOM 0 HA TYR A 65 4.210 -5.395 4.127 1.00 0.00 H new ATOM 0 HB2 TYR A 65 3.046 -7.863 2.864 1.00 0.00 H new ATOM 0 HB3 TYR A 65 3.029 -6.381 1.929 1.00 0.00 H new ATOM 0 HD1 TYR A 65 5.278 -5.153 1.583 1.00 0.00 H new ATOM 0 HD2 TYR A 65 5.028 -9.157 3.024 1.00 0.00 H new ATOM 0 HE1 TYR A 65 7.619 -5.528 0.945 1.00 0.00 H new ATOM 0 HE2 TYR A 65 7.372 -9.530 2.391 1.00 0.00 H new ATOM 0 HH TYR A 65 9.462 -6.943 1.425 1.00 0.00 H new ATOM 1073 N LEU A 66 2.186 -4.042 3.492 1.00 0.00 N ATOM 1074 CA LEU A 66 1.025 -3.165 3.379 1.00 0.00 C ATOM 1075 C LEU A 66 1.112 -2.312 2.116 1.00 0.00 C ATOM 1076 O LEU A 66 1.977 -1.446 2.002 1.00 0.00 O ATOM 1077 CB LEU A 66 0.919 -2.262 4.609 1.00 0.00 C ATOM 1078 CG LEU A 66 0.330 -2.930 5.857 1.00 0.00 C ATOM 1079 CD1 LEU A 66 1.322 -2.889 7.010 1.00 0.00 C ATOM 1080 CD2 LEU A 66 -0.979 -2.262 6.254 1.00 0.00 C ATOM 0 H LEU A 66 3.062 -3.625 3.177 1.00 0.00 H new ATOM 0 HA LEU A 66 0.133 -3.789 3.317 1.00 0.00 H new ATOM 0 HB2 LEU A 66 1.913 -1.887 4.852 1.00 0.00 H new ATOM 0 HB3 LEU A 66 0.305 -1.398 4.354 1.00 0.00 H new ATOM 0 HG LEU A 66 0.126 -3.974 5.620 1.00 0.00 H new ATOM 0 HD11 LEU A 66 0.883 -3.368 7.885 1.00 0.00 H new ATOM 0 HD12 LEU A 66 2.232 -3.417 6.726 1.00 0.00 H new ATOM 0 HD13 LEU A 66 1.562 -1.852 7.247 1.00 0.00 H new ATOM 0 HD21 LEU A 66 -1.382 -2.750 7.142 1.00 0.00 H new ATOM 0 HD22 LEU A 66 -0.799 -1.209 6.469 1.00 0.00 H new ATOM 0 HD23 LEU A 66 -1.694 -2.349 5.436 1.00 0.00 H new ATOM 1092 N PHE A 67 0.210 -2.563 1.171 1.00 0.00 N ATOM 1093 CA PHE A 67 0.192 -1.813 -0.080 1.00 0.00 C ATOM 1094 C PHE A 67 -0.662 -0.555 0.051 1.00 0.00 C ATOM 1095 O PHE A 67 -1.836 -0.627 0.413 1.00 0.00 O ATOM 1096 CB PHE A 67 -0.340 -2.685 -1.220 1.00 0.00 C ATOM 1097 CG PHE A 67 0.255 -4.063 -1.261 1.00 0.00 C ATOM 1098 CD1 PHE A 67 1.600 -4.267 -0.986 1.00 0.00 C ATOM 1099 CD2 PHE A 67 -0.532 -5.159 -1.578 1.00 0.00 C ATOM 1100 CE1 PHE A 67 2.145 -5.537 -1.026 1.00 0.00 C ATOM 1101 CE2 PHE A 67 0.009 -6.429 -1.620 1.00 0.00 C ATOM 1102 CZ PHE A 67 1.348 -6.618 -1.344 1.00 0.00 C ATOM 0 H PHE A 67 -0.515 -3.277 1.247 1.00 0.00 H new ATOM 0 HA PHE A 67 1.216 -1.516 -0.307 1.00 0.00 H new ATOM 0 HB2 PHE A 67 -1.422 -2.770 -1.124 1.00 0.00 H new ATOM 0 HB3 PHE A 67 -0.142 -2.186 -2.169 1.00 0.00 H new ATOM 0 HD1 PHE A 67 2.228 -3.424 -0.738 1.00 0.00 H new ATOM 0 HD2 PHE A 67 -1.581 -5.018 -1.795 1.00 0.00 H new ATOM 0 HE1 PHE A 67 3.193 -5.683 -0.809 1.00 0.00 H new ATOM 0 HE2 PHE A 67 -0.616 -7.274 -1.869 1.00 0.00 H new ATOM 0 HZ PHE A 67 1.772 -7.611 -1.377 1.00 0.00 H new ATOM 1112 N ILE A 68 -0.064 0.594 -0.243 1.00 0.00 N ATOM 1113 CA ILE A 68 -0.770 1.868 -0.155 1.00 0.00 C ATOM 1114 C ILE A 68 -0.595 2.685 -1.430 1.00 0.00 C ATOM 1115 O ILE A 68 0.520 3.077 -1.778 1.00 0.00 O ATOM 1116 CB ILE A 68 -0.277 2.711 1.040 1.00 0.00 C ATOM 1117 CG1 ILE A 68 -0.030 1.828 2.267 1.00 0.00 C ATOM 1118 CG2 ILE A 68 -1.283 3.807 1.365 1.00 0.00 C ATOM 1119 CD1 ILE A 68 1.433 1.710 2.637 1.00 0.00 C ATOM 0 H ILE A 68 0.908 0.670 -0.544 1.00 0.00 H new ATOM 0 HA ILE A 68 -1.824 1.628 -0.015 1.00 0.00 H new ATOM 0 HB ILE A 68 0.669 3.176 0.763 1.00 0.00 H new ATOM 0 HG12 ILE A 68 -0.580 2.235 3.115 1.00 0.00 H new ATOM 0 HG13 ILE A 68 -0.430 0.832 2.076 1.00 0.00 H new ATOM 0 HG21 ILE A 68 -0.922 4.393 2.210 1.00 0.00 H new ATOM 0 HG22 ILE A 68 -1.406 4.457 0.498 1.00 0.00 H new ATOM 0 HG23 ILE A 68 -2.242 3.356 1.620 1.00 0.00 H new ATOM 0 HD11 ILE A 68 1.536 1.071 3.514 1.00 0.00 H new ATOM 0 HD12 ILE A 68 1.985 1.275 1.804 1.00 0.00 H new ATOM 0 HD13 ILE A 68 1.833 2.699 2.860 1.00 0.00 H new ATOM 1131 N GLN A 69 -1.701 2.954 -2.117 1.00 0.00 N ATOM 1132 CA GLN A 69 -1.660 3.739 -3.345 1.00 0.00 C ATOM 1133 C GLN A 69 -1.576 5.225 -3.017 1.00 0.00 C ATOM 1134 O GLN A 69 -2.543 5.967 -3.190 1.00 0.00 O ATOM 1135 CB GLN A 69 -2.891 3.458 -4.208 1.00 0.00 C ATOM 1136 CG GLN A 69 -2.695 3.802 -5.676 1.00 0.00 C ATOM 1137 CD GLN A 69 -3.964 4.315 -6.329 1.00 0.00 C ATOM 1138 OE1 GLN A 69 -4.485 5.367 -5.960 1.00 0.00 O ATOM 1139 NE2 GLN A 69 -4.466 3.570 -7.308 1.00 0.00 N ATOM 0 H GLN A 69 -2.633 2.641 -1.845 1.00 0.00 H new ATOM 0 HA GLN A 69 -0.772 3.450 -3.908 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -3.152 2.403 -4.122 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -3.735 4.028 -3.819 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -1.913 4.556 -5.767 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -2.348 2.917 -6.210 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -4.000 2.705 -7.581 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -5.317 3.863 -7.787 1.00 0.00 H new ATOM 1148 N MET A 70 -0.412 5.645 -2.530 1.00 0.00 N ATOM 1149 CA MET A 70 -0.186 7.038 -2.163 1.00 0.00 C ATOM 1150 C MET A 70 0.373 7.835 -3.338 1.00 0.00 C ATOM 1151 O MET A 70 0.479 7.324 -4.454 1.00 0.00 O ATOM 1152 CB MET A 70 0.765 7.125 -0.967 1.00 0.00 C ATOM 1153 CG MET A 70 2.135 6.518 -1.228 1.00 0.00 C ATOM 1154 SD MET A 70 3.178 6.500 0.244 1.00 0.00 S ATOM 1155 CE MET A 70 2.054 5.802 1.449 1.00 0.00 C ATOM 0 H MET A 70 0.393 5.036 -2.380 1.00 0.00 H new ATOM 0 HA MET A 70 -1.147 7.472 -1.886 1.00 0.00 H new ATOM 0 HB2 MET A 70 0.889 8.171 -0.688 1.00 0.00 H new ATOM 0 HB3 MET A 70 0.310 6.620 -0.115 1.00 0.00 H new ATOM 0 HG2 MET A 70 2.013 5.499 -1.595 1.00 0.00 H new ATOM 0 HG3 MET A 70 2.634 7.082 -2.016 1.00 0.00 H new ATOM 0 HE1 MET A 70 2.605 5.146 2.123 1.00 0.00 H new ATOM 0 HE2 MET A 70 1.591 6.605 2.022 1.00 0.00 H new ATOM 0 HE3 MET A 70 1.281 5.229 0.937 1.00 0.00 H new ATOM 1165 N ASP A 71 0.732 9.089 -3.078 1.00 0.00 N ATOM 1166 CA ASP A 71 1.285 9.958 -4.111 1.00 0.00 C ATOM 1167 C ASP A 71 2.538 10.670 -3.608 1.00 0.00 C ATOM 1168 O ASP A 71 2.504 11.860 -3.293 1.00 0.00 O ATOM 1169 CB ASP A 71 0.242 10.987 -4.553 1.00 0.00 C ATOM 1170 CG ASP A 71 0.310 11.278 -6.039 1.00 0.00 C ATOM 1171 OD1 ASP A 71 1.357 10.985 -6.654 1.00 0.00 O ATOM 1172 OD2 ASP A 71 -0.684 11.797 -6.590 1.00 0.00 O ATOM 0 H ASP A 71 0.650 9.526 -2.160 1.00 0.00 H new ATOM 0 HA ASP A 71 1.558 9.338 -4.965 1.00 0.00 H new ATOM 0 HB2 ASP A 71 -0.754 10.621 -4.302 1.00 0.00 H new ATOM 0 HB3 ASP A 71 0.391 11.913 -3.997 1.00 0.00 H new ATOM 1177 N LEU A 72 3.643 9.935 -3.535 1.00 0.00 N ATOM 1178 CA LEU A 72 4.905 10.498 -3.070 1.00 0.00 C ATOM 1179 C LEU A 72 5.700 11.113 -4.223 1.00 0.00 C ATOM 1180 O LEU A 72 6.848 11.517 -4.047 1.00 0.00 O ATOM 1181 CB LEU A 72 5.745 9.419 -2.384 1.00 0.00 C ATOM 1182 CG LEU A 72 5.090 8.765 -1.167 1.00 0.00 C ATOM 1183 CD1 LEU A 72 6.006 7.706 -0.571 1.00 0.00 C ATOM 1184 CD2 LEU A 72 4.735 9.815 -0.124 1.00 0.00 C ATOM 0 H LEU A 72 3.690 8.949 -3.792 1.00 0.00 H new ATOM 0 HA LEU A 72 4.672 11.287 -2.355 1.00 0.00 H new ATOM 0 HB2 LEU A 72 5.978 8.643 -3.113 1.00 0.00 H new ATOM 0 HB3 LEU A 72 6.693 9.860 -2.074 1.00 0.00 H new ATOM 0 HG LEU A 72 4.170 8.278 -1.491 1.00 0.00 H new ATOM 0 HD11 LEU A 72 5.523 7.252 0.294 1.00 0.00 H new ATOM 0 HD12 LEU A 72 6.209 6.938 -1.318 1.00 0.00 H new ATOM 0 HD13 LEU A 72 6.943 8.168 -0.262 1.00 0.00 H new ATOM 0 HD21 LEU A 72 4.270 9.332 0.735 1.00 0.00 H new ATOM 0 HD22 LEU A 72 5.640 10.331 0.196 1.00 0.00 H new ATOM 0 HD23 LEU A 72 4.040 10.536 -0.555 1.00 0.00 H new ATOM 1196 N GLY A 73 5.085 11.182 -5.401 1.00 0.00 N ATOM 1197 CA GLY A 73 5.757 11.749 -6.554 1.00 0.00 C ATOM 1198 C GLY A 73 5.784 13.264 -6.526 1.00 0.00 C ATOM 1199 O GLY A 73 5.246 13.917 -7.421 1.00 0.00 O ATOM 0 H GLY A 73 4.135 10.855 -5.576 1.00 0.00 H new ATOM 0 HA2 GLY A 73 6.779 11.372 -6.596 1.00 0.00 H new ATOM 0 HA3 GLY A 73 5.256 11.415 -7.463 1.00 0.00 H new ATOM 1203 N ASP A 74 6.415 13.825 -5.500 1.00 0.00 N ATOM 1204 CA ASP A 74 6.510 15.274 -5.363 1.00 0.00 C ATOM 1205 C ASP A 74 7.648 15.824 -6.215 1.00 0.00 C ATOM 1206 O ASP A 74 7.418 16.525 -7.200 1.00 0.00 O ATOM 1207 CB ASP A 74 6.721 15.658 -3.897 1.00 0.00 C ATOM 1208 CG ASP A 74 5.668 15.061 -2.986 1.00 0.00 C ATOM 1209 OD1 ASP A 74 5.655 13.822 -2.824 1.00 0.00 O ATOM 1210 OD2 ASP A 74 4.854 15.832 -2.433 1.00 0.00 O ATOM 0 H ASP A 74 6.868 13.299 -4.752 1.00 0.00 H new ATOM 0 HA ASP A 74 5.574 15.710 -5.712 1.00 0.00 H new ATOM 0 HB2 ASP A 74 7.707 15.324 -3.575 1.00 0.00 H new ATOM 0 HB3 ASP A 74 6.706 16.744 -3.803 1.00 0.00 H new ATOM 1215 N GLU A 75 8.872 15.498 -5.825 1.00 0.00 N ATOM 1216 CA GLU A 75 10.054 15.949 -6.549 1.00 0.00 C ATOM 1217 C GLU A 75 11.275 15.116 -6.166 1.00 0.00 C ATOM 1218 O GLU A 75 11.605 14.138 -6.835 1.00 0.00 O ATOM 1219 CB GLU A 75 10.311 17.434 -6.270 1.00 0.00 C ATOM 1220 CG GLU A 75 9.741 18.361 -7.333 1.00 0.00 C ATOM 1221 CD GLU A 75 8.946 19.508 -6.741 1.00 0.00 C ATOM 1222 OE1 GLU A 75 7.831 19.259 -6.234 1.00 0.00 O ATOM 1223 OE2 GLU A 75 9.437 20.655 -6.784 1.00 0.00 O ATOM 0 H GLU A 75 9.074 14.921 -5.009 1.00 0.00 H new ATOM 0 HA GLU A 75 9.874 15.818 -7.616 1.00 0.00 H new ATOM 0 HB2 GLU A 75 9.879 17.694 -5.304 1.00 0.00 H new ATOM 0 HB3 GLU A 75 11.386 17.600 -6.193 1.00 0.00 H new ATOM 0 HG2 GLU A 75 10.556 18.762 -7.935 1.00 0.00 H new ATOM 0 HG3 GLU A 75 9.101 17.788 -8.004 1.00 0.00 H new ATOM 1230 N GLU A 76 11.941 15.507 -5.083 1.00 0.00 N ATOM 1231 CA GLU A 76 13.122 14.792 -4.612 1.00 0.00 C ATOM 1232 C GLU A 76 12.735 13.698 -3.624 1.00 0.00 C ATOM 1233 O GLU A 76 12.832 12.508 -3.925 1.00 0.00 O ATOM 1234 CB GLU A 76 14.105 15.764 -3.958 1.00 0.00 C ATOM 1235 CG GLU A 76 15.142 16.319 -4.921 1.00 0.00 C ATOM 1236 CD GLU A 76 16.020 17.379 -4.286 1.00 0.00 C ATOM 1237 OE1 GLU A 76 16.770 17.043 -3.345 1.00 0.00 O ATOM 1238 OE2 GLU A 76 15.958 18.545 -4.728 1.00 0.00 O ATOM 0 H GLU A 76 11.683 16.314 -4.516 1.00 0.00 H new ATOM 0 HA GLU A 76 13.603 14.326 -5.472 1.00 0.00 H new ATOM 0 HB2 GLU A 76 13.548 16.592 -3.520 1.00 0.00 H new ATOM 0 HB3 GLU A 76 14.616 15.256 -3.140 1.00 0.00 H new ATOM 0 HG2 GLU A 76 15.768 15.504 -5.284 1.00 0.00 H new ATOM 0 HG3 GLU A 76 14.636 16.743 -5.788 1.00 0.00 H new ATOM 1245 N GLU A 77 12.299 14.114 -2.443 1.00 0.00 N ATOM 1246 CA GLU A 77 11.894 13.180 -1.399 1.00 0.00 C ATOM 1247 C GLU A 77 10.383 13.225 -1.185 1.00 0.00 C ATOM 1248 O GLU A 77 9.730 14.212 -1.520 1.00 0.00 O ATOM 1249 CB GLU A 77 12.617 13.504 -0.091 1.00 0.00 C ATOM 1250 CG GLU A 77 14.091 13.131 -0.100 1.00 0.00 C ATOM 1251 CD GLU A 77 14.354 11.783 0.541 1.00 0.00 C ATOM 1252 OE1 GLU A 77 14.584 11.744 1.768 1.00 0.00 O ATOM 1253 OE2 GLU A 77 14.332 10.766 -0.183 1.00 0.00 O ATOM 0 H GLU A 77 12.216 15.097 -2.182 1.00 0.00 H new ATOM 0 HA GLU A 77 12.167 12.174 -1.718 1.00 0.00 H new ATOM 0 HB2 GLU A 77 12.522 14.571 0.112 1.00 0.00 H new ATOM 0 HB3 GLU A 77 12.123 12.979 0.727 1.00 0.00 H new ATOM 0 HG2 GLU A 77 14.452 13.117 -1.128 1.00 0.00 H new ATOM 0 HG3 GLU A 77 14.659 13.897 0.427 1.00 0.00 H new ATOM 1260 N PRO A 78 9.805 12.150 -0.617 1.00 0.00 N ATOM 1261 CA PRO A 78 8.364 12.075 -0.358 1.00 0.00 C ATOM 1262 C PRO A 78 7.884 13.202 0.551 1.00 0.00 C ATOM 1263 O PRO A 78 8.685 13.990 1.054 1.00 0.00 O ATOM 1264 CB PRO A 78 8.183 10.717 0.333 1.00 0.00 C ATOM 1265 CG PRO A 78 9.545 10.331 0.802 1.00 0.00 C ATOM 1266 CD PRO A 78 10.505 10.931 -0.183 1.00 0.00 C ATOM 0 HA PRO A 78 7.784 12.175 -1.275 1.00 0.00 H new ATOM 0 HB2 PRO A 78 7.485 10.790 1.167 1.00 0.00 H new ATOM 0 HB3 PRO A 78 7.779 9.975 -0.356 1.00 0.00 H new ATOM 0 HG2 PRO A 78 9.732 10.706 1.808 1.00 0.00 H new ATOM 0 HG3 PRO A 78 9.652 9.247 0.841 1.00 0.00 H new ATOM 0 HD2 PRO A 78 11.467 11.158 0.276 1.00 0.00 H new ATOM 0 HD3 PRO A 78 10.702 10.258 -1.018 1.00 0.00 H new ATOM 1274 N ASN A 79 6.573 13.276 0.754 1.00 0.00 N ATOM 1275 CA ASN A 79 5.988 14.310 1.599 1.00 0.00 C ATOM 1276 C ASN A 79 5.963 13.873 3.062 1.00 0.00 C ATOM 1277 O ASN A 79 6.529 12.839 3.421 1.00 0.00 O ATOM 1278 CB ASN A 79 4.570 14.642 1.127 1.00 0.00 C ATOM 1279 CG ASN A 79 3.620 13.471 1.275 1.00 0.00 C ATOM 1280 OD1 ASN A 79 2.919 13.347 2.280 1.00 0.00 O ATOM 1281 ND2 ASN A 79 3.591 12.603 0.270 1.00 0.00 N ATOM 0 H ASN A 79 5.896 12.632 0.345 1.00 0.00 H new ATOM 0 HA ASN A 79 6.609 15.202 1.519 1.00 0.00 H new ATOM 0 HB2 ASN A 79 4.189 15.489 1.698 1.00 0.00 H new ATOM 0 HB3 ASN A 79 4.601 14.950 0.082 1.00 0.00 H new ATOM 0 HD21 ASN A 79 2.970 11.795 0.312 1.00 0.00 H new ATOM 0 HD22 ASN A 79 4.189 12.745 -0.544 1.00 0.00 H new ATOM 1288 N GLU A 80 5.306 14.666 3.900 1.00 0.00 N ATOM 1289 CA GLU A 80 5.205 14.364 5.324 1.00 0.00 C ATOM 1290 C GLU A 80 4.564 12.997 5.557 1.00 0.00 C ATOM 1291 O GLU A 80 4.739 12.393 6.614 1.00 0.00 O ATOM 1292 CB GLU A 80 4.397 15.447 6.039 1.00 0.00 C ATOM 1293 CG GLU A 80 2.984 15.608 5.501 1.00 0.00 C ATOM 1294 CD GLU A 80 2.613 17.059 5.262 1.00 0.00 C ATOM 1295 OE1 GLU A 80 2.609 17.839 6.237 1.00 0.00 O ATOM 1296 OE2 GLU A 80 2.325 17.413 4.100 1.00 0.00 O ATOM 0 H GLU A 80 4.834 15.525 3.618 1.00 0.00 H new ATOM 0 HA GLU A 80 6.215 14.340 5.733 1.00 0.00 H new ATOM 0 HB2 GLU A 80 4.347 15.209 7.102 1.00 0.00 H new ATOM 0 HB3 GLU A 80 4.921 16.398 5.949 1.00 0.00 H new ATOM 0 HG2 GLU A 80 2.889 15.054 4.567 1.00 0.00 H new ATOM 0 HG3 GLU A 80 2.278 15.168 6.206 1.00 0.00 H new ATOM 1303 N ALA A 81 3.821 12.513 4.563 1.00 0.00 N ATOM 1304 CA ALA A 81 3.156 11.218 4.665 1.00 0.00 C ATOM 1305 C ALA A 81 4.129 10.129 5.107 1.00 0.00 C ATOM 1306 O ALA A 81 3.798 9.288 5.943 1.00 0.00 O ATOM 1307 CB ALA A 81 2.518 10.847 3.334 1.00 0.00 C ATOM 0 H ALA A 81 3.665 12.998 3.680 1.00 0.00 H new ATOM 0 HA ALA A 81 2.376 11.299 5.422 1.00 0.00 H new ATOM 0 HB1 ALA A 81 2.025 9.879 3.424 1.00 0.00 H new ATOM 0 HB2 ALA A 81 1.783 11.604 3.059 1.00 0.00 H new ATOM 0 HB3 ALA A 81 3.288 10.792 2.564 1.00 0.00 H new ATOM 1313 N TRP A 82 5.330 10.152 4.540 1.00 0.00 N ATOM 1314 CA TRP A 82 6.353 9.168 4.874 1.00 0.00 C ATOM 1315 C TRP A 82 6.782 9.300 6.332 1.00 0.00 C ATOM 1316 O TRP A 82 7.011 8.302 7.015 1.00 0.00 O ATOM 1317 CB TRP A 82 7.566 9.332 3.958 1.00 0.00 C ATOM 1318 CG TRP A 82 8.462 8.132 3.938 1.00 0.00 C ATOM 1319 CD1 TRP A 82 9.811 8.111 4.142 1.00 0.00 C ATOM 1320 CD2 TRP A 82 8.071 6.775 3.700 1.00 0.00 C ATOM 1321 NE1 TRP A 82 10.284 6.825 4.046 1.00 0.00 N ATOM 1322 CE2 TRP A 82 9.235 5.986 3.776 1.00 0.00 C ATOM 1323 CE3 TRP A 82 6.849 6.151 3.432 1.00 0.00 C ATOM 1324 CZ2 TRP A 82 9.210 4.605 3.593 1.00 0.00 C ATOM 1325 CZ3 TRP A 82 6.827 4.780 3.251 1.00 0.00 C ATOM 1326 CH2 TRP A 82 8.001 4.021 3.331 1.00 0.00 C ATOM 0 H TRP A 82 5.619 10.842 3.846 1.00 0.00 H new ATOM 0 HA TRP A 82 5.927 8.175 4.728 1.00 0.00 H new ATOM 0 HB2 TRP A 82 7.222 9.536 2.944 1.00 0.00 H new ATOM 0 HB3 TRP A 82 8.141 10.200 4.280 1.00 0.00 H new ATOM 0 HD1 TRP A 82 10.419 8.980 4.349 1.00 0.00 H new ATOM 0 HE1 TRP A 82 11.257 6.541 4.158 1.00 0.00 H new ATOM 0 HE3 TRP A 82 5.939 6.729 3.367 1.00 0.00 H new ATOM 0 HZ2 TRP A 82 10.113 4.016 3.656 1.00 0.00 H new ATOM 0 HZ3 TRP A 82 5.889 4.287 3.045 1.00 0.00 H new ATOM 0 HH2 TRP A 82 7.951 2.952 3.183 1.00 0.00 H new ATOM 1337 N GLU A 83 6.889 10.538 6.803 1.00 0.00 N ATOM 1338 CA GLU A 83 7.290 10.801 8.179 1.00 0.00 C ATOM 1339 C GLU A 83 6.295 10.194 9.163 1.00 0.00 C ATOM 1340 O GLU A 83 6.686 9.595 10.166 1.00 0.00 O ATOM 1341 CB GLU A 83 7.410 12.308 8.419 1.00 0.00 C ATOM 1342 CG GLU A 83 8.791 12.864 8.121 1.00 0.00 C ATOM 1343 CD GLU A 83 9.252 13.870 9.157 1.00 0.00 C ATOM 1344 OE1 GLU A 83 9.107 13.586 10.364 1.00 0.00 O ATOM 1345 OE2 GLU A 83 9.759 14.940 8.762 1.00 0.00 O ATOM 0 H GLU A 83 6.703 11.375 6.251 1.00 0.00 H new ATOM 0 HA GLU A 83 8.262 10.336 8.342 1.00 0.00 H new ATOM 0 HB2 GLU A 83 6.678 12.825 7.799 1.00 0.00 H new ATOM 0 HB3 GLU A 83 7.157 12.523 9.457 1.00 0.00 H new ATOM 0 HG2 GLU A 83 9.506 12.043 8.074 1.00 0.00 H new ATOM 0 HG3 GLU A 83 8.784 13.337 7.139 1.00 0.00 H new ATOM 1352 N VAL A 84 5.008 10.351 8.872 1.00 0.00 N ATOM 1353 CA VAL A 84 3.959 9.814 9.731 1.00 0.00 C ATOM 1354 C VAL A 84 4.085 8.302 9.869 1.00 0.00 C ATOM 1355 O VAL A 84 4.100 7.766 10.979 1.00 0.00 O ATOM 1356 CB VAL A 84 2.558 10.153 9.191 1.00 0.00 C ATOM 1357 CG1 VAL A 84 1.488 9.758 10.198 1.00 0.00 C ATOM 1358 CG2 VAL A 84 2.458 11.630 8.844 1.00 0.00 C ATOM 0 H VAL A 84 4.666 10.846 8.048 1.00 0.00 H new ATOM 0 HA VAL A 84 4.084 10.279 10.709 1.00 0.00 H new ATOM 0 HB VAL A 84 2.394 9.581 8.278 1.00 0.00 H new ATOM 0 HG11 VAL A 84 0.504 10.005 9.799 1.00 0.00 H new ATOM 0 HG12 VAL A 84 1.544 8.686 10.387 1.00 0.00 H new ATOM 0 HG13 VAL A 84 1.648 10.300 11.130 1.00 0.00 H new ATOM 0 HG21 VAL A 84 1.460 11.848 8.464 1.00 0.00 H new ATOM 0 HG22 VAL A 84 2.645 12.227 9.737 1.00 0.00 H new ATOM 0 HG23 VAL A 84 3.198 11.876 8.082 1.00 0.00 H new ATOM 1368 N VAL A 85 4.178 7.618 8.735 1.00 0.00 N ATOM 1369 CA VAL A 85 4.304 6.166 8.724 1.00 0.00 C ATOM 1370 C VAL A 85 5.583 5.720 9.425 1.00 0.00 C ATOM 1371 O VAL A 85 5.579 4.758 10.194 1.00 0.00 O ATOM 1372 CB VAL A 85 4.303 5.613 7.284 1.00 0.00 C ATOM 1373 CG1 VAL A 85 4.238 4.094 7.295 1.00 0.00 C ATOM 1374 CG2 VAL A 85 3.146 6.199 6.490 1.00 0.00 C ATOM 0 H VAL A 85 4.168 8.047 7.810 1.00 0.00 H new ATOM 0 HA VAL A 85 3.441 5.770 9.259 1.00 0.00 H new ATOM 0 HB VAL A 85 5.233 5.909 6.799 1.00 0.00 H new ATOM 0 HG11 VAL A 85 4.238 3.722 6.270 1.00 0.00 H new ATOM 0 HG12 VAL A 85 5.103 3.697 7.825 1.00 0.00 H new ATOM 0 HG13 VAL A 85 3.326 3.772 7.797 1.00 0.00 H new ATOM 0 HG21 VAL A 85 3.160 5.798 5.476 1.00 0.00 H new ATOM 0 HG22 VAL A 85 2.204 5.935 6.971 1.00 0.00 H new ATOM 0 HG23 VAL A 85 3.243 7.284 6.452 1.00 0.00 H new ATOM 1384 N ARG A 86 6.676 6.425 9.157 1.00 0.00 N ATOM 1385 CA ARG A 86 7.962 6.102 9.763 1.00 0.00 C ATOM 1386 C ARG A 86 7.944 6.350 11.270 1.00 0.00 C ATOM 1387 O ARG A 86 8.801 5.852 11.999 1.00 0.00 O ATOM 1388 CB ARG A 86 9.077 6.926 9.110 1.00 0.00 C ATOM 1389 CG ARG A 86 10.109 6.081 8.382 1.00 0.00 C ATOM 1390 CD ARG A 86 10.757 5.068 9.314 1.00 0.00 C ATOM 1391 NE ARG A 86 11.270 5.693 10.531 1.00 0.00 N ATOM 1392 CZ ARG A 86 11.742 5.010 11.572 1.00 0.00 C ATOM 1393 NH1 ARG A 86 11.766 3.683 11.549 1.00 0.00 N ATOM 1394 NH2 ARG A 86 12.190 5.656 12.639 1.00 0.00 N ATOM 0 H ARG A 86 6.697 7.224 8.524 1.00 0.00 H new ATOM 0 HA ARG A 86 8.153 5.042 9.596 1.00 0.00 H new ATOM 0 HB2 ARG A 86 8.633 7.629 8.406 1.00 0.00 H new ATOM 0 HB3 ARG A 86 9.578 7.516 9.877 1.00 0.00 H new ATOM 0 HG2 ARG A 86 9.634 5.560 7.551 1.00 0.00 H new ATOM 0 HG3 ARG A 86 10.876 6.728 7.956 1.00 0.00 H new ATOM 0 HD2 ARG A 86 10.029 4.302 9.579 1.00 0.00 H new ATOM 0 HD3 ARG A 86 11.572 4.566 8.793 1.00 0.00 H new ATOM 0 HE ARG A 86 11.266 6.711 10.586 1.00 0.00 H new ATOM 0 HH11 ARG A 86 11.422 3.181 10.731 1.00 0.00 H new ATOM 0 HH12 ARG A 86 12.129 3.166 12.350 1.00 0.00 H new ATOM 0 HH21 ARG A 86 12.173 6.676 12.662 1.00 0.00 H new ATOM 0 HH22 ARG A 86 12.552 5.134 13.437 1.00 0.00 H new ATOM 1408 N GLY A 87 6.966 7.125 11.734 1.00 0.00 N ATOM 1409 CA GLY A 87 6.867 7.423 13.151 1.00 0.00 C ATOM 1410 C GLY A 87 5.723 6.698 13.834 1.00 0.00 C ATOM 1411 O GLY A 87 5.680 6.620 15.062 1.00 0.00 O ATOM 0 H GLY A 87 6.242 7.550 11.154 1.00 0.00 H new ATOM 0 HA2 GLY A 87 7.803 7.153 13.639 1.00 0.00 H new ATOM 0 HA3 GLY A 87 6.738 8.497 13.282 1.00 0.00 H new ATOM 1415 N THR A 88 4.791 6.169 13.046 1.00 0.00 N ATOM 1416 CA THR A 88 3.647 5.452 13.600 1.00 0.00 C ATOM 1417 C THR A 88 4.100 4.216 14.377 1.00 0.00 C ATOM 1418 O THR A 88 5.045 3.536 13.978 1.00 0.00 O ATOM 1419 CB THR A 88 2.680 5.042 12.487 1.00 0.00 C ATOM 1420 OG1 THR A 88 3.375 4.825 11.273 1.00 0.00 O ATOM 1421 CG2 THR A 88 1.603 6.071 12.220 1.00 0.00 C ATOM 0 H THR A 88 4.805 6.223 12.028 1.00 0.00 H new ATOM 0 HA THR A 88 3.132 6.124 14.287 1.00 0.00 H new ATOM 0 HB THR A 88 2.206 4.126 12.841 1.00 0.00 H new ATOM 0 HG1 THR A 88 4.247 4.421 11.463 1.00 0.00 H new ATOM 0 HG21 THR A 88 0.952 5.717 11.420 1.00 0.00 H new ATOM 0 HG22 THR A 88 1.015 6.225 13.125 1.00 0.00 H new ATOM 0 HG23 THR A 88 2.065 7.012 11.923 1.00 0.00 H new ATOM 1429 N PRO A 89 3.430 3.906 15.501 1.00 0.00 N ATOM 1430 CA PRO A 89 3.775 2.744 16.329 1.00 0.00 C ATOM 1431 C PRO A 89 3.785 1.440 15.534 1.00 0.00 C ATOM 1432 O PRO A 89 4.389 0.453 15.954 1.00 0.00 O ATOM 1433 CB PRO A 89 2.666 2.712 17.385 1.00 0.00 C ATOM 1434 CG PRO A 89 2.157 4.110 17.447 1.00 0.00 C ATOM 1435 CD PRO A 89 2.288 4.659 16.054 1.00 0.00 C ATOM 0 HA PRO A 89 4.779 2.832 16.745 1.00 0.00 H new ATOM 0 HB2 PRO A 89 1.875 2.015 17.107 1.00 0.00 H new ATOM 0 HB3 PRO A 89 3.050 2.388 18.352 1.00 0.00 H new ATOM 0 HG2 PRO A 89 1.119 4.133 17.780 1.00 0.00 H new ATOM 0 HG3 PRO A 89 2.733 4.704 18.157 1.00 0.00 H new ATOM 0 HD2 PRO A 89 1.381 4.500 15.471 1.00 0.00 H new ATOM 0 HD3 PRO A 89 2.478 5.732 16.060 1.00 0.00 H new ATOM 1443 N GLY A 90 3.110 1.437 14.388 1.00 0.00 N ATOM 1444 CA GLY A 90 3.053 0.245 13.564 1.00 0.00 C ATOM 1445 C GLY A 90 4.133 0.209 12.499 1.00 0.00 C ATOM 1446 O GLY A 90 3.899 -0.269 11.389 1.00 0.00 O ATOM 0 H GLY A 90 2.602 2.239 14.016 1.00 0.00 H new ATOM 0 HA2 GLY A 90 3.148 -0.635 14.200 1.00 0.00 H new ATOM 0 HA3 GLY A 90 2.076 0.188 13.085 1.00 0.00 H new ATOM 1450 N ILE A 91 5.319 0.709 12.833 1.00 0.00 N ATOM 1451 CA ILE A 91 6.433 0.720 11.890 1.00 0.00 C ATOM 1452 C ILE A 91 7.736 0.312 12.571 1.00 0.00 C ATOM 1453 O ILE A 91 8.040 0.764 13.675 1.00 0.00 O ATOM 1454 CB ILE A 91 6.610 2.109 11.238 1.00 0.00 C ATOM 1455 CG1 ILE A 91 7.583 2.021 10.061 1.00 0.00 C ATOM 1456 CG2 ILE A 91 7.093 3.129 12.259 1.00 0.00 C ATOM 1457 CD1 ILE A 91 6.907 1.759 8.734 1.00 0.00 C ATOM 0 H ILE A 91 5.533 1.110 13.746 1.00 0.00 H new ATOM 0 HA ILE A 91 6.195 -0.005 11.112 1.00 0.00 H new ATOM 0 HB ILE A 91 5.641 2.440 10.864 1.00 0.00 H new ATOM 0 HG12 ILE A 91 8.145 2.952 9.995 1.00 0.00 H new ATOM 0 HG13 ILE A 91 8.304 1.227 10.255 1.00 0.00 H new ATOM 0 HG21 ILE A 91 7.210 4.099 11.776 1.00 0.00 H new ATOM 0 HG22 ILE A 91 6.364 3.210 13.065 1.00 0.00 H new ATOM 0 HG23 ILE A 91 8.051 2.809 12.668 1.00 0.00 H new ATOM 0 HD11 ILE A 91 7.659 1.709 7.946 1.00 0.00 H new ATOM 0 HD12 ILE A 91 6.368 0.813 8.781 1.00 0.00 H new ATOM 0 HD13 ILE A 91 6.207 2.566 8.517 1.00 0.00 H new ATOM 1469 N THR A 92 8.502 -0.545 11.905 1.00 0.00 N ATOM 1470 CA THR A 92 9.773 -1.014 12.446 1.00 0.00 C ATOM 1471 C THR A 92 10.943 -0.479 11.625 1.00 0.00 C ATOM 1472 O THR A 92 11.962 -0.062 12.176 1.00 0.00 O ATOM 1473 CB THR A 92 9.808 -2.544 12.470 1.00 0.00 C ATOM 1474 OG1 THR A 92 8.948 -3.080 11.480 1.00 0.00 O ATOM 1475 CG2 THR A 92 9.397 -3.130 13.804 1.00 0.00 C ATOM 0 H THR A 92 8.265 -0.929 10.990 1.00 0.00 H new ATOM 0 HA THR A 92 9.866 -0.640 13.466 1.00 0.00 H new ATOM 0 HB THR A 92 10.846 -2.814 12.278 1.00 0.00 H new ATOM 0 HG1 THR A 92 8.985 -4.059 11.510 1.00 0.00 H new ATOM 0 HG21 THR A 92 9.444 -4.218 13.753 1.00 0.00 H new ATOM 0 HG22 THR A 92 10.073 -2.774 14.582 1.00 0.00 H new ATOM 0 HG23 THR A 92 8.378 -2.821 14.039 1.00 0.00 H new ATOM 1483 N GLY A 93 10.789 -0.497 10.306 1.00 0.00 N ATOM 1484 CA GLY A 93 11.839 -0.012 9.430 1.00 0.00 C ATOM 1485 C GLY A 93 11.502 -0.193 7.963 1.00 0.00 C ATOM 1486 O GLY A 93 10.443 0.240 7.505 1.00 0.00 O ATOM 0 H GLY A 93 9.956 -0.839 9.828 1.00 0.00 H new ATOM 0 HA2 GLY A 93 12.016 1.045 9.631 1.00 0.00 H new ATOM 0 HA3 GLY A 93 12.767 -0.539 9.654 1.00 0.00 H new ATOM 1490 N PHE A 94 12.402 -0.835 7.226 1.00 0.00 N ATOM 1491 CA PHE A 94 12.192 -1.070 5.801 1.00 0.00 C ATOM 1492 C PHE A 94 12.949 -2.313 5.340 1.00 0.00 C ATOM 1493 O PHE A 94 13.634 -2.963 6.129 1.00 0.00 O ATOM 1494 CB PHE A 94 12.638 0.146 4.987 1.00 0.00 C ATOM 1495 CG PHE A 94 14.029 0.617 5.310 1.00 0.00 C ATOM 1496 CD1 PHE A 94 14.333 1.125 6.565 1.00 0.00 C ATOM 1497 CD2 PHE A 94 15.034 0.553 4.358 1.00 0.00 C ATOM 1498 CE1 PHE A 94 15.610 1.558 6.862 1.00 0.00 C ATOM 1499 CE2 PHE A 94 16.314 0.985 4.649 1.00 0.00 C ATOM 1500 CZ PHE A 94 16.601 1.488 5.903 1.00 0.00 C ATOM 0 H PHE A 94 13.282 -1.201 7.590 1.00 0.00 H new ATOM 0 HA PHE A 94 11.126 -1.232 5.638 1.00 0.00 H new ATOM 0 HB2 PHE A 94 12.585 -0.099 3.926 1.00 0.00 H new ATOM 0 HB3 PHE A 94 11.938 0.964 5.160 1.00 0.00 H new ATOM 0 HD1 PHE A 94 13.561 1.182 7.319 1.00 0.00 H new ATOM 0 HD2 PHE A 94 14.814 0.161 3.376 1.00 0.00 H new ATOM 0 HE1 PHE A 94 15.833 1.951 7.843 1.00 0.00 H new ATOM 0 HE2 PHE A 94 17.088 0.929 3.898 1.00 0.00 H new ATOM 0 HZ PHE A 94 17.600 1.826 6.133 1.00 0.00 H new ATOM 1510 N VAL A 95 12.819 -2.640 4.056 1.00 0.00 N ATOM 1511 CA VAL A 95 13.490 -3.805 3.491 1.00 0.00 C ATOM 1512 C VAL A 95 14.993 -3.751 3.738 1.00 0.00 C ATOM 1513 O VAL A 95 15.618 -4.765 4.051 1.00 0.00 O ATOM 1514 CB VAL A 95 13.237 -3.925 1.976 1.00 0.00 C ATOM 1515 CG1 VAL A 95 11.807 -4.364 1.702 1.00 0.00 C ATOM 1516 CG2 VAL A 95 13.544 -2.609 1.274 1.00 0.00 C ATOM 0 H VAL A 95 12.255 -2.114 3.389 1.00 0.00 H new ATOM 0 HA VAL A 95 13.072 -4.678 3.992 1.00 0.00 H new ATOM 0 HB VAL A 95 13.907 -4.687 1.577 1.00 0.00 H new ATOM 0 HG11 VAL A 95 11.650 -4.442 0.626 1.00 0.00 H new ATOM 0 HG12 VAL A 95 11.629 -5.334 2.166 1.00 0.00 H new ATOM 0 HG13 VAL A 95 11.115 -3.631 2.117 1.00 0.00 H new ATOM 0 HG21 VAL A 95 13.359 -2.715 0.205 1.00 0.00 H new ATOM 0 HG22 VAL A 95 12.904 -1.824 1.677 1.00 0.00 H new ATOM 0 HG23 VAL A 95 14.589 -2.345 1.437 1.00 0.00 H new ATOM 1526 N GLY A 96 15.567 -2.562 3.594 1.00 0.00 N ATOM 1527 CA GLY A 96 16.994 -2.395 3.804 1.00 0.00 C ATOM 1528 C GLY A 96 17.808 -2.772 2.582 1.00 0.00 C ATOM 1529 O GLY A 96 18.840 -3.433 2.696 1.00 0.00 O ATOM 0 H GLY A 96 15.070 -1.710 3.335 1.00 0.00 H new ATOM 0 HA2 GLY A 96 17.200 -1.358 4.068 1.00 0.00 H new ATOM 0 HA3 GLY A 96 17.308 -3.008 4.649 1.00 0.00 H new ATOM 1533 N ALA A 97 17.344 -2.350 1.410 1.00 0.00 N ATOM 1534 CA ALA A 97 18.037 -2.646 0.161 1.00 0.00 C ATOM 1535 C ALA A 97 18.662 -1.386 -0.428 1.00 0.00 C ATOM 1536 O ALA A 97 19.866 -1.160 -0.301 1.00 0.00 O ATOM 1537 CB ALA A 97 17.079 -3.281 -0.835 1.00 0.00 C ATOM 0 H ALA A 97 16.491 -1.802 1.299 1.00 0.00 H new ATOM 0 HA ALA A 97 18.839 -3.352 0.374 1.00 0.00 H new ATOM 0 HB1 ALA A 97 17.609 -3.497 -1.763 1.00 0.00 H new ATOM 0 HB2 ALA A 97 16.683 -4.208 -0.419 1.00 0.00 H new ATOM 0 HB3 ALA A 97 16.257 -2.594 -1.038 1.00 0.00 H new ATOM 1543 N GLY A 98 17.837 -0.568 -1.073 1.00 0.00 N ATOM 1544 CA GLY A 98 18.325 0.661 -1.671 1.00 0.00 C ATOM 1545 C GLY A 98 17.700 1.893 -1.047 1.00 0.00 C ATOM 1546 O GLY A 98 18.403 2.769 -0.545 1.00 0.00 O ATOM 0 H GLY A 98 16.838 -0.735 -1.192 1.00 0.00 H new ATOM 0 HA2 GLY A 98 19.408 0.711 -1.561 1.00 0.00 H new ATOM 0 HA3 GLY A 98 18.113 0.651 -2.740 1.00 0.00 H new ATOM 1550 N MET A 99 16.372 1.955 -1.076 1.00 0.00 N ATOM 1551 CA MET A 99 15.647 3.087 -0.507 1.00 0.00 C ATOM 1552 C MET A 99 14.867 2.657 0.732 1.00 0.00 C ATOM 1553 O MET A 99 14.987 1.520 1.189 1.00 0.00 O ATOM 1554 CB MET A 99 14.698 3.685 -1.546 1.00 0.00 C ATOM 1555 CG MET A 99 14.596 5.199 -1.476 1.00 0.00 C ATOM 1556 SD MET A 99 14.356 5.956 -3.094 1.00 0.00 S ATOM 1557 CE MET A 99 12.905 5.077 -3.667 1.00 0.00 C ATOM 0 H MET A 99 15.777 1.236 -1.487 1.00 0.00 H new ATOM 0 HA MET A 99 16.371 3.847 -0.213 1.00 0.00 H new ATOM 0 HB2 MET A 99 15.035 3.398 -2.542 1.00 0.00 H new ATOM 0 HB3 MET A 99 13.706 3.256 -1.409 1.00 0.00 H new ATOM 0 HG2 MET A 99 13.766 5.473 -0.824 1.00 0.00 H new ATOM 0 HG3 MET A 99 15.503 5.600 -1.023 1.00 0.00 H new ATOM 0 HE1 MET A 99 12.526 5.551 -4.572 1.00 0.00 H new ATOM 0 HE2 MET A 99 13.168 4.042 -3.883 1.00 0.00 H new ATOM 0 HE3 MET A 99 12.136 5.102 -2.895 1.00 0.00 H new ATOM 1567 N ARG A 100 14.069 3.572 1.275 1.00 0.00 N ATOM 1568 CA ARG A 100 13.275 3.280 2.463 1.00 0.00 C ATOM 1569 C ARG A 100 11.990 2.532 2.104 1.00 0.00 C ATOM 1570 O ARG A 100 11.677 1.506 2.707 1.00 0.00 O ATOM 1571 CB ARG A 100 12.939 4.568 3.221 1.00 0.00 C ATOM 1572 CG ARG A 100 14.098 5.549 3.304 1.00 0.00 C ATOM 1573 CD ARG A 100 15.168 5.067 4.273 1.00 0.00 C ATOM 1574 NE ARG A 100 14.880 5.463 5.649 1.00 0.00 N ATOM 1575 CZ ARG A 100 14.958 6.715 6.092 1.00 0.00 C ATOM 1576 NH1 ARG A 100 15.312 7.696 5.270 1.00 0.00 N ATOM 1577 NH2 ARG A 100 14.681 6.988 7.360 1.00 0.00 N ATOM 0 H ARG A 100 13.956 4.519 0.912 1.00 0.00 H new ATOM 0 HA ARG A 100 13.874 2.638 3.108 1.00 0.00 H new ATOM 0 HB2 ARG A 100 12.095 5.056 2.733 1.00 0.00 H new ATOM 0 HB3 ARG A 100 12.619 4.312 4.231 1.00 0.00 H new ATOM 0 HG2 ARG A 100 14.535 5.682 2.314 1.00 0.00 H new ATOM 0 HG3 ARG A 100 13.729 6.524 3.623 1.00 0.00 H new ATOM 0 HD2 ARG A 100 15.245 3.981 4.217 1.00 0.00 H new ATOM 0 HD3 ARG A 100 16.135 5.471 3.975 1.00 0.00 H new ATOM 0 HE ARG A 100 14.603 4.737 6.309 1.00 0.00 H new ATOM 0 HH11 ARG A 100 15.526 7.491 4.294 1.00 0.00 H new ATOM 0 HH12 ARG A 100 15.370 8.654 5.615 1.00 0.00 H new ATOM 0 HH21 ARG A 100 14.408 6.238 7.995 1.00 0.00 H new ATOM 0 HH22 ARG A 100 14.741 7.948 7.700 1.00 0.00 H new ATOM 1591 N PRO A 101 11.224 3.033 1.117 1.00 0.00 N ATOM 1592 CA PRO A 101 9.977 2.400 0.692 1.00 0.00 C ATOM 1593 C PRO A 101 10.207 1.241 -0.271 1.00 0.00 C ATOM 1594 O PRO A 101 11.340 0.804 -0.477 1.00 0.00 O ATOM 1595 CB PRO A 101 9.243 3.536 -0.009 1.00 0.00 C ATOM 1596 CG PRO A 101 10.326 4.381 -0.589 1.00 0.00 C ATOM 1597 CD PRO A 101 11.511 4.254 0.337 1.00 0.00 C ATOM 0 HA PRO A 101 9.432 1.963 1.529 1.00 0.00 H new ATOM 0 HB2 PRO A 101 8.576 3.159 -0.784 1.00 0.00 H new ATOM 0 HB3 PRO A 101 8.629 4.103 0.691 1.00 0.00 H new ATOM 0 HG2 PRO A 101 10.582 4.047 -1.595 1.00 0.00 H new ATOM 0 HG3 PRO A 101 10.006 5.420 -0.670 1.00 0.00 H new ATOM 0 HD2 PRO A 101 12.444 4.163 -0.219 1.00 0.00 H new ATOM 0 HD3 PRO A 101 11.609 5.127 0.983 1.00 0.00 H new ATOM 1605 N VAL A 102 9.123 0.748 -0.862 1.00 0.00 N ATOM 1606 CA VAL A 102 9.201 -0.359 -1.807 1.00 0.00 C ATOM 1607 C VAL A 102 8.040 -0.318 -2.799 1.00 0.00 C ATOM 1608 O VAL A 102 7.130 -1.146 -2.741 1.00 0.00 O ATOM 1609 CB VAL A 102 9.199 -1.719 -1.085 1.00 0.00 C ATOM 1610 CG1 VAL A 102 9.482 -2.846 -2.067 1.00 0.00 C ATOM 1611 CG2 VAL A 102 10.212 -1.725 0.051 1.00 0.00 C ATOM 0 H VAL A 102 8.179 1.099 -0.702 1.00 0.00 H new ATOM 0 HA VAL A 102 10.141 -0.247 -2.347 1.00 0.00 H new ATOM 0 HB VAL A 102 8.209 -1.880 -0.658 1.00 0.00 H new ATOM 0 HG11 VAL A 102 9.477 -3.799 -1.538 1.00 0.00 H new ATOM 0 HG12 VAL A 102 8.714 -2.856 -2.841 1.00 0.00 H new ATOM 0 HG13 VAL A 102 10.458 -2.692 -2.527 1.00 0.00 H new ATOM 0 HG21 VAL A 102 10.195 -2.695 0.548 1.00 0.00 H new ATOM 0 HG22 VAL A 102 11.209 -1.540 -0.349 1.00 0.00 H new ATOM 0 HG23 VAL A 102 9.959 -0.945 0.769 1.00 0.00 H new ATOM 1621 N PRO A 103 8.054 0.655 -3.726 1.00 0.00 N ATOM 1622 CA PRO A 103 6.998 0.805 -4.733 1.00 0.00 C ATOM 1623 C PRO A 103 6.851 -0.435 -5.609 1.00 0.00 C ATOM 1624 O PRO A 103 7.838 -0.976 -6.108 1.00 0.00 O ATOM 1625 CB PRO A 103 7.463 1.999 -5.576 1.00 0.00 C ATOM 1626 CG PRO A 103 8.429 2.732 -4.710 1.00 0.00 C ATOM 1627 CD PRO A 103 9.097 1.686 -3.864 1.00 0.00 C ATOM 0 HA PRO A 103 6.021 0.949 -4.272 1.00 0.00 H new ATOM 0 HB2 PRO A 103 7.935 1.668 -6.501 1.00 0.00 H new ATOM 0 HB3 PRO A 103 6.623 2.635 -5.856 1.00 0.00 H new ATOM 0 HG2 PRO A 103 9.159 3.274 -5.311 1.00 0.00 H new ATOM 0 HG3 PRO A 103 7.917 3.468 -4.090 1.00 0.00 H new ATOM 0 HD2 PRO A 103 9.993 1.292 -4.343 1.00 0.00 H new ATOM 0 HD3 PRO A 103 9.402 2.084 -2.896 1.00 0.00 H new ATOM 1635 N LEU A 104 5.612 -0.881 -5.792 1.00 0.00 N ATOM 1636 CA LEU A 104 5.336 -2.057 -6.610 1.00 0.00 C ATOM 1637 C LEU A 104 5.150 -1.670 -8.074 1.00 0.00 C ATOM 1638 O LEU A 104 4.904 -0.507 -8.393 1.00 0.00 O ATOM 1639 CB LEU A 104 4.085 -2.776 -6.101 1.00 0.00 C ATOM 1640 CG LEU A 104 3.991 -2.913 -4.578 1.00 0.00 C ATOM 1641 CD1 LEU A 104 2.604 -2.524 -4.090 1.00 0.00 C ATOM 1642 CD2 LEU A 104 4.330 -4.333 -4.148 1.00 0.00 C ATOM 0 H LEU A 104 4.784 -0.446 -5.385 1.00 0.00 H new ATOM 0 HA LEU A 104 6.191 -2.729 -6.535 1.00 0.00 H new ATOM 0 HB2 LEU A 104 3.206 -2.239 -6.457 1.00 0.00 H new ATOM 0 HB3 LEU A 104 4.052 -3.772 -6.543 1.00 0.00 H new ATOM 0 HG LEU A 104 4.715 -2.235 -4.127 1.00 0.00 H new ATOM 0 HD11 LEU A 104 2.557 -2.628 -3.006 1.00 0.00 H new ATOM 0 HD12 LEU A 104 2.399 -1.489 -4.364 1.00 0.00 H new ATOM 0 HD13 LEU A 104 1.861 -3.176 -4.549 1.00 0.00 H new ATOM 0 HD21 LEU A 104 4.258 -4.412 -3.063 1.00 0.00 H new ATOM 0 HD22 LEU A 104 3.630 -5.030 -4.610 1.00 0.00 H new ATOM 0 HD23 LEU A 104 5.345 -4.576 -4.463 1.00 0.00 H new ATOM 1654 N SER A 105 5.270 -2.653 -8.961 1.00 0.00 N ATOM 1655 CA SER A 105 5.115 -2.415 -10.392 1.00 0.00 C ATOM 1656 C SER A 105 3.659 -2.593 -10.818 1.00 0.00 C ATOM 1657 O SER A 105 2.904 -3.330 -10.184 1.00 0.00 O ATOM 1658 CB SER A 105 6.012 -3.364 -11.189 1.00 0.00 C ATOM 1659 OG SER A 105 7.250 -2.752 -11.504 1.00 0.00 O ATOM 0 H SER A 105 5.474 -3.621 -8.714 1.00 0.00 H new ATOM 0 HA SER A 105 5.413 -1.387 -10.599 1.00 0.00 H new ATOM 0 HB2 SER A 105 6.188 -4.272 -10.613 1.00 0.00 H new ATOM 0 HB3 SER A 105 5.506 -3.662 -12.107 1.00 0.00 H new ATOM 0 HG SER A 105 7.805 -3.380 -12.012 1.00 0.00 H new ATOM 1665 N PRO A 106 3.244 -1.916 -11.904 1.00 0.00 N ATOM 1666 CA PRO A 106 1.871 -2.004 -12.411 1.00 0.00 C ATOM 1667 C PRO A 106 1.410 -3.447 -12.596 1.00 0.00 C ATOM 1668 O PRO A 106 0.325 -3.824 -12.153 1.00 0.00 O ATOM 1669 CB PRO A 106 1.947 -1.291 -13.763 1.00 0.00 C ATOM 1670 CG PRO A 106 3.085 -0.340 -13.623 1.00 0.00 C ATOM 1671 CD PRO A 106 4.080 -1.014 -12.719 1.00 0.00 C ATOM 0 HA PRO A 106 1.153 -1.563 -11.719 1.00 0.00 H new ATOM 0 HB2 PRO A 106 2.119 -1.998 -14.575 1.00 0.00 H new ATOM 0 HB3 PRO A 106 1.018 -0.767 -13.988 1.00 0.00 H new ATOM 0 HG2 PRO A 106 3.528 -0.117 -14.593 1.00 0.00 H new ATOM 0 HG3 PRO A 106 2.752 0.607 -13.199 1.00 0.00 H new ATOM 0 HD2 PRO A 106 4.830 -1.565 -13.287 1.00 0.00 H new ATOM 0 HD3 PRO A 106 4.614 -0.293 -12.101 1.00 0.00 H new ATOM 1679 N ASP A 107 2.243 -4.249 -13.251 1.00 0.00 N ATOM 1680 CA ASP A 107 1.921 -5.651 -13.495 1.00 0.00 C ATOM 1681 C ASP A 107 1.751 -6.407 -12.180 1.00 0.00 C ATOM 1682 O ASP A 107 0.963 -7.348 -12.092 1.00 0.00 O ATOM 1683 CB ASP A 107 3.015 -6.308 -14.337 1.00 0.00 C ATOM 1684 CG ASP A 107 2.819 -6.076 -15.822 1.00 0.00 C ATOM 1685 OD1 ASP A 107 2.114 -6.885 -16.462 1.00 0.00 O ATOM 1686 OD2 ASP A 107 3.370 -5.085 -16.346 1.00 0.00 O ATOM 0 H ASP A 107 3.146 -3.953 -13.622 1.00 0.00 H new ATOM 0 HA ASP A 107 0.979 -5.692 -14.041 1.00 0.00 H new ATOM 0 HB2 ASP A 107 3.986 -5.916 -14.036 1.00 0.00 H new ATOM 0 HB3 ASP A 107 3.028 -7.380 -14.138 1.00 0.00 H new ATOM 1691 N GLU A 108 2.496 -5.988 -11.163 1.00 0.00 N ATOM 1692 CA GLU A 108 2.427 -6.626 -9.852 1.00 0.00 C ATOM 1693 C GLU A 108 1.235 -6.103 -9.055 1.00 0.00 C ATOM 1694 O GLU A 108 0.592 -6.853 -8.322 1.00 0.00 O ATOM 1695 CB GLU A 108 3.722 -6.381 -9.074 1.00 0.00 C ATOM 1696 CG GLU A 108 4.881 -7.254 -9.530 1.00 0.00 C ATOM 1697 CD GLU A 108 5.611 -6.676 -10.727 1.00 0.00 C ATOM 1698 OE1 GLU A 108 4.967 -6.489 -11.782 1.00 0.00 O ATOM 1699 OE2 GLU A 108 6.825 -6.409 -10.609 1.00 0.00 O ATOM 0 H GLU A 108 3.154 -5.211 -11.220 1.00 0.00 H new ATOM 0 HA GLU A 108 2.299 -7.698 -10.003 1.00 0.00 H new ATOM 0 HB2 GLU A 108 4.005 -5.333 -9.177 1.00 0.00 H new ATOM 0 HB3 GLU A 108 3.539 -6.559 -8.014 1.00 0.00 H new ATOM 0 HG2 GLU A 108 5.584 -7.378 -8.706 1.00 0.00 H new ATOM 0 HG3 GLU A 108 4.506 -8.246 -9.782 1.00 0.00 H new ATOM 1706 N VAL A 109 0.949 -4.814 -9.206 1.00 0.00 N ATOM 1707 CA VAL A 109 -0.164 -4.190 -8.501 1.00 0.00 C ATOM 1708 C VAL A 109 -1.486 -4.868 -8.845 1.00 0.00 C ATOM 1709 O VAL A 109 -2.294 -5.161 -7.964 1.00 0.00 O ATOM 1710 CB VAL A 109 -0.267 -2.689 -8.835 1.00 0.00 C ATOM 1711 CG1 VAL A 109 -1.360 -2.028 -8.008 1.00 0.00 C ATOM 1712 CG2 VAL A 109 1.072 -1.998 -8.615 1.00 0.00 C ATOM 0 H VAL A 109 1.473 -4.181 -9.811 1.00 0.00 H new ATOM 0 HA VAL A 109 0.032 -4.307 -7.435 1.00 0.00 H new ATOM 0 HB VAL A 109 -0.532 -2.589 -9.888 1.00 0.00 H new ATOM 0 HG11 VAL A 109 -1.416 -0.969 -8.259 1.00 0.00 H new ATOM 0 HG12 VAL A 109 -2.317 -2.503 -8.224 1.00 0.00 H new ATOM 0 HG13 VAL A 109 -1.131 -2.138 -6.948 1.00 0.00 H new ATOM 0 HG21 VAL A 109 0.979 -0.939 -8.856 1.00 0.00 H new ATOM 0 HG22 VAL A 109 1.371 -2.108 -7.573 1.00 0.00 H new ATOM 0 HG23 VAL A 109 1.826 -2.452 -9.259 1.00 0.00 H new ATOM 1722 N ARG A 110 -1.702 -5.114 -10.133 1.00 0.00 N ATOM 1723 CA ARG A 110 -2.928 -5.754 -10.593 1.00 0.00 C ATOM 1724 C ARG A 110 -3.062 -7.162 -10.017 1.00 0.00 C ATOM 1725 O ARG A 110 -4.171 -7.671 -9.855 1.00 0.00 O ATOM 1726 CB ARG A 110 -2.955 -5.809 -12.122 1.00 0.00 C ATOM 1727 CG ARG A 110 -4.265 -5.324 -12.724 1.00 0.00 C ATOM 1728 CD ARG A 110 -4.239 -5.392 -14.244 1.00 0.00 C ATOM 1729 NE ARG A 110 -4.814 -4.195 -14.853 1.00 0.00 N ATOM 1730 CZ ARG A 110 -4.164 -3.040 -14.978 1.00 0.00 C ATOM 1731 NH1 ARG A 110 -2.917 -2.921 -14.536 1.00 0.00 N ATOM 1732 NH2 ARG A 110 -4.760 -2.001 -15.546 1.00 0.00 N ATOM 0 H ARG A 110 -1.044 -4.880 -10.876 1.00 0.00 H new ATOM 0 HA ARG A 110 -3.771 -5.159 -10.242 1.00 0.00 H new ATOM 0 HB2 ARG A 110 -2.138 -5.203 -12.514 1.00 0.00 H new ATOM 0 HB3 ARG A 110 -2.774 -6.835 -12.444 1.00 0.00 H new ATOM 0 HG2 ARG A 110 -5.087 -5.931 -12.346 1.00 0.00 H new ATOM 0 HG3 ARG A 110 -4.454 -4.298 -12.408 1.00 0.00 H new ATOM 0 HD2 ARG A 110 -3.211 -5.514 -14.584 1.00 0.00 H new ATOM 0 HD3 ARG A 110 -4.792 -6.270 -14.578 1.00 0.00 H new ATOM 0 HE ARG A 110 -5.771 -4.247 -15.203 1.00 0.00 H new ATOM 0 HH11 ARG A 110 -2.453 -3.717 -14.098 1.00 0.00 H new ATOM 0 HH12 ARG A 110 -2.424 -2.034 -14.634 1.00 0.00 H new ATOM 0 HH21 ARG A 110 -5.717 -2.086 -15.888 1.00 0.00 H new ATOM 0 HH22 ARG A 110 -4.261 -1.116 -15.641 1.00 0.00 H new ATOM 1746 N HIS A 111 -1.928 -7.784 -9.711 1.00 0.00 N ATOM 1747 CA HIS A 111 -1.926 -9.133 -9.157 1.00 0.00 C ATOM 1748 C HIS A 111 -2.190 -9.109 -7.656 1.00 0.00 C ATOM 1749 O HIS A 111 -2.873 -9.983 -7.123 1.00 0.00 O ATOM 1750 CB HIS A 111 -0.593 -9.825 -9.444 1.00 0.00 C ATOM 1751 CG HIS A 111 -0.569 -10.564 -10.745 1.00 0.00 C ATOM 1752 ND1 HIS A 111 0.426 -10.398 -11.687 1.00 0.00 N ATOM 1753 CD2 HIS A 111 -1.422 -11.481 -11.260 1.00 0.00 C ATOM 1754 CE1 HIS A 111 0.181 -11.179 -12.725 1.00 0.00 C ATOM 1755 NE2 HIS A 111 -0.933 -11.846 -12.491 1.00 0.00 N ATOM 0 H HIS A 111 -1.001 -7.377 -9.837 1.00 0.00 H new ATOM 0 HA HIS A 111 -2.728 -9.694 -9.637 1.00 0.00 H new ATOM 0 HB2 HIS A 111 0.201 -9.079 -9.445 1.00 0.00 H new ATOM 0 HB3 HIS A 111 -0.374 -10.522 -8.636 1.00 0.00 H new ATOM 0 HD2 HIS A 111 -2.320 -11.856 -10.791 1.00 0.00 H new ATOM 0 HE1 HIS A 111 0.789 -11.258 -13.614 1.00 0.00 H new ATOM 0 HE2 HIS A 111 -1.362 -12.523 -13.122 1.00 0.00 H new ATOM 1764 N ILE A 112 -1.649 -8.105 -6.976 1.00 0.00 N ATOM 1765 CA ILE A 112 -1.840 -7.977 -5.538 1.00 0.00 C ATOM 1766 C ILE A 112 -3.189 -7.333 -5.221 1.00 0.00 C ATOM 1767 O ILE A 112 -3.708 -7.465 -4.113 1.00 0.00 O ATOM 1768 CB ILE A 112 -0.704 -7.163 -4.881 1.00 0.00 C ATOM 1769 CG1 ILE A 112 -0.851 -5.670 -5.194 1.00 0.00 C ATOM 1770 CG2 ILE A 112 0.650 -7.678 -5.348 1.00 0.00 C ATOM 1771 CD1 ILE A 112 0.303 -4.826 -4.693 1.00 0.00 C ATOM 0 H ILE A 112 -1.078 -7.372 -7.395 1.00 0.00 H new ATOM 0 HA ILE A 112 -1.821 -8.985 -5.123 1.00 0.00 H new ATOM 0 HB ILE A 112 -0.771 -7.288 -3.800 1.00 0.00 H new ATOM 0 HG12 ILE A 112 -0.942 -5.541 -6.273 1.00 0.00 H new ATOM 0 HG13 ILE A 112 -1.777 -5.304 -4.750 1.00 0.00 H new ATOM 0 HG21 ILE A 112 1.443 -7.096 -4.878 1.00 0.00 H new ATOM 0 HG22 ILE A 112 0.756 -8.727 -5.070 1.00 0.00 H new ATOM 0 HG23 ILE A 112 0.722 -7.581 -6.431 1.00 0.00 H new ATOM 0 HD11 ILE A 112 0.129 -3.781 -4.951 1.00 0.00 H new ATOM 0 HD12 ILE A 112 0.382 -4.924 -3.610 1.00 0.00 H new ATOM 0 HD13 ILE A 112 1.230 -5.165 -5.157 1.00 0.00 H new ATOM 1783 N LEU A 113 -3.753 -6.638 -6.208 1.00 0.00 N ATOM 1784 CA LEU A 113 -5.043 -5.981 -6.040 1.00 0.00 C ATOM 1785 C LEU A 113 -6.182 -6.941 -6.359 1.00 0.00 C ATOM 1786 O LEU A 113 -7.254 -6.868 -5.757 1.00 0.00 O ATOM 1787 CB LEU A 113 -5.133 -4.749 -6.945 1.00 0.00 C ATOM 1788 CG LEU A 113 -4.364 -3.522 -6.451 1.00 0.00 C ATOM 1789 CD1 LEU A 113 -4.620 -2.333 -7.363 1.00 0.00 C ATOM 1790 CD2 LEU A 113 -4.750 -3.194 -5.015 1.00 0.00 C ATOM 0 H LEU A 113 -3.335 -6.517 -7.131 1.00 0.00 H new ATOM 0 HA LEU A 113 -5.132 -5.667 -5.000 1.00 0.00 H new ATOM 0 HB2 LEU A 113 -4.762 -5.017 -7.934 1.00 0.00 H new ATOM 0 HB3 LEU A 113 -6.183 -4.478 -7.060 1.00 0.00 H new ATOM 0 HG LEU A 113 -3.298 -3.748 -6.474 1.00 0.00 H new ATOM 0 HD11 LEU A 113 -4.066 -1.468 -6.998 1.00 0.00 H new ATOM 0 HD12 LEU A 113 -4.292 -2.573 -8.375 1.00 0.00 H new ATOM 0 HD13 LEU A 113 -5.686 -2.104 -7.372 1.00 0.00 H new ATOM 0 HD21 LEU A 113 -4.194 -2.319 -4.680 1.00 0.00 H new ATOM 0 HD22 LEU A 113 -5.819 -2.986 -4.964 1.00 0.00 H new ATOM 0 HD23 LEU A 113 -4.514 -4.042 -4.372 1.00 0.00 H new ATOM 1802 N GLU A 114 -5.945 -7.844 -7.308 1.00 0.00 N ATOM 1803 CA GLU A 114 -6.956 -8.817 -7.700 1.00 0.00 C ATOM 1804 C GLU A 114 -7.216 -9.808 -6.570 1.00 0.00 C ATOM 1805 O GLU A 114 -8.335 -10.290 -6.398 1.00 0.00 O ATOM 1806 CB GLU A 114 -6.519 -9.561 -8.967 1.00 0.00 C ATOM 1807 CG GLU A 114 -5.332 -10.487 -8.757 1.00 0.00 C ATOM 1808 CD GLU A 114 -5.143 -11.461 -9.904 1.00 0.00 C ATOM 1809 OE1 GLU A 114 -5.204 -11.020 -11.071 1.00 0.00 O ATOM 1810 OE2 GLU A 114 -4.937 -12.662 -9.635 1.00 0.00 O ATOM 0 H GLU A 114 -5.064 -7.920 -7.817 1.00 0.00 H new ATOM 0 HA GLU A 114 -7.882 -8.282 -7.910 1.00 0.00 H new ATOM 0 HB2 GLU A 114 -7.360 -10.143 -9.343 1.00 0.00 H new ATOM 0 HB3 GLU A 114 -6.267 -8.831 -9.737 1.00 0.00 H new ATOM 0 HG2 GLU A 114 -4.427 -9.891 -8.638 1.00 0.00 H new ATOM 0 HG3 GLU A 114 -5.470 -11.045 -7.831 1.00 0.00 H new ATOM 1817 N VAL A 115 -6.173 -10.104 -5.801 1.00 0.00 N ATOM 1818 CA VAL A 115 -6.286 -11.033 -4.683 1.00 0.00 C ATOM 1819 C VAL A 115 -6.873 -10.341 -3.458 1.00 0.00 C ATOM 1820 O VAL A 115 -7.633 -10.942 -2.698 1.00 0.00 O ATOM 1821 CB VAL A 115 -4.917 -11.636 -4.312 1.00 0.00 C ATOM 1822 CG1 VAL A 115 -5.072 -12.705 -3.242 1.00 0.00 C ATOM 1823 CG2 VAL A 115 -4.231 -12.205 -5.545 1.00 0.00 C ATOM 0 H VAL A 115 -5.240 -9.714 -5.932 1.00 0.00 H new ATOM 0 HA VAL A 115 -6.952 -11.835 -5.001 1.00 0.00 H new ATOM 0 HB VAL A 115 -4.291 -10.840 -3.909 1.00 0.00 H new ATOM 0 HG11 VAL A 115 -4.094 -13.117 -2.995 1.00 0.00 H new ATOM 0 HG12 VAL A 115 -5.516 -12.265 -2.349 1.00 0.00 H new ATOM 0 HG13 VAL A 115 -5.718 -13.501 -3.613 1.00 0.00 H new ATOM 0 HG21 VAL A 115 -3.266 -12.626 -5.263 1.00 0.00 H new ATOM 0 HG22 VAL A 115 -4.854 -12.986 -5.980 1.00 0.00 H new ATOM 0 HG23 VAL A 115 -4.080 -11.411 -6.277 1.00 0.00 H new ATOM 1833 N SER A 116 -6.518 -9.074 -3.273 1.00 0.00 N ATOM 1834 CA SER A 116 -7.010 -8.298 -2.141 1.00 0.00 C ATOM 1835 C SER A 116 -8.533 -8.198 -2.173 1.00 0.00 C ATOM 1836 O SER A 116 -9.215 -8.687 -1.274 1.00 0.00 O ATOM 1837 CB SER A 116 -6.395 -6.899 -2.149 1.00 0.00 C ATOM 1838 OG SER A 116 -6.326 -6.363 -0.838 1.00 0.00 O ATOM 0 H SER A 116 -5.891 -8.562 -3.893 1.00 0.00 H new ATOM 0 HA SER A 116 -6.716 -8.810 -1.225 1.00 0.00 H new ATOM 0 HB2 SER A 116 -5.395 -6.941 -2.581 1.00 0.00 H new ATOM 0 HB3 SER A 116 -6.989 -6.241 -2.783 1.00 0.00 H new ATOM 0 HG SER A 116 -5.619 -6.819 -0.335 1.00 0.00 H new ATOM 1844 N GLY A 117 -9.054 -7.562 -3.217 1.00 0.00 N ATOM 1845 CA GLY A 117 -10.493 -7.410 -3.347 1.00 0.00 C ATOM 1846 C GLY A 117 -10.880 -6.178 -4.141 1.00 0.00 C ATOM 1847 O GLY A 117 -11.809 -5.460 -3.770 1.00 0.00 O ATOM 0 H GLY A 117 -8.508 -7.150 -3.974 1.00 0.00 H new ATOM 0 HA2 GLY A 117 -10.906 -8.295 -3.832 1.00 0.00 H new ATOM 0 HA3 GLY A 117 -10.940 -7.353 -2.354 1.00 0.00 H new ATOM 1851 N LEU A 118 -10.169 -5.931 -5.237 1.00 0.00 N ATOM 1852 CA LEU A 118 -10.448 -4.777 -6.085 1.00 0.00 C ATOM 1853 C LEU A 118 -10.874 -5.219 -7.482 1.00 0.00 C ATOM 1854 O LEU A 118 -11.951 -4.861 -7.956 1.00 0.00 O ATOM 1855 CB LEU A 118 -9.216 -3.872 -6.182 1.00 0.00 C ATOM 1856 CG LEU A 118 -8.693 -3.327 -4.850 1.00 0.00 C ATOM 1857 CD1 LEU A 118 -7.678 -2.222 -5.091 1.00 0.00 C ATOM 1858 CD2 LEU A 118 -9.839 -2.818 -3.987 1.00 0.00 C ATOM 0 H LEU A 118 -9.396 -6.514 -5.559 1.00 0.00 H new ATOM 0 HA LEU A 118 -11.266 -4.218 -5.631 1.00 0.00 H new ATOM 0 HB2 LEU A 118 -8.414 -4.429 -6.667 1.00 0.00 H new ATOM 0 HB3 LEU A 118 -9.456 -3.029 -6.831 1.00 0.00 H new ATOM 0 HG LEU A 118 -8.201 -4.141 -4.318 1.00 0.00 H new ATOM 0 HD11 LEU A 118 -7.316 -1.845 -4.134 1.00 0.00 H new ATOM 0 HD12 LEU A 118 -6.840 -2.617 -5.666 1.00 0.00 H new ATOM 0 HD13 LEU A 118 -8.149 -1.410 -5.646 1.00 0.00 H new ATOM 0 HD21 LEU A 118 -9.444 -2.436 -3.046 1.00 0.00 H new ATOM 0 HD22 LEU A 118 -10.363 -2.019 -4.512 1.00 0.00 H new ATOM 0 HD23 LEU A 118 -10.532 -3.634 -3.784 1.00 0.00 H new ATOM 1870 N LEU A 119 -10.017 -5.997 -8.134 1.00 0.00 N ATOM 1871 CA LEU A 119 -10.302 -6.489 -9.479 1.00 0.00 C ATOM 1872 C LEU A 119 -11.244 -7.688 -9.432 1.00 0.00 C ATOM 1873 O LEU A 119 -12.028 -7.911 -10.355 1.00 0.00 O ATOM 1874 CB LEU A 119 -8.999 -6.867 -10.190 1.00 0.00 C ATOM 1875 CG LEU A 119 -8.685 -6.044 -11.443 1.00 0.00 C ATOM 1876 CD1 LEU A 119 -7.422 -5.218 -11.239 1.00 0.00 C ATOM 1877 CD2 LEU A 119 -8.538 -6.949 -12.658 1.00 0.00 C ATOM 0 H LEU A 119 -9.120 -6.301 -7.755 1.00 0.00 H new ATOM 0 HA LEU A 119 -10.793 -5.692 -10.038 1.00 0.00 H new ATOM 0 HB2 LEU A 119 -8.174 -6.759 -9.486 1.00 0.00 H new ATOM 0 HB3 LEU A 119 -9.046 -7.920 -10.467 1.00 0.00 H new ATOM 0 HG LEU A 119 -9.518 -5.363 -11.621 1.00 0.00 H new ATOM 0 HD11 LEU A 119 -7.216 -4.640 -12.140 1.00 0.00 H new ATOM 0 HD12 LEU A 119 -7.563 -4.540 -10.397 1.00 0.00 H new ATOM 0 HD13 LEU A 119 -6.582 -5.882 -11.033 1.00 0.00 H new ATOM 0 HD21 LEU A 119 -8.315 -6.344 -13.537 1.00 0.00 H new ATOM 0 HD22 LEU A 119 -7.726 -7.656 -12.489 1.00 0.00 H new ATOM 0 HD23 LEU A 119 -9.467 -7.495 -12.819 1.00 0.00 H new ATOM 1889 N GLY A 120 -11.162 -8.458 -8.351 1.00 0.00 N ATOM 1890 CA GLY A 120 -12.012 -9.624 -8.206 1.00 0.00 C ATOM 1891 C GLY A 120 -11.503 -10.587 -7.151 1.00 0.00 C ATOM 1892 O GLY A 120 -11.106 -10.120 -6.063 1.00 0.00 O ATOM 1893 OXT GLY A 120 -11.500 -11.808 -7.414 1.00 0.00 O ATOM 0 H GLY A 120 -10.522 -8.295 -7.574 1.00 0.00 H new ATOM 0 HA2 GLY A 120 -13.021 -9.304 -7.945 1.00 0.00 H new ATOM 0 HA3 GLY A 120 -12.080 -10.141 -9.163 1.00 0.00 H new TER 1897 GLY A 120