USER MOD reduce.3.24.130724 H: found=0, std=0, add=1312, rem=0, adj=36 USER MOD reduce.3.24.130724 removed 1305 hydrogens (45 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 153 HIS : no HE2:sc= -2.9! C(o=-1.9!,f=-17!) USER MOD Set 1.2: A 155 TYR OH : rot 110:sc= 1.03 USER MOD Set 2.1: A 138 LYS NZ :NH3+ -150:sc= 0.0581 (180deg=-2.05!) USER MOD Set 2.2: A 141 SER OG : rot -71:sc= -0.439 USER MOD Set 3.1: A 101 GLN : amide:sc= -3.99! C(o=-3!,f=-6.7!) USER MOD Set 3.2: A 168 NDP O3B : rot -152:sc= 0.976 USER MOD Set 4.1: A 85 TYR OH : rot -80:sc= 1.32 USER MOD Set 4.2: A 89 HIS : no HE2:sc= 0.416 K(o=1.7,f=-2.8) USER MOD Set 5.1: A 63 THR OG1 : rot 35:sc= -1.1 USER MOD Set 5.2: A 65 GLN : amide:sc= -0.964 K(o=-2.1,f=-0.86) USER MOD Set 6.1: A 58 THR OG1 : rot -120:sc= -0.483 USER MOD Set 6.2: A 92 GLN : amide:sc= -1.62 K(o=-2.1,f=1.3!) USER MOD Single : A 1 THR N :NH3+ -119:sc= 0.178 (180deg=-0.514) USER MOD Single : A 1 THR OG1 : rot 130:sc= -0.253 USER MOD Single : A 7 GLN : amide:sc= -2.35 X(o=-2.3,f=-2) USER MOD Single : A 15 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 18 HIS : no HE2:sc= -1.9 K(o=-1.9,f=-5!) USER MOD Single : A 22 HIS : no HD1:sc= -0.0881 X(o=-0.088,f=-0.24) USER MOD Single : A 28 HIS : no HD1:sc= -0.302 X(o=-0.3,f=-0.1) USER MOD Single : A 29 TYR OH : rot 180:sc= 0 USER MOD Single : A 33 GLN : amide:sc= -3.51! C(o=-3.5!,f=-1.6!) USER MOD Single : A 34 THR OG1 : rot -83:sc= 1.28 USER MOD Single : A 37 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 39 MET CE :methyl -121:sc= -4.76! (180deg=-10.5!) USER MOD Single : A 45 THR OG1 : rot 20:sc= -0.148 USER MOD Single : A 46 TYR OH : rot 180:sc= -0.871 USER MOD Single : A 48 SER OG : rot 180:sc= 0 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 ASN : amide:sc= -4.35! C(o=-4.4!,f=-11!) USER MOD Single : A 64 HIS : no HD1:sc= -0.299 X(o=-0.3,f=0.067) USER MOD Single : A 68 TYR OH : rot -3:sc= 0.00489 USER MOD Single : A 69 GLN : amide:sc= 0 X(o=0,f=-0.13) USER MOD Single : A 71 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 77 HIS : no HE2:sc= -6.61! C(o=-6.6!,f=-10!) USER MOD Single : A 87 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 88 GLN : amide:sc= -0.0566 X(o=-0.057,f=0) USER MOD Single : A 104 THR OG1 : rot 180:sc= -1.78! USER MOD Single : A 107 LYS NZ :NH3+ 147:sc= 0.426 (180deg=0.126) USER MOD Single : A 112 THR OG1 : rot 180:sc= -0.225 USER MOD Single : A 116 THR OG1 : rot 180:sc= 0 USER MOD Single : A 121 SER OG : rot 180:sc= -1.33 USER MOD Single : A 126 THR OG1 : rot 180:sc= 0 USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= -0.0078 (180deg=-0.0078) USER MOD Single : A 128 MET CE :methyl -142:sc= -5.47 (180deg=-9.52!) USER MOD Single : A 132 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 137 THR OG1 : rot 180:sc= 0 USER MOD Single : A 140 SER OG : rot 25:sc= 0.0762 USER MOD Single : A 143 THR OG1 : rot 180:sc= -0.329 USER MOD Single : A 147 THR OG1 : rot 180:sc= 0.0142 USER MOD Single : A 148 ASN : amide:sc= -0.336 X(o=-0.34,f=0) USER MOD Single : A 152 THR OG1 : rot 180:sc= 0 USER MOD Single : A 154 THR OG1 : rot 180:sc= -0.729 USER MOD Single : A 159 GLN : amide:sc= -2.3! C(o=-2.3!,f=-8.1!) USER MOD Single : A 160 LYS NZ :NH3+ -158:sc= 0.512 (180deg=0.235) USER MOD Single : A 161 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 168 NDP O2D : rot -125:sc= 1.1 USER MOD Single : A 168 NDP O3D : rot 92:sc= 0.114 USER MOD ----------------------------------------------------------------- ATOM 1 N THR A 1 -5.473 10.146 3.474 1.00 0.00 N ATOM 2 CA THR A 1 -5.047 9.140 2.454 1.00 0.00 C ATOM 3 C THR A 1 -3.539 8.916 2.547 1.00 0.00 C ATOM 4 O THR A 1 -2.757 9.834 2.411 1.00 0.00 O ATOM 5 CB THR A 1 -5.399 9.642 1.052 1.00 0.00 C ATOM 6 OG1 THR A 1 -6.586 10.419 1.116 1.00 0.00 O ATOM 7 CG2 THR A 1 -5.615 8.449 0.119 1.00 0.00 C ATOM 0 H1 THR A 1 -6.150 9.709 4.131 1.00 0.00 H new ATOM 0 H2 THR A 1 -4.641 10.477 4.004 1.00 0.00 H new ATOM 0 H3 THR A 1 -5.924 10.953 2.998 1.00 0.00 H new ATOM 0 HA THR A 1 -5.566 8.201 2.644 1.00 0.00 H new ATOM 0 HB THR A 1 -4.583 10.254 0.668 1.00 0.00 H new ATOM 0 HG1 THR A 1 -6.443 11.273 0.657 1.00 0.00 H new ATOM 0 HG21 THR A 1 -5.866 8.808 -0.879 1.00 0.00 H new ATOM 0 HG22 THR A 1 -4.703 7.854 0.072 1.00 0.00 H new ATOM 0 HG23 THR A 1 -6.431 7.833 0.498 1.00 0.00 H new ATOM 17 N ALA A 2 -3.124 7.700 2.767 1.00 0.00 N ATOM 18 CA ALA A 2 -1.665 7.420 2.864 1.00 0.00 C ATOM 19 C ALA A 2 -1.302 6.258 1.940 1.00 0.00 C ATOM 20 O ALA A 2 -2.106 5.389 1.677 1.00 0.00 O ATOM 21 CB ALA A 2 -1.311 7.056 4.309 1.00 0.00 C ATOM 0 H ALA A 2 -3.731 6.889 2.884 1.00 0.00 H new ATOM 0 HA ALA A 2 -1.105 8.306 2.564 1.00 0.00 H new ATOM 0 HB1 ALA A 2 -0.243 6.851 4.381 1.00 0.00 H new ATOM 0 HB2 ALA A 2 -1.566 7.887 4.967 1.00 0.00 H new ATOM 0 HB3 ALA A 2 -1.872 6.171 4.609 1.00 0.00 H new ATOM 27 N PHE A 3 -0.089 6.226 1.461 1.00 0.00 N ATOM 28 CA PHE A 3 0.336 5.113 0.566 1.00 0.00 C ATOM 29 C PHE A 3 1.155 4.115 1.383 1.00 0.00 C ATOM 30 O PHE A 3 2.017 4.497 2.149 1.00 0.00 O ATOM 31 CB PHE A 3 1.216 5.664 -0.564 1.00 0.00 C ATOM 32 CG PHE A 3 0.387 6.298 -1.670 1.00 0.00 C ATOM 33 CD1 PHE A 3 -1.014 6.206 -1.682 1.00 0.00 C ATOM 34 CD2 PHE A 3 1.044 6.984 -2.698 1.00 0.00 C ATOM 35 CE1 PHE A 3 -1.745 6.799 -2.720 1.00 0.00 C ATOM 36 CE2 PHE A 3 0.311 7.575 -3.731 1.00 0.00 C ATOM 37 CZ PHE A 3 -1.081 7.482 -3.742 1.00 0.00 C ATOM 0 H PHE A 3 0.629 6.925 1.652 1.00 0.00 H new ATOM 0 HA PHE A 3 -0.543 4.630 0.140 1.00 0.00 H new ATOM 0 HB2 PHE A 3 1.907 6.403 -0.159 1.00 0.00 H new ATOM 0 HB3 PHE A 3 1.820 4.858 -0.980 1.00 0.00 H new ATOM 0 HD1 PHE A 3 -1.528 5.679 -0.892 1.00 0.00 H new ATOM 0 HD2 PHE A 3 2.122 7.057 -2.693 1.00 0.00 H new ATOM 0 HE1 PHE A 3 -2.823 6.728 -2.730 1.00 0.00 H new ATOM 0 HE2 PHE A 3 0.823 8.104 -4.521 1.00 0.00 H new ATOM 0 HZ PHE A 3 -1.646 7.938 -4.541 1.00 0.00 H new ATOM 47 N LEU A 4 0.911 2.841 1.224 1.00 0.00 N ATOM 48 CA LEU A 4 1.698 1.836 1.991 1.00 0.00 C ATOM 49 C LEU A 4 2.224 0.780 1.015 1.00 0.00 C ATOM 50 O LEU A 4 1.545 -0.171 0.697 1.00 0.00 O ATOM 51 CB LEU A 4 0.790 1.185 3.046 1.00 0.00 C ATOM 52 CG LEU A 4 1.504 0.013 3.740 1.00 0.00 C ATOM 53 CD1 LEU A 4 2.966 0.375 4.029 1.00 0.00 C ATOM 54 CD2 LEU A 4 0.795 -0.290 5.064 1.00 0.00 C ATOM 0 H LEU A 4 0.203 2.456 0.598 1.00 0.00 H new ATOM 0 HA LEU A 4 2.539 2.311 2.496 1.00 0.00 H new ATOM 0 HB2 LEU A 4 0.498 1.928 3.788 1.00 0.00 H new ATOM 0 HB3 LEU A 4 -0.126 0.829 2.573 1.00 0.00 H new ATOM 0 HG LEU A 4 1.475 -0.858 3.086 1.00 0.00 H new ATOM 0 HD11 LEU A 4 3.458 -0.464 4.520 1.00 0.00 H new ATOM 0 HD12 LEU A 4 3.477 0.598 3.093 1.00 0.00 H new ATOM 0 HD13 LEU A 4 3.003 1.249 4.680 1.00 0.00 H new ATOM 0 HD21 LEU A 4 1.295 -1.120 5.563 1.00 0.00 H new ATOM 0 HD22 LEU A 4 0.828 0.591 5.705 1.00 0.00 H new ATOM 0 HD23 LEU A 4 -0.243 -0.557 4.868 1.00 0.00 H new ATOM 66 N TRP A 5 3.422 0.949 0.521 1.00 0.00 N ATOM 67 CA TRP A 5 3.968 -0.048 -0.444 1.00 0.00 C ATOM 68 C TRP A 5 5.461 -0.277 -0.190 1.00 0.00 C ATOM 69 O TRP A 5 6.202 0.646 0.086 1.00 0.00 O ATOM 70 CB TRP A 5 3.756 0.462 -1.875 1.00 0.00 C ATOM 71 CG TRP A 5 4.734 1.556 -2.192 1.00 0.00 C ATOM 72 CD1 TRP A 5 5.788 1.434 -3.034 1.00 0.00 C ATOM 73 CD2 TRP A 5 4.772 2.925 -1.691 1.00 0.00 C ATOM 74 NE1 TRP A 5 6.463 2.641 -3.088 1.00 0.00 N ATOM 75 CE2 TRP A 5 5.877 3.590 -2.277 1.00 0.00 C ATOM 76 CE3 TRP A 5 3.963 3.649 -0.797 1.00 0.00 C ATOM 77 CZ2 TRP A 5 6.168 4.924 -1.986 1.00 0.00 C ATOM 78 CZ3 TRP A 5 4.254 4.991 -0.501 1.00 0.00 C ATOM 79 CH2 TRP A 5 5.354 5.627 -1.095 1.00 0.00 C ATOM 0 H TRP A 5 4.042 1.728 0.742 1.00 0.00 H new ATOM 0 HA TRP A 5 3.445 -0.995 -0.311 1.00 0.00 H new ATOM 0 HB2 TRP A 5 3.877 -0.359 -2.582 1.00 0.00 H new ATOM 0 HB3 TRP A 5 2.737 0.832 -1.988 1.00 0.00 H new ATOM 0 HD1 TRP A 5 6.058 0.539 -3.576 1.00 0.00 H new ATOM 0 HE1 TRP A 5 7.292 2.808 -3.658 1.00 0.00 H new ATOM 0 HE3 TRP A 5 3.112 3.170 -0.335 1.00 0.00 H new ATOM 0 HZ2 TRP A 5 7.016 5.409 -2.446 1.00 0.00 H new ATOM 0 HZ3 TRP A 5 3.627 5.537 0.188 1.00 0.00 H new ATOM 0 HH2 TRP A 5 5.571 6.659 -0.864 1.00 0.00 H new ATOM 90 N ALA A 6 5.907 -1.500 -0.298 1.00 0.00 N ATOM 91 CA ALA A 6 7.352 -1.791 -0.088 1.00 0.00 C ATOM 92 C ALA A 6 8.026 -1.908 -1.456 1.00 0.00 C ATOM 93 O ALA A 6 7.546 -2.596 -2.335 1.00 0.00 O ATOM 94 CB ALA A 6 7.507 -3.106 0.679 1.00 0.00 C ATOM 0 H ALA A 6 5.330 -2.311 -0.523 1.00 0.00 H new ATOM 0 HA ALA A 6 7.815 -0.991 0.489 1.00 0.00 H new ATOM 0 HB1 ALA A 6 8.566 -3.316 0.831 1.00 0.00 H new ATOM 0 HB2 ALA A 6 7.011 -3.024 1.646 1.00 0.00 H new ATOM 0 HB3 ALA A 6 7.055 -3.916 0.107 1.00 0.00 H new ATOM 100 N GLN A 7 9.120 -1.226 -1.652 1.00 0.00 N ATOM 101 CA GLN A 7 9.805 -1.291 -2.976 1.00 0.00 C ATOM 102 C GLN A 7 11.299 -1.553 -2.780 1.00 0.00 C ATOM 103 O GLN A 7 11.842 -1.338 -1.715 1.00 0.00 O ATOM 104 CB GLN A 7 9.608 0.032 -3.720 1.00 0.00 C ATOM 105 CG GLN A 7 10.027 1.197 -2.821 1.00 0.00 C ATOM 106 CD GLN A 7 10.792 2.232 -3.648 1.00 0.00 C ATOM 107 OE1 GLN A 7 10.223 3.204 -4.105 1.00 0.00 O ATOM 108 NE2 GLN A 7 12.068 2.062 -3.864 1.00 0.00 N ATOM 0 H GLN A 7 9.569 -0.629 -0.957 1.00 0.00 H new ATOM 0 HA GLN A 7 9.375 -2.104 -3.561 1.00 0.00 H new ATOM 0 HB2 GLN A 7 10.199 0.036 -4.636 1.00 0.00 H new ATOM 0 HB3 GLN A 7 8.564 0.143 -4.013 1.00 0.00 H new ATOM 0 HG2 GLN A 7 9.148 1.656 -2.369 1.00 0.00 H new ATOM 0 HG3 GLN A 7 10.652 0.834 -2.005 1.00 0.00 H new ATOM 0 HE21 GLN A 7 12.546 1.246 -3.481 1.00 0.00 H new ATOM 0 HE22 GLN A 7 12.587 2.745 -4.416 1.00 0.00 H new ATOM 117 N ASP A 8 11.964 -2.023 -3.803 1.00 0.00 N ATOM 118 CA ASP A 8 13.422 -2.308 -3.681 1.00 0.00 C ATOM 119 C ASP A 8 14.225 -1.046 -4.010 1.00 0.00 C ATOM 120 O ASP A 8 13.683 0.037 -4.109 1.00 0.00 O ATOM 121 CB ASP A 8 13.805 -3.433 -4.648 1.00 0.00 C ATOM 122 CG ASP A 8 13.375 -3.065 -6.069 1.00 0.00 C ATOM 123 OD1 ASP A 8 13.655 -1.953 -6.486 1.00 0.00 O ATOM 124 OD2 ASP A 8 12.775 -3.905 -6.719 1.00 0.00 O ATOM 0 H ASP A 8 11.559 -2.221 -4.718 1.00 0.00 H new ATOM 0 HA ASP A 8 13.646 -2.617 -2.660 1.00 0.00 H new ATOM 0 HB2 ASP A 8 14.881 -3.601 -4.616 1.00 0.00 H new ATOM 0 HB3 ASP A 8 13.328 -4.364 -4.344 1.00 0.00 H new ATOM 129 N ARG A 9 15.516 -1.179 -4.169 1.00 0.00 N ATOM 130 CA ARG A 9 16.359 0.012 -4.479 1.00 0.00 C ATOM 131 C ARG A 9 15.881 0.676 -5.776 1.00 0.00 C ATOM 132 O ARG A 9 15.796 1.886 -5.862 1.00 0.00 O ATOM 133 CB ARG A 9 17.825 -0.412 -4.624 1.00 0.00 C ATOM 134 CG ARG A 9 17.957 -1.483 -5.710 1.00 0.00 C ATOM 135 CD ARG A 9 18.298 -0.822 -7.050 1.00 0.00 C ATOM 136 NE ARG A 9 19.533 -1.445 -7.615 1.00 0.00 N ATOM 137 CZ ARG A 9 20.690 -0.823 -7.574 1.00 0.00 C ATOM 138 NH1 ARG A 9 20.804 0.362 -7.027 1.00 0.00 N ATOM 139 NH2 ARG A 9 21.743 -1.396 -8.088 1.00 0.00 N ATOM 0 H ARG A 9 16.022 -2.061 -4.097 1.00 0.00 H new ATOM 0 HA ARG A 9 16.270 0.728 -3.662 1.00 0.00 H new ATOM 0 HB2 ARG A 9 18.438 0.452 -4.878 1.00 0.00 H new ATOM 0 HB3 ARG A 9 18.196 -0.798 -3.674 1.00 0.00 H new ATOM 0 HG2 ARG A 9 18.734 -2.197 -5.438 1.00 0.00 H new ATOM 0 HG3 ARG A 9 17.026 -2.043 -5.797 1.00 0.00 H new ATOM 0 HD2 ARG A 9 17.468 -0.939 -7.747 1.00 0.00 H new ATOM 0 HD3 ARG A 9 18.449 0.249 -6.911 1.00 0.00 H new ATOM 0 HE ARG A 9 19.477 -2.370 -8.040 1.00 0.00 H new ATOM 0 HH11 ARG A 9 19.986 0.818 -6.623 1.00 0.00 H new ATOM 0 HH12 ARG A 9 21.711 0.828 -7.005 1.00 0.00 H new ATOM 0 HH21 ARG A 9 21.664 -2.318 -8.517 1.00 0.00 H new ATOM 0 HH22 ARG A 9 22.646 -0.922 -8.061 1.00 0.00 H new ATOM 153 N ASP A 10 15.578 -0.094 -6.790 1.00 0.00 N ATOM 154 CA ASP A 10 15.120 0.510 -8.076 1.00 0.00 C ATOM 155 C ASP A 10 13.706 1.070 -7.914 1.00 0.00 C ATOM 156 O ASP A 10 13.350 2.061 -8.523 1.00 0.00 O ATOM 157 CB ASP A 10 15.125 -0.559 -9.172 1.00 0.00 C ATOM 158 CG ASP A 10 16.436 -0.478 -9.956 1.00 0.00 C ATOM 159 OD1 ASP A 10 16.695 0.565 -10.534 1.00 0.00 O ATOM 160 OD2 ASP A 10 17.159 -1.461 -9.966 1.00 0.00 O ATOM 0 H ASP A 10 15.628 -1.113 -6.782 1.00 0.00 H new ATOM 0 HA ASP A 10 15.795 1.320 -8.352 1.00 0.00 H new ATOM 0 HB2 ASP A 10 15.014 -1.549 -8.730 1.00 0.00 H new ATOM 0 HB3 ASP A 10 14.278 -0.412 -9.842 1.00 0.00 H new ATOM 165 N GLY A 11 12.900 0.457 -7.089 1.00 0.00 N ATOM 166 CA GLY A 11 11.517 0.973 -6.882 1.00 0.00 C ATOM 167 C GLY A 11 10.492 0.071 -7.578 1.00 0.00 C ATOM 168 O GLY A 11 9.514 0.546 -8.117 1.00 0.00 O ATOM 0 H GLY A 11 13.139 -0.376 -6.551 1.00 0.00 H new ATOM 0 HA2 GLY A 11 11.299 1.024 -5.815 1.00 0.00 H new ATOM 0 HA3 GLY A 11 11.440 1.988 -7.272 1.00 0.00 H new ATOM 172 N LEU A 12 10.686 -1.222 -7.554 1.00 0.00 N ATOM 173 CA LEU A 12 9.695 -2.135 -8.201 1.00 0.00 C ATOM 174 C LEU A 12 8.721 -2.630 -7.135 1.00 0.00 C ATOM 175 O LEU A 12 9.080 -2.784 -5.983 1.00 0.00 O ATOM 176 CB LEU A 12 10.423 -3.331 -8.834 1.00 0.00 C ATOM 177 CG LEU A 12 9.417 -4.418 -9.253 1.00 0.00 C ATOM 178 CD1 LEU A 12 8.981 -4.189 -10.698 1.00 0.00 C ATOM 179 CD2 LEU A 12 10.082 -5.791 -9.134 1.00 0.00 C ATOM 0 H LEU A 12 11.483 -1.684 -7.117 1.00 0.00 H new ATOM 0 HA LEU A 12 9.154 -1.601 -8.982 1.00 0.00 H new ATOM 0 HB2 LEU A 12 10.991 -2.999 -9.703 1.00 0.00 H new ATOM 0 HB3 LEU A 12 11.139 -3.745 -8.124 1.00 0.00 H new ATOM 0 HG LEU A 12 8.543 -4.373 -8.603 1.00 0.00 H new ATOM 0 HD11 LEU A 12 8.269 -4.961 -10.990 1.00 0.00 H new ATOM 0 HD12 LEU A 12 8.510 -3.210 -10.785 1.00 0.00 H new ATOM 0 HD13 LEU A 12 9.852 -4.233 -11.352 1.00 0.00 H new ATOM 0 HD21 LEU A 12 9.374 -6.565 -9.430 1.00 0.00 H new ATOM 0 HD22 LEU A 12 10.955 -5.830 -9.785 1.00 0.00 H new ATOM 0 HD23 LEU A 12 10.391 -5.957 -8.102 1.00 0.00 H new ATOM 191 N ILE A 13 7.494 -2.886 -7.503 1.00 0.00 N ATOM 192 CA ILE A 13 6.511 -3.381 -6.505 1.00 0.00 C ATOM 193 C ILE A 13 5.752 -4.578 -7.090 1.00 0.00 C ATOM 194 O ILE A 13 5.725 -5.649 -6.516 1.00 0.00 O ATOM 195 CB ILE A 13 5.533 -2.256 -6.143 1.00 0.00 C ATOM 196 CG1 ILE A 13 5.111 -1.477 -7.397 1.00 0.00 C ATOM 197 CG2 ILE A 13 6.225 -1.296 -5.185 1.00 0.00 C ATOM 198 CD1 ILE A 13 3.599 -1.238 -7.362 1.00 0.00 C ATOM 0 H ILE A 13 7.133 -2.773 -8.450 1.00 0.00 H new ATOM 0 HA ILE A 13 7.032 -3.697 -5.601 1.00 0.00 H new ATOM 0 HB ILE A 13 4.647 -2.695 -5.684 1.00 0.00 H new ATOM 0 HG12 ILE A 13 5.640 -0.525 -7.442 1.00 0.00 H new ATOM 0 HG13 ILE A 13 5.382 -2.035 -8.293 1.00 0.00 H new ATOM 0 HG21 ILE A 13 5.540 -0.491 -4.919 1.00 0.00 H new ATOM 0 HG22 ILE A 13 6.522 -1.832 -4.284 1.00 0.00 H new ATOM 0 HG23 ILE A 13 7.109 -0.877 -5.665 1.00 0.00 H new ATOM 0 HD11 ILE A 13 3.297 -0.685 -8.252 1.00 0.00 H new ATOM 0 HD12 ILE A 13 3.080 -2.196 -7.337 1.00 0.00 H new ATOM 0 HD13 ILE A 13 3.342 -0.663 -6.473 1.00 0.00 H new ATOM 210 N GLY A 14 5.117 -4.396 -8.217 1.00 0.00 N ATOM 211 CA GLY A 14 4.338 -5.507 -8.832 1.00 0.00 C ATOM 212 C GLY A 14 5.273 -6.467 -9.558 1.00 0.00 C ATOM 213 O GLY A 14 6.097 -6.066 -10.357 1.00 0.00 O ATOM 0 H GLY A 14 5.105 -3.520 -8.740 1.00 0.00 H new ATOM 0 HA2 GLY A 14 3.783 -6.042 -8.061 1.00 0.00 H new ATOM 0 HA3 GLY A 14 3.605 -5.104 -9.531 1.00 0.00 H new ATOM 217 N LYS A 15 5.146 -7.737 -9.287 1.00 0.00 N ATOM 218 CA LYS A 15 6.012 -8.738 -9.961 1.00 0.00 C ATOM 219 C LYS A 15 5.159 -9.945 -10.353 1.00 0.00 C ATOM 220 O LYS A 15 5.181 -10.968 -9.696 1.00 0.00 O ATOM 221 CB LYS A 15 7.120 -9.183 -9.004 1.00 0.00 C ATOM 222 CG LYS A 15 8.366 -9.576 -9.805 1.00 0.00 C ATOM 223 CD LYS A 15 8.675 -11.062 -9.588 1.00 0.00 C ATOM 224 CE LYS A 15 8.230 -11.865 -10.814 1.00 0.00 C ATOM 225 NZ LYS A 15 9.429 -12.336 -11.567 1.00 0.00 N ATOM 0 H LYS A 15 4.475 -8.124 -8.623 1.00 0.00 H new ATOM 0 HA LYS A 15 6.463 -8.299 -10.851 1.00 0.00 H new ATOM 0 HB2 LYS A 15 7.361 -8.377 -8.311 1.00 0.00 H new ATOM 0 HB3 LYS A 15 6.779 -10.028 -8.405 1.00 0.00 H new ATOM 0 HG2 LYS A 15 8.205 -9.380 -10.865 1.00 0.00 H new ATOM 0 HG3 LYS A 15 9.216 -8.969 -9.494 1.00 0.00 H new ATOM 0 HD2 LYS A 15 9.743 -11.201 -9.418 1.00 0.00 H new ATOM 0 HD3 LYS A 15 8.161 -11.424 -8.698 1.00 0.00 H new ATOM 0 HE2 LYS A 15 7.626 -12.717 -10.503 1.00 0.00 H new ATOM 0 HE3 LYS A 15 7.603 -11.248 -11.458 1.00 0.00 H new ATOM 0 HZ1 LYS A 15 9.125 -12.881 -12.399 1.00 0.00 H new ATOM 0 HZ2 LYS A 15 9.989 -11.516 -11.876 1.00 0.00 H new ATOM 0 HZ3 LYS A 15 10.010 -12.940 -10.951 1.00 0.00 H new ATOM 239 N ASP A 16 4.415 -9.844 -11.424 1.00 0.00 N ATOM 240 CA ASP A 16 3.572 -10.991 -11.865 1.00 0.00 C ATOM 241 C ASP A 16 2.659 -11.472 -10.729 1.00 0.00 C ATOM 242 O ASP A 16 2.671 -12.634 -10.371 1.00 0.00 O ATOM 243 CB ASP A 16 4.480 -12.140 -12.308 1.00 0.00 C ATOM 244 CG ASP A 16 5.201 -11.751 -13.601 1.00 0.00 C ATOM 245 OD1 ASP A 16 6.084 -10.913 -13.534 1.00 0.00 O ATOM 246 OD2 ASP A 16 4.857 -12.299 -14.635 1.00 0.00 O ATOM 0 H ASP A 16 4.356 -9.013 -12.013 1.00 0.00 H new ATOM 0 HA ASP A 16 2.945 -10.664 -12.694 1.00 0.00 H new ATOM 0 HB2 ASP A 16 5.207 -12.365 -11.527 1.00 0.00 H new ATOM 0 HB3 ASP A 16 3.891 -13.043 -12.465 1.00 0.00 H new ATOM 251 N GLY A 17 1.849 -10.606 -10.168 1.00 0.00 N ATOM 252 CA GLY A 17 0.928 -11.044 -9.078 1.00 0.00 C ATOM 253 C GLY A 17 1.666 -11.087 -7.741 1.00 0.00 C ATOM 254 O GLY A 17 1.612 -10.161 -6.956 1.00 0.00 O ATOM 0 H GLY A 17 1.788 -9.619 -10.418 1.00 0.00 H new ATOM 0 HA2 GLY A 17 0.082 -10.360 -9.012 1.00 0.00 H new ATOM 0 HA3 GLY A 17 0.524 -12.030 -9.309 1.00 0.00 H new ATOM 258 N HIS A 18 2.340 -12.168 -7.476 1.00 0.00 N ATOM 259 CA HIS A 18 3.079 -12.312 -6.188 1.00 0.00 C ATOM 260 C HIS A 18 4.104 -11.183 -6.031 1.00 0.00 C ATOM 261 O HIS A 18 4.058 -10.184 -6.723 1.00 0.00 O ATOM 262 CB HIS A 18 3.789 -13.670 -6.166 1.00 0.00 C ATOM 263 CG HIS A 18 4.711 -13.776 -7.351 1.00 0.00 C ATOM 264 ND1 HIS A 18 6.077 -13.570 -7.245 1.00 0.00 N ATOM 265 CD2 HIS A 18 4.477 -14.067 -8.672 1.00 0.00 C ATOM 266 CE1 HIS A 18 6.609 -13.739 -8.469 1.00 0.00 C ATOM 267 NE2 HIS A 18 5.677 -14.043 -9.376 1.00 0.00 N ATOM 0 H HIS A 18 2.413 -12.969 -8.103 1.00 0.00 H new ATOM 0 HA HIS A 18 2.373 -12.253 -5.360 1.00 0.00 H new ATOM 0 HB2 HIS A 18 4.355 -13.781 -5.241 1.00 0.00 H new ATOM 0 HB3 HIS A 18 3.055 -14.476 -6.190 1.00 0.00 H new ATOM 0 HD1 HIS A 18 6.587 -13.333 -6.394 1.00 0.00 H new ATOM 0 HD2 HIS A 18 3.509 -14.282 -9.100 1.00 0.00 H new ATOM 0 HE1 HIS A 18 7.661 -13.641 -8.691 1.00 0.00 H new ATOM 275 N LEU A 19 5.043 -11.349 -5.135 1.00 0.00 N ATOM 276 CA LEU A 19 6.088 -10.308 -4.934 1.00 0.00 C ATOM 277 C LEU A 19 7.408 -10.839 -5.493 1.00 0.00 C ATOM 278 O LEU A 19 7.553 -12.029 -5.691 1.00 0.00 O ATOM 279 CB LEU A 19 6.249 -10.024 -3.438 1.00 0.00 C ATOM 280 CG LEU A 19 5.326 -8.875 -3.032 1.00 0.00 C ATOM 281 CD1 LEU A 19 5.104 -8.911 -1.519 1.00 0.00 C ATOM 282 CD2 LEU A 19 5.971 -7.542 -3.419 1.00 0.00 C ATOM 0 H LEU A 19 5.129 -12.167 -4.532 1.00 0.00 H new ATOM 0 HA LEU A 19 5.803 -9.387 -5.443 1.00 0.00 H new ATOM 0 HB2 LEU A 19 6.010 -10.917 -2.860 1.00 0.00 H new ATOM 0 HB3 LEU A 19 7.285 -9.768 -3.216 1.00 0.00 H new ATOM 0 HG LEU A 19 4.369 -8.979 -3.544 1.00 0.00 H new ATOM 0 HD11 LEU A 19 4.446 -8.092 -1.228 1.00 0.00 H new ATOM 0 HD12 LEU A 19 4.646 -9.860 -1.241 1.00 0.00 H new ATOM 0 HD13 LEU A 19 6.061 -8.806 -1.008 1.00 0.00 H new ATOM 0 HD21 LEU A 19 5.313 -6.722 -3.130 1.00 0.00 H new ATOM 0 HD22 LEU A 19 6.927 -7.438 -2.906 1.00 0.00 H new ATOM 0 HD23 LEU A 19 6.132 -7.515 -4.497 1.00 0.00 H new ATOM 294 N PRO A 20 8.336 -9.951 -5.733 1.00 0.00 N ATOM 295 CA PRO A 20 9.696 -10.256 -6.285 1.00 0.00 C ATOM 296 C PRO A 20 10.594 -10.818 -5.181 1.00 0.00 C ATOM 297 O PRO A 20 11.443 -11.653 -5.427 1.00 0.00 O ATOM 298 CB PRO A 20 10.258 -8.936 -6.811 1.00 0.00 C ATOM 299 CG PRO A 20 9.260 -7.849 -6.464 1.00 0.00 C ATOM 300 CD PRO A 20 8.246 -8.466 -5.510 1.00 0.00 C ATOM 0 HA PRO A 20 9.645 -11.001 -7.079 1.00 0.00 H new ATOM 0 HB2 PRO A 20 11.228 -8.725 -6.360 1.00 0.00 H new ATOM 0 HB3 PRO A 20 10.412 -8.986 -7.889 1.00 0.00 H new ATOM 0 HG2 PRO A 20 9.761 -7.000 -5.999 1.00 0.00 H new ATOM 0 HG3 PRO A 20 8.768 -7.476 -7.362 1.00 0.00 H new ATOM 0 HD2 PRO A 20 8.474 -8.210 -4.475 1.00 0.00 H new ATOM 0 HD3 PRO A 20 7.240 -8.099 -5.715 1.00 0.00 H new ATOM 308 N TRP A 21 10.433 -10.352 -3.970 1.00 0.00 N ATOM 309 CA TRP A 21 11.295 -10.841 -2.856 1.00 0.00 C ATOM 310 C TRP A 21 10.432 -11.401 -1.720 1.00 0.00 C ATOM 311 O TRP A 21 9.366 -10.896 -1.428 1.00 0.00 O ATOM 312 CB TRP A 21 12.103 -9.659 -2.317 1.00 0.00 C ATOM 313 CG TRP A 21 11.159 -8.548 -1.977 1.00 0.00 C ATOM 314 CD1 TRP A 21 10.390 -8.497 -0.864 1.00 0.00 C ATOM 315 CD2 TRP A 21 10.856 -7.344 -2.739 1.00 0.00 C ATOM 316 NE1 TRP A 21 9.633 -7.340 -0.896 1.00 0.00 N ATOM 317 CE2 TRP A 21 9.887 -6.594 -2.029 1.00 0.00 C ATOM 318 CE3 TRP A 21 11.324 -6.833 -3.963 1.00 0.00 C ATOM 319 CZ2 TRP A 21 9.398 -5.382 -2.518 1.00 0.00 C ATOM 320 CZ3 TRP A 21 10.834 -5.612 -4.457 1.00 0.00 C ATOM 321 CH2 TRP A 21 9.873 -4.889 -3.737 1.00 0.00 C ATOM 0 H TRP A 21 9.740 -9.652 -3.705 1.00 0.00 H new ATOM 0 HA TRP A 21 11.951 -11.628 -3.227 1.00 0.00 H new ATOM 0 HB2 TRP A 21 12.668 -9.959 -1.434 1.00 0.00 H new ATOM 0 HB3 TRP A 21 12.827 -9.326 -3.061 1.00 0.00 H new ATOM 0 HD1 TRP A 21 10.371 -9.239 -0.079 1.00 0.00 H new ATOM 0 HE1 TRP A 21 8.968 -7.071 -0.171 1.00 0.00 H new ATOM 0 HE3 TRP A 21 12.064 -7.382 -4.526 1.00 0.00 H new ATOM 0 HZ2 TRP A 21 8.658 -4.829 -1.959 1.00 0.00 H new ATOM 0 HZ3 TRP A 21 11.200 -5.228 -5.398 1.00 0.00 H new ATOM 0 HH2 TRP A 21 9.500 -3.952 -4.123 1.00 0.00 H new ATOM 332 N HIS A 22 10.895 -12.434 -1.068 1.00 0.00 N ATOM 333 CA HIS A 22 10.116 -13.015 0.062 1.00 0.00 C ATOM 334 C HIS A 22 10.617 -12.400 1.373 1.00 0.00 C ATOM 335 O HIS A 22 11.596 -12.843 1.941 1.00 0.00 O ATOM 336 CB HIS A 22 10.311 -14.533 0.098 1.00 0.00 C ATOM 337 CG HIS A 22 9.079 -15.183 0.666 1.00 0.00 C ATOM 338 ND1 HIS A 22 7.840 -15.082 0.052 1.00 0.00 N ATOM 339 CD2 HIS A 22 8.878 -15.944 1.791 1.00 0.00 C ATOM 340 CE1 HIS A 22 6.958 -15.765 0.805 1.00 0.00 C ATOM 341 NE2 HIS A 22 7.538 -16.310 1.877 1.00 0.00 N ATOM 0 H HIS A 22 11.779 -12.900 -1.270 1.00 0.00 H new ATOM 0 HA HIS A 22 9.056 -12.798 -0.069 1.00 0.00 H new ATOM 0 HB2 HIS A 22 10.504 -14.910 -0.907 1.00 0.00 H new ATOM 0 HB3 HIS A 22 11.181 -14.784 0.705 1.00 0.00 H new ATOM 0 HD2 HIS A 22 9.644 -16.217 2.502 1.00 0.00 H new ATOM 0 HE1 HIS A 22 5.908 -15.861 0.570 1.00 0.00 H new ATOM 0 HE2 HIS A 22 7.095 -16.873 2.603 1.00 0.00 H new ATOM 349 N LEU A 23 9.958 -11.377 1.851 1.00 0.00 N ATOM 350 CA LEU A 23 10.400 -10.724 3.119 1.00 0.00 C ATOM 351 C LEU A 23 9.235 -10.707 4.120 1.00 0.00 C ATOM 352 O LEU A 23 8.318 -9.923 3.980 1.00 0.00 O ATOM 353 CB LEU A 23 10.838 -9.285 2.818 1.00 0.00 C ATOM 354 CG LEU A 23 11.384 -8.628 4.090 1.00 0.00 C ATOM 355 CD1 LEU A 23 12.690 -9.307 4.501 1.00 0.00 C ATOM 356 CD2 LEU A 23 11.650 -7.142 3.824 1.00 0.00 C ATOM 0 H LEU A 23 9.132 -10.965 1.418 1.00 0.00 H new ATOM 0 HA LEU A 23 11.235 -11.280 3.546 1.00 0.00 H new ATOM 0 HB2 LEU A 23 11.602 -9.284 2.041 1.00 0.00 H new ATOM 0 HB3 LEU A 23 9.994 -8.711 2.436 1.00 0.00 H new ATOM 0 HG LEU A 23 10.652 -8.733 4.891 1.00 0.00 H new ATOM 0 HD11 LEU A 23 13.075 -8.837 5.406 1.00 0.00 H new ATOM 0 HD12 LEU A 23 12.506 -10.364 4.691 1.00 0.00 H new ATOM 0 HD13 LEU A 23 13.421 -9.204 3.699 1.00 0.00 H new ATOM 0 HD21 LEU A 23 12.038 -6.674 4.729 1.00 0.00 H new ATOM 0 HD22 LEU A 23 12.380 -7.041 3.021 1.00 0.00 H new ATOM 0 HD23 LEU A 23 10.721 -6.652 3.533 1.00 0.00 H new ATOM 368 N PRO A 24 9.306 -11.574 5.103 1.00 0.00 N ATOM 369 CA PRO A 24 8.278 -11.731 6.191 1.00 0.00 C ATOM 370 C PRO A 24 8.278 -10.496 7.096 1.00 0.00 C ATOM 371 O PRO A 24 7.242 -10.038 7.535 1.00 0.00 O ATOM 372 CB PRO A 24 8.655 -12.972 6.996 1.00 0.00 C ATOM 373 CG PRO A 24 9.957 -13.507 6.441 1.00 0.00 C ATOM 374 CD PRO A 24 10.415 -12.566 5.333 1.00 0.00 C ATOM 0 HA PRO A 24 7.280 -11.836 5.766 1.00 0.00 H new ATOM 0 HB2 PRO A 24 8.763 -12.724 8.052 1.00 0.00 H new ATOM 0 HB3 PRO A 24 7.871 -13.726 6.925 1.00 0.00 H new ATOM 0 HG2 PRO A 24 10.711 -13.567 7.226 1.00 0.00 H new ATOM 0 HG3 PRO A 24 9.820 -14.516 6.052 1.00 0.00 H new ATOM 0 HD2 PRO A 24 11.335 -12.055 5.618 1.00 0.00 H new ATOM 0 HD3 PRO A 24 10.629 -13.122 4.420 1.00 0.00 H new ATOM 382 N ASP A 25 9.433 -9.950 7.373 1.00 0.00 N ATOM 383 CA ASP A 25 9.499 -8.741 8.245 1.00 0.00 C ATOM 384 C ASP A 25 8.716 -7.598 7.594 1.00 0.00 C ATOM 385 O ASP A 25 8.210 -6.717 8.264 1.00 0.00 O ATOM 386 CB ASP A 25 10.960 -8.322 8.424 1.00 0.00 C ATOM 387 CG ASP A 25 11.121 -7.585 9.755 1.00 0.00 C ATOM 388 OD1 ASP A 25 11.036 -8.234 10.784 1.00 0.00 O ATOM 389 OD2 ASP A 25 11.327 -6.382 9.722 1.00 0.00 O ATOM 0 H ASP A 25 10.333 -10.289 7.033 1.00 0.00 H new ATOM 0 HA ASP A 25 9.064 -8.970 9.218 1.00 0.00 H new ATOM 0 HB2 ASP A 25 11.606 -9.199 8.402 1.00 0.00 H new ATOM 0 HB3 ASP A 25 11.268 -7.678 7.600 1.00 0.00 H new ATOM 394 N ASP A 26 8.611 -7.606 6.292 1.00 0.00 N ATOM 395 CA ASP A 26 7.861 -6.524 5.597 1.00 0.00 C ATOM 396 C ASP A 26 6.360 -6.790 5.738 1.00 0.00 C ATOM 397 O ASP A 26 5.589 -5.895 6.027 1.00 0.00 O ATOM 398 CB ASP A 26 8.257 -6.500 4.117 1.00 0.00 C ATOM 399 CG ASP A 26 7.369 -5.515 3.353 1.00 0.00 C ATOM 400 OD1 ASP A 26 7.332 -4.354 3.734 1.00 0.00 O ATOM 401 OD2 ASP A 26 6.728 -5.945 2.410 1.00 0.00 O ATOM 0 H ASP A 26 9.013 -8.316 5.681 1.00 0.00 H new ATOM 0 HA ASP A 26 8.099 -5.558 6.041 1.00 0.00 H new ATOM 0 HB2 ASP A 26 9.303 -6.212 4.017 1.00 0.00 H new ATOM 0 HB3 ASP A 26 8.159 -7.498 3.690 1.00 0.00 H new ATOM 406 N LEU A 27 5.939 -8.014 5.544 1.00 0.00 N ATOM 407 CA LEU A 27 4.488 -8.335 5.676 1.00 0.00 C ATOM 408 C LEU A 27 3.995 -7.879 7.051 1.00 0.00 C ATOM 409 O LEU A 27 2.919 -7.329 7.184 1.00 0.00 O ATOM 410 CB LEU A 27 4.281 -9.844 5.531 1.00 0.00 C ATOM 411 CG LEU A 27 4.524 -10.255 4.077 1.00 0.00 C ATOM 412 CD1 LEU A 27 4.827 -11.753 4.015 1.00 0.00 C ATOM 413 CD2 LEU A 27 3.274 -9.953 3.245 1.00 0.00 C ATOM 0 H LEU A 27 6.537 -8.803 5.300 1.00 0.00 H new ATOM 0 HA LEU A 27 3.927 -7.820 4.897 1.00 0.00 H new ATOM 0 HB2 LEU A 27 4.963 -10.380 6.191 1.00 0.00 H new ATOM 0 HB3 LEU A 27 3.269 -10.114 5.832 1.00 0.00 H new ATOM 0 HG LEU A 27 5.370 -9.696 3.678 1.00 0.00 H new ATOM 0 HD11 LEU A 27 5.000 -12.047 2.980 1.00 0.00 H new ATOM 0 HD12 LEU A 27 5.716 -11.969 4.607 1.00 0.00 H new ATOM 0 HD13 LEU A 27 3.981 -12.312 4.414 1.00 0.00 H new ATOM 0 HD21 LEU A 27 3.447 -10.246 2.209 1.00 0.00 H new ATOM 0 HD22 LEU A 27 2.428 -10.512 3.644 1.00 0.00 H new ATOM 0 HD23 LEU A 27 3.057 -8.886 3.289 1.00 0.00 H new ATOM 425 N HIS A 28 4.784 -8.089 8.072 1.00 0.00 N ATOM 426 CA HIS A 28 4.372 -7.654 9.437 1.00 0.00 C ATOM 427 C HIS A 28 4.216 -6.133 9.439 1.00 0.00 C ATOM 428 O HIS A 28 3.294 -5.592 10.019 1.00 0.00 O ATOM 429 CB HIS A 28 5.442 -8.061 10.451 1.00 0.00 C ATOM 430 CG HIS A 28 5.568 -9.560 10.473 1.00 0.00 C ATOM 431 ND1 HIS A 28 4.464 -10.393 10.567 1.00 0.00 N ATOM 432 CD2 HIS A 28 6.660 -10.389 10.414 1.00 0.00 C ATOM 433 CE1 HIS A 28 4.913 -11.662 10.560 1.00 0.00 C ATOM 434 NE2 HIS A 28 6.244 -11.716 10.469 1.00 0.00 N ATOM 0 H HIS A 28 5.696 -8.543 8.018 1.00 0.00 H new ATOM 0 HA HIS A 28 3.428 -8.126 9.709 1.00 0.00 H new ATOM 0 HB2 HIS A 28 6.398 -7.609 10.188 1.00 0.00 H new ATOM 0 HB3 HIS A 28 5.177 -7.693 11.442 1.00 0.00 H new ATOM 0 HD2 HIS A 28 7.686 -10.061 10.337 1.00 0.00 H new ATOM 0 HE1 HIS A 28 4.274 -12.531 10.621 1.00 0.00 H new ATOM 0 HE2 HIS A 28 6.830 -12.551 10.445 1.00 0.00 H new ATOM 442 N TYR A 29 5.108 -5.442 8.779 1.00 0.00 N ATOM 443 CA TYR A 29 5.013 -3.955 8.720 1.00 0.00 C ATOM 444 C TYR A 29 3.699 -3.567 8.037 1.00 0.00 C ATOM 445 O TYR A 29 3.094 -2.561 8.352 1.00 0.00 O ATOM 446 CB TYR A 29 6.191 -3.405 7.912 1.00 0.00 C ATOM 447 CG TYR A 29 6.293 -1.913 8.114 1.00 0.00 C ATOM 448 CD1 TYR A 29 6.509 -1.392 9.395 1.00 0.00 C ATOM 449 CD2 TYR A 29 6.173 -1.049 7.018 1.00 0.00 C ATOM 450 CE1 TYR A 29 6.605 -0.008 9.582 1.00 0.00 C ATOM 451 CE2 TYR A 29 6.268 0.335 7.204 1.00 0.00 C ATOM 452 CZ TYR A 29 6.485 0.856 8.486 1.00 0.00 C ATOM 453 OH TYR A 29 6.580 2.220 8.669 1.00 0.00 O ATOM 0 H TYR A 29 5.900 -5.845 8.278 1.00 0.00 H new ATOM 0 HA TYR A 29 5.040 -3.540 9.728 1.00 0.00 H new ATOM 0 HB2 TYR A 29 7.117 -3.888 8.225 1.00 0.00 H new ATOM 0 HB3 TYR A 29 6.056 -3.630 6.854 1.00 0.00 H new ATOM 0 HD1 TYR A 29 6.602 -2.058 10.240 1.00 0.00 H new ATOM 0 HD2 TYR A 29 6.007 -1.451 6.029 1.00 0.00 H new ATOM 0 HE1 TYR A 29 6.771 0.393 10.571 1.00 0.00 H new ATOM 0 HE2 TYR A 29 6.174 1.001 6.359 1.00 0.00 H new ATOM 0 HH TYR A 29 6.475 2.674 7.807 1.00 0.00 H new ATOM 463 N PHE A 30 3.259 -4.366 7.102 1.00 0.00 N ATOM 464 CA PHE A 30 1.986 -4.063 6.386 1.00 0.00 C ATOM 465 C PHE A 30 0.802 -4.281 7.332 1.00 0.00 C ATOM 466 O PHE A 30 -0.062 -3.437 7.464 1.00 0.00 O ATOM 467 CB PHE A 30 1.850 -4.993 5.176 1.00 0.00 C ATOM 468 CG PHE A 30 0.551 -4.709 4.458 1.00 0.00 C ATOM 469 CD1 PHE A 30 0.243 -3.404 4.059 1.00 0.00 C ATOM 470 CD2 PHE A 30 -0.346 -5.751 4.193 1.00 0.00 C ATOM 471 CE1 PHE A 30 -0.961 -3.139 3.397 1.00 0.00 C ATOM 472 CE2 PHE A 30 -1.550 -5.486 3.529 1.00 0.00 C ATOM 473 CZ PHE A 30 -1.856 -4.180 3.131 1.00 0.00 C ATOM 0 H PHE A 30 3.729 -5.220 6.802 1.00 0.00 H new ATOM 0 HA PHE A 30 1.995 -3.026 6.051 1.00 0.00 H new ATOM 0 HB2 PHE A 30 2.691 -4.848 4.498 1.00 0.00 H new ATOM 0 HB3 PHE A 30 1.878 -6.033 5.500 1.00 0.00 H new ATOM 0 HD1 PHE A 30 0.935 -2.600 4.262 1.00 0.00 H new ATOM 0 HD2 PHE A 30 -0.109 -6.759 4.501 1.00 0.00 H new ATOM 0 HE1 PHE A 30 -1.199 -2.131 3.092 1.00 0.00 H new ATOM 0 HE2 PHE A 30 -2.242 -6.289 3.324 1.00 0.00 H new ATOM 0 HZ PHE A 30 -2.784 -3.976 2.618 1.00 0.00 H new ATOM 483 N ARG A 31 0.753 -5.410 7.984 1.00 0.00 N ATOM 484 CA ARG A 31 -0.375 -5.693 8.914 1.00 0.00 C ATOM 485 C ARG A 31 -0.357 -4.695 10.075 1.00 0.00 C ATOM 486 O ARG A 31 -1.387 -4.218 10.508 1.00 0.00 O ATOM 487 CB ARG A 31 -0.224 -7.115 9.458 1.00 0.00 C ATOM 488 CG ARG A 31 -1.474 -7.507 10.247 1.00 0.00 C ATOM 489 CD ARG A 31 -1.136 -8.669 11.182 1.00 0.00 C ATOM 490 NE ARG A 31 -0.245 -8.178 12.276 1.00 0.00 N ATOM 491 CZ ARG A 31 0.842 -8.834 12.615 1.00 0.00 C ATOM 492 NH1 ARG A 31 1.173 -9.952 12.018 1.00 0.00 N ATOM 493 NH2 ARG A 31 1.601 -8.368 13.568 1.00 0.00 N ATOM 0 H ARG A 31 1.449 -6.152 7.912 1.00 0.00 H new ATOM 0 HA ARG A 31 -1.321 -5.598 8.381 1.00 0.00 H new ATOM 0 HB2 ARG A 31 -0.069 -7.813 8.636 1.00 0.00 H new ATOM 0 HB3 ARG A 31 0.655 -7.177 10.099 1.00 0.00 H new ATOM 0 HG2 ARG A 31 -1.837 -6.655 10.823 1.00 0.00 H new ATOM 0 HG3 ARG A 31 -2.274 -7.795 9.565 1.00 0.00 H new ATOM 0 HD2 ARG A 31 -2.049 -9.090 11.602 1.00 0.00 H new ATOM 0 HD3 ARG A 31 -0.643 -9.467 10.626 1.00 0.00 H new ATOM 0 HE ARG A 31 -0.485 -7.318 12.769 1.00 0.00 H new ATOM 0 HH11 ARG A 31 0.583 -10.328 11.276 1.00 0.00 H new ATOM 0 HH12 ARG A 31 2.021 -10.447 12.295 1.00 0.00 H new ATOM 0 HH21 ARG A 31 1.349 -7.501 14.043 1.00 0.00 H new ATOM 0 HH22 ARG A 31 2.447 -8.870 13.838 1.00 0.00 H new ATOM 507 N ALA A 32 0.804 -4.385 10.588 1.00 0.00 N ATOM 508 CA ALA A 32 0.890 -3.429 11.730 1.00 0.00 C ATOM 509 C ALA A 32 0.572 -2.005 11.258 1.00 0.00 C ATOM 510 O ALA A 32 -0.098 -1.253 11.938 1.00 0.00 O ATOM 511 CB ALA A 32 2.304 -3.464 12.312 1.00 0.00 C ATOM 0 H ALA A 32 1.698 -4.754 10.264 1.00 0.00 H new ATOM 0 HA ALA A 32 0.166 -3.720 12.491 1.00 0.00 H new ATOM 0 HB1 ALA A 32 2.371 -2.767 13.147 1.00 0.00 H new ATOM 0 HB2 ALA A 32 2.529 -4.472 12.662 1.00 0.00 H new ATOM 0 HB3 ALA A 32 3.021 -3.179 11.542 1.00 0.00 H new ATOM 517 N GLN A 33 1.062 -1.623 10.109 1.00 0.00 N ATOM 518 CA GLN A 33 0.803 -0.241 9.604 1.00 0.00 C ATOM 519 C GLN A 33 -0.667 -0.080 9.194 1.00 0.00 C ATOM 520 O GLN A 33 -1.134 1.020 8.970 1.00 0.00 O ATOM 521 CB GLN A 33 1.698 0.029 8.393 1.00 0.00 C ATOM 522 CG GLN A 33 3.137 0.259 8.862 1.00 0.00 C ATOM 523 CD GLN A 33 3.250 1.643 9.505 1.00 0.00 C ATOM 524 OE1 GLN A 33 3.736 1.773 10.611 1.00 0.00 O ATOM 525 NE2 GLN A 33 2.820 2.689 8.855 1.00 0.00 N ATOM 0 H GLN A 33 1.631 -2.208 9.497 1.00 0.00 H new ATOM 0 HA GLN A 33 1.023 0.470 10.400 1.00 0.00 H new ATOM 0 HB2 GLN A 33 1.659 -0.815 7.704 1.00 0.00 H new ATOM 0 HB3 GLN A 33 1.338 0.902 7.849 1.00 0.00 H new ATOM 0 HG2 GLN A 33 3.425 -0.511 9.578 1.00 0.00 H new ATOM 0 HG3 GLN A 33 3.822 0.181 8.018 1.00 0.00 H new ATOM 0 HE21 GLN A 33 2.412 2.580 7.927 1.00 0.00 H new ATOM 0 HE22 GLN A 33 2.892 3.616 9.275 1.00 0.00 H new ATOM 534 N THR A 34 -1.397 -1.158 9.078 1.00 0.00 N ATOM 535 CA THR A 34 -2.828 -1.042 8.665 1.00 0.00 C ATOM 536 C THR A 34 -3.749 -1.571 9.769 1.00 0.00 C ATOM 537 O THR A 34 -4.835 -2.047 9.502 1.00 0.00 O ATOM 538 CB THR A 34 -3.052 -1.851 7.385 1.00 0.00 C ATOM 539 OG1 THR A 34 -2.774 -3.221 7.639 1.00 0.00 O ATOM 540 CG2 THR A 34 -2.125 -1.336 6.284 1.00 0.00 C ATOM 0 H THR A 34 -1.068 -2.108 9.250 1.00 0.00 H new ATOM 0 HA THR A 34 -3.060 0.008 8.487 1.00 0.00 H new ATOM 0 HB THR A 34 -4.088 -1.743 7.063 1.00 0.00 H new ATOM 0 HG1 THR A 34 -1.810 -3.380 7.559 1.00 0.00 H new ATOM 0 HG21 THR A 34 -2.286 -1.913 5.373 1.00 0.00 H new ATOM 0 HG22 THR A 34 -2.339 -0.285 6.090 1.00 0.00 H new ATOM 0 HG23 THR A 34 -1.088 -1.442 6.602 1.00 0.00 H new ATOM 548 N VAL A 35 -3.330 -1.495 11.004 1.00 0.00 N ATOM 549 CA VAL A 35 -4.193 -2.000 12.113 1.00 0.00 C ATOM 550 C VAL A 35 -5.229 -0.940 12.501 1.00 0.00 C ATOM 551 O VAL A 35 -4.891 0.146 12.932 1.00 0.00 O ATOM 552 CB VAL A 35 -3.326 -2.333 13.330 1.00 0.00 C ATOM 553 CG1 VAL A 35 -2.300 -3.397 12.943 1.00 0.00 C ATOM 554 CG2 VAL A 35 -2.597 -1.072 13.807 1.00 0.00 C ATOM 0 H VAL A 35 -2.432 -1.107 11.293 1.00 0.00 H new ATOM 0 HA VAL A 35 -4.710 -2.898 11.775 1.00 0.00 H new ATOM 0 HB VAL A 35 -3.959 -2.708 14.134 1.00 0.00 H new ATOM 0 HG11 VAL A 35 -1.681 -3.637 13.807 1.00 0.00 H new ATOM 0 HG12 VAL A 35 -2.817 -4.296 12.607 1.00 0.00 H new ATOM 0 HG13 VAL A 35 -1.669 -3.019 12.138 1.00 0.00 H new ATOM 0 HG21 VAL A 35 -1.981 -1.314 14.673 1.00 0.00 H new ATOM 0 HG22 VAL A 35 -1.963 -0.693 13.005 1.00 0.00 H new ATOM 0 HG23 VAL A 35 -3.328 -0.311 14.082 1.00 0.00 H new ATOM 564 N GLY A 36 -6.488 -1.256 12.362 1.00 0.00 N ATOM 565 CA GLY A 36 -7.556 -0.282 12.733 1.00 0.00 C ATOM 566 C GLY A 36 -7.668 0.823 11.678 1.00 0.00 C ATOM 567 O GLY A 36 -8.303 1.834 11.903 1.00 0.00 O ATOM 0 H GLY A 36 -6.825 -2.151 12.006 1.00 0.00 H new ATOM 0 HA2 GLY A 36 -8.511 -0.800 12.828 1.00 0.00 H new ATOM 0 HA3 GLY A 36 -7.333 0.157 13.705 1.00 0.00 H new ATOM 571 N LYS A 37 -7.056 0.651 10.535 1.00 0.00 N ATOM 572 CA LYS A 37 -7.136 1.707 9.483 1.00 0.00 C ATOM 573 C LYS A 37 -7.834 1.146 8.240 1.00 0.00 C ATOM 574 O LYS A 37 -8.015 -0.049 8.105 1.00 0.00 O ATOM 575 CB LYS A 37 -5.724 2.163 9.113 1.00 0.00 C ATOM 576 CG LYS A 37 -5.140 3.000 10.256 1.00 0.00 C ATOM 577 CD LYS A 37 -3.705 2.549 10.542 1.00 0.00 C ATOM 578 CE LYS A 37 -2.835 3.772 10.844 1.00 0.00 C ATOM 579 NZ LYS A 37 -2.993 4.153 12.275 1.00 0.00 N ATOM 0 H LYS A 37 -6.507 -0.171 10.285 1.00 0.00 H new ATOM 0 HA LYS A 37 -7.706 2.555 9.864 1.00 0.00 H new ATOM 0 HB2 LYS A 37 -5.090 1.298 8.921 1.00 0.00 H new ATOM 0 HB3 LYS A 37 -5.749 2.750 8.195 1.00 0.00 H new ATOM 0 HG2 LYS A 37 -5.153 4.057 9.990 1.00 0.00 H new ATOM 0 HG3 LYS A 37 -5.752 2.889 11.151 1.00 0.00 H new ATOM 0 HD2 LYS A 37 -3.690 1.862 11.388 1.00 0.00 H new ATOM 0 HD3 LYS A 37 -3.305 2.008 9.685 1.00 0.00 H new ATOM 0 HE2 LYS A 37 -1.790 3.550 10.629 1.00 0.00 H new ATOM 0 HE3 LYS A 37 -3.123 4.604 10.201 1.00 0.00 H new ATOM 0 HZ1 LYS A 37 -2.402 4.984 12.480 1.00 0.00 H new ATOM 0 HZ2 LYS A 37 -3.990 4.381 12.465 1.00 0.00 H new ATOM 0 HZ3 LYS A 37 -2.698 3.360 12.880 1.00 0.00 H new ATOM 593 N ILE A 38 -8.230 2.001 7.331 1.00 0.00 N ATOM 594 CA ILE A 38 -8.914 1.519 6.096 1.00 0.00 C ATOM 595 C ILE A 38 -7.862 1.136 5.053 1.00 0.00 C ATOM 596 O ILE A 38 -7.000 1.921 4.716 1.00 0.00 O ATOM 597 CB ILE A 38 -9.804 2.628 5.532 1.00 0.00 C ATOM 598 CG1 ILE A 38 -10.746 3.137 6.626 1.00 0.00 C ATOM 599 CG2 ILE A 38 -10.629 2.077 4.367 1.00 0.00 C ATOM 600 CD1 ILE A 38 -11.552 4.322 6.090 1.00 0.00 C ATOM 0 H ILE A 38 -8.108 3.012 7.392 1.00 0.00 H new ATOM 0 HA ILE A 38 -9.528 0.651 6.338 1.00 0.00 H new ATOM 0 HB ILE A 38 -9.179 3.449 5.181 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -11.418 2.339 6.943 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -10.173 3.439 7.503 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -11.263 2.867 3.965 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.960 1.716 3.586 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.252 1.255 4.719 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -12.224 4.686 6.867 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -10.872 5.121 5.794 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -12.135 4.004 5.226 1.00 0.00 H new ATOM 612 N MET A 39 -7.923 -0.065 4.548 1.00 0.00 N ATOM 613 CA MET A 39 -6.922 -0.506 3.532 1.00 0.00 C ATOM 614 C MET A 39 -7.540 -0.446 2.133 1.00 0.00 C ATOM 615 O MET A 39 -8.343 -1.282 1.766 1.00 0.00 O ATOM 616 CB MET A 39 -6.498 -1.944 3.839 1.00 0.00 C ATOM 617 CG MET A 39 -5.402 -2.382 2.865 1.00 0.00 C ATOM 618 SD MET A 39 -5.391 -4.189 2.750 1.00 0.00 S ATOM 619 CE MET A 39 -6.863 -4.363 1.714 1.00 0.00 C ATOM 0 H MET A 39 -8.624 -0.763 4.795 1.00 0.00 H new ATOM 0 HA MET A 39 -6.054 0.153 3.568 1.00 0.00 H new ATOM 0 HB2 MET A 39 -6.135 -2.014 4.864 1.00 0.00 H new ATOM 0 HB3 MET A 39 -7.356 -2.611 3.758 1.00 0.00 H new ATOM 0 HG2 MET A 39 -5.577 -1.945 1.882 1.00 0.00 H new ATOM 0 HG3 MET A 39 -4.431 -2.022 3.206 1.00 0.00 H new ATOM 0 HE1 MET A 39 -7.603 -4.973 2.232 1.00 0.00 H new ATOM 0 HE2 MET A 39 -7.283 -3.378 1.510 1.00 0.00 H new ATOM 0 HE3 MET A 39 -6.592 -4.843 0.774 1.00 0.00 H new ATOM 629 N VAL A 40 -7.175 0.535 1.348 1.00 0.00 N ATOM 630 CA VAL A 40 -7.746 0.644 -0.025 1.00 0.00 C ATOM 631 C VAL A 40 -6.844 -0.097 -1.017 1.00 0.00 C ATOM 632 O VAL A 40 -5.671 0.212 -1.172 1.00 0.00 O ATOM 633 CB VAL A 40 -7.843 2.117 -0.426 1.00 0.00 C ATOM 634 CG1 VAL A 40 -8.526 2.234 -1.791 1.00 0.00 C ATOM 635 CG2 VAL A 40 -8.662 2.878 0.621 1.00 0.00 C ATOM 0 H VAL A 40 -6.507 1.264 1.599 1.00 0.00 H new ATOM 0 HA VAL A 40 -8.741 0.199 -0.037 1.00 0.00 H new ATOM 0 HB VAL A 40 -6.841 2.542 -0.485 1.00 0.00 H new ATOM 0 HG11 VAL A 40 -8.594 3.284 -2.075 1.00 0.00 H new ATOM 0 HG12 VAL A 40 -7.943 1.694 -2.537 1.00 0.00 H new ATOM 0 HG13 VAL A 40 -9.528 1.808 -1.734 1.00 0.00 H new ATOM 0 HG21 VAL A 40 -8.732 3.928 0.336 1.00 0.00 H new ATOM 0 HG22 VAL A 40 -9.663 2.451 0.680 1.00 0.00 H new ATOM 0 HG23 VAL A 40 -8.175 2.797 1.593 1.00 0.00 H new ATOM 645 N VAL A 41 -7.386 -1.076 -1.690 1.00 0.00 N ATOM 646 CA VAL A 41 -6.577 -1.847 -2.672 1.00 0.00 C ATOM 647 C VAL A 41 -7.256 -1.816 -4.041 1.00 0.00 C ATOM 648 O VAL A 41 -8.265 -1.164 -4.237 1.00 0.00 O ATOM 649 CB VAL A 41 -6.446 -3.301 -2.208 1.00 0.00 C ATOM 650 CG1 VAL A 41 -5.419 -3.385 -1.080 1.00 0.00 C ATOM 651 CG2 VAL A 41 -7.802 -3.808 -1.706 1.00 0.00 C ATOM 0 H VAL A 41 -8.357 -1.374 -1.600 1.00 0.00 H new ATOM 0 HA VAL A 41 -5.587 -1.397 -2.746 1.00 0.00 H new ATOM 0 HB VAL A 41 -6.119 -3.919 -3.045 1.00 0.00 H new ATOM 0 HG11 VAL A 41 -5.325 -4.419 -0.749 1.00 0.00 H new ATOM 0 HG12 VAL A 41 -4.453 -3.030 -1.440 1.00 0.00 H new ATOM 0 HG13 VAL A 41 -5.745 -2.765 -0.245 1.00 0.00 H new ATOM 0 HG21 VAL A 41 -7.704 -4.843 -1.377 1.00 0.00 H new ATOM 0 HG22 VAL A 41 -8.135 -3.191 -0.871 1.00 0.00 H new ATOM 0 HG23 VAL A 41 -8.533 -3.751 -2.513 1.00 0.00 H new ATOM 661 N GLY A 42 -6.723 -2.545 -4.981 1.00 0.00 N ATOM 662 CA GLY A 42 -7.335 -2.587 -6.337 1.00 0.00 C ATOM 663 C GLY A 42 -7.836 -4.004 -6.624 1.00 0.00 C ATOM 664 O GLY A 42 -7.271 -4.976 -6.162 1.00 0.00 O ATOM 0 H GLY A 42 -5.886 -3.116 -4.867 1.00 0.00 H new ATOM 0 HA2 GLY A 42 -8.161 -1.878 -6.398 1.00 0.00 H new ATOM 0 HA3 GLY A 42 -6.603 -2.289 -7.088 1.00 0.00 H new ATOM 668 N ARG A 43 -8.903 -4.124 -7.372 1.00 0.00 N ATOM 669 CA ARG A 43 -9.472 -5.471 -7.691 1.00 0.00 C ATOM 670 C ARG A 43 -8.365 -6.456 -8.091 1.00 0.00 C ATOM 671 O ARG A 43 -8.507 -7.652 -7.928 1.00 0.00 O ATOM 672 CB ARG A 43 -10.463 -5.333 -8.850 1.00 0.00 C ATOM 673 CG ARG A 43 -11.131 -6.684 -9.124 1.00 0.00 C ATOM 674 CD ARG A 43 -10.605 -7.259 -10.442 1.00 0.00 C ATOM 675 NE ARG A 43 -11.115 -6.438 -11.579 1.00 0.00 N ATOM 676 CZ ARG A 43 -11.132 -6.917 -12.800 1.00 0.00 C ATOM 677 NH1 ARG A 43 -10.694 -8.124 -13.054 1.00 0.00 N ATOM 678 NH2 ARG A 43 -11.585 -6.178 -13.775 1.00 0.00 N ATOM 0 H ARG A 43 -9.410 -3.339 -7.780 1.00 0.00 H new ATOM 0 HA ARG A 43 -9.973 -5.856 -6.803 1.00 0.00 H new ATOM 0 HB2 ARG A 43 -11.219 -4.586 -8.608 1.00 0.00 H new ATOM 0 HB3 ARG A 43 -9.945 -4.985 -9.744 1.00 0.00 H new ATOM 0 HG2 ARG A 43 -10.926 -7.375 -8.306 1.00 0.00 H new ATOM 0 HG3 ARG A 43 -12.213 -6.563 -9.175 1.00 0.00 H new ATOM 0 HD2 ARG A 43 -9.515 -7.262 -10.441 1.00 0.00 H new ATOM 0 HD3 ARG A 43 -10.926 -8.295 -10.554 1.00 0.00 H new ATOM 0 HE ARG A 43 -11.455 -5.492 -11.404 1.00 0.00 H new ATOM 0 HH11 ARG A 43 -10.333 -8.705 -12.297 1.00 0.00 H new ATOM 0 HH12 ARG A 43 -10.713 -8.483 -14.008 1.00 0.00 H new ATOM 0 HH21 ARG A 43 -11.923 -5.234 -13.585 1.00 0.00 H new ATOM 0 HH22 ARG A 43 -11.601 -6.544 -14.727 1.00 0.00 H new ATOM 692 N ARG A 44 -7.270 -5.973 -8.614 1.00 0.00 N ATOM 693 CA ARG A 44 -6.172 -6.895 -9.021 1.00 0.00 C ATOM 694 C ARG A 44 -5.399 -7.360 -7.782 1.00 0.00 C ATOM 695 O ARG A 44 -5.084 -8.526 -7.637 1.00 0.00 O ATOM 696 CB ARG A 44 -5.219 -6.162 -9.968 1.00 0.00 C ATOM 697 CG ARG A 44 -5.664 -6.375 -11.417 1.00 0.00 C ATOM 698 CD ARG A 44 -4.757 -5.567 -12.348 1.00 0.00 C ATOM 699 NE ARG A 44 -4.831 -6.125 -13.731 1.00 0.00 N ATOM 700 CZ ARG A 44 -5.824 -5.812 -14.531 1.00 0.00 C ATOM 701 NH1 ARG A 44 -6.781 -5.013 -14.133 1.00 0.00 N ATOM 702 NH2 ARG A 44 -5.855 -6.301 -15.740 1.00 0.00 N ATOM 0 H ARG A 44 -7.089 -4.982 -8.776 1.00 0.00 H new ATOM 0 HA ARG A 44 -6.598 -7.762 -9.526 1.00 0.00 H new ATOM 0 HB2 ARG A 44 -5.207 -5.097 -9.734 1.00 0.00 H new ATOM 0 HB3 ARG A 44 -4.202 -6.530 -9.832 1.00 0.00 H new ATOM 0 HG2 ARG A 44 -5.616 -7.434 -11.672 1.00 0.00 H new ATOM 0 HG3 ARG A 44 -6.701 -6.064 -11.541 1.00 0.00 H new ATOM 0 HD2 ARG A 44 -5.062 -4.521 -12.351 1.00 0.00 H new ATOM 0 HD3 ARG A 44 -3.729 -5.598 -11.987 1.00 0.00 H new ATOM 0 HE ARG A 44 -4.101 -6.757 -14.058 1.00 0.00 H new ATOM 0 HH11 ARG A 44 -6.762 -4.624 -13.190 1.00 0.00 H new ATOM 0 HH12 ARG A 44 -7.546 -4.779 -14.766 1.00 0.00 H new ATOM 0 HH21 ARG A 44 -5.111 -6.922 -16.058 1.00 0.00 H new ATOM 0 HH22 ARG A 44 -6.623 -6.062 -16.367 1.00 0.00 H new ATOM 716 N THR A 45 -5.085 -6.457 -6.890 1.00 0.00 N ATOM 717 CA THR A 45 -4.324 -6.849 -5.666 1.00 0.00 C ATOM 718 C THR A 45 -5.221 -7.657 -4.726 1.00 0.00 C ATOM 719 O THR A 45 -4.842 -8.711 -4.258 1.00 0.00 O ATOM 720 CB THR A 45 -3.833 -5.595 -4.940 1.00 0.00 C ATOM 721 OG1 THR A 45 -3.271 -4.692 -5.882 1.00 0.00 O ATOM 722 CG2 THR A 45 -2.772 -5.988 -3.908 1.00 0.00 C ATOM 0 H THR A 45 -5.322 -5.467 -6.956 1.00 0.00 H new ATOM 0 HA THR A 45 -3.471 -7.459 -5.963 1.00 0.00 H new ATOM 0 HB THR A 45 -4.670 -5.114 -4.434 1.00 0.00 H new ATOM 0 HG1 THR A 45 -3.599 -4.909 -6.780 1.00 0.00 H new ATOM 0 HG21 THR A 45 -2.421 -5.096 -3.390 1.00 0.00 H new ATOM 0 HG22 THR A 45 -3.205 -6.680 -3.186 1.00 0.00 H new ATOM 0 HG23 THR A 45 -1.934 -6.468 -4.413 1.00 0.00 H new ATOM 730 N TYR A 46 -6.403 -7.175 -4.440 1.00 0.00 N ATOM 731 CA TYR A 46 -7.314 -7.924 -3.521 1.00 0.00 C ATOM 732 C TYR A 46 -7.479 -9.364 -4.016 1.00 0.00 C ATOM 733 O TYR A 46 -7.501 -10.298 -3.239 1.00 0.00 O ATOM 734 CB TYR A 46 -8.681 -7.240 -3.478 1.00 0.00 C ATOM 735 CG TYR A 46 -9.450 -7.730 -2.272 1.00 0.00 C ATOM 736 CD1 TYR A 46 -9.254 -7.128 -1.023 1.00 0.00 C ATOM 737 CD2 TYR A 46 -10.361 -8.785 -2.404 1.00 0.00 C ATOM 738 CE1 TYR A 46 -9.967 -7.580 0.092 1.00 0.00 C ATOM 739 CE2 TYR A 46 -11.075 -9.236 -1.288 1.00 0.00 C ATOM 740 CZ TYR A 46 -10.878 -8.634 -0.040 1.00 0.00 C ATOM 741 OH TYR A 46 -11.584 -9.078 1.060 1.00 0.00 O ATOM 0 H TYR A 46 -6.777 -6.298 -4.802 1.00 0.00 H new ATOM 0 HA TYR A 46 -6.882 -7.933 -2.520 1.00 0.00 H new ATOM 0 HB2 TYR A 46 -8.557 -6.158 -3.429 1.00 0.00 H new ATOM 0 HB3 TYR A 46 -9.237 -7.456 -4.390 1.00 0.00 H new ATOM 0 HD1 TYR A 46 -8.552 -6.314 -0.921 1.00 0.00 H new ATOM 0 HD2 TYR A 46 -10.513 -9.251 -3.367 1.00 0.00 H new ATOM 0 HE1 TYR A 46 -9.815 -7.116 1.055 1.00 0.00 H new ATOM 0 HE2 TYR A 46 -11.778 -10.049 -1.390 1.00 0.00 H new ATOM 0 HH TYR A 46 -12.174 -9.814 0.795 1.00 0.00 H new ATOM 751 N GLU A 47 -7.585 -9.550 -5.305 1.00 0.00 N ATOM 752 CA GLU A 47 -7.740 -10.929 -5.850 1.00 0.00 C ATOM 753 C GLU A 47 -6.393 -11.657 -5.794 1.00 0.00 C ATOM 754 O GLU A 47 -6.329 -12.869 -5.864 1.00 0.00 O ATOM 755 CB GLU A 47 -8.225 -10.853 -7.299 1.00 0.00 C ATOM 756 CG GLU A 47 -9.755 -10.806 -7.321 1.00 0.00 C ATOM 757 CD GLU A 47 -10.237 -10.463 -8.731 1.00 0.00 C ATOM 758 OE1 GLU A 47 -9.662 -10.979 -9.675 1.00 0.00 O ATOM 759 OE2 GLU A 47 -11.174 -9.690 -8.843 1.00 0.00 O ATOM 0 H GLU A 47 -7.571 -8.807 -6.003 1.00 0.00 H new ATOM 0 HA GLU A 47 -8.470 -11.476 -5.253 1.00 0.00 H new ATOM 0 HB2 GLU A 47 -7.816 -9.967 -7.785 1.00 0.00 H new ATOM 0 HB3 GLU A 47 -7.869 -11.717 -7.859 1.00 0.00 H new ATOM 0 HG2 GLU A 47 -10.163 -11.768 -7.010 1.00 0.00 H new ATOM 0 HG3 GLU A 47 -10.116 -10.062 -6.611 1.00 0.00 H new ATOM 766 N SER A 48 -5.315 -10.927 -5.659 1.00 0.00 N ATOM 767 CA SER A 48 -3.973 -11.575 -5.588 1.00 0.00 C ATOM 768 C SER A 48 -3.569 -11.755 -4.119 1.00 0.00 C ATOM 769 O SER A 48 -2.735 -12.577 -3.794 1.00 0.00 O ATOM 770 CB SER A 48 -2.944 -10.693 -6.296 1.00 0.00 C ATOM 771 OG SER A 48 -1.751 -11.438 -6.503 1.00 0.00 O ATOM 0 H SER A 48 -5.308 -9.909 -5.595 1.00 0.00 H new ATOM 0 HA SER A 48 -4.013 -12.549 -6.075 1.00 0.00 H new ATOM 0 HB2 SER A 48 -3.340 -10.346 -7.250 1.00 0.00 H new ATOM 0 HB3 SER A 48 -2.734 -9.807 -5.697 1.00 0.00 H new ATOM 0 HG SER A 48 -1.089 -10.876 -6.958 1.00 0.00 H new ATOM 777 N PHE A 49 -4.154 -10.988 -3.232 1.00 0.00 N ATOM 778 CA PHE A 49 -3.815 -11.100 -1.780 1.00 0.00 C ATOM 779 C PHE A 49 -3.867 -12.573 -1.343 1.00 0.00 C ATOM 780 O PHE A 49 -4.599 -13.356 -1.913 1.00 0.00 O ATOM 781 CB PHE A 49 -4.847 -10.309 -0.966 1.00 0.00 C ATOM 782 CG PHE A 49 -4.257 -9.003 -0.487 1.00 0.00 C ATOM 783 CD1 PHE A 49 -3.559 -8.956 0.725 1.00 0.00 C ATOM 784 CD2 PHE A 49 -4.420 -7.838 -1.245 1.00 0.00 C ATOM 785 CE1 PHE A 49 -3.022 -7.748 1.178 1.00 0.00 C ATOM 786 CE2 PHE A 49 -3.884 -6.627 -0.789 1.00 0.00 C ATOM 787 CZ PHE A 49 -3.185 -6.582 0.422 1.00 0.00 C ATOM 0 H PHE A 49 -4.857 -10.284 -3.454 1.00 0.00 H new ATOM 0 HA PHE A 49 -2.813 -10.705 -1.612 1.00 0.00 H new ATOM 0 HB2 PHE A 49 -5.728 -10.114 -1.577 1.00 0.00 H new ATOM 0 HB3 PHE A 49 -5.176 -10.901 -0.112 1.00 0.00 H new ATOM 0 HD1 PHE A 49 -3.435 -9.855 1.311 1.00 0.00 H new ATOM 0 HD2 PHE A 49 -4.958 -7.873 -2.181 1.00 0.00 H new ATOM 0 HE1 PHE A 49 -2.481 -7.714 2.112 1.00 0.00 H new ATOM 0 HE2 PHE A 49 -4.010 -5.727 -1.373 1.00 0.00 H new ATOM 0 HZ PHE A 49 -2.772 -5.648 0.773 1.00 0.00 H new ATOM 797 N PRO A 50 -3.099 -12.902 -0.332 1.00 0.00 N ATOM 798 CA PRO A 50 -3.002 -14.269 0.277 1.00 0.00 C ATOM 799 C PRO A 50 -4.138 -14.454 1.287 1.00 0.00 C ATOM 800 O PRO A 50 -4.922 -15.378 1.194 1.00 0.00 O ATOM 801 CB PRO A 50 -1.651 -14.327 0.985 1.00 0.00 C ATOM 802 CG PRO A 50 -1.133 -12.906 1.085 1.00 0.00 C ATOM 803 CD PRO A 50 -2.163 -11.998 0.420 1.00 0.00 C ATOM 0 HA PRO A 50 -3.084 -15.056 -0.473 1.00 0.00 H new ATOM 0 HB2 PRO A 50 -1.755 -14.769 1.976 1.00 0.00 H new ATOM 0 HB3 PRO A 50 -0.952 -14.952 0.429 1.00 0.00 H new ATOM 0 HG2 PRO A 50 -0.988 -12.623 2.127 1.00 0.00 H new ATOM 0 HG3 PRO A 50 -0.165 -12.814 0.592 1.00 0.00 H new ATOM 0 HD2 PRO A 50 -2.702 -11.412 1.164 1.00 0.00 H new ATOM 0 HD3 PRO A 50 -1.680 -11.291 -0.254 1.00 0.00 H new ATOM 811 N LYS A 51 -4.232 -13.573 2.249 1.00 0.00 N ATOM 812 CA LYS A 51 -5.316 -13.682 3.268 1.00 0.00 C ATOM 813 C LYS A 51 -6.281 -12.504 3.109 1.00 0.00 C ATOM 814 O LYS A 51 -5.904 -11.358 3.264 1.00 0.00 O ATOM 815 CB LYS A 51 -4.701 -13.650 4.669 1.00 0.00 C ATOM 816 CG LYS A 51 -5.620 -14.381 5.649 1.00 0.00 C ATOM 817 CD LYS A 51 -5.379 -13.854 7.066 1.00 0.00 C ATOM 818 CE LYS A 51 -4.352 -14.740 7.774 1.00 0.00 C ATOM 819 NZ LYS A 51 -4.274 -14.357 9.212 1.00 0.00 N ATOM 0 H LYS A 51 -3.602 -12.780 2.372 1.00 0.00 H new ATOM 0 HA LYS A 51 -5.856 -14.618 3.129 1.00 0.00 H new ATOM 0 HB2 LYS A 51 -3.718 -14.121 4.657 1.00 0.00 H new ATOM 0 HB3 LYS A 51 -4.557 -12.619 4.990 1.00 0.00 H new ATOM 0 HG2 LYS A 51 -6.662 -14.232 5.367 1.00 0.00 H new ATOM 0 HG3 LYS A 51 -5.430 -15.454 5.611 1.00 0.00 H new ATOM 0 HD2 LYS A 51 -5.021 -12.825 7.027 1.00 0.00 H new ATOM 0 HD3 LYS A 51 -6.314 -13.845 7.626 1.00 0.00 H new ATOM 0 HE2 LYS A 51 -4.634 -15.789 7.681 1.00 0.00 H new ATOM 0 HE3 LYS A 51 -3.375 -14.630 7.304 1.00 0.00 H new ATOM 0 HZ1 LYS A 51 -3.576 -14.959 9.694 1.00 0.00 H new ATOM 0 HZ2 LYS A 51 -3.986 -13.361 9.291 1.00 0.00 H new ATOM 0 HZ3 LYS A 51 -5.206 -14.484 9.656 1.00 0.00 H new ATOM 833 N ARG A 52 -7.523 -12.774 2.799 1.00 0.00 N ATOM 834 CA ARG A 52 -8.509 -11.665 2.632 1.00 0.00 C ATOM 835 C ARG A 52 -9.825 -12.041 3.324 1.00 0.00 C ATOM 836 O ARG A 52 -10.337 -13.123 3.118 1.00 0.00 O ATOM 837 CB ARG A 52 -8.792 -11.427 1.142 1.00 0.00 C ATOM 838 CG ARG A 52 -7.483 -11.401 0.348 1.00 0.00 C ATOM 839 CD ARG A 52 -7.453 -12.581 -0.625 1.00 0.00 C ATOM 840 NE ARG A 52 -8.551 -12.429 -1.623 1.00 0.00 N ATOM 841 CZ ARG A 52 -8.646 -13.247 -2.644 1.00 0.00 C ATOM 842 NH1 ARG A 52 -7.781 -14.215 -2.808 1.00 0.00 N ATOM 843 NH2 ARG A 52 -9.614 -13.094 -3.505 1.00 0.00 N ATOM 0 H ARG A 52 -7.896 -13.712 2.655 1.00 0.00 H new ATOM 0 HA ARG A 52 -8.094 -10.760 3.075 1.00 0.00 H new ATOM 0 HB2 ARG A 52 -9.442 -12.214 0.759 1.00 0.00 H new ATOM 0 HB3 ARG A 52 -9.322 -10.484 1.012 1.00 0.00 H new ATOM 0 HG2 ARG A 52 -7.396 -10.462 -0.199 1.00 0.00 H new ATOM 0 HG3 ARG A 52 -6.632 -11.454 1.027 1.00 0.00 H new ATOM 0 HD2 ARG A 52 -6.489 -12.624 -1.132 1.00 0.00 H new ATOM 0 HD3 ARG A 52 -7.569 -13.518 -0.081 1.00 0.00 H new ATOM 0 HE ARG A 52 -9.235 -11.681 -1.510 1.00 0.00 H new ATOM 0 HH11 ARG A 52 -7.022 -14.340 -2.138 1.00 0.00 H new ATOM 0 HH12 ARG A 52 -7.865 -14.845 -3.606 1.00 0.00 H new ATOM 0 HH21 ARG A 52 -10.292 -12.342 -3.382 1.00 0.00 H new ATOM 0 HH22 ARG A 52 -9.693 -13.727 -4.301 1.00 0.00 H new ATOM 857 N PRO A 53 -10.348 -11.131 4.112 1.00 0.00 N ATOM 858 CA PRO A 53 -9.787 -9.772 4.424 1.00 0.00 C ATOM 859 C PRO A 53 -8.846 -9.866 5.628 1.00 0.00 C ATOM 860 O PRO A 53 -8.697 -10.913 6.228 1.00 0.00 O ATOM 861 CB PRO A 53 -10.990 -8.900 4.770 1.00 0.00 C ATOM 862 CG PRO A 53 -12.143 -9.837 5.083 1.00 0.00 C ATOM 863 CD PRO A 53 -11.642 -11.263 4.858 1.00 0.00 C ATOM 0 HA PRO A 53 -9.219 -9.363 3.588 1.00 0.00 H new ATOM 0 HB2 PRO A 53 -10.770 -8.261 5.625 1.00 0.00 H new ATOM 0 HB3 PRO A 53 -11.242 -8.243 3.938 1.00 0.00 H new ATOM 0 HG2 PRO A 53 -12.477 -9.705 6.112 1.00 0.00 H new ATOM 0 HG3 PRO A 53 -12.997 -9.624 4.440 1.00 0.00 H new ATOM 0 HD2 PRO A 53 -11.495 -11.780 5.806 1.00 0.00 H new ATOM 0 HD3 PRO A 53 -12.365 -11.845 4.286 1.00 0.00 H new ATOM 871 N LEU A 54 -8.218 -8.780 5.995 1.00 0.00 N ATOM 872 CA LEU A 54 -7.301 -8.815 7.170 1.00 0.00 C ATOM 873 C LEU A 54 -8.136 -8.834 8.458 1.00 0.00 C ATOM 874 O LEU A 54 -9.185 -8.224 8.518 1.00 0.00 O ATOM 875 CB LEU A 54 -6.401 -7.579 7.164 1.00 0.00 C ATOM 876 CG LEU A 54 -5.458 -7.638 5.961 1.00 0.00 C ATOM 877 CD1 LEU A 54 -5.223 -6.224 5.427 1.00 0.00 C ATOM 878 CD2 LEU A 54 -4.123 -8.248 6.392 1.00 0.00 C ATOM 0 H LEU A 54 -8.300 -7.874 5.533 1.00 0.00 H new ATOM 0 HA LEU A 54 -6.679 -9.709 7.119 1.00 0.00 H new ATOM 0 HB2 LEU A 54 -7.008 -6.675 7.119 1.00 0.00 H new ATOM 0 HB3 LEU A 54 -5.825 -7.531 8.088 1.00 0.00 H new ATOM 0 HG LEU A 54 -5.904 -8.252 5.179 1.00 0.00 H new ATOM 0 HD11 LEU A 54 -4.551 -6.266 4.570 1.00 0.00 H new ATOM 0 HD12 LEU A 54 -6.174 -5.788 5.122 1.00 0.00 H new ATOM 0 HD13 LEU A 54 -4.776 -5.609 6.209 1.00 0.00 H new ATOM 0 HD21 LEU A 54 -3.449 -8.291 5.536 1.00 0.00 H new ATOM 0 HD22 LEU A 54 -3.677 -7.633 7.174 1.00 0.00 H new ATOM 0 HD23 LEU A 54 -4.290 -9.255 6.774 1.00 0.00 H new ATOM 890 N PRO A 55 -7.648 -9.537 9.452 1.00 0.00 N ATOM 891 CA PRO A 55 -8.300 -9.699 10.800 1.00 0.00 C ATOM 892 C PRO A 55 -8.278 -8.375 11.572 1.00 0.00 C ATOM 893 O PRO A 55 -7.286 -7.672 11.595 1.00 0.00 O ATOM 894 CB PRO A 55 -7.509 -10.759 11.560 1.00 0.00 C ATOM 895 CG PRO A 55 -6.292 -11.112 10.733 1.00 0.00 C ATOM 896 CD PRO A 55 -6.355 -10.310 9.438 1.00 0.00 C ATOM 0 HA PRO A 55 -9.342 -9.997 10.685 1.00 0.00 H new ATOM 0 HB2 PRO A 55 -7.210 -10.383 12.538 1.00 0.00 H new ATOM 0 HB3 PRO A 55 -8.123 -11.643 11.732 1.00 0.00 H new ATOM 0 HG2 PRO A 55 -5.379 -10.880 11.281 1.00 0.00 H new ATOM 0 HG3 PRO A 55 -6.273 -12.181 10.519 1.00 0.00 H new ATOM 0 HD2 PRO A 55 -5.504 -9.633 9.363 1.00 0.00 H new ATOM 0 HD3 PRO A 55 -6.313 -10.972 8.573 1.00 0.00 H new ATOM 904 N GLU A 56 -9.367 -8.044 12.219 1.00 0.00 N ATOM 905 CA GLU A 56 -9.433 -6.780 13.015 1.00 0.00 C ATOM 906 C GLU A 56 -8.928 -5.592 12.188 1.00 0.00 C ATOM 907 O GLU A 56 -8.308 -4.685 12.707 1.00 0.00 O ATOM 908 CB GLU A 56 -8.570 -6.928 14.270 1.00 0.00 C ATOM 909 CG GLU A 56 -9.278 -7.843 15.274 1.00 0.00 C ATOM 910 CD GLU A 56 -9.902 -6.998 16.387 1.00 0.00 C ATOM 911 OE1 GLU A 56 -9.165 -6.560 17.255 1.00 0.00 O ATOM 912 OE2 GLU A 56 -11.106 -6.805 16.353 1.00 0.00 O ATOM 0 H GLU A 56 -10.221 -8.601 12.230 1.00 0.00 H new ATOM 0 HA GLU A 56 -10.470 -6.595 13.294 1.00 0.00 H new ATOM 0 HB2 GLU A 56 -7.597 -7.343 14.008 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -8.390 -5.950 14.717 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -10.049 -8.425 14.770 1.00 0.00 H new ATOM 0 HG3 GLU A 56 -8.568 -8.553 15.697 1.00 0.00 H new ATOM 919 N ARG A 57 -9.190 -5.587 10.908 1.00 0.00 N ATOM 920 CA ARG A 57 -8.727 -4.455 10.057 1.00 0.00 C ATOM 921 C ARG A 57 -9.783 -4.135 8.997 1.00 0.00 C ATOM 922 O ARG A 57 -10.306 -5.016 8.342 1.00 0.00 O ATOM 923 CB ARG A 57 -7.418 -4.841 9.371 1.00 0.00 C ATOM 924 CG ARG A 57 -6.308 -4.938 10.417 1.00 0.00 C ATOM 925 CD ARG A 57 -5.117 -5.696 9.833 1.00 0.00 C ATOM 926 NE ARG A 57 -4.963 -7.003 10.536 1.00 0.00 N ATOM 927 CZ ARG A 57 -4.598 -7.049 11.796 1.00 0.00 C ATOM 928 NH1 ARG A 57 -4.367 -5.949 12.466 1.00 0.00 N ATOM 929 NH2 ARG A 57 -4.467 -8.204 12.388 1.00 0.00 N ATOM 0 H ARG A 57 -9.704 -6.318 10.416 1.00 0.00 H new ATOM 0 HA ARG A 57 -8.569 -3.576 10.682 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -7.532 -5.795 8.856 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -7.158 -4.100 8.616 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -5.999 -3.940 10.728 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -6.676 -5.449 11.306 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -5.266 -5.861 8.766 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -4.208 -5.104 9.941 1.00 0.00 H new ATOM 0 HE ARG A 57 -5.143 -7.871 10.032 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.470 -5.043 12.010 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -4.084 -5.998 13.445 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -4.648 -9.065 11.872 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -4.184 -8.246 13.367 1.00 0.00 H new ATOM 943 N THR A 58 -10.095 -2.878 8.822 1.00 0.00 N ATOM 944 CA THR A 58 -11.111 -2.493 7.801 1.00 0.00 C ATOM 945 C THR A 58 -10.423 -2.343 6.444 1.00 0.00 C ATOM 946 O THR A 58 -9.459 -1.615 6.304 1.00 0.00 O ATOM 947 CB THR A 58 -11.757 -1.163 8.196 1.00 0.00 C ATOM 948 OG1 THR A 58 -12.049 -1.176 9.587 1.00 0.00 O ATOM 949 CG2 THR A 58 -13.049 -0.966 7.402 1.00 0.00 C ATOM 0 H THR A 58 -9.689 -2.101 9.343 1.00 0.00 H new ATOM 0 HA THR A 58 -11.881 -3.262 7.741 1.00 0.00 H new ATOM 0 HB THR A 58 -11.071 -0.345 7.976 1.00 0.00 H new ATOM 0 HG1 THR A 58 -13.012 -1.056 9.720 1.00 0.00 H new ATOM 0 HG21 THR A 58 -13.508 -0.019 7.684 1.00 0.00 H new ATOM 0 HG22 THR A 58 -12.823 -0.957 6.336 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.738 -1.782 7.620 1.00 0.00 H new ATOM 957 N ASN A 59 -10.901 -3.035 5.446 1.00 0.00 N ATOM 958 CA ASN A 59 -10.262 -2.942 4.102 1.00 0.00 C ATOM 959 C ASN A 59 -11.313 -2.588 3.047 1.00 0.00 C ATOM 960 O ASN A 59 -12.455 -2.992 3.135 1.00 0.00 O ATOM 961 CB ASN A 59 -9.618 -4.288 3.762 1.00 0.00 C ATOM 962 CG ASN A 59 -8.750 -4.745 4.940 1.00 0.00 C ATOM 963 OD1 ASN A 59 -7.625 -4.309 5.087 1.00 0.00 O ATOM 964 ND2 ASN A 59 -9.233 -5.605 5.794 1.00 0.00 N ATOM 0 H ASN A 59 -11.705 -3.660 5.503 1.00 0.00 H new ATOM 0 HA ASN A 59 -9.500 -2.162 4.113 1.00 0.00 H new ATOM 0 HB2 ASN A 59 -10.388 -5.030 3.553 1.00 0.00 H new ATOM 0 HB3 ASN A 59 -9.011 -4.197 2.861 1.00 0.00 H new ATOM 0 HD21 ASN A 59 -8.667 -5.911 6.585 1.00 0.00 H new ATOM 0 HD22 ASN A 59 -10.177 -5.971 5.671 1.00 0.00 H new ATOM 971 N VAL A 60 -10.931 -1.830 2.052 1.00 0.00 N ATOM 972 CA VAL A 60 -11.898 -1.441 0.985 1.00 0.00 C ATOM 973 C VAL A 60 -11.311 -1.809 -0.380 1.00 0.00 C ATOM 974 O VAL A 60 -10.146 -1.583 -0.644 1.00 0.00 O ATOM 975 CB VAL A 60 -12.145 0.069 1.046 1.00 0.00 C ATOM 976 CG1 VAL A 60 -13.214 0.459 0.020 1.00 0.00 C ATOM 977 CG2 VAL A 60 -12.620 0.450 2.450 1.00 0.00 C ATOM 0 H VAL A 60 -9.987 -1.463 1.933 1.00 0.00 H new ATOM 0 HA VAL A 60 -12.841 -1.967 1.133 1.00 0.00 H new ATOM 0 HB VAL A 60 -11.219 0.597 0.819 1.00 0.00 H new ATOM 0 HG11 VAL A 60 -13.387 1.534 0.066 1.00 0.00 H new ATOM 0 HG12 VAL A 60 -12.874 0.189 -0.980 1.00 0.00 H new ATOM 0 HG13 VAL A 60 -14.142 -0.068 0.243 1.00 0.00 H new ATOM 0 HG21 VAL A 60 -12.796 1.525 2.495 1.00 0.00 H new ATOM 0 HG22 VAL A 60 -13.545 -0.079 2.677 1.00 0.00 H new ATOM 0 HG23 VAL A 60 -11.857 0.176 3.179 1.00 0.00 H new ATOM 987 N VAL A 61 -12.102 -2.387 -1.243 1.00 0.00 N ATOM 988 CA VAL A 61 -11.579 -2.784 -2.583 1.00 0.00 C ATOM 989 C VAL A 61 -12.028 -1.778 -3.647 1.00 0.00 C ATOM 990 O VAL A 61 -13.079 -1.172 -3.545 1.00 0.00 O ATOM 991 CB VAL A 61 -12.115 -4.171 -2.949 1.00 0.00 C ATOM 992 CG1 VAL A 61 -11.321 -4.728 -4.133 1.00 0.00 C ATOM 993 CG2 VAL A 61 -11.967 -5.113 -1.752 1.00 0.00 C ATOM 0 H VAL A 61 -13.086 -2.601 -1.079 1.00 0.00 H new ATOM 0 HA VAL A 61 -10.490 -2.803 -2.544 1.00 0.00 H new ATOM 0 HB VAL A 61 -13.168 -4.091 -3.219 1.00 0.00 H new ATOM 0 HG11 VAL A 61 -11.702 -5.715 -4.394 1.00 0.00 H new ATOM 0 HG12 VAL A 61 -11.427 -4.060 -4.988 1.00 0.00 H new ATOM 0 HG13 VAL A 61 -10.268 -4.805 -3.861 1.00 0.00 H new ATOM 0 HG21 VAL A 61 -12.349 -6.099 -2.016 1.00 0.00 H new ATOM 0 HG22 VAL A 61 -10.915 -5.193 -1.480 1.00 0.00 H new ATOM 0 HG23 VAL A 61 -12.532 -4.719 -0.907 1.00 0.00 H new ATOM 1003 N LEU A 62 -11.246 -1.620 -4.682 1.00 0.00 N ATOM 1004 CA LEU A 62 -11.623 -0.678 -5.772 1.00 0.00 C ATOM 1005 C LEU A 62 -11.791 -1.470 -7.071 1.00 0.00 C ATOM 1006 O LEU A 62 -10.881 -2.138 -7.522 1.00 0.00 O ATOM 1007 CB LEU A 62 -10.522 0.374 -5.947 1.00 0.00 C ATOM 1008 CG LEU A 62 -11.076 1.757 -5.600 1.00 0.00 C ATOM 1009 CD1 LEU A 62 -11.319 1.844 -4.092 1.00 0.00 C ATOM 1010 CD2 LEU A 62 -10.069 2.833 -6.021 1.00 0.00 C ATOM 0 H LEU A 62 -10.359 -2.105 -4.818 1.00 0.00 H new ATOM 0 HA LEU A 62 -12.557 -0.175 -5.522 1.00 0.00 H new ATOM 0 HB2 LEU A 62 -9.674 0.139 -5.304 1.00 0.00 H new ATOM 0 HB3 LEU A 62 -10.156 0.365 -6.974 1.00 0.00 H new ATOM 0 HG LEU A 62 -12.016 1.916 -6.129 1.00 0.00 H new ATOM 0 HD11 LEU A 62 -11.714 2.829 -3.843 1.00 0.00 H new ATOM 0 HD12 LEU A 62 -12.037 1.080 -3.794 1.00 0.00 H new ATOM 0 HD13 LEU A 62 -10.380 1.685 -3.562 1.00 0.00 H new ATOM 0 HD21 LEU A 62 -10.464 3.818 -5.773 1.00 0.00 H new ATOM 0 HD22 LEU A 62 -9.128 2.677 -5.494 1.00 0.00 H new ATOM 0 HD23 LEU A 62 -9.898 2.770 -7.096 1.00 0.00 H new ATOM 1022 N THR A 63 -12.948 -1.405 -7.671 1.00 0.00 N ATOM 1023 CA THR A 63 -13.174 -2.161 -8.936 1.00 0.00 C ATOM 1024 C THR A 63 -14.191 -1.418 -9.803 1.00 0.00 C ATOM 1025 O THR A 63 -14.968 -0.618 -9.318 1.00 0.00 O ATOM 1026 CB THR A 63 -13.709 -3.558 -8.604 1.00 0.00 C ATOM 1027 OG1 THR A 63 -13.931 -4.276 -9.810 1.00 0.00 O ATOM 1028 CG2 THR A 63 -15.023 -3.437 -7.831 1.00 0.00 C ATOM 0 H THR A 63 -13.746 -0.862 -7.341 1.00 0.00 H new ATOM 0 HA THR A 63 -12.233 -2.250 -9.479 1.00 0.00 H new ATOM 0 HB THR A 63 -12.980 -4.089 -7.992 1.00 0.00 H new ATOM 0 HG1 THR A 63 -13.246 -4.031 -10.467 1.00 0.00 H new ATOM 0 HG21 THR A 63 -15.400 -4.432 -7.597 1.00 0.00 H new ATOM 0 HG22 THR A 63 -14.851 -2.887 -6.906 1.00 0.00 H new ATOM 0 HG23 THR A 63 -15.755 -2.905 -8.439 1.00 0.00 H new ATOM 1036 N HIS A 64 -14.197 -1.681 -11.082 1.00 0.00 N ATOM 1037 CA HIS A 64 -15.168 -0.996 -11.981 1.00 0.00 C ATOM 1038 C HIS A 64 -16.368 -1.915 -12.242 1.00 0.00 C ATOM 1039 O HIS A 64 -17.190 -1.642 -13.095 1.00 0.00 O ATOM 1040 CB HIS A 64 -14.484 -0.663 -13.309 1.00 0.00 C ATOM 1041 CG HIS A 64 -13.884 0.714 -13.233 1.00 0.00 C ATOM 1042 ND1 HIS A 64 -14.641 1.861 -13.411 1.00 0.00 N ATOM 1043 CD2 HIS A 64 -12.601 1.144 -13.002 1.00 0.00 C ATOM 1044 CE1 HIS A 64 -13.815 2.916 -13.284 1.00 0.00 C ATOM 1045 NE2 HIS A 64 -12.560 2.535 -13.034 1.00 0.00 N ATOM 0 H HIS A 64 -13.571 -2.341 -11.543 1.00 0.00 H new ATOM 0 HA HIS A 64 -15.513 -0.077 -11.507 1.00 0.00 H new ATOM 0 HB2 HIS A 64 -13.708 -1.398 -13.525 1.00 0.00 H new ATOM 0 HB3 HIS A 64 -15.206 -0.712 -14.124 1.00 0.00 H new ATOM 0 HD2 HIS A 64 -11.752 0.501 -12.823 1.00 0.00 H new ATOM 0 HE1 HIS A 64 -14.129 3.945 -13.373 1.00 0.00 H new ATOM 0 HE2 HIS A 64 -11.746 3.134 -12.896 1.00 0.00 H new ATOM 1053 N GLN A 65 -16.476 -3.003 -11.521 1.00 0.00 N ATOM 1054 CA GLN A 65 -17.621 -3.933 -11.738 1.00 0.00 C ATOM 1055 C GLN A 65 -18.822 -3.466 -10.913 1.00 0.00 C ATOM 1056 O GLN A 65 -18.711 -2.587 -10.081 1.00 0.00 O ATOM 1057 CB GLN A 65 -17.220 -5.344 -11.299 1.00 0.00 C ATOM 1058 CG GLN A 65 -16.604 -6.093 -12.481 1.00 0.00 C ATOM 1059 CD GLN A 65 -15.258 -5.462 -12.843 1.00 0.00 C ATOM 1060 OE1 GLN A 65 -15.117 -4.860 -13.888 1.00 0.00 O ATOM 1061 NE2 GLN A 65 -14.254 -5.577 -12.016 1.00 0.00 N ATOM 0 H GLN A 65 -15.820 -3.285 -10.793 1.00 0.00 H new ATOM 0 HA GLN A 65 -17.887 -3.941 -12.795 1.00 0.00 H new ATOM 0 HB2 GLN A 65 -16.506 -5.291 -10.477 1.00 0.00 H new ATOM 0 HB3 GLN A 65 -18.093 -5.882 -10.929 1.00 0.00 H new ATOM 0 HG2 GLN A 65 -16.468 -7.144 -12.227 1.00 0.00 H new ATOM 0 HG3 GLN A 65 -17.276 -6.056 -13.338 1.00 0.00 H new ATOM 0 HE21 GLN A 65 -14.372 -6.083 -11.138 1.00 0.00 H new ATOM 0 HE22 GLN A 65 -13.352 -5.161 -12.248 1.00 0.00 H new ATOM 1070 N GLU A 66 -19.970 -4.048 -11.138 1.00 0.00 N ATOM 1071 CA GLU A 66 -21.180 -3.637 -10.369 1.00 0.00 C ATOM 1072 C GLU A 66 -21.726 -4.825 -9.568 1.00 0.00 C ATOM 1073 O GLU A 66 -22.513 -4.654 -8.657 1.00 0.00 O ATOM 1074 CB GLU A 66 -22.254 -3.144 -11.343 1.00 0.00 C ATOM 1075 CG GLU A 66 -22.987 -1.947 -10.734 1.00 0.00 C ATOM 1076 CD GLU A 66 -23.989 -1.393 -11.748 1.00 0.00 C ATOM 1077 OE1 GLU A 66 -25.017 -2.022 -11.940 1.00 0.00 O ATOM 1078 OE2 GLU A 66 -23.713 -0.349 -12.315 1.00 0.00 O ATOM 0 H GLU A 66 -20.122 -4.790 -11.821 1.00 0.00 H new ATOM 0 HA GLU A 66 -20.910 -2.838 -9.679 1.00 0.00 H new ATOM 0 HB2 GLU A 66 -21.797 -2.860 -12.291 1.00 0.00 H new ATOM 0 HB3 GLU A 66 -22.961 -3.946 -11.557 1.00 0.00 H new ATOM 0 HG2 GLU A 66 -23.504 -2.249 -9.823 1.00 0.00 H new ATOM 0 HG3 GLU A 66 -22.272 -1.174 -10.453 1.00 0.00 H new ATOM 1085 N ASP A 67 -21.325 -6.026 -9.898 1.00 0.00 N ATOM 1086 CA ASP A 67 -21.834 -7.213 -9.151 1.00 0.00 C ATOM 1087 C ASP A 67 -20.721 -7.797 -8.276 1.00 0.00 C ATOM 1088 O ASP A 67 -20.746 -8.960 -7.924 1.00 0.00 O ATOM 1089 CB ASP A 67 -22.307 -8.275 -10.146 1.00 0.00 C ATOM 1090 CG ASP A 67 -23.581 -7.792 -10.841 1.00 0.00 C ATOM 1091 OD1 ASP A 67 -24.652 -8.034 -10.308 1.00 0.00 O ATOM 1092 OD2 ASP A 67 -23.465 -7.190 -11.896 1.00 0.00 O ATOM 0 H ASP A 67 -20.669 -6.235 -10.651 1.00 0.00 H new ATOM 0 HA ASP A 67 -22.665 -6.907 -8.516 1.00 0.00 H new ATOM 0 HB2 ASP A 67 -21.529 -8.469 -10.884 1.00 0.00 H new ATOM 0 HB3 ASP A 67 -22.497 -9.215 -9.628 1.00 0.00 H new ATOM 1097 N TYR A 68 -19.746 -7.003 -7.922 1.00 0.00 N ATOM 1098 CA TYR A 68 -18.635 -7.517 -7.069 1.00 0.00 C ATOM 1099 C TYR A 68 -19.192 -7.981 -5.720 1.00 0.00 C ATOM 1100 O TYR A 68 -19.662 -7.187 -4.929 1.00 0.00 O ATOM 1101 CB TYR A 68 -17.611 -6.403 -6.839 1.00 0.00 C ATOM 1102 CG TYR A 68 -16.251 -7.012 -6.597 1.00 0.00 C ATOM 1103 CD1 TYR A 68 -15.475 -7.442 -7.680 1.00 0.00 C ATOM 1104 CD2 TYR A 68 -15.767 -7.149 -5.290 1.00 0.00 C ATOM 1105 CE1 TYR A 68 -14.214 -8.009 -7.456 1.00 0.00 C ATOM 1106 CE2 TYR A 68 -14.506 -7.715 -5.067 1.00 0.00 C ATOM 1107 CZ TYR A 68 -13.730 -8.145 -6.150 1.00 0.00 C ATOM 1108 OH TYR A 68 -12.487 -8.703 -5.930 1.00 0.00 O ATOM 0 H TYR A 68 -19.671 -6.021 -8.187 1.00 0.00 H new ATOM 0 HA TYR A 68 -18.155 -8.357 -7.571 1.00 0.00 H new ATOM 0 HB2 TYR A 68 -17.576 -5.742 -7.705 1.00 0.00 H new ATOM 0 HB3 TYR A 68 -17.906 -5.794 -5.984 1.00 0.00 H new ATOM 0 HD1 TYR A 68 -15.849 -7.337 -8.688 1.00 0.00 H new ATOM 0 HD2 TYR A 68 -16.366 -6.818 -4.455 1.00 0.00 H new ATOM 0 HE1 TYR A 68 -13.615 -8.341 -8.291 1.00 0.00 H new ATOM 0 HE2 TYR A 68 -14.132 -7.820 -4.059 1.00 0.00 H new ATOM 0 HH TYR A 68 -12.102 -8.991 -6.784 1.00 0.00 H new ATOM 1118 N GLN A 69 -19.122 -9.257 -5.440 1.00 0.00 N ATOM 1119 CA GLN A 69 -19.629 -9.765 -4.132 1.00 0.00 C ATOM 1120 C GLN A 69 -18.440 -10.017 -3.203 1.00 0.00 C ATOM 1121 O GLN A 69 -17.674 -10.940 -3.403 1.00 0.00 O ATOM 1122 CB GLN A 69 -20.394 -11.073 -4.347 1.00 0.00 C ATOM 1123 CG GLN A 69 -21.517 -10.849 -5.361 1.00 0.00 C ATOM 1124 CD GLN A 69 -22.688 -10.139 -4.679 1.00 0.00 C ATOM 1125 OE1 GLN A 69 -23.205 -10.611 -3.685 1.00 0.00 O ATOM 1126 NE2 GLN A 69 -23.133 -9.017 -5.175 1.00 0.00 N ATOM 0 H GLN A 69 -18.736 -9.968 -6.061 1.00 0.00 H new ATOM 0 HA GLN A 69 -20.298 -9.029 -3.687 1.00 0.00 H new ATOM 0 HB2 GLN A 69 -19.716 -11.848 -4.705 1.00 0.00 H new ATOM 0 HB3 GLN A 69 -20.808 -11.424 -3.402 1.00 0.00 H new ATOM 0 HG2 GLN A 69 -21.153 -10.251 -6.197 1.00 0.00 H new ATOM 0 HG3 GLN A 69 -21.846 -11.804 -5.771 1.00 0.00 H new ATOM 0 HE21 GLN A 69 -22.700 -8.621 -6.009 1.00 0.00 H new ATOM 0 HE22 GLN A 69 -23.914 -8.536 -4.729 1.00 0.00 H new ATOM 1135 N ALA A 70 -18.274 -9.205 -2.194 1.00 0.00 N ATOM 1136 CA ALA A 70 -17.124 -9.407 -1.266 1.00 0.00 C ATOM 1137 C ALA A 70 -17.546 -9.136 0.181 1.00 0.00 C ATOM 1138 O ALA A 70 -17.403 -8.037 0.680 1.00 0.00 O ATOM 1139 CB ALA A 70 -15.991 -8.453 -1.648 1.00 0.00 C ATOM 0 H ALA A 70 -18.881 -8.415 -1.973 1.00 0.00 H new ATOM 0 HA ALA A 70 -16.786 -10.440 -1.346 1.00 0.00 H new ATOM 0 HB1 ALA A 70 -15.149 -8.599 -0.971 1.00 0.00 H new ATOM 0 HB2 ALA A 70 -15.674 -8.656 -2.671 1.00 0.00 H new ATOM 0 HB3 ALA A 70 -16.342 -7.424 -1.575 1.00 0.00 H new ATOM 1145 N GLN A 71 -18.043 -10.133 0.867 1.00 0.00 N ATOM 1146 CA GLN A 71 -18.442 -9.928 2.289 1.00 0.00 C ATOM 1147 C GLN A 71 -17.168 -9.812 3.127 1.00 0.00 C ATOM 1148 O GLN A 71 -16.115 -10.263 2.719 1.00 0.00 O ATOM 1149 CB GLN A 71 -19.273 -11.121 2.769 1.00 0.00 C ATOM 1150 CG GLN A 71 -20.605 -11.151 2.016 1.00 0.00 C ATOM 1151 CD GLN A 71 -21.701 -11.693 2.935 1.00 0.00 C ATOM 1152 OE1 GLN A 71 -22.140 -11.014 3.842 1.00 0.00 O ATOM 1153 NE2 GLN A 71 -22.166 -12.897 2.738 1.00 0.00 N ATOM 0 H GLN A 71 -18.189 -11.075 0.505 1.00 0.00 H new ATOM 0 HA GLN A 71 -19.042 -9.024 2.388 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -18.727 -12.049 2.601 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -19.451 -11.046 3.842 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -20.865 -10.149 1.675 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -20.518 -11.777 1.128 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -21.798 -13.468 1.977 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -22.897 -13.267 3.345 1.00 0.00 H new ATOM 1162 N GLY A 72 -17.235 -9.208 4.284 1.00 0.00 N ATOM 1163 CA GLY A 72 -16.004 -9.069 5.119 1.00 0.00 C ATOM 1164 C GLY A 72 -15.252 -7.800 4.703 1.00 0.00 C ATOM 1165 O GLY A 72 -14.777 -7.047 5.530 1.00 0.00 O ATOM 0 H GLY A 72 -18.083 -8.807 4.686 1.00 0.00 H new ATOM 0 HA2 GLY A 72 -16.270 -9.018 6.175 1.00 0.00 H new ATOM 0 HA3 GLY A 72 -15.364 -9.943 4.993 1.00 0.00 H new ATOM 1169 N ALA A 73 -15.148 -7.559 3.423 1.00 0.00 N ATOM 1170 CA ALA A 73 -14.440 -6.346 2.925 1.00 0.00 C ATOM 1171 C ALA A 73 -15.485 -5.313 2.500 1.00 0.00 C ATOM 1172 O ALA A 73 -16.673 -5.552 2.599 1.00 0.00 O ATOM 1173 CB ALA A 73 -13.563 -6.719 1.727 1.00 0.00 C ATOM 0 H ALA A 73 -15.529 -8.160 2.692 1.00 0.00 H new ATOM 0 HA ALA A 73 -13.807 -5.933 3.710 1.00 0.00 H new ATOM 0 HB1 ALA A 73 -13.046 -5.831 1.364 1.00 0.00 H new ATOM 0 HB2 ALA A 73 -12.830 -7.466 2.031 1.00 0.00 H new ATOM 0 HB3 ALA A 73 -14.187 -7.126 0.932 1.00 0.00 H new ATOM 1179 N VAL A 74 -15.063 -4.181 2.003 1.00 0.00 N ATOM 1180 CA VAL A 74 -16.041 -3.153 1.544 1.00 0.00 C ATOM 1181 C VAL A 74 -15.880 -3.007 0.030 1.00 0.00 C ATOM 1182 O VAL A 74 -14.773 -2.981 -0.473 1.00 0.00 O ATOM 1183 CB VAL A 74 -15.735 -1.818 2.228 1.00 0.00 C ATOM 1184 CG1 VAL A 74 -16.815 -0.795 1.870 1.00 0.00 C ATOM 1185 CG2 VAL A 74 -15.706 -2.021 3.744 1.00 0.00 C ATOM 0 H VAL A 74 -14.082 -3.924 1.895 1.00 0.00 H new ATOM 0 HA VAL A 74 -17.060 -3.448 1.794 1.00 0.00 H new ATOM 0 HB VAL A 74 -14.766 -1.451 1.889 1.00 0.00 H new ATOM 0 HG11 VAL A 74 -16.594 0.154 2.359 1.00 0.00 H new ATOM 0 HG12 VAL A 74 -16.836 -0.651 0.790 1.00 0.00 H new ATOM 0 HG13 VAL A 74 -17.786 -1.158 2.206 1.00 0.00 H new ATOM 0 HG21 VAL A 74 -15.488 -1.072 4.234 1.00 0.00 H new ATOM 0 HG22 VAL A 74 -16.675 -2.389 4.080 1.00 0.00 H new ATOM 0 HG23 VAL A 74 -14.934 -2.747 3.999 1.00 0.00 H new ATOM 1195 N VAL A 75 -16.954 -2.928 -0.710 1.00 0.00 N ATOM 1196 CA VAL A 75 -16.820 -2.806 -2.192 1.00 0.00 C ATOM 1197 C VAL A 75 -17.194 -1.392 -2.643 1.00 0.00 C ATOM 1198 O VAL A 75 -18.256 -0.890 -2.330 1.00 0.00 O ATOM 1199 CB VAL A 75 -17.758 -3.812 -2.867 1.00 0.00 C ATOM 1200 CG1 VAL A 75 -17.554 -3.771 -4.383 1.00 0.00 C ATOM 1201 CG2 VAL A 75 -17.456 -5.222 -2.356 1.00 0.00 C ATOM 0 H VAL A 75 -17.911 -2.942 -0.357 1.00 0.00 H new ATOM 0 HA VAL A 75 -15.787 -3.009 -2.473 1.00 0.00 H new ATOM 0 HB VAL A 75 -18.790 -3.551 -2.631 1.00 0.00 H new ATOM 0 HG11 VAL A 75 -18.223 -4.488 -4.860 1.00 0.00 H new ATOM 0 HG12 VAL A 75 -17.773 -2.769 -4.753 1.00 0.00 H new ATOM 0 HG13 VAL A 75 -16.521 -4.027 -4.618 1.00 0.00 H new ATOM 0 HG21 VAL A 75 -18.125 -5.935 -2.838 1.00 0.00 H new ATOM 0 HG22 VAL A 75 -16.423 -5.480 -2.588 1.00 0.00 H new ATOM 0 HG23 VAL A 75 -17.605 -5.258 -1.277 1.00 0.00 H new ATOM 1211 N VAL A 76 -16.334 -0.756 -3.394 1.00 0.00 N ATOM 1212 CA VAL A 76 -16.640 0.615 -3.890 1.00 0.00 C ATOM 1213 C VAL A 76 -16.175 0.723 -5.344 1.00 0.00 C ATOM 1214 O VAL A 76 -15.327 -0.029 -5.786 1.00 0.00 O ATOM 1215 CB VAL A 76 -15.915 1.656 -3.031 1.00 0.00 C ATOM 1216 CG1 VAL A 76 -16.441 1.588 -1.595 1.00 0.00 C ATOM 1217 CG2 VAL A 76 -14.411 1.373 -3.036 1.00 0.00 C ATOM 0 H VAL A 76 -15.431 -1.129 -3.685 1.00 0.00 H new ATOM 0 HA VAL A 76 -17.712 0.801 -3.828 1.00 0.00 H new ATOM 0 HB VAL A 76 -16.096 2.650 -3.440 1.00 0.00 H new ATOM 0 HG11 VAL A 76 -15.926 2.328 -0.983 1.00 0.00 H new ATOM 0 HG12 VAL A 76 -17.511 1.794 -1.589 1.00 0.00 H new ATOM 0 HG13 VAL A 76 -16.261 0.593 -1.188 1.00 0.00 H new ATOM 0 HG21 VAL A 76 -13.899 2.116 -2.424 1.00 0.00 H new ATOM 0 HG22 VAL A 76 -14.227 0.378 -2.630 1.00 0.00 H new ATOM 0 HG23 VAL A 76 -14.035 1.423 -4.058 1.00 0.00 H new ATOM 1227 N HIS A 77 -16.731 1.631 -6.099 1.00 0.00 N ATOM 1228 CA HIS A 77 -16.322 1.759 -7.529 1.00 0.00 C ATOM 1229 C HIS A 77 -16.133 3.234 -7.880 1.00 0.00 C ATOM 1230 O HIS A 77 -16.361 3.646 -9.000 1.00 0.00 O ATOM 1231 CB HIS A 77 -17.410 1.165 -8.430 1.00 0.00 C ATOM 1232 CG HIS A 77 -17.873 -0.152 -7.869 1.00 0.00 C ATOM 1233 ND1 HIS A 77 -16.999 -1.198 -7.625 1.00 0.00 N ATOM 1234 CD2 HIS A 77 -19.114 -0.605 -7.496 1.00 0.00 C ATOM 1235 CE1 HIS A 77 -17.718 -2.220 -7.126 1.00 0.00 C ATOM 1236 NE2 HIS A 77 -19.014 -1.912 -7.027 1.00 0.00 N ATOM 0 H HIS A 77 -17.448 2.288 -5.790 1.00 0.00 H new ATOM 0 HA HIS A 77 -15.385 1.223 -7.682 1.00 0.00 H new ATOM 0 HB2 HIS A 77 -18.251 1.855 -8.504 1.00 0.00 H new ATOM 0 HB3 HIS A 77 -17.023 1.025 -9.439 1.00 0.00 H new ATOM 0 HD1 HIS A 77 -15.993 -1.194 -7.793 1.00 0.00 H new ATOM 0 HD2 HIS A 77 -20.029 -0.034 -7.557 1.00 0.00 H new ATOM 0 HE1 HIS A 77 -17.298 -3.173 -6.840 1.00 0.00 H new ATOM 1244 N ASP A 78 -15.716 4.033 -6.936 1.00 0.00 N ATOM 1245 CA ASP A 78 -15.512 5.479 -7.227 1.00 0.00 C ATOM 1246 C ASP A 78 -14.688 6.124 -6.112 1.00 0.00 C ATOM 1247 O ASP A 78 -15.167 6.324 -5.015 1.00 0.00 O ATOM 1248 CB ASP A 78 -16.875 6.174 -7.326 1.00 0.00 C ATOM 1249 CG ASP A 78 -17.067 6.731 -8.738 1.00 0.00 C ATOM 1250 OD1 ASP A 78 -16.499 7.772 -9.025 1.00 0.00 O ATOM 1251 OD2 ASP A 78 -17.778 6.106 -9.508 1.00 0.00 O ATOM 0 H ASP A 78 -15.509 3.748 -5.979 1.00 0.00 H new ATOM 0 HA ASP A 78 -14.977 5.584 -8.171 1.00 0.00 H new ATOM 0 HB2 ASP A 78 -17.672 5.468 -7.091 1.00 0.00 H new ATOM 0 HB3 ASP A 78 -16.937 6.980 -6.595 1.00 0.00 H new ATOM 1256 N VAL A 79 -13.443 6.428 -6.381 1.00 0.00 N ATOM 1257 CA VAL A 79 -12.562 7.054 -5.343 1.00 0.00 C ATOM 1258 C VAL A 79 -13.344 8.109 -4.545 1.00 0.00 C ATOM 1259 O VAL A 79 -13.103 8.314 -3.371 1.00 0.00 O ATOM 1260 CB VAL A 79 -11.371 7.723 -6.040 1.00 0.00 C ATOM 1261 CG1 VAL A 79 -10.593 8.579 -5.037 1.00 0.00 C ATOM 1262 CG2 VAL A 79 -10.447 6.645 -6.612 1.00 0.00 C ATOM 0 H VAL A 79 -12.994 6.268 -7.283 1.00 0.00 H new ATOM 0 HA VAL A 79 -12.212 6.283 -4.656 1.00 0.00 H new ATOM 0 HB VAL A 79 -11.738 8.359 -6.845 1.00 0.00 H new ATOM 0 HG11 VAL A 79 -9.749 9.051 -5.539 1.00 0.00 H new ATOM 0 HG12 VAL A 79 -11.249 9.348 -4.629 1.00 0.00 H new ATOM 0 HG13 VAL A 79 -10.227 7.948 -4.227 1.00 0.00 H new ATOM 0 HG21 VAL A 79 -9.599 7.118 -7.108 1.00 0.00 H new ATOM 0 HG22 VAL A 79 -10.086 6.009 -5.804 1.00 0.00 H new ATOM 0 HG23 VAL A 79 -10.997 6.039 -7.332 1.00 0.00 H new ATOM 1272 N ALA A 80 -14.277 8.775 -5.172 1.00 0.00 N ATOM 1273 CA ALA A 80 -15.072 9.812 -4.450 1.00 0.00 C ATOM 1274 C ALA A 80 -15.775 9.176 -3.246 1.00 0.00 C ATOM 1275 O ALA A 80 -15.823 9.744 -2.172 1.00 0.00 O ATOM 1276 CB ALA A 80 -16.116 10.404 -5.399 1.00 0.00 C ATOM 0 H ALA A 80 -14.523 8.646 -6.153 1.00 0.00 H new ATOM 0 HA ALA A 80 -14.407 10.602 -4.102 1.00 0.00 H new ATOM 0 HB1 ALA A 80 -16.697 11.161 -4.873 1.00 0.00 H new ATOM 0 HB2 ALA A 80 -15.615 10.859 -6.253 1.00 0.00 H new ATOM 0 HB3 ALA A 80 -16.781 9.614 -5.748 1.00 0.00 H new ATOM 1282 N ALA A 81 -16.315 7.999 -3.418 1.00 0.00 N ATOM 1283 CA ALA A 81 -17.011 7.318 -2.291 1.00 0.00 C ATOM 1284 C ALA A 81 -15.994 6.947 -1.210 1.00 0.00 C ATOM 1285 O ALA A 81 -16.209 7.187 -0.038 1.00 0.00 O ATOM 1286 CB ALA A 81 -17.693 6.049 -2.805 1.00 0.00 C ATOM 0 H ALA A 81 -16.303 7.479 -4.295 1.00 0.00 H new ATOM 0 HA ALA A 81 -17.760 7.989 -1.870 1.00 0.00 H new ATOM 0 HB1 ALA A 81 -18.202 5.550 -1.980 1.00 0.00 H new ATOM 0 HB2 ALA A 81 -18.419 6.312 -3.574 1.00 0.00 H new ATOM 0 HB3 ALA A 81 -16.944 5.379 -3.227 1.00 0.00 H new ATOM 1292 N VAL A 82 -14.890 6.354 -1.592 1.00 0.00 N ATOM 1293 CA VAL A 82 -13.860 5.959 -0.581 1.00 0.00 C ATOM 1294 C VAL A 82 -13.522 7.156 0.310 1.00 0.00 C ATOM 1295 O VAL A 82 -13.352 7.024 1.507 1.00 0.00 O ATOM 1296 CB VAL A 82 -12.586 5.494 -1.293 1.00 0.00 C ATOM 1297 CG1 VAL A 82 -11.643 4.845 -0.278 1.00 0.00 C ATOM 1298 CG2 VAL A 82 -12.941 4.477 -2.383 1.00 0.00 C ATOM 0 H VAL A 82 -14.657 6.126 -2.559 1.00 0.00 H new ATOM 0 HA VAL A 82 -14.258 5.148 0.029 1.00 0.00 H new ATOM 0 HB VAL A 82 -12.096 6.354 -1.750 1.00 0.00 H new ATOM 0 HG11 VAL A 82 -10.736 4.514 -0.784 1.00 0.00 H new ATOM 0 HG12 VAL A 82 -11.384 5.570 0.493 1.00 0.00 H new ATOM 0 HG13 VAL A 82 -12.136 3.988 0.181 1.00 0.00 H new ATOM 0 HG21 VAL A 82 -12.031 4.150 -2.886 1.00 0.00 H new ATOM 0 HG22 VAL A 82 -13.435 3.617 -1.931 1.00 0.00 H new ATOM 0 HG23 VAL A 82 -13.610 4.940 -3.108 1.00 0.00 H new ATOM 1308 N PHE A 83 -13.416 8.322 -0.267 1.00 0.00 N ATOM 1309 CA PHE A 83 -13.084 9.531 0.538 1.00 0.00 C ATOM 1310 C PHE A 83 -14.184 9.777 1.574 1.00 0.00 C ATOM 1311 O PHE A 83 -13.916 10.146 2.701 1.00 0.00 O ATOM 1312 CB PHE A 83 -12.978 10.743 -0.390 1.00 0.00 C ATOM 1313 CG PHE A 83 -11.596 10.797 -0.998 1.00 0.00 C ATOM 1314 CD1 PHE A 83 -10.471 10.871 -0.170 1.00 0.00 C ATOM 1315 CD2 PHE A 83 -11.440 10.775 -2.390 1.00 0.00 C ATOM 1316 CE1 PHE A 83 -9.191 10.924 -0.731 1.00 0.00 C ATOM 1317 CE2 PHE A 83 -10.158 10.828 -2.951 1.00 0.00 C ATOM 1318 CZ PHE A 83 -9.034 10.903 -2.121 1.00 0.00 C ATOM 0 H PHE A 83 -13.546 8.489 -1.265 1.00 0.00 H new ATOM 0 HA PHE A 83 -12.134 9.377 1.050 1.00 0.00 H new ATOM 0 HB2 PHE A 83 -13.730 10.678 -1.176 1.00 0.00 H new ATOM 0 HB3 PHE A 83 -13.177 11.659 0.167 1.00 0.00 H new ATOM 0 HD1 PHE A 83 -10.591 10.887 0.903 1.00 0.00 H new ATOM 0 HD2 PHE A 83 -12.308 10.717 -3.030 1.00 0.00 H new ATOM 0 HE1 PHE A 83 -8.323 10.981 -0.091 1.00 0.00 H new ATOM 0 HE2 PHE A 83 -10.037 10.811 -4.024 1.00 0.00 H new ATOM 0 HZ PHE A 83 -8.045 10.945 -2.553 1.00 0.00 H new ATOM 1328 N ALA A 84 -15.420 9.580 1.200 1.00 0.00 N ATOM 1329 CA ALA A 84 -16.543 9.808 2.158 1.00 0.00 C ATOM 1330 C ALA A 84 -16.348 8.952 3.415 1.00 0.00 C ATOM 1331 O ALA A 84 -16.224 9.466 4.510 1.00 0.00 O ATOM 1332 CB ALA A 84 -17.869 9.436 1.488 1.00 0.00 C ATOM 0 H ALA A 84 -15.702 9.270 0.270 1.00 0.00 H new ATOM 0 HA ALA A 84 -16.558 10.860 2.444 1.00 0.00 H new ATOM 0 HB1 ALA A 84 -18.689 9.602 2.187 1.00 0.00 H new ATOM 0 HB2 ALA A 84 -18.016 10.055 0.603 1.00 0.00 H new ATOM 0 HB3 ALA A 84 -17.848 8.386 1.197 1.00 0.00 H new ATOM 1338 N TYR A 85 -16.348 7.650 3.268 1.00 0.00 N ATOM 1339 CA TYR A 85 -16.188 6.743 4.450 1.00 0.00 C ATOM 1340 C TYR A 85 -15.069 7.240 5.374 1.00 0.00 C ATOM 1341 O TYR A 85 -15.285 7.476 6.547 1.00 0.00 O ATOM 1342 CB TYR A 85 -15.848 5.334 3.963 1.00 0.00 C ATOM 1343 CG TYR A 85 -16.233 4.328 5.021 1.00 0.00 C ATOM 1344 CD1 TYR A 85 -17.583 4.104 5.318 1.00 0.00 C ATOM 1345 CD2 TYR A 85 -15.239 3.617 5.705 1.00 0.00 C ATOM 1346 CE1 TYR A 85 -17.938 3.169 6.298 1.00 0.00 C ATOM 1347 CE2 TYR A 85 -15.595 2.682 6.685 1.00 0.00 C ATOM 1348 CZ TYR A 85 -16.944 2.458 6.981 1.00 0.00 C ATOM 1349 OH TYR A 85 -17.295 1.537 7.947 1.00 0.00 O ATOM 0 H TYR A 85 -16.453 7.172 2.373 1.00 0.00 H new ATOM 0 HA TYR A 85 -17.124 6.734 5.009 1.00 0.00 H new ATOM 0 HB2 TYR A 85 -16.377 5.121 3.034 1.00 0.00 H new ATOM 0 HB3 TYR A 85 -14.782 5.260 3.747 1.00 0.00 H new ATOM 0 HD1 TYR A 85 -18.350 4.652 4.791 1.00 0.00 H new ATOM 0 HD2 TYR A 85 -14.198 3.790 5.477 1.00 0.00 H new ATOM 0 HE1 TYR A 85 -18.979 2.996 6.527 1.00 0.00 H new ATOM 0 HE2 TYR A 85 -14.828 2.134 7.212 1.00 0.00 H new ATOM 0 HH TYR A 85 -17.508 2.004 8.782 1.00 0.00 H new ATOM 1359 N ALA A 86 -13.877 7.394 4.859 1.00 0.00 N ATOM 1360 CA ALA A 86 -12.743 7.868 5.710 1.00 0.00 C ATOM 1361 C ALA A 86 -13.150 9.139 6.466 1.00 0.00 C ATOM 1362 O ALA A 86 -12.931 9.262 7.655 1.00 0.00 O ATOM 1363 CB ALA A 86 -11.535 8.168 4.819 1.00 0.00 C ATOM 0 H ALA A 86 -13.639 7.212 3.884 1.00 0.00 H new ATOM 0 HA ALA A 86 -12.486 7.093 6.432 1.00 0.00 H new ATOM 0 HB1 ALA A 86 -10.705 8.514 5.435 1.00 0.00 H new ATOM 0 HB2 ALA A 86 -11.240 7.262 4.289 1.00 0.00 H new ATOM 0 HB3 ALA A 86 -11.798 8.941 4.097 1.00 0.00 H new ATOM 1369 N LYS A 87 -13.750 10.075 5.784 1.00 0.00 N ATOM 1370 CA LYS A 87 -14.185 11.333 6.457 1.00 0.00 C ATOM 1371 C LYS A 87 -15.295 11.025 7.468 1.00 0.00 C ATOM 1372 O LYS A 87 -15.575 11.810 8.353 1.00 0.00 O ATOM 1373 CB LYS A 87 -14.714 12.310 5.403 1.00 0.00 C ATOM 1374 CG LYS A 87 -14.278 13.734 5.755 1.00 0.00 C ATOM 1375 CD LYS A 87 -15.115 14.737 4.956 1.00 0.00 C ATOM 1376 CE LYS A 87 -14.234 15.911 4.524 1.00 0.00 C ATOM 1377 NZ LYS A 87 -13.685 15.646 3.164 1.00 0.00 N ATOM 0 H LYS A 87 -13.959 10.023 4.787 1.00 0.00 H new ATOM 0 HA LYS A 87 -13.337 11.776 6.980 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -14.336 12.037 4.418 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -15.801 12.254 5.354 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -14.402 13.910 6.823 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -13.220 13.867 5.531 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -15.546 14.251 4.081 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -15.946 15.097 5.562 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -14.815 16.833 4.520 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -13.420 16.050 5.236 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -13.086 16.444 2.870 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -13.117 14.775 3.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -14.468 15.534 2.489 1.00 0.00 H new ATOM 1391 N GLN A 88 -15.948 9.900 7.327 1.00 0.00 N ATOM 1392 CA GLN A 88 -17.060 9.554 8.260 1.00 0.00 C ATOM 1393 C GLN A 88 -16.525 8.834 9.504 1.00 0.00 C ATOM 1394 O GLN A 88 -17.020 9.032 10.597 1.00 0.00 O ATOM 1395 CB GLN A 88 -18.057 8.643 7.537 1.00 0.00 C ATOM 1396 CG GLN A 88 -19.489 9.107 7.825 1.00 0.00 C ATOM 1397 CD GLN A 88 -20.208 9.405 6.507 1.00 0.00 C ATOM 1398 OE1 GLN A 88 -21.224 8.810 6.208 1.00 0.00 O ATOM 1399 NE2 GLN A 88 -19.720 10.307 5.701 1.00 0.00 N ATOM 0 H GLN A 88 -15.758 9.206 6.604 1.00 0.00 H new ATOM 0 HA GLN A 88 -17.550 10.475 8.576 1.00 0.00 H new ATOM 0 HB2 GLN A 88 -17.868 8.662 6.464 1.00 0.00 H new ATOM 0 HB3 GLN A 88 -17.926 7.612 7.866 1.00 0.00 H new ATOM 0 HG2 GLN A 88 -20.027 8.337 8.378 1.00 0.00 H new ATOM 0 HG3 GLN A 88 -19.474 9.998 8.452 1.00 0.00 H new ATOM 0 HE21 GLN A 88 -18.867 10.807 5.952 1.00 0.00 H new ATOM 0 HE22 GLN A 88 -20.191 10.512 4.820 1.00 0.00 H new ATOM 1408 N HIS A 89 -15.541 7.986 9.356 1.00 0.00 N ATOM 1409 CA HIS A 89 -15.011 7.247 10.541 1.00 0.00 C ATOM 1410 C HIS A 89 -13.885 8.049 11.210 1.00 0.00 C ATOM 1411 O HIS A 89 -12.876 8.324 10.591 1.00 0.00 O ATOM 1412 CB HIS A 89 -14.460 5.894 10.084 1.00 0.00 C ATOM 1413 CG HIS A 89 -15.547 4.857 10.162 1.00 0.00 C ATOM 1414 ND1 HIS A 89 -15.542 3.851 11.115 1.00 0.00 N ATOM 1415 CD2 HIS A 89 -16.681 4.658 9.414 1.00 0.00 C ATOM 1416 CE1 HIS A 89 -16.640 3.099 10.918 1.00 0.00 C ATOM 1417 NE2 HIS A 89 -17.370 3.548 9.892 1.00 0.00 N ATOM 0 H HIS A 89 -15.083 7.773 8.470 1.00 0.00 H new ATOM 0 HA HIS A 89 -15.818 7.102 11.259 1.00 0.00 H new ATOM 0 HB2 HIS A 89 -14.086 5.968 9.063 1.00 0.00 H new ATOM 0 HB3 HIS A 89 -13.618 5.602 10.712 1.00 0.00 H new ATOM 0 HD1 HIS A 89 -14.834 3.707 11.835 1.00 0.00 H new ATOM 0 HD2 HIS A 89 -16.991 5.271 8.580 1.00 0.00 H new ATOM 0 HE1 HIS A 89 -16.900 2.238 11.516 1.00 0.00 H new ATOM 1425 N PRO A 90 -14.084 8.392 12.465 1.00 0.00 N ATOM 1426 CA PRO A 90 -13.122 9.162 13.327 1.00 0.00 C ATOM 1427 C PRO A 90 -12.094 8.213 13.961 1.00 0.00 C ATOM 1428 O PRO A 90 -11.323 8.605 14.815 1.00 0.00 O ATOM 1429 CB PRO A 90 -13.964 9.819 14.414 1.00 0.00 C ATOM 1430 CG PRO A 90 -15.301 9.105 14.441 1.00 0.00 C ATOM 1431 CD PRO A 90 -15.303 8.095 13.295 1.00 0.00 C ATOM 0 HA PRO A 90 -12.570 9.899 12.744 1.00 0.00 H new ATOM 0 HB2 PRO A 90 -13.469 9.744 15.382 1.00 0.00 H new ATOM 0 HB3 PRO A 90 -14.099 10.881 14.207 1.00 0.00 H new ATOM 0 HG2 PRO A 90 -15.448 8.602 15.397 1.00 0.00 H new ATOM 0 HG3 PRO A 90 -16.119 9.817 14.327 1.00 0.00 H new ATOM 0 HD2 PRO A 90 -15.274 7.074 13.677 1.00 0.00 H new ATOM 0 HD3 PRO A 90 -16.211 8.186 12.698 1.00 0.00 H new ATOM 1439 N ASP A 91 -12.073 6.972 13.548 1.00 0.00 N ATOM 1440 CA ASP A 91 -11.092 6.002 14.120 1.00 0.00 C ATOM 1441 C ASP A 91 -10.507 5.142 12.994 1.00 0.00 C ATOM 1442 O ASP A 91 -9.815 4.172 13.235 1.00 0.00 O ATOM 1443 CB ASP A 91 -11.798 5.101 15.136 1.00 0.00 C ATOM 1444 CG ASP A 91 -10.826 4.741 16.261 1.00 0.00 C ATOM 1445 OD1 ASP A 91 -10.445 5.637 16.997 1.00 0.00 O ATOM 1446 OD2 ASP A 91 -10.481 3.576 16.369 1.00 0.00 O ATOM 0 H ASP A 91 -12.695 6.588 12.837 1.00 0.00 H new ATOM 0 HA ASP A 91 -10.289 6.548 14.615 1.00 0.00 H new ATOM 0 HB2 ASP A 91 -12.671 5.610 15.544 1.00 0.00 H new ATOM 0 HB3 ASP A 91 -12.157 4.195 14.647 1.00 0.00 H new ATOM 1451 N GLN A 92 -10.778 5.496 11.766 1.00 0.00 N ATOM 1452 CA GLN A 92 -10.246 4.720 10.613 1.00 0.00 C ATOM 1453 C GLN A 92 -9.978 5.698 9.470 1.00 0.00 C ATOM 1454 O GLN A 92 -10.894 6.126 8.797 1.00 0.00 O ATOM 1455 CB GLN A 92 -11.296 3.692 10.169 1.00 0.00 C ATOM 1456 CG GLN A 92 -10.680 2.290 10.139 1.00 0.00 C ATOM 1457 CD GLN A 92 -11.289 1.439 11.257 1.00 0.00 C ATOM 1458 OE1 GLN A 92 -10.638 1.150 12.241 1.00 0.00 O ATOM 1459 NE2 GLN A 92 -12.521 1.024 11.146 1.00 0.00 N ATOM 0 H GLN A 92 -11.352 6.300 11.512 1.00 0.00 H new ATOM 0 HA GLN A 92 -9.329 4.200 10.891 1.00 0.00 H new ATOM 0 HB2 GLN A 92 -12.145 3.710 10.852 1.00 0.00 H new ATOM 0 HB3 GLN A 92 -11.676 3.952 9.181 1.00 0.00 H new ATOM 0 HG2 GLN A 92 -10.862 1.822 9.171 1.00 0.00 H new ATOM 0 HG3 GLN A 92 -9.599 2.354 10.264 1.00 0.00 H new ATOM 0 HE21 GLN A 92 -13.068 1.266 10.320 1.00 0.00 H new ATOM 0 HE22 GLN A 92 -12.937 0.457 11.885 1.00 0.00 H new ATOM 1468 N GLU A 93 -8.745 6.063 9.233 1.00 0.00 N ATOM 1469 CA GLU A 93 -8.461 7.021 8.129 1.00 0.00 C ATOM 1470 C GLU A 93 -8.389 6.267 6.801 1.00 0.00 C ATOM 1471 O GLU A 93 -8.792 5.125 6.702 1.00 0.00 O ATOM 1472 CB GLU A 93 -7.123 7.717 8.401 1.00 0.00 C ATOM 1473 CG GLU A 93 -7.340 8.889 9.364 1.00 0.00 C ATOM 1474 CD GLU A 93 -6.877 10.190 8.705 1.00 0.00 C ATOM 1475 OE1 GLU A 93 -7.400 10.515 7.651 1.00 0.00 O ATOM 1476 OE2 GLU A 93 -6.009 10.839 9.264 1.00 0.00 O ATOM 0 H GLU A 93 -7.929 5.741 9.753 1.00 0.00 H new ATOM 0 HA GLU A 93 -9.256 7.765 8.074 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -6.413 7.009 8.828 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -6.692 8.076 7.467 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -8.394 8.961 9.633 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -6.786 8.721 10.288 1.00 0.00 H new ATOM 1483 N LEU A 94 -7.883 6.902 5.779 1.00 0.00 N ATOM 1484 CA LEU A 94 -7.783 6.231 4.455 1.00 0.00 C ATOM 1485 C LEU A 94 -6.343 5.764 4.222 1.00 0.00 C ATOM 1486 O LEU A 94 -5.436 6.563 4.095 1.00 0.00 O ATOM 1487 CB LEU A 94 -8.188 7.220 3.360 1.00 0.00 C ATOM 1488 CG LEU A 94 -8.849 6.466 2.206 1.00 0.00 C ATOM 1489 CD1 LEU A 94 -10.293 6.123 2.580 1.00 0.00 C ATOM 1490 CD2 LEU A 94 -8.840 7.350 0.957 1.00 0.00 C ATOM 0 H LEU A 94 -7.534 7.860 5.806 1.00 0.00 H new ATOM 0 HA LEU A 94 -8.446 5.367 4.431 1.00 0.00 H new ATOM 0 HB2 LEU A 94 -8.876 7.963 3.763 1.00 0.00 H new ATOM 0 HB3 LEU A 94 -7.311 7.759 3.001 1.00 0.00 H new ATOM 0 HG LEU A 94 -8.300 5.546 2.007 1.00 0.00 H new ATOM 0 HD11 LEU A 94 -10.764 5.585 1.757 1.00 0.00 H new ATOM 0 HD12 LEU A 94 -10.299 5.497 3.473 1.00 0.00 H new ATOM 0 HD13 LEU A 94 -10.846 7.042 2.777 1.00 0.00 H new ATOM 0 HD21 LEU A 94 -9.310 6.817 0.131 1.00 0.00 H new ATOM 0 HD22 LEU A 94 -9.392 8.268 1.157 1.00 0.00 H new ATOM 0 HD23 LEU A 94 -7.811 7.595 0.692 1.00 0.00 H new ATOM 1502 N VAL A 95 -6.128 4.476 4.153 1.00 0.00 N ATOM 1503 CA VAL A 95 -4.748 3.959 3.910 1.00 0.00 C ATOM 1504 C VAL A 95 -4.739 3.186 2.590 1.00 0.00 C ATOM 1505 O VAL A 95 -5.525 2.283 2.383 1.00 0.00 O ATOM 1506 CB VAL A 95 -4.317 3.036 5.054 1.00 0.00 C ATOM 1507 CG1 VAL A 95 -2.867 2.596 4.836 1.00 0.00 C ATOM 1508 CG2 VAL A 95 -4.420 3.788 6.382 1.00 0.00 C ATOM 0 H VAL A 95 -6.848 3.760 4.254 1.00 0.00 H new ATOM 0 HA VAL A 95 -4.050 4.794 3.859 1.00 0.00 H new ATOM 0 HB VAL A 95 -4.966 2.161 5.077 1.00 0.00 H new ATOM 0 HG11 VAL A 95 -2.560 1.939 5.650 1.00 0.00 H new ATOM 0 HG12 VAL A 95 -2.787 2.062 3.889 1.00 0.00 H new ATOM 0 HG13 VAL A 95 -2.220 3.473 4.814 1.00 0.00 H new ATOM 0 HG21 VAL A 95 -4.113 3.132 7.196 1.00 0.00 H new ATOM 0 HG22 VAL A 95 -3.770 4.662 6.356 1.00 0.00 H new ATOM 0 HG23 VAL A 95 -5.450 4.106 6.541 1.00 0.00 H new ATOM 1518 N ILE A 96 -3.870 3.551 1.689 1.00 0.00 N ATOM 1519 CA ILE A 96 -3.817 2.860 0.369 1.00 0.00 C ATOM 1520 C ILE A 96 -2.926 1.621 0.459 1.00 0.00 C ATOM 1521 O ILE A 96 -1.947 1.591 1.186 1.00 0.00 O ATOM 1522 CB ILE A 96 -3.249 3.817 -0.680 1.00 0.00 C ATOM 1523 CG1 ILE A 96 -3.959 5.174 -0.576 1.00 0.00 C ATOM 1524 CG2 ILE A 96 -3.452 3.229 -2.080 1.00 0.00 C ATOM 1525 CD1 ILE A 96 -5.416 5.038 -1.024 1.00 0.00 C ATOM 0 H ILE A 96 -3.191 4.302 1.810 1.00 0.00 H new ATOM 0 HA ILE A 96 -4.824 2.554 0.086 1.00 0.00 H new ATOM 0 HB ILE A 96 -2.182 3.956 -0.503 1.00 0.00 H new ATOM 0 HG12 ILE A 96 -3.918 5.537 0.451 1.00 0.00 H new ATOM 0 HG13 ILE A 96 -3.447 5.910 -1.195 1.00 0.00 H new ATOM 0 HG21 ILE A 96 -3.046 3.914 -2.825 1.00 0.00 H new ATOM 0 HG22 ILE A 96 -2.938 2.270 -2.150 1.00 0.00 H new ATOM 0 HG23 ILE A 96 -4.517 3.084 -2.263 1.00 0.00 H new ATOM 0 HD11 ILE A 96 -5.912 6.005 -0.947 1.00 0.00 H new ATOM 0 HD12 ILE A 96 -5.448 4.695 -2.058 1.00 0.00 H new ATOM 0 HD13 ILE A 96 -5.927 4.316 -0.386 1.00 0.00 H new ATOM 1537 N ALA A 97 -3.233 0.616 -0.319 1.00 0.00 N ATOM 1538 CA ALA A 97 -2.401 -0.619 -0.329 1.00 0.00 C ATOM 1539 C ALA A 97 -2.019 -0.954 -1.779 1.00 0.00 C ATOM 1540 O ALA A 97 -1.264 -1.872 -2.036 1.00 0.00 O ATOM 1541 CB ALA A 97 -3.192 -1.778 0.278 1.00 0.00 C ATOM 0 H ALA A 97 -4.032 0.600 -0.953 1.00 0.00 H new ATOM 0 HA ALA A 97 -1.498 -0.459 0.260 1.00 0.00 H new ATOM 0 HB1 ALA A 97 -2.580 -2.680 0.269 1.00 0.00 H new ATOM 0 HB2 ALA A 97 -3.464 -1.534 1.305 1.00 0.00 H new ATOM 0 HB3 ALA A 97 -4.096 -1.947 -0.307 1.00 0.00 H new ATOM 1547 N GLY A 98 -2.501 -0.182 -2.724 1.00 0.00 N ATOM 1548 CA GLY A 98 -2.134 -0.419 -4.152 1.00 0.00 C ATOM 1549 C GLY A 98 -3.204 -1.255 -4.872 1.00 0.00 C ATOM 1550 O GLY A 98 -4.350 -1.290 -4.471 1.00 0.00 O ATOM 0 H GLY A 98 -3.133 0.602 -2.565 1.00 0.00 H new ATOM 0 HA2 GLY A 98 -2.012 0.537 -4.662 1.00 0.00 H new ATOM 0 HA3 GLY A 98 -1.174 -0.932 -4.203 1.00 0.00 H new ATOM 1554 N GLY A 99 -2.848 -1.917 -5.954 1.00 0.00 N ATOM 1555 CA GLY A 99 -1.438 -1.883 -6.457 1.00 0.00 C ATOM 1556 C GLY A 99 -1.078 -0.513 -7.052 1.00 0.00 C ATOM 1557 O GLY A 99 -1.476 0.525 -6.563 1.00 0.00 O ATOM 0 H GLY A 99 -3.485 -2.485 -6.513 1.00 0.00 H new ATOM 0 HA2 GLY A 99 -0.755 -2.115 -5.640 1.00 0.00 H new ATOM 0 HA3 GLY A 99 -1.303 -2.655 -7.215 1.00 0.00 H new ATOM 1561 N ALA A 100 -0.320 -0.517 -8.117 1.00 0.00 N ATOM 1562 CA ALA A 100 0.098 0.766 -8.755 1.00 0.00 C ATOM 1563 C ALA A 100 -1.122 1.533 -9.262 1.00 0.00 C ATOM 1564 O ALA A 100 -1.169 2.746 -9.196 1.00 0.00 O ATOM 1565 CB ALA A 100 1.030 0.466 -9.931 1.00 0.00 C ATOM 0 H ALA A 100 0.029 -1.359 -8.575 1.00 0.00 H new ATOM 0 HA ALA A 100 0.615 1.376 -8.014 1.00 0.00 H new ATOM 0 HB1 ALA A 100 1.337 1.401 -10.399 1.00 0.00 H new ATOM 0 HB2 ALA A 100 1.911 -0.066 -9.571 1.00 0.00 H new ATOM 0 HB3 ALA A 100 0.507 -0.151 -10.662 1.00 0.00 H new ATOM 1571 N GLN A 101 -2.096 0.847 -9.789 1.00 0.00 N ATOM 1572 CA GLN A 101 -3.295 1.554 -10.317 1.00 0.00 C ATOM 1573 C GLN A 101 -3.946 2.378 -9.201 1.00 0.00 C ATOM 1574 O GLN A 101 -4.429 3.473 -9.434 1.00 0.00 O ATOM 1575 CB GLN A 101 -4.298 0.530 -10.858 1.00 0.00 C ATOM 1576 CG GLN A 101 -4.407 0.677 -12.378 1.00 0.00 C ATOM 1577 CD GLN A 101 -5.031 -0.587 -12.974 1.00 0.00 C ATOM 1578 OE1 GLN A 101 -6.125 -0.548 -13.500 1.00 0.00 O ATOM 1579 NE2 GLN A 101 -4.375 -1.714 -12.915 1.00 0.00 N ATOM 0 H GLN A 101 -2.114 -0.169 -9.877 1.00 0.00 H new ATOM 0 HA GLN A 101 -2.992 2.223 -11.123 1.00 0.00 H new ATOM 0 HB2 GLN A 101 -3.977 -0.480 -10.602 1.00 0.00 H new ATOM 0 HB3 GLN A 101 -5.274 0.682 -10.396 1.00 0.00 H new ATOM 0 HG2 GLN A 101 -5.015 1.547 -12.626 1.00 0.00 H new ATOM 0 HG3 GLN A 101 -3.420 0.845 -12.809 1.00 0.00 H new ATOM 0 HE21 GLN A 101 -3.456 -1.747 -12.473 1.00 0.00 H new ATOM 0 HE22 GLN A 101 -4.781 -2.562 -13.311 1.00 0.00 H new ATOM 1588 N ILE A 102 -3.990 1.865 -7.997 1.00 0.00 N ATOM 1589 CA ILE A 102 -4.643 2.624 -6.895 1.00 0.00 C ATOM 1590 C ILE A 102 -3.736 3.761 -6.418 1.00 0.00 C ATOM 1591 O ILE A 102 -4.207 4.759 -5.913 1.00 0.00 O ATOM 1592 CB ILE A 102 -4.928 1.663 -5.737 1.00 0.00 C ATOM 1593 CG1 ILE A 102 -5.738 0.468 -6.252 1.00 0.00 C ATOM 1594 CG2 ILE A 102 -5.725 2.381 -4.647 1.00 0.00 C ATOM 1595 CD1 ILE A 102 -7.029 0.960 -6.916 1.00 0.00 C ATOM 0 H ILE A 102 -3.604 0.959 -7.734 1.00 0.00 H new ATOM 0 HA ILE A 102 -5.575 3.059 -7.256 1.00 0.00 H new ATOM 0 HB ILE A 102 -3.982 1.315 -5.321 1.00 0.00 H new ATOM 0 HG12 ILE A 102 -5.146 -0.103 -6.967 1.00 0.00 H new ATOM 0 HG13 ILE A 102 -5.976 -0.204 -5.427 1.00 0.00 H new ATOM 0 HG21 ILE A 102 -5.924 1.691 -3.827 1.00 0.00 H new ATOM 0 HG22 ILE A 102 -5.151 3.230 -4.276 1.00 0.00 H new ATOM 0 HG23 ILE A 102 -6.670 2.735 -5.060 1.00 0.00 H new ATOM 0 HD11 ILE A 102 -7.600 0.105 -7.280 1.00 0.00 H new ATOM 0 HD12 ILE A 102 -7.625 1.511 -6.189 1.00 0.00 H new ATOM 0 HD13 ILE A 102 -6.782 1.614 -7.753 1.00 0.00 H new ATOM 1607 N PHE A 103 -2.445 3.636 -6.572 1.00 0.00 N ATOM 1608 CA PHE A 103 -1.542 4.735 -6.122 1.00 0.00 C ATOM 1609 C PHE A 103 -1.642 5.908 -7.102 1.00 0.00 C ATOM 1610 O PHE A 103 -1.357 7.041 -6.762 1.00 0.00 O ATOM 1611 CB PHE A 103 -0.096 4.230 -6.084 1.00 0.00 C ATOM 1612 CG PHE A 103 0.079 3.248 -4.948 1.00 0.00 C ATOM 1613 CD1 PHE A 103 -0.401 3.558 -3.668 1.00 0.00 C ATOM 1614 CD2 PHE A 103 0.728 2.028 -5.175 1.00 0.00 C ATOM 1615 CE1 PHE A 103 -0.233 2.646 -2.618 1.00 0.00 C ATOM 1616 CE2 PHE A 103 0.896 1.117 -4.125 1.00 0.00 C ATOM 1617 CZ PHE A 103 0.415 1.426 -2.846 1.00 0.00 C ATOM 0 H PHE A 103 -1.980 2.828 -6.986 1.00 0.00 H new ATOM 0 HA PHE A 103 -1.839 5.062 -5.125 1.00 0.00 H new ATOM 0 HB2 PHE A 103 0.156 3.752 -7.031 1.00 0.00 H new ATOM 0 HB3 PHE A 103 0.588 5.069 -5.959 1.00 0.00 H new ATOM 0 HD1 PHE A 103 -0.900 4.499 -3.491 1.00 0.00 H new ATOM 0 HD2 PHE A 103 1.099 1.790 -6.161 1.00 0.00 H new ATOM 0 HE1 PHE A 103 -0.604 2.884 -1.632 1.00 0.00 H new ATOM 0 HE2 PHE A 103 1.396 0.176 -4.301 1.00 0.00 H new ATOM 0 HZ PHE A 103 0.544 0.723 -2.036 1.00 0.00 H new ATOM 1627 N THR A 104 -2.046 5.645 -8.317 1.00 0.00 N ATOM 1628 CA THR A 104 -2.163 6.739 -9.323 1.00 0.00 C ATOM 1629 C THR A 104 -3.418 7.568 -9.045 1.00 0.00 C ATOM 1630 O THR A 104 -3.369 8.781 -8.985 1.00 0.00 O ATOM 1631 CB THR A 104 -2.265 6.134 -10.726 1.00 0.00 C ATOM 1632 OG1 THR A 104 -1.382 5.021 -10.830 1.00 0.00 O ATOM 1633 CG2 THR A 104 -1.898 7.195 -11.769 1.00 0.00 C ATOM 0 H THR A 104 -2.300 4.717 -8.656 1.00 0.00 H new ATOM 0 HA THR A 104 -1.282 7.378 -9.258 1.00 0.00 H new ATOM 0 HB THR A 104 -3.286 5.796 -10.905 1.00 0.00 H new ATOM 0 HG1 THR A 104 -1.449 4.633 -11.727 1.00 0.00 H new ATOM 0 HG21 THR A 104 -1.971 6.764 -12.768 1.00 0.00 H new ATOM 0 HG22 THR A 104 -2.584 8.038 -11.687 1.00 0.00 H new ATOM 0 HG23 THR A 104 -0.878 7.538 -11.595 1.00 0.00 H new ATOM 1641 N ALA A 105 -4.544 6.926 -8.890 1.00 0.00 N ATOM 1642 CA ALA A 105 -5.806 7.682 -8.632 1.00 0.00 C ATOM 1643 C ALA A 105 -5.705 8.462 -7.317 1.00 0.00 C ATOM 1644 O ALA A 105 -6.346 9.481 -7.144 1.00 0.00 O ATOM 1645 CB ALA A 105 -6.977 6.701 -8.547 1.00 0.00 C ATOM 0 H ALA A 105 -4.646 5.912 -8.931 1.00 0.00 H new ATOM 0 HA ALA A 105 -5.966 8.386 -9.449 1.00 0.00 H new ATOM 0 HB1 ALA A 105 -7.899 7.251 -8.359 1.00 0.00 H new ATOM 0 HB2 ALA A 105 -7.065 6.157 -9.487 1.00 0.00 H new ATOM 0 HB3 ALA A 105 -6.803 5.996 -7.734 1.00 0.00 H new ATOM 1651 N PHE A 106 -4.932 7.984 -6.378 1.00 0.00 N ATOM 1652 CA PHE A 106 -4.824 8.694 -5.068 1.00 0.00 C ATOM 1653 C PHE A 106 -3.526 9.508 -4.990 1.00 0.00 C ATOM 1654 O PHE A 106 -3.239 10.128 -3.984 1.00 0.00 O ATOM 1655 CB PHE A 106 -4.840 7.664 -3.939 1.00 0.00 C ATOM 1656 CG PHE A 106 -6.244 7.145 -3.753 1.00 0.00 C ATOM 1657 CD1 PHE A 106 -7.117 7.793 -2.875 1.00 0.00 C ATOM 1658 CD2 PHE A 106 -6.673 6.015 -4.459 1.00 0.00 C ATOM 1659 CE1 PHE A 106 -8.419 7.312 -2.701 1.00 0.00 C ATOM 1660 CE2 PHE A 106 -7.975 5.534 -4.285 1.00 0.00 C ATOM 1661 CZ PHE A 106 -8.847 6.182 -3.406 1.00 0.00 C ATOM 0 H PHE A 106 -4.372 7.135 -6.460 1.00 0.00 H new ATOM 0 HA PHE A 106 -5.668 9.378 -4.972 1.00 0.00 H new ATOM 0 HB2 PHE A 106 -4.165 6.841 -4.173 1.00 0.00 H new ATOM 0 HB3 PHE A 106 -4.482 8.117 -3.014 1.00 0.00 H new ATOM 0 HD1 PHE A 106 -6.786 8.665 -2.331 1.00 0.00 H new ATOM 0 HD2 PHE A 106 -5.999 5.514 -5.138 1.00 0.00 H new ATOM 0 HE1 PHE A 106 -9.094 7.813 -2.023 1.00 0.00 H new ATOM 0 HE2 PHE A 106 -8.306 4.662 -4.830 1.00 0.00 H new ATOM 0 HZ PHE A 106 -9.852 5.810 -3.271 1.00 0.00 H new ATOM 1671 N LYS A 107 -2.727 9.500 -6.024 1.00 0.00 N ATOM 1672 CA LYS A 107 -1.448 10.267 -5.971 1.00 0.00 C ATOM 1673 C LYS A 107 -1.726 11.760 -5.726 1.00 0.00 C ATOM 1674 O LYS A 107 -1.012 12.411 -4.992 1.00 0.00 O ATOM 1675 CB LYS A 107 -0.666 10.067 -7.283 1.00 0.00 C ATOM 1676 CG LYS A 107 -1.196 10.986 -8.394 1.00 0.00 C ATOM 1677 CD LYS A 107 -0.185 11.024 -9.542 1.00 0.00 C ATOM 1678 CE LYS A 107 0.787 12.186 -9.322 1.00 0.00 C ATOM 1679 NZ LYS A 107 2.114 11.846 -9.910 1.00 0.00 N ATOM 0 H LYS A 107 -2.902 9.000 -6.896 1.00 0.00 H new ATOM 0 HA LYS A 107 -0.845 9.895 -5.143 1.00 0.00 H new ATOM 0 HB2 LYS A 107 0.391 10.270 -7.113 1.00 0.00 H new ATOM 0 HB3 LYS A 107 -0.744 9.027 -7.600 1.00 0.00 H new ATOM 0 HG2 LYS A 107 -2.159 10.623 -8.754 1.00 0.00 H new ATOM 0 HG3 LYS A 107 -1.359 11.991 -8.004 1.00 0.00 H new ATOM 0 HD2 LYS A 107 0.361 10.082 -9.592 1.00 0.00 H new ATOM 0 HD3 LYS A 107 -0.703 11.143 -10.494 1.00 0.00 H new ATOM 0 HE2 LYS A 107 0.395 13.093 -9.783 1.00 0.00 H new ATOM 0 HE3 LYS A 107 0.891 12.389 -8.256 1.00 0.00 H new ATOM 0 HZ1 LYS A 107 2.565 12.711 -10.271 1.00 0.00 H new ATOM 0 HZ2 LYS A 107 2.718 11.419 -9.179 1.00 0.00 H new ATOM 0 HZ3 LYS A 107 1.985 11.171 -10.691 1.00 0.00 H new ATOM 1693 N ASP A 108 -2.745 12.310 -6.332 1.00 0.00 N ATOM 1694 CA ASP A 108 -3.041 13.762 -6.133 1.00 0.00 C ATOM 1695 C ASP A 108 -3.482 14.036 -4.690 1.00 0.00 C ATOM 1696 O ASP A 108 -3.179 15.071 -4.129 1.00 0.00 O ATOM 1697 CB ASP A 108 -4.161 14.180 -7.088 1.00 0.00 C ATOM 1698 CG ASP A 108 -4.003 15.658 -7.449 1.00 0.00 C ATOM 1699 OD1 ASP A 108 -2.998 15.996 -8.050 1.00 0.00 O ATOM 1700 OD2 ASP A 108 -4.892 16.426 -7.118 1.00 0.00 O ATOM 0 H ASP A 108 -3.385 11.818 -6.956 1.00 0.00 H new ATOM 0 HA ASP A 108 -2.136 14.334 -6.335 1.00 0.00 H new ATOM 0 HB2 ASP A 108 -4.130 13.570 -7.990 1.00 0.00 H new ATOM 0 HB3 ASP A 108 -5.132 14.011 -6.622 1.00 0.00 H new ATOM 1705 N ASP A 109 -4.211 13.133 -4.091 1.00 0.00 N ATOM 1706 CA ASP A 109 -4.685 13.359 -2.692 1.00 0.00 C ATOM 1707 C ASP A 109 -3.917 12.455 -1.726 1.00 0.00 C ATOM 1708 O ASP A 109 -4.367 11.377 -1.389 1.00 0.00 O ATOM 1709 CB ASP A 109 -6.179 13.040 -2.604 1.00 0.00 C ATOM 1710 CG ASP A 109 -6.988 14.230 -3.122 1.00 0.00 C ATOM 1711 OD1 ASP A 109 -6.806 14.590 -4.274 1.00 0.00 O ATOM 1712 OD2 ASP A 109 -7.776 14.763 -2.358 1.00 0.00 O ATOM 0 H ASP A 109 -4.500 12.248 -4.509 1.00 0.00 H new ATOM 0 HA ASP A 109 -4.513 14.401 -2.421 1.00 0.00 H new ATOM 0 HB2 ASP A 109 -6.406 12.150 -3.190 1.00 0.00 H new ATOM 0 HB3 ASP A 109 -6.455 12.821 -1.572 1.00 0.00 H new ATOM 1717 N VAL A 110 -2.768 12.883 -1.267 1.00 0.00 N ATOM 1718 CA VAL A 110 -1.987 12.041 -0.313 1.00 0.00 C ATOM 1719 C VAL A 110 -1.802 12.795 1.006 1.00 0.00 C ATOM 1720 O VAL A 110 -1.769 14.010 1.040 1.00 0.00 O ATOM 1721 CB VAL A 110 -0.607 11.731 -0.894 1.00 0.00 C ATOM 1722 CG1 VAL A 110 0.052 10.623 -0.068 1.00 0.00 C ATOM 1723 CG2 VAL A 110 -0.742 11.278 -2.351 1.00 0.00 C ATOM 0 H VAL A 110 -2.339 13.776 -1.511 1.00 0.00 H new ATOM 0 HA VAL A 110 -2.531 11.112 -0.142 1.00 0.00 H new ATOM 0 HB VAL A 110 0.009 12.629 -0.859 1.00 0.00 H new ATOM 0 HG11 VAL A 110 1.036 10.399 -0.479 1.00 0.00 H new ATOM 0 HG12 VAL A 110 0.157 10.953 0.965 1.00 0.00 H new ATOM 0 HG13 VAL A 110 -0.568 9.727 -0.101 1.00 0.00 H new ATOM 0 HG21 VAL A 110 0.246 11.059 -2.757 1.00 0.00 H new ATOM 0 HG22 VAL A 110 -1.360 10.381 -2.397 1.00 0.00 H new ATOM 0 HG23 VAL A 110 -1.208 12.071 -2.937 1.00 0.00 H new ATOM 1733 N ASP A 111 -1.680 12.080 2.092 1.00 0.00 N ATOM 1734 CA ASP A 111 -1.491 12.742 3.415 1.00 0.00 C ATOM 1735 C ASP A 111 -0.260 12.145 4.109 1.00 0.00 C ATOM 1736 O ASP A 111 0.449 12.822 4.827 1.00 0.00 O ATOM 1737 CB ASP A 111 -2.730 12.509 4.283 1.00 0.00 C ATOM 1738 CG ASP A 111 -2.989 13.744 5.148 1.00 0.00 C ATOM 1739 OD1 ASP A 111 -2.166 14.027 6.003 1.00 0.00 O ATOM 1740 OD2 ASP A 111 -4.006 14.385 4.941 1.00 0.00 O ATOM 0 H ASP A 111 -1.703 11.061 2.120 1.00 0.00 H new ATOM 0 HA ASP A 111 -1.346 13.813 3.271 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -3.596 12.306 3.652 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -2.584 11.633 4.916 1.00 0.00 H new ATOM 1745 N THR A 112 -0.007 10.878 3.900 1.00 0.00 N ATOM 1746 CA THR A 112 1.172 10.229 4.542 1.00 0.00 C ATOM 1747 C THR A 112 1.677 9.095 3.645 1.00 0.00 C ATOM 1748 O THR A 112 0.927 8.225 3.250 1.00 0.00 O ATOM 1749 CB THR A 112 0.764 9.659 5.903 1.00 0.00 C ATOM 1750 OG1 THR A 112 -0.051 10.602 6.585 1.00 0.00 O ATOM 1751 CG2 THR A 112 2.015 9.367 6.734 1.00 0.00 C ATOM 0 H THR A 112 -0.569 10.265 3.310 1.00 0.00 H new ATOM 0 HA THR A 112 1.963 10.966 4.680 1.00 0.00 H new ATOM 0 HB THR A 112 0.206 8.734 5.756 1.00 0.00 H new ATOM 0 HG1 THR A 112 -0.314 10.238 7.456 1.00 0.00 H new ATOM 0 HG21 THR A 112 1.722 8.961 7.702 1.00 0.00 H new ATOM 0 HG22 THR A 112 2.639 8.642 6.211 1.00 0.00 H new ATOM 0 HG23 THR A 112 2.577 10.289 6.882 1.00 0.00 H new ATOM 1759 N LEU A 113 2.939 9.104 3.308 1.00 0.00 N ATOM 1760 CA LEU A 113 3.481 8.031 2.425 1.00 0.00 C ATOM 1761 C LEU A 113 4.284 7.026 3.254 1.00 0.00 C ATOM 1762 O LEU A 113 5.104 7.395 4.072 1.00 0.00 O ATOM 1763 CB LEU A 113 4.391 8.653 1.364 1.00 0.00 C ATOM 1764 CG LEU A 113 3.596 9.665 0.537 1.00 0.00 C ATOM 1765 CD1 LEU A 113 4.559 10.624 -0.170 1.00 0.00 C ATOM 1766 CD2 LEU A 113 2.759 8.921 -0.506 1.00 0.00 C ATOM 0 H LEU A 113 3.617 9.806 3.605 1.00 0.00 H new ATOM 0 HA LEU A 113 2.651 7.516 1.942 1.00 0.00 H new ATOM 0 HB2 LEU A 113 5.240 9.144 1.840 1.00 0.00 H new ATOM 0 HB3 LEU A 113 4.795 7.876 0.716 1.00 0.00 H new ATOM 0 HG LEU A 113 2.939 10.235 1.195 1.00 0.00 H new ATOM 0 HD11 LEU A 113 3.989 11.344 -0.758 1.00 0.00 H new ATOM 0 HD12 LEU A 113 5.156 11.154 0.573 1.00 0.00 H new ATOM 0 HD13 LEU A 113 5.218 10.058 -0.828 1.00 0.00 H new ATOM 0 HD21 LEU A 113 2.191 9.640 -1.097 1.00 0.00 H new ATOM 0 HD22 LEU A 113 3.417 8.351 -1.162 1.00 0.00 H new ATOM 0 HD23 LEU A 113 2.071 8.241 -0.003 1.00 0.00 H new ATOM 1778 N LEU A 114 4.064 5.756 3.035 1.00 0.00 N ATOM 1779 CA LEU A 114 4.819 4.716 3.789 1.00 0.00 C ATOM 1780 C LEU A 114 5.540 3.814 2.784 1.00 0.00 C ATOM 1781 O LEU A 114 4.936 2.985 2.130 1.00 0.00 O ATOM 1782 CB LEU A 114 3.849 3.887 4.633 1.00 0.00 C ATOM 1783 CG LEU A 114 3.137 4.801 5.633 1.00 0.00 C ATOM 1784 CD1 LEU A 114 1.710 4.299 5.857 1.00 0.00 C ATOM 1785 CD2 LEU A 114 3.895 4.791 6.962 1.00 0.00 C ATOM 0 H LEU A 114 3.389 5.394 2.361 1.00 0.00 H new ATOM 0 HA LEU A 114 5.546 5.186 4.452 1.00 0.00 H new ATOM 0 HB2 LEU A 114 3.119 3.395 3.990 1.00 0.00 H new ATOM 0 HB3 LEU A 114 4.389 3.102 5.162 1.00 0.00 H new ATOM 0 HG LEU A 114 3.107 5.817 5.239 1.00 0.00 H new ATOM 0 HD11 LEU A 114 1.203 4.950 6.569 1.00 0.00 H new ATOM 0 HD12 LEU A 114 1.169 4.306 4.911 1.00 0.00 H new ATOM 0 HD13 LEU A 114 1.739 3.283 6.251 1.00 0.00 H new ATOM 0 HD21 LEU A 114 3.388 5.442 7.675 1.00 0.00 H new ATOM 0 HD22 LEU A 114 3.925 3.775 7.356 1.00 0.00 H new ATOM 0 HD23 LEU A 114 4.912 5.149 6.803 1.00 0.00 H new ATOM 1797 N VAL A 115 6.822 3.998 2.637 1.00 0.00 N ATOM 1798 CA VAL A 115 7.581 3.178 1.649 1.00 0.00 C ATOM 1799 C VAL A 115 8.688 2.367 2.330 1.00 0.00 C ATOM 1800 O VAL A 115 9.406 2.856 3.180 1.00 0.00 O ATOM 1801 CB VAL A 115 8.195 4.101 0.591 1.00 0.00 C ATOM 1802 CG1 VAL A 115 9.262 4.994 1.231 1.00 0.00 C ATOM 1803 CG2 VAL A 115 8.832 3.252 -0.512 1.00 0.00 C ATOM 0 H VAL A 115 7.377 4.678 3.156 1.00 0.00 H new ATOM 0 HA VAL A 115 6.890 2.477 1.180 1.00 0.00 H new ATOM 0 HB VAL A 115 7.414 4.731 0.166 1.00 0.00 H new ATOM 0 HG11 VAL A 115 9.693 5.647 0.472 1.00 0.00 H new ATOM 0 HG12 VAL A 115 8.807 5.600 2.015 1.00 0.00 H new ATOM 0 HG13 VAL A 115 10.046 4.372 1.662 1.00 0.00 H new ATOM 0 HG21 VAL A 115 9.270 3.905 -1.267 1.00 0.00 H new ATOM 0 HG22 VAL A 115 9.610 2.621 -0.082 1.00 0.00 H new ATOM 0 HG23 VAL A 115 8.070 2.624 -0.974 1.00 0.00 H new ATOM 1813 N THR A 116 8.840 1.131 1.929 1.00 0.00 N ATOM 1814 CA THR A 116 9.908 0.269 2.510 1.00 0.00 C ATOM 1815 C THR A 116 10.967 0.027 1.432 1.00 0.00 C ATOM 1816 O THR A 116 10.707 -0.614 0.433 1.00 0.00 O ATOM 1817 CB THR A 116 9.318 -1.077 2.947 1.00 0.00 C ATOM 1818 OG1 THR A 116 7.990 -0.891 3.417 1.00 0.00 O ATOM 1819 CG2 THR A 116 10.178 -1.672 4.064 1.00 0.00 C ATOM 0 H THR A 116 8.264 0.680 1.218 1.00 0.00 H new ATOM 0 HA THR A 116 10.347 0.760 3.378 1.00 0.00 H new ATOM 0 HB THR A 116 9.305 -1.757 2.096 1.00 0.00 H new ATOM 0 HG1 THR A 116 7.617 -1.754 3.693 1.00 0.00 H new ATOM 0 HG21 THR A 116 9.759 -2.629 4.375 1.00 0.00 H new ATOM 0 HG22 THR A 116 11.194 -1.822 3.700 1.00 0.00 H new ATOM 0 HG23 THR A 116 10.194 -0.989 4.914 1.00 0.00 H new ATOM 1827 N ARG A 117 12.150 0.547 1.613 1.00 0.00 N ATOM 1828 CA ARG A 117 13.210 0.355 0.582 1.00 0.00 C ATOM 1829 C ARG A 117 14.095 -0.837 0.952 1.00 0.00 C ATOM 1830 O ARG A 117 14.762 -0.839 1.968 1.00 0.00 O ATOM 1831 CB ARG A 117 14.064 1.622 0.490 1.00 0.00 C ATOM 1832 CG ARG A 117 13.495 2.538 -0.596 1.00 0.00 C ATOM 1833 CD ARG A 117 14.377 3.780 -0.737 1.00 0.00 C ATOM 1834 NE ARG A 117 13.518 4.999 -0.731 1.00 0.00 N ATOM 1835 CZ ARG A 117 12.793 5.313 -1.778 1.00 0.00 C ATOM 1836 NH1 ARG A 117 12.808 4.564 -2.852 1.00 0.00 N ATOM 1837 NH2 ARG A 117 12.047 6.383 -1.750 1.00 0.00 N ATOM 0 H ARG A 117 12.428 1.095 2.427 1.00 0.00 H new ATOM 0 HA ARG A 117 12.740 0.159 -0.382 1.00 0.00 H new ATOM 0 HB2 ARG A 117 14.073 2.139 1.450 1.00 0.00 H new ATOM 0 HB3 ARG A 117 15.097 1.362 0.258 1.00 0.00 H new ATOM 0 HG2 ARG A 117 13.446 2.005 -1.546 1.00 0.00 H new ATOM 0 HG3 ARG A 117 12.476 2.831 -0.342 1.00 0.00 H new ATOM 0 HD2 ARG A 117 15.096 3.824 0.081 1.00 0.00 H new ATOM 0 HD3 ARG A 117 14.950 3.730 -1.663 1.00 0.00 H new ATOM 0 HE ARG A 117 13.494 5.595 0.096 1.00 0.00 H new ATOM 0 HH11 ARG A 117 13.388 3.725 -2.881 1.00 0.00 H new ATOM 0 HH12 ARG A 117 12.240 4.819 -3.660 1.00 0.00 H new ATOM 0 HH21 ARG A 117 12.030 6.971 -0.917 1.00 0.00 H new ATOM 0 HH22 ARG A 117 11.481 6.632 -2.562 1.00 0.00 H new ATOM 1851 N LEU A 118 14.105 -1.852 0.127 1.00 0.00 N ATOM 1852 CA LEU A 118 14.946 -3.048 0.417 1.00 0.00 C ATOM 1853 C LEU A 118 16.376 -2.785 -0.058 1.00 0.00 C ATOM 1854 O LEU A 118 16.608 -1.982 -0.941 1.00 0.00 O ATOM 1855 CB LEU A 118 14.381 -4.265 -0.321 1.00 0.00 C ATOM 1856 CG LEU A 118 13.324 -4.948 0.547 1.00 0.00 C ATOM 1857 CD1 LEU A 118 12.030 -4.134 0.513 1.00 0.00 C ATOM 1858 CD2 LEU A 118 13.056 -6.355 0.009 1.00 0.00 C ATOM 0 H LEU A 118 13.565 -1.903 -0.737 1.00 0.00 H new ATOM 0 HA LEU A 118 14.944 -3.243 1.489 1.00 0.00 H new ATOM 0 HB2 LEU A 118 13.942 -3.956 -1.270 1.00 0.00 H new ATOM 0 HB3 LEU A 118 15.183 -4.966 -0.554 1.00 0.00 H new ATOM 0 HG LEU A 118 13.684 -5.013 1.574 1.00 0.00 H new ATOM 0 HD11 LEU A 118 11.277 -4.622 1.132 1.00 0.00 H new ATOM 0 HD12 LEU A 118 12.221 -3.131 0.896 1.00 0.00 H new ATOM 0 HD13 LEU A 118 11.669 -4.068 -0.513 1.00 0.00 H new ATOM 0 HD21 LEU A 118 12.302 -6.843 0.627 1.00 0.00 H new ATOM 0 HD22 LEU A 118 12.696 -6.290 -1.018 1.00 0.00 H new ATOM 0 HD23 LEU A 118 13.978 -6.936 0.034 1.00 0.00 H new ATOM 1870 N ALA A 119 17.337 -3.451 0.524 1.00 0.00 N ATOM 1871 CA ALA A 119 18.753 -3.234 0.109 1.00 0.00 C ATOM 1872 C ALA A 119 19.058 -4.061 -1.142 1.00 0.00 C ATOM 1873 O ALA A 119 19.907 -3.705 -1.936 1.00 0.00 O ATOM 1874 CB ALA A 119 19.686 -3.661 1.243 1.00 0.00 C ATOM 0 H ALA A 119 17.203 -4.135 1.268 1.00 0.00 H new ATOM 0 HA ALA A 119 18.906 -2.178 -0.112 1.00 0.00 H new ATOM 0 HB1 ALA A 119 20.721 -3.503 0.941 1.00 0.00 H new ATOM 0 HB2 ALA A 119 19.473 -3.068 2.132 1.00 0.00 H new ATOM 0 HB3 ALA A 119 19.530 -4.717 1.465 1.00 0.00 H new ATOM 1880 N GLY A 120 18.380 -5.163 -1.324 1.00 0.00 N ATOM 1881 CA GLY A 120 18.640 -6.010 -2.524 1.00 0.00 C ATOM 1882 C GLY A 120 18.066 -5.333 -3.770 1.00 0.00 C ATOM 1883 O GLY A 120 17.305 -4.388 -3.681 1.00 0.00 O ATOM 0 H GLY A 120 17.658 -5.513 -0.694 1.00 0.00 H new ATOM 0 HA2 GLY A 120 19.712 -6.166 -2.645 1.00 0.00 H new ATOM 0 HA3 GLY A 120 18.188 -6.993 -2.392 1.00 0.00 H new ATOM 1887 N SER A 121 18.425 -5.811 -4.933 1.00 0.00 N ATOM 1888 CA SER A 121 17.904 -5.201 -6.190 1.00 0.00 C ATOM 1889 C SER A 121 17.150 -6.261 -6.995 1.00 0.00 C ATOM 1890 O SER A 121 17.725 -7.233 -7.446 1.00 0.00 O ATOM 1891 CB SER A 121 19.074 -4.676 -7.023 1.00 0.00 C ATOM 1892 OG SER A 121 19.918 -3.882 -6.200 1.00 0.00 O ATOM 0 H SER A 121 19.058 -6.600 -5.066 1.00 0.00 H new ATOM 0 HA SER A 121 17.231 -4.380 -5.943 1.00 0.00 H new ATOM 0 HB2 SER A 121 19.637 -5.508 -7.445 1.00 0.00 H new ATOM 0 HB3 SER A 121 18.703 -4.085 -7.860 1.00 0.00 H new ATOM 0 HG SER A 121 20.670 -3.545 -6.731 1.00 0.00 H new ATOM 1898 N PHE A 122 15.868 -6.088 -7.175 1.00 0.00 N ATOM 1899 CA PHE A 122 15.077 -7.089 -7.946 1.00 0.00 C ATOM 1900 C PHE A 122 14.616 -6.467 -9.267 1.00 0.00 C ATOM 1901 O PHE A 122 14.607 -5.261 -9.425 1.00 0.00 O ATOM 1902 CB PHE A 122 13.860 -7.517 -7.123 1.00 0.00 C ATOM 1903 CG PHE A 122 14.313 -7.945 -5.747 1.00 0.00 C ATOM 1904 CD1 PHE A 122 14.502 -6.987 -4.743 1.00 0.00 C ATOM 1905 CD2 PHE A 122 14.551 -9.298 -5.476 1.00 0.00 C ATOM 1906 CE1 PHE A 122 14.926 -7.381 -3.468 1.00 0.00 C ATOM 1907 CE2 PHE A 122 14.976 -9.693 -4.201 1.00 0.00 C ATOM 1908 CZ PHE A 122 15.164 -8.734 -3.197 1.00 0.00 C ATOM 0 H PHE A 122 15.334 -5.295 -6.820 1.00 0.00 H new ATOM 0 HA PHE A 122 15.696 -7.962 -8.156 1.00 0.00 H new ATOM 0 HB2 PHE A 122 13.151 -6.693 -7.045 1.00 0.00 H new ATOM 0 HB3 PHE A 122 13.341 -8.337 -7.619 1.00 0.00 H new ATOM 0 HD1 PHE A 122 14.321 -5.943 -4.952 1.00 0.00 H new ATOM 0 HD2 PHE A 122 14.407 -10.037 -6.250 1.00 0.00 H new ATOM 0 HE1 PHE A 122 15.069 -6.642 -2.694 1.00 0.00 H new ATOM 0 HE2 PHE A 122 15.159 -10.737 -3.992 1.00 0.00 H new ATOM 0 HZ PHE A 122 15.492 -9.038 -2.214 1.00 0.00 H new ATOM 1918 N GLU A 123 14.229 -7.280 -10.214 1.00 0.00 N ATOM 1919 CA GLU A 123 13.764 -6.735 -11.524 1.00 0.00 C ATOM 1920 C GLU A 123 12.283 -7.067 -11.726 1.00 0.00 C ATOM 1921 O GLU A 123 11.728 -7.911 -11.050 1.00 0.00 O ATOM 1922 CB GLU A 123 14.588 -7.347 -12.660 1.00 0.00 C ATOM 1923 CG GLU A 123 14.585 -8.874 -12.538 1.00 0.00 C ATOM 1924 CD GLU A 123 15.985 -9.359 -12.153 1.00 0.00 C ATOM 1925 OE1 GLU A 123 16.377 -9.135 -11.020 1.00 0.00 O ATOM 1926 OE2 GLU A 123 16.640 -9.947 -12.998 1.00 0.00 O ATOM 0 H GLU A 123 14.215 -8.297 -10.138 1.00 0.00 H new ATOM 0 HA GLU A 123 13.894 -5.653 -11.528 1.00 0.00 H new ATOM 0 HB2 GLU A 123 14.174 -7.049 -13.623 1.00 0.00 H new ATOM 0 HB3 GLU A 123 15.611 -6.972 -12.623 1.00 0.00 H new ATOM 0 HG2 GLU A 123 13.861 -9.188 -11.786 1.00 0.00 H new ATOM 0 HG3 GLU A 123 14.280 -9.324 -13.483 1.00 0.00 H new ATOM 1933 N GLY A 124 11.643 -6.405 -12.654 1.00 0.00 N ATOM 1934 CA GLY A 124 10.196 -6.669 -12.914 1.00 0.00 C ATOM 1935 C GLY A 124 9.711 -5.724 -14.015 1.00 0.00 C ATOM 1936 O GLY A 124 10.482 -5.295 -14.851 1.00 0.00 O ATOM 0 H GLY A 124 12.063 -5.689 -13.247 1.00 0.00 H new ATOM 0 HA2 GLY A 124 10.050 -7.706 -13.216 1.00 0.00 H new ATOM 0 HA3 GLY A 124 9.615 -6.517 -12.004 1.00 0.00 H new ATOM 1940 N ASP A 125 8.445 -5.389 -14.032 1.00 0.00 N ATOM 1941 CA ASP A 125 7.930 -4.464 -15.085 1.00 0.00 C ATOM 1942 C ASP A 125 6.921 -3.479 -14.469 1.00 0.00 C ATOM 1943 O ASP A 125 6.504 -2.530 -15.104 1.00 0.00 O ATOM 1944 CB ASP A 125 7.239 -5.276 -16.183 1.00 0.00 C ATOM 1945 CG ASP A 125 8.284 -5.783 -17.179 1.00 0.00 C ATOM 1946 OD1 ASP A 125 8.646 -5.025 -18.064 1.00 0.00 O ATOM 1947 OD2 ASP A 125 8.704 -6.920 -17.039 1.00 0.00 O ATOM 0 H ASP A 125 7.748 -5.716 -13.363 1.00 0.00 H new ATOM 0 HA ASP A 125 8.764 -3.906 -15.510 1.00 0.00 H new ATOM 0 HB2 ASP A 125 6.702 -6.117 -15.744 1.00 0.00 H new ATOM 0 HB3 ASP A 125 6.501 -4.659 -16.696 1.00 0.00 H new ATOM 1952 N THR A 126 6.516 -3.704 -13.242 1.00 0.00 N ATOM 1953 CA THR A 126 5.529 -2.789 -12.595 1.00 0.00 C ATOM 1954 C THR A 126 6.176 -2.099 -11.392 1.00 0.00 C ATOM 1955 O THR A 126 6.718 -2.740 -10.516 1.00 0.00 O ATOM 1956 CB THR A 126 4.317 -3.599 -12.125 1.00 0.00 C ATOM 1957 OG1 THR A 126 3.935 -4.511 -13.146 1.00 0.00 O ATOM 1958 CG2 THR A 126 3.154 -2.653 -11.822 1.00 0.00 C ATOM 0 H THR A 126 6.828 -4.483 -12.662 1.00 0.00 H new ATOM 0 HA THR A 126 5.210 -2.035 -13.315 1.00 0.00 H new ATOM 0 HB THR A 126 4.577 -4.151 -11.222 1.00 0.00 H new ATOM 0 HG1 THR A 126 3.161 -5.032 -12.847 1.00 0.00 H new ATOM 0 HG21 THR A 126 2.292 -3.231 -11.488 1.00 0.00 H new ATOM 0 HG22 THR A 126 3.448 -1.954 -11.039 1.00 0.00 H new ATOM 0 HG23 THR A 126 2.892 -2.099 -12.723 1.00 0.00 H new ATOM 1966 N LYS A 127 6.134 -0.795 -11.353 1.00 0.00 N ATOM 1967 CA LYS A 127 6.757 -0.055 -10.216 1.00 0.00 C ATOM 1968 C LYS A 127 5.759 0.957 -9.657 1.00 0.00 C ATOM 1969 O LYS A 127 4.750 1.253 -10.267 1.00 0.00 O ATOM 1970 CB LYS A 127 7.996 0.687 -10.723 1.00 0.00 C ATOM 1971 CG LYS A 127 8.929 -0.298 -11.433 1.00 0.00 C ATOM 1972 CD LYS A 127 10.317 0.329 -11.593 1.00 0.00 C ATOM 1973 CE LYS A 127 11.373 -0.599 -10.989 1.00 0.00 C ATOM 1974 NZ LYS A 127 11.684 -1.694 -11.952 1.00 0.00 N ATOM 0 H LYS A 127 5.694 -0.208 -12.061 1.00 0.00 H new ATOM 0 HA LYS A 127 7.039 -0.758 -9.432 1.00 0.00 H new ATOM 0 HB2 LYS A 127 7.701 1.482 -11.407 1.00 0.00 H new ATOM 0 HB3 LYS A 127 8.516 1.160 -9.890 1.00 0.00 H new ATOM 0 HG2 LYS A 127 9.001 -1.223 -10.860 1.00 0.00 H new ATOM 0 HG3 LYS A 127 8.522 -0.559 -12.410 1.00 0.00 H new ATOM 0 HD2 LYS A 127 10.530 0.501 -12.648 1.00 0.00 H new ATOM 0 HD3 LYS A 127 10.347 1.300 -11.100 1.00 0.00 H new ATOM 0 HE2 LYS A 127 12.277 -0.036 -10.758 1.00 0.00 H new ATOM 0 HE3 LYS A 127 11.010 -1.018 -10.051 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 12.402 -2.324 -11.541 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 10.820 -2.237 -12.151 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 12.048 -1.285 -12.837 1.00 0.00 H new ATOM 1988 N MET A 128 6.041 1.496 -8.502 1.00 0.00 N ATOM 1989 CA MET A 128 5.117 2.494 -7.899 1.00 0.00 C ATOM 1990 C MET A 128 5.038 3.720 -8.808 1.00 0.00 C ATOM 1991 O MET A 128 5.917 3.968 -9.610 1.00 0.00 O ATOM 1992 CB MET A 128 5.643 2.911 -6.524 1.00 0.00 C ATOM 1993 CG MET A 128 4.468 3.291 -5.620 1.00 0.00 C ATOM 1994 SD MET A 128 4.256 5.088 -5.620 1.00 0.00 S ATOM 1995 CE MET A 128 2.876 5.148 -4.452 1.00 0.00 C ATOM 0 H MET A 128 6.873 1.287 -7.950 1.00 0.00 H new ATOM 0 HA MET A 128 4.125 2.055 -7.789 1.00 0.00 H new ATOM 0 HB2 MET A 128 6.210 2.094 -6.077 1.00 0.00 H new ATOM 0 HB3 MET A 128 6.325 3.755 -6.625 1.00 0.00 H new ATOM 0 HG2 MET A 128 3.556 2.807 -5.970 1.00 0.00 H new ATOM 0 HG3 MET A 128 4.648 2.936 -4.605 1.00 0.00 H new ATOM 0 HE1 MET A 128 2.170 5.919 -4.762 1.00 0.00 H new ATOM 0 HE2 MET A 128 2.373 4.181 -4.433 1.00 0.00 H new ATOM 0 HE3 MET A 128 3.252 5.380 -3.456 1.00 0.00 H new ATOM 2005 N ILE A 129 3.989 4.486 -8.690 1.00 0.00 N ATOM 2006 CA ILE A 129 3.845 5.695 -9.549 1.00 0.00 C ATOM 2007 C ILE A 129 4.827 6.775 -9.078 1.00 0.00 C ATOM 2008 O ILE A 129 5.369 6.683 -7.995 1.00 0.00 O ATOM 2009 CB ILE A 129 2.409 6.213 -9.443 1.00 0.00 C ATOM 2010 CG1 ILE A 129 2.096 6.586 -7.988 1.00 0.00 C ATOM 2011 CG2 ILE A 129 1.443 5.120 -9.904 1.00 0.00 C ATOM 2012 CD1 ILE A 129 1.416 7.955 -7.948 1.00 0.00 C ATOM 0 H ILE A 129 3.224 4.327 -8.035 1.00 0.00 H new ATOM 0 HA ILE A 129 4.064 5.443 -10.587 1.00 0.00 H new ATOM 0 HB ILE A 129 2.297 7.096 -10.073 1.00 0.00 H new ATOM 0 HG12 ILE A 129 1.448 5.833 -7.540 1.00 0.00 H new ATOM 0 HG13 ILE A 129 3.014 6.607 -7.401 1.00 0.00 H new ATOM 0 HG21 ILE A 129 0.419 5.485 -9.830 1.00 0.00 H new ATOM 0 HG22 ILE A 129 1.660 4.855 -10.939 1.00 0.00 H new ATOM 0 HG23 ILE A 129 1.561 4.240 -9.272 1.00 0.00 H new ATOM 0 HD11 ILE A 129 1.193 8.221 -6.915 1.00 0.00 H new ATOM 0 HD12 ILE A 129 2.080 8.704 -8.380 1.00 0.00 H new ATOM 0 HD13 ILE A 129 0.489 7.918 -8.521 1.00 0.00 H new ATOM 2024 N PRO A 130 5.033 7.764 -9.912 1.00 0.00 N ATOM 2025 CA PRO A 130 5.957 8.924 -9.664 1.00 0.00 C ATOM 2026 C PRO A 130 5.418 9.786 -8.520 1.00 0.00 C ATOM 2027 O PRO A 130 4.525 10.590 -8.702 1.00 0.00 O ATOM 2028 CB PRO A 130 6.019 9.738 -10.954 1.00 0.00 C ATOM 2029 CG PRO A 130 5.127 9.062 -11.972 1.00 0.00 C ATOM 2030 CD PRO A 130 4.392 7.931 -11.264 1.00 0.00 C ATOM 0 HA PRO A 130 6.951 8.575 -9.382 1.00 0.00 H new ATOM 0 HB2 PRO A 130 5.688 10.761 -10.776 1.00 0.00 H new ATOM 0 HB3 PRO A 130 7.044 9.794 -11.321 1.00 0.00 H new ATOM 0 HG2 PRO A 130 4.418 9.775 -12.393 1.00 0.00 H new ATOM 0 HG3 PRO A 130 5.719 8.674 -12.801 1.00 0.00 H new ATOM 0 HD2 PRO A 130 3.332 8.165 -11.162 1.00 0.00 H new ATOM 0 HD3 PRO A 130 4.460 7.008 -11.839 1.00 0.00 H new ATOM 2038 N LEU A 131 5.951 9.617 -7.339 1.00 0.00 N ATOM 2039 CA LEU A 131 5.469 10.419 -6.179 1.00 0.00 C ATOM 2040 C LEU A 131 6.254 11.729 -6.107 1.00 0.00 C ATOM 2041 O LEU A 131 7.399 11.801 -6.510 1.00 0.00 O ATOM 2042 CB LEU A 131 5.689 9.629 -4.887 1.00 0.00 C ATOM 2043 CG LEU A 131 4.436 8.817 -4.558 1.00 0.00 C ATOM 2044 CD1 LEU A 131 4.765 7.800 -3.464 1.00 0.00 C ATOM 2045 CD2 LEU A 131 3.333 9.756 -4.064 1.00 0.00 C ATOM 0 H LEU A 131 6.700 8.957 -7.128 1.00 0.00 H new ATOM 0 HA LEU A 131 4.407 10.633 -6.301 1.00 0.00 H new ATOM 0 HB2 LEU A 131 6.546 8.964 -4.998 1.00 0.00 H new ATOM 0 HB3 LEU A 131 5.918 10.310 -4.068 1.00 0.00 H new ATOM 0 HG LEU A 131 4.095 8.296 -5.452 1.00 0.00 H new ATOM 0 HD11 LEU A 131 3.874 7.219 -3.227 1.00 0.00 H new ATOM 0 HD12 LEU A 131 5.551 7.131 -3.814 1.00 0.00 H new ATOM 0 HD13 LEU A 131 5.105 8.324 -2.571 1.00 0.00 H new ATOM 0 HD21 LEU A 131 2.440 9.177 -3.830 1.00 0.00 H new ATOM 0 HD22 LEU A 131 3.673 10.277 -3.169 1.00 0.00 H new ATOM 0 HD23 LEU A 131 3.100 10.484 -4.841 1.00 0.00 H new ATOM 2057 N ASN A 132 5.646 12.766 -5.597 1.00 0.00 N ATOM 2058 CA ASN A 132 6.354 14.074 -5.498 1.00 0.00 C ATOM 2059 C ASN A 132 7.060 14.166 -4.143 1.00 0.00 C ATOM 2060 O ASN A 132 6.707 14.967 -3.301 1.00 0.00 O ATOM 2061 CB ASN A 132 5.339 15.213 -5.631 1.00 0.00 C ATOM 2062 CG ASN A 132 5.382 15.774 -7.053 1.00 0.00 C ATOM 2063 OD1 ASN A 132 5.240 15.042 -8.012 1.00 0.00 O ATOM 2064 ND2 ASN A 132 5.575 17.052 -7.232 1.00 0.00 N ATOM 0 H ASN A 132 4.689 12.763 -5.244 1.00 0.00 H new ATOM 0 HA ASN A 132 7.092 14.154 -6.296 1.00 0.00 H new ATOM 0 HB2 ASN A 132 4.337 14.849 -5.403 1.00 0.00 H new ATOM 0 HB3 ASN A 132 5.564 16.000 -4.912 1.00 0.00 H new ATOM 0 HD21 ASN A 132 5.607 17.436 -8.177 1.00 0.00 H new ATOM 0 HD22 ASN A 132 5.694 17.667 -6.427 1.00 0.00 H new ATOM 2071 N TRP A 133 8.055 13.345 -3.928 1.00 0.00 N ATOM 2072 CA TRP A 133 8.788 13.372 -2.626 1.00 0.00 C ATOM 2073 C TRP A 133 9.230 14.804 -2.308 1.00 0.00 C ATOM 2074 O TRP A 133 9.339 15.188 -1.159 1.00 0.00 O ATOM 2075 CB TRP A 133 10.020 12.468 -2.716 1.00 0.00 C ATOM 2076 CG TRP A 133 9.601 11.095 -3.135 1.00 0.00 C ATOM 2077 CD1 TRP A 133 9.644 10.623 -4.402 1.00 0.00 C ATOM 2078 CD2 TRP A 133 9.078 10.011 -2.313 1.00 0.00 C ATOM 2079 NE1 TRP A 133 9.178 9.321 -4.411 1.00 0.00 N ATOM 2080 CE2 TRP A 133 8.818 8.899 -3.147 1.00 0.00 C ATOM 2081 CE3 TRP A 133 8.806 9.888 -0.939 1.00 0.00 C ATOM 2082 CZ2 TRP A 133 8.306 7.706 -2.636 1.00 0.00 C ATOM 2083 CZ3 TRP A 133 8.291 8.688 -0.421 1.00 0.00 C ATOM 2084 CH2 TRP A 133 8.041 7.600 -1.268 1.00 0.00 C ATOM 0 H TRP A 133 8.393 12.655 -4.599 1.00 0.00 H new ATOM 0 HA TRP A 133 8.128 13.015 -1.835 1.00 0.00 H new ATOM 0 HB2 TRP A 133 10.733 12.877 -3.432 1.00 0.00 H new ATOM 0 HB3 TRP A 133 10.526 12.427 -1.751 1.00 0.00 H new ATOM 0 HD1 TRP A 133 9.986 11.173 -5.266 1.00 0.00 H new ATOM 0 HE1 TRP A 133 9.109 8.743 -5.249 1.00 0.00 H new ATOM 0 HE3 TRP A 133 8.994 10.721 -0.278 1.00 0.00 H new ATOM 0 HZ2 TRP A 133 8.116 6.870 -3.293 1.00 0.00 H new ATOM 0 HZ3 TRP A 133 8.087 8.604 0.636 1.00 0.00 H new ATOM 0 HH2 TRP A 133 7.644 6.680 -0.864 1.00 0.00 H new ATOM 2095 N ASP A 134 9.484 15.596 -3.315 1.00 0.00 N ATOM 2096 CA ASP A 134 9.919 17.002 -3.072 1.00 0.00 C ATOM 2097 C ASP A 134 8.819 17.760 -2.323 1.00 0.00 C ATOM 2098 O ASP A 134 9.090 18.660 -1.551 1.00 0.00 O ATOM 2099 CB ASP A 134 10.190 17.689 -4.414 1.00 0.00 C ATOM 2100 CG ASP A 134 11.468 18.525 -4.313 1.00 0.00 C ATOM 2101 OD1 ASP A 134 12.513 17.945 -4.070 1.00 0.00 O ATOM 2102 OD2 ASP A 134 11.379 19.730 -4.482 1.00 0.00 O ATOM 0 H ASP A 134 9.409 15.330 -4.297 1.00 0.00 H new ATOM 0 HA ASP A 134 10.829 17.001 -2.471 1.00 0.00 H new ATOM 0 HB2 ASP A 134 10.293 16.943 -5.202 1.00 0.00 H new ATOM 0 HB3 ASP A 134 9.348 18.325 -4.685 1.00 0.00 H new ATOM 2107 N ASP A 135 7.581 17.405 -2.542 1.00 0.00 N ATOM 2108 CA ASP A 135 6.465 18.105 -1.842 1.00 0.00 C ATOM 2109 C ASP A 135 6.188 17.429 -0.494 1.00 0.00 C ATOM 2110 O ASP A 135 5.346 17.868 0.266 1.00 0.00 O ATOM 2111 CB ASP A 135 5.204 18.043 -2.708 1.00 0.00 C ATOM 2112 CG ASP A 135 5.151 19.266 -3.625 1.00 0.00 C ATOM 2113 OD1 ASP A 135 5.984 19.353 -4.512 1.00 0.00 O ATOM 2114 OD2 ASP A 135 4.278 20.094 -3.425 1.00 0.00 O ATOM 0 H ASP A 135 7.294 16.659 -3.176 1.00 0.00 H new ATOM 0 HA ASP A 135 6.745 19.145 -1.672 1.00 0.00 H new ATOM 0 HB2 ASP A 135 5.204 17.130 -3.303 1.00 0.00 H new ATOM 0 HB3 ASP A 135 4.317 18.012 -2.075 1.00 0.00 H new ATOM 2119 N PHE A 136 6.883 16.362 -0.191 1.00 0.00 N ATOM 2120 CA PHE A 136 6.648 15.664 1.105 1.00 0.00 C ATOM 2121 C PHE A 136 7.928 15.671 1.941 1.00 0.00 C ATOM 2122 O PHE A 136 9.011 15.909 1.441 1.00 0.00 O ATOM 2123 CB PHE A 136 6.227 14.218 0.839 1.00 0.00 C ATOM 2124 CG PHE A 136 4.805 14.191 0.335 1.00 0.00 C ATOM 2125 CD1 PHE A 136 4.522 14.583 -0.977 1.00 0.00 C ATOM 2126 CD2 PHE A 136 3.771 13.769 1.179 1.00 0.00 C ATOM 2127 CE1 PHE A 136 3.205 14.553 -1.448 1.00 0.00 C ATOM 2128 CE2 PHE A 136 2.453 13.740 0.708 1.00 0.00 C ATOM 2129 CZ PHE A 136 2.171 14.132 -0.606 1.00 0.00 C ATOM 0 H PHE A 136 7.601 15.946 -0.785 1.00 0.00 H new ATOM 0 HA PHE A 136 5.859 16.182 1.650 1.00 0.00 H new ATOM 0 HB2 PHE A 136 6.893 13.764 0.105 1.00 0.00 H new ATOM 0 HB3 PHE A 136 6.311 13.630 1.753 1.00 0.00 H new ATOM 0 HD1 PHE A 136 5.320 14.909 -1.627 1.00 0.00 H new ATOM 0 HD2 PHE A 136 3.990 13.466 2.192 1.00 0.00 H new ATOM 0 HE1 PHE A 136 2.987 14.855 -2.462 1.00 0.00 H new ATOM 0 HE2 PHE A 136 1.654 13.415 1.358 1.00 0.00 H new ATOM 0 HZ PHE A 136 1.154 14.109 -0.970 1.00 0.00 H new ATOM 2139 N THR A 137 7.805 15.406 3.213 1.00 0.00 N ATOM 2140 CA THR A 137 9.004 15.389 4.098 1.00 0.00 C ATOM 2141 C THR A 137 8.949 14.154 4.999 1.00 0.00 C ATOM 2142 O THR A 137 7.934 13.860 5.599 1.00 0.00 O ATOM 2143 CB THR A 137 9.019 16.651 4.962 1.00 0.00 C ATOM 2144 OG1 THR A 137 8.703 17.778 4.156 1.00 0.00 O ATOM 2145 CG2 THR A 137 10.406 16.834 5.578 1.00 0.00 C ATOM 0 H THR A 137 6.922 15.200 3.679 1.00 0.00 H new ATOM 0 HA THR A 137 9.907 15.357 3.489 1.00 0.00 H new ATOM 0 HB THR A 137 8.281 16.555 5.759 1.00 0.00 H new ATOM 0 HG1 THR A 137 8.711 18.588 4.708 1.00 0.00 H new ATOM 0 HG21 THR A 137 10.415 17.734 6.193 1.00 0.00 H new ATOM 0 HG22 THR A 137 10.647 15.969 6.196 1.00 0.00 H new ATOM 0 HG23 THR A 137 11.147 16.930 4.784 1.00 0.00 H new ATOM 2153 N LYS A 138 10.031 13.428 5.101 1.00 0.00 N ATOM 2154 CA LYS A 138 10.037 12.211 5.961 1.00 0.00 C ATOM 2155 C LYS A 138 10.030 12.634 7.432 1.00 0.00 C ATOM 2156 O LYS A 138 10.928 13.308 7.898 1.00 0.00 O ATOM 2157 CB LYS A 138 11.302 11.399 5.664 1.00 0.00 C ATOM 2158 CG LYS A 138 11.214 10.032 6.344 1.00 0.00 C ATOM 2159 CD LYS A 138 11.964 10.071 7.677 1.00 0.00 C ATOM 2160 CE LYS A 138 13.470 10.195 7.421 1.00 0.00 C ATOM 2161 NZ LYS A 138 13.922 9.095 6.521 1.00 0.00 N ATOM 0 H LYS A 138 10.911 13.626 4.625 1.00 0.00 H new ATOM 0 HA LYS A 138 9.156 11.603 5.756 1.00 0.00 H new ATOM 0 HB2 LYS A 138 11.419 11.273 4.588 1.00 0.00 H new ATOM 0 HB3 LYS A 138 12.181 11.936 6.020 1.00 0.00 H new ATOM 0 HG2 LYS A 138 10.171 9.764 6.510 1.00 0.00 H new ATOM 0 HG3 LYS A 138 11.641 9.265 5.698 1.00 0.00 H new ATOM 0 HD2 LYS A 138 11.617 10.913 8.276 1.00 0.00 H new ATOM 0 HD3 LYS A 138 11.756 9.166 8.249 1.00 0.00 H new ATOM 0 HE2 LYS A 138 13.693 11.162 6.969 1.00 0.00 H new ATOM 0 HE3 LYS A 138 14.013 10.151 8.365 1.00 0.00 H new ATOM 0 HZ1 LYS A 138 14.911 8.855 6.736 1.00 0.00 H new ATOM 0 HZ2 LYS A 138 13.323 8.258 6.668 1.00 0.00 H new ATOM 0 HZ3 LYS A 138 13.848 9.404 5.531 1.00 0.00 H new ATOM 2175 N VAL A 139 9.014 12.255 8.162 1.00 0.00 N ATOM 2176 CA VAL A 139 8.935 12.645 9.600 1.00 0.00 C ATOM 2177 C VAL A 139 9.395 11.486 10.489 1.00 0.00 C ATOM 2178 O VAL A 139 9.818 11.689 11.611 1.00 0.00 O ATOM 2179 CB VAL A 139 7.490 13.008 9.949 1.00 0.00 C ATOM 2180 CG1 VAL A 139 7.090 14.287 9.211 1.00 0.00 C ATOM 2181 CG2 VAL A 139 6.561 11.866 9.528 1.00 0.00 C ATOM 0 H VAL A 139 8.234 11.691 7.823 1.00 0.00 H new ATOM 0 HA VAL A 139 9.585 13.503 9.771 1.00 0.00 H new ATOM 0 HB VAL A 139 7.407 13.168 11.024 1.00 0.00 H new ATOM 0 HG11 VAL A 139 6.061 14.544 9.461 1.00 0.00 H new ATOM 0 HG12 VAL A 139 7.750 15.101 9.510 1.00 0.00 H new ATOM 0 HG13 VAL A 139 7.174 14.128 8.136 1.00 0.00 H new ATOM 0 HG21 VAL A 139 5.532 12.124 9.776 1.00 0.00 H new ATOM 0 HG22 VAL A 139 6.646 11.706 8.453 1.00 0.00 H new ATOM 0 HG23 VAL A 139 6.844 10.954 10.054 1.00 0.00 H new ATOM 2191 N SER A 140 9.311 10.273 10.009 1.00 0.00 N ATOM 2192 CA SER A 140 9.738 9.114 10.845 1.00 0.00 C ATOM 2193 C SER A 140 10.396 8.052 9.964 1.00 0.00 C ATOM 2194 O SER A 140 9.918 7.733 8.893 1.00 0.00 O ATOM 2195 CB SER A 140 8.515 8.510 11.537 1.00 0.00 C ATOM 2196 OG SER A 140 8.284 9.194 12.762 1.00 0.00 O ATOM 0 H SER A 140 8.967 10.036 9.079 1.00 0.00 H new ATOM 0 HA SER A 140 10.454 9.455 11.593 1.00 0.00 H new ATOM 0 HB2 SER A 140 7.640 8.591 10.891 1.00 0.00 H new ATOM 0 HB3 SER A 140 8.676 7.448 11.724 1.00 0.00 H new ATOM 0 HG SER A 140 8.667 10.095 12.711 1.00 0.00 H new ATOM 2202 N SER A 141 11.490 7.497 10.416 1.00 0.00 N ATOM 2203 CA SER A 141 12.183 6.449 9.616 1.00 0.00 C ATOM 2204 C SER A 141 12.914 5.483 10.551 1.00 0.00 C ATOM 2205 O SER A 141 13.572 5.889 11.488 1.00 0.00 O ATOM 2206 CB SER A 141 13.190 7.107 8.672 1.00 0.00 C ATOM 2207 OG SER A 141 12.720 6.994 7.336 1.00 0.00 O ATOM 0 H SER A 141 11.933 7.726 11.306 1.00 0.00 H new ATOM 0 HA SER A 141 11.446 5.897 9.033 1.00 0.00 H new ATOM 0 HB2 SER A 141 13.323 8.156 8.936 1.00 0.00 H new ATOM 0 HB3 SER A 141 14.164 6.628 8.769 1.00 0.00 H new ATOM 0 HG SER A 141 12.789 6.061 7.043 1.00 0.00 H new ATOM 2213 N ARG A 142 12.814 4.208 10.292 1.00 0.00 N ATOM 2214 CA ARG A 142 13.512 3.206 11.146 1.00 0.00 C ATOM 2215 C ARG A 142 14.264 2.240 10.232 1.00 0.00 C ATOM 2216 O ARG A 142 13.714 1.745 9.268 1.00 0.00 O ATOM 2217 CB ARG A 142 12.482 2.434 11.975 1.00 0.00 C ATOM 2218 CG ARG A 142 13.169 1.807 13.189 1.00 0.00 C ATOM 2219 CD ARG A 142 13.086 2.770 14.375 1.00 0.00 C ATOM 2220 NE ARG A 142 13.750 2.156 15.562 1.00 0.00 N ATOM 2221 CZ ARG A 142 13.603 2.678 16.755 1.00 0.00 C ATOM 2222 NH1 ARG A 142 12.871 3.749 16.930 1.00 0.00 N ATOM 2223 NH2 ARG A 142 14.193 2.125 17.779 1.00 0.00 N ATOM 0 H ARG A 142 12.275 3.815 9.520 1.00 0.00 H new ATOM 0 HA ARG A 142 14.208 3.704 11.821 1.00 0.00 H new ATOM 0 HB2 ARG A 142 11.686 3.104 12.300 1.00 0.00 H new ATOM 0 HB3 ARG A 142 12.017 1.658 11.366 1.00 0.00 H new ATOM 0 HG2 ARG A 142 12.692 0.860 13.442 1.00 0.00 H new ATOM 0 HG3 ARG A 142 14.211 1.587 12.957 1.00 0.00 H new ATOM 0 HD2 ARG A 142 13.567 3.715 14.124 1.00 0.00 H new ATOM 0 HD3 ARG A 142 12.044 2.994 14.603 1.00 0.00 H new ATOM 0 HE ARG A 142 14.324 1.321 15.444 1.00 0.00 H new ATOM 0 HH11 ARG A 142 12.408 4.186 16.133 1.00 0.00 H new ATOM 0 HH12 ARG A 142 12.764 4.147 17.863 1.00 0.00 H new ATOM 0 HH21 ARG A 142 14.765 1.291 17.649 1.00 0.00 H new ATOM 0 HH22 ARG A 142 14.082 2.527 18.710 1.00 0.00 H new ATOM 2237 N THR A 143 15.510 1.964 10.514 1.00 0.00 N ATOM 2238 CA THR A 143 16.280 1.029 9.643 1.00 0.00 C ATOM 2239 C THR A 143 16.450 -0.312 10.354 1.00 0.00 C ATOM 2240 O THR A 143 16.868 -0.371 11.494 1.00 0.00 O ATOM 2241 CB THR A 143 17.658 1.627 9.346 1.00 0.00 C ATOM 2242 OG1 THR A 143 17.512 2.993 8.986 1.00 0.00 O ATOM 2243 CG2 THR A 143 18.313 0.860 8.196 1.00 0.00 C ATOM 0 H THR A 143 16.026 2.344 11.307 1.00 0.00 H new ATOM 0 HA THR A 143 15.739 0.877 8.709 1.00 0.00 H new ATOM 0 HB THR A 143 18.286 1.551 10.233 1.00 0.00 H new ATOM 0 HG1 THR A 143 18.393 3.378 8.797 1.00 0.00 H new ATOM 0 HG21 THR A 143 19.294 1.287 7.986 1.00 0.00 H new ATOM 0 HG22 THR A 143 18.425 -0.188 8.475 1.00 0.00 H new ATOM 0 HG23 THR A 143 17.687 0.933 7.307 1.00 0.00 H new ATOM 2251 N VAL A 144 16.131 -1.390 9.691 1.00 0.00 N ATOM 2252 CA VAL A 144 16.273 -2.727 10.331 1.00 0.00 C ATOM 2253 C VAL A 144 17.149 -3.633 9.459 1.00 0.00 C ATOM 2254 O VAL A 144 16.895 -3.817 8.279 1.00 0.00 O ATOM 2255 CB VAL A 144 14.886 -3.357 10.498 1.00 0.00 C ATOM 2256 CG1 VAL A 144 14.249 -3.572 9.122 1.00 0.00 C ATOM 2257 CG2 VAL A 144 15.015 -4.704 11.217 1.00 0.00 C ATOM 0 H VAL A 144 15.778 -1.402 8.734 1.00 0.00 H new ATOM 0 HA VAL A 144 16.744 -2.612 11.307 1.00 0.00 H new ATOM 0 HB VAL A 144 14.257 -2.690 11.088 1.00 0.00 H new ATOM 0 HG11 VAL A 144 13.263 -4.020 9.244 1.00 0.00 H new ATOM 0 HG12 VAL A 144 14.152 -2.613 8.612 1.00 0.00 H new ATOM 0 HG13 VAL A 144 14.879 -4.236 8.529 1.00 0.00 H new ATOM 0 HG21 VAL A 144 14.027 -5.150 11.334 1.00 0.00 H new ATOM 0 HG22 VAL A 144 15.647 -5.371 10.630 1.00 0.00 H new ATOM 0 HG23 VAL A 144 15.463 -4.551 12.199 1.00 0.00 H new ATOM 2267 N GLU A 145 18.176 -4.199 10.034 1.00 0.00 N ATOM 2268 CA GLU A 145 19.078 -5.093 9.257 1.00 0.00 C ATOM 2269 C GLU A 145 18.529 -6.520 9.302 1.00 0.00 C ATOM 2270 O GLU A 145 17.727 -6.861 10.149 1.00 0.00 O ATOM 2271 CB GLU A 145 20.479 -5.067 9.875 1.00 0.00 C ATOM 2272 CG GLU A 145 21.374 -4.116 9.078 1.00 0.00 C ATOM 2273 CD GLU A 145 22.801 -4.667 9.041 1.00 0.00 C ATOM 2274 OE1 GLU A 145 23.549 -4.382 9.962 1.00 0.00 O ATOM 2275 OE2 GLU A 145 23.122 -5.365 8.093 1.00 0.00 O ATOM 0 H GLU A 145 18.429 -4.079 11.015 1.00 0.00 H new ATOM 0 HA GLU A 145 19.132 -4.751 8.223 1.00 0.00 H new ATOM 0 HB2 GLU A 145 20.423 -4.744 10.915 1.00 0.00 H new ATOM 0 HB3 GLU A 145 20.906 -6.070 9.875 1.00 0.00 H new ATOM 0 HG2 GLU A 145 20.990 -4.003 8.064 1.00 0.00 H new ATOM 0 HG3 GLU A 145 21.367 -3.126 9.534 1.00 0.00 H new ATOM 2282 N ASP A 146 18.958 -7.355 8.396 1.00 0.00 N ATOM 2283 CA ASP A 146 18.465 -8.761 8.384 1.00 0.00 C ATOM 2284 C ASP A 146 19.628 -9.703 8.071 1.00 0.00 C ATOM 2285 O ASP A 146 20.614 -9.310 7.479 1.00 0.00 O ATOM 2286 CB ASP A 146 17.380 -8.911 7.314 1.00 0.00 C ATOM 2287 CG ASP A 146 16.214 -9.728 7.875 1.00 0.00 C ATOM 2288 OD1 ASP A 146 15.463 -9.184 8.667 1.00 0.00 O ATOM 2289 OD2 ASP A 146 16.091 -10.882 7.501 1.00 0.00 O ATOM 0 H ASP A 146 19.629 -7.124 7.663 1.00 0.00 H new ATOM 0 HA ASP A 146 18.048 -9.011 9.359 1.00 0.00 H new ATOM 0 HB2 ASP A 146 17.030 -7.929 6.997 1.00 0.00 H new ATOM 0 HB3 ASP A 146 17.791 -9.403 6.432 1.00 0.00 H new ATOM 2294 N THR A 147 19.515 -10.948 8.451 1.00 0.00 N ATOM 2295 CA THR A 147 20.609 -11.917 8.159 1.00 0.00 C ATOM 2296 C THR A 147 20.815 -11.987 6.644 1.00 0.00 C ATOM 2297 O THR A 147 21.905 -12.224 6.162 1.00 0.00 O ATOM 2298 CB THR A 147 20.224 -13.301 8.692 1.00 0.00 C ATOM 2299 OG1 THR A 147 18.853 -13.548 8.413 1.00 0.00 O ATOM 2300 CG2 THR A 147 20.457 -13.356 10.204 1.00 0.00 C ATOM 0 H THR A 147 18.714 -11.334 8.950 1.00 0.00 H new ATOM 0 HA THR A 147 21.531 -11.593 8.642 1.00 0.00 H new ATOM 0 HB THR A 147 20.838 -14.060 8.207 1.00 0.00 H new ATOM 0 HG1 THR A 147 18.605 -14.434 8.751 1.00 0.00 H new ATOM 0 HG21 THR A 147 20.182 -14.342 10.579 1.00 0.00 H new ATOM 0 HG22 THR A 147 21.509 -13.167 10.417 1.00 0.00 H new ATOM 0 HG23 THR A 147 19.846 -12.598 10.694 1.00 0.00 H new ATOM 2308 N ASN A 148 19.767 -11.773 5.893 1.00 0.00 N ATOM 2309 CA ASN A 148 19.882 -11.816 4.408 1.00 0.00 C ATOM 2310 C ASN A 148 20.161 -10.401 3.878 1.00 0.00 C ATOM 2311 O ASN A 148 19.382 -9.497 4.105 1.00 0.00 O ATOM 2312 CB ASN A 148 18.569 -12.334 3.813 1.00 0.00 C ATOM 2313 CG ASN A 148 18.823 -13.650 3.074 1.00 0.00 C ATOM 2314 OD1 ASN A 148 18.294 -14.680 3.442 1.00 0.00 O ATOM 2315 ND2 ASN A 148 19.616 -13.658 2.038 1.00 0.00 N ATOM 0 H ASN A 148 18.832 -11.569 6.247 1.00 0.00 H new ATOM 0 HA ASN A 148 20.698 -12.479 4.123 1.00 0.00 H new ATOM 0 HB2 ASN A 148 17.835 -12.486 4.604 1.00 0.00 H new ATOM 0 HB3 ASN A 148 18.152 -11.595 3.128 1.00 0.00 H new ATOM 0 HD21 ASN A 148 19.792 -14.529 1.537 1.00 0.00 H new ATOM 0 HD22 ASN A 148 20.060 -12.793 1.729 1.00 0.00 H new ATOM 2322 N PRO A 149 21.268 -10.248 3.190 1.00 0.00 N ATOM 2323 CA PRO A 149 21.740 -8.954 2.583 1.00 0.00 C ATOM 2324 C PRO A 149 20.604 -8.293 1.797 1.00 0.00 C ATOM 2325 O PRO A 149 20.403 -7.097 1.869 1.00 0.00 O ATOM 2326 CB PRO A 149 22.892 -9.295 1.641 1.00 0.00 C ATOM 2327 CG PRO A 149 23.192 -10.770 1.791 1.00 0.00 C ATOM 2328 CD PRO A 149 22.276 -11.322 2.876 1.00 0.00 C ATOM 0 HA PRO A 149 22.061 -8.259 3.359 1.00 0.00 H new ATOM 0 HB2 PRO A 149 22.624 -9.063 0.610 1.00 0.00 H new ATOM 0 HB3 PRO A 149 23.772 -8.700 1.883 1.00 0.00 H new ATOM 0 HG2 PRO A 149 23.026 -11.292 0.848 1.00 0.00 H new ATOM 0 HG3 PRO A 149 24.237 -10.922 2.059 1.00 0.00 H new ATOM 0 HD2 PRO A 149 21.778 -12.230 2.535 1.00 0.00 H new ATOM 0 HD3 PRO A 149 22.848 -11.586 3.766 1.00 0.00 H new ATOM 2336 N ALA A 150 19.875 -9.060 1.032 1.00 0.00 N ATOM 2337 CA ALA A 150 18.768 -8.474 0.223 1.00 0.00 C ATOM 2338 C ALA A 150 17.532 -8.252 1.098 1.00 0.00 C ATOM 2339 O ALA A 150 16.801 -7.298 0.912 1.00 0.00 O ATOM 2340 CB ALA A 150 18.414 -9.427 -0.921 1.00 0.00 C ATOM 0 H ALA A 150 19.998 -10.068 0.932 1.00 0.00 H new ATOM 0 HA ALA A 150 19.094 -7.516 -0.181 1.00 0.00 H new ATOM 0 HB1 ALA A 150 17.605 -9.000 -1.513 1.00 0.00 H new ATOM 0 HB2 ALA A 150 19.288 -9.575 -1.555 1.00 0.00 H new ATOM 0 HB3 ALA A 150 18.096 -10.386 -0.511 1.00 0.00 H new ATOM 2346 N LEU A 151 17.276 -9.127 2.037 1.00 0.00 N ATOM 2347 CA LEU A 151 16.070 -8.963 2.902 1.00 0.00 C ATOM 2348 C LEU A 151 16.231 -7.755 3.838 1.00 0.00 C ATOM 2349 O LEU A 151 15.318 -7.404 4.561 1.00 0.00 O ATOM 2350 CB LEU A 151 15.861 -10.231 3.735 1.00 0.00 C ATOM 2351 CG LEU A 151 15.535 -11.412 2.814 1.00 0.00 C ATOM 2352 CD1 LEU A 151 15.436 -12.696 3.644 1.00 0.00 C ATOM 2353 CD2 LEU A 151 14.199 -11.166 2.105 1.00 0.00 C ATOM 0 H LEU A 151 17.849 -9.946 2.241 1.00 0.00 H new ATOM 0 HA LEU A 151 15.204 -8.794 2.262 1.00 0.00 H new ATOM 0 HB2 LEU A 151 16.758 -10.448 4.315 1.00 0.00 H new ATOM 0 HB3 LEU A 151 15.050 -10.079 4.447 1.00 0.00 H new ATOM 0 HG LEU A 151 16.326 -11.514 2.071 1.00 0.00 H new ATOM 0 HD11 LEU A 151 15.204 -13.536 2.989 1.00 0.00 H new ATOM 0 HD12 LEU A 151 16.386 -12.879 4.146 1.00 0.00 H new ATOM 0 HD13 LEU A 151 14.647 -12.588 4.388 1.00 0.00 H new ATOM 0 HD21 LEU A 151 13.973 -12.009 1.452 1.00 0.00 H new ATOM 0 HD22 LEU A 151 13.408 -11.059 2.847 1.00 0.00 H new ATOM 0 HD23 LEU A 151 14.265 -10.254 1.511 1.00 0.00 H new ATOM 2365 N THR A 152 17.365 -7.101 3.825 1.00 0.00 N ATOM 2366 CA THR A 152 17.538 -5.908 4.703 1.00 0.00 C ATOM 2367 C THR A 152 16.682 -4.777 4.132 1.00 0.00 C ATOM 2368 O THR A 152 16.476 -4.702 2.936 1.00 0.00 O ATOM 2369 CB THR A 152 19.012 -5.487 4.717 1.00 0.00 C ATOM 2370 OG1 THR A 152 19.805 -6.567 5.190 1.00 0.00 O ATOM 2371 CG2 THR A 152 19.195 -4.277 5.634 1.00 0.00 C ATOM 0 H THR A 152 18.172 -7.340 3.249 1.00 0.00 H new ATOM 0 HA THR A 152 17.232 -6.138 5.724 1.00 0.00 H new ATOM 0 HB THR A 152 19.322 -5.221 3.707 1.00 0.00 H new ATOM 0 HG1 THR A 152 20.748 -6.301 5.198 1.00 0.00 H new ATOM 0 HG21 THR A 152 20.244 -3.981 5.641 1.00 0.00 H new ATOM 0 HG22 THR A 152 18.587 -3.449 5.270 1.00 0.00 H new ATOM 0 HG23 THR A 152 18.885 -4.537 6.646 1.00 0.00 H new ATOM 2379 N HIS A 153 16.173 -3.896 4.956 1.00 0.00 N ATOM 2380 CA HIS A 153 15.329 -2.797 4.399 1.00 0.00 C ATOM 2381 C HIS A 153 15.118 -1.687 5.430 1.00 0.00 C ATOM 2382 O HIS A 153 15.421 -1.834 6.597 1.00 0.00 O ATOM 2383 CB HIS A 153 13.971 -3.362 3.973 1.00 0.00 C ATOM 2384 CG HIS A 153 13.362 -4.145 5.105 1.00 0.00 C ATOM 2385 ND1 HIS A 153 13.919 -5.325 5.577 1.00 0.00 N ATOM 2386 CD2 HIS A 153 12.238 -3.933 5.866 1.00 0.00 C ATOM 2387 CE1 HIS A 153 13.138 -5.772 6.577 1.00 0.00 C ATOM 2388 NE2 HIS A 153 12.099 -4.961 6.794 1.00 0.00 N ATOM 0 H HIS A 153 16.301 -3.888 5.968 1.00 0.00 H new ATOM 0 HA HIS A 153 15.844 -2.372 3.537 1.00 0.00 H new ATOM 0 HB2 HIS A 153 13.305 -2.550 3.682 1.00 0.00 H new ATOM 0 HB3 HIS A 153 14.092 -4.003 3.100 1.00 0.00 H new ATOM 0 HD1 HIS A 153 14.767 -5.772 5.229 1.00 0.00 H new ATOM 0 HD2 HIS A 153 11.564 -3.096 5.760 1.00 0.00 H new ATOM 0 HE1 HIS A 153 13.328 -6.676 7.136 1.00 0.00 H new ATOM 2396 N THR A 154 14.588 -0.576 4.989 1.00 0.00 N ATOM 2397 CA THR A 154 14.338 0.569 5.909 1.00 0.00 C ATOM 2398 C THR A 154 12.903 1.072 5.708 1.00 0.00 C ATOM 2399 O THR A 154 12.340 0.946 4.638 1.00 0.00 O ATOM 2400 CB THR A 154 15.326 1.693 5.579 1.00 0.00 C ATOM 2401 OG1 THR A 154 16.604 1.133 5.312 1.00 0.00 O ATOM 2402 CG2 THR A 154 15.430 2.659 6.759 1.00 0.00 C ATOM 0 H THR A 154 14.315 -0.413 4.020 1.00 0.00 H new ATOM 0 HA THR A 154 14.470 0.254 6.944 1.00 0.00 H new ATOM 0 HB THR A 154 14.972 2.236 4.703 1.00 0.00 H new ATOM 0 HG1 THR A 154 17.237 1.850 5.099 1.00 0.00 H new ATOM 0 HG21 THR A 154 16.134 3.455 6.517 1.00 0.00 H new ATOM 0 HG22 THR A 154 14.450 3.091 6.963 1.00 0.00 H new ATOM 0 HG23 THR A 154 15.780 2.121 7.640 1.00 0.00 H new ATOM 2410 N TYR A 155 12.308 1.643 6.724 1.00 0.00 N ATOM 2411 CA TYR A 155 10.911 2.155 6.581 1.00 0.00 C ATOM 2412 C TYR A 155 10.930 3.685 6.553 1.00 0.00 C ATOM 2413 O TYR A 155 11.433 4.320 7.459 1.00 0.00 O ATOM 2414 CB TYR A 155 10.065 1.699 7.773 1.00 0.00 C ATOM 2415 CG TYR A 155 10.137 0.199 7.923 1.00 0.00 C ATOM 2416 CD1 TYR A 155 9.327 -0.624 7.131 1.00 0.00 C ATOM 2417 CD2 TYR A 155 11.005 -0.368 8.863 1.00 0.00 C ATOM 2418 CE1 TYR A 155 9.386 -2.016 7.281 1.00 0.00 C ATOM 2419 CE2 TYR A 155 11.065 -1.758 9.011 1.00 0.00 C ATOM 2420 CZ TYR A 155 10.255 -2.582 8.221 1.00 0.00 C ATOM 2421 OH TYR A 155 10.312 -3.953 8.370 1.00 0.00 O ATOM 0 H TYR A 155 12.727 1.777 7.644 1.00 0.00 H new ATOM 0 HA TYR A 155 10.485 1.767 5.656 1.00 0.00 H new ATOM 0 HB2 TYR A 155 10.420 2.180 8.685 1.00 0.00 H new ATOM 0 HB3 TYR A 155 9.029 2.008 7.632 1.00 0.00 H new ATOM 0 HD1 TYR A 155 8.657 -0.186 6.405 1.00 0.00 H new ATOM 0 HD2 TYR A 155 11.629 0.267 9.474 1.00 0.00 H new ATOM 0 HE1 TYR A 155 8.761 -2.652 6.671 1.00 0.00 H new ATOM 0 HE2 TYR A 155 11.737 -2.195 9.735 1.00 0.00 H new ATOM 0 HH TYR A 155 11.170 -4.284 8.031 1.00 0.00 H new ATOM 2431 N GLU A 156 10.388 4.286 5.526 1.00 0.00 N ATOM 2432 CA GLU A 156 10.380 5.775 5.456 1.00 0.00 C ATOM 2433 C GLU A 156 8.935 6.284 5.479 1.00 0.00 C ATOM 2434 O GLU A 156 8.122 5.910 4.657 1.00 0.00 O ATOM 2435 CB GLU A 156 11.059 6.230 4.162 1.00 0.00 C ATOM 2436 CG GLU A 156 12.519 5.772 4.159 1.00 0.00 C ATOM 2437 CD GLU A 156 13.250 6.405 2.974 1.00 0.00 C ATOM 2438 OE1 GLU A 156 13.130 7.607 2.803 1.00 0.00 O ATOM 2439 OE2 GLU A 156 13.917 5.677 2.258 1.00 0.00 O ATOM 0 H GLU A 156 9.952 3.811 4.736 1.00 0.00 H new ATOM 0 HA GLU A 156 10.920 6.179 6.312 1.00 0.00 H new ATOM 0 HB2 GLU A 156 10.536 5.816 3.300 1.00 0.00 H new ATOM 0 HB3 GLU A 156 11.008 7.315 4.075 1.00 0.00 H new ATOM 0 HG2 GLU A 156 13.003 6.058 5.093 1.00 0.00 H new ATOM 0 HG3 GLU A 156 12.570 4.685 4.093 1.00 0.00 H new ATOM 2446 N VAL A 157 8.615 7.140 6.413 1.00 0.00 N ATOM 2447 CA VAL A 157 7.227 7.684 6.494 1.00 0.00 C ATOM 2448 C VAL A 157 7.253 9.175 6.153 1.00 0.00 C ATOM 2449 O VAL A 157 7.998 9.938 6.736 1.00 0.00 O ATOM 2450 CB VAL A 157 6.686 7.492 7.913 1.00 0.00 C ATOM 2451 CG1 VAL A 157 5.229 7.954 7.975 1.00 0.00 C ATOM 2452 CG2 VAL A 157 6.766 6.011 8.291 1.00 0.00 C ATOM 0 H VAL A 157 9.257 7.487 7.126 1.00 0.00 H new ATOM 0 HA VAL A 157 6.583 7.158 5.789 1.00 0.00 H new ATOM 0 HB VAL A 157 7.282 8.081 8.610 1.00 0.00 H new ATOM 0 HG11 VAL A 157 4.846 7.816 8.986 1.00 0.00 H new ATOM 0 HG12 VAL A 157 5.170 9.008 7.705 1.00 0.00 H new ATOM 0 HG13 VAL A 157 4.631 7.367 7.278 1.00 0.00 H new ATOM 0 HG21 VAL A 157 6.381 5.872 9.301 1.00 0.00 H new ATOM 0 HG22 VAL A 157 6.170 5.424 7.592 1.00 0.00 H new ATOM 0 HG23 VAL A 157 7.804 5.680 8.249 1.00 0.00 H new ATOM 2462 N TRP A 158 6.451 9.600 5.212 1.00 0.00 N ATOM 2463 CA TRP A 158 6.446 11.043 4.837 1.00 0.00 C ATOM 2464 C TRP A 158 5.084 11.668 5.147 1.00 0.00 C ATOM 2465 O TRP A 158 4.092 10.985 5.308 1.00 0.00 O ATOM 2466 CB TRP A 158 6.725 11.184 3.339 1.00 0.00 C ATOM 2467 CG TRP A 158 8.022 10.523 3.000 1.00 0.00 C ATOM 2468 CD1 TRP A 158 8.254 9.192 3.056 1.00 0.00 C ATOM 2469 CD2 TRP A 158 9.263 11.137 2.549 1.00 0.00 C ATOM 2470 NE1 TRP A 158 9.560 8.950 2.669 1.00 0.00 N ATOM 2471 CE2 TRP A 158 10.223 10.117 2.348 1.00 0.00 C ATOM 2472 CE3 TRP A 158 9.647 12.467 2.299 1.00 0.00 C ATOM 2473 CZ2 TRP A 158 11.517 10.406 1.913 1.00 0.00 C ATOM 2474 CZ3 TRP A 158 10.948 12.762 1.862 1.00 0.00 C ATOM 2475 CH2 TRP A 158 11.881 11.733 1.669 1.00 0.00 C ATOM 0 H TRP A 158 5.802 9.012 4.689 1.00 0.00 H new ATOM 0 HA TRP A 158 7.218 11.555 5.412 1.00 0.00 H new ATOM 0 HB2 TRP A 158 5.916 10.733 2.765 1.00 0.00 H new ATOM 0 HB3 TRP A 158 6.761 12.238 3.064 1.00 0.00 H new ATOM 0 HD1 TRP A 158 7.537 8.441 3.354 1.00 0.00 H new ATOM 0 HE1 TRP A 158 9.981 8.022 2.626 1.00 0.00 H new ATOM 0 HE3 TRP A 158 8.936 13.267 2.444 1.00 0.00 H new ATOM 0 HZ2 TRP A 158 12.232 9.610 1.766 1.00 0.00 H new ATOM 0 HZ3 TRP A 158 11.232 13.787 1.673 1.00 0.00 H new ATOM 0 HH2 TRP A 158 12.880 11.966 1.332 1.00 0.00 H new ATOM 2486 N GLN A 159 5.035 12.971 5.200 1.00 0.00 N ATOM 2487 CA GLN A 159 3.752 13.680 5.466 1.00 0.00 C ATOM 2488 C GLN A 159 3.690 14.904 4.551 1.00 0.00 C ATOM 2489 O GLN A 159 4.702 15.516 4.269 1.00 0.00 O ATOM 2490 CB GLN A 159 3.702 14.127 6.930 1.00 0.00 C ATOM 2491 CG GLN A 159 3.504 12.906 7.831 1.00 0.00 C ATOM 2492 CD GLN A 159 3.153 13.367 9.247 1.00 0.00 C ATOM 2493 OE1 GLN A 159 4.026 13.566 10.067 1.00 0.00 O ATOM 2494 NE2 GLN A 159 1.901 13.545 9.570 1.00 0.00 N ATOM 0 H GLN A 159 5.841 13.582 5.068 1.00 0.00 H new ATOM 0 HA GLN A 159 2.907 13.019 5.274 1.00 0.00 H new ATOM 0 HB2 GLN A 159 4.625 14.642 7.196 1.00 0.00 H new ATOM 0 HB3 GLN A 159 2.888 14.836 7.077 1.00 0.00 H new ATOM 0 HG2 GLN A 159 2.709 12.274 7.435 1.00 0.00 H new ATOM 0 HG3 GLN A 159 4.412 12.303 7.848 1.00 0.00 H new ATOM 0 HE21 GLN A 159 1.168 13.378 8.881 1.00 0.00 H new ATOM 0 HE22 GLN A 159 1.656 13.851 10.511 1.00 0.00 H new ATOM 2503 N LYS A 160 2.530 15.273 4.075 1.00 0.00 N ATOM 2504 CA LYS A 160 2.445 16.458 3.174 1.00 0.00 C ATOM 2505 C LYS A 160 2.519 17.742 4.001 1.00 0.00 C ATOM 2506 O LYS A 160 1.776 17.929 4.945 1.00 0.00 O ATOM 2507 CB LYS A 160 1.120 16.420 2.410 1.00 0.00 C ATOM 2508 CG LYS A 160 1.211 17.330 1.184 1.00 0.00 C ATOM 2509 CD LYS A 160 -0.155 17.966 0.918 1.00 0.00 C ATOM 2510 CE LYS A 160 0.034 19.364 0.323 1.00 0.00 C ATOM 2511 NZ LYS A 160 -0.606 20.373 1.213 1.00 0.00 N ATOM 0 H LYS A 160 1.643 14.808 4.270 1.00 0.00 H new ATOM 0 HA LYS A 160 3.276 16.436 2.469 1.00 0.00 H new ATOM 0 HB2 LYS A 160 0.895 15.399 2.102 1.00 0.00 H new ATOM 0 HB3 LYS A 160 0.305 16.745 3.057 1.00 0.00 H new ATOM 0 HG2 LYS A 160 1.959 18.105 1.348 1.00 0.00 H new ATOM 0 HG3 LYS A 160 1.532 16.756 0.315 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -0.730 17.343 0.233 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -0.725 18.029 1.845 1.00 0.00 H new ATOM 0 HE2 LYS A 160 1.096 19.583 0.212 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -0.407 19.410 -0.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -0.813 21.234 0.668 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -1.491 19.985 1.597 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 0.039 20.605 1.995 1.00 0.00 H new ATOM 2525 N LYS A 161 3.412 18.629 3.652 1.00 0.00 N ATOM 2526 CA LYS A 161 3.539 19.905 4.413 1.00 0.00 C ATOM 2527 C LYS A 161 2.328 20.795 4.123 1.00 0.00 C ATOM 2528 O LYS A 161 1.726 20.718 3.070 1.00 0.00 O ATOM 2529 CB LYS A 161 4.817 20.628 3.984 1.00 0.00 C ATOM 2530 CG LYS A 161 6.035 19.785 4.369 1.00 0.00 C ATOM 2531 CD LYS A 161 6.503 20.176 5.772 1.00 0.00 C ATOM 2532 CE LYS A 161 7.265 21.502 5.708 1.00 0.00 C ATOM 2533 NZ LYS A 161 6.835 22.377 6.835 1.00 0.00 N ATOM 0 H LYS A 161 4.060 18.524 2.871 1.00 0.00 H new ATOM 0 HA LYS A 161 3.584 19.689 5.480 1.00 0.00 H new ATOM 0 HB2 LYS A 161 4.806 20.800 2.908 1.00 0.00 H new ATOM 0 HB3 LYS A 161 4.872 21.606 4.463 1.00 0.00 H new ATOM 0 HG2 LYS A 161 5.781 18.725 4.341 1.00 0.00 H new ATOM 0 HG3 LYS A 161 6.839 19.939 3.650 1.00 0.00 H new ATOM 0 HD2 LYS A 161 5.646 20.269 6.439 1.00 0.00 H new ATOM 0 HD3 LYS A 161 7.144 19.396 6.183 1.00 0.00 H new ATOM 0 HE2 LYS A 161 8.338 21.320 5.764 1.00 0.00 H new ATOM 0 HE3 LYS A 161 7.075 21.997 4.756 1.00 0.00 H new ATOM 0 HZ1 LYS A 161 7.353 23.278 6.792 1.00 0.00 H new ATOM 0 HZ2 LYS A 161 5.814 22.560 6.762 1.00 0.00 H new ATOM 0 HZ3 LYS A 161 7.038 21.904 7.739 1.00 0.00 H new ATOM 2547 N ALA A 162 1.969 21.640 5.052 1.00 0.00 N ATOM 2548 CA ALA A 162 0.799 22.538 4.836 1.00 0.00 C ATOM 2549 C ALA A 162 0.963 23.803 5.680 1.00 0.00 C ATOM 2550 O ALA A 162 1.262 23.673 6.856 1.00 0.00 O ATOM 2551 CB ALA A 162 -0.484 21.814 5.248 1.00 0.00 C ATOM 2552 OXT ALA A 162 0.788 24.881 5.136 1.00 0.00 O ATOM 0 H ALA A 162 2.437 21.747 5.952 1.00 0.00 H new ATOM 0 HA ALA A 162 0.741 22.809 3.782 1.00 0.00 H new ATOM 0 HB1 ALA A 162 -1.339 22.471 5.090 1.00 0.00 H new ATOM 0 HB2 ALA A 162 -0.603 20.913 4.646 1.00 0.00 H new ATOM 0 HB3 ALA A 162 -0.426 21.542 6.302 1.00 0.00 H new TER 2558 ALA A 162 HETATM 2559 PA NDP A 168 -3.632 -2.951 -9.352 1.00 0.00 P HETATM 2560 O1A NDP A 168 -3.103 -1.721 -8.730 1.00 0.00 O HETATM 2561 O2A NDP A 168 -3.695 -4.165 -8.514 1.00 0.00 O HETATM 2562 O5B NDP A 168 -5.018 -2.679 -10.088 1.00 0.00 O HETATM 2563 C5B NDP A 168 -6.032 -1.868 -9.468 1.00 0.00 C HETATM 2564 C4B NDP A 168 -7.383 -2.156 -10.078 1.00 0.00 C HETATM 2565 O4B NDP A 168 -8.407 -1.449 -9.330 1.00 0.00 O HETATM 2566 C3B NDP A 168 -7.573 -1.695 -11.514 1.00 0.00 C HETATM 2567 O3B NDP A 168 -7.089 -2.676 -12.437 1.00 0.00 O HETATM 2568 C2B NDP A 168 -9.085 -1.538 -11.606 1.00 0.00 C HETATM 2569 O2B NDP A 168 -9.769 -2.752 -11.840 1.00 0.00 O HETATM 2570 C1B NDP A 168 -9.420 -0.998 -10.213 1.00 0.00 C HETATM 2571 N9A NDP A 168 -9.458 0.462 -10.151 1.00 0.00 N HETATM 2572 C8A NDP A 168 -8.408 1.339 -10.282 1.00 0.00 C HETATM 2573 N7A NDP A 168 -8.755 2.599 -10.177 1.00 0.00 N HETATM 2574 C5A NDP A 168 -10.126 2.550 -9.963 1.00 0.00 C HETATM 2575 C6A NDP A 168 -11.094 3.555 -9.768 1.00 0.00 C HETATM 2576 N6A NDP A 168 -10.813 4.861 -9.760 1.00 0.00 N HETATM 2577 N1A NDP A 168 -12.376 3.168 -9.581 1.00 0.00 N HETATM 2578 C2A NDP A 168 -12.658 1.857 -9.591 1.00 0.00 C HETATM 2579 N3A NDP A 168 -11.838 0.820 -9.763 1.00 0.00 N HETATM 2580 C4A NDP A 168 -10.572 1.239 -9.946 1.00 0.00 C HETATM 2581 O3 NDP A 168 -2.724 -3.286 -10.687 1.00 0.00 O HETATM 2582 PN NDP A 168 -1.170 -2.988 -11.151 1.00 0.00 P HETATM 2583 O1N NDP A 168 -1.027 -1.538 -11.388 1.00 0.00 O HETATM 2584 O2N NDP A 168 -0.835 -3.897 -12.265 1.00 0.00 O HETATM 2585 O5D NDP A 168 -0.450 -3.432 -9.801 1.00 0.00 O HETATM 2586 C5D NDP A 168 -1.005 -4.474 -8.978 1.00 0.00 C HETATM 2587 C4D NDP A 168 0.081 -5.432 -8.542 1.00 0.00 C HETATM 2588 O4D NDP A 168 1.108 -4.715 -7.806 1.00 0.00 O HETATM 2589 C3D NDP A 168 -0.345 -6.539 -7.592 1.00 0.00 C HETATM 2590 O3D NDP A 168 -0.915 -7.638 -8.309 1.00 0.00 O HETATM 2591 C2D NDP A 168 0.978 -6.931 -6.942 1.00 0.00 C HETATM 2592 O2D NDP A 168 1.753 -7.837 -7.730 1.00 0.00 O HETATM 2593 C1D NDP A 168 1.686 -5.577 -6.840 1.00 0.00 C HETATM 2594 N1N NDP A 168 1.584 -4.944 -5.524 1.00 0.00 N HETATM 2595 C2N NDP A 168 2.529 -4.389 -4.773 1.00 0.00 C HETATM 2596 C3N NDP A 168 2.381 -3.851 -3.604 1.00 0.00 C HETATM 2597 C7N NDP A 168 3.651 -3.413 -3.100 1.00 0.00 C HETATM 2598 O7N NDP A 168 3.365 -2.900 -1.923 1.00 0.00 O HETATM 2599 N7N NDP A 168 4.896 -3.488 -3.633 1.00 0.00 N HETATM 2600 C4N NDP A 168 1.002 -3.831 -3.013 1.00 0.00 C HETATM 2601 C5N NDP A 168 -0.076 -4.414 -3.766 1.00 0.00 C HETATM 2602 C6N NDP A 168 0.125 -4.994 -5.024 1.00 0.00 C HETATM 2603 P2B NDP A 168 -10.936 -3.067 -12.994 1.00 0.00 P HETATM 2604 O1X NDP A 168 -11.942 -3.855 -12.066 1.00 0.00 O HETATM 2605 O2X NDP A 168 -11.468 -1.656 -13.238 1.00 0.00 O HETATM 2606 O3X NDP A 168 -10.184 -4.057 -13.882 1.00 0.00 O HETATM 0 HO3N NDP A 168 -0.213 -8.287 -8.525 1.00 0.00 H new HETATM 0 HO3A NDP A 168 -6.799 -2.234 -13.262 1.00 0.00 H new HETATM 0 HO2N NDP A 168 1.963 -8.634 -7.200 1.00 0.00 H new HETATM 0 H72N NDP A 168 5.694 -3.116 -3.119 1.00 0.00 H new HETATM 0 H71N NDP A 168 5.034 -3.917 -4.548 1.00 0.00 H new HETATM 0 H62A NDP A 168 -11.558 5.542 -9.614 1.00 0.00 H new HETATM 0 H61A NDP A 168 -9.853 5.177 -9.900 1.00 0.00 H new HETATM 0 H52N NDP A 168 -1.488 -4.038 -8.103 1.00 0.00 H new HETATM 0 H52A NDP A 168 -6.060 -2.066 -8.397 1.00 0.00 H new HETATM 0 H51N NDP A 168 -1.774 -5.013 -9.531 1.00 0.00 H new HETATM 0 H51A NDP A 168 -5.788 -0.813 -9.591 1.00 0.00 H new HETATM 0 H42N NDP A 168 1.047 -4.340 -2.050 1.00 0.00 H new HETATM 0 H41N NDP A 168 0.742 -2.792 -2.813 1.00 0.00 H new HETATM 0 H8A NDP A 168 -7.382 1.017 -10.457 1.00 0.00 H new HETATM 0 H6N NDP A 168 -0.682 -5.444 -5.602 1.00 0.00 H new HETATM 0 H5N NDP A 168 -1.081 -4.404 -3.344 1.00 0.00 H new HETATM 0 H4D NDP A 168 0.406 -5.876 -9.483 1.00 0.00 H new HETATM 0 H4B NDP A 168 -7.454 -3.243 -10.050 1.00 0.00 H new HETATM 0 H3D NDP A 168 -1.110 -6.236 -6.877 1.00 0.00 H new HETATM 0 H3B NDP A 168 -7.028 -0.784 -11.760 1.00 0.00 H new HETATM 0 H2N NDP A 168 3.538 -4.386 -5.185 1.00 0.00 H new HETATM 0 H2D NDP A 168 0.836 -7.457 -5.998 1.00 0.00 H new HETATM 0 H2B NDP A 168 -9.386 -0.905 -12.441 1.00 0.00 H new HETATM 0 H2A NDP A 168 -13.707 1.603 -9.437 1.00 0.00 H new HETATM 0 H1D NDP A 168 2.748 -5.754 -7.011 1.00 0.00 H new HETATM 0 H1B NDP A 168 -10.414 -1.357 -9.945 1.00 0.00 H new HETATM 2633 N1 TRR A 170 3.996 -4.650 1.827 1.00 0.00 N HETATM 2634 C2 TRR A 170 3.922 -3.338 2.239 1.00 0.00 C HETATM 2635 N2 TRR A 170 5.002 -2.749 2.855 1.00 0.00 N HETATM 2636 N3 TRR A 170 2.768 -2.616 2.036 1.00 0.00 N HETATM 2637 C4 TRR A 170 1.682 -3.201 1.420 1.00 0.00 C HETATM 2638 N4 TRR A 170 0.534 -2.472 1.222 1.00 0.00 N HETATM 2639 C5 TRR A 170 1.749 -4.525 1.002 1.00 0.00 C HETATM 2640 C6 TRR A 170 2.919 -5.247 1.211 1.00 0.00 C HETATM 2641 C7 TRR A 170 0.557 -5.164 0.329 1.00 0.00 C HETATM 2642 C11 TRR A 170 0.696 -6.653 0.135 1.00 0.00 C HETATM 2643 C12 TRR A 170 1.144 -7.158 -1.086 1.00 0.00 C HETATM 2644 C13 TRR A 170 1.273 -8.543 -1.268 1.00 0.00 C HETATM 2645 C14 TRR A 170 0.951 -9.413 -0.225 1.00 0.00 C HETATM 2646 C15 TRR A 170 0.502 -8.910 0.997 1.00 0.00 C HETATM 2647 C16 TRR A 170 0.375 -7.525 1.176 1.00 0.00 C HETATM 2648 O13 TRR A 170 1.718 -9.067 -2.480 1.00 0.00 O HETATM 2649 O14 TRR A 170 1.077 -10.779 -0.403 1.00 0.00 O HETATM 2650 O15 TRR A 170 0.188 -9.795 2.027 1.00 0.00 O HETATM 2651 C17 TRR A 170 2.039 -8.193 -3.531 1.00 0.00 C HETATM 2652 C18 TRR A 170 0.473 -11.356 -1.530 1.00 0.00 C HETATM 2653 C19 TRR A 170 -0.258 -9.283 3.258 1.00 0.00 C HETATM 0 H193 TRR A 170 0.509 -8.635 3.682 1.00 0.00 H new HETATM 0 H192 TRR A 170 -1.173 -8.710 3.104 1.00 0.00 H new HETATM 0 H191 TRR A 170 -0.457 -10.106 3.944 1.00 0.00 H new HETATM 0 H183 TRR A 170 -0.601 -11.173 -1.501 1.00 0.00 H new HETATM 0 H182 TRR A 170 0.892 -10.914 -2.434 1.00 0.00 H new HETATM 0 H181 TRR A 170 0.658 -12.430 -1.532 1.00 0.00 H new HETATM 0 H173 TRR A 170 1.160 -7.606 -3.798 1.00 0.00 H new HETATM 0 H172 TRR A 170 2.840 -7.524 -3.216 1.00 0.00 H new HETATM 0 H171 TRR A 170 2.367 -8.769 -4.396 1.00 0.00 H new HETATM 0 H72 TRR A 170 -0.334 -4.966 0.924 1.00 0.00 H new HETATM 0 H71 TRR A 170 0.403 -4.693 -0.642 1.00 0.00 H new HETATM 0 H6 TRR A 170 2.983 -6.286 0.887 1.00 0.00 H new HETATM 0 H42 TRR A 170 -0.271 -2.902 0.767 1.00 0.00 H new HETATM 0 H41 TRR A 170 0.487 -1.501 1.530 1.00 0.00 H new HETATM 0 H22 TRR A 170 4.948 -1.777 3.160 1.00 0.00 H new HETATM 0 H21 TRR A 170 5.857 -3.284 3.006 1.00 0.00 H new HETATM 0 H16 TRR A 170 0.025 -7.129 2.129 1.00 0.00 H new HETATM 0 H12 TRR A 170 1.394 -6.476 -1.899 1.00 0.00 H new HETATM 0 H1 TRR A 170 4.853 -5.182 1.979 1.00 0.00 H new