USER MOD reduce.3.24.130724 H: found=0, std=0, add=886, rem=0, adj=29 USER MOD reduce.3.24.130724 removed 737 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 98 ASN : amide:sc= -2.66! C(o=-2.1!,f=-5.6!) USER MOD Set 1.2: A 100 TYR OH : rot 72:sc= 0.515 USER MOD Set 2.1: A 46 HIS : no HE2:sc= -1.53 K(o=-0.92,f=-4.1!) USER MOD Set 2.2: A 48 THR OG1 : rot 89:sc= 0.61 USER MOD Single : A 16 SER OG : rot 180:sc= 0 USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 177:sc= 0 (180deg=-0.007) USER MOD Single : A 21 THR OG1 : rot 180:sc= 0 USER MOD Single : A 25 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 GLN : amide:sc= 0 K(o=0,f=-0.57) USER MOD Single : A 30 HIS : no HD1:sc= -0.816 K(o=-0.82,f=0.085) USER MOD Single : A 31 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 33 SER OG : rot 180:sc= 0 USER MOD Single : A 38 THR OG1 : rot -50:sc= 0.975 USER MOD Single : A 39 THR OG1 : rot 92:sc= 0.837 USER MOD Single : A 43 GLN : amide:sc= -0.668 K(o=-0.67,f=-1.7) USER MOD Single : A 44 TYR OH : rot 180:sc= 0 USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 52 ASN : amide:sc= -2.92 K(o=-2.9,f=-4.2!) USER MOD Single : A 54 SER OG : rot 180:sc= -0.0452 USER MOD Single : A 57 TYR OH : rot 180:sc= -4.42! USER MOD Single : A 58 THR OG1 : rot -174:sc= 0.588 USER MOD Single : A 59 TYR OH : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -2.01 K(o=-2,f=-3.1!) USER MOD Single : A 62 THR OG1 : rot 52:sc= 0.545 USER MOD Single : A 63 THR OG1 : rot 180:sc= 0 USER MOD Single : A 66 GLN : amide:sc= -2.18! C(o=-2.2!,f=-4!) USER MOD Single : A 69 THR OG1 : rot -160:sc= 0 USER MOD Single : A 73 GLN : amide:sc= -0.291 K(o=-0.29,f=-2.2!) USER MOD Single : A 74 SER OG : rot 167:sc= -4.99! USER MOD Single : A 87 TYR OH : rot 180:sc= 0 USER MOD Single : A 89 ASN : amide:sc= -2.89! K(o=-2.9!,f=-1.3) USER MOD Single : A 92 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 93 TYR OH : rot 180:sc= 0 USER MOD Single : A 94 ASN : amide:sc= -4.41 K(o=-4.4,f=-2.7) USER MOD Single : A 95 THR OG1 : rot 180:sc= -0.433 USER MOD Single : A 96 THR OG1 : rot 180:sc= -0.0175 USER MOD Single : A 106 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 108 THR OG1 : rot 180:sc= -0.649 USER MOD Single : A 111 SER OG : rot 180:sc= 0 USER MOD Single : A 114 ASN : amide:sc= -3.7! C(o=-3.7!,f=-4.2!) USER MOD Single : A 115 TYR OH : rot -73:sc= -0.799 USER MOD Single : A 116 SER OG : rot 180:sc= 0 USER MOD Single : A 117 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD Single : A 125 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 126 GLN : amide:sc= -0.0143 X(o=-0.014,f=-0.25) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 180:sc= 0 USER MOD Single : A 132 HIS : no HD1:sc= 0 X(o=0,f=-0.097) USER MOD Single : A 133 TYR OH : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 15 -38.098 51.498 -21.434 1.00 0.00 N ATOM 2 CA GLY A 15 -36.967 50.785 -20.866 1.00 0.00 C ATOM 3 C GLY A 15 -35.998 50.333 -21.960 1.00 0.00 C ATOM 4 O GLY A 15 -35.661 51.108 -22.854 1.00 0.00 O ATOM 0 HA2 GLY A 15 -36.446 51.428 -20.157 1.00 0.00 H new ATOM 0 HA3 GLY A 15 -37.322 49.918 -20.309 1.00 0.00 H new ATOM 8 N SER A 16 -35.576 49.082 -21.853 1.00 0.00 N ATOM 9 CA SER A 16 -34.653 48.518 -22.822 1.00 0.00 C ATOM 10 C SER A 16 -33.328 49.285 -22.792 1.00 0.00 C ATOM 11 O SER A 16 -33.320 50.511 -22.690 1.00 0.00 O ATOM 12 CB SER A 16 -35.248 48.544 -24.231 1.00 0.00 C ATOM 13 OG SER A 16 -36.087 47.419 -24.476 1.00 0.00 O ATOM 0 H SER A 16 -35.857 48.443 -21.109 1.00 0.00 H new ATOM 0 HA SER A 16 -34.470 47.478 -22.553 1.00 0.00 H new ATOM 0 HB2 SER A 16 -35.822 49.461 -24.365 1.00 0.00 H new ATOM 0 HB3 SER A 16 -34.442 48.562 -24.965 1.00 0.00 H new ATOM 0 HG SER A 16 -36.449 47.473 -25.385 1.00 0.00 H new ATOM 18 N GLY A 17 -32.243 48.531 -22.881 1.00 0.00 N ATOM 19 CA GLY A 17 -30.917 49.125 -22.865 1.00 0.00 C ATOM 20 C GLY A 17 -29.882 48.142 -22.315 1.00 0.00 C ATOM 21 O GLY A 17 -29.737 47.035 -22.831 1.00 0.00 O ATOM 0 H GLY A 17 -32.254 47.514 -22.964 1.00 0.00 H new ATOM 0 HA2 GLY A 17 -30.637 49.426 -23.875 1.00 0.00 H new ATOM 0 HA3 GLY A 17 -30.927 50.028 -22.254 1.00 0.00 H new ATOM 25 N MET A 18 -29.189 48.581 -21.274 1.00 0.00 N ATOM 26 CA MET A 18 -28.173 47.753 -20.648 1.00 0.00 C ATOM 27 C MET A 18 -27.062 47.403 -21.641 1.00 0.00 C ATOM 28 O MET A 18 -27.333 47.137 -22.811 1.00 0.00 O ATOM 29 CB MET A 18 -28.813 46.466 -20.124 1.00 0.00 C ATOM 30 CG MET A 18 -29.454 46.691 -18.753 1.00 0.00 C ATOM 31 SD MET A 18 -30.732 45.478 -18.469 1.00 0.00 S ATOM 32 CE MET A 18 -32.179 46.477 -18.776 1.00 0.00 C ATOM 0 H MET A 18 -29.312 49.500 -20.849 1.00 0.00 H new ATOM 0 HA MET A 18 -27.734 48.313 -19.822 1.00 0.00 H new ATOM 0 HB2 MET A 18 -29.567 46.118 -20.829 1.00 0.00 H new ATOM 0 HB3 MET A 18 -28.058 45.683 -20.052 1.00 0.00 H new ATOM 0 HG2 MET A 18 -28.696 46.622 -17.973 1.00 0.00 H new ATOM 0 HG3 MET A 18 -29.876 47.695 -18.700 1.00 0.00 H new ATOM 0 HE1 MET A 18 -33.075 45.871 -18.642 1.00 0.00 H new ATOM 0 HE2 MET A 18 -32.199 47.313 -18.077 1.00 0.00 H new ATOM 0 HE3 MET A 18 -32.148 46.858 -19.797 1.00 0.00 H new ATOM 40 N LYS A 19 -25.838 47.417 -21.138 1.00 0.00 N ATOM 41 CA LYS A 19 -24.685 47.104 -21.967 1.00 0.00 C ATOM 42 C LYS A 19 -23.636 46.379 -21.121 1.00 0.00 C ATOM 43 O LYS A 19 -23.637 46.489 -19.896 1.00 0.00 O ATOM 44 CB LYS A 19 -24.158 48.368 -22.650 1.00 0.00 C ATOM 45 CG LYS A 19 -24.795 48.551 -24.028 1.00 0.00 C ATOM 46 CD LYS A 19 -25.614 49.842 -24.087 1.00 0.00 C ATOM 47 CE LYS A 19 -26.186 50.067 -25.487 1.00 0.00 C ATOM 48 NZ LYS A 19 -27.306 49.136 -25.747 1.00 0.00 N ATOM 0 H LYS A 19 -25.618 47.640 -20.167 1.00 0.00 H new ATOM 0 HA LYS A 19 -24.968 46.428 -22.774 1.00 0.00 H new ATOM 0 HB2 LYS A 19 -24.371 49.238 -22.028 1.00 0.00 H new ATOM 0 HB3 LYS A 19 -23.074 48.306 -22.751 1.00 0.00 H new ATOM 0 HG2 LYS A 19 -24.018 48.574 -24.792 1.00 0.00 H new ATOM 0 HG3 LYS A 19 -25.436 47.699 -24.252 1.00 0.00 H new ATOM 0 HD2 LYS A 19 -26.427 49.794 -23.362 1.00 0.00 H new ATOM 0 HD3 LYS A 19 -24.986 50.688 -23.807 1.00 0.00 H new ATOM 0 HE2 LYS A 19 -26.532 51.096 -25.584 1.00 0.00 H new ATOM 0 HE3 LYS A 19 -25.404 49.922 -26.233 1.00 0.00 H new ATOM 0 HZ1 LYS A 19 -27.715 49.337 -26.682 1.00 0.00 H new ATOM 0 HZ2 LYS A 19 -26.956 48.157 -25.726 1.00 0.00 H new ATOM 0 HZ3 LYS A 19 -28.036 49.259 -25.016 1.00 0.00 H new ATOM 58 N GLU A 20 -22.766 45.654 -21.809 1.00 0.00 N ATOM 59 CA GLU A 20 -21.713 44.912 -21.137 1.00 0.00 C ATOM 60 C GLU A 20 -20.813 44.221 -22.162 1.00 0.00 C ATOM 61 O GLU A 20 -21.134 44.183 -23.349 1.00 0.00 O ATOM 62 CB GLU A 20 -22.301 43.897 -20.153 1.00 0.00 C ATOM 63 CG GLU A 20 -21.696 44.073 -18.758 1.00 0.00 C ATOM 64 CD GLU A 20 -22.529 43.341 -17.704 1.00 0.00 C ATOM 65 OE1 GLU A 20 -22.590 42.095 -17.794 1.00 0.00 O ATOM 66 OE2 GLU A 20 -23.085 44.042 -16.832 1.00 0.00 O ATOM 0 H GLU A 20 -22.769 45.565 -22.825 1.00 0.00 H new ATOM 0 HA GLU A 20 -21.107 45.616 -20.566 1.00 0.00 H new ATOM 0 HB2 GLU A 20 -23.383 44.019 -20.102 1.00 0.00 H new ATOM 0 HB3 GLU A 20 -22.111 42.885 -20.511 1.00 0.00 H new ATOM 0 HG2 GLU A 20 -20.675 43.691 -18.749 1.00 0.00 H new ATOM 0 HG3 GLU A 20 -21.642 45.134 -18.512 1.00 0.00 H new ATOM 71 N THR A 21 -19.702 43.694 -21.668 1.00 0.00 N ATOM 72 CA THR A 21 -18.752 43.007 -22.526 1.00 0.00 C ATOM 73 C THR A 21 -18.339 41.671 -21.905 1.00 0.00 C ATOM 74 O THR A 21 -18.418 41.499 -20.689 1.00 0.00 O ATOM 75 CB THR A 21 -17.575 43.951 -22.778 1.00 0.00 C ATOM 76 OG1 THR A 21 -18.082 44.897 -23.714 1.00 0.00 O ATOM 77 CG2 THR A 21 -16.426 43.268 -23.523 1.00 0.00 C ATOM 0 H THR A 21 -19.439 43.729 -20.683 1.00 0.00 H new ATOM 0 HA THR A 21 -19.198 42.756 -23.488 1.00 0.00 H new ATOM 0 HB THR A 21 -17.211 44.339 -21.827 1.00 0.00 H new ATOM 0 HG1 THR A 21 -17.383 45.549 -23.932 1.00 0.00 H new ATOM 0 HG21 THR A 21 -15.617 43.982 -23.676 1.00 0.00 H new ATOM 0 HG22 THR A 21 -16.061 42.426 -22.935 1.00 0.00 H new ATOM 0 HG23 THR A 21 -16.781 42.909 -24.489 1.00 0.00 H new ATOM 85 N ALA A 22 -17.908 40.763 -22.767 1.00 0.00 N ATOM 86 CA ALA A 22 -17.483 39.448 -22.316 1.00 0.00 C ATOM 87 C ALA A 22 -16.031 39.214 -22.740 1.00 0.00 C ATOM 88 O ALA A 22 -15.499 39.944 -23.574 1.00 0.00 O ATOM 89 CB ALA A 22 -18.431 38.386 -22.876 1.00 0.00 C ATOM 0 H ALA A 22 -17.844 40.911 -23.774 1.00 0.00 H new ATOM 0 HA ALA A 22 -17.525 39.382 -21.229 1.00 0.00 H new ATOM 0 HB1 ALA A 22 -18.113 37.400 -22.538 1.00 0.00 H new ATOM 0 HB2 ALA A 22 -19.444 38.581 -22.524 1.00 0.00 H new ATOM 0 HB3 ALA A 22 -18.413 38.420 -23.965 1.00 0.00 H new ATOM 95 N ALA A 23 -15.431 38.193 -22.144 1.00 0.00 N ATOM 96 CA ALA A 23 -14.052 37.854 -22.450 1.00 0.00 C ATOM 97 C ALA A 23 -13.950 36.353 -22.728 1.00 0.00 C ATOM 98 O ALA A 23 -14.934 35.626 -22.598 1.00 0.00 O ATOM 99 CB ALA A 23 -13.151 38.296 -21.295 1.00 0.00 C ATOM 0 H ALA A 23 -15.875 37.590 -21.451 1.00 0.00 H new ATOM 0 HA ALA A 23 -13.717 38.378 -23.345 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -12.116 38.042 -21.523 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -13.238 39.374 -21.157 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -13.456 37.787 -20.380 1.00 0.00 H new ATOM 105 N ALA A 24 -12.751 35.934 -23.107 1.00 0.00 N ATOM 106 CA ALA A 24 -12.508 34.533 -23.405 1.00 0.00 C ATOM 107 C ALA A 24 -11.274 34.059 -22.634 1.00 0.00 C ATOM 108 O ALA A 24 -11.289 34.002 -21.405 1.00 0.00 O ATOM 109 CB ALA A 24 -12.357 34.351 -24.916 1.00 0.00 C ATOM 0 H ALA A 24 -11.938 36.540 -23.214 1.00 0.00 H new ATOM 0 HA ALA A 24 -13.351 33.921 -23.086 1.00 0.00 H new ATOM 0 HB1 ALA A 24 -12.175 33.300 -25.139 1.00 0.00 H new ATOM 0 HB2 ALA A 24 -13.271 34.675 -25.415 1.00 0.00 H new ATOM 0 HB3 ALA A 24 -11.518 34.949 -25.272 1.00 0.00 H new ATOM 115 N LYS A 25 -10.235 33.730 -23.388 1.00 0.00 N ATOM 116 CA LYS A 25 -8.995 33.264 -22.791 1.00 0.00 C ATOM 117 C LYS A 25 -9.257 31.955 -22.042 1.00 0.00 C ATOM 118 O LYS A 25 -10.361 31.727 -21.550 1.00 0.00 O ATOM 119 CB LYS A 25 -8.374 34.358 -21.921 1.00 0.00 C ATOM 120 CG LYS A 25 -7.298 35.126 -22.690 1.00 0.00 C ATOM 121 CD LYS A 25 -7.729 36.571 -22.943 1.00 0.00 C ATOM 122 CE LYS A 25 -6.514 37.492 -23.071 1.00 0.00 C ATOM 123 NZ LYS A 25 -6.403 38.014 -24.452 1.00 0.00 N ATOM 0 H LYS A 25 -10.227 33.777 -24.407 1.00 0.00 H new ATOM 0 HA LYS A 25 -8.257 33.048 -23.563 1.00 0.00 H new ATOM 0 HB2 LYS A 25 -9.150 35.047 -21.589 1.00 0.00 H new ATOM 0 HB3 LYS A 25 -7.939 33.913 -21.026 1.00 0.00 H new ATOM 0 HG2 LYS A 25 -6.365 35.115 -22.126 1.00 0.00 H new ATOM 0 HG3 LYS A 25 -7.102 34.630 -23.640 1.00 0.00 H new ATOM 0 HD2 LYS A 25 -8.326 36.622 -23.854 1.00 0.00 H new ATOM 0 HD3 LYS A 25 -8.364 36.913 -22.126 1.00 0.00 H new ATOM 0 HE2 LYS A 25 -6.603 38.321 -22.369 1.00 0.00 H new ATOM 0 HE3 LYS A 25 -5.608 36.947 -22.808 1.00 0.00 H new ATOM 0 HZ1 LYS A 25 -5.573 38.637 -24.522 1.00 0.00 H new ATOM 0 HZ2 LYS A 25 -6.297 37.220 -25.116 1.00 0.00 H new ATOM 0 HZ3 LYS A 25 -7.261 38.552 -24.690 1.00 0.00 H new ATOM 133 N PHE A 26 -8.221 31.130 -21.978 1.00 0.00 N ATOM 134 CA PHE A 26 -8.326 29.851 -21.298 1.00 0.00 C ATOM 135 C PHE A 26 -7.320 29.759 -20.148 1.00 0.00 C ATOM 136 O PHE A 26 -6.511 30.664 -19.953 1.00 0.00 O ATOM 137 CB PHE A 26 -8.002 28.768 -22.329 1.00 0.00 C ATOM 138 CG PHE A 26 -9.232 28.203 -23.044 1.00 0.00 C ATOM 139 CD1 PHE A 26 -9.699 28.805 -24.170 1.00 0.00 C ATOM 140 CD2 PHE A 26 -9.857 27.100 -22.553 1.00 0.00 C ATOM 141 CE1 PHE A 26 -10.840 28.281 -24.834 1.00 0.00 C ATOM 142 CE2 PHE A 26 -10.998 26.575 -23.217 1.00 0.00 C ATOM 143 CZ PHE A 26 -11.465 27.178 -24.343 1.00 0.00 C ATOM 0 H PHE A 26 -7.306 31.323 -22.386 1.00 0.00 H new ATOM 0 HA PHE A 26 -9.327 29.731 -20.883 1.00 0.00 H new ATOM 0 HB2 PHE A 26 -7.320 29.180 -23.072 1.00 0.00 H new ATOM 0 HB3 PHE A 26 -7.477 27.953 -21.832 1.00 0.00 H new ATOM 0 HD1 PHE A 26 -9.202 29.681 -24.559 1.00 0.00 H new ATOM 0 HD2 PHE A 26 -9.486 26.623 -21.658 1.00 0.00 H new ATOM 0 HE1 PHE A 26 -11.211 28.759 -25.729 1.00 0.00 H new ATOM 0 HE2 PHE A 26 -11.494 25.698 -22.828 1.00 0.00 H new ATOM 0 HZ PHE A 26 -12.333 26.780 -24.848 1.00 0.00 H new ATOM 152 N GLU A 27 -7.405 28.658 -19.417 1.00 0.00 N ATOM 153 CA GLU A 27 -6.514 28.435 -18.291 1.00 0.00 C ATOM 154 C GLU A 27 -6.078 26.970 -18.240 1.00 0.00 C ATOM 155 O GLU A 27 -6.723 26.150 -17.588 1.00 0.00 O ATOM 156 CB GLU A 27 -7.174 28.858 -16.978 1.00 0.00 C ATOM 157 CG GLU A 27 -6.850 30.315 -16.645 1.00 0.00 C ATOM 158 CD GLU A 27 -5.685 30.407 -15.657 1.00 0.00 C ATOM 159 OE1 GLU A 27 -4.532 30.310 -16.127 1.00 0.00 O ATOM 160 OE2 GLU A 27 -5.975 30.574 -14.451 1.00 0.00 O ATOM 0 H GLU A 27 -8.078 27.910 -19.583 1.00 0.00 H new ATOM 0 HA GLU A 27 -5.626 29.052 -18.428 1.00 0.00 H new ATOM 0 HB2 GLU A 27 -8.254 28.730 -17.052 1.00 0.00 H new ATOM 0 HB3 GLU A 27 -6.831 28.212 -16.170 1.00 0.00 H new ATOM 0 HG2 GLU A 27 -6.599 30.853 -17.559 1.00 0.00 H new ATOM 0 HG3 GLU A 27 -7.730 30.799 -16.221 1.00 0.00 H new ATOM 165 N ARG A 28 -4.987 26.685 -18.935 1.00 0.00 N ATOM 166 CA ARG A 28 -4.459 25.332 -18.978 1.00 0.00 C ATOM 167 C ARG A 28 -4.433 24.729 -17.572 1.00 0.00 C ATOM 168 O ARG A 28 -4.662 25.430 -16.587 1.00 0.00 O ATOM 169 CB ARG A 28 -3.044 25.311 -19.560 1.00 0.00 C ATOM 170 CG ARG A 28 -3.074 25.493 -21.078 1.00 0.00 C ATOM 171 CD ARG A 28 -2.659 26.913 -21.469 1.00 0.00 C ATOM 172 NE ARG A 28 -1.302 26.900 -22.060 1.00 0.00 N ATOM 173 CZ ARG A 28 -0.996 26.321 -23.228 1.00 0.00 C ATOM 174 NH1 ARG A 28 -1.949 25.704 -23.940 1.00 0.00 N ATOM 175 NH2 ARG A 28 0.262 26.359 -23.686 1.00 0.00 N ATOM 0 H ARG A 28 -4.454 27.368 -19.473 1.00 0.00 H new ATOM 0 HA ARG A 28 -5.112 24.741 -19.620 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -2.449 26.103 -19.107 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -2.559 24.367 -19.313 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -2.404 24.772 -21.547 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -4.077 25.287 -21.453 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -3.372 27.325 -22.183 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -2.676 27.560 -20.592 1.00 0.00 H new ATOM 0 HE ARG A 28 -0.552 27.361 -21.545 1.00 0.00 H new ATOM 0 HH11 ARG A 28 -2.907 25.675 -23.592 1.00 0.00 H new ATOM 0 HH12 ARG A 28 -1.716 25.263 -24.830 1.00 0.00 H new ATOM 0 HH21 ARG A 28 0.988 26.829 -23.145 1.00 0.00 H new ATOM 0 HH22 ARG A 28 0.494 25.918 -24.576 1.00 0.00 H new ATOM 186 N GLN A 29 -4.153 23.434 -17.524 1.00 0.00 N ATOM 187 CA GLN A 29 -4.094 22.728 -16.255 1.00 0.00 C ATOM 188 C GLN A 29 -2.831 23.122 -15.486 1.00 0.00 C ATOM 189 O GLN A 29 -2.901 23.473 -14.310 1.00 0.00 O ATOM 190 CB GLN A 29 -4.158 21.215 -16.467 1.00 0.00 C ATOM 191 CG GLN A 29 -4.718 20.510 -15.228 1.00 0.00 C ATOM 192 CD GLN A 29 -5.191 19.096 -15.568 1.00 0.00 C ATOM 193 OE1 GLN A 29 -4.798 18.504 -16.560 1.00 0.00 O ATOM 194 NE2 GLN A 29 -6.055 18.590 -14.692 1.00 0.00 N ATOM 0 H GLN A 29 -3.965 22.856 -18.343 1.00 0.00 H new ATOM 0 HA GLN A 29 -4.961 23.015 -15.661 1.00 0.00 H new ATOM 0 HB2 GLN A 29 -4.784 20.991 -17.331 1.00 0.00 H new ATOM 0 HB3 GLN A 29 -3.161 20.833 -16.688 1.00 0.00 H new ATOM 0 HG2 GLN A 29 -3.952 20.465 -14.454 1.00 0.00 H new ATOM 0 HG3 GLN A 29 -5.548 21.087 -14.821 1.00 0.00 H new ATOM 0 HE21 GLN A 29 -6.342 19.140 -13.883 1.00 0.00 H new ATOM 0 HE22 GLN A 29 -6.431 17.652 -14.830 1.00 0.00 H new ATOM 201 N HIS A 30 -1.707 23.049 -16.182 1.00 0.00 N ATOM 202 CA HIS A 30 -0.430 23.393 -15.580 1.00 0.00 C ATOM 203 C HIS A 30 -0.103 22.396 -14.468 1.00 0.00 C ATOM 204 O HIS A 30 -0.932 21.560 -14.113 1.00 0.00 O ATOM 205 CB HIS A 30 -0.432 24.844 -15.095 1.00 0.00 C ATOM 206 CG HIS A 30 0.887 25.555 -15.278 1.00 0.00 C ATOM 207 ND1 HIS A 30 1.162 26.357 -16.371 1.00 0.00 N ATOM 208 CD2 HIS A 30 2.005 25.575 -14.495 1.00 0.00 C ATOM 209 CE1 HIS A 30 2.391 26.834 -16.242 1.00 0.00 C ATOM 210 NE2 HIS A 30 2.913 26.347 -15.080 1.00 0.00 N ATOM 0 H HIS A 30 -1.653 22.757 -17.158 1.00 0.00 H new ATOM 0 HA HIS A 30 0.360 23.322 -16.327 1.00 0.00 H new ATOM 0 HB2 HIS A 30 -1.207 25.394 -15.630 1.00 0.00 H new ATOM 0 HB3 HIS A 30 -0.699 24.863 -14.038 1.00 0.00 H new ATOM 0 HD2 HIS A 30 2.130 25.052 -13.559 1.00 0.00 H new ATOM 0 HE1 HIS A 30 2.892 27.493 -16.936 1.00 0.00 H new ATOM 0 HE2 HIS A 30 3.847 26.543 -14.720 1.00 0.00 H new ATOM 217 N MET A 31 1.111 22.516 -13.948 1.00 0.00 N ATOM 218 CA MET A 31 1.558 21.636 -12.882 1.00 0.00 C ATOM 219 C MET A 31 1.692 22.396 -11.561 1.00 0.00 C ATOM 220 O MET A 31 1.455 23.603 -11.509 1.00 0.00 O ATOM 221 CB MET A 31 2.910 21.025 -13.259 1.00 0.00 C ATOM 222 CG MET A 31 2.864 19.498 -13.176 1.00 0.00 C ATOM 223 SD MET A 31 4.509 18.827 -13.347 1.00 0.00 S ATOM 224 CE MET A 31 4.219 17.620 -14.630 1.00 0.00 C ATOM 0 H MET A 31 1.798 23.209 -14.245 1.00 0.00 H new ATOM 0 HA MET A 31 0.816 20.849 -12.751 1.00 0.00 H new ATOM 0 HB2 MET A 31 3.182 21.330 -14.270 1.00 0.00 H new ATOM 0 HB3 MET A 31 3.684 21.406 -12.592 1.00 0.00 H new ATOM 0 HG2 MET A 31 2.434 19.190 -12.223 1.00 0.00 H new ATOM 0 HG3 MET A 31 2.218 19.102 -13.960 1.00 0.00 H new ATOM 0 HE1 MET A 31 5.151 17.104 -14.861 1.00 0.00 H new ATOM 0 HE2 MET A 31 3.479 16.897 -14.288 1.00 0.00 H new ATOM 0 HE3 MET A 31 3.850 18.122 -15.525 1.00 0.00 H new ATOM 232 N ASP A 32 2.072 21.660 -10.527 1.00 0.00 N ATOM 233 CA ASP A 32 2.240 22.251 -9.210 1.00 0.00 C ATOM 234 C ASP A 32 3.732 22.380 -8.900 1.00 0.00 C ATOM 235 O ASP A 32 4.566 21.806 -9.599 1.00 0.00 O ATOM 236 CB ASP A 32 1.607 21.374 -8.128 1.00 0.00 C ATOM 237 CG ASP A 32 1.950 19.885 -8.220 1.00 0.00 C ATOM 238 OD1 ASP A 32 1.295 19.202 -9.038 1.00 0.00 O ATOM 239 OD2 ASP A 32 2.858 19.465 -7.472 1.00 0.00 O ATOM 0 H ASP A 32 2.268 20.660 -10.574 1.00 0.00 H new ATOM 0 HA ASP A 32 1.754 23.227 -9.214 1.00 0.00 H new ATOM 0 HB2 ASP A 32 1.921 21.744 -7.152 1.00 0.00 H new ATOM 0 HB3 ASP A 32 0.524 21.486 -8.178 1.00 0.00 H new ATOM 243 N SER A 33 4.024 23.138 -7.854 1.00 0.00 N ATOM 244 CA SER A 33 5.401 23.350 -7.443 1.00 0.00 C ATOM 245 C SER A 33 5.777 22.359 -6.339 1.00 0.00 C ATOM 246 O SER A 33 4.930 21.966 -5.539 1.00 0.00 O ATOM 247 CB SER A 33 5.618 24.787 -6.964 1.00 0.00 C ATOM 248 OG SER A 33 6.222 25.599 -7.967 1.00 0.00 O ATOM 0 H SER A 33 3.329 23.614 -7.278 1.00 0.00 H new ATOM 0 HA SER A 33 6.045 23.183 -8.306 1.00 0.00 H new ATOM 0 HB2 SER A 33 4.661 25.221 -6.674 1.00 0.00 H new ATOM 0 HB3 SER A 33 6.248 24.781 -6.074 1.00 0.00 H new ATOM 0 HG SER A 33 6.342 26.509 -7.623 1.00 0.00 H new ATOM 253 N PRO A 34 7.082 21.975 -6.331 1.00 0.00 N ATOM 254 CA PRO A 34 7.580 21.039 -5.338 1.00 0.00 C ATOM 255 C PRO A 34 7.734 21.715 -3.975 1.00 0.00 C ATOM 256 O PRO A 34 7.541 22.924 -3.852 1.00 0.00 O ATOM 257 CB PRO A 34 8.897 20.531 -5.902 1.00 0.00 C ATOM 258 CG PRO A 34 9.314 21.541 -6.959 1.00 0.00 C ATOM 259 CD PRO A 34 8.113 22.421 -7.262 1.00 0.00 C ATOM 0 HA PRO A 34 6.893 20.212 -5.158 1.00 0.00 H new ATOM 0 HB2 PRO A 34 9.652 20.450 -5.120 1.00 0.00 H new ATOM 0 HB3 PRO A 34 8.779 19.538 -6.335 1.00 0.00 H new ATOM 0 HG2 PRO A 34 10.149 22.144 -6.602 1.00 0.00 H new ATOM 0 HG3 PRO A 34 9.651 21.032 -7.862 1.00 0.00 H new ATOM 0 HD2 PRO A 34 8.348 23.475 -7.117 1.00 0.00 H new ATOM 0 HD3 PRO A 34 7.789 22.306 -8.296 1.00 0.00 H new ATOM 264 N ASP A 35 8.081 20.906 -2.985 1.00 0.00 N ATOM 265 CA ASP A 35 8.264 21.412 -1.634 1.00 0.00 C ATOM 266 C ASP A 35 7.141 22.399 -1.308 1.00 0.00 C ATOM 267 O ASP A 35 7.228 23.577 -1.650 1.00 0.00 O ATOM 268 CB ASP A 35 9.597 22.149 -1.499 1.00 0.00 C ATOM 269 CG ASP A 35 10.536 22.014 -2.698 1.00 0.00 C ATOM 270 OD1 ASP A 35 10.282 22.717 -3.700 1.00 0.00 O ATOM 271 OD2 ASP A 35 11.488 21.211 -2.587 1.00 0.00 O ATOM 0 H ASP A 35 8.240 19.904 -3.091 1.00 0.00 H new ATOM 0 HA ASP A 35 8.251 20.563 -0.950 1.00 0.00 H new ATOM 0 HB2 ASP A 35 9.394 23.207 -1.333 1.00 0.00 H new ATOM 0 HB3 ASP A 35 10.111 21.780 -0.611 1.00 0.00 H new ATOM 275 N LEU A 36 6.115 21.881 -0.650 1.00 0.00 N ATOM 276 CA LEU A 36 4.977 22.703 -0.273 1.00 0.00 C ATOM 277 C LEU A 36 3.979 21.853 0.517 1.00 0.00 C ATOM 278 O LEU A 36 3.428 22.306 1.519 1.00 0.00 O ATOM 279 CB LEU A 36 4.371 23.375 -1.506 1.00 0.00 C ATOM 280 CG LEU A 36 4.378 24.906 -1.506 1.00 0.00 C ATOM 281 CD1 LEU A 36 4.483 25.453 -2.932 1.00 0.00 C ATOM 282 CD2 LEU A 36 3.159 25.460 -0.768 1.00 0.00 C ATOM 0 H LEU A 36 6.047 20.903 -0.368 1.00 0.00 H new ATOM 0 HA LEU A 36 5.293 23.515 0.382 1.00 0.00 H new ATOM 0 HB2 LEU A 36 4.912 23.029 -2.387 1.00 0.00 H new ATOM 0 HB3 LEU A 36 3.340 23.036 -1.611 1.00 0.00 H new ATOM 0 HG LEU A 36 5.262 25.244 -0.965 1.00 0.00 H new ATOM 0 HD11 LEU A 36 4.486 26.543 -2.904 1.00 0.00 H new ATOM 0 HD12 LEU A 36 5.406 25.099 -3.390 1.00 0.00 H new ATOM 0 HD13 LEU A 36 3.631 25.107 -3.518 1.00 0.00 H new ATOM 0 HD21 LEU A 36 3.189 26.549 -0.783 1.00 0.00 H new ATOM 0 HD22 LEU A 36 2.249 25.115 -1.259 1.00 0.00 H new ATOM 0 HD23 LEU A 36 3.169 25.111 0.265 1.00 0.00 H new ATOM 293 N GLY A 37 3.778 20.634 0.036 1.00 0.00 N ATOM 294 CA GLY A 37 2.856 19.717 0.685 1.00 0.00 C ATOM 295 C GLY A 37 3.238 19.502 2.152 1.00 0.00 C ATOM 296 O GLY A 37 2.571 20.012 3.051 1.00 0.00 O ATOM 0 H GLY A 37 4.238 20.261 -0.795 1.00 0.00 H new ATOM 0 HA2 GLY A 37 1.842 20.111 0.624 1.00 0.00 H new ATOM 0 HA3 GLY A 37 2.859 18.761 0.161 1.00 0.00 H new ATOM 300 N THR A 38 4.309 18.747 2.347 1.00 0.00 N ATOM 301 CA THR A 38 4.787 18.458 3.688 1.00 0.00 C ATOM 302 C THR A 38 3.636 17.969 4.570 1.00 0.00 C ATOM 303 O THR A 38 3.702 18.068 5.795 1.00 0.00 O ATOM 304 CB THR A 38 5.473 19.716 4.226 1.00 0.00 C ATOM 305 OG1 THR A 38 6.048 19.296 5.460 1.00 0.00 O ATOM 306 CG2 THR A 38 4.473 20.801 4.631 1.00 0.00 C ATOM 0 H THR A 38 4.859 18.327 1.598 1.00 0.00 H new ATOM 0 HA THR A 38 5.517 17.649 3.683 1.00 0.00 H new ATOM 0 HB THR A 38 6.151 20.112 3.470 1.00 0.00 H new ATOM 0 HG1 THR A 38 5.369 18.838 5.998 1.00 0.00 H new ATOM 0 HG21 THR A 38 5.012 21.671 5.006 1.00 0.00 H new ATOM 0 HG22 THR A 38 3.877 21.088 3.765 1.00 0.00 H new ATOM 0 HG23 THR A 38 3.816 20.417 5.412 1.00 0.00 H new ATOM 314 N THR A 39 2.608 17.451 3.914 1.00 0.00 N ATOM 315 CA THR A 39 1.445 16.946 4.623 1.00 0.00 C ATOM 316 C THR A 39 1.129 15.517 4.179 1.00 0.00 C ATOM 317 O THR A 39 2.036 14.735 3.899 1.00 0.00 O ATOM 318 CB THR A 39 0.290 17.924 4.394 1.00 0.00 C ATOM 319 OG1 THR A 39 0.892 19.209 4.531 1.00 0.00 O ATOM 320 CG2 THR A 39 -0.747 17.876 5.517 1.00 0.00 C ATOM 0 H THR A 39 2.557 17.370 2.899 1.00 0.00 H new ATOM 0 HA THR A 39 1.631 16.886 5.695 1.00 0.00 H new ATOM 0 HB THR A 39 -0.194 17.700 3.443 1.00 0.00 H new ATOM 0 HG1 THR A 39 1.188 19.527 3.653 1.00 0.00 H new ATOM 0 HG21 THR A 39 -1.545 18.588 5.306 1.00 0.00 H new ATOM 0 HG22 THR A 39 -1.165 16.872 5.583 1.00 0.00 H new ATOM 0 HG23 THR A 39 -0.271 18.134 6.463 1.00 0.00 H new ATOM 328 N LEU A 40 -0.162 15.220 4.127 1.00 0.00 N ATOM 329 CA LEU A 40 -0.609 13.898 3.721 1.00 0.00 C ATOM 330 C LEU A 40 -0.366 13.721 2.220 1.00 0.00 C ATOM 331 O LEU A 40 0.122 12.679 1.786 1.00 0.00 O ATOM 332 CB LEU A 40 -2.063 13.673 4.140 1.00 0.00 C ATOM 333 CG LEU A 40 -2.500 14.354 5.439 1.00 0.00 C ATOM 334 CD1 LEU A 40 -3.896 13.889 5.859 1.00 0.00 C ATOM 335 CD2 LEU A 40 -1.467 14.137 6.546 1.00 0.00 C ATOM 0 H LEU A 40 -0.912 15.872 4.359 1.00 0.00 H new ATOM 0 HA LEU A 40 -0.032 13.127 4.231 1.00 0.00 H new ATOM 0 HB2 LEU A 40 -2.710 14.021 3.335 1.00 0.00 H new ATOM 0 HB3 LEU A 40 -2.229 12.601 4.242 1.00 0.00 H new ATOM 0 HG LEU A 40 -2.559 15.427 5.259 1.00 0.00 H new ATOM 0 HD11 LEU A 40 -4.182 14.388 6.785 1.00 0.00 H new ATOM 0 HD12 LEU A 40 -4.613 14.137 5.076 1.00 0.00 H new ATOM 0 HD13 LEU A 40 -3.888 12.810 6.016 1.00 0.00 H new ATOM 0 HD21 LEU A 40 -1.802 14.631 7.458 1.00 0.00 H new ATOM 0 HD22 LEU A 40 -1.353 13.069 6.733 1.00 0.00 H new ATOM 0 HD23 LEU A 40 -0.509 14.556 6.237 1.00 0.00 H new ATOM 346 N LEU A 41 -0.719 14.754 1.471 1.00 0.00 N ATOM 347 CA LEU A 41 -0.547 14.725 0.028 1.00 0.00 C ATOM 348 C LEU A 41 -1.591 13.792 -0.588 1.00 0.00 C ATOM 349 O LEU A 41 -1.540 13.500 -1.781 1.00 0.00 O ATOM 350 CB LEU A 41 0.895 14.359 -0.332 1.00 0.00 C ATOM 351 CG LEU A 41 1.981 14.947 0.572 1.00 0.00 C ATOM 352 CD1 LEU A 41 3.147 13.970 0.733 1.00 0.00 C ATOM 353 CD2 LEU A 41 2.444 16.311 0.056 1.00 0.00 C ATOM 0 H LEU A 41 -1.123 15.617 1.835 1.00 0.00 H new ATOM 0 HA LEU A 41 -0.716 15.715 -0.396 1.00 0.00 H new ATOM 0 HB2 LEU A 41 0.988 13.273 -0.319 1.00 0.00 H new ATOM 0 HB3 LEU A 41 1.087 14.683 -1.355 1.00 0.00 H new ATOM 0 HG LEU A 41 1.553 15.105 1.562 1.00 0.00 H new ATOM 0 HD11 LEU A 41 3.905 14.412 1.380 1.00 0.00 H new ATOM 0 HD12 LEU A 41 2.786 13.043 1.178 1.00 0.00 H new ATOM 0 HD13 LEU A 41 3.582 13.758 -0.244 1.00 0.00 H new ATOM 0 HD21 LEU A 41 3.216 16.707 0.716 1.00 0.00 H new ATOM 0 HD22 LEU A 41 2.849 16.201 -0.950 1.00 0.00 H new ATOM 0 HD23 LEU A 41 1.598 16.998 0.034 1.00 0.00 H new ATOM 364 N GLU A 42 -2.513 13.349 0.254 1.00 0.00 N ATOM 365 CA GLU A 42 -3.567 12.454 -0.193 1.00 0.00 C ATOM 366 C GLU A 42 -4.939 13.083 0.059 1.00 0.00 C ATOM 367 O GLU A 42 -5.939 12.376 0.169 1.00 0.00 O ATOM 368 CB GLU A 42 -3.455 11.091 0.491 1.00 0.00 C ATOM 369 CG GLU A 42 -2.318 10.265 -0.113 1.00 0.00 C ATOM 370 CD GLU A 42 -0.959 10.746 0.399 1.00 0.00 C ATOM 371 OE1 GLU A 42 -0.614 10.363 1.538 1.00 0.00 O ATOM 372 OE2 GLU A 42 -0.295 11.485 -0.360 1.00 0.00 O ATOM 0 H GLU A 42 -2.552 13.593 1.244 1.00 0.00 H new ATOM 0 HA GLU A 42 -3.453 12.296 -1.265 1.00 0.00 H new ATOM 0 HB2 GLU A 42 -3.281 11.229 1.558 1.00 0.00 H new ATOM 0 HB3 GLU A 42 -4.396 10.550 0.388 1.00 0.00 H new ATOM 0 HG2 GLU A 42 -2.454 9.213 0.139 1.00 0.00 H new ATOM 0 HG3 GLU A 42 -2.348 10.339 -1.200 1.00 0.00 H new ATOM 377 N GLN A 43 -4.942 14.406 0.143 1.00 0.00 N ATOM 378 CA GLN A 43 -6.175 15.138 0.379 1.00 0.00 C ATOM 379 C GLN A 43 -7.327 14.502 -0.401 1.00 0.00 C ATOM 380 O GLN A 43 -7.424 14.668 -1.617 1.00 0.00 O ATOM 381 CB GLN A 43 -6.014 16.615 0.015 1.00 0.00 C ATOM 382 CG GLN A 43 -5.166 17.348 1.056 1.00 0.00 C ATOM 383 CD GLN A 43 -5.788 17.233 2.449 1.00 0.00 C ATOM 384 OE1 GLN A 43 -6.980 17.031 2.610 1.00 0.00 O ATOM 385 NE2 GLN A 43 -4.916 17.372 3.444 1.00 0.00 N ATOM 0 H GLN A 43 -4.110 14.989 0.052 1.00 0.00 H new ATOM 0 HA GLN A 43 -6.409 15.084 1.442 1.00 0.00 H new ATOM 0 HB2 GLN A 43 -5.547 16.702 -0.966 1.00 0.00 H new ATOM 0 HB3 GLN A 43 -6.995 17.085 -0.056 1.00 0.00 H new ATOM 0 HG2 GLN A 43 -4.159 16.932 1.068 1.00 0.00 H new ATOM 0 HG3 GLN A 43 -5.074 18.399 0.781 1.00 0.00 H new ATOM 0 HE21 GLN A 43 -3.931 17.539 3.239 1.00 0.00 H new ATOM 0 HE22 GLN A 43 -5.232 17.311 4.412 1.00 0.00 H new ATOM 392 N TYR A 44 -8.173 13.789 0.329 1.00 0.00 N ATOM 393 CA TYR A 44 -9.314 13.129 -0.279 1.00 0.00 C ATOM 394 C TYR A 44 -8.882 12.273 -1.471 1.00 0.00 C ATOM 395 O TYR A 44 -8.979 12.705 -2.619 1.00 0.00 O ATOM 396 CB TYR A 44 -10.232 14.247 -0.777 1.00 0.00 C ATOM 397 CG TYR A 44 -10.572 15.293 0.288 1.00 0.00 C ATOM 398 CD1 TYR A 44 -11.596 15.058 1.183 1.00 0.00 C ATOM 399 CD2 TYR A 44 -9.855 16.470 0.353 1.00 0.00 C ATOM 400 CE1 TYR A 44 -11.916 16.043 2.184 1.00 0.00 C ATOM 401 CE2 TYR A 44 -10.174 17.454 1.353 1.00 0.00 C ATOM 402 CZ TYR A 44 -11.190 17.192 2.220 1.00 0.00 C ATOM 403 OH TYR A 44 -11.491 18.121 3.166 1.00 0.00 O ATOM 0 H TYR A 44 -8.090 13.655 1.337 1.00 0.00 H new ATOM 0 HA TYR A 44 -9.805 12.473 0.440 1.00 0.00 H new ATOM 0 HB2 TYR A 44 -9.756 14.745 -1.622 1.00 0.00 H new ATOM 0 HB3 TYR A 44 -11.157 13.806 -1.147 1.00 0.00 H new ATOM 0 HD1 TYR A 44 -12.157 14.136 1.133 1.00 0.00 H new ATOM 0 HD2 TYR A 44 -9.054 16.653 -0.347 1.00 0.00 H new ATOM 0 HE1 TYR A 44 -12.715 15.873 2.890 1.00 0.00 H new ATOM 0 HE2 TYR A 44 -9.620 18.379 1.414 1.00 0.00 H new ATOM 0 HH TYR A 44 -10.890 18.889 3.073 1.00 0.00 H new ATOM 412 N CYS A 45 -8.412 11.074 -1.159 1.00 0.00 N ATOM 413 CA CYS A 45 -7.965 10.154 -2.189 1.00 0.00 C ATOM 414 C CYS A 45 -9.198 9.523 -2.840 1.00 0.00 C ATOM 415 O CYS A 45 -9.490 8.350 -2.614 1.00 0.00 O ATOM 416 CB CYS A 45 -7.011 9.096 -1.629 1.00 0.00 C ATOM 417 SG CYS A 45 -5.531 8.775 -2.656 1.00 0.00 S ATOM 0 H CYS A 45 -8.331 10.719 -0.206 1.00 0.00 H new ATOM 0 HA CYS A 45 -7.396 10.699 -2.943 1.00 0.00 H new ATOM 0 HB2 CYS A 45 -6.686 9.409 -0.637 1.00 0.00 H new ATOM 0 HB3 CYS A 45 -7.559 8.162 -1.505 1.00 0.00 H new ATOM 421 N HIS A 46 -9.887 10.329 -3.633 1.00 0.00 N ATOM 422 CA HIS A 46 -11.081 9.865 -4.317 1.00 0.00 C ATOM 423 C HIS A 46 -11.563 10.939 -5.293 1.00 0.00 C ATOM 424 O HIS A 46 -11.961 12.027 -4.880 1.00 0.00 O ATOM 425 CB HIS A 46 -12.158 9.452 -3.310 1.00 0.00 C ATOM 426 CG HIS A 46 -13.434 8.953 -3.946 1.00 0.00 C ATOM 427 ND1 HIS A 46 -14.523 8.526 -3.206 1.00 0.00 N ATOM 428 CD2 HIS A 46 -13.783 8.818 -5.257 1.00 0.00 C ATOM 429 CE1 HIS A 46 -15.477 8.153 -4.045 1.00 0.00 C ATOM 430 NE2 HIS A 46 -15.017 8.334 -5.315 1.00 0.00 N ATOM 0 H HIS A 46 -9.641 11.302 -3.817 1.00 0.00 H new ATOM 0 HA HIS A 46 -10.848 8.973 -4.899 1.00 0.00 H new ATOM 0 HB2 HIS A 46 -11.757 8.671 -2.664 1.00 0.00 H new ATOM 0 HB3 HIS A 46 -12.391 10.305 -2.672 1.00 0.00 H new ATOM 0 HD1 HIS A 46 -14.581 8.503 -2.188 1.00 0.00 H new ATOM 0 HD2 HIS A 46 -13.160 9.063 -6.105 1.00 0.00 H new ATOM 0 HE1 HIS A 46 -16.450 7.772 -3.771 1.00 0.00 H new ATOM 437 N ARG A 47 -11.514 10.595 -6.572 1.00 0.00 N ATOM 438 CA ARG A 47 -11.941 11.516 -7.612 1.00 0.00 C ATOM 439 C ARG A 47 -13.322 11.119 -8.139 1.00 0.00 C ATOM 440 O ARG A 47 -14.155 11.980 -8.417 1.00 0.00 O ATOM 441 CB ARG A 47 -10.945 11.535 -8.773 1.00 0.00 C ATOM 442 CG ARG A 47 -11.136 10.317 -9.679 1.00 0.00 C ATOM 443 CD ARG A 47 -9.975 10.181 -10.666 1.00 0.00 C ATOM 444 NE ARG A 47 -10.103 11.191 -11.741 1.00 0.00 N ATOM 445 CZ ARG A 47 -10.827 11.015 -12.854 1.00 0.00 C ATOM 446 NH1 ARG A 47 -11.491 9.868 -13.048 1.00 0.00 N ATOM 447 NH2 ARG A 47 -10.885 11.987 -13.776 1.00 0.00 N ATOM 0 H ARG A 47 -11.185 9.691 -6.912 1.00 0.00 H new ATOM 0 HA ARG A 47 -11.989 12.513 -7.173 1.00 0.00 H new ATOM 0 HB2 ARG A 47 -11.075 12.448 -9.353 1.00 0.00 H new ATOM 0 HB3 ARG A 47 -9.927 11.547 -8.383 1.00 0.00 H new ATOM 0 HG2 ARG A 47 -11.209 9.415 -9.071 1.00 0.00 H new ATOM 0 HG3 ARG A 47 -12.074 10.410 -10.226 1.00 0.00 H new ATOM 0 HD2 ARG A 47 -9.027 10.311 -10.145 1.00 0.00 H new ATOM 0 HD3 ARG A 47 -9.968 9.179 -11.096 1.00 0.00 H new ATOM 0 HE ARG A 47 -9.609 12.076 -11.627 1.00 0.00 H new ATOM 0 HH11 ARG A 47 -11.446 9.128 -12.348 1.00 0.00 H new ATOM 0 HH12 ARG A 47 -12.042 9.735 -13.896 1.00 0.00 H new ATOM 0 HH21 ARG A 47 -10.378 12.860 -13.630 1.00 0.00 H new ATOM 0 HH22 ARG A 47 -11.436 11.854 -14.624 1.00 0.00 H new ATOM 458 N THR A 48 -13.521 9.815 -8.260 1.00 0.00 N ATOM 459 CA THR A 48 -14.786 9.293 -8.749 1.00 0.00 C ATOM 460 C THR A 48 -14.955 9.609 -10.236 1.00 0.00 C ATOM 461 O THR A 48 -14.414 10.599 -10.729 1.00 0.00 O ATOM 462 CB THR A 48 -15.903 9.866 -7.875 1.00 0.00 C ATOM 463 OG1 THR A 48 -16.774 8.762 -7.655 1.00 0.00 O ATOM 464 CG2 THR A 48 -16.770 10.882 -8.624 1.00 0.00 C ATOM 0 H THR A 48 -12.827 9.104 -8.028 1.00 0.00 H new ATOM 0 HA THR A 48 -14.820 8.206 -8.675 1.00 0.00 H new ATOM 0 HB THR A 48 -15.468 10.339 -6.995 1.00 0.00 H new ATOM 0 HG1 THR A 48 -16.484 8.270 -6.859 1.00 0.00 H new ATOM 0 HG21 THR A 48 -17.547 11.258 -7.959 1.00 0.00 H new ATOM 0 HG22 THR A 48 -16.149 11.712 -8.961 1.00 0.00 H new ATOM 0 HG23 THR A 48 -17.232 10.401 -9.486 1.00 0.00 H new ATOM 472 N THR A 49 -15.707 8.751 -10.909 1.00 0.00 N ATOM 473 CA THR A 49 -15.953 8.926 -12.330 1.00 0.00 C ATOM 474 C THR A 49 -14.803 8.336 -13.148 1.00 0.00 C ATOM 475 O THR A 49 -13.850 7.798 -12.587 1.00 0.00 O ATOM 476 CB THR A 49 -16.181 10.417 -12.590 1.00 0.00 C ATOM 477 OG1 THR A 49 -17.169 10.443 -13.617 1.00 0.00 O ATOM 478 CG2 THR A 49 -14.965 11.094 -13.225 1.00 0.00 C ATOM 0 H THR A 49 -16.154 7.932 -10.496 1.00 0.00 H new ATOM 0 HA THR A 49 -16.845 8.385 -12.646 1.00 0.00 H new ATOM 0 HB THR A 49 -16.425 10.916 -11.652 1.00 0.00 H new ATOM 0 HG1 THR A 49 -17.378 11.373 -13.846 1.00 0.00 H new ATOM 0 HG21 THR A 49 -15.180 12.150 -13.388 1.00 0.00 H new ATOM 0 HG22 THR A 49 -14.106 10.997 -12.561 1.00 0.00 H new ATOM 0 HG23 THR A 49 -14.741 10.618 -14.180 1.00 0.00 H new ATOM 486 N ILE A 50 -14.930 8.458 -14.462 1.00 0.00 N ATOM 487 CA ILE A 50 -13.912 7.944 -15.362 1.00 0.00 C ATOM 488 C ILE A 50 -13.909 8.771 -16.649 1.00 0.00 C ATOM 489 O ILE A 50 -12.951 9.489 -16.927 1.00 0.00 O ATOM 490 CB ILE A 50 -14.112 6.445 -15.596 1.00 0.00 C ATOM 491 CG1 ILE A 50 -13.865 5.652 -14.311 1.00 0.00 C ATOM 492 CG2 ILE A 50 -13.241 5.949 -16.752 1.00 0.00 C ATOM 493 CD1 ILE A 50 -13.857 4.147 -14.589 1.00 0.00 C ATOM 0 H ILE A 50 -15.722 8.905 -14.924 1.00 0.00 H new ATOM 0 HA ILE A 50 -12.923 8.046 -14.915 1.00 0.00 H new ATOM 0 HB ILE A 50 -15.151 6.280 -15.882 1.00 0.00 H new ATOM 0 HG12 ILE A 50 -12.912 5.950 -13.873 1.00 0.00 H new ATOM 0 HG13 ILE A 50 -14.639 5.886 -13.580 1.00 0.00 H new ATOM 0 HG21 ILE A 50 -13.402 4.881 -16.897 1.00 0.00 H new ATOM 0 HG22 ILE A 50 -13.508 6.483 -17.664 1.00 0.00 H new ATOM 0 HG23 ILE A 50 -12.191 6.129 -16.520 1.00 0.00 H new ATOM 0 HD11 ILE A 50 -13.679 3.606 -13.659 1.00 0.00 H new ATOM 0 HD12 ILE A 50 -14.820 3.849 -15.004 1.00 0.00 H new ATOM 0 HD13 ILE A 50 -13.066 3.913 -15.302 1.00 0.00 H new ATOM 504 N GLY A 51 -14.995 8.645 -17.398 1.00 0.00 N ATOM 505 CA GLY A 51 -15.130 9.373 -18.648 1.00 0.00 C ATOM 506 C GLY A 51 -16.486 9.096 -19.300 1.00 0.00 C ATOM 507 O GLY A 51 -16.550 8.689 -20.459 1.00 0.00 O ATOM 0 H GLY A 51 -15.789 8.050 -17.163 1.00 0.00 H new ATOM 0 HA2 GLY A 51 -15.023 10.442 -18.464 1.00 0.00 H new ATOM 0 HA3 GLY A 51 -14.329 9.085 -19.329 1.00 0.00 H new ATOM 511 N ASN A 52 -17.537 9.327 -18.527 1.00 0.00 N ATOM 512 CA ASN A 52 -18.888 9.107 -19.014 1.00 0.00 C ATOM 513 C ASN A 52 -19.885 9.757 -18.052 1.00 0.00 C ATOM 514 O ASN A 52 -20.601 10.684 -18.429 1.00 0.00 O ATOM 515 CB ASN A 52 -19.210 7.613 -19.092 1.00 0.00 C ATOM 516 CG ASN A 52 -20.054 7.297 -20.327 1.00 0.00 C ATOM 517 OD1 ASN A 52 -20.519 8.176 -21.036 1.00 0.00 O ATOM 518 ND2 ASN A 52 -20.225 5.997 -20.547 1.00 0.00 N ATOM 0 H ASN A 52 -17.480 9.665 -17.566 1.00 0.00 H new ATOM 0 HA ASN A 52 -18.962 9.544 -20.010 1.00 0.00 H new ATOM 0 HB2 ASN A 52 -18.284 7.039 -19.124 1.00 0.00 H new ATOM 0 HB3 ASN A 52 -19.745 7.305 -18.193 1.00 0.00 H new ATOM 0 HD21 ASN A 52 -20.773 5.683 -21.348 1.00 0.00 H new ATOM 0 HD22 ASN A 52 -19.809 5.314 -19.915 1.00 0.00 H new ATOM 524 N PHE A 53 -19.899 9.245 -16.831 1.00 0.00 N ATOM 525 CA PHE A 53 -20.796 9.764 -15.812 1.00 0.00 C ATOM 526 C PHE A 53 -20.499 9.135 -14.449 1.00 0.00 C ATOM 527 O PHE A 53 -20.512 9.823 -13.429 1.00 0.00 O ATOM 528 CB PHE A 53 -22.217 9.389 -16.235 1.00 0.00 C ATOM 529 CG PHE A 53 -22.350 7.963 -16.775 1.00 0.00 C ATOM 530 CD1 PHE A 53 -22.464 6.917 -15.913 1.00 0.00 C ATOM 531 CD2 PHE A 53 -22.354 7.742 -18.117 1.00 0.00 C ATOM 532 CE1 PHE A 53 -22.587 5.595 -16.414 1.00 0.00 C ATOM 533 CE2 PHE A 53 -22.478 6.420 -18.618 1.00 0.00 C ATOM 534 CZ PHE A 53 -22.591 5.373 -17.757 1.00 0.00 C ATOM 0 H PHE A 53 -19.304 8.476 -16.524 1.00 0.00 H new ATOM 0 HA PHE A 53 -20.670 10.843 -15.719 1.00 0.00 H new ATOM 0 HB2 PHE A 53 -22.883 9.506 -15.380 1.00 0.00 H new ATOM 0 HB3 PHE A 53 -22.554 10.089 -17.000 1.00 0.00 H new ATOM 0 HD1 PHE A 53 -22.461 7.093 -14.847 1.00 0.00 H new ATOM 0 HD2 PHE A 53 -22.263 8.573 -18.801 1.00 0.00 H new ATOM 0 HE1 PHE A 53 -22.677 4.765 -15.729 1.00 0.00 H new ATOM 0 HE2 PHE A 53 -22.483 6.245 -19.684 1.00 0.00 H new ATOM 0 HZ PHE A 53 -22.684 4.367 -18.138 1.00 0.00 H new ATOM 543 N SER A 54 -20.239 7.837 -14.476 1.00 0.00 N ATOM 544 CA SER A 54 -19.940 7.108 -13.255 1.00 0.00 C ATOM 545 C SER A 54 -19.267 5.776 -13.592 1.00 0.00 C ATOM 546 O SER A 54 -19.633 5.121 -14.566 1.00 0.00 O ATOM 547 CB SER A 54 -21.207 6.869 -12.432 1.00 0.00 C ATOM 548 OG SER A 54 -21.997 5.809 -12.963 1.00 0.00 O ATOM 0 H SER A 54 -20.229 7.271 -15.324 1.00 0.00 H new ATOM 0 HA SER A 54 -19.258 7.711 -12.655 1.00 0.00 H new ATOM 0 HB2 SER A 54 -20.932 6.636 -11.403 1.00 0.00 H new ATOM 0 HB3 SER A 54 -21.799 7.784 -12.404 1.00 0.00 H new ATOM 0 HG SER A 54 -22.796 5.687 -12.409 1.00 0.00 H new ATOM 553 N GLY A 55 -18.295 5.415 -12.767 1.00 0.00 N ATOM 554 CA GLY A 55 -17.567 4.174 -12.965 1.00 0.00 C ATOM 555 C GLY A 55 -18.496 3.070 -13.478 1.00 0.00 C ATOM 556 O GLY A 55 -19.211 2.443 -12.698 1.00 0.00 O ATOM 0 H GLY A 55 -17.995 5.961 -11.959 1.00 0.00 H new ATOM 0 HA2 GLY A 55 -16.757 4.333 -13.677 1.00 0.00 H new ATOM 0 HA3 GLY A 55 -17.110 3.862 -12.026 1.00 0.00 H new ATOM 560 N PRO A 56 -18.452 2.862 -14.821 1.00 0.00 N ATOM 561 CA PRO A 56 -19.281 1.846 -15.448 1.00 0.00 C ATOM 562 C PRO A 56 -18.728 0.445 -15.178 1.00 0.00 C ATOM 563 O PRO A 56 -19.329 -0.332 -14.437 1.00 0.00 O ATOM 564 CB PRO A 56 -19.295 2.205 -16.925 1.00 0.00 C ATOM 565 CG PRO A 56 -18.107 3.127 -17.141 1.00 0.00 C ATOM 566 CD PRO A 56 -17.618 3.586 -15.776 1.00 0.00 C ATOM 0 HA PRO A 56 -20.295 1.824 -15.048 1.00 0.00 H new ATOM 0 HB2 PRO A 56 -19.214 1.312 -17.545 1.00 0.00 H new ATOM 0 HB3 PRO A 56 -20.227 2.699 -17.198 1.00 0.00 H new ATOM 0 HG2 PRO A 56 -17.312 2.607 -17.676 1.00 0.00 H new ATOM 0 HG3 PRO A 56 -18.394 3.983 -17.751 1.00 0.00 H new ATOM 0 HD2 PRO A 56 -16.562 3.354 -15.635 1.00 0.00 H new ATOM 0 HD3 PRO A 56 -17.726 4.664 -15.659 1.00 0.00 H new ATOM 571 N TYR A 57 -17.590 0.164 -15.795 1.00 0.00 N ATOM 572 CA TYR A 57 -16.949 -1.129 -15.630 1.00 0.00 C ATOM 573 C TYR A 57 -16.180 -1.197 -14.309 1.00 0.00 C ATOM 574 O TYR A 57 -15.874 -0.166 -13.711 1.00 0.00 O ATOM 575 CB TYR A 57 -15.958 -1.259 -16.789 1.00 0.00 C ATOM 576 CG TYR A 57 -15.084 -0.021 -17.003 1.00 0.00 C ATOM 577 CD1 TYR A 57 -14.113 0.305 -16.078 1.00 0.00 C ATOM 578 CD2 TYR A 57 -15.267 0.768 -18.120 1.00 0.00 C ATOM 579 CE1 TYR A 57 -13.291 1.470 -16.279 1.00 0.00 C ATOM 580 CE2 TYR A 57 -14.445 1.933 -18.321 1.00 0.00 C ATOM 581 CZ TYR A 57 -13.496 2.226 -17.391 1.00 0.00 C ATOM 582 OH TYR A 57 -12.720 3.326 -17.581 1.00 0.00 O ATOM 0 H TYR A 57 -17.095 0.810 -16.410 1.00 0.00 H new ATOM 0 HA TYR A 57 -17.692 -1.926 -15.622 1.00 0.00 H new ATOM 0 HB2 TYR A 57 -15.313 -2.119 -16.608 1.00 0.00 H new ATOM 0 HB3 TYR A 57 -16.511 -1.463 -17.706 1.00 0.00 H new ATOM 0 HD1 TYR A 57 -13.970 -0.313 -15.204 1.00 0.00 H new ATOM 0 HD2 TYR A 57 -16.027 0.512 -18.844 1.00 0.00 H new ATOM 0 HE1 TYR A 57 -12.528 1.738 -15.563 1.00 0.00 H new ATOM 0 HE2 TYR A 57 -14.579 2.560 -19.190 1.00 0.00 H new ATOM 0 HH TYR A 57 -12.978 3.768 -18.417 1.00 0.00 H new ATOM 591 N THR A 58 -15.890 -2.420 -13.892 1.00 0.00 N ATOM 592 CA THR A 58 -15.163 -2.636 -12.652 1.00 0.00 C ATOM 593 C THR A 58 -13.716 -2.162 -12.793 1.00 0.00 C ATOM 594 O THR A 58 -12.872 -2.880 -13.326 1.00 0.00 O ATOM 595 CB THR A 58 -15.285 -4.116 -12.284 1.00 0.00 C ATOM 596 OG1 THR A 58 -14.448 -4.259 -11.140 1.00 0.00 O ATOM 597 CG2 THR A 58 -14.647 -5.034 -13.329 1.00 0.00 C ATOM 0 H THR A 58 -16.145 -3.272 -14.391 1.00 0.00 H new ATOM 0 HA THR A 58 -15.586 -2.048 -11.838 1.00 0.00 H new ATOM 0 HB THR A 58 -16.337 -4.375 -12.167 1.00 0.00 H new ATOM 0 HG1 THR A 58 -14.395 -5.205 -10.890 1.00 0.00 H new ATOM 0 HG21 THR A 58 -14.761 -6.073 -13.019 1.00 0.00 H new ATOM 0 HG22 THR A 58 -15.137 -4.886 -14.291 1.00 0.00 H new ATOM 0 HG23 THR A 58 -13.587 -4.798 -13.422 1.00 0.00 H new ATOM 605 N TYR A 59 -13.473 -0.954 -12.304 1.00 0.00 N ATOM 606 CA TYR A 59 -12.142 -0.374 -12.370 1.00 0.00 C ATOM 607 C TYR A 59 -11.558 -0.184 -10.968 1.00 0.00 C ATOM 608 O TYR A 59 -12.296 -0.139 -9.986 1.00 0.00 O ATOM 609 CB TYR A 59 -12.310 0.995 -13.030 1.00 0.00 C ATOM 610 CG TYR A 59 -11.016 1.569 -13.610 1.00 0.00 C ATOM 611 CD1 TYR A 59 -10.457 1.006 -14.740 1.00 0.00 C ATOM 612 CD2 TYR A 59 -10.408 2.650 -13.005 1.00 0.00 C ATOM 613 CE1 TYR A 59 -9.239 1.547 -15.286 1.00 0.00 C ATOM 614 CE2 TYR A 59 -9.189 3.190 -13.551 1.00 0.00 C ATOM 615 CZ TYR A 59 -8.666 2.611 -14.666 1.00 0.00 C ATOM 616 OH TYR A 59 -7.515 3.121 -15.181 1.00 0.00 O ATOM 0 H TYR A 59 -14.175 -0.362 -11.861 1.00 0.00 H new ATOM 0 HA TYR A 59 -11.467 -1.025 -12.926 1.00 0.00 H new ATOM 0 HB2 TYR A 59 -13.049 0.914 -13.827 1.00 0.00 H new ATOM 0 HB3 TYR A 59 -12.709 1.695 -12.295 1.00 0.00 H new ATOM 0 HD1 TYR A 59 -10.933 0.160 -15.214 1.00 0.00 H new ATOM 0 HD2 TYR A 59 -10.846 3.091 -12.122 1.00 0.00 H new ATOM 0 HE1 TYR A 59 -8.791 1.116 -16.169 1.00 0.00 H new ATOM 0 HE2 TYR A 59 -8.702 4.034 -13.086 1.00 0.00 H new ATOM 0 HH TYR A 59 -7.220 3.880 -14.635 1.00 0.00 H new ATOM 625 N CYS A 60 -10.238 -0.077 -10.922 1.00 0.00 N ATOM 626 CA CYS A 60 -9.547 0.108 -9.657 1.00 0.00 C ATOM 627 C CYS A 60 -9.753 1.554 -9.203 1.00 0.00 C ATOM 628 O CYS A 60 -9.595 2.484 -9.992 1.00 0.00 O ATOM 629 CB CYS A 60 -8.063 -0.250 -9.766 1.00 0.00 C ATOM 630 SG CYS A 60 -7.713 -1.807 -10.661 1.00 0.00 S ATOM 0 H CYS A 60 -9.629 -0.115 -11.740 1.00 0.00 H new ATOM 0 HA CYS A 60 -9.963 -0.568 -8.910 1.00 0.00 H new ATOM 0 HB2 CYS A 60 -7.543 0.566 -10.268 1.00 0.00 H new ATOM 0 HB3 CYS A 60 -7.647 -0.323 -8.761 1.00 0.00 H new ATOM 634 N ASN A 61 -10.104 1.698 -7.933 1.00 0.00 N ATOM 635 CA ASN A 61 -10.334 3.015 -7.366 1.00 0.00 C ATOM 636 C ASN A 61 -9.041 3.522 -6.723 1.00 0.00 C ATOM 637 O ASN A 61 -8.091 2.760 -6.548 1.00 0.00 O ATOM 638 CB ASN A 61 -11.413 2.967 -6.281 1.00 0.00 C ATOM 639 CG ASN A 61 -11.805 4.377 -5.835 1.00 0.00 C ATOM 640 OD1 ASN A 61 -11.238 4.945 -4.915 1.00 0.00 O ATOM 641 ND2 ASN A 61 -12.803 4.908 -6.534 1.00 0.00 N ATOM 0 H ASN A 61 -10.234 0.924 -7.281 1.00 0.00 H new ATOM 0 HA ASN A 61 -10.659 3.676 -8.170 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -12.291 2.444 -6.659 1.00 0.00 H new ATOM 0 HB3 ASN A 61 -11.048 2.399 -5.425 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -13.138 5.845 -6.313 1.00 0.00 H new ATOM 0 HD22 ASN A 61 -13.233 4.378 -7.292 1.00 0.00 H new ATOM 647 N THR A 62 -9.047 4.804 -6.390 1.00 0.00 N ATOM 648 CA THR A 62 -7.886 5.421 -5.771 1.00 0.00 C ATOM 649 C THR A 62 -7.971 5.310 -4.247 1.00 0.00 C ATOM 650 O THR A 62 -8.997 5.640 -3.654 1.00 0.00 O ATOM 651 CB THR A 62 -7.795 6.865 -6.271 1.00 0.00 C ATOM 652 OG1 THR A 62 -6.679 7.406 -5.568 1.00 0.00 O ATOM 653 CG2 THR A 62 -8.976 7.719 -5.809 1.00 0.00 C ATOM 0 H THR A 62 -9.837 5.432 -6.537 1.00 0.00 H new ATOM 0 HA THR A 62 -6.968 4.906 -6.052 1.00 0.00 H new ATOM 0 HB THR A 62 -7.747 6.870 -7.360 1.00 0.00 H new ATOM 0 HG1 THR A 62 -5.904 6.817 -5.682 1.00 0.00 H new ATOM 0 HG21 THR A 62 -8.863 8.734 -6.191 1.00 0.00 H new ATOM 0 HG22 THR A 62 -9.904 7.291 -6.187 1.00 0.00 H new ATOM 0 HG23 THR A 62 -9.004 7.742 -4.720 1.00 0.00 H new ATOM 661 N THR A 63 -6.880 4.845 -3.658 1.00 0.00 N ATOM 662 CA THR A 63 -6.819 4.687 -2.215 1.00 0.00 C ATOM 663 C THR A 63 -5.419 4.244 -1.786 1.00 0.00 C ATOM 664 O THR A 63 -4.572 3.948 -2.628 1.00 0.00 O ATOM 665 CB THR A 63 -7.919 3.707 -1.799 1.00 0.00 C ATOM 666 OG1 THR A 63 -8.268 4.117 -0.480 1.00 0.00 O ATOM 667 CG2 THR A 63 -7.396 2.280 -1.621 1.00 0.00 C ATOM 0 H THR A 63 -6.031 4.572 -4.153 1.00 0.00 H new ATOM 0 HA THR A 63 -6.997 5.634 -1.706 1.00 0.00 H new ATOM 0 HB THR A 63 -8.711 3.711 -2.548 1.00 0.00 H new ATOM 0 HG1 THR A 63 -8.977 3.536 -0.134 1.00 0.00 H new ATOM 0 HG21 THR A 63 -8.217 1.626 -1.326 1.00 0.00 H new ATOM 0 HG22 THR A 63 -6.972 1.928 -2.561 1.00 0.00 H new ATOM 0 HG23 THR A 63 -6.627 2.268 -0.849 1.00 0.00 H new ATOM 675 N LEU A 64 -5.217 4.215 -0.476 1.00 0.00 N ATOM 676 CA LEU A 64 -3.934 3.814 0.075 1.00 0.00 C ATOM 677 C LEU A 64 -4.156 2.757 1.159 1.00 0.00 C ATOM 678 O LEU A 64 -4.914 2.981 2.102 1.00 0.00 O ATOM 679 CB LEU A 64 -3.153 5.036 0.559 1.00 0.00 C ATOM 680 CG LEU A 64 -3.849 5.902 1.611 1.00 0.00 C ATOM 681 CD1 LEU A 64 -3.564 5.387 3.022 1.00 0.00 C ATOM 682 CD2 LEU A 64 -3.464 7.375 1.450 1.00 0.00 C ATOM 0 H LEU A 64 -5.921 4.463 0.219 1.00 0.00 H new ATOM 0 HA LEU A 64 -3.316 3.355 -0.696 1.00 0.00 H new ATOM 0 HB2 LEU A 64 -2.202 4.696 0.968 1.00 0.00 H new ATOM 0 HB3 LEU A 64 -2.924 5.661 -0.304 1.00 0.00 H new ATOM 0 HG LEU A 64 -4.925 5.831 1.454 1.00 0.00 H new ATOM 0 HD11 LEU A 64 -4.071 6.021 3.750 1.00 0.00 H new ATOM 0 HD12 LEU A 64 -3.928 4.364 3.116 1.00 0.00 H new ATOM 0 HD13 LEU A 64 -2.490 5.409 3.207 1.00 0.00 H new ATOM 0 HD21 LEU A 64 -3.972 7.969 2.210 1.00 0.00 H new ATOM 0 HD22 LEU A 64 -2.386 7.484 1.565 1.00 0.00 H new ATOM 0 HD23 LEU A 64 -3.760 7.722 0.460 1.00 0.00 H new ATOM 693 N ASP A 65 -3.484 1.628 0.988 1.00 0.00 N ATOM 694 CA ASP A 65 -3.599 0.537 1.940 1.00 0.00 C ATOM 695 C ASP A 65 -2.533 -0.516 1.633 1.00 0.00 C ATOM 696 O ASP A 65 -2.777 -1.713 1.780 1.00 0.00 O ATOM 697 CB ASP A 65 -4.970 -0.136 1.843 1.00 0.00 C ATOM 698 CG ASP A 65 -5.310 -1.079 2.999 1.00 0.00 C ATOM 699 OD1 ASP A 65 -5.204 -0.619 4.157 1.00 0.00 O ATOM 700 OD2 ASP A 65 -5.668 -2.238 2.700 1.00 0.00 O ATOM 0 H ASP A 65 -2.858 1.445 0.204 1.00 0.00 H new ATOM 0 HA ASP A 65 -3.469 0.948 2.941 1.00 0.00 H new ATOM 0 HB2 ASP A 65 -5.735 0.638 1.788 1.00 0.00 H new ATOM 0 HB3 ASP A 65 -5.017 -0.697 0.910 1.00 0.00 H new ATOM 704 N GLN A 66 -1.373 -0.033 1.212 1.00 0.00 N ATOM 705 CA GLN A 66 -0.269 -0.918 0.883 1.00 0.00 C ATOM 706 C GLN A 66 0.966 -0.556 1.712 1.00 0.00 C ATOM 707 O GLN A 66 1.416 -1.347 2.540 1.00 0.00 O ATOM 708 CB GLN A 66 0.043 -0.873 -0.614 1.00 0.00 C ATOM 709 CG GLN A 66 -0.640 -2.027 -1.351 1.00 0.00 C ATOM 710 CD GLN A 66 -2.055 -1.639 -1.783 1.00 0.00 C ATOM 711 OE1 GLN A 66 -2.286 -1.152 -2.878 1.00 0.00 O ATOM 712 NE2 GLN A 66 -2.987 -1.882 -0.866 1.00 0.00 N ATOM 0 H GLN A 66 -1.174 0.960 1.091 1.00 0.00 H new ATOM 0 HA GLN A 66 -0.561 -1.939 1.129 1.00 0.00 H new ATOM 0 HB2 GLN A 66 -0.291 0.077 -1.030 1.00 0.00 H new ATOM 0 HB3 GLN A 66 1.121 -0.927 -0.766 1.00 0.00 H new ATOM 0 HG2 GLN A 66 -0.052 -2.304 -2.226 1.00 0.00 H new ATOM 0 HG3 GLN A 66 -0.681 -2.903 -0.704 1.00 0.00 H new ATOM 0 HE21 GLN A 66 -2.726 -2.291 0.031 1.00 0.00 H new ATOM 0 HE22 GLN A 66 -3.963 -1.659 -1.060 1.00 0.00 H new ATOM 719 N ILE A 67 1.480 0.638 1.460 1.00 0.00 N ATOM 720 CA ILE A 67 2.653 1.114 2.172 1.00 0.00 C ATOM 721 C ILE A 67 2.521 2.618 2.417 1.00 0.00 C ATOM 722 O ILE A 67 3.501 3.355 2.321 1.00 0.00 O ATOM 723 CB ILE A 67 3.929 0.723 1.424 1.00 0.00 C ATOM 724 CG1 ILE A 67 3.673 0.618 -0.081 1.00 0.00 C ATOM 725 CG2 ILE A 67 4.526 -0.565 1.993 1.00 0.00 C ATOM 726 CD1 ILE A 67 4.913 1.025 -0.879 1.00 0.00 C ATOM 0 H ILE A 67 1.105 1.291 0.772 1.00 0.00 H new ATOM 0 HA ILE A 67 2.724 0.637 3.149 1.00 0.00 H new ATOM 0 HB ILE A 67 4.666 1.513 1.572 1.00 0.00 H new ATOM 0 HG12 ILE A 67 3.392 -0.404 -0.335 1.00 0.00 H new ATOM 0 HG13 ILE A 67 2.834 1.257 -0.356 1.00 0.00 H new ATOM 0 HG21 ILE A 67 5.432 -0.820 1.443 1.00 0.00 H new ATOM 0 HG22 ILE A 67 4.769 -0.419 3.045 1.00 0.00 H new ATOM 0 HG23 ILE A 67 3.803 -1.375 1.896 1.00 0.00 H new ATOM 0 HD11 ILE A 67 4.703 0.941 -1.945 1.00 0.00 H new ATOM 0 HD12 ILE A 67 5.177 2.056 -0.641 1.00 0.00 H new ATOM 0 HD13 ILE A 67 5.744 0.369 -0.620 1.00 0.00 H new ATOM 737 N GLY A 68 1.301 3.030 2.728 1.00 0.00 N ATOM 738 CA GLY A 68 1.027 4.433 2.987 1.00 0.00 C ATOM 739 C GLY A 68 0.899 5.217 1.680 1.00 0.00 C ATOM 740 O GLY A 68 0.601 6.411 1.695 1.00 0.00 O ATOM 0 H GLY A 68 0.490 2.416 2.807 1.00 0.00 H new ATOM 0 HA2 GLY A 68 0.107 4.527 3.563 1.00 0.00 H new ATOM 0 HA3 GLY A 68 1.827 4.858 3.593 1.00 0.00 H new ATOM 744 N THR A 69 1.133 4.515 0.581 1.00 0.00 N ATOM 745 CA THR A 69 1.048 5.131 -0.732 1.00 0.00 C ATOM 746 C THR A 69 -0.380 5.041 -1.273 1.00 0.00 C ATOM 747 O THR A 69 -1.100 4.088 -0.976 1.00 0.00 O ATOM 748 CB THR A 69 2.084 4.461 -1.637 1.00 0.00 C ATOM 749 OG1 THR A 69 3.278 5.202 -1.403 1.00 0.00 O ATOM 750 CG2 THR A 69 1.793 4.681 -3.123 1.00 0.00 C ATOM 0 H THR A 69 1.381 3.526 0.573 1.00 0.00 H new ATOM 0 HA THR A 69 1.277 6.196 -0.684 1.00 0.00 H new ATOM 0 HB THR A 69 2.112 3.392 -1.428 1.00 0.00 H new ATOM 0 HG1 THR A 69 3.900 5.064 -2.148 1.00 0.00 H new ATOM 0 HG21 THR A 69 2.558 4.185 -3.721 1.00 0.00 H new ATOM 0 HG22 THR A 69 0.815 4.266 -3.368 1.00 0.00 H new ATOM 0 HG23 THR A 69 1.798 5.749 -3.341 1.00 0.00 H new ATOM 758 N CYS A 70 -0.748 6.043 -2.056 1.00 0.00 N ATOM 759 CA CYS A 70 -2.078 6.088 -2.641 1.00 0.00 C ATOM 760 C CYS A 70 -1.939 5.968 -4.160 1.00 0.00 C ATOM 761 O CYS A 70 -1.284 6.793 -4.795 1.00 0.00 O ATOM 762 CB CYS A 70 -2.831 7.356 -2.236 1.00 0.00 C ATOM 763 SG CYS A 70 -4.629 7.132 -1.980 1.00 0.00 S ATOM 0 H CYS A 70 -0.148 6.831 -2.300 1.00 0.00 H new ATOM 0 HA CYS A 70 -2.672 5.255 -2.264 1.00 0.00 H new ATOM 0 HB2 CYS A 70 -2.393 7.744 -1.316 1.00 0.00 H new ATOM 0 HB3 CYS A 70 -2.679 8.113 -3.005 1.00 0.00 H new ATOM 767 N TRP A 71 -2.566 4.933 -4.700 1.00 0.00 N ATOM 768 CA TRP A 71 -2.520 4.692 -6.132 1.00 0.00 C ATOM 769 C TRP A 71 -3.713 5.409 -6.769 1.00 0.00 C ATOM 770 O TRP A 71 -4.848 5.249 -6.323 1.00 0.00 O ATOM 771 CB TRP A 71 -2.490 3.195 -6.437 1.00 0.00 C ATOM 772 CG TRP A 71 -1.904 2.341 -5.310 1.00 0.00 C ATOM 773 CD1 TRP A 71 -2.460 2.042 -4.128 1.00 0.00 C ATOM 774 CD2 TRP A 71 -0.619 1.685 -5.308 1.00 0.00 C ATOM 775 NE1 TRP A 71 -1.629 1.244 -3.367 1.00 0.00 N ATOM 776 CE2 TRP A 71 -0.474 1.021 -4.107 1.00 0.00 C ATOM 777 CE3 TRP A 71 0.389 1.655 -6.288 1.00 0.00 C ATOM 778 CZ2 TRP A 71 0.665 0.278 -3.774 1.00 0.00 C ATOM 779 CZ3 TRP A 71 1.521 0.907 -5.940 1.00 0.00 C ATOM 780 CH2 TRP A 71 1.681 0.233 -4.736 1.00 0.00 C ATOM 0 H TRP A 71 -3.109 4.251 -4.171 1.00 0.00 H new ATOM 0 HA TRP A 71 -1.602 5.093 -6.561 1.00 0.00 H new ATOM 0 HB2 TRP A 71 -3.505 2.857 -6.645 1.00 0.00 H new ATOM 0 HB3 TRP A 71 -1.907 3.031 -7.344 1.00 0.00 H new ATOM 0 HD1 TRP A 71 -3.435 2.382 -3.811 1.00 0.00 H new ATOM 0 HE1 TRP A 71 -1.827 0.884 -2.433 1.00 0.00 H new ATOM 0 HE3 TRP A 71 0.298 2.168 -7.234 1.00 0.00 H new ATOM 0 HZ2 TRP A 71 0.755 -0.233 -2.827 1.00 0.00 H new ATOM 0 HZ3 TRP A 71 2.326 0.850 -6.658 1.00 0.00 H new ATOM 0 HH2 TRP A 71 2.586 -0.324 -4.543 1.00 0.00 H new ATOM 790 N PRO A 72 -3.407 6.205 -7.829 1.00 0.00 N ATOM 791 CA PRO A 72 -4.440 6.946 -8.532 1.00 0.00 C ATOM 792 C PRO A 72 -5.270 6.019 -9.423 1.00 0.00 C ATOM 793 O PRO A 72 -5.012 5.908 -10.620 1.00 0.00 O ATOM 794 CB PRO A 72 -3.694 8.013 -9.316 1.00 0.00 C ATOM 795 CG PRO A 72 -2.251 7.541 -9.393 1.00 0.00 C ATOM 796 CD PRO A 72 -2.073 6.419 -8.384 1.00 0.00 C ATOM 0 HA PRO A 72 -5.165 7.401 -7.857 1.00 0.00 H new ATOM 0 HB2 PRO A 72 -4.119 8.134 -10.312 1.00 0.00 H new ATOM 0 HB3 PRO A 72 -3.762 8.981 -8.820 1.00 0.00 H new ATOM 0 HG2 PRO A 72 -2.017 7.191 -10.398 1.00 0.00 H new ATOM 0 HG3 PRO A 72 -1.569 8.362 -9.175 1.00 0.00 H new ATOM 0 HD2 PRO A 72 -1.692 5.515 -8.860 1.00 0.00 H new ATOM 0 HD3 PRO A 72 -1.360 6.695 -7.607 1.00 0.00 H new ATOM 801 N GLN A 73 -6.249 5.377 -8.804 1.00 0.00 N ATOM 802 CA GLN A 73 -7.118 4.463 -9.525 1.00 0.00 C ATOM 803 C GLN A 73 -6.288 3.511 -10.387 1.00 0.00 C ATOM 804 O GLN A 73 -5.059 3.552 -10.358 1.00 0.00 O ATOM 805 CB GLN A 73 -8.134 5.230 -10.376 1.00 0.00 C ATOM 806 CG GLN A 73 -9.305 5.721 -9.522 1.00 0.00 C ATOM 807 CD GLN A 73 -10.618 5.660 -10.305 1.00 0.00 C ATOM 808 OE1 GLN A 73 -11.628 5.159 -9.838 1.00 0.00 O ATOM 809 NE2 GLN A 73 -10.548 6.197 -11.520 1.00 0.00 N ATOM 0 H GLN A 73 -6.460 5.472 -7.811 1.00 0.00 H new ATOM 0 HA GLN A 73 -7.675 3.871 -8.798 1.00 0.00 H new ATOM 0 HB2 GLN A 73 -7.646 6.080 -10.853 1.00 0.00 H new ATOM 0 HB3 GLN A 73 -8.505 4.586 -11.173 1.00 0.00 H new ATOM 0 HG2 GLN A 73 -9.385 5.110 -8.623 1.00 0.00 H new ATOM 0 HG3 GLN A 73 -9.119 6.745 -9.197 1.00 0.00 H new ATOM 0 HE21 GLN A 73 -9.671 6.600 -11.850 1.00 0.00 H new ATOM 0 HE22 GLN A 73 -11.371 6.206 -12.122 1.00 0.00 H new ATOM 816 N SER A 74 -6.993 2.674 -11.136 1.00 0.00 N ATOM 817 CA SER A 74 -6.337 1.712 -12.006 1.00 0.00 C ATOM 818 C SER A 74 -7.380 0.822 -12.682 1.00 0.00 C ATOM 819 O SER A 74 -8.577 0.969 -12.442 1.00 0.00 O ATOM 820 CB SER A 74 -5.335 0.858 -11.225 1.00 0.00 C ATOM 821 OG SER A 74 -5.452 1.050 -9.818 1.00 0.00 O ATOM 0 H SER A 74 -8.012 2.643 -11.158 1.00 0.00 H new ATOM 0 HA SER A 74 -5.787 2.261 -12.771 1.00 0.00 H new ATOM 0 HB2 SER A 74 -5.494 -0.194 -11.462 1.00 0.00 H new ATOM 0 HB3 SER A 74 -4.322 1.107 -11.542 1.00 0.00 H new ATOM 0 HG SER A 74 -4.953 0.348 -9.350 1.00 0.00 H new ATOM 826 N ALA A 75 -6.888 -0.082 -13.517 1.00 0.00 N ATOM 827 CA ALA A 75 -7.762 -0.996 -14.231 1.00 0.00 C ATOM 828 C ALA A 75 -7.529 -2.421 -13.723 1.00 0.00 C ATOM 829 O ALA A 75 -6.548 -2.682 -13.027 1.00 0.00 O ATOM 830 CB ALA A 75 -7.518 -0.866 -15.736 1.00 0.00 C ATOM 0 H ALA A 75 -5.894 -0.200 -13.715 1.00 0.00 H new ATOM 0 HA ALA A 75 -8.808 -0.748 -14.048 1.00 0.00 H new ATOM 0 HB1 ALA A 75 -8.174 -1.552 -16.272 1.00 0.00 H new ATOM 0 HB2 ALA A 75 -7.727 0.156 -16.051 1.00 0.00 H new ATOM 0 HB3 ALA A 75 -6.479 -1.109 -15.959 1.00 0.00 H new ATOM 836 N PRO A 76 -8.469 -3.327 -14.101 1.00 0.00 N ATOM 837 CA PRO A 76 -8.375 -4.718 -13.691 1.00 0.00 C ATOM 838 C PRO A 76 -7.295 -5.453 -14.489 1.00 0.00 C ATOM 839 O PRO A 76 -7.095 -5.174 -15.670 1.00 0.00 O ATOM 840 CB PRO A 76 -9.767 -5.287 -13.910 1.00 0.00 C ATOM 841 CG PRO A 76 -10.464 -4.331 -14.864 1.00 0.00 C ATOM 842 CD PRO A 76 -9.643 -3.053 -14.925 1.00 0.00 C ATOM 0 HA PRO A 76 -8.073 -4.831 -12.650 1.00 0.00 H new ATOM 0 HB2 PRO A 76 -9.716 -6.291 -14.331 1.00 0.00 H new ATOM 0 HB3 PRO A 76 -10.310 -5.364 -12.968 1.00 0.00 H new ATOM 0 HG2 PRO A 76 -10.551 -4.776 -15.855 1.00 0.00 H new ATOM 0 HG3 PRO A 76 -11.476 -4.119 -14.520 1.00 0.00 H new ATOM 0 HD2 PRO A 76 -9.360 -2.813 -15.950 1.00 0.00 H new ATOM 0 HD3 PRO A 76 -10.206 -2.202 -14.542 1.00 0.00 H new ATOM 847 N GLY A 77 -6.631 -6.377 -13.813 1.00 0.00 N ATOM 848 CA GLY A 77 -5.577 -7.154 -14.444 1.00 0.00 C ATOM 849 C GLY A 77 -4.498 -6.241 -15.028 1.00 0.00 C ATOM 850 O GLY A 77 -3.689 -6.675 -15.846 1.00 0.00 O ATOM 0 H GLY A 77 -6.802 -6.606 -12.834 1.00 0.00 H new ATOM 0 HA2 GLY A 77 -5.131 -7.829 -13.714 1.00 0.00 H new ATOM 0 HA3 GLY A 77 -6.001 -7.774 -15.234 1.00 0.00 H new ATOM 854 N ALA A 78 -4.521 -4.993 -14.585 1.00 0.00 N ATOM 855 CA ALA A 78 -3.553 -4.015 -15.054 1.00 0.00 C ATOM 856 C ALA A 78 -2.181 -4.335 -14.459 1.00 0.00 C ATOM 857 O ALA A 78 -1.852 -5.500 -14.241 1.00 0.00 O ATOM 858 CB ALA A 78 -4.032 -2.608 -14.691 1.00 0.00 C ATOM 0 H ALA A 78 -5.194 -4.636 -13.907 1.00 0.00 H new ATOM 0 HA ALA A 78 -3.459 -4.058 -16.139 1.00 0.00 H new ATOM 0 HB1 ALA A 78 -3.306 -1.875 -15.043 1.00 0.00 H new ATOM 0 HB2 ALA A 78 -4.996 -2.419 -15.162 1.00 0.00 H new ATOM 0 HB3 ALA A 78 -4.135 -2.527 -13.609 1.00 0.00 H new ATOM 864 N LEU A 79 -1.417 -3.281 -14.214 1.00 0.00 N ATOM 865 CA LEU A 79 -0.087 -3.435 -13.649 1.00 0.00 C ATOM 866 C LEU A 79 0.341 -2.118 -12.997 1.00 0.00 C ATOM 867 O LEU A 79 0.995 -1.293 -13.631 1.00 0.00 O ATOM 868 CB LEU A 79 0.891 -3.943 -14.710 1.00 0.00 C ATOM 869 CG LEU A 79 1.610 -5.254 -14.386 1.00 0.00 C ATOM 870 CD1 LEU A 79 2.141 -5.249 -12.951 1.00 0.00 C ATOM 871 CD2 LEU A 79 0.705 -6.458 -14.659 1.00 0.00 C ATOM 0 H LEU A 79 -1.694 -2.316 -14.396 1.00 0.00 H new ATOM 0 HA LEU A 79 -0.091 -4.192 -12.865 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.347 -4.072 -15.646 1.00 0.00 H new ATOM 0 HB3 LEU A 79 1.642 -3.172 -14.882 1.00 0.00 H new ATOM 0 HG LEU A 79 2.472 -5.343 -15.047 1.00 0.00 H new ATOM 0 HD11 LEU A 79 2.647 -6.192 -12.747 1.00 0.00 H new ATOM 0 HD12 LEU A 79 2.844 -4.425 -12.826 1.00 0.00 H new ATOM 0 HD13 LEU A 79 1.310 -5.126 -12.256 1.00 0.00 H new ATOM 0 HD21 LEU A 79 1.240 -7.377 -14.420 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.190 -6.388 -14.040 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.419 -6.467 -15.711 1.00 0.00 H new ATOM 882 N VAL A 80 -0.045 -1.965 -11.739 1.00 0.00 N ATOM 883 CA VAL A 80 0.291 -0.763 -10.994 1.00 0.00 C ATOM 884 C VAL A 80 1.633 -0.964 -10.289 1.00 0.00 C ATOM 885 O VAL A 80 1.696 -0.992 -9.061 1.00 0.00 O ATOM 886 CB VAL A 80 -0.843 -0.410 -10.031 1.00 0.00 C ATOM 887 CG1 VAL A 80 -0.440 0.741 -9.106 1.00 0.00 C ATOM 888 CG2 VAL A 80 -2.127 -0.076 -10.793 1.00 0.00 C ATOM 0 H VAL A 80 -0.587 -2.653 -11.217 1.00 0.00 H new ATOM 0 HA VAL A 80 0.402 0.086 -11.669 1.00 0.00 H new ATOM 0 HB VAL A 80 -1.039 -1.285 -9.411 1.00 0.00 H new ATOM 0 HG11 VAL A 80 -1.265 0.972 -8.432 1.00 0.00 H new ATOM 0 HG12 VAL A 80 0.435 0.451 -8.524 1.00 0.00 H new ATOM 0 HG13 VAL A 80 -0.202 1.621 -9.703 1.00 0.00 H new ATOM 0 HG21 VAL A 80 -2.917 0.171 -10.084 1.00 0.00 H new ATOM 0 HG22 VAL A 80 -1.949 0.776 -11.450 1.00 0.00 H new ATOM 0 HG23 VAL A 80 -2.431 -0.937 -11.389 1.00 0.00 H new ATOM 898 N GLU A 81 2.675 -1.098 -11.096 1.00 0.00 N ATOM 899 CA GLU A 81 4.013 -1.297 -10.565 1.00 0.00 C ATOM 900 C GLU A 81 4.554 0.013 -9.987 1.00 0.00 C ATOM 901 O GLU A 81 4.349 1.081 -10.562 1.00 0.00 O ATOM 902 CB GLU A 81 4.954 -1.852 -11.637 1.00 0.00 C ATOM 903 CG GLU A 81 4.327 -3.054 -12.347 1.00 0.00 C ATOM 904 CD GLU A 81 5.103 -3.405 -13.618 1.00 0.00 C ATOM 905 OE1 GLU A 81 5.057 -2.583 -14.557 1.00 0.00 O ATOM 906 OE2 GLU A 81 5.724 -4.490 -13.621 1.00 0.00 O ATOM 0 H GLU A 81 2.620 -1.073 -12.114 1.00 0.00 H new ATOM 0 HA GLU A 81 3.958 -2.032 -9.762 1.00 0.00 H new ATOM 0 HB2 GLU A 81 5.182 -1.073 -12.365 1.00 0.00 H new ATOM 0 HB3 GLU A 81 5.898 -2.147 -11.180 1.00 0.00 H new ATOM 0 HG2 GLU A 81 4.315 -3.912 -11.675 1.00 0.00 H new ATOM 0 HG3 GLU A 81 3.290 -2.832 -12.599 1.00 0.00 H new ATOM 911 N ARG A 82 5.233 -0.112 -8.857 1.00 0.00 N ATOM 912 CA ARG A 82 5.805 1.048 -8.194 1.00 0.00 C ATOM 913 C ARG A 82 6.980 0.629 -7.309 1.00 0.00 C ATOM 914 O ARG A 82 6.889 -0.355 -6.575 1.00 0.00 O ATOM 915 CB ARG A 82 4.759 1.763 -7.336 1.00 0.00 C ATOM 916 CG ARG A 82 5.083 3.253 -7.204 1.00 0.00 C ATOM 917 CD ARG A 82 3.808 4.078 -7.022 1.00 0.00 C ATOM 918 NE ARG A 82 2.809 3.698 -8.047 1.00 0.00 N ATOM 919 CZ ARG A 82 2.746 4.239 -9.270 1.00 0.00 C ATOM 920 NH1 ARG A 82 3.622 5.187 -9.631 1.00 0.00 N ATOM 921 NH2 ARG A 82 1.806 3.833 -10.134 1.00 0.00 N ATOM 0 H ARG A 82 5.400 -0.999 -8.383 1.00 0.00 H new ATOM 0 HA ARG A 82 6.155 1.732 -8.967 1.00 0.00 H new ATOM 0 HB2 ARG A 82 3.772 1.640 -7.782 1.00 0.00 H new ATOM 0 HB3 ARG A 82 4.721 1.306 -6.347 1.00 0.00 H new ATOM 0 HG2 ARG A 82 5.747 3.410 -6.354 1.00 0.00 H new ATOM 0 HG3 ARG A 82 5.616 3.593 -8.092 1.00 0.00 H new ATOM 0 HD2 ARG A 82 3.399 3.915 -6.025 1.00 0.00 H new ATOM 0 HD3 ARG A 82 4.038 5.140 -7.102 1.00 0.00 H new ATOM 0 HE ARG A 82 2.126 2.979 -7.806 1.00 0.00 H new ATOM 0 HH11 ARG A 82 4.338 5.497 -8.974 1.00 0.00 H new ATOM 0 HH12 ARG A 82 3.573 5.598 -10.563 1.00 0.00 H new ATOM 0 HH21 ARG A 82 1.139 3.112 -9.860 1.00 0.00 H new ATOM 0 HH22 ARG A 82 1.758 4.245 -11.066 1.00 0.00 H new ATOM 932 N PRO A 83 8.084 1.416 -7.409 1.00 0.00 N ATOM 933 CA PRO A 83 9.276 1.136 -6.626 1.00 0.00 C ATOM 934 C PRO A 83 9.079 1.540 -5.164 1.00 0.00 C ATOM 935 O PRO A 83 8.520 2.597 -4.878 1.00 0.00 O ATOM 936 CB PRO A 83 10.389 1.912 -7.312 1.00 0.00 C ATOM 937 CG PRO A 83 9.699 2.961 -8.169 1.00 0.00 C ATOM 938 CD PRO A 83 8.228 2.587 -8.267 1.00 0.00 C ATOM 0 HA PRO A 83 9.514 0.073 -6.589 1.00 0.00 H new ATOM 0 HB2 PRO A 83 11.049 2.378 -6.580 1.00 0.00 H new ATOM 0 HB3 PRO A 83 11.006 1.253 -7.923 1.00 0.00 H new ATOM 0 HG2 PRO A 83 9.813 3.951 -7.727 1.00 0.00 H new ATOM 0 HG3 PRO A 83 10.150 3.001 -9.161 1.00 0.00 H new ATOM 0 HD2 PRO A 83 7.589 3.404 -7.932 1.00 0.00 H new ATOM 0 HD3 PRO A 83 7.945 2.362 -9.295 1.00 0.00 H new ATOM 943 N CYS A 84 9.549 0.677 -4.276 1.00 0.00 N ATOM 944 CA CYS A 84 9.432 0.930 -2.850 1.00 0.00 C ATOM 945 C CYS A 84 9.839 2.381 -2.585 1.00 0.00 C ATOM 946 O CYS A 84 11.001 2.745 -2.759 1.00 0.00 O ATOM 947 CB CYS A 84 10.265 -0.055 -2.029 1.00 0.00 C ATOM 948 SG CYS A 84 9.383 -1.581 -1.536 1.00 0.00 S ATOM 0 H CYS A 84 10.012 -0.199 -4.517 1.00 0.00 H new ATOM 0 HA CYS A 84 8.399 0.779 -2.536 1.00 0.00 H new ATOM 0 HB2 CYS A 84 11.147 -0.332 -2.606 1.00 0.00 H new ATOM 0 HB3 CYS A 84 10.618 0.450 -1.130 1.00 0.00 H new ATOM 952 N PRO A 85 8.833 3.191 -2.157 1.00 0.00 N ATOM 953 CA PRO A 85 9.076 4.595 -1.866 1.00 0.00 C ATOM 954 C PRO A 85 9.819 4.759 -0.540 1.00 0.00 C ATOM 955 O PRO A 85 9.677 3.936 0.362 1.00 0.00 O ATOM 956 CB PRO A 85 7.698 5.238 -1.859 1.00 0.00 C ATOM 957 CG PRO A 85 6.708 4.099 -1.684 1.00 0.00 C ATOM 958 CD PRO A 85 7.445 2.795 -1.940 1.00 0.00 C ATOM 0 HA PRO A 85 9.721 5.073 -2.604 1.00 0.00 H new ATOM 0 HB2 PRO A 85 7.609 5.961 -1.048 1.00 0.00 H new ATOM 0 HB3 PRO A 85 7.514 5.777 -2.789 1.00 0.00 H new ATOM 0 HG2 PRO A 85 6.289 4.109 -0.678 1.00 0.00 H new ATOM 0 HG3 PRO A 85 5.874 4.208 -2.378 1.00 0.00 H new ATOM 0 HD2 PRO A 85 7.355 2.116 -1.092 1.00 0.00 H new ATOM 0 HD3 PRO A 85 7.041 2.276 -2.809 1.00 0.00 H new ATOM 963 N GLU A 86 10.597 5.829 -0.463 1.00 0.00 N ATOM 964 CA GLU A 86 11.364 6.113 0.738 1.00 0.00 C ATOM 965 C GLU A 86 10.450 6.102 1.966 1.00 0.00 C ATOM 966 O GLU A 86 9.901 7.136 2.344 1.00 0.00 O ATOM 967 CB GLU A 86 12.102 7.447 0.616 1.00 0.00 C ATOM 968 CG GLU A 86 11.179 8.536 0.066 1.00 0.00 C ATOM 969 CD GLU A 86 11.558 9.909 0.625 1.00 0.00 C ATOM 970 OE1 GLU A 86 12.161 9.930 1.720 1.00 0.00 O ATOM 971 OE2 GLU A 86 11.236 10.908 -0.056 1.00 0.00 O ATOM 0 H GLU A 86 10.713 6.510 -1.213 1.00 0.00 H new ATOM 0 HA GLU A 86 12.114 5.331 0.860 1.00 0.00 H new ATOM 0 HB2 GLU A 86 12.482 7.747 1.592 1.00 0.00 H new ATOM 0 HB3 GLU A 86 12.965 7.331 -0.040 1.00 0.00 H new ATOM 0 HG2 GLU A 86 11.239 8.553 -1.022 1.00 0.00 H new ATOM 0 HG3 GLU A 86 10.145 8.307 0.325 1.00 0.00 H new ATOM 976 N TYR A 87 10.317 4.923 2.554 1.00 0.00 N ATOM 977 CA TYR A 87 9.480 4.764 3.731 1.00 0.00 C ATOM 978 C TYR A 87 9.462 3.307 4.200 1.00 0.00 C ATOM 979 O TYR A 87 9.411 3.038 5.399 1.00 0.00 O ATOM 980 CB TYR A 87 8.067 5.166 3.301 1.00 0.00 C ATOM 981 CG TYR A 87 7.241 5.818 4.411 1.00 0.00 C ATOM 982 CD1 TYR A 87 7.670 6.993 4.992 1.00 0.00 C ATOM 983 CD2 TYR A 87 6.065 5.230 4.832 1.00 0.00 C ATOM 984 CE1 TYR A 87 6.892 7.607 6.037 1.00 0.00 C ATOM 985 CE2 TYR A 87 5.287 5.843 5.876 1.00 0.00 C ATOM 986 CZ TYR A 87 5.739 7.001 6.427 1.00 0.00 C ATOM 987 OH TYR A 87 5.004 7.581 7.414 1.00 0.00 O ATOM 0 H TYR A 87 10.775 4.068 2.238 1.00 0.00 H new ATOM 0 HA TYR A 87 9.856 5.372 4.554 1.00 0.00 H new ATOM 0 HB2 TYR A 87 8.137 5.857 2.461 1.00 0.00 H new ATOM 0 HB3 TYR A 87 7.541 4.281 2.943 1.00 0.00 H new ATOM 0 HD1 TYR A 87 8.590 7.453 4.663 1.00 0.00 H new ATOM 0 HD2 TYR A 87 5.729 4.310 4.378 1.00 0.00 H new ATOM 0 HE1 TYR A 87 7.217 8.527 6.500 1.00 0.00 H new ATOM 0 HE2 TYR A 87 4.365 5.393 6.214 1.00 0.00 H new ATOM 0 HH TYR A 87 4.206 7.040 7.589 1.00 0.00 H new ATOM 996 N PHE A 88 9.506 2.407 3.229 1.00 0.00 N ATOM 997 CA PHE A 88 9.495 0.984 3.527 1.00 0.00 C ATOM 998 C PHE A 88 10.274 0.688 4.811 1.00 0.00 C ATOM 999 O PHE A 88 9.811 -0.073 5.659 1.00 0.00 O ATOM 1000 CB PHE A 88 10.179 0.277 2.356 1.00 0.00 C ATOM 1001 CG PHE A 88 11.318 1.080 1.724 1.00 0.00 C ATOM 1002 CD1 PHE A 88 12.560 1.050 2.277 1.00 0.00 C ATOM 1003 CD2 PHE A 88 11.089 1.822 0.607 1.00 0.00 C ATOM 1004 CE1 PHE A 88 13.617 1.795 1.690 1.00 0.00 C ATOM 1005 CE2 PHE A 88 12.146 2.568 0.020 1.00 0.00 C ATOM 1006 CZ PHE A 88 13.387 2.538 0.575 1.00 0.00 C ATOM 0 H PHE A 88 9.549 2.635 2.236 1.00 0.00 H new ATOM 0 HA PHE A 88 8.470 0.640 3.667 1.00 0.00 H new ATOM 0 HB2 PHE A 88 10.571 -0.680 2.701 1.00 0.00 H new ATOM 0 HB3 PHE A 88 9.434 0.059 1.591 1.00 0.00 H new ATOM 0 HD1 PHE A 88 12.743 0.460 3.163 1.00 0.00 H new ATOM 0 HD2 PHE A 88 10.103 1.844 0.166 1.00 0.00 H new ATOM 0 HE1 PHE A 88 14.603 1.771 2.129 1.00 0.00 H new ATOM 0 HE2 PHE A 88 11.964 3.158 -0.866 1.00 0.00 H new ATOM 0 HZ PHE A 88 14.191 3.105 0.129 1.00 0.00 H new ATOM 1015 N ASN A 89 11.442 1.305 4.913 1.00 0.00 N ATOM 1016 CA ASN A 89 12.288 1.117 6.079 1.00 0.00 C ATOM 1017 C ASN A 89 12.927 2.454 6.462 1.00 0.00 C ATOM 1018 O ASN A 89 12.693 2.967 7.554 1.00 0.00 O ATOM 1019 CB ASN A 89 13.412 0.122 5.787 1.00 0.00 C ATOM 1020 CG ASN A 89 12.852 -1.202 5.263 1.00 0.00 C ATOM 1021 OD1 ASN A 89 12.056 -1.867 5.905 1.00 0.00 O ATOM 1022 ND2 ASN A 89 13.310 -1.546 4.063 1.00 0.00 N ATOM 0 H ASN A 89 11.822 1.936 4.207 1.00 0.00 H new ATOM 0 HA ASN A 89 11.667 0.733 6.889 1.00 0.00 H new ATOM 0 HB2 ASN A 89 14.097 0.547 5.053 1.00 0.00 H new ATOM 0 HB3 ASN A 89 13.989 -0.057 6.695 1.00 0.00 H new ATOM 0 HD21 ASN A 89 12.996 -2.413 3.626 1.00 0.00 H new ATOM 0 HD22 ASN A 89 13.976 -0.943 3.579 1.00 0.00 H new ATOM 1028 N GLY A 90 13.720 2.978 5.540 1.00 0.00 N ATOM 1029 CA GLY A 90 14.394 4.246 5.767 1.00 0.00 C ATOM 1030 C GLY A 90 15.734 4.294 5.030 1.00 0.00 C ATOM 1031 O GLY A 90 16.780 4.483 5.648 1.00 0.00 O ATOM 0 H GLY A 90 13.911 2.549 4.635 1.00 0.00 H new ATOM 0 HA2 GLY A 90 13.759 5.065 5.429 1.00 0.00 H new ATOM 0 HA3 GLY A 90 14.557 4.389 6.835 1.00 0.00 H new ATOM 1035 N ILE A 91 15.659 4.120 3.718 1.00 0.00 N ATOM 1036 CA ILE A 91 16.853 4.142 2.891 1.00 0.00 C ATOM 1037 C ILE A 91 16.573 4.946 1.620 1.00 0.00 C ATOM 1038 O ILE A 91 15.492 5.512 1.465 1.00 0.00 O ATOM 1039 CB ILE A 91 17.343 2.718 2.622 1.00 0.00 C ATOM 1040 CG1 ILE A 91 18.869 2.637 2.706 1.00 0.00 C ATOM 1041 CG2 ILE A 91 16.815 2.199 1.283 1.00 0.00 C ATOM 1042 CD1 ILE A 91 19.385 3.320 3.974 1.00 0.00 C ATOM 0 H ILE A 91 14.790 3.963 3.208 1.00 0.00 H new ATOM 0 HA ILE A 91 17.669 4.643 3.412 1.00 0.00 H new ATOM 0 HB ILE A 91 16.943 2.068 3.400 1.00 0.00 H new ATOM 0 HG12 ILE A 91 19.182 1.593 2.698 1.00 0.00 H new ATOM 0 HG13 ILE A 91 19.311 3.109 1.829 1.00 0.00 H new ATOM 0 HG21 ILE A 91 17.179 1.185 1.117 1.00 0.00 H new ATOM 0 HG22 ILE A 91 15.725 2.196 1.298 1.00 0.00 H new ATOM 0 HG23 ILE A 91 17.165 2.846 0.479 1.00 0.00 H new ATOM 0 HD11 ILE A 91 20.472 3.248 4.009 1.00 0.00 H new ATOM 0 HD12 ILE A 91 19.091 4.369 3.967 1.00 0.00 H new ATOM 0 HD13 ILE A 91 18.960 2.830 4.850 1.00 0.00 H new ATOM 1053 N LYS A 92 17.566 4.971 0.743 1.00 0.00 N ATOM 1054 CA LYS A 92 17.440 5.696 -0.509 1.00 0.00 C ATOM 1055 C LYS A 92 16.614 4.867 -1.494 1.00 0.00 C ATOM 1056 O LYS A 92 17.072 3.833 -1.976 1.00 0.00 O ATOM 1057 CB LYS A 92 18.820 6.089 -1.042 1.00 0.00 C ATOM 1058 CG LYS A 92 19.604 4.855 -1.495 1.00 0.00 C ATOM 1059 CD LYS A 92 21.073 4.955 -1.080 1.00 0.00 C ATOM 1060 CE LYS A 92 21.809 3.642 -1.348 1.00 0.00 C ATOM 1061 NZ LYS A 92 23.152 3.664 -0.726 1.00 0.00 N ATOM 0 H LYS A 92 18.461 4.501 0.875 1.00 0.00 H new ATOM 0 HA LYS A 92 16.905 6.633 -0.354 1.00 0.00 H new ATOM 0 HB2 LYS A 92 18.708 6.780 -1.877 1.00 0.00 H new ATOM 0 HB3 LYS A 92 19.377 6.614 -0.266 1.00 0.00 H new ATOM 0 HG2 LYS A 92 19.160 3.959 -1.062 1.00 0.00 H new ATOM 0 HG3 LYS A 92 19.535 4.753 -2.578 1.00 0.00 H new ATOM 0 HD2 LYS A 92 21.555 5.765 -1.628 1.00 0.00 H new ATOM 0 HD3 LYS A 92 21.139 5.203 -0.021 1.00 0.00 H new ATOM 0 HE2 LYS A 92 21.232 2.807 -0.951 1.00 0.00 H new ATOM 0 HE3 LYS A 92 21.902 3.483 -2.422 1.00 0.00 H new ATOM 0 HZ1 LYS A 92 23.638 2.765 -0.918 1.00 0.00 H new ATOM 0 HZ2 LYS A 92 23.706 4.449 -1.124 1.00 0.00 H new ATOM 0 HZ3 LYS A 92 23.057 3.794 0.301 1.00 0.00 H new ATOM 1071 N TYR A 93 15.411 5.352 -1.762 1.00 0.00 N ATOM 1072 CA TYR A 93 14.516 4.668 -2.680 1.00 0.00 C ATOM 1073 C TYR A 93 14.926 4.918 -4.133 1.00 0.00 C ATOM 1074 O TYR A 93 14.137 5.432 -4.924 1.00 0.00 O ATOM 1075 CB TYR A 93 13.129 5.269 -2.443 1.00 0.00 C ATOM 1076 CG TYR A 93 12.954 6.677 -3.016 1.00 0.00 C ATOM 1077 CD1 TYR A 93 14.060 7.469 -3.251 1.00 0.00 C ATOM 1078 CD2 TYR A 93 11.691 7.155 -3.300 1.00 0.00 C ATOM 1079 CE1 TYR A 93 13.896 8.794 -3.791 1.00 0.00 C ATOM 1080 CE2 TYR A 93 11.526 8.480 -3.839 1.00 0.00 C ATOM 1081 CZ TYR A 93 12.637 9.234 -4.058 1.00 0.00 C ATOM 1082 OH TYR A 93 12.482 10.485 -4.568 1.00 0.00 O ATOM 0 H TYR A 93 15.035 6.210 -1.360 1.00 0.00 H new ATOM 0 HA TYR A 93 14.540 3.592 -2.509 1.00 0.00 H new ATOM 0 HB2 TYR A 93 12.380 4.612 -2.885 1.00 0.00 H new ATOM 0 HB3 TYR A 93 12.935 5.298 -1.371 1.00 0.00 H new ATOM 0 HD1 TYR A 93 15.049 7.095 -3.030 1.00 0.00 H new ATOM 0 HD2 TYR A 93 10.826 6.535 -3.118 1.00 0.00 H new ATOM 0 HE1 TYR A 93 14.753 9.424 -3.980 1.00 0.00 H new ATOM 0 HE2 TYR A 93 10.543 8.866 -4.064 1.00 0.00 H new ATOM 0 HH TYR A 93 11.529 10.665 -4.710 1.00 0.00 H new ATOM 1091 N ASN A 94 16.159 4.542 -4.439 1.00 0.00 N ATOM 1092 CA ASN A 94 16.682 4.719 -5.783 1.00 0.00 C ATOM 1093 C ASN A 94 17.052 3.354 -6.365 1.00 0.00 C ATOM 1094 O ASN A 94 16.759 3.070 -7.525 1.00 0.00 O ATOM 1095 CB ASN A 94 17.943 5.587 -5.772 1.00 0.00 C ATOM 1096 CG ASN A 94 17.793 6.761 -4.804 1.00 0.00 C ATOM 1097 OD1 ASN A 94 18.736 7.195 -4.163 1.00 0.00 O ATOM 1098 ND2 ASN A 94 16.558 7.250 -4.734 1.00 0.00 N ATOM 0 H ASN A 94 16.811 4.116 -3.780 1.00 0.00 H new ATOM 0 HA ASN A 94 15.914 5.206 -6.384 1.00 0.00 H new ATOM 0 HB2 ASN A 94 18.803 4.982 -5.484 1.00 0.00 H new ATOM 0 HB3 ASN A 94 18.139 5.962 -6.776 1.00 0.00 H new ATOM 0 HD21 ASN A 94 16.355 8.036 -4.116 1.00 0.00 H new ATOM 0 HD22 ASN A 94 15.814 6.839 -5.298 1.00 0.00 H new ATOM 1104 N THR A 95 17.691 2.545 -5.533 1.00 0.00 N ATOM 1105 CA THR A 95 18.104 1.217 -5.951 1.00 0.00 C ATOM 1106 C THR A 95 17.477 0.153 -5.047 1.00 0.00 C ATOM 1107 O THR A 95 17.012 0.462 -3.950 1.00 0.00 O ATOM 1108 CB THR A 95 19.634 1.178 -5.963 1.00 0.00 C ATOM 1109 OG1 THR A 95 19.946 -0.210 -6.037 1.00 0.00 O ATOM 1110 CG2 THR A 95 20.241 1.626 -4.631 1.00 0.00 C ATOM 0 H THR A 95 17.933 2.784 -4.571 1.00 0.00 H new ATOM 0 HA THR A 95 17.751 0.993 -6.958 1.00 0.00 H new ATOM 0 HB THR A 95 20.007 1.815 -6.765 1.00 0.00 H new ATOM 0 HG1 THR A 95 20.919 -0.326 -6.051 1.00 0.00 H new ATOM 0 HG21 THR A 95 21.328 1.580 -4.693 1.00 0.00 H new ATOM 0 HG22 THR A 95 19.933 2.649 -4.417 1.00 0.00 H new ATOM 0 HG23 THR A 95 19.895 0.968 -3.834 1.00 0.00 H new ATOM 1118 N THR A 96 17.484 -1.077 -5.539 1.00 0.00 N ATOM 1119 CA THR A 96 16.922 -2.186 -4.789 1.00 0.00 C ATOM 1120 C THR A 96 15.591 -1.780 -4.153 1.00 0.00 C ATOM 1121 O THR A 96 15.554 -1.358 -2.997 1.00 0.00 O ATOM 1122 CB THR A 96 17.967 -2.647 -3.771 1.00 0.00 C ATOM 1123 OG1 THR A 96 17.236 -3.481 -2.876 1.00 0.00 O ATOM 1124 CG2 THR A 96 18.468 -1.502 -2.889 1.00 0.00 C ATOM 0 H THR A 96 17.870 -1.330 -6.449 1.00 0.00 H new ATOM 0 HA THR A 96 16.691 -3.028 -5.442 1.00 0.00 H new ATOM 0 HB THR A 96 18.810 -3.098 -4.294 1.00 0.00 H new ATOM 0 HG1 THR A 96 17.838 -3.825 -2.184 1.00 0.00 H new ATOM 0 HG21 THR A 96 19.207 -1.882 -2.184 1.00 0.00 H new ATOM 0 HG22 THR A 96 18.924 -0.734 -3.514 1.00 0.00 H new ATOM 0 HG23 THR A 96 17.630 -1.073 -2.339 1.00 0.00 H new ATOM 1132 N ARG A 97 14.530 -1.922 -4.934 1.00 0.00 N ATOM 1133 CA ARG A 97 13.201 -1.575 -4.461 1.00 0.00 C ATOM 1134 C ARG A 97 12.138 -2.304 -5.285 1.00 0.00 C ATOM 1135 O ARG A 97 12.228 -2.360 -6.510 1.00 0.00 O ATOM 1136 CB ARG A 97 12.960 -0.067 -4.551 1.00 0.00 C ATOM 1137 CG ARG A 97 13.389 0.476 -5.915 1.00 0.00 C ATOM 1138 CD ARG A 97 14.503 1.515 -5.766 1.00 0.00 C ATOM 1139 NE ARG A 97 14.130 2.762 -6.473 1.00 0.00 N ATOM 1140 CZ ARG A 97 13.857 2.829 -7.783 1.00 0.00 C ATOM 1141 NH1 ARG A 97 13.912 1.723 -8.538 1.00 0.00 N ATOM 1142 NH2 ARG A 97 13.527 4.003 -8.338 1.00 0.00 N ATOM 0 H ARG A 97 14.564 -2.273 -5.891 1.00 0.00 H new ATOM 0 HA ARG A 97 13.130 -1.881 -3.417 1.00 0.00 H new ATOM 0 HB2 ARG A 97 11.904 0.147 -4.386 1.00 0.00 H new ATOM 0 HB3 ARG A 97 13.515 0.441 -3.762 1.00 0.00 H new ATOM 0 HG2 ARG A 97 13.734 -0.344 -6.545 1.00 0.00 H new ATOM 0 HG3 ARG A 97 12.532 0.925 -6.417 1.00 0.00 H new ATOM 0 HD2 ARG A 97 14.678 1.724 -4.711 1.00 0.00 H new ATOM 0 HD3 ARG A 97 15.435 1.122 -6.172 1.00 0.00 H new ATOM 0 HE ARG A 97 14.078 3.623 -5.929 1.00 0.00 H new ATOM 0 HH11 ARG A 97 14.162 0.829 -8.115 1.00 0.00 H new ATOM 0 HH12 ARG A 97 13.704 1.775 -9.535 1.00 0.00 H new ATOM 0 HH21 ARG A 97 13.484 4.845 -7.763 1.00 0.00 H new ATOM 0 HH22 ARG A 97 13.319 4.055 -9.335 1.00 0.00 H new ATOM 1153 N ASN A 98 11.155 -2.844 -4.579 1.00 0.00 N ATOM 1154 CA ASN A 98 10.076 -3.568 -5.230 1.00 0.00 C ATOM 1155 C ASN A 98 8.759 -3.261 -4.514 1.00 0.00 C ATOM 1156 O ASN A 98 8.606 -3.562 -3.331 1.00 0.00 O ATOM 1157 CB ASN A 98 10.307 -5.078 -5.167 1.00 0.00 C ATOM 1158 CG ASN A 98 11.797 -5.398 -5.025 1.00 0.00 C ATOM 1159 OD1 ASN A 98 12.309 -5.626 -3.941 1.00 0.00 O ATOM 1160 ND2 ASN A 98 12.462 -5.403 -6.177 1.00 0.00 N ATOM 0 H ASN A 98 11.083 -2.795 -3.563 1.00 0.00 H new ATOM 0 HA ASN A 98 10.040 -3.253 -6.273 1.00 0.00 H new ATOM 0 HB2 ASN A 98 9.759 -5.499 -4.324 1.00 0.00 H new ATOM 0 HB3 ASN A 98 9.915 -5.548 -6.069 1.00 0.00 H new ATOM 0 HD21 ASN A 98 13.461 -5.606 -6.188 1.00 0.00 H new ATOM 0 HD22 ASN A 98 11.972 -5.204 -7.049 1.00 0.00 H new ATOM 1166 N ALA A 99 7.840 -2.667 -5.261 1.00 0.00 N ATOM 1167 CA ALA A 99 6.540 -2.318 -4.713 1.00 0.00 C ATOM 1168 C ALA A 99 5.498 -2.329 -5.834 1.00 0.00 C ATOM 1169 O ALA A 99 4.775 -1.352 -6.024 1.00 0.00 O ATOM 1170 CB ALA A 99 6.629 -0.960 -4.014 1.00 0.00 C ATOM 0 H ALA A 99 7.970 -2.418 -6.242 1.00 0.00 H new ATOM 0 HA ALA A 99 6.229 -3.050 -3.967 1.00 0.00 H new ATOM 0 HB1 ALA A 99 5.654 -0.698 -3.603 1.00 0.00 H new ATOM 0 HB2 ALA A 99 7.361 -1.013 -3.208 1.00 0.00 H new ATOM 0 HB3 ALA A 99 6.936 -0.200 -4.733 1.00 0.00 H new ATOM 1176 N TYR A 100 5.455 -3.445 -6.548 1.00 0.00 N ATOM 1177 CA TYR A 100 4.514 -3.596 -7.644 1.00 0.00 C ATOM 1178 C TYR A 100 3.296 -4.414 -7.212 1.00 0.00 C ATOM 1179 O TYR A 100 3.344 -5.123 -6.209 1.00 0.00 O ATOM 1180 CB TYR A 100 5.263 -4.356 -8.741 1.00 0.00 C ATOM 1181 CG TYR A 100 6.779 -4.153 -8.714 1.00 0.00 C ATOM 1182 CD1 TYR A 100 7.317 -2.928 -9.053 1.00 0.00 C ATOM 1183 CD2 TYR A 100 7.609 -5.195 -8.352 1.00 0.00 C ATOM 1184 CE1 TYR A 100 8.743 -2.737 -9.029 1.00 0.00 C ATOM 1185 CE2 TYR A 100 9.036 -5.004 -8.327 1.00 0.00 C ATOM 1186 CZ TYR A 100 9.532 -3.784 -8.667 1.00 0.00 C ATOM 1187 OH TYR A 100 10.880 -3.603 -8.644 1.00 0.00 O ATOM 0 H TYR A 100 6.057 -4.253 -6.388 1.00 0.00 H new ATOM 0 HA TYR A 100 4.156 -2.623 -7.980 1.00 0.00 H new ATOM 0 HB2 TYR A 100 5.047 -5.420 -8.644 1.00 0.00 H new ATOM 0 HB3 TYR A 100 4.882 -4.041 -9.712 1.00 0.00 H new ATOM 0 HD1 TYR A 100 6.668 -2.113 -9.336 1.00 0.00 H new ATOM 0 HD2 TYR A 100 7.188 -6.154 -8.087 1.00 0.00 H new ATOM 0 HE1 TYR A 100 9.177 -1.784 -9.292 1.00 0.00 H new ATOM 0 HE2 TYR A 100 9.697 -5.810 -8.045 1.00 0.00 H new ATOM 0 HH TYR A 100 11.120 -3.028 -7.887 1.00 0.00 H new ATOM 1196 N ARG A 101 2.232 -4.290 -7.993 1.00 0.00 N ATOM 1197 CA ARG A 101 1.004 -5.010 -7.704 1.00 0.00 C ATOM 1198 C ARG A 101 0.131 -5.093 -8.957 1.00 0.00 C ATOM 1199 O ARG A 101 0.067 -4.145 -9.739 1.00 0.00 O ATOM 1200 CB ARG A 101 0.214 -4.325 -6.586 1.00 0.00 C ATOM 1201 CG ARG A 101 0.094 -2.821 -6.841 1.00 0.00 C ATOM 1202 CD ARG A 101 -1.217 -2.272 -6.274 1.00 0.00 C ATOM 1203 NE ARG A 101 -2.238 -3.342 -6.233 1.00 0.00 N ATOM 1204 CZ ARG A 101 -2.667 -4.013 -7.311 1.00 0.00 C ATOM 1205 NH1 ARG A 101 -2.165 -3.730 -8.521 1.00 0.00 N ATOM 1206 NH2 ARG A 101 -3.597 -4.970 -7.178 1.00 0.00 N ATOM 0 H ARG A 101 2.196 -3.702 -8.825 1.00 0.00 H new ATOM 0 HA ARG A 101 1.277 -6.014 -7.379 1.00 0.00 H new ATOM 0 HB2 ARG A 101 -0.780 -4.766 -6.516 1.00 0.00 H new ATOM 0 HB3 ARG A 101 0.707 -4.497 -5.629 1.00 0.00 H new ATOM 0 HG2 ARG A 101 0.937 -2.303 -6.384 1.00 0.00 H new ATOM 0 HG3 ARG A 101 0.141 -2.625 -7.912 1.00 0.00 H new ATOM 0 HD2 ARG A 101 -1.052 -1.877 -5.272 1.00 0.00 H new ATOM 0 HD3 ARG A 101 -1.570 -1.444 -6.889 1.00 0.00 H new ATOM 0 HE ARG A 101 -2.641 -3.584 -5.328 1.00 0.00 H new ATOM 0 HH11 ARG A 101 -1.456 -3.004 -8.622 1.00 0.00 H new ATOM 0 HH12 ARG A 101 -2.492 -4.241 -9.341 1.00 0.00 H new ATOM 0 HH21 ARG A 101 -3.977 -5.187 -6.257 1.00 0.00 H new ATOM 0 HH22 ARG A 101 -3.924 -5.481 -7.998 1.00 0.00 H new ATOM 1217 N GLU A 102 -0.521 -6.237 -9.110 1.00 0.00 N ATOM 1218 CA GLU A 102 -1.388 -6.456 -10.255 1.00 0.00 C ATOM 1219 C GLU A 102 -2.856 -6.333 -9.842 1.00 0.00 C ATOM 1220 O GLU A 102 -3.286 -6.954 -8.871 1.00 0.00 O ATOM 1221 CB GLU A 102 -1.112 -7.818 -10.898 1.00 0.00 C ATOM 1222 CG GLU A 102 -0.721 -8.854 -9.842 1.00 0.00 C ATOM 1223 CD GLU A 102 -0.600 -10.249 -10.460 1.00 0.00 C ATOM 1224 OE1 GLU A 102 0.419 -10.478 -11.146 1.00 0.00 O ATOM 1225 OE2 GLU A 102 -1.529 -11.053 -10.232 1.00 0.00 O ATOM 0 H GLU A 102 -0.466 -7.021 -8.460 1.00 0.00 H new ATOM 0 HA GLU A 102 -1.175 -5.688 -10.999 1.00 0.00 H new ATOM 0 HB2 GLU A 102 -1.998 -8.157 -11.435 1.00 0.00 H new ATOM 0 HB3 GLU A 102 -0.312 -7.722 -11.632 1.00 0.00 H new ATOM 0 HG2 GLU A 102 0.227 -8.572 -9.384 1.00 0.00 H new ATOM 0 HG3 GLU A 102 -1.467 -8.868 -9.047 1.00 0.00 H new ATOM 1230 N CYS A 103 -3.584 -5.526 -10.600 1.00 0.00 N ATOM 1231 CA CYS A 103 -4.996 -5.314 -10.325 1.00 0.00 C ATOM 1232 C CYS A 103 -5.745 -6.614 -10.620 1.00 0.00 C ATOM 1233 O CYS A 103 -5.573 -7.205 -11.685 1.00 0.00 O ATOM 1234 CB CYS A 103 -5.557 -4.137 -11.126 1.00 0.00 C ATOM 1235 SG CYS A 103 -6.053 -2.691 -10.120 1.00 0.00 S ATOM 0 H CYS A 103 -3.224 -5.011 -11.404 1.00 0.00 H new ATOM 0 HA CYS A 103 -5.129 -5.051 -9.276 1.00 0.00 H new ATOM 0 HB2 CYS A 103 -4.807 -3.818 -11.850 1.00 0.00 H new ATOM 0 HB3 CYS A 103 -6.422 -4.481 -11.693 1.00 0.00 H new ATOM 1239 N LEU A 104 -6.559 -7.022 -9.659 1.00 0.00 N ATOM 1240 CA LEU A 104 -7.336 -8.241 -9.802 1.00 0.00 C ATOM 1241 C LEU A 104 -8.269 -8.109 -11.007 1.00 0.00 C ATOM 1242 O LEU A 104 -8.547 -7.000 -11.461 1.00 0.00 O ATOM 1243 CB LEU A 104 -8.062 -8.572 -8.496 1.00 0.00 C ATOM 1244 CG LEU A 104 -7.605 -9.843 -7.779 1.00 0.00 C ATOM 1245 CD1 LEU A 104 -7.966 -11.090 -8.588 1.00 0.00 C ATOM 1246 CD2 LEU A 104 -6.111 -9.784 -7.454 1.00 0.00 C ATOM 0 H LEU A 104 -6.698 -6.529 -8.777 1.00 0.00 H new ATOM 0 HA LEU A 104 -6.679 -9.089 -9.998 1.00 0.00 H new ATOM 0 HB2 LEU A 104 -7.942 -7.731 -7.814 1.00 0.00 H new ATOM 0 HB3 LEU A 104 -9.127 -8.661 -8.708 1.00 0.00 H new ATOM 0 HG LEU A 104 -8.138 -9.909 -6.831 1.00 0.00 H new ATOM 0 HD11 LEU A 104 -7.630 -11.979 -8.055 1.00 0.00 H new ATOM 0 HD12 LEU A 104 -9.047 -11.135 -8.724 1.00 0.00 H new ATOM 0 HD13 LEU A 104 -7.479 -11.045 -9.562 1.00 0.00 H new ATOM 0 HD21 LEU A 104 -5.813 -10.700 -6.944 1.00 0.00 H new ATOM 0 HD22 LEU A 104 -5.542 -9.681 -8.378 1.00 0.00 H new ATOM 0 HD23 LEU A 104 -5.913 -8.929 -6.808 1.00 0.00 H new ATOM 1257 N GLU A 105 -8.726 -9.254 -11.491 1.00 0.00 N ATOM 1258 CA GLU A 105 -9.622 -9.279 -12.635 1.00 0.00 C ATOM 1259 C GLU A 105 -10.993 -8.722 -12.247 1.00 0.00 C ATOM 1260 O GLU A 105 -11.872 -8.581 -13.096 1.00 0.00 O ATOM 1261 CB GLU A 105 -9.745 -10.694 -13.204 1.00 0.00 C ATOM 1262 CG GLU A 105 -9.928 -10.661 -14.721 1.00 0.00 C ATOM 1263 CD GLU A 105 -9.801 -12.063 -15.321 1.00 0.00 C ATOM 1264 OE1 GLU A 105 -10.708 -12.879 -15.053 1.00 0.00 O ATOM 1265 OE2 GLU A 105 -8.798 -12.287 -16.032 1.00 0.00 O ATOM 0 H GLU A 105 -8.493 -10.172 -11.112 1.00 0.00 H new ATOM 0 HA GLU A 105 -9.202 -8.645 -13.416 1.00 0.00 H new ATOM 0 HB2 GLU A 105 -8.853 -11.269 -12.954 1.00 0.00 H new ATOM 0 HB3 GLU A 105 -10.592 -11.203 -12.743 1.00 0.00 H new ATOM 0 HG2 GLU A 105 -10.906 -10.245 -14.964 1.00 0.00 H new ATOM 0 HG3 GLU A 105 -9.182 -10.002 -15.166 1.00 0.00 H new ATOM 1270 N ASN A 106 -11.133 -8.422 -10.964 1.00 0.00 N ATOM 1271 CA ASN A 106 -12.383 -7.882 -10.454 1.00 0.00 C ATOM 1272 C ASN A 106 -12.258 -6.365 -10.310 1.00 0.00 C ATOM 1273 O ASN A 106 -13.144 -5.716 -9.755 1.00 0.00 O ATOM 1274 CB ASN A 106 -12.711 -8.464 -9.077 1.00 0.00 C ATOM 1275 CG ASN A 106 -14.053 -9.198 -9.098 1.00 0.00 C ATOM 1276 OD1 ASN A 106 -15.114 -8.605 -9.196 1.00 0.00 O ATOM 1277 ND2 ASN A 106 -13.947 -10.520 -9.000 1.00 0.00 N ATOM 0 H ASN A 106 -10.402 -8.542 -10.263 1.00 0.00 H new ATOM 0 HA ASN A 106 -13.175 -8.144 -11.155 1.00 0.00 H new ATOM 0 HB2 ASN A 106 -11.922 -9.151 -8.771 1.00 0.00 H new ATOM 0 HB3 ASN A 106 -12.742 -7.664 -8.338 1.00 0.00 H new ATOM 0 HD21 ASN A 106 -14.786 -11.101 -9.004 1.00 0.00 H new ATOM 0 HD22 ASN A 106 -13.027 -10.953 -8.921 1.00 0.00 H new ATOM 1283 N GLY A 107 -11.151 -5.843 -10.818 1.00 0.00 N ATOM 1284 CA GLY A 107 -10.899 -4.414 -10.752 1.00 0.00 C ATOM 1285 C GLY A 107 -10.594 -3.976 -9.319 1.00 0.00 C ATOM 1286 O GLY A 107 -10.624 -2.786 -9.009 1.00 0.00 O ATOM 0 H GLY A 107 -10.419 -6.385 -11.277 1.00 0.00 H new ATOM 0 HA2 GLY A 107 -10.061 -4.159 -11.400 1.00 0.00 H new ATOM 0 HA3 GLY A 107 -11.767 -3.871 -11.125 1.00 0.00 H new ATOM 1290 N THR A 108 -10.306 -4.962 -8.481 1.00 0.00 N ATOM 1291 CA THR A 108 -9.995 -4.693 -7.087 1.00 0.00 C ATOM 1292 C THR A 108 -8.493 -4.458 -6.912 1.00 0.00 C ATOM 1293 O THR A 108 -7.728 -4.566 -7.869 1.00 0.00 O ATOM 1294 CB THR A 108 -10.528 -5.858 -6.251 1.00 0.00 C ATOM 1295 OG1 THR A 108 -9.925 -7.010 -6.834 1.00 0.00 O ATOM 1296 CG2 THR A 108 -12.029 -6.083 -6.451 1.00 0.00 C ATOM 0 H THR A 108 -10.282 -5.948 -8.741 1.00 0.00 H new ATOM 0 HA THR A 108 -10.478 -3.779 -6.743 1.00 0.00 H new ATOM 0 HB THR A 108 -10.325 -5.670 -5.197 1.00 0.00 H new ATOM 0 HG1 THR A 108 -10.216 -7.811 -6.351 1.00 0.00 H new ATOM 0 HG21 THR A 108 -12.357 -6.921 -5.835 1.00 0.00 H new ATOM 0 HG22 THR A 108 -12.573 -5.185 -6.160 1.00 0.00 H new ATOM 0 HG23 THR A 108 -12.227 -6.304 -7.500 1.00 0.00 H new ATOM 1304 N TRP A 109 -8.116 -4.140 -5.682 1.00 0.00 N ATOM 1305 CA TRP A 109 -6.720 -3.889 -5.369 1.00 0.00 C ATOM 1306 C TRP A 109 -6.105 -5.196 -4.867 1.00 0.00 C ATOM 1307 O TRP A 109 -6.790 -6.214 -4.776 1.00 0.00 O ATOM 1308 CB TRP A 109 -6.582 -2.740 -4.367 1.00 0.00 C ATOM 1309 CG TRP A 109 -6.405 -1.365 -5.017 1.00 0.00 C ATOM 1310 CD1 TRP A 109 -7.076 -0.236 -4.753 1.00 0.00 C ATOM 1311 CD2 TRP A 109 -5.465 -1.020 -6.055 1.00 0.00 C ATOM 1312 NE1 TRP A 109 -6.639 0.807 -5.542 1.00 0.00 N ATOM 1313 CE2 TRP A 109 -5.628 0.316 -6.359 1.00 0.00 C ATOM 1314 CE3 TRP A 109 -4.507 -1.811 -6.716 1.00 0.00 C ATOM 1315 CZ2 TRP A 109 -4.868 0.979 -7.330 1.00 0.00 C ATOM 1316 CZ3 TRP A 109 -3.757 -1.133 -7.684 1.00 0.00 C ATOM 1317 CH2 TRP A 109 -3.908 0.212 -8.002 1.00 0.00 C ATOM 0 H TRP A 109 -8.753 -4.051 -4.891 1.00 0.00 H new ATOM 0 HA TRP A 109 -6.177 -3.568 -6.258 1.00 0.00 H new ATOM 0 HB2 TRP A 109 -7.467 -2.718 -3.730 1.00 0.00 H new ATOM 0 HB3 TRP A 109 -5.728 -2.937 -3.719 1.00 0.00 H new ATOM 0 HD1 TRP A 109 -7.860 -0.153 -4.015 1.00 0.00 H new ATOM 0 HE1 TRP A 109 -6.993 1.764 -5.528 1.00 0.00 H new ATOM 0 HE3 TRP A 109 -4.362 -2.858 -6.494 1.00 0.00 H new ATOM 0 HZ2 TRP A 109 -5.014 2.026 -7.549 1.00 0.00 H new ATOM 0 HZ3 TRP A 109 -3.008 -1.695 -8.222 1.00 0.00 H new ATOM 0 HH2 TRP A 109 -3.288 0.663 -8.763 1.00 0.00 H new ATOM 1327 N ALA A 110 -4.818 -5.126 -4.556 1.00 0.00 N ATOM 1328 CA ALA A 110 -4.104 -6.293 -4.066 1.00 0.00 C ATOM 1329 C ALA A 110 -4.011 -6.226 -2.540 1.00 0.00 C ATOM 1330 O ALA A 110 -3.819 -5.151 -1.974 1.00 0.00 O ATOM 1331 CB ALA A 110 -2.727 -6.363 -4.731 1.00 0.00 C ATOM 0 H ALA A 110 -4.253 -4.281 -4.634 1.00 0.00 H new ATOM 0 HA ALA A 110 -4.639 -7.207 -4.323 1.00 0.00 H new ATOM 0 HB1 ALA A 110 -2.190 -7.238 -4.365 1.00 0.00 H new ATOM 0 HB2 ALA A 110 -2.848 -6.438 -5.812 1.00 0.00 H new ATOM 0 HB3 ALA A 110 -2.161 -5.463 -4.491 1.00 0.00 H new ATOM 1337 N SER A 111 -4.154 -7.387 -1.920 1.00 0.00 N ATOM 1338 CA SER A 111 -4.089 -7.474 -0.470 1.00 0.00 C ATOM 1339 C SER A 111 -2.950 -6.598 0.055 1.00 0.00 C ATOM 1340 O SER A 111 -3.154 -5.783 0.954 1.00 0.00 O ATOM 1341 CB SER A 111 -3.900 -8.922 -0.014 1.00 0.00 C ATOM 1342 OG SER A 111 -5.071 -9.442 0.610 1.00 0.00 O ATOM 0 H SER A 111 -4.315 -8.276 -2.394 1.00 0.00 H new ATOM 0 HA SER A 111 -5.033 -7.114 -0.062 1.00 0.00 H new ATOM 0 HB2 SER A 111 -3.641 -9.542 -0.873 1.00 0.00 H new ATOM 0 HB3 SER A 111 -3.063 -8.977 0.682 1.00 0.00 H new ATOM 0 HG SER A 111 -4.911 -10.369 0.885 1.00 0.00 H new ATOM 1347 N ARG A 112 -1.776 -6.797 -0.525 1.00 0.00 N ATOM 1348 CA ARG A 112 -0.605 -6.035 -0.126 1.00 0.00 C ATOM 1349 C ARG A 112 0.512 -6.198 -1.159 1.00 0.00 C ATOM 1350 O ARG A 112 0.932 -7.317 -1.453 1.00 0.00 O ATOM 1351 CB ARG A 112 -0.094 -6.489 1.243 1.00 0.00 C ATOM 1352 CG ARG A 112 -0.404 -5.444 2.317 1.00 0.00 C ATOM 1353 CD ARG A 112 -1.028 -6.095 3.553 1.00 0.00 C ATOM 1354 NE ARG A 112 0.010 -6.321 4.584 1.00 0.00 N ATOM 1355 CZ ARG A 112 -0.186 -7.030 5.704 1.00 0.00 C ATOM 1356 NH1 ARG A 112 -1.380 -7.587 5.945 1.00 0.00 N ATOM 1357 NH2 ARG A 112 0.815 -7.182 6.583 1.00 0.00 N ATOM 0 H ARG A 112 -1.610 -7.475 -1.269 1.00 0.00 H new ATOM 0 HA ARG A 112 -0.897 -4.987 -0.064 1.00 0.00 H new ATOM 0 HB2 ARG A 112 -0.556 -7.439 1.511 1.00 0.00 H new ATOM 0 HB3 ARG A 112 0.982 -6.659 1.196 1.00 0.00 H new ATOM 0 HG2 ARG A 112 0.512 -4.924 2.599 1.00 0.00 H new ATOM 0 HG3 ARG A 112 -1.085 -4.694 1.914 1.00 0.00 H new ATOM 0 HD2 ARG A 112 -1.816 -5.456 3.952 1.00 0.00 H new ATOM 0 HD3 ARG A 112 -1.493 -7.042 3.280 1.00 0.00 H new ATOM 0 HE ARG A 112 0.932 -5.912 4.432 1.00 0.00 H new ATOM 0 HH11 ARG A 112 -2.141 -7.472 5.276 1.00 0.00 H new ATOM 0 HH12 ARG A 112 -1.528 -8.127 6.798 1.00 0.00 H new ATOM 0 HH21 ARG A 112 1.724 -6.758 6.399 1.00 0.00 H new ATOM 0 HH22 ARG A 112 0.667 -7.721 7.436 1.00 0.00 H new ATOM 1368 N VAL A 113 0.961 -5.067 -1.682 1.00 0.00 N ATOM 1369 CA VAL A 113 2.021 -5.070 -2.676 1.00 0.00 C ATOM 1370 C VAL A 113 3.104 -6.067 -2.256 1.00 0.00 C ATOM 1371 O VAL A 113 3.356 -6.251 -1.066 1.00 0.00 O ATOM 1372 CB VAL A 113 2.558 -3.651 -2.873 1.00 0.00 C ATOM 1373 CG1 VAL A 113 3.175 -3.114 -1.580 1.00 0.00 C ATOM 1374 CG2 VAL A 113 3.564 -3.601 -4.024 1.00 0.00 C ATOM 0 H VAL A 113 0.610 -4.141 -1.436 1.00 0.00 H new ATOM 0 HA VAL A 113 1.637 -5.394 -3.643 1.00 0.00 H new ATOM 0 HB VAL A 113 1.718 -3.008 -3.135 1.00 0.00 H new ATOM 0 HG11 VAL A 113 3.549 -2.104 -1.747 1.00 0.00 H new ATOM 0 HG12 VAL A 113 2.418 -3.095 -0.796 1.00 0.00 H new ATOM 0 HG13 VAL A 113 3.998 -3.760 -1.274 1.00 0.00 H new ATOM 0 HG21 VAL A 113 3.930 -2.581 -4.143 1.00 0.00 H new ATOM 0 HG22 VAL A 113 4.401 -4.264 -3.805 1.00 0.00 H new ATOM 0 HG23 VAL A 113 3.079 -3.922 -4.946 1.00 0.00 H new ATOM 1384 N ASN A 114 3.716 -6.682 -3.256 1.00 0.00 N ATOM 1385 CA ASN A 114 4.767 -7.655 -3.006 1.00 0.00 C ATOM 1386 C ASN A 114 5.955 -6.956 -2.342 1.00 0.00 C ATOM 1387 O ASN A 114 6.496 -5.993 -2.884 1.00 0.00 O ATOM 1388 CB ASN A 114 5.258 -8.283 -4.312 1.00 0.00 C ATOM 1389 CG ASN A 114 5.999 -7.256 -5.170 1.00 0.00 C ATOM 1390 OD1 ASN A 114 7.165 -6.960 -4.962 1.00 0.00 O ATOM 1391 ND2 ASN A 114 5.261 -6.730 -6.143 1.00 0.00 N ATOM 0 H ASN A 114 3.505 -6.526 -4.242 1.00 0.00 H new ATOM 0 HA ASN A 114 4.359 -8.434 -2.362 1.00 0.00 H new ATOM 0 HB2 ASN A 114 5.918 -9.121 -4.091 1.00 0.00 H new ATOM 0 HB3 ASN A 114 4.410 -8.683 -4.868 1.00 0.00 H new ATOM 0 HD21 ASN A 114 5.665 -6.035 -6.770 1.00 0.00 H new ATOM 0 HD22 ASN A 114 4.291 -7.022 -6.262 1.00 0.00 H new ATOM 1397 N TYR A 115 6.325 -7.468 -1.177 1.00 0.00 N ATOM 1398 CA TYR A 115 7.439 -6.905 -0.433 1.00 0.00 C ATOM 1399 C TYR A 115 8.361 -8.007 0.091 1.00 0.00 C ATOM 1400 O TYR A 115 8.196 -8.478 1.216 1.00 0.00 O ATOM 1401 CB TYR A 115 6.821 -6.166 0.756 1.00 0.00 C ATOM 1402 CG TYR A 115 7.022 -4.649 0.718 1.00 0.00 C ATOM 1403 CD1 TYR A 115 6.503 -3.911 -0.327 1.00 0.00 C ATOM 1404 CD2 TYR A 115 7.719 -4.019 1.728 1.00 0.00 C ATOM 1405 CE1 TYR A 115 6.692 -2.483 -0.363 1.00 0.00 C ATOM 1406 CE2 TYR A 115 7.908 -2.592 1.692 1.00 0.00 C ATOM 1407 CZ TYR A 115 7.385 -1.895 0.648 1.00 0.00 C ATOM 1408 OH TYR A 115 7.563 -0.546 0.614 1.00 0.00 O ATOM 0 H TYR A 115 5.873 -8.266 -0.730 1.00 0.00 H new ATOM 0 HA TYR A 115 8.034 -6.250 -1.070 1.00 0.00 H new ATOM 0 HB2 TYR A 115 5.753 -6.380 0.788 1.00 0.00 H new ATOM 0 HB3 TYR A 115 7.252 -6.557 1.678 1.00 0.00 H new ATOM 0 HD1 TYR A 115 5.956 -4.404 -1.117 1.00 0.00 H new ATOM 0 HD2 TYR A 115 8.123 -4.596 2.546 1.00 0.00 H new ATOM 0 HE1 TYR A 115 6.292 -1.893 -1.175 1.00 0.00 H new ATOM 0 HE2 TYR A 115 8.453 -2.087 2.476 1.00 0.00 H new ATOM 0 HH TYR A 115 8.214 -0.319 -0.082 1.00 0.00 H new ATOM 1417 N SER A 116 9.312 -8.388 -0.749 1.00 0.00 N ATOM 1418 CA SER A 116 10.261 -9.426 -0.385 1.00 0.00 C ATOM 1419 C SER A 116 11.684 -8.863 -0.396 1.00 0.00 C ATOM 1420 O SER A 116 12.348 -8.824 0.637 1.00 0.00 O ATOM 1421 CB SER A 116 10.156 -10.624 -1.330 1.00 0.00 C ATOM 1422 OG SER A 116 8.904 -11.293 -1.208 1.00 0.00 O ATOM 0 H SER A 116 9.446 -7.996 -1.681 1.00 0.00 H new ATOM 0 HA SER A 116 10.022 -9.770 0.621 1.00 0.00 H new ATOM 0 HB2 SER A 116 10.288 -10.287 -2.358 1.00 0.00 H new ATOM 0 HB3 SER A 116 10.963 -11.325 -1.118 1.00 0.00 H new ATOM 0 HG SER A 116 8.876 -12.051 -1.829 1.00 0.00 H new ATOM 1427 N HIS A 117 12.108 -8.440 -1.578 1.00 0.00 N ATOM 1428 CA HIS A 117 13.440 -7.881 -1.739 1.00 0.00 C ATOM 1429 C HIS A 117 13.371 -6.355 -1.643 1.00 0.00 C ATOM 1430 O HIS A 117 14.259 -5.658 -2.129 1.00 0.00 O ATOM 1431 CB HIS A 117 14.079 -8.365 -3.042 1.00 0.00 C ATOM 1432 CG HIS A 117 13.827 -9.823 -3.345 1.00 0.00 C ATOM 1433 ND1 HIS A 117 14.400 -10.849 -2.614 1.00 0.00 N ATOM 1434 CD2 HIS A 117 13.061 -10.414 -4.305 1.00 0.00 C ATOM 1435 CE1 HIS A 117 13.990 -12.003 -3.122 1.00 0.00 C ATOM 1436 NE2 HIS A 117 13.159 -11.731 -4.169 1.00 0.00 N ATOM 0 H HIS A 117 11.553 -8.473 -2.433 1.00 0.00 H new ATOM 0 HA HIS A 117 14.085 -8.232 -0.934 1.00 0.00 H new ATOM 0 HB2 HIS A 117 13.699 -7.762 -3.867 1.00 0.00 H new ATOM 0 HB3 HIS A 117 15.155 -8.195 -2.992 1.00 0.00 H new ATOM 0 HD2 HIS A 117 12.474 -9.898 -5.050 1.00 0.00 H new ATOM 0 HE1 HIS A 117 14.266 -12.986 -2.769 1.00 0.00 H new ATOM 0 HE2 HIS A 117 12.690 -12.425 -4.751 1.00 0.00 H new ATOM 1443 N CYS A 118 12.307 -5.882 -1.012 1.00 0.00 N ATOM 1444 CA CYS A 118 12.110 -4.452 -0.845 1.00 0.00 C ATOM 1445 C CYS A 118 13.172 -3.930 0.125 1.00 0.00 C ATOM 1446 O CYS A 118 12.861 -3.585 1.264 1.00 0.00 O ATOM 1447 CB CYS A 118 10.692 -4.127 -0.368 1.00 0.00 C ATOM 1448 SG CYS A 118 10.397 -2.362 0.014 1.00 0.00 S ATOM 0 H CYS A 118 11.572 -6.464 -0.610 1.00 0.00 H new ATOM 0 HA CYS A 118 12.222 -3.953 -1.808 1.00 0.00 H new ATOM 0 HB2 CYS A 118 9.985 -4.441 -1.135 1.00 0.00 H new ATOM 0 HB3 CYS A 118 10.479 -4.718 0.523 1.00 0.00 H new ATOM 1452 N GLU A 119 14.403 -3.889 -0.363 1.00 0.00 N ATOM 1453 CA GLU A 119 15.513 -3.416 0.447 1.00 0.00 C ATOM 1454 C GLU A 119 15.239 -3.678 1.929 1.00 0.00 C ATOM 1455 O GLU A 119 15.002 -2.745 2.695 1.00 0.00 O ATOM 1456 CB GLU A 119 15.782 -1.931 0.194 1.00 0.00 C ATOM 1457 CG GLU A 119 14.634 -1.068 0.721 1.00 0.00 C ATOM 1458 CD GLU A 119 14.253 0.015 -0.291 1.00 0.00 C ATOM 1459 OE1 GLU A 119 15.140 0.839 -0.602 1.00 0.00 O ATOM 1460 OE2 GLU A 119 13.083 -0.006 -0.730 1.00 0.00 O ATOM 0 H GLU A 119 14.656 -4.175 -1.309 1.00 0.00 H new ATOM 0 HA GLU A 119 16.408 -3.968 0.160 1.00 0.00 H new ATOM 0 HB2 GLU A 119 16.713 -1.639 0.679 1.00 0.00 H new ATOM 0 HB3 GLU A 119 15.911 -1.758 -0.874 1.00 0.00 H new ATOM 0 HG2 GLU A 119 13.768 -1.696 0.930 1.00 0.00 H new ATOM 0 HG3 GLU A 119 14.926 -0.604 1.663 1.00 0.00 H new ATOM 1465 N PRO A 120 15.281 -4.986 2.299 1.00 0.00 N ATOM 1466 CA PRO A 120 15.039 -5.383 3.676 1.00 0.00 C ATOM 1467 C PRO A 120 16.247 -5.059 4.558 1.00 0.00 C ATOM 1468 O PRO A 120 16.830 -5.952 5.172 1.00 0.00 O ATOM 1469 CB PRO A 120 14.735 -6.871 3.608 1.00 0.00 C ATOM 1470 CG PRO A 120 15.271 -7.346 2.267 1.00 0.00 C ATOM 1471 CD PRO A 120 15.558 -6.118 1.419 1.00 0.00 C ATOM 0 HA PRO A 120 14.210 -4.841 4.132 1.00 0.00 H new ATOM 0 HB2 PRO A 120 15.212 -7.405 4.430 1.00 0.00 H new ATOM 0 HB3 PRO A 120 13.664 -7.055 3.687 1.00 0.00 H new ATOM 0 HG2 PRO A 120 16.178 -7.935 2.405 1.00 0.00 H new ATOM 0 HG3 PRO A 120 14.545 -7.991 1.772 1.00 0.00 H new ATOM 0 HD2 PRO A 120 16.592 -6.108 1.074 1.00 0.00 H new ATOM 0 HD3 PRO A 120 14.926 -6.093 0.531 1.00 0.00 H new ATOM 1476 N ILE A 121 16.585 -3.779 4.596 1.00 0.00 N ATOM 1477 CA ILE A 121 17.711 -3.325 5.394 1.00 0.00 C ATOM 1478 C ILE A 121 17.507 -3.757 6.848 1.00 0.00 C ATOM 1479 O ILE A 121 16.374 -3.927 7.296 1.00 0.00 O ATOM 1480 CB ILE A 121 17.917 -1.819 5.224 1.00 0.00 C ATOM 1481 CG1 ILE A 121 18.680 -1.513 3.933 1.00 0.00 C ATOM 1482 CG2 ILE A 121 18.604 -1.217 6.451 1.00 0.00 C ATOM 1483 CD1 ILE A 121 17.780 -0.807 2.918 1.00 0.00 C ATOM 0 H ILE A 121 16.099 -3.041 4.087 1.00 0.00 H new ATOM 0 HA ILE A 121 18.634 -3.790 5.048 1.00 0.00 H new ATOM 0 HB ILE A 121 16.938 -1.348 5.140 1.00 0.00 H new ATOM 0 HG12 ILE A 121 19.543 -0.886 4.157 1.00 0.00 H new ATOM 0 HG13 ILE A 121 19.061 -2.439 3.504 1.00 0.00 H new ATOM 0 HG21 ILE A 121 18.738 -0.145 6.304 1.00 0.00 H new ATOM 0 HG22 ILE A 121 17.987 -1.387 7.333 1.00 0.00 H new ATOM 0 HG23 ILE A 121 19.577 -1.689 6.591 1.00 0.00 H new ATOM 0 HD11 ILE A 121 18.347 -0.601 2.010 1.00 0.00 H new ATOM 0 HD12 ILE A 121 16.931 -1.447 2.678 1.00 0.00 H new ATOM 0 HD13 ILE A 121 17.420 0.131 3.341 1.00 0.00 H new ATOM 1494 N LEU A 122 18.622 -3.922 7.546 1.00 0.00 N ATOM 1495 CA LEU A 122 18.579 -4.330 8.939 1.00 0.00 C ATOM 1496 C LEU A 122 18.319 -3.105 9.818 1.00 0.00 C ATOM 1497 O LEU A 122 19.082 -2.825 10.741 1.00 0.00 O ATOM 1498 CB LEU A 122 19.851 -5.096 9.312 1.00 0.00 C ATOM 1499 CG LEU A 122 21.152 -4.291 9.275 1.00 0.00 C ATOM 1500 CD1 LEU A 122 21.975 -4.519 10.545 1.00 0.00 C ATOM 1501 CD2 LEU A 122 21.954 -4.605 8.009 1.00 0.00 C ATOM 0 H LEU A 122 19.560 -3.780 7.172 1.00 0.00 H new ATOM 0 HA LEU A 122 17.755 -5.024 9.107 1.00 0.00 H new ATOM 0 HB2 LEU A 122 19.726 -5.502 10.316 1.00 0.00 H new ATOM 0 HB3 LEU A 122 19.952 -5.945 8.635 1.00 0.00 H new ATOM 0 HG LEU A 122 20.898 -3.232 9.242 1.00 0.00 H new ATOM 0 HD11 LEU A 122 22.894 -3.935 10.493 1.00 0.00 H new ATOM 0 HD12 LEU A 122 21.396 -4.207 11.414 1.00 0.00 H new ATOM 0 HD13 LEU A 122 22.222 -5.577 10.634 1.00 0.00 H new ATOM 0 HD21 LEU A 122 22.874 -4.020 8.007 1.00 0.00 H new ATOM 0 HD22 LEU A 122 22.199 -5.667 7.988 1.00 0.00 H new ATOM 0 HD23 LEU A 122 21.361 -4.352 7.130 1.00 0.00 H new ATOM 1512 N ASP A 123 17.238 -2.407 9.499 1.00 0.00 N ATOM 1513 CA ASP A 123 16.868 -1.219 10.248 1.00 0.00 C ATOM 1514 C ASP A 123 16.294 -1.634 11.604 1.00 0.00 C ATOM 1515 O ASP A 123 15.249 -2.280 11.670 1.00 0.00 O ATOM 1516 CB ASP A 123 15.797 -0.414 9.508 1.00 0.00 C ATOM 1517 CG ASP A 123 14.381 -0.987 9.597 1.00 0.00 C ATOM 1518 OD1 ASP A 123 14.115 -1.958 8.858 1.00 0.00 O ATOM 1519 OD2 ASP A 123 13.597 -0.440 10.403 1.00 0.00 O ATOM 0 H ASP A 123 16.607 -2.642 8.732 1.00 0.00 H new ATOM 0 HA ASP A 123 17.761 -0.606 10.371 1.00 0.00 H new ATOM 0 HB2 ASP A 123 15.788 0.601 9.905 1.00 0.00 H new ATOM 0 HB3 ASP A 123 16.079 -0.343 8.457 1.00 0.00 H new ATOM 1523 N ASP A 124 17.003 -1.246 12.654 1.00 0.00 N ATOM 1524 CA ASP A 124 16.579 -1.569 14.006 1.00 0.00 C ATOM 1525 C ASP A 124 16.771 -3.067 14.251 1.00 0.00 C ATOM 1526 O ASP A 124 15.936 -3.878 13.853 1.00 0.00 O ATOM 1527 CB ASP A 124 15.097 -1.244 14.210 1.00 0.00 C ATOM 1528 CG ASP A 124 14.806 -0.221 15.310 1.00 0.00 C ATOM 1529 OD1 ASP A 124 15.789 0.361 15.818 1.00 0.00 O ATOM 1530 OD2 ASP A 124 13.608 -0.045 15.618 1.00 0.00 O ATOM 0 H ASP A 124 17.869 -0.710 12.596 1.00 0.00 H new ATOM 0 HA ASP A 124 17.178 -0.977 14.698 1.00 0.00 H new ATOM 0 HB2 ASP A 124 14.689 -0.871 13.270 1.00 0.00 H new ATOM 0 HB3 ASP A 124 14.567 -2.167 14.443 1.00 0.00 H new ATOM 1534 N LYS A 125 17.878 -3.389 14.906 1.00 0.00 N ATOM 1535 CA LYS A 125 18.191 -4.776 15.209 1.00 0.00 C ATOM 1536 C LYS A 125 18.593 -4.892 16.680 1.00 0.00 C ATOM 1537 O LYS A 125 19.779 -4.906 17.004 1.00 0.00 O ATOM 1538 CB LYS A 125 19.245 -5.311 14.239 1.00 0.00 C ATOM 1539 CG LYS A 125 19.263 -6.841 14.238 1.00 0.00 C ATOM 1540 CD LYS A 125 20.670 -7.374 14.514 1.00 0.00 C ATOM 1541 CE LYS A 125 21.313 -7.914 13.235 1.00 0.00 C ATOM 1542 NZ LYS A 125 22.744 -8.215 13.461 1.00 0.00 N ATOM 0 H LYS A 125 18.568 -2.714 15.235 1.00 0.00 H new ATOM 0 HA LYS A 125 17.313 -5.406 15.067 1.00 0.00 H new ATOM 0 HB2 LYS A 125 19.038 -4.946 13.233 1.00 0.00 H new ATOM 0 HB3 LYS A 125 20.228 -4.932 14.519 1.00 0.00 H new ATOM 0 HG2 LYS A 125 18.573 -7.217 14.994 1.00 0.00 H new ATOM 0 HG3 LYS A 125 18.913 -7.212 13.275 1.00 0.00 H new ATOM 0 HD2 LYS A 125 21.289 -6.578 14.929 1.00 0.00 H new ATOM 0 HD3 LYS A 125 20.623 -8.164 15.263 1.00 0.00 H new ATOM 0 HE2 LYS A 125 20.792 -8.816 12.912 1.00 0.00 H new ATOM 0 HE3 LYS A 125 21.211 -7.183 12.433 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 23.165 -8.580 12.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 23.240 -7.347 13.748 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 22.834 -8.929 14.211 1.00 0.00 H new ATOM 1552 N GLN A 126 17.582 -4.975 17.533 1.00 0.00 N ATOM 1553 CA GLN A 126 17.815 -5.090 18.962 1.00 0.00 C ATOM 1554 C GLN A 126 18.995 -4.210 19.380 1.00 0.00 C ATOM 1555 O GLN A 126 19.910 -4.674 20.058 1.00 0.00 O ATOM 1556 CB GLN A 126 18.049 -6.547 19.363 1.00 0.00 C ATOM 1557 CG GLN A 126 17.696 -6.775 20.835 1.00 0.00 C ATOM 1558 CD GLN A 126 18.754 -7.637 21.526 1.00 0.00 C ATOM 1559 OE1 GLN A 126 19.327 -8.545 20.946 1.00 0.00 O ATOM 1560 NE2 GLN A 126 18.980 -7.305 22.794 1.00 0.00 N ATOM 0 H GLN A 126 16.599 -4.965 17.261 1.00 0.00 H new ATOM 0 HA GLN A 126 16.924 -4.742 19.485 1.00 0.00 H new ATOM 0 HB2 GLN A 126 17.445 -7.202 18.735 1.00 0.00 H new ATOM 0 HB3 GLN A 126 19.092 -6.812 19.190 1.00 0.00 H new ATOM 0 HG2 GLN A 126 17.614 -5.816 21.346 1.00 0.00 H new ATOM 0 HG3 GLN A 126 16.722 -7.260 20.908 1.00 0.00 H new ATOM 0 HE21 GLN A 126 18.465 -6.534 23.219 1.00 0.00 H new ATOM 0 HE22 GLN A 126 19.668 -7.822 23.342 1.00 0.00 H new ATOM 1567 N ARG A 127 18.934 -2.955 18.959 1.00 0.00 N ATOM 1568 CA ARG A 127 19.986 -2.006 19.281 1.00 0.00 C ATOM 1569 C ARG A 127 21.355 -2.592 18.932 1.00 0.00 C ATOM 1570 O ARG A 127 21.973 -3.268 19.754 1.00 0.00 O ATOM 1571 CB ARG A 127 19.959 -1.637 20.766 1.00 0.00 C ATOM 1572 CG ARG A 127 19.341 -0.254 20.977 1.00 0.00 C ATOM 1573 CD ARG A 127 18.493 -0.221 22.250 1.00 0.00 C ATOM 1574 NE ARG A 127 17.228 -0.959 22.036 1.00 0.00 N ATOM 1575 CZ ARG A 127 17.025 -2.228 22.415 1.00 0.00 C ATOM 1576 NH1 ARG A 127 18.002 -2.907 23.030 1.00 0.00 N ATOM 1577 NH2 ARG A 127 15.845 -2.817 22.179 1.00 0.00 N ATOM 0 H ARG A 127 18.172 -2.574 18.398 1.00 0.00 H new ATOM 0 HA ARG A 127 19.812 -1.106 18.692 1.00 0.00 H new ATOM 0 HB2 ARG A 127 19.388 -2.383 21.319 1.00 0.00 H new ATOM 0 HB3 ARG A 127 20.973 -1.651 21.166 1.00 0.00 H new ATOM 0 HG2 ARG A 127 20.130 0.495 21.042 1.00 0.00 H new ATOM 0 HG3 ARG A 127 18.724 0.007 20.118 1.00 0.00 H new ATOM 0 HD2 ARG A 127 19.047 -0.665 23.077 1.00 0.00 H new ATOM 0 HD3 ARG A 127 18.279 0.811 22.527 1.00 0.00 H new ATOM 0 HE ARG A 127 16.463 -0.471 21.571 1.00 0.00 H new ATOM 0 HH11 ARG A 127 18.900 -2.458 23.210 1.00 0.00 H new ATOM 0 HH12 ARG A 127 17.848 -3.873 23.319 1.00 0.00 H new ATOM 0 HH21 ARG A 127 15.101 -2.299 21.711 1.00 0.00 H new ATOM 0 HH22 ARG A 127 15.690 -3.783 22.468 1.00 0.00 H new ATOM 1588 N LYS A 128 21.790 -2.313 17.713 1.00 0.00 N ATOM 1589 CA LYS A 128 23.075 -2.804 17.245 1.00 0.00 C ATOM 1590 C LYS A 128 24.195 -2.105 18.019 1.00 0.00 C ATOM 1591 O LYS A 128 25.350 -2.526 17.961 1.00 0.00 O ATOM 1592 CB LYS A 128 23.188 -2.651 15.727 1.00 0.00 C ATOM 1593 CG LYS A 128 22.763 -1.249 15.285 1.00 0.00 C ATOM 1594 CD LYS A 128 23.644 -0.745 14.140 1.00 0.00 C ATOM 1595 CE LYS A 128 24.876 -0.014 14.678 1.00 0.00 C ATOM 1596 NZ LYS A 128 25.553 0.729 13.591 1.00 0.00 N ATOM 0 H LYS A 128 21.275 -1.752 17.034 1.00 0.00 H new ATOM 0 HA LYS A 128 23.169 -3.872 17.441 1.00 0.00 H new ATOM 0 HB2 LYS A 128 24.215 -2.839 15.414 1.00 0.00 H new ATOM 0 HB3 LYS A 128 22.563 -3.396 15.235 1.00 0.00 H new ATOM 0 HG2 LYS A 128 21.721 -1.264 14.967 1.00 0.00 H new ATOM 0 HG3 LYS A 128 22.829 -0.562 16.129 1.00 0.00 H new ATOM 0 HD2 LYS A 128 23.957 -1.585 13.520 1.00 0.00 H new ATOM 0 HD3 LYS A 128 23.069 -0.075 13.502 1.00 0.00 H new ATOM 0 HE2 LYS A 128 24.581 0.676 15.469 1.00 0.00 H new ATOM 0 HE3 LYS A 128 25.567 -0.731 15.122 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 26.387 1.219 13.973 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 25.852 0.064 12.850 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 24.896 1.427 13.186 1.00 0.00 H new ATOM 1606 N TYR A 129 23.815 -1.051 18.724 1.00 0.00 N ATOM 1607 CA TYR A 129 24.774 -0.290 19.509 1.00 0.00 C ATOM 1608 C TYR A 129 24.061 0.635 20.498 1.00 0.00 C ATOM 1609 O TYR A 129 22.925 1.044 20.263 1.00 0.00 O ATOM 1610 CB TYR A 129 25.557 0.560 18.507 1.00 0.00 C ATOM 1611 CG TYR A 129 26.890 1.085 19.045 1.00 0.00 C ATOM 1612 CD1 TYR A 129 26.904 2.093 19.987 1.00 0.00 C ATOM 1613 CD2 TYR A 129 28.078 0.550 18.588 1.00 0.00 C ATOM 1614 CE1 TYR A 129 28.158 2.587 20.493 1.00 0.00 C ATOM 1615 CE2 TYR A 129 29.331 1.044 19.094 1.00 0.00 C ATOM 1616 CZ TYR A 129 29.310 2.039 20.022 1.00 0.00 C ATOM 1617 OH TYR A 129 30.495 2.505 20.500 1.00 0.00 O ATOM 0 H TYR A 129 22.857 -0.705 18.769 1.00 0.00 H new ATOM 0 HA TYR A 129 25.417 -0.957 20.084 1.00 0.00 H new ATOM 0 HB2 TYR A 129 25.746 -0.033 17.612 1.00 0.00 H new ATOM 0 HB3 TYR A 129 24.940 1.406 18.204 1.00 0.00 H new ATOM 0 HD1 TYR A 129 25.975 2.511 20.345 1.00 0.00 H new ATOM 0 HD2 TYR A 129 28.067 -0.239 17.851 1.00 0.00 H new ATOM 0 HE1 TYR A 129 28.183 3.376 21.231 1.00 0.00 H new ATOM 0 HE2 TYR A 129 30.267 0.634 18.745 1.00 0.00 H new ATOM 0 HH TYR A 129 31.233 2.020 20.075 1.00 0.00 H new ATOM 1626 N ASP A 130 24.758 0.938 21.582 1.00 0.00 N ATOM 1627 CA ASP A 130 24.207 1.807 22.608 1.00 0.00 C ATOM 1628 C ASP A 130 23.530 3.008 21.943 1.00 0.00 C ATOM 1629 O ASP A 130 24.175 3.768 21.223 1.00 0.00 O ATOM 1630 CB ASP A 130 25.306 2.335 23.531 1.00 0.00 C ATOM 1631 CG ASP A 130 26.394 1.322 23.888 1.00 0.00 C ATOM 1632 OD1 ASP A 130 26.127 0.114 23.704 1.00 0.00 O ATOM 1633 OD2 ASP A 130 27.469 1.776 24.338 1.00 0.00 O ATOM 0 H ASP A 130 25.700 0.597 21.773 1.00 0.00 H new ATOM 0 HA ASP A 130 23.493 1.228 23.193 1.00 0.00 H new ATOM 0 HB2 ASP A 130 25.775 3.197 23.056 1.00 0.00 H new ATOM 0 HB3 ASP A 130 24.845 2.690 24.453 1.00 0.00 H new ATOM 1637 N LEU A 131 22.239 3.140 22.208 1.00 0.00 N ATOM 1638 CA LEU A 131 21.467 4.235 21.644 1.00 0.00 C ATOM 1639 C LEU A 131 20.128 4.338 22.375 1.00 0.00 C ATOM 1640 O LEU A 131 19.075 4.106 21.782 1.00 0.00 O ATOM 1641 CB LEU A 131 21.332 4.071 20.129 1.00 0.00 C ATOM 1642 CG LEU A 131 22.169 5.022 19.273 1.00 0.00 C ATOM 1643 CD1 LEU A 131 22.402 4.443 17.877 1.00 0.00 C ATOM 1644 CD2 LEU A 131 21.532 6.413 19.217 1.00 0.00 C ATOM 0 H LEU A 131 21.708 2.507 22.806 1.00 0.00 H new ATOM 0 HA LEU A 131 21.984 5.183 21.792 1.00 0.00 H new ATOM 0 HB2 LEU A 131 21.602 3.047 19.869 1.00 0.00 H new ATOM 0 HB3 LEU A 131 20.283 4.202 19.862 1.00 0.00 H new ATOM 0 HG LEU A 131 23.146 5.133 19.743 1.00 0.00 H new ATOM 0 HD11 LEU A 131 23.000 5.140 17.289 1.00 0.00 H new ATOM 0 HD12 LEU A 131 22.930 3.493 17.961 1.00 0.00 H new ATOM 0 HD13 LEU A 131 21.443 4.283 17.385 1.00 0.00 H new ATOM 0 HD21 LEU A 131 22.147 7.070 18.602 1.00 0.00 H new ATOM 0 HD22 LEU A 131 20.534 6.339 18.784 1.00 0.00 H new ATOM 0 HD23 LEU A 131 21.461 6.821 20.225 1.00 0.00 H new ATOM 1655 N HIS A 132 20.210 4.685 23.650 1.00 0.00 N ATOM 1656 CA HIS A 132 19.016 4.822 24.468 1.00 0.00 C ATOM 1657 C HIS A 132 19.264 5.855 25.569 1.00 0.00 C ATOM 1658 O HIS A 132 20.326 5.866 26.187 1.00 0.00 O ATOM 1659 CB HIS A 132 18.575 3.463 25.017 1.00 0.00 C ATOM 1660 CG HIS A 132 17.957 3.529 26.392 1.00 0.00 C ATOM 1661 ND1 HIS A 132 18.695 3.386 27.554 1.00 0.00 N ATOM 1662 CD2 HIS A 132 16.664 3.724 26.779 1.00 0.00 C ATOM 1663 CE1 HIS A 132 17.872 3.491 28.587 1.00 0.00 C ATOM 1664 NE2 HIS A 132 16.614 3.699 28.106 1.00 0.00 N ATOM 0 H HIS A 132 21.085 4.876 24.138 1.00 0.00 H new ATOM 0 HA HIS A 132 18.191 5.186 23.856 1.00 0.00 H new ATOM 0 HB2 HIS A 132 17.856 3.020 24.328 1.00 0.00 H new ATOM 0 HB3 HIS A 132 19.438 2.798 25.049 1.00 0.00 H new ATOM 0 HD2 HIS A 132 15.823 3.873 26.118 1.00 0.00 H new ATOM 0 HE1 HIS A 132 18.150 3.424 29.629 1.00 0.00 H new ATOM 0 HE2 HIS A 132 15.773 3.816 28.671 1.00 0.00 H new ATOM 1672 N TYR A 133 18.264 6.699 25.780 1.00 0.00 N ATOM 1673 CA TYR A 133 18.360 7.733 26.796 1.00 0.00 C ATOM 1674 C TYR A 133 17.707 7.279 28.103 1.00 0.00 C ATOM 1675 O TYR A 133 18.398 6.915 29.053 1.00 0.00 O ATOM 1676 CB TYR A 133 17.590 8.936 26.246 1.00 0.00 C ATOM 1677 CG TYR A 133 17.874 10.246 26.983 1.00 0.00 C ATOM 1678 CD1 TYR A 133 18.940 11.035 26.601 1.00 0.00 C ATOM 1679 CD2 TYR A 133 17.065 10.638 28.031 1.00 0.00 C ATOM 1680 CE1 TYR A 133 19.207 12.268 27.296 1.00 0.00 C ATOM 1681 CE2 TYR A 133 17.333 11.871 28.725 1.00 0.00 C ATOM 1682 CZ TYR A 133 18.391 12.626 28.323 1.00 0.00 C ATOM 1683 OH TYR A 133 18.644 13.790 28.978 1.00 0.00 O ATOM 0 H TYR A 133 17.384 6.688 25.265 1.00 0.00 H new ATOM 0 HA TYR A 133 19.403 7.966 27.010 1.00 0.00 H new ATOM 0 HB2 TYR A 133 17.838 9.063 25.192 1.00 0.00 H new ATOM 0 HB3 TYR A 133 16.522 8.726 26.299 1.00 0.00 H new ATOM 0 HD1 TYR A 133 19.573 10.728 25.782 1.00 0.00 H new ATOM 0 HD2 TYR A 133 16.231 10.020 28.330 1.00 0.00 H new ATOM 0 HE1 TYR A 133 20.038 12.895 27.007 1.00 0.00 H new ATOM 0 HE2 TYR A 133 16.708 12.189 29.546 1.00 0.00 H new ATOM 0 HH TYR A 133 17.980 13.917 29.687 1.00 0.00 H new TER 1692 TYR A 133