USER MOD reduce.3.24.130724 H: found=0, std=0, add=744, rem=0, adj=22 USER MOD reduce.3.24.130724 removed 741 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 47 LYS NZ :NH3+ 179:sc= 1.13 (180deg=0) USER MOD Set 1.2: A 56 GLN : amide:sc= 0.949 K(o=2.1,f=-2.4) USER MOD Set 2.1: A 49 THR OG1 : rot 180:sc= -0.0134 USER MOD Set 2.2: A 51 THR OG1 : rot 180:sc= 0 USER MOD Set 3.1: A 17 GLN : amide:sc= -0.264 X(o=0.55,f=0.17) USER MOD Set 3.2: A 19 THR OG1 : rot -60:sc= -0.0295 USER MOD Set 3.3: A 22 CYS SG : rot -146:sc= 0.209 USER MOD Set 3.4: A 79 ASN : amide:sc= 0 X(o=0.55,f=0.38) USER MOD Set 3.5: A 81 GLN : amide:sc= 0.634 K(o=0.55,f=-0.4) USER MOD Set 4.1: A 5 GLN : amide:sc= 0.268 X(o=0.27,f=0.33) USER MOD Set 4.2: A 9 SER OG : rot 180:sc= 0 USER MOD Single : A 1 GLY N :NH3+ -142:sc= 0.00609 (180deg=0) USER MOD Single : A 4 GLN : amide:sc= 0.854 K(o=0.85,f=-3.1!) USER MOD Single : A 8 GLN : amide:sc=0.000138 X(o=0.00014,f=-0.35) USER MOD Single : A 10 LYS NZ :NH3+ 173:sc= 0.0437 (180deg=-0.0274) USER MOD Single : A 16 ASN : amide:sc= 1.16 K(o=1.2,f=0) USER MOD Single : A 18 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 24 ASN : amide:sc= 0.632 K(o=0.63,f=-0.26) USER MOD Single : A 25 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot -140:sc= 0 USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 37 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 38 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 TYR OH : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 46 THR OG1 : rot -45:sc= 0.0692 USER MOD Single : A 52 SER OG : rot 180:sc= -0.228 USER MOD Single : A 53 LYS NZ :NH3+ -162:sc= 1.11 (180deg=0.757) USER MOD Single : A 60 THR OG1 : rot 92:sc= 0.404 USER MOD Single : A 61 THR OG1 : rot 180:sc= 0 USER MOD Single : A 64 GLN : amide:sc= -0.0506 X(o=-0.051,f=-0.18) USER MOD Single : A 70 LYS NZ :NH3+ -154:sc= 1.22 (180deg=0.901) USER MOD Single : A 74 GLN : amide:sc= -0.584 K(o=-0.58,f=-1.2) USER MOD Single : A 75 LYS NZ :NH3+ -160:sc= 0.4 (180deg=0.32) USER MOD Single : A 77 LYS NZ :NH3+ -113:sc= 0.131 (180deg=0) USER MOD Single : A 80 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 82 MET CE :methyl -156:sc= 0 (180deg=-0.137) USER MOD Single : A 85 GLN : amide:sc= 0.943 K(o=0.94,f=0) USER MOD Single : A 87 TYR OH : rot -22:sc= 0.688 USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 44.586 44.544 -42.210 1.00 0.00 N ATOM 2 CA GLY A 1 43.812 43.524 -41.460 1.00 0.00 C ATOM 3 C GLY A 1 42.498 44.105 -40.964 1.00 0.00 C ATOM 4 O GLY A 1 41.804 44.756 -41.744 1.00 0.00 O ATOM 0 H1 GLY A 1 45.059 44.095 -43.020 1.00 0.00 H new ATOM 0 H2 GLY A 1 43.942 45.285 -42.553 1.00 0.00 H new ATOM 0 H3 GLY A 1 45.300 44.968 -41.584 1.00 0.00 H new ATOM 0 HA2 GLY A 1 43.616 42.665 -42.101 1.00 0.00 H new ATOM 0 HA3 GLY A 1 44.398 43.164 -40.615 1.00 0.00 H new ATOM 7 N ILE A 2 42.146 43.914 -39.684 1.00 0.00 N ATOM 8 CA ILE A 2 40.874 44.389 -39.098 1.00 0.00 C ATOM 9 C ILE A 2 41.135 45.293 -37.886 1.00 0.00 C ATOM 10 O ILE A 2 40.872 46.493 -37.968 1.00 0.00 O ATOM 11 CB ILE A 2 39.946 43.188 -38.777 1.00 0.00 C ATOM 12 CG1 ILE A 2 39.533 42.465 -40.083 1.00 0.00 C ATOM 13 CG2 ILE A 2 38.703 43.644 -37.991 1.00 0.00 C ATOM 14 CD1 ILE A 2 38.792 41.139 -39.874 1.00 0.00 C ATOM 0 H ILE A 2 42.739 43.421 -39.016 1.00 0.00 H new ATOM 0 HA ILE A 2 40.349 45.005 -39.828 1.00 0.00 H new ATOM 0 HB ILE A 2 40.498 42.487 -38.151 1.00 0.00 H new ATOM 0 HG12 ILE A 2 38.899 43.132 -40.667 1.00 0.00 H new ATOM 0 HG13 ILE A 2 40.428 42.276 -40.676 1.00 0.00 H new ATOM 0 HG21 ILE A 2 38.070 42.782 -37.779 1.00 0.00 H new ATOM 0 HG22 ILE A 2 39.014 44.105 -37.053 1.00 0.00 H new ATOM 0 HG23 ILE A 2 38.144 44.368 -38.583 1.00 0.00 H new ATOM 0 HD11 ILE A 2 38.543 40.705 -40.842 1.00 0.00 H new ATOM 0 HD12 ILE A 2 39.429 40.449 -39.320 1.00 0.00 H new ATOM 0 HD13 ILE A 2 37.876 41.319 -39.311 1.00 0.00 H new ATOM 26 N ALA A 3 41.721 44.782 -36.797 1.00 0.00 N ATOM 27 CA ALA A 3 42.080 45.599 -35.632 1.00 0.00 C ATOM 28 C ALA A 3 43.171 46.616 -36.003 1.00 0.00 C ATOM 29 O ALA A 3 43.056 47.802 -35.693 1.00 0.00 O ATOM 30 CB ALA A 3 42.539 44.693 -34.481 1.00 0.00 C ATOM 0 H ALA A 3 41.959 43.795 -36.698 1.00 0.00 H new ATOM 0 HA ALA A 3 41.202 46.156 -35.304 1.00 0.00 H new ATOM 0 HB1 ALA A 3 42.804 45.306 -33.619 1.00 0.00 H new ATOM 0 HB2 ALA A 3 41.731 44.014 -34.209 1.00 0.00 H new ATOM 0 HB3 ALA A 3 43.408 44.116 -34.797 1.00 0.00 H new ATOM 36 N GLN A 4 44.181 46.163 -36.756 1.00 0.00 N ATOM 37 CA GLN A 4 45.263 47.005 -37.277 1.00 0.00 C ATOM 38 C GLN A 4 44.764 48.053 -38.287 1.00 0.00 C ATOM 39 O GLN A 4 45.367 49.113 -38.412 1.00 0.00 O ATOM 40 CB GLN A 4 46.356 46.137 -37.933 1.00 0.00 C ATOM 41 CG GLN A 4 46.936 44.988 -37.083 1.00 0.00 C ATOM 42 CD GLN A 4 47.708 45.443 -35.843 1.00 0.00 C ATOM 43 OE1 GLN A 4 47.221 46.189 -35.012 1.00 0.00 O ATOM 44 NE2 GLN A 4 48.929 44.995 -35.650 1.00 0.00 N ATOM 0 H GLN A 4 44.270 45.183 -37.025 1.00 0.00 H new ATOM 0 HA GLN A 4 45.678 47.541 -36.423 1.00 0.00 H new ATOM 0 HB2 GLN A 4 45.946 45.709 -38.848 1.00 0.00 H new ATOM 0 HB3 GLN A 4 47.178 46.790 -38.227 1.00 0.00 H new ATOM 0 HG2 GLN A 4 46.120 44.338 -36.769 1.00 0.00 H new ATOM 0 HG3 GLN A 4 47.598 44.389 -37.708 1.00 0.00 H new ATOM 0 HE21 GLN A 4 49.357 44.369 -36.333 1.00 0.00 H new ATOM 0 HE22 GLN A 4 49.449 45.273 -34.818 1.00 0.00 H new ATOM 53 N GLN A 5 43.661 47.796 -39.003 1.00 0.00 N ATOM 54 CA GLN A 5 43.085 48.771 -39.939 1.00 0.00 C ATOM 55 C GLN A 5 42.241 49.822 -39.205 1.00 0.00 C ATOM 56 O GLN A 5 42.348 51.011 -39.505 1.00 0.00 O ATOM 57 CB GLN A 5 42.292 48.029 -41.028 1.00 0.00 C ATOM 58 CG GLN A 5 41.985 48.894 -42.265 1.00 0.00 C ATOM 59 CD GLN A 5 40.584 49.504 -42.254 1.00 0.00 C ATOM 60 OE1 GLN A 5 39.629 48.939 -42.771 1.00 0.00 O ATOM 61 NE2 GLN A 5 40.393 50.674 -41.683 1.00 0.00 N ATOM 0 H GLN A 5 43.148 46.916 -38.951 1.00 0.00 H new ATOM 0 HA GLN A 5 43.890 49.322 -40.426 1.00 0.00 H new ATOM 0 HB2 GLN A 5 42.855 47.150 -41.341 1.00 0.00 H new ATOM 0 HB3 GLN A 5 41.354 47.672 -40.603 1.00 0.00 H new ATOM 0 HG2 GLN A 5 42.721 49.696 -42.329 1.00 0.00 H new ATOM 0 HG3 GLN A 5 42.100 48.285 -43.161 1.00 0.00 H new ATOM 0 HE21 GLN A 5 41.175 51.162 -41.246 1.00 0.00 H new ATOM 0 HE22 GLN A 5 39.463 51.093 -41.677 1.00 0.00 H new ATOM 70 N TRP A 6 41.457 49.419 -38.199 1.00 0.00 N ATOM 71 CA TRP A 6 40.695 50.340 -37.344 1.00 0.00 C ATOM 72 C TRP A 6 41.634 51.276 -36.560 1.00 0.00 C ATOM 73 O TRP A 6 41.435 52.493 -36.564 1.00 0.00 O ATOM 74 CB TRP A 6 39.772 49.519 -36.428 1.00 0.00 C ATOM 75 CG TRP A 6 38.439 50.121 -36.089 1.00 0.00 C ATOM 76 CD1 TRP A 6 37.370 50.176 -36.919 1.00 0.00 C ATOM 77 CD2 TRP A 6 37.959 50.606 -34.797 1.00 0.00 C ATOM 78 NE1 TRP A 6 36.262 50.635 -36.228 1.00 0.00 N ATOM 79 CE2 TRP A 6 36.568 50.906 -34.914 1.00 0.00 C ATOM 80 CE3 TRP A 6 38.542 50.768 -33.524 1.00 0.00 C ATOM 81 CZ2 TRP A 6 35.790 51.316 -33.823 1.00 0.00 C ATOM 82 CZ3 TRP A 6 37.771 51.183 -32.422 1.00 0.00 C ATOM 83 CH2 TRP A 6 36.394 51.426 -32.561 1.00 0.00 C ATOM 0 H TRP A 6 41.332 48.437 -37.952 1.00 0.00 H new ATOM 0 HA TRP A 6 40.074 50.991 -37.959 1.00 0.00 H new ATOM 0 HB2 TRP A 6 39.597 48.553 -36.901 1.00 0.00 H new ATOM 0 HB3 TRP A 6 40.304 49.326 -35.496 1.00 0.00 H new ATOM 0 HD1 TRP A 6 37.381 49.903 -37.964 1.00 0.00 H new ATOM 0 HE1 TRP A 6 35.337 50.757 -36.640 1.00 0.00 H new ATOM 0 HE3 TRP A 6 39.596 50.571 -33.392 1.00 0.00 H new ATOM 0 HZ2 TRP A 6 34.742 51.544 -33.951 1.00 0.00 H new ATOM 0 HZ3 TRP A 6 38.243 51.316 -31.460 1.00 0.00 H new ATOM 0 HH2 TRP A 6 35.802 51.697 -31.699 1.00 0.00 H new ATOM 94 N ILE A 7 42.734 50.737 -36.009 1.00 0.00 N ATOM 95 CA ILE A 7 43.815 51.498 -35.348 1.00 0.00 C ATOM 96 C ILE A 7 44.642 52.389 -36.306 1.00 0.00 C ATOM 97 O ILE A 7 45.478 53.165 -35.847 1.00 0.00 O ATOM 98 CB ILE A 7 44.700 50.548 -34.487 1.00 0.00 C ATOM 99 CG1 ILE A 7 44.925 51.125 -33.075 1.00 0.00 C ATOM 100 CG2 ILE A 7 46.059 50.183 -35.108 1.00 0.00 C ATOM 101 CD1 ILE A 7 43.760 50.787 -32.140 1.00 0.00 C ATOM 0 H ILE A 7 42.904 49.731 -36.009 1.00 0.00 H new ATOM 0 HA ILE A 7 43.333 52.212 -34.680 1.00 0.00 H new ATOM 0 HB ILE A 7 44.128 49.622 -34.437 1.00 0.00 H new ATOM 0 HG12 ILE A 7 45.852 50.728 -32.662 1.00 0.00 H new ATOM 0 HG13 ILE A 7 45.041 52.207 -33.137 1.00 0.00 H new ATOM 0 HG21 ILE A 7 46.600 49.519 -34.434 1.00 0.00 H new ATOM 0 HG22 ILE A 7 45.900 49.681 -36.062 1.00 0.00 H new ATOM 0 HG23 ILE A 7 46.641 51.090 -35.268 1.00 0.00 H new ATOM 0 HD11 ILE A 7 43.951 51.209 -31.153 1.00 0.00 H new ATOM 0 HD12 ILE A 7 42.838 51.207 -32.542 1.00 0.00 H new ATOM 0 HD13 ILE A 7 43.661 49.705 -32.059 1.00 0.00 H new ATOM 113 N GLN A 8 44.398 52.322 -37.622 1.00 0.00 N ATOM 114 CA GLN A 8 45.054 53.131 -38.666 1.00 0.00 C ATOM 115 C GLN A 8 44.087 54.095 -39.389 1.00 0.00 C ATOM 116 O GLN A 8 44.534 54.912 -40.197 1.00 0.00 O ATOM 117 CB GLN A 8 45.775 52.200 -39.659 1.00 0.00 C ATOM 118 CG GLN A 8 47.084 51.632 -39.077 1.00 0.00 C ATOM 119 CD GLN A 8 47.711 50.537 -39.946 1.00 0.00 C ATOM 120 OE1 GLN A 8 47.404 50.361 -41.121 1.00 0.00 O ATOM 121 NE2 GLN A 8 48.633 49.757 -39.419 1.00 0.00 N ATOM 0 H GLN A 8 43.709 51.676 -38.007 1.00 0.00 H new ATOM 0 HA GLN A 8 45.785 53.773 -38.175 1.00 0.00 H new ATOM 0 HB2 GLN A 8 45.113 51.378 -39.930 1.00 0.00 H new ATOM 0 HB3 GLN A 8 45.994 52.748 -40.575 1.00 0.00 H new ATOM 0 HG2 GLN A 8 47.801 52.444 -38.955 1.00 0.00 H new ATOM 0 HG3 GLN A 8 46.887 51.229 -38.084 1.00 0.00 H new ATOM 0 HE21 GLN A 8 48.909 49.880 -38.445 1.00 0.00 H new ATOM 0 HE22 GLN A 8 49.071 49.030 -39.985 1.00 0.00 H new ATOM 130 N SER A 9 42.791 54.077 -39.045 1.00 0.00 N ATOM 131 CA SER A 9 41.781 55.026 -39.551 1.00 0.00 C ATOM 132 C SER A 9 41.180 55.873 -38.429 1.00 0.00 C ATOM 133 O SER A 9 41.147 57.098 -38.544 1.00 0.00 O ATOM 134 CB SER A 9 40.660 54.294 -40.300 1.00 0.00 C ATOM 135 OG SER A 9 41.158 53.731 -41.502 1.00 0.00 O ATOM 0 H SER A 9 42.406 53.391 -38.396 1.00 0.00 H new ATOM 0 HA SER A 9 42.297 55.692 -40.243 1.00 0.00 H new ATOM 0 HB2 SER A 9 40.243 53.510 -39.668 1.00 0.00 H new ATOM 0 HB3 SER A 9 39.849 54.988 -40.524 1.00 0.00 H new ATOM 0 HG SER A 9 40.434 53.265 -41.970 1.00 0.00 H new ATOM 141 N LYS A 10 40.803 55.261 -37.299 1.00 0.00 N ATOM 142 CA LYS A 10 40.193 55.950 -36.147 1.00 0.00 C ATOM 143 C LYS A 10 41.196 56.274 -35.039 1.00 0.00 C ATOM 144 O LYS A 10 40.777 56.630 -33.947 1.00 0.00 O ATOM 145 CB LYS A 10 38.994 55.136 -35.625 1.00 0.00 C ATOM 146 CG LYS A 10 37.864 55.086 -36.662 1.00 0.00 C ATOM 147 CD LYS A 10 36.679 54.287 -36.110 1.00 0.00 C ATOM 148 CE LYS A 10 35.554 54.075 -37.133 1.00 0.00 C ATOM 149 NZ LYS A 10 35.997 53.288 -38.316 1.00 0.00 N ATOM 0 H LYS A 10 40.914 54.257 -37.154 1.00 0.00 H new ATOM 0 HA LYS A 10 39.833 56.918 -36.495 1.00 0.00 H new ATOM 0 HB2 LYS A 10 39.316 54.123 -35.385 1.00 0.00 H new ATOM 0 HB3 LYS A 10 38.624 55.580 -34.701 1.00 0.00 H new ATOM 0 HG2 LYS A 10 37.545 56.098 -36.913 1.00 0.00 H new ATOM 0 HG3 LYS A 10 38.225 54.627 -37.583 1.00 0.00 H new ATOM 0 HD2 LYS A 10 37.035 53.316 -35.766 1.00 0.00 H new ATOM 0 HD3 LYS A 10 36.275 54.805 -35.240 1.00 0.00 H new ATOM 0 HE2 LYS A 10 34.722 53.562 -36.651 1.00 0.00 H new ATOM 0 HE3 LYS A 10 35.182 55.044 -37.465 1.00 0.00 H new ATOM 0 HZ1 LYS A 10 35.176 53.072 -38.917 1.00 0.00 H new ATOM 0 HZ2 LYS A 10 36.689 53.841 -38.861 1.00 0.00 H new ATOM 0 HZ3 LYS A 10 36.436 52.400 -37.998 1.00 0.00 H new ATOM 163 N ARG A 11 42.507 56.198 -35.299 1.00 0.00 N ATOM 164 CA ARG A 11 43.588 56.518 -34.340 1.00 0.00 C ATOM 165 C ARG A 11 43.347 57.774 -33.490 1.00 0.00 C ATOM 166 O ARG A 11 43.419 57.706 -32.268 1.00 0.00 O ATOM 167 CB ARG A 11 44.964 56.522 -35.041 1.00 0.00 C ATOM 168 CG ARG A 11 45.288 57.621 -36.073 1.00 0.00 C ATOM 169 CD ARG A 11 44.404 57.626 -37.332 1.00 0.00 C ATOM 170 NE ARG A 11 44.986 58.482 -38.384 1.00 0.00 N ATOM 171 CZ ARG A 11 44.397 58.934 -39.479 1.00 0.00 C ATOM 172 NH1 ARG A 11 43.141 58.722 -39.756 1.00 0.00 N ATOM 173 NH2 ARG A 11 45.081 59.628 -40.343 1.00 0.00 N ATOM 0 H ARG A 11 42.863 55.904 -36.209 1.00 0.00 H new ATOM 0 HA ARG A 11 43.583 55.711 -33.608 1.00 0.00 H new ATOM 0 HB2 ARG A 11 45.726 56.569 -34.263 1.00 0.00 H new ATOM 0 HB3 ARG A 11 45.078 55.560 -35.541 1.00 0.00 H new ATOM 0 HG2 ARG A 11 45.200 58.591 -35.584 1.00 0.00 H new ATOM 0 HG3 ARG A 11 46.328 57.512 -36.380 1.00 0.00 H new ATOM 0 HD2 ARG A 11 44.293 56.608 -37.707 1.00 0.00 H new ATOM 0 HD3 ARG A 11 43.406 57.983 -37.078 1.00 0.00 H new ATOM 0 HE ARG A 11 45.959 58.758 -38.251 1.00 0.00 H new ATOM 0 HH11 ARG A 11 42.561 58.183 -39.113 1.00 0.00 H new ATOM 0 HH12 ARG A 11 42.738 59.095 -40.616 1.00 0.00 H new ATOM 0 HH21 ARG A 11 46.068 59.822 -40.175 1.00 0.00 H new ATOM 0 HH22 ARG A 11 44.630 59.978 -41.188 1.00 0.00 H new ATOM 187 N GLU A 12 42.980 58.895 -34.112 1.00 0.00 N ATOM 188 CA GLU A 12 42.647 60.138 -33.396 1.00 0.00 C ATOM 189 C GLU A 12 41.304 60.075 -32.647 1.00 0.00 C ATOM 190 O GLU A 12 41.169 60.653 -31.571 1.00 0.00 O ATOM 191 CB GLU A 12 42.676 61.340 -34.359 1.00 0.00 C ATOM 192 CG GLU A 12 41.760 61.217 -35.588 1.00 0.00 C ATOM 193 CD GLU A 12 41.679 62.553 -36.349 1.00 0.00 C ATOM 194 OE1 GLU A 12 42.570 62.839 -37.184 1.00 0.00 O ATOM 195 OE2 GLU A 12 40.718 63.331 -36.120 1.00 0.00 O ATOM 0 H GLU A 12 42.904 58.972 -35.126 1.00 0.00 H new ATOM 0 HA GLU A 12 43.414 60.266 -32.632 1.00 0.00 H new ATOM 0 HB2 GLU A 12 42.395 62.236 -33.805 1.00 0.00 H new ATOM 0 HB3 GLU A 12 43.700 61.485 -34.702 1.00 0.00 H new ATOM 0 HG2 GLU A 12 42.137 60.438 -36.251 1.00 0.00 H new ATOM 0 HG3 GLU A 12 40.762 60.912 -35.274 1.00 0.00 H new ATOM 202 N ASP A 13 40.315 59.356 -33.176 1.00 0.00 N ATOM 203 CA ASP A 13 38.979 59.204 -32.588 1.00 0.00 C ATOM 204 C ASP A 13 39.014 58.310 -31.335 1.00 0.00 C ATOM 205 O ASP A 13 38.444 58.649 -30.298 1.00 0.00 O ATOM 206 CB ASP A 13 38.025 58.632 -33.657 1.00 0.00 C ATOM 207 CG ASP A 13 36.819 59.554 -33.905 1.00 0.00 C ATOM 208 OD1 ASP A 13 36.069 59.852 -32.946 1.00 0.00 O ATOM 209 OD2 ASP A 13 36.620 59.989 -35.065 1.00 0.00 O ATOM 0 H ASP A 13 40.422 58.846 -34.053 1.00 0.00 H new ATOM 0 HA ASP A 13 38.617 60.180 -32.266 1.00 0.00 H new ATOM 0 HB2 ASP A 13 38.570 58.489 -34.590 1.00 0.00 H new ATOM 0 HB3 ASP A 13 37.672 57.651 -33.340 1.00 0.00 H new ATOM 214 N ILE A 14 39.770 57.211 -31.401 1.00 0.00 N ATOM 215 CA ILE A 14 40.111 56.327 -30.281 1.00 0.00 C ATOM 216 C ILE A 14 40.831 57.118 -29.186 1.00 0.00 C ATOM 217 O ILE A 14 40.473 56.991 -28.021 1.00 0.00 O ATOM 218 CB ILE A 14 40.958 55.136 -30.792 1.00 0.00 C ATOM 219 CG1 ILE A 14 40.116 54.248 -31.740 1.00 0.00 C ATOM 220 CG2 ILE A 14 41.517 54.284 -29.636 1.00 0.00 C ATOM 221 CD1 ILE A 14 40.964 53.276 -32.563 1.00 0.00 C ATOM 0 H ILE A 14 40.182 56.897 -32.280 1.00 0.00 H new ATOM 0 HA ILE A 14 39.200 55.921 -29.842 1.00 0.00 H new ATOM 0 HB ILE A 14 41.806 55.552 -31.337 1.00 0.00 H new ATOM 0 HG12 ILE A 14 39.394 53.682 -31.152 1.00 0.00 H new ATOM 0 HG13 ILE A 14 39.547 54.886 -32.416 1.00 0.00 H new ATOM 0 HG21 ILE A 14 42.104 53.460 -30.042 1.00 0.00 H new ATOM 0 HG22 ILE A 14 42.151 54.903 -29.001 1.00 0.00 H new ATOM 0 HG23 ILE A 14 40.692 53.885 -29.046 1.00 0.00 H new ATOM 0 HD11 ILE A 14 40.315 52.682 -33.207 1.00 0.00 H new ATOM 0 HD12 ILE A 14 41.669 53.837 -33.176 1.00 0.00 H new ATOM 0 HD13 ILE A 14 41.513 52.615 -31.893 1.00 0.00 H new ATOM 233 N VAL A 15 41.788 57.984 -29.537 1.00 0.00 N ATOM 234 CA VAL A 15 42.490 58.858 -28.575 1.00 0.00 C ATOM 235 C VAL A 15 41.581 59.948 -27.979 1.00 0.00 C ATOM 236 O VAL A 15 41.738 60.303 -26.811 1.00 0.00 O ATOM 237 CB VAL A 15 43.756 59.445 -29.235 1.00 0.00 C ATOM 238 CG1 VAL A 15 44.433 60.551 -28.420 1.00 0.00 C ATOM 239 CG2 VAL A 15 44.796 58.331 -29.396 1.00 0.00 C ATOM 0 H VAL A 15 42.103 58.103 -30.500 1.00 0.00 H new ATOM 0 HA VAL A 15 42.792 58.247 -27.724 1.00 0.00 H new ATOM 0 HB VAL A 15 43.423 59.871 -30.181 1.00 0.00 H new ATOM 0 HG11 VAL A 15 45.314 60.909 -28.953 1.00 0.00 H new ATOM 0 HG12 VAL A 15 43.735 61.376 -28.277 1.00 0.00 H new ATOM 0 HG13 VAL A 15 44.732 60.156 -27.449 1.00 0.00 H new ATOM 0 HG21 VAL A 15 45.694 58.736 -29.862 1.00 0.00 H new ATOM 0 HG22 VAL A 15 45.047 57.923 -28.417 1.00 0.00 H new ATOM 0 HG23 VAL A 15 44.387 57.540 -30.024 1.00 0.00 H new ATOM 249 N ASN A 16 40.596 60.455 -28.729 1.00 0.00 N ATOM 250 CA ASN A 16 39.573 61.372 -28.204 1.00 0.00 C ATOM 251 C ASN A 16 38.557 60.677 -27.269 1.00 0.00 C ATOM 252 O ASN A 16 38.018 61.324 -26.368 1.00 0.00 O ATOM 253 CB ASN A 16 38.863 62.083 -29.374 1.00 0.00 C ATOM 254 CG ASN A 16 39.588 63.351 -29.798 1.00 0.00 C ATOM 255 OD1 ASN A 16 39.290 64.446 -29.342 1.00 0.00 O ATOM 256 ND2 ASN A 16 40.564 63.255 -30.670 1.00 0.00 N ATOM 0 H ASN A 16 40.484 60.241 -29.720 1.00 0.00 H new ATOM 0 HA ASN A 16 40.083 62.112 -27.587 1.00 0.00 H new ATOM 0 HB2 ASN A 16 38.796 61.403 -30.223 1.00 0.00 H new ATOM 0 HB3 ASN A 16 37.842 62.330 -29.082 1.00 0.00 H new ATOM 0 HD21 ASN A 16 41.069 64.091 -30.964 1.00 0.00 H new ATOM 0 HD22 ASN A 16 40.817 62.345 -31.054 1.00 0.00 H new ATOM 263 N GLN A 17 38.298 59.377 -27.456 1.00 0.00 N ATOM 264 CA GLN A 17 37.338 58.598 -26.661 1.00 0.00 C ATOM 265 C GLN A 17 37.977 57.907 -25.443 1.00 0.00 C ATOM 266 O GLN A 17 37.471 58.035 -24.327 1.00 0.00 O ATOM 267 CB GLN A 17 36.664 57.562 -27.582 1.00 0.00 C ATOM 268 CG GLN A 17 35.585 58.204 -28.470 1.00 0.00 C ATOM 269 CD GLN A 17 34.360 58.662 -27.678 1.00 0.00 C ATOM 270 OE1 GLN A 17 33.832 57.958 -26.825 1.00 0.00 O ATOM 271 NE2 GLN A 17 33.851 59.849 -27.930 1.00 0.00 N ATOM 0 H GLN A 17 38.759 58.825 -28.179 1.00 0.00 H new ATOM 0 HA GLN A 17 36.600 59.290 -26.255 1.00 0.00 H new ATOM 0 HB2 GLN A 17 37.418 57.089 -28.211 1.00 0.00 H new ATOM 0 HB3 GLN A 17 36.215 56.775 -26.976 1.00 0.00 H new ATOM 0 HG2 GLN A 17 36.013 59.059 -28.994 1.00 0.00 H new ATOM 0 HG3 GLN A 17 35.273 57.488 -29.230 1.00 0.00 H new ATOM 0 HE21 GLN A 17 34.278 60.448 -28.637 1.00 0.00 H new ATOM 0 HE22 GLN A 17 33.029 60.171 -27.418 1.00 0.00 H new ATOM 280 N MET A 18 39.076 57.175 -25.624 1.00 0.00 N ATOM 281 CA MET A 18 39.801 56.495 -24.546 1.00 0.00 C ATOM 282 C MET A 18 40.683 57.488 -23.783 1.00 0.00 C ATOM 283 O MET A 18 41.622 58.064 -24.338 1.00 0.00 O ATOM 284 CB MET A 18 40.667 55.355 -25.103 1.00 0.00 C ATOM 285 CG MET A 18 39.820 54.250 -25.737 1.00 0.00 C ATOM 286 SD MET A 18 40.778 52.795 -26.226 1.00 0.00 S ATOM 287 CE MET A 18 40.907 51.902 -24.652 1.00 0.00 C ATOM 0 H MET A 18 39.497 57.034 -26.542 1.00 0.00 H new ATOM 0 HA MET A 18 39.065 56.073 -23.862 1.00 0.00 H new ATOM 0 HB2 MET A 18 41.358 55.754 -25.846 1.00 0.00 H new ATOM 0 HB3 MET A 18 41.271 54.933 -24.300 1.00 0.00 H new ATOM 0 HG2 MET A 18 39.047 53.946 -25.031 1.00 0.00 H new ATOM 0 HG3 MET A 18 39.311 54.651 -26.613 1.00 0.00 H new ATOM 0 HE1 MET A 18 41.473 50.983 -24.801 1.00 0.00 H new ATOM 0 HE2 MET A 18 41.417 52.528 -23.919 1.00 0.00 H new ATOM 0 HE3 MET A 18 39.909 51.659 -24.289 1.00 0.00 H new ATOM 297 N THR A 19 40.389 57.679 -22.498 1.00 0.00 N ATOM 298 CA THR A 19 41.225 58.461 -21.572 1.00 0.00 C ATOM 299 C THR A 19 42.491 57.694 -21.168 1.00 0.00 C ATOM 300 O THR A 19 42.684 56.533 -21.550 1.00 0.00 O ATOM 301 CB THR A 19 40.423 58.831 -20.313 1.00 0.00 C ATOM 302 OG1 THR A 19 40.071 57.659 -19.609 1.00 0.00 O ATOM 303 CG2 THR A 19 39.141 59.597 -20.643 1.00 0.00 C ATOM 0 H THR A 19 39.553 57.292 -22.059 1.00 0.00 H new ATOM 0 HA THR A 19 41.529 59.369 -22.093 1.00 0.00 H new ATOM 0 HB THR A 19 41.062 59.474 -19.708 1.00 0.00 H new ATOM 0 HG1 THR A 19 39.522 57.085 -20.183 1.00 0.00 H new ATOM 0 HG21 THR A 19 38.611 59.835 -19.720 1.00 0.00 H new ATOM 0 HG22 THR A 19 39.393 60.520 -21.165 1.00 0.00 H new ATOM 0 HG23 THR A 19 38.504 58.983 -21.279 1.00 0.00 H new ATOM 311 N GLU A 20 43.340 58.308 -20.332 1.00 0.00 N ATOM 312 CA GLU A 20 44.422 57.596 -19.636 1.00 0.00 C ATOM 313 C GLU A 20 43.883 56.347 -18.927 1.00 0.00 C ATOM 314 O GLU A 20 44.432 55.270 -19.118 1.00 0.00 O ATOM 315 CB GLU A 20 45.115 58.533 -18.630 1.00 0.00 C ATOM 316 CG GLU A 20 46.552 58.130 -18.251 1.00 0.00 C ATOM 317 CD GLU A 20 46.708 56.797 -17.490 1.00 0.00 C ATOM 318 OE1 GLU A 20 46.041 56.572 -16.455 1.00 0.00 O ATOM 319 OE2 GLU A 20 47.569 55.984 -17.904 1.00 0.00 O ATOM 0 H GLU A 20 43.297 59.305 -20.120 1.00 0.00 H new ATOM 0 HA GLU A 20 45.156 57.275 -20.376 1.00 0.00 H new ATOM 0 HB2 GLU A 20 45.134 59.540 -19.047 1.00 0.00 H new ATOM 0 HB3 GLU A 20 44.514 58.575 -17.722 1.00 0.00 H new ATOM 0 HG2 GLU A 20 47.144 58.074 -19.164 1.00 0.00 H new ATOM 0 HG3 GLU A 20 46.981 58.925 -17.641 1.00 0.00 H new ATOM 326 N ALA A 21 42.773 56.456 -18.187 1.00 0.00 N ATOM 327 CA ALA A 21 42.188 55.340 -17.444 1.00 0.00 C ATOM 328 C ALA A 21 41.720 54.180 -18.347 1.00 0.00 C ATOM 329 O ALA A 21 41.893 53.017 -17.978 1.00 0.00 O ATOM 330 CB ALA A 21 41.046 55.870 -16.571 1.00 0.00 C ATOM 0 H ALA A 21 42.254 57.329 -18.088 1.00 0.00 H new ATOM 0 HA ALA A 21 42.968 54.911 -16.815 1.00 0.00 H new ATOM 0 HB1 ALA A 21 40.602 55.046 -16.012 1.00 0.00 H new ATOM 0 HB2 ALA A 21 41.435 56.613 -15.874 1.00 0.00 H new ATOM 0 HB3 ALA A 21 40.287 56.329 -17.204 1.00 0.00 H new ATOM 336 N CYS A 22 41.185 54.463 -19.541 1.00 0.00 N ATOM 337 CA CYS A 22 40.816 53.426 -20.512 1.00 0.00 C ATOM 338 C CYS A 22 42.048 52.670 -21.052 1.00 0.00 C ATOM 339 O CYS A 22 42.025 51.442 -21.146 1.00 0.00 O ATOM 340 CB CYS A 22 40.016 54.051 -21.663 1.00 0.00 C ATOM 341 SG CYS A 22 38.476 54.801 -21.057 1.00 0.00 S ATOM 0 H CYS A 22 40.996 55.413 -19.860 1.00 0.00 H new ATOM 0 HA CYS A 22 40.195 52.693 -19.997 1.00 0.00 H new ATOM 0 HB2 CYS A 22 40.621 54.808 -22.162 1.00 0.00 H new ATOM 0 HB3 CYS A 22 39.785 53.288 -22.406 1.00 0.00 H new ATOM 0 HG CYS A 22 37.547 54.673 -21.958 1.00 0.00 H new ATOM 347 N LEU A 23 43.142 53.381 -21.358 1.00 0.00 N ATOM 348 CA LEU A 23 44.437 52.777 -21.707 1.00 0.00 C ATOM 349 C LEU A 23 45.025 51.984 -20.522 1.00 0.00 C ATOM 350 O LEU A 23 45.511 50.871 -20.699 1.00 0.00 O ATOM 351 CB LEU A 23 45.393 53.903 -22.151 1.00 0.00 C ATOM 352 CG LEU A 23 46.779 53.419 -22.622 1.00 0.00 C ATOM 353 CD1 LEU A 23 46.738 52.886 -24.051 1.00 0.00 C ATOM 354 CD2 LEU A 23 47.792 54.561 -22.565 1.00 0.00 C ATOM 0 H LEU A 23 43.154 54.401 -21.371 1.00 0.00 H new ATOM 0 HA LEU A 23 44.300 52.066 -22.522 1.00 0.00 H new ATOM 0 HB2 LEU A 23 44.924 54.462 -22.960 1.00 0.00 H new ATOM 0 HB3 LEU A 23 45.528 54.596 -21.321 1.00 0.00 H new ATOM 0 HG LEU A 23 47.076 52.614 -21.950 1.00 0.00 H new ATOM 0 HD11 LEU A 23 47.734 52.555 -24.345 1.00 0.00 H new ATOM 0 HD12 LEU A 23 46.046 52.046 -24.106 1.00 0.00 H new ATOM 0 HD13 LEU A 23 46.405 53.676 -24.724 1.00 0.00 H new ATOM 0 HD21 LEU A 23 48.765 54.202 -22.901 1.00 0.00 H new ATOM 0 HD22 LEU A 23 47.462 55.373 -23.213 1.00 0.00 H new ATOM 0 HD23 LEU A 23 47.873 54.924 -21.541 1.00 0.00 H new ATOM 366 N ASN A 24 44.958 52.543 -19.312 1.00 0.00 N ATOM 367 CA ASN A 24 45.470 51.964 -18.067 1.00 0.00 C ATOM 368 C ASN A 24 44.760 50.644 -17.718 1.00 0.00 C ATOM 369 O ASN A 24 45.415 49.675 -17.346 1.00 0.00 O ATOM 370 CB ASN A 24 45.321 53.023 -16.958 1.00 0.00 C ATOM 371 CG ASN A 24 46.288 52.867 -15.799 1.00 0.00 C ATOM 372 OD1 ASN A 24 46.512 51.791 -15.264 1.00 0.00 O ATOM 373 ND2 ASN A 24 46.892 53.954 -15.373 1.00 0.00 N ATOM 0 H ASN A 24 44.525 53.455 -19.166 1.00 0.00 H new ATOM 0 HA ASN A 24 46.522 51.703 -18.180 1.00 0.00 H new ATOM 0 HB2 ASN A 24 45.458 54.011 -17.397 1.00 0.00 H new ATOM 0 HB3 ASN A 24 44.303 52.984 -16.572 1.00 0.00 H new ATOM 0 HD21 ASN A 24 47.549 53.901 -14.595 1.00 0.00 H new ATOM 0 HD22 ASN A 24 46.704 54.851 -15.821 1.00 0.00 H new ATOM 380 N GLN A 25 43.441 50.564 -17.925 1.00 0.00 N ATOM 381 CA GLN A 25 42.662 49.323 -17.838 1.00 0.00 C ATOM 382 C GLN A 25 43.193 48.226 -18.776 1.00 0.00 C ATOM 383 O GLN A 25 43.363 47.084 -18.342 1.00 0.00 O ATOM 384 CB GLN A 25 41.185 49.629 -18.150 1.00 0.00 C ATOM 385 CG GLN A 25 40.334 49.920 -16.903 1.00 0.00 C ATOM 386 CD GLN A 25 39.441 48.735 -16.530 1.00 0.00 C ATOM 387 OE1 GLN A 25 38.224 48.776 -16.653 1.00 0.00 O ATOM 388 NE2 GLN A 25 39.993 47.618 -16.101 1.00 0.00 N ATOM 0 H GLN A 25 42.873 51.377 -18.163 1.00 0.00 H new ATOM 0 HA GLN A 25 42.759 48.938 -16.823 1.00 0.00 H new ATOM 0 HB2 GLN A 25 41.135 50.487 -18.820 1.00 0.00 H new ATOM 0 HB3 GLN A 25 40.753 48.782 -18.683 1.00 0.00 H new ATOM 0 HG2 GLN A 25 40.989 50.159 -16.065 1.00 0.00 H new ATOM 0 HG3 GLN A 25 39.714 50.798 -17.084 1.00 0.00 H new ATOM 0 HE21 GLN A 25 41.005 47.559 -15.990 1.00 0.00 H new ATOM 0 HE22 GLN A 25 39.408 46.812 -15.880 1.00 0.00 H new ATOM 397 N SER A 26 43.495 48.558 -20.036 1.00 0.00 N ATOM 398 CA SER A 26 44.128 47.617 -20.971 1.00 0.00 C ATOM 399 C SER A 26 45.546 47.242 -20.535 1.00 0.00 C ATOM 400 O SER A 26 45.857 46.059 -20.476 1.00 0.00 O ATOM 401 CB SER A 26 44.149 48.177 -22.395 1.00 0.00 C ATOM 402 OG SER A 26 42.821 48.278 -22.872 1.00 0.00 O ATOM 0 H SER A 26 43.310 49.478 -20.435 1.00 0.00 H new ATOM 0 HA SER A 26 43.521 46.711 -20.960 1.00 0.00 H new ATOM 0 HB2 SER A 26 44.628 49.156 -22.407 1.00 0.00 H new ATOM 0 HB3 SER A 26 44.734 47.527 -23.046 1.00 0.00 H new ATOM 0 HG SER A 26 42.790 48.008 -23.814 1.00 0.00 H new ATOM 408 N LEU A 27 46.395 48.211 -20.173 1.00 0.00 N ATOM 409 CA LEU A 27 47.767 47.973 -19.699 1.00 0.00 C ATOM 410 C LEU A 27 47.821 47.085 -18.442 1.00 0.00 C ATOM 411 O LEU A 27 48.658 46.188 -18.366 1.00 0.00 O ATOM 412 CB LEU A 27 48.461 49.324 -19.443 1.00 0.00 C ATOM 413 CG LEU A 27 48.887 50.086 -20.713 1.00 0.00 C ATOM 414 CD1 LEU A 27 49.308 51.507 -20.334 1.00 0.00 C ATOM 415 CD2 LEU A 27 50.073 49.416 -21.414 1.00 0.00 C ATOM 0 H LEU A 27 46.146 49.200 -20.201 1.00 0.00 H new ATOM 0 HA LEU A 27 48.296 47.426 -20.480 1.00 0.00 H new ATOM 0 HB2 LEU A 27 47.788 49.958 -18.865 1.00 0.00 H new ATOM 0 HB3 LEU A 27 49.344 49.151 -18.827 1.00 0.00 H new ATOM 0 HG LEU A 27 48.034 50.089 -21.391 1.00 0.00 H new ATOM 0 HD11 LEU A 27 49.610 52.048 -21.231 1.00 0.00 H new ATOM 0 HD12 LEU A 27 48.470 52.022 -19.864 1.00 0.00 H new ATOM 0 HD13 LEU A 27 50.145 51.465 -19.637 1.00 0.00 H new ATOM 0 HD21 LEU A 27 50.339 49.987 -22.304 1.00 0.00 H new ATOM 0 HD22 LEU A 27 50.925 49.383 -20.735 1.00 0.00 H new ATOM 0 HD23 LEU A 27 49.799 48.401 -21.702 1.00 0.00 H new ATOM 427 N ASP A 28 46.919 47.288 -17.480 1.00 0.00 N ATOM 428 CA ASP A 28 46.787 46.455 -16.279 1.00 0.00 C ATOM 429 C ASP A 28 46.415 45.003 -16.622 1.00 0.00 C ATOM 430 O ASP A 28 47.065 44.069 -16.146 1.00 0.00 O ATOM 431 CB ASP A 28 45.737 47.076 -15.347 1.00 0.00 C ATOM 432 CG ASP A 28 45.565 46.258 -14.059 1.00 0.00 C ATOM 433 OD1 ASP A 28 46.439 46.346 -13.162 1.00 0.00 O ATOM 434 OD2 ASP A 28 44.547 45.535 -13.928 1.00 0.00 O ATOM 0 H ASP A 28 46.244 48.052 -17.513 1.00 0.00 H new ATOM 0 HA ASP A 28 47.754 46.423 -15.777 1.00 0.00 H new ATOM 0 HB2 ASP A 28 46.032 48.095 -15.094 1.00 0.00 H new ATOM 0 HB3 ASP A 28 44.781 47.140 -15.867 1.00 0.00 H new ATOM 439 N ALA A 29 45.419 44.809 -17.497 1.00 0.00 N ATOM 440 CA ALA A 29 45.046 43.488 -17.997 1.00 0.00 C ATOM 441 C ALA A 29 46.207 42.819 -18.755 1.00 0.00 C ATOM 442 O ALA A 29 46.547 41.672 -18.474 1.00 0.00 O ATOM 443 CB ALA A 29 43.795 43.623 -18.876 1.00 0.00 C ATOM 0 H ALA A 29 44.851 45.567 -17.876 1.00 0.00 H new ATOM 0 HA ALA A 29 44.819 42.837 -17.153 1.00 0.00 H new ATOM 0 HB1 ALA A 29 43.508 42.642 -19.254 1.00 0.00 H new ATOM 0 HB2 ALA A 29 42.978 44.037 -18.285 1.00 0.00 H new ATOM 0 HB3 ALA A 29 44.009 44.287 -19.714 1.00 0.00 H new ATOM 449 N LEU A 30 46.858 43.547 -19.668 1.00 0.00 N ATOM 450 CA LEU A 30 47.998 43.093 -20.470 1.00 0.00 C ATOM 451 C LEU A 30 49.198 42.643 -19.621 1.00 0.00 C ATOM 452 O LEU A 30 49.841 41.650 -19.966 1.00 0.00 O ATOM 453 CB LEU A 30 48.427 44.234 -21.407 1.00 0.00 C ATOM 454 CG LEU A 30 47.522 44.466 -22.631 1.00 0.00 C ATOM 455 CD1 LEU A 30 47.847 45.821 -23.263 1.00 0.00 C ATOM 456 CD2 LEU A 30 47.736 43.360 -23.663 1.00 0.00 C ATOM 0 H LEU A 30 46.593 44.510 -19.877 1.00 0.00 H new ATOM 0 HA LEU A 30 47.673 42.219 -21.034 1.00 0.00 H new ATOM 0 HB2 LEU A 30 48.470 45.157 -20.829 1.00 0.00 H new ATOM 0 HB3 LEU A 30 49.438 44.030 -21.759 1.00 0.00 H new ATOM 0 HG LEU A 30 46.482 44.454 -22.306 1.00 0.00 H new ATOM 0 HD11 LEU A 30 47.205 45.982 -24.129 1.00 0.00 H new ATOM 0 HD12 LEU A 30 47.678 46.613 -22.533 1.00 0.00 H new ATOM 0 HD13 LEU A 30 48.891 45.835 -23.578 1.00 0.00 H new ATOM 0 HD21 LEU A 30 47.090 43.535 -24.524 1.00 0.00 H new ATOM 0 HD22 LEU A 30 48.777 43.359 -23.985 1.00 0.00 H new ATOM 0 HD23 LEU A 30 47.493 42.395 -23.218 1.00 0.00 H new ATOM 468 N LEU A 31 49.496 43.340 -18.518 1.00 0.00 N ATOM 469 CA LEU A 31 50.568 42.970 -17.586 1.00 0.00 C ATOM 470 C LEU A 31 50.245 41.623 -16.912 1.00 0.00 C ATOM 471 O LEU A 31 51.043 40.686 -16.978 1.00 0.00 O ATOM 472 CB LEU A 31 50.767 44.121 -16.572 1.00 0.00 C ATOM 473 CG LEU A 31 52.157 44.260 -15.917 1.00 0.00 C ATOM 474 CD1 LEU A 31 52.642 42.997 -15.206 1.00 0.00 C ATOM 475 CD2 LEU A 31 53.227 44.686 -16.924 1.00 0.00 C ATOM 0 H LEU A 31 48.995 44.185 -18.245 1.00 0.00 H new ATOM 0 HA LEU A 31 51.509 42.829 -18.117 1.00 0.00 H new ATOM 0 HB2 LEU A 31 50.538 45.059 -17.078 1.00 0.00 H new ATOM 0 HB3 LEU A 31 50.031 44.000 -15.777 1.00 0.00 H new ATOM 0 HG LEU A 31 52.016 45.037 -15.165 1.00 0.00 H new ATOM 0 HD11 LEU A 31 53.626 43.178 -14.773 1.00 0.00 H new ATOM 0 HD12 LEU A 31 51.940 42.733 -14.415 1.00 0.00 H new ATOM 0 HD13 LEU A 31 52.706 42.178 -15.922 1.00 0.00 H new ATOM 0 HD21 LEU A 31 54.189 44.771 -16.419 1.00 0.00 H new ATOM 0 HD22 LEU A 31 53.298 43.941 -17.716 1.00 0.00 H new ATOM 0 HD23 LEU A 31 52.957 45.650 -17.356 1.00 0.00 H new ATOM 487 N SER A 32 49.037 41.481 -16.354 1.00 0.00 N ATOM 488 CA SER A 32 48.546 40.224 -15.760 1.00 0.00 C ATOM 489 C SER A 32 48.426 39.067 -16.769 1.00 0.00 C ATOM 490 O SER A 32 48.594 37.903 -16.396 1.00 0.00 O ATOM 491 CB SER A 32 47.188 40.457 -15.086 1.00 0.00 C ATOM 492 OG SER A 32 47.330 41.363 -14.001 1.00 0.00 O ATOM 0 H SER A 32 48.362 42.243 -16.300 1.00 0.00 H new ATOM 0 HA SER A 32 49.294 39.924 -15.026 1.00 0.00 H new ATOM 0 HB2 SER A 32 46.477 40.854 -15.811 1.00 0.00 H new ATOM 0 HB3 SER A 32 46.784 39.510 -14.729 1.00 0.00 H new ATOM 0 HG SER A 32 46.458 41.507 -13.578 1.00 0.00 H new ATOM 498 N ARG A 33 48.181 39.373 -18.052 1.00 0.00 N ATOM 499 CA ARG A 33 48.125 38.423 -19.183 1.00 0.00 C ATOM 500 C ARG A 33 49.508 38.077 -19.773 1.00 0.00 C ATOM 501 O ARG A 33 49.588 37.284 -20.711 1.00 0.00 O ATOM 502 CB ARG A 33 47.210 39.021 -20.272 1.00 0.00 C ATOM 503 CG ARG A 33 46.531 37.971 -21.167 1.00 0.00 C ATOM 504 CD ARG A 33 46.275 38.544 -22.567 1.00 0.00 C ATOM 505 NE ARG A 33 45.433 37.656 -23.393 1.00 0.00 N ATOM 506 CZ ARG A 33 45.766 36.496 -23.935 1.00 0.00 C ATOM 507 NH1 ARG A 33 46.943 35.958 -23.778 1.00 0.00 N ATOM 508 NH2 ARG A 33 44.901 35.843 -24.656 1.00 0.00 N ATOM 0 H ARG A 33 48.008 40.334 -18.347 1.00 0.00 H new ATOM 0 HA ARG A 33 47.726 37.481 -18.806 1.00 0.00 H new ATOM 0 HB2 ARG A 33 46.441 39.627 -19.793 1.00 0.00 H new ATOM 0 HB3 ARG A 33 47.799 39.691 -20.899 1.00 0.00 H new ATOM 0 HG2 ARG A 33 47.161 37.084 -21.240 1.00 0.00 H new ATOM 0 HG3 ARG A 33 45.589 37.656 -20.718 1.00 0.00 H new ATOM 0 HD2 ARG A 33 45.792 39.517 -22.476 1.00 0.00 H new ATOM 0 HD3 ARG A 33 47.228 38.707 -23.070 1.00 0.00 H new ATOM 0 HE ARG A 33 44.480 37.975 -23.567 1.00 0.00 H new ATOM 0 HH11 ARG A 33 47.651 36.434 -23.218 1.00 0.00 H new ATOM 0 HH12 ARG A 33 47.156 35.061 -24.215 1.00 0.00 H new ATOM 0 HH21 ARG A 33 43.967 36.226 -24.803 1.00 0.00 H new ATOM 0 HH22 ARG A 33 45.157 34.949 -25.074 1.00 0.00 H new ATOM 522 N ASP A 34 50.588 38.668 -19.254 1.00 0.00 N ATOM 523 CA ASP A 34 51.963 38.565 -19.775 1.00 0.00 C ATOM 524 C ASP A 34 52.087 38.878 -21.289 1.00 0.00 C ATOM 525 O ASP A 34 52.817 38.214 -22.029 1.00 0.00 O ATOM 526 CB ASP A 34 52.579 37.218 -19.345 1.00 0.00 C ATOM 527 CG ASP A 34 54.100 37.139 -19.579 1.00 0.00 C ATOM 528 OD1 ASP A 34 54.820 38.122 -19.280 1.00 0.00 O ATOM 529 OD2 ASP A 34 54.592 36.067 -20.012 1.00 0.00 O ATOM 0 H ASP A 34 50.530 39.258 -18.424 1.00 0.00 H new ATOM 0 HA ASP A 34 52.560 39.357 -19.322 1.00 0.00 H new ATOM 0 HB2 ASP A 34 52.372 37.053 -18.287 1.00 0.00 H new ATOM 0 HB3 ASP A 34 52.092 36.412 -19.894 1.00 0.00 H new ATOM 534 N LEU A 35 51.356 39.902 -21.753 1.00 0.00 N ATOM 535 CA LEU A 35 51.311 40.361 -23.154 1.00 0.00 C ATOM 536 C LEU A 35 51.938 41.765 -23.340 1.00 0.00 C ATOM 537 O LEU A 35 51.986 42.287 -24.453 1.00 0.00 O ATOM 538 CB LEU A 35 49.852 40.225 -23.651 1.00 0.00 C ATOM 539 CG LEU A 35 49.582 40.522 -25.145 1.00 0.00 C ATOM 540 CD1 LEU A 35 50.467 39.715 -26.097 1.00 0.00 C ATOM 541 CD2 LEU A 35 48.129 40.200 -25.502 1.00 0.00 C ATOM 0 H LEU A 35 50.756 40.456 -21.142 1.00 0.00 H new ATOM 0 HA LEU A 35 51.940 39.732 -23.784 1.00 0.00 H new ATOM 0 HB2 LEU A 35 49.518 39.208 -23.443 1.00 0.00 H new ATOM 0 HB3 LEU A 35 49.229 40.893 -23.056 1.00 0.00 H new ATOM 0 HG LEU A 35 49.806 41.581 -25.271 1.00 0.00 H new ATOM 0 HD11 LEU A 35 50.224 39.974 -27.127 1.00 0.00 H new ATOM 0 HD12 LEU A 35 51.515 39.945 -25.903 1.00 0.00 H new ATOM 0 HD13 LEU A 35 50.294 38.650 -25.940 1.00 0.00 H new ATOM 0 HD21 LEU A 35 47.957 40.415 -26.557 1.00 0.00 H new ATOM 0 HD22 LEU A 35 47.932 39.145 -25.310 1.00 0.00 H new ATOM 0 HD23 LEU A 35 47.461 40.810 -24.894 1.00 0.00 H new ATOM 553 N ILE A 36 52.482 42.363 -22.271 1.00 0.00 N ATOM 554 CA ILE A 36 53.256 43.616 -22.307 1.00 0.00 C ATOM 555 C ILE A 36 54.448 43.511 -21.334 1.00 0.00 C ATOM 556 O ILE A 36 54.279 43.198 -20.154 1.00 0.00 O ATOM 557 CB ILE A 36 52.299 44.816 -22.064 1.00 0.00 C ATOM 558 CG1 ILE A 36 52.717 46.122 -22.766 1.00 0.00 C ATOM 559 CG2 ILE A 36 51.926 45.058 -20.593 1.00 0.00 C ATOM 560 CD1 ILE A 36 53.938 46.845 -22.211 1.00 0.00 C ATOM 0 H ILE A 36 52.394 41.979 -21.330 1.00 0.00 H new ATOM 0 HA ILE A 36 53.700 43.793 -23.286 1.00 0.00 H new ATOM 0 HB ILE A 36 51.384 44.485 -22.554 1.00 0.00 H new ATOM 0 HG12 ILE A 36 52.905 45.897 -23.816 1.00 0.00 H new ATOM 0 HG13 ILE A 36 51.872 46.810 -22.733 1.00 0.00 H new ATOM 0 HG21 ILE A 36 51.256 45.915 -20.524 1.00 0.00 H new ATOM 0 HG22 ILE A 36 51.428 44.175 -20.194 1.00 0.00 H new ATOM 0 HG23 ILE A 36 52.829 45.257 -20.016 1.00 0.00 H new ATOM 0 HD11 ILE A 36 54.123 47.747 -22.794 1.00 0.00 H new ATOM 0 HD12 ILE A 36 53.759 47.116 -21.171 1.00 0.00 H new ATOM 0 HD13 ILE A 36 54.807 46.190 -22.270 1.00 0.00 H new ATOM 572 N MET A 37 55.673 43.695 -21.839 1.00 0.00 N ATOM 573 CA MET A 37 56.900 43.710 -21.024 1.00 0.00 C ATOM 574 C MET A 37 56.989 44.976 -20.162 1.00 0.00 C ATOM 575 O MET A 37 56.645 46.065 -20.620 1.00 0.00 O ATOM 576 CB MET A 37 58.138 43.649 -21.938 1.00 0.00 C ATOM 577 CG MET A 37 58.484 42.219 -22.359 1.00 0.00 C ATOM 578 SD MET A 37 59.930 42.133 -23.452 1.00 0.00 S ATOM 579 CE MET A 37 60.385 40.390 -23.242 1.00 0.00 C ATOM 0 H MET A 37 55.846 43.839 -22.834 1.00 0.00 H new ATOM 0 HA MET A 37 56.868 42.840 -20.368 1.00 0.00 H new ATOM 0 HB2 MET A 37 57.959 44.253 -22.827 1.00 0.00 H new ATOM 0 HB3 MET A 37 58.990 44.088 -21.420 1.00 0.00 H new ATOM 0 HG2 MET A 37 58.672 41.619 -21.468 1.00 0.00 H new ATOM 0 HG3 MET A 37 57.626 41.777 -22.865 1.00 0.00 H new ATOM 0 HE1 MET A 37 61.262 40.167 -23.850 1.00 0.00 H new ATOM 0 HE2 MET A 37 60.612 40.197 -22.193 1.00 0.00 H new ATOM 0 HE3 MET A 37 59.555 39.757 -23.556 1.00 0.00 H new ATOM 589 N LYS A 38 57.551 44.871 -18.949 1.00 0.00 N ATOM 590 CA LYS A 38 57.813 46.030 -18.071 1.00 0.00 C ATOM 591 C LYS A 38 58.654 47.117 -18.758 1.00 0.00 C ATOM 592 O LYS A 38 58.423 48.305 -18.545 1.00 0.00 O ATOM 593 CB LYS A 38 58.432 45.535 -16.748 1.00 0.00 C ATOM 594 CG LYS A 38 58.491 46.609 -15.643 1.00 0.00 C ATOM 595 CD LYS A 38 59.783 47.442 -15.587 1.00 0.00 C ATOM 596 CE LYS A 38 61.003 46.626 -15.144 1.00 0.00 C ATOM 597 NZ LYS A 38 62.228 47.466 -15.126 1.00 0.00 N ATOM 0 H LYS A 38 57.839 43.980 -18.545 1.00 0.00 H new ATOM 0 HA LYS A 38 56.865 46.519 -17.845 1.00 0.00 H new ATOM 0 HB2 LYS A 38 57.854 44.685 -16.384 1.00 0.00 H new ATOM 0 HB3 LYS A 38 59.442 45.174 -16.944 1.00 0.00 H new ATOM 0 HG2 LYS A 38 57.649 47.288 -15.777 1.00 0.00 H new ATOM 0 HG3 LYS A 38 58.355 46.119 -14.679 1.00 0.00 H new ATOM 0 HD2 LYS A 38 59.976 47.869 -16.571 1.00 0.00 H new ATOM 0 HD3 LYS A 38 59.642 48.276 -14.900 1.00 0.00 H new ATOM 0 HE2 LYS A 38 60.827 46.212 -14.151 1.00 0.00 H new ATOM 0 HE3 LYS A 38 61.146 45.783 -15.820 1.00 0.00 H new ATOM 0 HZ1 LYS A 38 63.039 46.890 -14.823 1.00 0.00 H new ATOM 0 HZ2 LYS A 38 62.406 47.840 -16.080 1.00 0.00 H new ATOM 0 HZ3 LYS A 38 62.097 48.256 -14.463 1.00 0.00 H new ATOM 611 N GLU A 39 59.584 46.718 -19.627 1.00 0.00 N ATOM 612 CA GLU A 39 60.419 47.634 -20.415 1.00 0.00 C ATOM 613 C GLU A 39 59.586 48.562 -21.321 1.00 0.00 C ATOM 614 O GLU A 39 59.796 49.775 -21.334 1.00 0.00 O ATOM 615 CB GLU A 39 61.421 46.813 -21.251 1.00 0.00 C ATOM 616 CG GLU A 39 62.772 47.517 -21.428 1.00 0.00 C ATOM 617 CD GLU A 39 63.681 47.309 -20.196 1.00 0.00 C ATOM 618 OE1 GLU A 39 63.455 47.957 -19.145 1.00 0.00 O ATOM 619 OE2 GLU A 39 64.629 46.488 -20.270 1.00 0.00 O ATOM 0 H GLU A 39 59.784 45.734 -19.808 1.00 0.00 H new ATOM 0 HA GLU A 39 60.955 48.282 -19.721 1.00 0.00 H new ATOM 0 HB2 GLU A 39 61.581 45.847 -20.771 1.00 0.00 H new ATOM 0 HB3 GLU A 39 60.990 46.614 -22.232 1.00 0.00 H new ATOM 0 HG2 GLU A 39 63.270 47.134 -22.319 1.00 0.00 H new ATOM 0 HG3 GLU A 39 62.610 48.583 -21.587 1.00 0.00 H new ATOM 626 N ASP A 40 58.595 48.014 -22.036 1.00 0.00 N ATOM 627 CA ASP A 40 57.653 48.802 -22.841 1.00 0.00 C ATOM 628 C ASP A 40 56.599 49.510 -21.973 1.00 0.00 C ATOM 629 O ASP A 40 56.201 50.629 -22.292 1.00 0.00 O ATOM 630 CB ASP A 40 56.979 47.913 -23.896 1.00 0.00 C ATOM 631 CG ASP A 40 57.932 47.539 -25.042 1.00 0.00 C ATOM 632 OD1 ASP A 40 58.445 48.455 -25.730 1.00 0.00 O ATOM 633 OD2 ASP A 40 58.153 46.327 -25.275 1.00 0.00 O ATOM 0 H ASP A 40 58.424 47.009 -22.073 1.00 0.00 H new ATOM 0 HA ASP A 40 58.226 49.580 -23.346 1.00 0.00 H new ATOM 0 HB2 ASP A 40 56.613 47.003 -23.420 1.00 0.00 H new ATOM 0 HB3 ASP A 40 56.111 48.432 -24.303 1.00 0.00 H new ATOM 638 N TYR A 41 56.184 48.912 -20.849 1.00 0.00 N ATOM 639 CA TYR A 41 55.259 49.523 -19.887 1.00 0.00 C ATOM 640 C TYR A 41 55.803 50.859 -19.356 1.00 0.00 C ATOM 641 O TYR A 41 55.101 51.870 -19.376 1.00 0.00 O ATOM 642 CB TYR A 41 54.996 48.537 -18.737 1.00 0.00 C ATOM 643 CG TYR A 41 53.833 48.886 -17.828 1.00 0.00 C ATOM 644 CD1 TYR A 41 54.023 49.761 -16.740 1.00 0.00 C ATOM 645 CD2 TYR A 41 52.575 48.282 -18.031 1.00 0.00 C ATOM 646 CE1 TYR A 41 52.960 50.033 -15.858 1.00 0.00 C ATOM 647 CE2 TYR A 41 51.518 48.529 -17.134 1.00 0.00 C ATOM 648 CZ TYR A 41 51.705 49.414 -16.048 1.00 0.00 C ATOM 649 OH TYR A 41 50.689 49.666 -15.178 1.00 0.00 O ATOM 0 H TYR A 41 56.486 47.976 -20.579 1.00 0.00 H new ATOM 0 HA TYR A 41 54.319 49.741 -20.394 1.00 0.00 H new ATOM 0 HB2 TYR A 41 54.818 47.549 -19.163 1.00 0.00 H new ATOM 0 HB3 TYR A 41 55.899 48.465 -18.131 1.00 0.00 H new ATOM 0 HD1 TYR A 41 54.986 50.224 -16.582 1.00 0.00 H new ATOM 0 HD2 TYR A 41 52.422 47.628 -18.877 1.00 0.00 H new ATOM 0 HE1 TYR A 41 53.105 50.716 -15.034 1.00 0.00 H new ATOM 0 HE2 TYR A 41 50.564 48.042 -17.276 1.00 0.00 H new ATOM 0 HH TYR A 41 49.893 49.163 -15.450 1.00 0.00 H new ATOM 659 N GLU A 42 57.074 50.903 -18.941 1.00 0.00 N ATOM 660 CA GLU A 42 57.721 52.144 -18.497 1.00 0.00 C ATOM 661 C GLU A 42 58.011 53.125 -19.649 1.00 0.00 C ATOM 662 O GLU A 42 57.895 54.334 -19.445 1.00 0.00 O ATOM 663 CB GLU A 42 58.989 51.848 -17.679 1.00 0.00 C ATOM 664 CG GLU A 42 58.645 51.208 -16.324 1.00 0.00 C ATOM 665 CD GLU A 42 59.839 51.259 -15.349 1.00 0.00 C ATOM 666 OE1 GLU A 42 60.870 50.587 -15.594 1.00 0.00 O ATOM 667 OE2 GLU A 42 59.748 51.966 -14.315 1.00 0.00 O ATOM 0 H GLU A 42 57.681 50.084 -18.903 1.00 0.00 H new ATOM 0 HA GLU A 42 57.004 52.646 -17.848 1.00 0.00 H new ATOM 0 HB2 GLU A 42 59.641 51.181 -18.243 1.00 0.00 H new ATOM 0 HB3 GLU A 42 59.543 52.772 -17.516 1.00 0.00 H new ATOM 0 HG2 GLU A 42 57.793 51.725 -15.883 1.00 0.00 H new ATOM 0 HG3 GLU A 42 58.344 50.172 -16.477 1.00 0.00 H new ATOM 674 N LEU A 43 58.297 52.651 -20.870 1.00 0.00 N ATOM 675 CA LEU A 43 58.379 53.519 -22.060 1.00 0.00 C ATOM 676 C LEU A 43 57.026 54.159 -22.434 1.00 0.00 C ATOM 677 O LEU A 43 57.005 55.272 -22.959 1.00 0.00 O ATOM 678 CB LEU A 43 58.971 52.747 -23.255 1.00 0.00 C ATOM 679 CG LEU A 43 60.496 52.532 -23.185 1.00 0.00 C ATOM 680 CD1 LEU A 43 60.937 51.597 -24.314 1.00 0.00 C ATOM 681 CD2 LEU A 43 61.275 53.843 -23.340 1.00 0.00 C ATOM 0 H LEU A 43 58.477 51.666 -21.063 1.00 0.00 H new ATOM 0 HA LEU A 43 59.047 54.341 -21.803 1.00 0.00 H new ATOM 0 HB2 LEU A 43 58.482 51.775 -23.321 1.00 0.00 H new ATOM 0 HB3 LEU A 43 58.735 53.286 -24.173 1.00 0.00 H new ATOM 0 HG LEU A 43 60.710 52.106 -22.205 1.00 0.00 H new ATOM 0 HD11 LEU A 43 62.015 51.447 -24.262 1.00 0.00 H new ATOM 0 HD12 LEU A 43 60.432 50.637 -24.210 1.00 0.00 H new ATOM 0 HD13 LEU A 43 60.678 52.040 -25.276 1.00 0.00 H new ATOM 0 HD21 LEU A 43 62.344 53.640 -23.284 1.00 0.00 H new ATOM 0 HD22 LEU A 43 61.041 54.293 -24.305 1.00 0.00 H new ATOM 0 HD23 LEU A 43 60.994 54.530 -22.542 1.00 0.00 H new ATOM 693 N VAL A 44 55.897 53.510 -22.131 1.00 0.00 N ATOM 694 CA VAL A 44 54.554 54.112 -22.228 1.00 0.00 C ATOM 695 C VAL A 44 54.267 55.040 -21.037 1.00 0.00 C ATOM 696 O VAL A 44 53.675 56.097 -21.230 1.00 0.00 O ATOM 697 CB VAL A 44 53.473 53.020 -22.398 1.00 0.00 C ATOM 698 CG1 VAL A 44 52.048 53.587 -22.365 1.00 0.00 C ATOM 699 CG2 VAL A 44 53.622 52.311 -23.753 1.00 0.00 C ATOM 0 H VAL A 44 55.885 52.543 -21.808 1.00 0.00 H new ATOM 0 HA VAL A 44 54.524 54.736 -23.121 1.00 0.00 H new ATOM 0 HB VAL A 44 53.621 52.336 -21.563 1.00 0.00 H new ATOM 0 HG11 VAL A 44 51.331 52.776 -22.489 1.00 0.00 H new ATOM 0 HG12 VAL A 44 51.875 54.081 -21.409 1.00 0.00 H new ATOM 0 HG13 VAL A 44 51.924 54.307 -23.174 1.00 0.00 H new ATOM 0 HG21 VAL A 44 52.851 51.547 -23.851 1.00 0.00 H new ATOM 0 HG22 VAL A 44 53.516 53.038 -24.558 1.00 0.00 H new ATOM 0 HG23 VAL A 44 54.605 51.844 -23.813 1.00 0.00 H new ATOM 709 N SER A 45 54.715 54.725 -19.818 1.00 0.00 N ATOM 710 CA SER A 45 54.493 55.567 -18.624 1.00 0.00 C ATOM 711 C SER A 45 55.416 56.793 -18.484 1.00 0.00 C ATOM 712 O SER A 45 55.142 57.658 -17.649 1.00 0.00 O ATOM 713 CB SER A 45 54.536 54.711 -17.351 1.00 0.00 C ATOM 714 OG SER A 45 53.292 54.044 -17.201 1.00 0.00 O ATOM 0 H SER A 45 55.245 53.876 -19.624 1.00 0.00 H new ATOM 0 HA SER A 45 53.499 55.991 -18.768 1.00 0.00 H new ATOM 0 HB2 SER A 45 55.347 53.986 -17.412 1.00 0.00 H new ATOM 0 HB3 SER A 45 54.734 55.338 -16.482 1.00 0.00 H new ATOM 0 HG SER A 45 53.312 53.493 -16.391 1.00 0.00 H new ATOM 720 N THR A 46 56.475 56.926 -19.293 1.00 0.00 N ATOM 721 CA THR A 46 57.428 58.062 -19.232 1.00 0.00 C ATOM 722 C THR A 46 57.047 59.260 -20.131 1.00 0.00 C ATOM 723 O THR A 46 57.685 60.316 -20.081 1.00 0.00 O ATOM 724 CB THR A 46 58.862 57.560 -19.505 1.00 0.00 C ATOM 725 OG1 THR A 46 59.826 58.476 -19.029 1.00 0.00 O ATOM 726 CG2 THR A 46 59.157 57.286 -20.981 1.00 0.00 C ATOM 0 H THR A 46 56.704 56.246 -20.018 1.00 0.00 H new ATOM 0 HA THR A 46 57.377 58.462 -18.219 1.00 0.00 H new ATOM 0 HB THR A 46 58.926 56.614 -18.968 1.00 0.00 H new ATOM 0 HG1 THR A 46 59.566 59.386 -19.283 1.00 0.00 H new ATOM 0 HG21 THR A 46 60.184 56.937 -21.088 1.00 0.00 H new ATOM 0 HG22 THR A 46 58.474 56.523 -21.353 1.00 0.00 H new ATOM 0 HG23 THR A 46 59.024 58.203 -21.555 1.00 0.00 H new ATOM 734 N LYS A 47 55.999 59.128 -20.960 1.00 0.00 N ATOM 735 CA LYS A 47 55.539 60.159 -21.918 1.00 0.00 C ATOM 736 C LYS A 47 55.068 61.458 -21.224 1.00 0.00 C ATOM 737 O LYS A 47 54.537 61.390 -20.110 1.00 0.00 O ATOM 738 CB LYS A 47 54.400 59.585 -22.785 1.00 0.00 C ATOM 739 CG LYS A 47 54.739 58.272 -23.517 1.00 0.00 C ATOM 740 CD LYS A 47 55.893 58.344 -24.524 1.00 0.00 C ATOM 741 CE LYS A 47 55.536 59.243 -25.709 1.00 0.00 C ATOM 742 NZ LYS A 47 56.547 59.161 -26.792 1.00 0.00 N ATOM 0 H LYS A 47 55.430 58.282 -20.987 1.00 0.00 H new ATOM 0 HA LYS A 47 56.393 60.425 -22.540 1.00 0.00 H new ATOM 0 HB2 LYS A 47 53.530 59.416 -22.150 1.00 0.00 H new ATOM 0 HB3 LYS A 47 54.114 60.333 -23.525 1.00 0.00 H new ATOM 0 HG2 LYS A 47 54.980 57.515 -22.771 1.00 0.00 H new ATOM 0 HG3 LYS A 47 53.846 57.930 -24.041 1.00 0.00 H new ATOM 0 HD2 LYS A 47 56.787 58.726 -24.031 1.00 0.00 H new ATOM 0 HD3 LYS A 47 56.130 57.342 -24.882 1.00 0.00 H new ATOM 0 HE2 LYS A 47 54.560 58.956 -26.101 1.00 0.00 H new ATOM 0 HE3 LYS A 47 55.452 60.275 -25.369 1.00 0.00 H new ATOM 0 HZ1 LYS A 47 56.259 59.772 -27.583 1.00 0.00 H new ATOM 0 HZ2 LYS A 47 57.470 59.475 -26.430 1.00 0.00 H new ATOM 0 HZ3 LYS A 47 56.622 58.178 -27.123 1.00 0.00 H new ATOM 756 N PRO A 48 55.188 62.636 -21.876 1.00 0.00 N ATOM 757 CA PRO A 48 54.773 63.922 -21.303 1.00 0.00 C ATOM 758 C PRO A 48 53.250 64.144 -21.297 1.00 0.00 C ATOM 759 O PRO A 48 52.758 64.957 -20.511 1.00 0.00 O ATOM 760 CB PRO A 48 55.470 64.984 -22.161 1.00 0.00 C ATOM 761 CG PRO A 48 55.578 64.316 -23.530 1.00 0.00 C ATOM 762 CD PRO A 48 55.813 62.847 -23.178 1.00 0.00 C ATOM 0 HA PRO A 48 55.053 63.966 -20.251 1.00 0.00 H new ATOM 0 HB2 PRO A 48 54.891 65.906 -22.208 1.00 0.00 H new ATOM 0 HB3 PRO A 48 56.451 65.243 -21.762 1.00 0.00 H new ATOM 0 HG2 PRO A 48 54.670 64.450 -24.117 1.00 0.00 H new ATOM 0 HG3 PRO A 48 56.400 64.727 -24.116 1.00 0.00 H new ATOM 0 HD2 PRO A 48 55.375 62.191 -23.931 1.00 0.00 H new ATOM 0 HD3 PRO A 48 56.879 62.621 -23.140 1.00 0.00 H new ATOM 770 N THR A 49 52.496 63.436 -22.148 1.00 0.00 N ATOM 771 CA THR A 49 51.038 63.591 -22.314 1.00 0.00 C ATOM 772 C THR A 49 50.332 62.249 -22.524 1.00 0.00 C ATOM 773 O THR A 49 50.881 61.306 -23.098 1.00 0.00 O ATOM 774 CB THR A 49 50.682 64.515 -23.495 1.00 0.00 C ATOM 775 OG1 THR A 49 51.276 64.052 -24.687 1.00 0.00 O ATOM 776 CG2 THR A 49 51.129 65.961 -23.284 1.00 0.00 C ATOM 0 H THR A 49 52.890 62.720 -22.758 1.00 0.00 H new ATOM 0 HA THR A 49 50.690 64.040 -21.384 1.00 0.00 H new ATOM 0 HB THR A 49 49.594 64.494 -23.563 1.00 0.00 H new ATOM 0 HG1 THR A 49 51.037 64.650 -25.425 1.00 0.00 H new ATOM 0 HG21 THR A 49 50.848 66.559 -24.151 1.00 0.00 H new ATOM 0 HG22 THR A 49 50.647 66.365 -22.394 1.00 0.00 H new ATOM 0 HG23 THR A 49 52.211 65.992 -23.156 1.00 0.00 H new ATOM 784 N ARG A 50 49.077 62.178 -22.067 1.00 0.00 N ATOM 785 CA ARG A 50 48.209 60.981 -22.092 1.00 0.00 C ATOM 786 C ARG A 50 47.864 60.535 -23.514 1.00 0.00 C ATOM 787 O ARG A 50 47.875 59.343 -23.807 1.00 0.00 O ATOM 788 CB ARG A 50 46.930 61.285 -21.293 1.00 0.00 C ATOM 789 CG ARG A 50 47.224 61.567 -19.805 1.00 0.00 C ATOM 790 CD ARG A 50 46.122 62.399 -19.138 1.00 0.00 C ATOM 791 NE ARG A 50 46.156 63.803 -19.603 1.00 0.00 N ATOM 792 CZ ARG A 50 45.626 64.858 -19.011 1.00 0.00 C ATOM 793 NH1 ARG A 50 44.922 64.763 -17.919 1.00 0.00 N ATOM 794 NH2 ARG A 50 45.800 66.047 -19.515 1.00 0.00 N ATOM 0 H ARG A 50 48.612 62.985 -21.650 1.00 0.00 H new ATOM 0 HA ARG A 50 48.753 60.153 -21.637 1.00 0.00 H new ATOM 0 HB2 ARG A 50 46.426 62.146 -21.731 1.00 0.00 H new ATOM 0 HB3 ARG A 50 46.245 60.441 -21.372 1.00 0.00 H new ATOM 0 HG2 ARG A 50 47.333 60.622 -19.274 1.00 0.00 H new ATOM 0 HG3 ARG A 50 48.175 62.093 -19.719 1.00 0.00 H new ATOM 0 HD2 ARG A 50 45.148 61.963 -19.361 1.00 0.00 H new ATOM 0 HD3 ARG A 50 46.245 62.369 -18.055 1.00 0.00 H new ATOM 0 HE ARG A 50 46.645 63.976 -20.481 1.00 0.00 H new ATOM 0 HH11 ARG A 50 44.764 63.850 -17.492 1.00 0.00 H new ATOM 0 HH12 ARG A 50 44.529 65.601 -17.491 1.00 0.00 H new ATOM 0 HH21 ARG A 50 46.346 66.164 -20.368 1.00 0.00 H new ATOM 0 HH22 ARG A 50 45.390 66.860 -19.056 1.00 0.00 H new ATOM 808 N THR A 51 47.645 61.490 -24.416 1.00 0.00 N ATOM 809 CA THR A 51 47.492 61.261 -25.865 1.00 0.00 C ATOM 810 C THR A 51 48.712 60.543 -26.451 1.00 0.00 C ATOM 811 O THR A 51 48.575 59.566 -27.190 1.00 0.00 O ATOM 812 CB THR A 51 47.276 62.602 -26.591 1.00 0.00 C ATOM 813 OG1 THR A 51 48.268 63.529 -26.193 1.00 0.00 O ATOM 814 CG2 THR A 51 45.925 63.231 -26.243 1.00 0.00 C ATOM 0 H THR A 51 47.566 62.474 -24.159 1.00 0.00 H new ATOM 0 HA THR A 51 46.621 60.622 -26.012 1.00 0.00 H new ATOM 0 HB THR A 51 47.321 62.389 -27.659 1.00 0.00 H new ATOM 0 HG1 THR A 51 48.127 64.379 -26.659 1.00 0.00 H new ATOM 0 HG21 THR A 51 45.815 64.175 -26.777 1.00 0.00 H new ATOM 0 HG22 THR A 51 45.122 62.553 -26.534 1.00 0.00 H new ATOM 0 HG23 THR A 51 45.874 63.413 -25.170 1.00 0.00 H new ATOM 822 N SER A 52 49.916 60.964 -26.053 1.00 0.00 N ATOM 823 CA SER A 52 51.182 60.351 -26.461 1.00 0.00 C ATOM 824 C SER A 52 51.426 58.968 -25.829 1.00 0.00 C ATOM 825 O SER A 52 52.039 58.118 -26.475 1.00 0.00 O ATOM 826 CB SER A 52 52.329 61.326 -26.180 1.00 0.00 C ATOM 827 OG SER A 52 53.464 60.997 -26.958 1.00 0.00 O ATOM 0 H SER A 52 50.040 61.758 -25.425 1.00 0.00 H new ATOM 0 HA SER A 52 51.129 60.158 -27.532 1.00 0.00 H new ATOM 0 HB2 SER A 52 52.011 62.344 -26.404 1.00 0.00 H new ATOM 0 HB3 SER A 52 52.586 61.298 -25.121 1.00 0.00 H new ATOM 0 HG SER A 52 54.186 61.631 -26.767 1.00 0.00 H new ATOM 833 N LYS A 53 50.880 58.665 -24.634 1.00 0.00 N ATOM 834 CA LYS A 53 50.858 57.286 -24.084 1.00 0.00 C ATOM 835 C LYS A 53 50.133 56.313 -25.017 1.00 0.00 C ATOM 836 O LYS A 53 50.659 55.241 -25.316 1.00 0.00 O ATOM 837 CB LYS A 53 50.227 57.202 -22.677 1.00 0.00 C ATOM 838 CG LYS A 53 50.925 58.056 -21.612 1.00 0.00 C ATOM 839 CD LYS A 53 50.420 57.786 -20.183 1.00 0.00 C ATOM 840 CE LYS A 53 50.889 56.430 -19.624 1.00 0.00 C ATOM 841 NZ LYS A 53 49.786 55.456 -19.422 1.00 0.00 N ATOM 0 H LYS A 53 50.445 59.358 -24.025 1.00 0.00 H new ATOM 0 HA LYS A 53 51.906 56.998 -24.001 1.00 0.00 H new ATOM 0 HB2 LYS A 53 49.183 57.508 -22.743 1.00 0.00 H new ATOM 0 HB3 LYS A 53 50.234 56.162 -22.352 1.00 0.00 H new ATOM 0 HG2 LYS A 53 51.998 57.867 -21.652 1.00 0.00 H new ATOM 0 HG3 LYS A 53 50.778 59.110 -21.848 1.00 0.00 H new ATOM 0 HD2 LYS A 53 50.766 58.583 -19.525 1.00 0.00 H new ATOM 0 HD3 LYS A 53 49.330 57.818 -20.177 1.00 0.00 H new ATOM 0 HE2 LYS A 53 51.622 55.999 -20.306 1.00 0.00 H new ATOM 0 HE3 LYS A 53 51.396 56.594 -18.673 1.00 0.00 H new ATOM 0 HZ1 LYS A 53 50.102 54.702 -18.778 1.00 0.00 H new ATOM 0 HZ2 LYS A 53 48.965 55.942 -19.009 1.00 0.00 H new ATOM 0 HZ3 LYS A 53 49.518 55.040 -20.337 1.00 0.00 H new ATOM 855 N VAL A 54 48.955 56.696 -25.520 1.00 0.00 N ATOM 856 CA VAL A 54 48.194 55.868 -26.476 1.00 0.00 C ATOM 857 C VAL A 54 48.964 55.701 -27.791 1.00 0.00 C ATOM 858 O VAL A 54 49.060 54.586 -28.296 1.00 0.00 O ATOM 859 CB VAL A 54 46.783 56.425 -26.755 1.00 0.00 C ATOM 860 CG1 VAL A 54 45.948 55.405 -27.544 1.00 0.00 C ATOM 861 CG2 VAL A 54 45.997 56.765 -25.483 1.00 0.00 C ATOM 0 H VAL A 54 48.501 57.578 -25.283 1.00 0.00 H new ATOM 0 HA VAL A 54 48.070 54.892 -26.007 1.00 0.00 H new ATOM 0 HB VAL A 54 46.944 57.342 -27.322 1.00 0.00 H new ATOM 0 HG11 VAL A 54 44.956 55.815 -27.732 1.00 0.00 H new ATOM 0 HG12 VAL A 54 46.438 55.191 -28.494 1.00 0.00 H new ATOM 0 HG13 VAL A 54 45.857 54.485 -26.967 1.00 0.00 H new ATOM 0 HG21 VAL A 54 45.015 57.151 -25.755 1.00 0.00 H new ATOM 0 HG22 VAL A 54 45.879 55.867 -24.877 1.00 0.00 H new ATOM 0 HG23 VAL A 54 46.538 57.519 -24.912 1.00 0.00 H new ATOM 871 N ARG A 55 49.586 56.767 -28.322 1.00 0.00 N ATOM 872 CA ARG A 55 50.440 56.684 -29.528 1.00 0.00 C ATOM 873 C ARG A 55 51.664 55.776 -29.342 1.00 0.00 C ATOM 874 O ARG A 55 51.995 55.009 -30.246 1.00 0.00 O ATOM 875 CB ARG A 55 50.869 58.080 -30.003 1.00 0.00 C ATOM 876 CG ARG A 55 49.689 58.885 -30.570 1.00 0.00 C ATOM 877 CD ARG A 55 50.183 60.206 -31.170 1.00 0.00 C ATOM 878 NE ARG A 55 49.067 61.014 -31.701 1.00 0.00 N ATOM 879 CZ ARG A 55 49.167 62.188 -32.302 1.00 0.00 C ATOM 880 NH1 ARG A 55 50.316 62.772 -32.494 1.00 0.00 N ATOM 881 NH2 ARG A 55 48.103 62.805 -32.730 1.00 0.00 N ATOM 0 H ARG A 55 49.514 57.707 -27.933 1.00 0.00 H new ATOM 0 HA ARG A 55 49.824 56.223 -30.300 1.00 0.00 H new ATOM 0 HB2 ARG A 55 51.313 58.626 -29.170 1.00 0.00 H new ATOM 0 HB3 ARG A 55 51.641 57.982 -30.767 1.00 0.00 H new ATOM 0 HG2 ARG A 55 49.175 58.301 -31.334 1.00 0.00 H new ATOM 0 HG3 ARG A 55 48.964 59.085 -29.781 1.00 0.00 H new ATOM 0 HD2 ARG A 55 50.715 60.776 -30.408 1.00 0.00 H new ATOM 0 HD3 ARG A 55 50.895 59.999 -31.969 1.00 0.00 H new ATOM 0 HE ARG A 55 48.128 60.630 -31.594 1.00 0.00 H new ATOM 0 HH11 ARG A 55 51.175 62.323 -32.177 1.00 0.00 H new ATOM 0 HH12 ARG A 55 50.356 63.678 -32.961 1.00 0.00 H new ATOM 0 HH21 ARG A 55 47.183 62.383 -32.603 1.00 0.00 H new ATOM 0 HH22 ARG A 55 48.190 63.710 -33.192 1.00 0.00 H new ATOM 895 N GLN A 56 52.300 55.805 -28.169 1.00 0.00 N ATOM 896 CA GLN A 56 53.410 54.908 -27.823 1.00 0.00 C ATOM 897 C GLN A 56 52.966 53.430 -27.806 1.00 0.00 C ATOM 898 O GLN A 56 53.677 52.570 -28.327 1.00 0.00 O ATOM 899 CB GLN A 56 54.003 55.337 -26.469 1.00 0.00 C ATOM 900 CG GLN A 56 55.375 54.703 -26.174 1.00 0.00 C ATOM 901 CD GLN A 56 56.531 55.294 -26.985 1.00 0.00 C ATOM 902 OE1 GLN A 56 56.485 56.407 -27.495 1.00 0.00 O ATOM 903 NE2 GLN A 56 57.633 54.589 -27.117 1.00 0.00 N ATOM 0 H GLN A 56 52.058 56.458 -27.423 1.00 0.00 H new ATOM 0 HA GLN A 56 54.181 54.988 -28.590 1.00 0.00 H new ATOM 0 HB2 GLN A 56 54.101 56.422 -26.451 1.00 0.00 H new ATOM 0 HB3 GLN A 56 53.308 55.067 -25.674 1.00 0.00 H new ATOM 0 HG2 GLN A 56 55.595 54.819 -25.113 1.00 0.00 H new ATOM 0 HG3 GLN A 56 55.318 53.633 -26.372 1.00 0.00 H new ATOM 0 HE21 GLN A 56 57.697 53.660 -26.702 1.00 0.00 H new ATOM 0 HE22 GLN A 56 58.424 54.972 -27.635 1.00 0.00 H new ATOM 912 N LEU A 57 51.772 53.138 -27.273 1.00 0.00 N ATOM 913 CA LEU A 57 51.137 51.817 -27.374 1.00 0.00 C ATOM 914 C LEU A 57 50.762 51.451 -28.828 1.00 0.00 C ATOM 915 O LEU A 57 50.961 50.309 -29.235 1.00 0.00 O ATOM 916 CB LEU A 57 49.955 51.750 -26.380 1.00 0.00 C ATOM 917 CG LEU A 57 48.983 50.574 -26.632 1.00 0.00 C ATOM 918 CD1 LEU A 57 48.602 49.824 -25.355 1.00 0.00 C ATOM 919 CD2 LEU A 57 47.723 51.067 -27.339 1.00 0.00 C ATOM 0 H LEU A 57 51.215 53.818 -26.755 1.00 0.00 H new ATOM 0 HA LEU A 57 51.853 51.046 -27.089 1.00 0.00 H new ATOM 0 HB2 LEU A 57 50.350 51.670 -25.367 1.00 0.00 H new ATOM 0 HB3 LEU A 57 49.398 52.685 -26.432 1.00 0.00 H new ATOM 0 HG LEU A 57 49.514 49.867 -27.269 1.00 0.00 H new ATOM 0 HD11 LEU A 57 47.918 49.011 -25.601 1.00 0.00 H new ATOM 0 HD12 LEU A 57 49.500 49.415 -24.891 1.00 0.00 H new ATOM 0 HD13 LEU A 57 48.116 50.510 -24.661 1.00 0.00 H new ATOM 0 HD21 LEU A 57 47.049 50.227 -27.509 1.00 0.00 H new ATOM 0 HD22 LEU A 57 47.225 51.812 -26.718 1.00 0.00 H new ATOM 0 HD23 LEU A 57 47.994 51.514 -28.295 1.00 0.00 H new ATOM 931 N LEU A 58 50.272 52.386 -29.649 1.00 0.00 N ATOM 932 CA LEU A 58 50.016 52.139 -31.078 1.00 0.00 C ATOM 933 C LEU A 58 51.284 51.686 -31.830 1.00 0.00 C ATOM 934 O LEU A 58 51.204 50.807 -32.687 1.00 0.00 O ATOM 935 CB LEU A 58 49.376 53.382 -31.732 1.00 0.00 C ATOM 936 CG LEU A 58 47.868 53.254 -32.017 1.00 0.00 C ATOM 937 CD1 LEU A 58 47.043 52.931 -30.770 1.00 0.00 C ATOM 938 CD2 LEU A 58 47.349 54.570 -32.599 1.00 0.00 C ATOM 0 H LEU A 58 50.041 53.332 -29.346 1.00 0.00 H new ATOM 0 HA LEU A 58 49.309 51.313 -31.150 1.00 0.00 H new ATOM 0 HB2 LEU A 58 49.537 54.242 -31.082 1.00 0.00 H new ATOM 0 HB3 LEU A 58 49.893 53.590 -32.669 1.00 0.00 H new ATOM 0 HG LEU A 58 47.754 52.427 -32.717 1.00 0.00 H new ATOM 0 HD11 LEU A 58 45.990 52.854 -31.040 1.00 0.00 H new ATOM 0 HD12 LEU A 58 47.379 51.984 -30.347 1.00 0.00 H new ATOM 0 HD13 LEU A 58 47.172 53.724 -30.033 1.00 0.00 H new ATOM 0 HD21 LEU A 58 46.282 54.482 -32.802 1.00 0.00 H new ATOM 0 HD22 LEU A 58 47.518 55.376 -31.884 1.00 0.00 H new ATOM 0 HD23 LEU A 58 47.877 54.791 -33.526 1.00 0.00 H new ATOM 950 N ASP A 59 52.460 52.213 -31.478 1.00 0.00 N ATOM 951 CA ASP A 59 53.740 51.759 -32.043 1.00 0.00 C ATOM 952 C ASP A 59 54.040 50.274 -31.749 1.00 0.00 C ATOM 953 O ASP A 59 54.483 49.551 -32.643 1.00 0.00 O ATOM 954 CB ASP A 59 54.891 52.659 -31.555 1.00 0.00 C ATOM 955 CG ASP A 59 55.508 53.462 -32.713 1.00 0.00 C ATOM 956 OD1 ASP A 59 56.229 52.865 -33.548 1.00 0.00 O ATOM 957 OD2 ASP A 59 55.284 54.694 -32.791 1.00 0.00 O ATOM 0 H ASP A 59 52.555 52.965 -30.795 1.00 0.00 H new ATOM 0 HA ASP A 59 53.653 51.843 -33.126 1.00 0.00 H new ATOM 0 HB2 ASP A 59 54.520 53.344 -30.793 1.00 0.00 H new ATOM 0 HB3 ASP A 59 55.660 52.046 -31.086 1.00 0.00 H new ATOM 962 N THR A 60 53.762 49.784 -30.533 1.00 0.00 N ATOM 963 CA THR A 60 53.909 48.355 -30.191 1.00 0.00 C ATOM 964 C THR A 60 52.737 47.497 -30.681 1.00 0.00 C ATOM 965 O THR A 60 52.934 46.317 -30.970 1.00 0.00 O ATOM 966 CB THR A 60 54.146 48.128 -28.688 1.00 0.00 C ATOM 967 OG1 THR A 60 53.149 48.733 -27.901 1.00 0.00 O ATOM 968 CG2 THR A 60 55.480 48.717 -28.230 1.00 0.00 C ATOM 0 H THR A 60 53.430 50.360 -29.760 1.00 0.00 H new ATOM 0 HA THR A 60 54.801 48.028 -30.726 1.00 0.00 H new ATOM 0 HB THR A 60 54.135 47.046 -28.555 1.00 0.00 H new ATOM 0 HG1 THR A 60 52.432 48.088 -27.729 1.00 0.00 H new ATOM 0 HG21 THR A 60 55.610 48.536 -27.163 1.00 0.00 H new ATOM 0 HG22 THR A 60 56.294 48.245 -28.780 1.00 0.00 H new ATOM 0 HG23 THR A 60 55.488 49.790 -28.420 1.00 0.00 H new ATOM 976 N THR A 61 51.543 48.066 -30.880 1.00 0.00 N ATOM 977 CA THR A 61 50.378 47.379 -31.473 1.00 0.00 C ATOM 978 C THR A 61 50.661 46.838 -32.881 1.00 0.00 C ATOM 979 O THR A 61 50.284 45.708 -33.202 1.00 0.00 O ATOM 980 CB THR A 61 49.127 48.287 -31.418 1.00 0.00 C ATOM 981 OG1 THR A 61 48.072 47.591 -30.805 1.00 0.00 O ATOM 982 CG2 THR A 61 48.559 48.797 -32.740 1.00 0.00 C ATOM 0 H THR A 61 51.350 49.036 -30.630 1.00 0.00 H new ATOM 0 HA THR A 61 50.171 46.497 -30.867 1.00 0.00 H new ATOM 0 HB THR A 61 49.493 49.159 -30.876 1.00 0.00 H new ATOM 0 HG1 THR A 61 47.279 48.166 -30.768 1.00 0.00 H new ATOM 0 HG21 THR A 61 47.686 49.419 -32.545 1.00 0.00 H new ATOM 0 HG22 THR A 61 49.316 49.386 -33.258 1.00 0.00 H new ATOM 0 HG23 THR A 61 48.269 47.950 -33.362 1.00 0.00 H new ATOM 990 N ASP A 62 51.408 47.586 -33.703 1.00 0.00 N ATOM 991 CA ASP A 62 51.858 47.132 -35.028 1.00 0.00 C ATOM 992 C ASP A 62 52.828 45.933 -34.952 1.00 0.00 C ATOM 993 O ASP A 62 52.853 45.099 -35.860 1.00 0.00 O ATOM 994 CB ASP A 62 52.530 48.289 -35.789 1.00 0.00 C ATOM 995 CG ASP A 62 51.552 49.372 -36.285 1.00 0.00 C ATOM 996 OD1 ASP A 62 50.491 49.030 -36.862 1.00 0.00 O ATOM 997 OD2 ASP A 62 51.879 50.577 -36.166 1.00 0.00 O ATOM 0 H ASP A 62 51.720 48.528 -33.468 1.00 0.00 H new ATOM 0 HA ASP A 62 50.968 46.799 -35.562 1.00 0.00 H new ATOM 0 HB2 ASP A 62 53.271 48.755 -35.139 1.00 0.00 H new ATOM 0 HB3 ASP A 62 53.068 47.882 -36.645 1.00 0.00 H new ATOM 1002 N ILE A 63 53.611 45.825 -33.869 1.00 0.00 N ATOM 1003 CA ILE A 63 54.589 44.746 -33.641 1.00 0.00 C ATOM 1004 C ILE A 63 53.895 43.484 -33.095 1.00 0.00 C ATOM 1005 O ILE A 63 54.174 42.375 -33.555 1.00 0.00 O ATOM 1006 CB ILE A 63 55.715 45.226 -32.685 1.00 0.00 C ATOM 1007 CG1 ILE A 63 56.425 46.483 -33.249 1.00 0.00 C ATOM 1008 CG2 ILE A 63 56.744 44.105 -32.437 1.00 0.00 C ATOM 1009 CD1 ILE A 63 57.448 47.122 -32.299 1.00 0.00 C ATOM 0 H ILE A 63 53.583 46.502 -33.107 1.00 0.00 H new ATOM 0 HA ILE A 63 55.045 44.486 -34.596 1.00 0.00 H new ATOM 0 HB ILE A 63 55.250 45.487 -31.734 1.00 0.00 H new ATOM 0 HG12 ILE A 63 56.930 46.213 -34.177 1.00 0.00 H new ATOM 0 HG13 ILE A 63 55.670 47.227 -33.502 1.00 0.00 H new ATOM 0 HG21 ILE A 63 57.522 44.467 -31.765 1.00 0.00 H new ATOM 0 HG22 ILE A 63 56.246 43.247 -31.987 1.00 0.00 H new ATOM 0 HG23 ILE A 63 57.193 43.807 -33.384 1.00 0.00 H new ATOM 0 HD11 ILE A 63 57.894 47.994 -32.778 1.00 0.00 H new ATOM 0 HD12 ILE A 63 56.949 47.428 -31.380 1.00 0.00 H new ATOM 0 HD13 ILE A 63 58.228 46.398 -32.065 1.00 0.00 H new ATOM 1021 N GLN A 64 52.980 43.640 -32.130 1.00 0.00 N ATOM 1022 CA GLN A 64 52.292 42.525 -31.463 1.00 0.00 C ATOM 1023 C GLN A 64 51.303 41.772 -32.370 1.00 0.00 C ATOM 1024 O GLN A 64 51.206 40.545 -32.277 1.00 0.00 O ATOM 1025 CB GLN A 64 51.537 43.051 -30.231 1.00 0.00 C ATOM 1026 CG GLN A 64 52.441 43.492 -29.068 1.00 0.00 C ATOM 1027 CD GLN A 64 53.294 42.363 -28.485 1.00 0.00 C ATOM 1028 OE1 GLN A 64 52.914 41.200 -28.437 1.00 0.00 O ATOM 1029 NE2 GLN A 64 54.497 42.656 -28.037 1.00 0.00 N ATOM 0 H GLN A 64 52.692 44.556 -31.785 1.00 0.00 H new ATOM 0 HA GLN A 64 53.068 41.813 -31.181 1.00 0.00 H new ATOM 0 HB2 GLN A 64 50.918 43.896 -30.534 1.00 0.00 H new ATOM 0 HB3 GLN A 64 50.862 42.273 -29.875 1.00 0.00 H new ATOM 0 HG2 GLN A 64 53.098 44.290 -29.414 1.00 0.00 H new ATOM 0 HG3 GLN A 64 51.820 43.911 -28.276 1.00 0.00 H new ATOM 0 HE21 GLN A 64 54.832 43.619 -28.068 1.00 0.00 H new ATOM 0 HE22 GLN A 64 55.094 41.920 -27.659 1.00 0.00 H new ATOM 1038 N GLY A 65 50.568 42.481 -33.236 1.00 0.00 N ATOM 1039 CA GLY A 65 49.560 41.893 -34.130 1.00 0.00 C ATOM 1040 C GLY A 65 48.115 42.112 -33.662 1.00 0.00 C ATOM 1041 O GLY A 65 47.837 42.937 -32.789 1.00 0.00 O ATOM 0 H GLY A 65 50.657 43.492 -33.337 1.00 0.00 H new ATOM 0 HA2 GLY A 65 49.678 42.320 -35.126 1.00 0.00 H new ATOM 0 HA3 GLY A 65 49.746 40.822 -34.218 1.00 0.00 H new ATOM 1045 N GLU A 66 47.184 41.348 -34.239 1.00 0.00 N ATOM 1046 CA GLU A 66 45.720 41.429 -34.044 1.00 0.00 C ATOM 1047 C GLU A 66 45.220 40.919 -32.664 1.00 0.00 C ATOM 1048 O GLU A 66 44.136 40.352 -32.531 1.00 0.00 O ATOM 1049 CB GLU A 66 45.052 40.737 -35.250 1.00 0.00 C ATOM 1050 CG GLU A 66 43.577 41.110 -35.465 1.00 0.00 C ATOM 1051 CD GLU A 66 43.259 41.233 -36.960 1.00 0.00 C ATOM 1052 OE1 GLU A 66 43.370 40.225 -37.707 1.00 0.00 O ATOM 1053 OE2 GLU A 66 42.936 42.356 -37.414 1.00 0.00 O ATOM 0 H GLU A 66 47.439 40.610 -34.895 1.00 0.00 H new ATOM 0 HA GLU A 66 45.424 42.477 -34.012 1.00 0.00 H new ATOM 0 HB2 GLU A 66 45.612 40.987 -36.151 1.00 0.00 H new ATOM 0 HB3 GLU A 66 45.125 39.657 -35.119 1.00 0.00 H new ATOM 0 HG2 GLU A 66 42.936 40.353 -35.013 1.00 0.00 H new ATOM 0 HG3 GLU A 66 43.359 42.053 -34.963 1.00 0.00 H new ATOM 1060 N GLU A 67 46.019 41.134 -31.616 1.00 0.00 N ATOM 1061 CA GLU A 67 45.757 40.788 -30.208 1.00 0.00 C ATOM 1062 C GLU A 67 45.808 42.046 -29.322 1.00 0.00 C ATOM 1063 O GLU A 67 44.915 42.286 -28.508 1.00 0.00 O ATOM 1064 CB GLU A 67 46.817 39.782 -29.712 1.00 0.00 C ATOM 1065 CG GLU A 67 46.816 38.409 -30.405 1.00 0.00 C ATOM 1066 CD GLU A 67 45.788 37.415 -29.822 1.00 0.00 C ATOM 1067 OE1 GLU A 67 44.646 37.812 -29.495 1.00 0.00 O ATOM 1068 OE2 GLU A 67 46.117 36.208 -29.702 1.00 0.00 O ATOM 0 H GLU A 67 46.927 41.584 -31.731 1.00 0.00 H new ATOM 0 HA GLU A 67 44.763 40.345 -30.143 1.00 0.00 H new ATOM 0 HB2 GLU A 67 47.802 40.230 -29.838 1.00 0.00 H new ATOM 0 HB3 GLU A 67 46.671 39.628 -28.643 1.00 0.00 H new ATOM 0 HG2 GLU A 67 46.610 38.549 -31.466 1.00 0.00 H new ATOM 0 HG3 GLU A 67 47.812 37.973 -30.328 1.00 0.00 H new ATOM 1075 N PHE A 68 46.826 42.890 -29.522 1.00 0.00 N ATOM 1076 CA PHE A 68 47.058 44.119 -28.753 1.00 0.00 C ATOM 1077 C PHE A 68 46.107 45.243 -29.193 1.00 0.00 C ATOM 1078 O PHE A 68 45.446 45.867 -28.362 1.00 0.00 O ATOM 1079 CB PHE A 68 48.534 44.498 -28.945 1.00 0.00 C ATOM 1080 CG PHE A 68 49.205 45.215 -27.792 1.00 0.00 C ATOM 1081 CD1 PHE A 68 49.538 44.490 -26.634 1.00 0.00 C ATOM 1082 CD2 PHE A 68 49.622 46.553 -27.914 1.00 0.00 C ATOM 1083 CE1 PHE A 68 50.286 45.096 -25.611 1.00 0.00 C ATOM 1084 CE2 PHE A 68 50.373 47.155 -26.893 1.00 0.00 C ATOM 1085 CZ PHE A 68 50.693 46.435 -25.737 1.00 0.00 C ATOM 0 H PHE A 68 47.531 42.733 -30.243 1.00 0.00 H new ATOM 0 HA PHE A 68 46.850 43.959 -27.695 1.00 0.00 H new ATOM 0 HB2 PHE A 68 49.095 43.587 -29.153 1.00 0.00 H new ATOM 0 HB3 PHE A 68 48.611 45.129 -29.830 1.00 0.00 H new ATOM 0 HD1 PHE A 68 49.218 43.464 -26.531 1.00 0.00 H new ATOM 0 HD2 PHE A 68 49.363 47.119 -28.797 1.00 0.00 H new ATOM 0 HE1 PHE A 68 50.548 44.533 -24.728 1.00 0.00 H new ATOM 0 HE2 PHE A 68 50.705 48.177 -27.000 1.00 0.00 H new ATOM 0 HZ PHE A 68 51.252 46.908 -24.943 1.00 0.00 H new ATOM 1095 N ALA A 69 45.932 45.426 -30.507 1.00 0.00 N ATOM 1096 CA ALA A 69 44.907 46.313 -31.060 1.00 0.00 C ATOM 1097 C ALA A 69 43.487 45.807 -30.747 1.00 0.00 C ATOM 1098 O ALA A 69 42.590 46.605 -30.477 1.00 0.00 O ATOM 1099 CB ALA A 69 45.142 46.453 -32.566 1.00 0.00 C ATOM 0 H ALA A 69 46.499 44.962 -31.216 1.00 0.00 H new ATOM 0 HA ALA A 69 44.987 47.294 -30.591 1.00 0.00 H new ATOM 0 HB1 ALA A 69 44.385 47.112 -32.993 1.00 0.00 H new ATOM 0 HB2 ALA A 69 46.131 46.875 -32.742 1.00 0.00 H new ATOM 0 HB3 ALA A 69 45.077 45.472 -33.037 1.00 0.00 H new ATOM 1105 N LYS A 70 43.286 44.480 -30.716 1.00 0.00 N ATOM 1106 CA LYS A 70 42.023 43.863 -30.283 1.00 0.00 C ATOM 1107 C LYS A 70 41.678 44.218 -28.835 1.00 0.00 C ATOM 1108 O LYS A 70 40.575 44.706 -28.611 1.00 0.00 O ATOM 1109 CB LYS A 70 42.054 42.348 -30.558 1.00 0.00 C ATOM 1110 CG LYS A 70 40.953 41.555 -29.825 1.00 0.00 C ATOM 1111 CD LYS A 70 40.717 40.155 -30.414 1.00 0.00 C ATOM 1112 CE LYS A 70 41.998 39.313 -30.444 1.00 0.00 C ATOM 1113 NZ LYS A 70 41.911 38.079 -29.625 1.00 0.00 N ATOM 0 H LYS A 70 43.997 43.803 -30.992 1.00 0.00 H new ATOM 0 HA LYS A 70 41.207 44.278 -30.874 1.00 0.00 H new ATOM 0 HB2 LYS A 70 41.954 42.182 -31.631 1.00 0.00 H new ATOM 0 HB3 LYS A 70 43.027 41.955 -30.264 1.00 0.00 H new ATOM 0 HG2 LYS A 70 41.224 41.458 -28.774 1.00 0.00 H new ATOM 0 HG3 LYS A 70 40.021 42.120 -29.864 1.00 0.00 H new ATOM 0 HD2 LYS A 70 39.959 39.639 -29.825 1.00 0.00 H new ATOM 0 HD3 LYS A 70 40.324 40.251 -31.426 1.00 0.00 H new ATOM 0 HE2 LYS A 70 42.221 39.041 -31.476 1.00 0.00 H new ATOM 0 HE3 LYS A 70 42.831 39.919 -30.087 1.00 0.00 H new ATOM 0 HZ1 LYS A 70 42.865 37.796 -29.322 1.00 0.00 H new ATOM 0 HZ2 LYS A 70 41.321 38.259 -28.788 1.00 0.00 H new ATOM 0 HZ3 LYS A 70 41.486 37.316 -30.190 1.00 0.00 H new ATOM 1127 N VAL A 71 42.575 44.041 -27.856 1.00 0.00 N ATOM 1128 CA VAL A 71 42.226 44.304 -26.440 1.00 0.00 C ATOM 1129 C VAL A 71 41.821 45.764 -26.183 1.00 0.00 C ATOM 1130 O VAL A 71 40.897 46.013 -25.412 1.00 0.00 O ATOM 1131 CB VAL A 71 43.310 43.814 -25.452 1.00 0.00 C ATOM 1132 CG1 VAL A 71 44.412 44.832 -25.137 1.00 0.00 C ATOM 1133 CG2 VAL A 71 42.668 43.401 -24.122 1.00 0.00 C ATOM 0 H VAL A 71 43.532 43.723 -28.006 1.00 0.00 H new ATOM 0 HA VAL A 71 41.338 43.703 -26.243 1.00 0.00 H new ATOM 0 HB VAL A 71 43.782 42.975 -25.963 1.00 0.00 H new ATOM 0 HG11 VAL A 71 45.123 44.394 -24.436 1.00 0.00 H new ATOM 0 HG12 VAL A 71 44.930 45.104 -26.057 1.00 0.00 H new ATOM 0 HG13 VAL A 71 43.968 45.723 -24.694 1.00 0.00 H new ATOM 0 HG21 VAL A 71 43.442 43.058 -23.435 1.00 0.00 H new ATOM 0 HG22 VAL A 71 42.150 44.256 -23.687 1.00 0.00 H new ATOM 0 HG23 VAL A 71 41.955 42.595 -24.297 1.00 0.00 H new ATOM 1143 N ILE A 72 42.438 46.719 -26.888 1.00 0.00 N ATOM 1144 CA ILE A 72 42.082 48.149 -26.871 1.00 0.00 C ATOM 1145 C ILE A 72 40.620 48.369 -27.291 1.00 0.00 C ATOM 1146 O ILE A 72 39.860 49.045 -26.594 1.00 0.00 O ATOM 1147 CB ILE A 72 43.081 48.913 -27.776 1.00 0.00 C ATOM 1148 CG1 ILE A 72 44.490 48.955 -27.143 1.00 0.00 C ATOM 1149 CG2 ILE A 72 42.631 50.330 -28.165 1.00 0.00 C ATOM 1150 CD1 ILE A 72 44.663 49.916 -25.955 1.00 0.00 C ATOM 0 H ILE A 72 43.223 46.515 -27.506 1.00 0.00 H new ATOM 0 HA ILE A 72 42.158 48.539 -25.856 1.00 0.00 H new ATOM 0 HB ILE A 72 43.113 48.342 -28.704 1.00 0.00 H new ATOM 0 HG12 ILE A 72 44.749 47.949 -26.813 1.00 0.00 H new ATOM 0 HG13 ILE A 72 45.207 49.231 -27.916 1.00 0.00 H new ATOM 0 HG21 ILE A 72 43.389 50.791 -28.798 1.00 0.00 H new ATOM 0 HG22 ILE A 72 41.688 50.276 -28.709 1.00 0.00 H new ATOM 0 HG23 ILE A 72 42.497 50.929 -27.264 1.00 0.00 H new ATOM 0 HD11 ILE A 72 45.689 49.863 -25.591 1.00 0.00 H new ATOM 0 HD12 ILE A 72 44.444 50.934 -26.276 1.00 0.00 H new ATOM 0 HD13 ILE A 72 43.979 49.632 -25.155 1.00 0.00 H new ATOM 1162 N VAL A 73 40.195 47.754 -28.397 1.00 0.00 N ATOM 1163 CA VAL A 73 38.819 47.879 -28.906 1.00 0.00 C ATOM 1164 C VAL A 73 37.818 47.043 -28.095 1.00 0.00 C ATOM 1165 O VAL A 73 36.680 47.466 -27.883 1.00 0.00 O ATOM 1166 CB VAL A 73 38.763 47.543 -30.404 1.00 0.00 C ATOM 1167 CG1 VAL A 73 37.354 47.768 -30.954 1.00 0.00 C ATOM 1168 CG2 VAL A 73 39.722 48.432 -31.208 1.00 0.00 C ATOM 0 H VAL A 73 40.791 47.155 -28.968 1.00 0.00 H new ATOM 0 HA VAL A 73 38.517 48.919 -28.782 1.00 0.00 H new ATOM 0 HB VAL A 73 39.051 46.497 -30.506 1.00 0.00 H new ATOM 0 HG11 VAL A 73 37.335 47.525 -32.016 1.00 0.00 H new ATOM 0 HG12 VAL A 73 36.649 47.128 -30.422 1.00 0.00 H new ATOM 0 HG13 VAL A 73 37.072 48.812 -30.816 1.00 0.00 H new ATOM 0 HG21 VAL A 73 39.660 48.171 -32.265 1.00 0.00 H new ATOM 0 HG22 VAL A 73 39.446 49.478 -31.076 1.00 0.00 H new ATOM 0 HG23 VAL A 73 40.742 48.279 -30.855 1.00 0.00 H new ATOM 1178 N GLN A 74 38.230 45.892 -27.559 1.00 0.00 N ATOM 1179 CA GLN A 74 37.397 45.107 -26.643 1.00 0.00 C ATOM 1180 C GLN A 74 37.153 45.881 -25.326 1.00 0.00 C ATOM 1181 O GLN A 74 36.031 45.903 -24.818 1.00 0.00 O ATOM 1182 CB GLN A 74 37.951 43.663 -26.523 1.00 0.00 C ATOM 1183 CG GLN A 74 38.552 43.197 -25.184 1.00 0.00 C ATOM 1184 CD GLN A 74 37.524 43.035 -24.060 1.00 0.00 C ATOM 1185 OE1 GLN A 74 36.330 42.883 -24.272 1.00 0.00 O ATOM 1186 NE2 GLN A 74 37.953 43.078 -22.818 1.00 0.00 N ATOM 0 H GLN A 74 39.144 45.479 -27.745 1.00 0.00 H new ATOM 0 HA GLN A 74 36.392 44.970 -27.041 1.00 0.00 H new ATOM 0 HB2 GLN A 74 37.141 42.979 -26.774 1.00 0.00 H new ATOM 0 HB3 GLN A 74 38.719 43.542 -27.287 1.00 0.00 H new ATOM 0 HG2 GLN A 74 39.060 42.245 -25.338 1.00 0.00 H new ATOM 0 HG3 GLN A 74 39.309 43.915 -24.869 1.00 0.00 H new ATOM 0 HE21 GLN A 74 38.947 43.204 -22.626 1.00 0.00 H new ATOM 0 HE22 GLN A 74 37.292 42.985 -22.047 1.00 0.00 H new ATOM 1195 N LYS A 75 38.153 46.624 -24.822 1.00 0.00 N ATOM 1196 CA LYS A 75 38.002 47.544 -23.681 1.00 0.00 C ATOM 1197 C LYS A 75 37.085 48.741 -23.983 1.00 0.00 C ATOM 1198 O LYS A 75 36.271 49.097 -23.134 1.00 0.00 O ATOM 1199 CB LYS A 75 39.395 47.983 -23.189 1.00 0.00 C ATOM 1200 CG LYS A 75 39.384 48.839 -21.910 1.00 0.00 C ATOM 1201 CD LYS A 75 38.650 48.251 -20.688 1.00 0.00 C ATOM 1202 CE LYS A 75 39.263 46.976 -20.078 1.00 0.00 C ATOM 1203 NZ LYS A 75 38.948 45.726 -20.821 1.00 0.00 N ATOM 0 H LYS A 75 39.100 46.603 -25.200 1.00 0.00 H new ATOM 0 HA LYS A 75 37.498 47.004 -22.880 1.00 0.00 H new ATOM 0 HB2 LYS A 75 39.999 47.094 -23.010 1.00 0.00 H new ATOM 0 HB3 LYS A 75 39.885 48.546 -23.983 1.00 0.00 H new ATOM 0 HG2 LYS A 75 40.417 49.036 -21.624 1.00 0.00 H new ATOM 0 HG3 LYS A 75 38.930 49.801 -22.149 1.00 0.00 H new ATOM 0 HD2 LYS A 75 38.607 49.016 -19.913 1.00 0.00 H new ATOM 0 HD3 LYS A 75 37.622 48.033 -20.977 1.00 0.00 H new ATOM 0 HE2 LYS A 75 40.346 47.094 -20.032 1.00 0.00 H new ATOM 0 HE3 LYS A 75 38.910 46.873 -19.052 1.00 0.00 H new ATOM 0 HZ1 LYS A 75 39.091 44.906 -20.197 1.00 0.00 H new ATOM 0 HZ2 LYS A 75 37.958 45.751 -21.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 75 39.575 45.646 -21.647 1.00 0.00 H new ATOM 1217 N LEU A 76 37.124 49.305 -25.195 1.00 0.00 N ATOM 1218 CA LEU A 76 36.126 50.288 -25.659 1.00 0.00 C ATOM 1219 C LEU A 76 34.683 49.757 -25.534 1.00 0.00 C ATOM 1220 O LEU A 76 33.803 50.480 -25.057 1.00 0.00 O ATOM 1221 CB LEU A 76 36.439 50.702 -27.110 1.00 0.00 C ATOM 1222 CG LEU A 76 37.381 51.908 -27.227 1.00 0.00 C ATOM 1223 CD1 LEU A 76 38.109 51.882 -28.570 1.00 0.00 C ATOM 1224 CD2 LEU A 76 36.587 53.209 -27.119 1.00 0.00 C ATOM 0 H LEU A 76 37.846 49.096 -25.885 1.00 0.00 H new ATOM 0 HA LEU A 76 36.192 51.164 -25.014 1.00 0.00 H new ATOM 0 HB2 LEU A 76 36.885 49.854 -27.630 1.00 0.00 H new ATOM 0 HB3 LEU A 76 35.504 50.934 -27.620 1.00 0.00 H new ATOM 0 HG LEU A 76 38.108 51.854 -26.417 1.00 0.00 H new ATOM 0 HD11 LEU A 76 38.774 52.743 -28.640 1.00 0.00 H new ATOM 0 HD12 LEU A 76 38.693 50.965 -28.650 1.00 0.00 H new ATOM 0 HD13 LEU A 76 37.380 51.920 -29.380 1.00 0.00 H new ATOM 0 HD21 LEU A 76 37.266 54.058 -27.203 1.00 0.00 H new ATOM 0 HD22 LEU A 76 35.850 53.253 -27.921 1.00 0.00 H new ATOM 0 HD23 LEU A 76 36.078 53.246 -26.156 1.00 0.00 H new ATOM 1236 N LYS A 77 34.453 48.482 -25.887 1.00 0.00 N ATOM 1237 CA LYS A 77 33.160 47.804 -25.689 1.00 0.00 C ATOM 1238 C LYS A 77 32.822 47.529 -24.215 1.00 0.00 C ATOM 1239 O LYS A 77 31.677 47.751 -23.826 1.00 0.00 O ATOM 1240 CB LYS A 77 33.067 46.521 -26.548 1.00 0.00 C ATOM 1241 CG LYS A 77 32.044 46.665 -27.690 1.00 0.00 C ATOM 1242 CD LYS A 77 30.591 46.853 -27.200 1.00 0.00 C ATOM 1243 CE LYS A 77 29.888 48.041 -27.874 1.00 0.00 C ATOM 1244 NZ LYS A 77 29.462 47.730 -29.264 1.00 0.00 N ATOM 0 H LYS A 77 35.161 47.889 -26.320 1.00 0.00 H new ATOM 0 HA LYS A 77 32.398 48.503 -26.032 1.00 0.00 H new ATOM 0 HB2 LYS A 77 34.047 46.293 -26.966 1.00 0.00 H new ATOM 0 HB3 LYS A 77 32.787 45.680 -25.914 1.00 0.00 H new ATOM 0 HG2 LYS A 77 32.322 47.517 -28.310 1.00 0.00 H new ATOM 0 HG3 LYS A 77 32.093 45.780 -28.324 1.00 0.00 H new ATOM 0 HD2 LYS A 77 30.025 45.942 -27.396 1.00 0.00 H new ATOM 0 HD3 LYS A 77 30.592 47.002 -26.120 1.00 0.00 H new ATOM 0 HE2 LYS A 77 29.017 48.327 -27.285 1.00 0.00 H new ATOM 0 HE3 LYS A 77 30.560 48.899 -27.886 1.00 0.00 H new ATOM 0 HZ1 LYS A 77 30.013 48.305 -29.933 1.00 0.00 H new ATOM 0 HZ2 LYS A 77 29.624 46.721 -29.459 1.00 0.00 H new ATOM 0 HZ3 LYS A 77 28.451 47.946 -29.374 1.00 0.00 H new ATOM 1258 N ASP A 78 33.781 47.136 -23.370 1.00 0.00 N ATOM 1259 CA ASP A 78 33.561 47.016 -21.911 1.00 0.00 C ATOM 1260 C ASP A 78 33.132 48.354 -21.272 1.00 0.00 C ATOM 1261 O ASP A 78 32.286 48.373 -20.376 1.00 0.00 O ATOM 1262 CB ASP A 78 34.822 46.512 -21.181 1.00 0.00 C ATOM 1263 CG ASP A 78 35.120 45.008 -21.271 1.00 0.00 C ATOM 1264 OD1 ASP A 78 34.193 44.192 -21.512 1.00 0.00 O ATOM 1265 OD2 ASP A 78 36.297 44.647 -21.031 1.00 0.00 O ATOM 0 H ASP A 78 34.726 46.892 -23.667 1.00 0.00 H new ATOM 0 HA ASP A 78 32.756 46.290 -21.796 1.00 0.00 H new ATOM 0 HB2 ASP A 78 35.682 47.053 -21.576 1.00 0.00 H new ATOM 0 HB3 ASP A 78 34.734 46.778 -20.128 1.00 0.00 H new ATOM 1270 N ASN A 79 33.667 49.478 -21.760 1.00 0.00 N ATOM 1271 CA ASN A 79 33.285 50.837 -21.359 1.00 0.00 C ATOM 1272 C ASN A 79 32.013 51.367 -22.075 1.00 0.00 C ATOM 1273 O ASN A 79 31.613 52.507 -21.824 1.00 0.00 O ATOM 1274 CB ASN A 79 34.501 51.768 -21.570 1.00 0.00 C ATOM 1275 CG ASN A 79 35.565 51.629 -20.488 1.00 0.00 C ATOM 1276 OD1 ASN A 79 36.095 50.563 -20.211 1.00 0.00 O ATOM 1277 ND2 ASN A 79 35.909 52.706 -19.818 1.00 0.00 N ATOM 0 H ASN A 79 34.401 49.467 -22.468 1.00 0.00 H new ATOM 0 HA ASN A 79 33.009 50.816 -20.305 1.00 0.00 H new ATOM 0 HB2 ASN A 79 34.950 51.553 -22.540 1.00 0.00 H new ATOM 0 HB3 ASN A 79 34.157 52.802 -21.600 1.00 0.00 H new ATOM 0 HD21 ASN A 79 36.609 52.645 -19.079 1.00 0.00 H new ATOM 0 HD22 ASN A 79 35.476 53.603 -20.037 1.00 0.00 H new ATOM 1284 N LYS A 80 31.373 50.571 -22.954 1.00 0.00 N ATOM 1285 CA LYS A 80 30.244 50.940 -23.842 1.00 0.00 C ATOM 1286 C LYS A 80 30.366 52.352 -24.452 1.00 0.00 C ATOM 1287 O LYS A 80 29.454 53.176 -24.347 1.00 0.00 O ATOM 1288 CB LYS A 80 28.879 50.717 -23.151 1.00 0.00 C ATOM 1289 CG LYS A 80 28.484 49.255 -22.873 1.00 0.00 C ATOM 1290 CD LYS A 80 28.817 48.779 -21.452 1.00 0.00 C ATOM 1291 CE LYS A 80 28.030 47.499 -21.134 1.00 0.00 C ATOM 1292 NZ LYS A 80 27.983 47.222 -19.674 1.00 0.00 N ATOM 0 H LYS A 80 31.643 49.595 -23.073 1.00 0.00 H new ATOM 0 HA LYS A 80 30.299 50.259 -24.691 1.00 0.00 H new ATOM 0 HB2 LYS A 80 28.883 51.256 -22.204 1.00 0.00 H new ATOM 0 HB3 LYS A 80 28.104 51.168 -23.771 1.00 0.00 H new ATOM 0 HG2 LYS A 80 27.413 49.140 -23.042 1.00 0.00 H new ATOM 0 HG3 LYS A 80 28.991 48.609 -23.590 1.00 0.00 H new ATOM 0 HD2 LYS A 80 29.887 48.590 -21.363 1.00 0.00 H new ATOM 0 HD3 LYS A 80 28.570 49.558 -20.730 1.00 0.00 H new ATOM 0 HE2 LYS A 80 27.014 47.593 -21.518 1.00 0.00 H new ATOM 0 HE3 LYS A 80 28.488 46.654 -21.649 1.00 0.00 H new ATOM 0 HZ1 LYS A 80 27.443 46.350 -19.503 1.00 0.00 H new ATOM 0 HZ2 LYS A 80 28.951 47.106 -19.311 1.00 0.00 H new ATOM 0 HZ3 LYS A 80 27.523 48.016 -19.185 1.00 0.00 H new ATOM 1306 N GLN A 81 31.509 52.662 -25.065 1.00 0.00 N ATOM 1307 CA GLN A 81 31.781 53.997 -25.619 1.00 0.00 C ATOM 1308 C GLN A 81 31.069 54.219 -26.968 1.00 0.00 C ATOM 1309 O GLN A 81 31.424 53.625 -27.988 1.00 0.00 O ATOM 1310 CB GLN A 81 33.297 54.242 -25.681 1.00 0.00 C ATOM 1311 CG GLN A 81 33.870 54.219 -24.249 1.00 0.00 C ATOM 1312 CD GLN A 81 35.249 54.853 -24.092 1.00 0.00 C ATOM 1313 OE1 GLN A 81 36.209 54.237 -23.648 1.00 0.00 O ATOM 1314 NE2 GLN A 81 35.385 56.122 -24.400 1.00 0.00 N ATOM 0 H GLN A 81 32.273 51.999 -25.193 1.00 0.00 H new ATOM 0 HA GLN A 81 31.359 54.747 -24.950 1.00 0.00 H new ATOM 0 HB2 GLN A 81 33.777 53.477 -26.291 1.00 0.00 H new ATOM 0 HB3 GLN A 81 33.504 55.202 -26.154 1.00 0.00 H new ATOM 0 HG2 GLN A 81 33.173 54.734 -23.588 1.00 0.00 H new ATOM 0 HG3 GLN A 81 33.923 53.184 -23.912 1.00 0.00 H new ATOM 0 HE21 GLN A 81 34.591 56.645 -24.771 1.00 0.00 H new ATOM 0 HE22 GLN A 81 36.284 56.585 -24.269 1.00 0.00 H new ATOM 1323 N MET A 82 30.035 55.070 -26.966 1.00 0.00 N ATOM 1324 CA MET A 82 29.146 55.328 -28.115 1.00 0.00 C ATOM 1325 C MET A 82 29.751 56.222 -29.214 1.00 0.00 C ATOM 1326 O MET A 82 29.140 56.382 -30.272 1.00 0.00 O ATOM 1327 CB MET A 82 27.822 55.942 -27.620 1.00 0.00 C ATOM 1328 CG MET A 82 27.004 55.027 -26.699 1.00 0.00 C ATOM 1329 SD MET A 82 26.347 53.518 -27.474 1.00 0.00 S ATOM 1330 CE MET A 82 27.582 52.296 -26.950 1.00 0.00 C ATOM 0 H MET A 82 29.783 55.616 -26.142 1.00 0.00 H new ATOM 0 HA MET A 82 28.982 54.357 -28.582 1.00 0.00 H new ATOM 0 HB2 MET A 82 28.041 56.869 -27.090 1.00 0.00 H new ATOM 0 HB3 MET A 82 27.212 56.206 -28.484 1.00 0.00 H new ATOM 0 HG2 MET A 82 27.630 54.738 -25.855 1.00 0.00 H new ATOM 0 HG3 MET A 82 26.169 55.600 -26.295 1.00 0.00 H new ATOM 0 HE1 MET A 82 27.585 51.459 -27.648 1.00 0.00 H new ATOM 0 HE2 MET A 82 28.569 52.759 -26.935 1.00 0.00 H new ATOM 0 HE3 MET A 82 27.335 51.934 -25.952 1.00 0.00 H new ATOM 1340 N GLY A 83 30.943 56.794 -29.014 1.00 0.00 N ATOM 1341 CA GLY A 83 31.609 57.626 -30.028 1.00 0.00 C ATOM 1342 C GLY A 83 32.062 56.855 -31.276 1.00 0.00 C ATOM 1343 O GLY A 83 32.210 57.454 -32.342 1.00 0.00 O ATOM 0 H GLY A 83 31.474 56.695 -28.149 1.00 0.00 H new ATOM 0 HA2 GLY A 83 30.929 58.421 -30.333 1.00 0.00 H new ATOM 0 HA3 GLY A 83 32.477 58.105 -29.576 1.00 0.00 H new ATOM 1347 N LEU A 84 32.247 55.532 -31.162 1.00 0.00 N ATOM 1348 CA LEU A 84 32.851 54.663 -32.185 1.00 0.00 C ATOM 1349 C LEU A 84 31.899 53.537 -32.649 1.00 0.00 C ATOM 1350 O LEU A 84 32.347 52.442 -32.987 1.00 0.00 O ATOM 1351 CB LEU A 84 34.198 54.106 -31.677 1.00 0.00 C ATOM 1352 CG LEU A 84 35.204 55.112 -31.090 1.00 0.00 C ATOM 1353 CD1 LEU A 84 36.497 54.393 -30.719 1.00 0.00 C ATOM 1354 CD2 LEU A 84 35.591 56.233 -32.051 1.00 0.00 C ATOM 0 H LEU A 84 31.971 55.018 -30.325 1.00 0.00 H new ATOM 0 HA LEU A 84 33.039 55.272 -33.069 1.00 0.00 H new ATOM 0 HB2 LEU A 84 33.986 53.357 -30.914 1.00 0.00 H new ATOM 0 HB3 LEU A 84 34.683 53.589 -32.505 1.00 0.00 H new ATOM 0 HG LEU A 84 34.701 55.551 -30.228 1.00 0.00 H new ATOM 0 HD11 LEU A 84 37.206 55.110 -30.304 1.00 0.00 H new ATOM 0 HD12 LEU A 84 36.285 53.622 -29.978 1.00 0.00 H new ATOM 0 HD13 LEU A 84 36.926 53.933 -31.609 1.00 0.00 H new ATOM 0 HD21 LEU A 84 36.302 56.900 -31.564 1.00 0.00 H new ATOM 0 HD22 LEU A 84 36.047 55.805 -32.944 1.00 0.00 H new ATOM 0 HD23 LEU A 84 34.700 56.795 -32.332 1.00 0.00 H new ATOM 1366 N GLN A 85 30.586 53.811 -32.674 1.00 0.00 N ATOM 1367 CA GLN A 85 29.499 52.910 -33.116 1.00 0.00 C ATOM 1368 C GLN A 85 29.820 51.926 -34.272 1.00 0.00 C ATOM 1369 O GLN A 85 29.451 50.755 -34.139 1.00 0.00 O ATOM 1370 CB GLN A 85 28.253 53.753 -33.449 1.00 0.00 C ATOM 1371 CG GLN A 85 27.421 54.081 -32.199 1.00 0.00 C ATOM 1372 CD GLN A 85 26.480 55.261 -32.442 1.00 0.00 C ATOM 1373 OE1 GLN A 85 25.464 55.159 -33.118 1.00 0.00 O ATOM 1374 NE2 GLN A 85 26.787 56.427 -31.914 1.00 0.00 N ATOM 0 H GLN A 85 30.229 54.717 -32.370 1.00 0.00 H new ATOM 0 HA GLN A 85 29.329 52.244 -32.270 1.00 0.00 H new ATOM 0 HB2 GLN A 85 28.562 54.681 -33.931 1.00 0.00 H new ATOM 0 HB3 GLN A 85 27.633 53.214 -34.165 1.00 0.00 H new ATOM 0 HG2 GLN A 85 26.840 53.206 -31.908 1.00 0.00 H new ATOM 0 HG3 GLN A 85 28.088 54.312 -31.368 1.00 0.00 H new ATOM 0 HE21 GLN A 85 27.631 56.525 -31.349 1.00 0.00 H new ATOM 0 HE22 GLN A 85 26.181 57.233 -32.070 1.00 0.00 H new ATOM 1383 N PRO A 86 30.508 52.311 -35.371 1.00 0.00 N ATOM 1384 CA PRO A 86 31.032 51.373 -36.376 1.00 0.00 C ATOM 1385 C PRO A 86 32.247 50.551 -35.868 1.00 0.00 C ATOM 1386 O PRO A 86 33.360 50.656 -36.394 1.00 0.00 O ATOM 1387 CB PRO A 86 31.322 52.237 -37.612 1.00 0.00 C ATOM 1388 CG PRO A 86 31.672 53.595 -37.014 1.00 0.00 C ATOM 1389 CD PRO A 86 30.730 53.685 -35.818 1.00 0.00 C ATOM 0 HA PRO A 86 30.313 50.590 -36.616 1.00 0.00 H new ATOM 0 HB2 PRO A 86 32.145 51.833 -38.202 1.00 0.00 H new ATOM 0 HB3 PRO A 86 30.457 52.299 -38.272 1.00 0.00 H new ATOM 0 HG2 PRO A 86 32.718 53.647 -36.711 1.00 0.00 H new ATOM 0 HG3 PRO A 86 31.505 54.405 -37.723 1.00 0.00 H new ATOM 0 HD2 PRO A 86 31.168 54.288 -35.022 1.00 0.00 H new ATOM 0 HD3 PRO A 86 29.790 54.160 -36.098 1.00 0.00 H new ATOM 1397 N TYR A 87 32.040 49.739 -34.825 1.00 0.00 N ATOM 1398 CA TYR A 87 33.024 48.797 -34.264 1.00 0.00 C ATOM 1399 C TYR A 87 33.519 47.751 -35.299 1.00 0.00 C ATOM 1400 O TYR A 87 32.752 47.363 -36.190 1.00 0.00 O ATOM 1401 CB TYR A 87 32.423 48.093 -33.032 1.00 0.00 C ATOM 1402 CG TYR A 87 32.518 48.887 -31.739 1.00 0.00 C ATOM 1403 CD1 TYR A 87 31.509 49.804 -31.380 1.00 0.00 C ATOM 1404 CD2 TYR A 87 33.625 48.702 -30.887 1.00 0.00 C ATOM 1405 CE1 TYR A 87 31.623 50.560 -30.194 1.00 0.00 C ATOM 1406 CE2 TYR A 87 33.735 49.441 -29.694 1.00 0.00 C ATOM 1407 CZ TYR A 87 32.742 50.383 -29.351 1.00 0.00 C ATOM 1408 OH TYR A 87 32.863 51.109 -28.208 1.00 0.00 O ATOM 0 H TYR A 87 31.150 49.717 -34.327 1.00 0.00 H new ATOM 0 HA TYR A 87 33.898 49.378 -33.971 1.00 0.00 H new ATOM 0 HB2 TYR A 87 31.374 47.873 -33.231 1.00 0.00 H new ATOM 0 HB3 TYR A 87 32.928 47.137 -32.894 1.00 0.00 H new ATOM 0 HD1 TYR A 87 30.645 49.928 -32.016 1.00 0.00 H new ATOM 0 HD2 TYR A 87 34.393 47.990 -31.151 1.00 0.00 H new ATOM 0 HE1 TYR A 87 30.856 51.273 -29.931 1.00 0.00 H new ATOM 0 HE2 TYR A 87 34.581 49.287 -29.040 1.00 0.00 H new ATOM 0 HH TYR A 87 32.326 51.925 -28.281 1.00 0.00 H new ATOM 1418 N PRO A 88 34.774 47.265 -35.189 1.00 0.00 N ATOM 1419 CA PRO A 88 35.376 46.288 -36.097 1.00 0.00 C ATOM 1420 C PRO A 88 35.099 44.832 -35.666 1.00 0.00 C ATOM 1421 O PRO A 88 34.479 44.561 -34.635 1.00 0.00 O ATOM 1422 CB PRO A 88 36.871 46.612 -36.041 1.00 0.00 C ATOM 1423 CG PRO A 88 37.076 46.983 -34.576 1.00 0.00 C ATOM 1424 CD PRO A 88 35.741 47.603 -34.156 1.00 0.00 C ATOM 0 HA PRO A 88 34.962 46.357 -37.103 1.00 0.00 H new ATOM 0 HB2 PRO A 88 37.482 45.758 -36.332 1.00 0.00 H new ATOM 0 HB3 PRO A 88 37.133 47.433 -36.708 1.00 0.00 H new ATOM 0 HG2 PRO A 88 37.316 46.107 -33.973 1.00 0.00 H new ATOM 0 HG3 PRO A 88 37.898 47.688 -34.455 1.00 0.00 H new ATOM 0 HD2 PRO A 88 35.423 47.216 -33.188 1.00 0.00 H new ATOM 0 HD3 PRO A 88 35.833 48.684 -34.052 1.00 0.00 H new ATOM 1432 N GLU A 89 35.605 43.871 -36.442 1.00 0.00 N ATOM 1433 CA GLU A 89 35.339 42.433 -36.291 1.00 0.00 C ATOM 1434 C GLU A 89 36.439 41.710 -35.481 1.00 0.00 C ATOM 1435 O GLU A 89 37.196 40.888 -35.999 1.00 0.00 O ATOM 1436 CB GLU A 89 35.095 41.795 -37.671 1.00 0.00 C ATOM 1437 CG GLU A 89 33.927 42.415 -38.451 1.00 0.00 C ATOM 1438 CD GLU A 89 34.382 43.486 -39.459 1.00 0.00 C ATOM 1439 OE1 GLU A 89 34.792 43.106 -40.585 1.00 0.00 O ATOM 1440 OE2 GLU A 89 34.325 44.698 -39.142 1.00 0.00 O ATOM 0 H GLU A 89 36.232 44.076 -37.220 1.00 0.00 H new ATOM 0 HA GLU A 89 34.429 42.314 -35.703 1.00 0.00 H new ATOM 0 HB2 GLU A 89 36.004 41.885 -38.266 1.00 0.00 H new ATOM 0 HB3 GLU A 89 34.905 40.730 -37.538 1.00 0.00 H new ATOM 0 HG2 GLU A 89 33.392 41.627 -38.982 1.00 0.00 H new ATOM 0 HG3 GLU A 89 33.223 42.860 -37.748 1.00 0.00 H new ATOM 1447 N ILE A 90 36.534 42.036 -34.188 1.00 0.00 N ATOM 1448 CA ILE A 90 37.578 41.574 -33.247 1.00 0.00 C ATOM 1449 C ILE A 90 37.078 40.535 -32.216 1.00 0.00 C ATOM 1450 O ILE A 90 37.585 40.458 -31.097 1.00 0.00 O ATOM 1451 CB ILE A 90 38.246 42.792 -32.567 1.00 0.00 C ATOM 1452 CG1 ILE A 90 37.237 43.656 -31.768 1.00 0.00 C ATOM 1453 CG2 ILE A 90 39.007 43.632 -33.605 1.00 0.00 C ATOM 1454 CD1 ILE A 90 37.681 43.880 -30.321 1.00 0.00 C ATOM 0 H ILE A 90 35.859 42.657 -33.742 1.00 0.00 H new ATOM 0 HA ILE A 90 38.324 41.039 -33.835 1.00 0.00 H new ATOM 0 HB ILE A 90 38.960 42.408 -31.839 1.00 0.00 H new ATOM 0 HG12 ILE A 90 37.117 44.620 -32.262 1.00 0.00 H new ATOM 0 HG13 ILE A 90 36.261 43.170 -31.775 1.00 0.00 H new ATOM 0 HG21 ILE A 90 39.472 44.486 -33.112 1.00 0.00 H new ATOM 0 HG22 ILE A 90 39.777 43.020 -34.074 1.00 0.00 H new ATOM 0 HG23 ILE A 90 38.312 43.987 -34.366 1.00 0.00 H new ATOM 0 HD11 ILE A 90 36.941 44.491 -29.804 1.00 0.00 H new ATOM 0 HD12 ILE A 90 37.775 42.918 -29.816 1.00 0.00 H new ATOM 0 HD13 ILE A 90 38.644 44.391 -30.311 1.00 0.00 H new