USER MOD reduce.3.24.130724 H: found=0, std=0, add=696, rem=0, adj=20 USER MOD reduce.3.24.130724 removed 694 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 50 MET CE :methyl 156:sc= -0.0273 (180deg=-0.363) USER MOD Set 1.2: A 53 THR OG1 : rot -23:sc= 0.371 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 5 SER OG : rot 180:sc= 0 USER MOD Single : A 9 SER OG : rot 21:sc= 0.612 USER MOD Single : A 26 THR OG1 : rot 180:sc= 0 USER MOD Single : A 32 SER OG : rot -20:sc= -0.119 USER MOD Single : A 34 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 37 THR OG1 : rot 180:sc= 0 USER MOD Single : A 38 SER OG : rot 180:sc= 0 USER MOD Single : A 44 SER OG : rot 180:sc= 0 USER MOD Single : A 45 SER OG : rot 180:sc= 0 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 51 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 52 SER OG : rot 180:sc= 0 USER MOD Single : A 58 ASN : amide:sc= -0.0994 K(o=-0.099,f=-1.5!) USER MOD Single : A 66 SER OG : rot 180:sc= 0 USER MOD Single : A 72 GLN : amide:sc= 0 K(o=0,f=-0.8) USER MOD Single : A 73 SER OG : rot 180:sc= 0 USER MOD Single : A 80 SER OG : rot 88:sc= 0.666 USER MOD Single : A 82 THR OG1 : rot 62:sc= 0.929 USER MOD Single : A 83 SER OG : rot -67:sc= 0.746 USER MOD Single : A 84 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 92 THR OG1 : rot 69:sc= 0.57 USER MOD Single : A 100 SER OG : rot 180:sc= 0 USER MOD Single : A 103 SER OG : rot 180:sc= 0 USER MOD Single : A 104 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -6.144 -11.637 -6.324 1.00 0.00 N ATOM 2 CA MET A 1 -5.950 -12.895 -7.026 1.00 0.00 C ATOM 3 C MET A 1 -7.273 -13.647 -7.180 1.00 0.00 C ATOM 4 O MET A 1 -7.769 -14.240 -6.224 1.00 0.00 O ATOM 5 CB MET A 1 -4.956 -13.763 -6.252 1.00 0.00 C ATOM 6 CG MET A 1 -3.947 -14.417 -7.198 1.00 0.00 C ATOM 7 SD MET A 1 -2.375 -13.579 -7.087 1.00 0.00 S ATOM 8 CE MET A 1 -1.399 -14.853 -6.304 1.00 0.00 C ATOM 0 H1 MET A 1 -5.232 -11.146 -6.233 1.00 0.00 H new ATOM 0 H2 MET A 1 -6.806 -11.040 -6.859 1.00 0.00 H new ATOM 0 H3 MET A 1 -6.533 -11.824 -5.378 1.00 0.00 H new ATOM 0 HA MET A 1 -5.560 -12.678 -8.020 1.00 0.00 H new ATOM 0 HB2 MET A 1 -4.429 -13.153 -5.518 1.00 0.00 H new ATOM 0 HB3 MET A 1 -5.494 -14.533 -5.699 1.00 0.00 H new ATOM 0 HG2 MET A 1 -3.826 -15.470 -6.943 1.00 0.00 H new ATOM 0 HG3 MET A 1 -4.318 -14.378 -8.222 1.00 0.00 H new ATOM 0 HE1 MET A 1 -0.380 -14.493 -6.159 1.00 0.00 H new ATOM 0 HE2 MET A 1 -1.836 -15.104 -5.338 1.00 0.00 H new ATOM 0 HE3 MET A 1 -1.384 -15.740 -6.937 1.00 0.00 H new ATOM 18 N GLY A 2 -7.808 -13.597 -8.392 1.00 0.00 N ATOM 19 CA GLY A 2 -9.064 -14.266 -8.683 1.00 0.00 C ATOM 20 C GLY A 2 -9.732 -13.662 -9.920 1.00 0.00 C ATOM 21 O GLY A 2 -9.468 -14.087 -11.043 1.00 0.00 O ATOM 0 H GLY A 2 -7.394 -13.104 -9.183 1.00 0.00 H new ATOM 0 HA2 GLY A 2 -8.885 -15.329 -8.844 1.00 0.00 H new ATOM 0 HA3 GLY A 2 -9.732 -14.181 -7.826 1.00 0.00 H new ATOM 25 N LYS A 3 -10.586 -12.680 -9.672 1.00 0.00 N ATOM 26 CA LYS A 3 -11.295 -12.013 -10.751 1.00 0.00 C ATOM 27 C LYS A 3 -10.426 -10.880 -11.302 1.00 0.00 C ATOM 28 O LYS A 3 -9.998 -10.926 -12.454 1.00 0.00 O ATOM 29 CB LYS A 3 -12.677 -11.555 -10.282 1.00 0.00 C ATOM 30 CG LYS A 3 -13.739 -12.613 -10.591 1.00 0.00 C ATOM 31 CD LYS A 3 -14.895 -12.012 -11.392 1.00 0.00 C ATOM 32 CE LYS A 3 -16.243 -12.513 -10.869 1.00 0.00 C ATOM 33 NZ LYS A 3 -16.885 -13.404 -11.861 1.00 0.00 N ATOM 0 H LYS A 3 -10.803 -12.330 -8.739 1.00 0.00 H new ATOM 0 HA LYS A 3 -11.476 -12.706 -11.573 1.00 0.00 H new ATOM 0 HB2 LYS A 3 -12.655 -11.359 -9.210 1.00 0.00 H new ATOM 0 HB3 LYS A 3 -12.939 -10.617 -10.772 1.00 0.00 H new ATOM 0 HG2 LYS A 3 -13.289 -13.431 -11.153 1.00 0.00 H new ATOM 0 HG3 LYS A 3 -14.118 -13.036 -9.660 1.00 0.00 H new ATOM 0 HD2 LYS A 3 -14.858 -10.924 -11.330 1.00 0.00 H new ATOM 0 HD3 LYS A 3 -14.789 -12.275 -12.444 1.00 0.00 H new ATOM 0 HE2 LYS A 3 -16.099 -13.048 -9.930 1.00 0.00 H new ATOM 0 HE3 LYS A 3 -16.895 -11.666 -10.657 1.00 0.00 H new ATOM 0 HZ1 LYS A 3 -17.799 -13.735 -11.490 1.00 0.00 H new ATOM 0 HZ2 LYS A 3 -17.039 -12.882 -12.747 1.00 0.00 H new ATOM 0 HZ3 LYS A 3 -16.269 -14.222 -12.043 1.00 0.00 H new ATOM 47 N GLU A 4 -10.192 -9.890 -10.453 1.00 0.00 N ATOM 48 CA GLU A 4 -9.383 -8.747 -10.840 1.00 0.00 C ATOM 49 C GLU A 4 -8.560 -8.251 -9.649 1.00 0.00 C ATOM 50 O GLU A 4 -7.333 -8.206 -9.713 1.00 0.00 O ATOM 51 CB GLU A 4 -10.254 -7.626 -11.410 1.00 0.00 C ATOM 52 CG GLU A 4 -10.681 -7.940 -12.846 1.00 0.00 C ATOM 53 CD GLU A 4 -10.779 -6.661 -13.680 1.00 0.00 C ATOM 54 OE1 GLU A 4 -9.649 -6.181 -14.077 1.00 0.00 O ATOM 55 OE2 GLU A 4 -11.888 -6.165 -13.926 1.00 0.00 O ATOM 0 H GLU A 4 -10.549 -9.856 -9.498 1.00 0.00 H new ATOM 0 HA GLU A 4 -8.696 -9.063 -11.625 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -11.137 -7.493 -10.785 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -9.703 -6.686 -11.388 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -9.963 -8.622 -13.302 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -11.645 -8.449 -12.840 1.00 0.00 H new ATOM 62 N SER A 5 -9.270 -7.891 -8.590 1.00 0.00 N ATOM 63 CA SER A 5 -8.621 -7.400 -7.386 1.00 0.00 C ATOM 64 C SER A 5 -8.840 -8.384 -6.235 1.00 0.00 C ATOM 65 O SER A 5 -7.880 -8.882 -5.650 1.00 0.00 O ATOM 66 CB SER A 5 -9.144 -6.013 -7.006 1.00 0.00 C ATOM 67 OG SER A 5 -8.859 -5.041 -8.008 1.00 0.00 O ATOM 0 H SER A 5 -10.288 -7.929 -8.541 1.00 0.00 H new ATOM 0 HA SER A 5 -7.552 -7.314 -7.583 1.00 0.00 H new ATOM 0 HB2 SER A 5 -10.221 -6.063 -6.846 1.00 0.00 H new ATOM 0 HB3 SER A 5 -8.696 -5.703 -6.062 1.00 0.00 H new ATOM 0 HG SER A 5 -9.211 -4.170 -7.728 1.00 0.00 H new ATOM 73 N GLY A 6 -10.108 -8.634 -5.945 1.00 0.00 N ATOM 74 CA GLY A 6 -10.465 -9.549 -4.875 1.00 0.00 C ATOM 75 C GLY A 6 -11.577 -8.965 -4.001 1.00 0.00 C ATOM 76 O GLY A 6 -11.310 -8.177 -3.095 1.00 0.00 O ATOM 0 H GLY A 6 -10.901 -8.218 -6.433 1.00 0.00 H new ATOM 0 HA2 GLY A 6 -10.791 -10.499 -5.298 1.00 0.00 H new ATOM 0 HA3 GLY A 6 -9.588 -9.757 -4.262 1.00 0.00 H new ATOM 80 N TRP A 7 -12.800 -9.373 -4.305 1.00 0.00 N ATOM 81 CA TRP A 7 -13.954 -8.900 -3.559 1.00 0.00 C ATOM 82 C TRP A 7 -14.329 -9.974 -2.537 1.00 0.00 C ATOM 83 O TRP A 7 -15.365 -10.625 -2.667 1.00 0.00 O ATOM 84 CB TRP A 7 -15.106 -8.542 -4.500 1.00 0.00 C ATOM 85 CG TRP A 7 -15.587 -7.095 -4.373 1.00 0.00 C ATOM 86 CD1 TRP A 7 -14.869 -5.972 -4.508 1.00 0.00 C ATOM 87 CD2 TRP A 7 -16.931 -6.659 -4.076 1.00 0.00 C ATOM 88 NE1 TRP A 7 -15.649 -4.848 -4.322 1.00 0.00 N ATOM 89 CE2 TRP A 7 -16.942 -5.279 -4.051 1.00 0.00 C ATOM 90 CE3 TRP A 7 -18.098 -7.406 -3.838 1.00 0.00 C ATOM 91 CZ2 TRP A 7 -18.093 -4.527 -3.790 1.00 0.00 C ATOM 92 CZ3 TRP A 7 -19.240 -6.639 -3.579 1.00 0.00 C ATOM 93 CH2 TRP A 7 -19.268 -5.249 -3.550 1.00 0.00 C ATOM 0 H TRP A 7 -13.017 -10.026 -5.058 1.00 0.00 H new ATOM 0 HA TRP A 7 -13.717 -7.979 -3.025 1.00 0.00 H new ATOM 0 HB2 TRP A 7 -14.791 -8.720 -5.528 1.00 0.00 H new ATOM 0 HB3 TRP A 7 -15.944 -9.211 -4.303 1.00 0.00 H new ATOM 0 HD1 TRP A 7 -13.813 -5.949 -4.734 1.00 0.00 H new ATOM 0 HE1 TRP A 7 -15.334 -3.879 -4.374 1.00 0.00 H new ATOM 0 HE3 TRP A 7 -18.112 -8.486 -3.854 1.00 0.00 H new ATOM 0 HZ2 TRP A 7 -18.076 -3.447 -3.775 1.00 0.00 H new ATOM 0 HZ3 TRP A 7 -20.164 -7.164 -3.388 1.00 0.00 H new ATOM 0 HH2 TRP A 7 -20.192 -4.729 -3.343 1.00 0.00 H new ATOM 104 N ASP A 8 -13.467 -10.127 -1.543 1.00 0.00 N ATOM 105 CA ASP A 8 -13.694 -11.112 -0.499 1.00 0.00 C ATOM 106 C ASP A 8 -12.498 -11.124 0.454 1.00 0.00 C ATOM 107 O ASP A 8 -11.356 -11.271 0.021 1.00 0.00 O ATOM 108 CB ASP A 8 -13.844 -12.515 -1.089 1.00 0.00 C ATOM 109 CG ASP A 8 -15.246 -13.116 -0.981 1.00 0.00 C ATOM 110 OD1 ASP A 8 -16.175 -12.482 -0.458 1.00 0.00 O ATOM 111 OD2 ASP A 8 -15.369 -14.305 -1.467 1.00 0.00 O ATOM 0 H ASP A 8 -12.609 -9.585 -1.438 1.00 0.00 H new ATOM 0 HA ASP A 8 -14.610 -10.842 0.026 1.00 0.00 H new ATOM 0 HB2 ASP A 8 -13.559 -12.483 -2.141 1.00 0.00 H new ATOM 0 HB3 ASP A 8 -13.140 -13.180 -0.588 1.00 0.00 H new ATOM 116 N SER A 9 -12.800 -10.968 1.735 1.00 0.00 N ATOM 117 CA SER A 9 -11.764 -10.959 2.753 1.00 0.00 C ATOM 118 C SER A 9 -12.359 -11.343 4.109 1.00 0.00 C ATOM 119 O SER A 9 -13.082 -10.556 4.719 1.00 0.00 O ATOM 120 CB SER A 9 -11.087 -9.590 2.838 1.00 0.00 C ATOM 121 OG SER A 9 -10.100 -9.418 1.825 1.00 0.00 O ATOM 0 H SER A 9 -13.748 -10.847 2.091 1.00 0.00 H new ATOM 0 HA SER A 9 -11.006 -11.692 2.476 1.00 0.00 H new ATOM 0 HB2 SER A 9 -11.840 -8.807 2.747 1.00 0.00 H new ATOM 0 HB3 SER A 9 -10.624 -9.475 3.818 1.00 0.00 H new ATOM 0 HG SER A 9 -10.274 -10.042 1.089 1.00 0.00 H new ATOM 127 N GLY A 10 -12.033 -12.552 4.542 1.00 0.00 N ATOM 128 CA GLY A 10 -12.527 -13.049 5.815 1.00 0.00 C ATOM 129 C GLY A 10 -12.033 -12.179 6.972 1.00 0.00 C ATOM 130 O GLY A 10 -11.584 -11.054 6.760 1.00 0.00 O ATOM 0 H GLY A 10 -11.433 -13.202 4.034 1.00 0.00 H new ATOM 0 HA2 GLY A 10 -13.617 -13.063 5.806 1.00 0.00 H new ATOM 0 HA3 GLY A 10 -12.196 -14.077 5.961 1.00 0.00 H new ATOM 134 N ARG A 11 -12.132 -12.734 8.171 1.00 0.00 N ATOM 135 CA ARG A 11 -11.700 -12.023 9.363 1.00 0.00 C ATOM 136 C ARG A 11 -10.174 -11.925 9.398 1.00 0.00 C ATOM 137 O ARG A 11 -9.619 -10.827 9.425 1.00 0.00 O ATOM 138 CB ARG A 11 -12.189 -12.726 10.631 1.00 0.00 C ATOM 139 CG ARG A 11 -13.345 -11.957 11.273 1.00 0.00 C ATOM 140 CD ARG A 11 -14.124 -12.848 12.243 1.00 0.00 C ATOM 141 NE ARG A 11 -15.173 -12.057 12.925 1.00 0.00 N ATOM 142 CZ ARG A 11 -16.288 -12.589 13.469 1.00 0.00 C ATOM 143 NH1 ARG A 11 -16.509 -13.920 13.415 1.00 0.00 N ATOM 144 NH2 ARG A 11 -17.159 -11.788 14.054 1.00 0.00 N ATOM 0 H ARG A 11 -12.505 -13.668 8.343 1.00 0.00 H new ATOM 0 HA ARG A 11 -12.131 -11.022 9.327 1.00 0.00 H new ATOM 0 HB2 ARG A 11 -12.511 -13.739 10.388 1.00 0.00 H new ATOM 0 HB3 ARG A 11 -11.367 -12.815 11.342 1.00 0.00 H new ATOM 0 HG2 ARG A 11 -12.958 -11.087 11.804 1.00 0.00 H new ATOM 0 HG3 ARG A 11 -14.015 -11.585 10.497 1.00 0.00 H new ATOM 0 HD2 ARG A 11 -14.577 -13.679 11.702 1.00 0.00 H new ATOM 0 HD3 ARG A 11 -13.445 -13.279 12.979 1.00 0.00 H new ATOM 0 HE ARG A 11 -15.045 -11.047 12.988 1.00 0.00 H new ATOM 0 HH11 ARG A 11 -15.831 -14.532 12.961 1.00 0.00 H new ATOM 0 HH12 ARG A 11 -17.354 -14.314 13.829 1.00 0.00 H new ATOM 0 HH21 ARG A 11 -16.984 -10.784 14.090 1.00 0.00 H new ATOM 0 HH22 ARG A 11 -18.007 -12.173 14.470 1.00 0.00 H new ATOM 158 N ALA A 12 -9.537 -13.087 9.398 1.00 0.00 N ATOM 159 CA ALA A 12 -8.086 -13.145 9.430 1.00 0.00 C ATOM 160 C ALA A 12 -7.516 -12.081 8.490 1.00 0.00 C ATOM 161 O ALA A 12 -6.528 -11.425 8.815 1.00 0.00 O ATOM 162 CB ALA A 12 -7.623 -14.557 9.062 1.00 0.00 C ATOM 0 H ALA A 12 -10.000 -13.996 9.376 1.00 0.00 H new ATOM 0 HA ALA A 12 -7.716 -12.931 10.433 1.00 0.00 H new ATOM 0 HB1 ALA A 12 -6.534 -14.601 9.086 1.00 0.00 H new ATOM 0 HB2 ALA A 12 -8.031 -15.272 9.777 1.00 0.00 H new ATOM 0 HB3 ALA A 12 -7.974 -14.806 8.060 1.00 0.00 H new ATOM 168 N ALA A 13 -8.163 -11.944 7.342 1.00 0.00 N ATOM 169 CA ALA A 13 -7.734 -10.971 6.352 1.00 0.00 C ATOM 170 C ALA A 13 -7.363 -9.664 7.056 1.00 0.00 C ATOM 171 O ALA A 13 -6.244 -9.173 6.913 1.00 0.00 O ATOM 172 CB ALA A 13 -8.838 -10.780 5.311 1.00 0.00 C ATOM 0 H ALA A 13 -8.982 -12.491 7.075 1.00 0.00 H new ATOM 0 HA ALA A 13 -6.848 -11.325 5.825 1.00 0.00 H new ATOM 0 HB1 ALA A 13 -8.516 -10.050 4.569 1.00 0.00 H new ATOM 0 HB2 ALA A 13 -9.043 -11.731 4.820 1.00 0.00 H new ATOM 0 HB3 ALA A 13 -9.743 -10.423 5.802 1.00 0.00 H new ATOM 178 N VAL A 14 -8.324 -9.136 7.800 1.00 0.00 N ATOM 179 CA VAL A 14 -8.113 -7.896 8.526 1.00 0.00 C ATOM 180 C VAL A 14 -6.760 -7.951 9.238 1.00 0.00 C ATOM 181 O VAL A 14 -5.974 -7.008 9.159 1.00 0.00 O ATOM 182 CB VAL A 14 -9.282 -7.643 9.481 1.00 0.00 C ATOM 183 CG1 VAL A 14 -8.974 -6.482 10.429 1.00 0.00 C ATOM 184 CG2 VAL A 14 -10.577 -7.390 8.707 1.00 0.00 C ATOM 0 H VAL A 14 -9.251 -9.545 7.915 1.00 0.00 H new ATOM 0 HA VAL A 14 -8.084 -7.051 7.838 1.00 0.00 H new ATOM 0 HB VAL A 14 -9.422 -8.540 10.084 1.00 0.00 H new ATOM 0 HG11 VAL A 14 -9.821 -6.323 11.097 1.00 0.00 H new ATOM 0 HG12 VAL A 14 -8.087 -6.718 11.017 1.00 0.00 H new ATOM 0 HG13 VAL A 14 -8.794 -5.577 9.849 1.00 0.00 H new ATOM 0 HG21 VAL A 14 -11.392 -7.213 9.409 1.00 0.00 H new ATOM 0 HG22 VAL A 14 -10.454 -6.516 8.067 1.00 0.00 H new ATOM 0 HG23 VAL A 14 -10.810 -8.260 8.093 1.00 0.00 H new ATOM 194 N ALA A 15 -6.530 -9.064 9.919 1.00 0.00 N ATOM 195 CA ALA A 15 -5.286 -9.254 10.645 1.00 0.00 C ATOM 196 C ALA A 15 -4.108 -9.038 9.694 1.00 0.00 C ATOM 197 O ALA A 15 -3.144 -8.355 10.038 1.00 0.00 O ATOM 198 CB ALA A 15 -5.274 -10.645 11.282 1.00 0.00 C ATOM 0 H ALA A 15 -7.185 -9.844 9.983 1.00 0.00 H new ATOM 0 HA ALA A 15 -5.197 -8.526 11.451 1.00 0.00 H new ATOM 0 HB1 ALA A 15 -4.341 -10.788 11.827 1.00 0.00 H new ATOM 0 HB2 ALA A 15 -6.114 -10.737 11.971 1.00 0.00 H new ATOM 0 HB3 ALA A 15 -5.359 -11.403 10.503 1.00 0.00 H new ATOM 204 N ALA A 16 -4.223 -9.633 8.515 1.00 0.00 N ATOM 205 CA ALA A 16 -3.179 -9.514 7.512 1.00 0.00 C ATOM 206 C ALA A 16 -3.025 -8.044 7.114 1.00 0.00 C ATOM 207 O ALA A 16 -1.937 -7.609 6.741 1.00 0.00 O ATOM 208 CB ALA A 16 -3.513 -10.410 6.318 1.00 0.00 C ATOM 0 H ALA A 16 -5.023 -10.199 8.233 1.00 0.00 H new ATOM 0 HA ALA A 16 -2.222 -9.849 7.912 1.00 0.00 H new ATOM 0 HB1 ALA A 16 -2.729 -10.321 5.566 1.00 0.00 H new ATOM 0 HB2 ALA A 16 -3.582 -11.446 6.649 1.00 0.00 H new ATOM 0 HB3 ALA A 16 -4.466 -10.102 5.888 1.00 0.00 H new ATOM 214 N VAL A 17 -4.131 -7.321 7.206 1.00 0.00 N ATOM 215 CA VAL A 17 -4.133 -5.910 6.859 1.00 0.00 C ATOM 216 C VAL A 17 -3.581 -5.100 8.034 1.00 0.00 C ATOM 217 O VAL A 17 -3.141 -3.965 7.858 1.00 0.00 O ATOM 218 CB VAL A 17 -5.540 -5.475 6.442 1.00 0.00 C ATOM 219 CG1 VAL A 17 -5.562 -3.998 6.046 1.00 0.00 C ATOM 220 CG2 VAL A 17 -6.072 -6.355 5.309 1.00 0.00 C ATOM 0 H VAL A 17 -5.032 -7.686 7.516 1.00 0.00 H new ATOM 0 HA VAL A 17 -3.484 -5.726 6.003 1.00 0.00 H new ATOM 0 HB VAL A 17 -6.199 -5.601 7.301 1.00 0.00 H new ATOM 0 HG11 VAL A 17 -6.573 -3.715 5.754 1.00 0.00 H new ATOM 0 HG12 VAL A 17 -5.245 -3.389 6.893 1.00 0.00 H new ATOM 0 HG13 VAL A 17 -4.884 -3.836 5.208 1.00 0.00 H new ATOM 0 HG21 VAL A 17 -7.073 -6.025 5.031 1.00 0.00 H new ATOM 0 HG22 VAL A 17 -5.411 -6.276 4.446 1.00 0.00 H new ATOM 0 HG23 VAL A 17 -6.111 -7.392 5.642 1.00 0.00 H new ATOM 230 N VAL A 18 -3.622 -5.715 9.207 1.00 0.00 N ATOM 231 CA VAL A 18 -3.132 -5.066 10.411 1.00 0.00 C ATOM 232 C VAL A 18 -1.605 -5.154 10.446 1.00 0.00 C ATOM 233 O VAL A 18 -0.921 -4.134 10.510 1.00 0.00 O ATOM 234 CB VAL A 18 -3.795 -5.681 11.645 1.00 0.00 C ATOM 235 CG1 VAL A 18 -3.129 -5.185 12.930 1.00 0.00 C ATOM 236 CG2 VAL A 18 -5.298 -5.393 11.660 1.00 0.00 C ATOM 0 H VAL A 18 -3.987 -6.657 9.349 1.00 0.00 H new ATOM 0 HA VAL A 18 -3.397 -4.009 10.410 1.00 0.00 H new ATOM 0 HB VAL A 18 -3.661 -6.762 11.594 1.00 0.00 H new ATOM 0 HG11 VAL A 18 -3.619 -5.637 13.792 1.00 0.00 H new ATOM 0 HG12 VAL A 18 -2.075 -5.463 12.924 1.00 0.00 H new ATOM 0 HG13 VAL A 18 -3.217 -4.100 12.990 1.00 0.00 H new ATOM 0 HG21 VAL A 18 -5.745 -5.841 12.547 1.00 0.00 H new ATOM 0 HG22 VAL A 18 -5.462 -4.315 11.676 1.00 0.00 H new ATOM 0 HG23 VAL A 18 -5.759 -5.817 10.768 1.00 0.00 H new ATOM 246 N GLY A 19 -1.114 -6.384 10.404 1.00 0.00 N ATOM 247 CA GLY A 19 0.320 -6.619 10.431 1.00 0.00 C ATOM 248 C GLY A 19 1.060 -5.591 9.573 1.00 0.00 C ATOM 249 O GLY A 19 0.724 -5.394 8.406 1.00 0.00 O ATOM 0 H GLY A 19 -1.684 -7.228 10.351 1.00 0.00 H new ATOM 0 HA2 GLY A 19 0.681 -6.568 11.458 1.00 0.00 H new ATOM 0 HA3 GLY A 19 0.534 -7.624 10.067 1.00 0.00 H new ATOM 253 N GLY A 20 2.054 -4.964 10.184 1.00 0.00 N ATOM 254 CA GLY A 20 2.844 -3.961 9.491 1.00 0.00 C ATOM 255 C GLY A 20 2.384 -2.549 9.859 1.00 0.00 C ATOM 256 O GLY A 20 2.561 -1.612 9.082 1.00 0.00 O ATOM 0 H GLY A 20 2.330 -5.131 11.151 1.00 0.00 H new ATOM 0 HA2 GLY A 20 3.897 -4.082 9.746 1.00 0.00 H new ATOM 0 HA3 GLY A 20 2.758 -4.106 8.414 1.00 0.00 H new ATOM 260 N VAL A 21 1.803 -2.441 11.045 1.00 0.00 N ATOM 261 CA VAL A 21 1.316 -1.159 11.525 1.00 0.00 C ATOM 262 C VAL A 21 2.367 -0.083 11.248 1.00 0.00 C ATOM 263 O VAL A 21 2.083 0.909 10.577 1.00 0.00 O ATOM 264 CB VAL A 21 0.943 -1.263 13.006 1.00 0.00 C ATOM 265 CG1 VAL A 21 -0.296 -2.140 13.199 1.00 0.00 C ATOM 266 CG2 VAL A 21 2.119 -1.786 13.832 1.00 0.00 C ATOM 0 H VAL A 21 1.659 -3.220 11.687 1.00 0.00 H new ATOM 0 HA VAL A 21 0.409 -0.872 10.994 1.00 0.00 H new ATOM 0 HB VAL A 21 0.703 -0.261 13.362 1.00 0.00 H new ATOM 0 HG11 VAL A 21 -0.540 -2.197 14.260 1.00 0.00 H new ATOM 0 HG12 VAL A 21 -1.136 -1.707 12.657 1.00 0.00 H new ATOM 0 HG13 VAL A 21 -0.096 -3.141 12.818 1.00 0.00 H new ATOM 0 HG21 VAL A 21 1.827 -1.850 14.880 1.00 0.00 H new ATOM 0 HG22 VAL A 21 2.404 -2.775 13.473 1.00 0.00 H new ATOM 0 HG23 VAL A 21 2.965 -1.106 13.732 1.00 0.00 H new ATOM 276 N VAL A 22 3.559 -0.314 11.778 1.00 0.00 N ATOM 277 CA VAL A 22 4.653 0.624 11.596 1.00 0.00 C ATOM 278 C VAL A 22 4.765 0.989 10.114 1.00 0.00 C ATOM 279 O VAL A 22 4.905 2.161 9.769 1.00 0.00 O ATOM 280 CB VAL A 22 5.946 0.036 12.166 1.00 0.00 C ATOM 281 CG1 VAL A 22 6.050 0.297 13.670 1.00 0.00 C ATOM 282 CG2 VAL A 22 6.050 -1.459 11.860 1.00 0.00 C ATOM 0 H VAL A 22 3.791 -1.137 12.334 1.00 0.00 H new ATOM 0 HA VAL A 22 4.461 1.546 12.144 1.00 0.00 H new ATOM 0 HB VAL A 22 6.784 0.536 11.681 1.00 0.00 H new ATOM 0 HG11 VAL A 22 6.978 -0.131 14.050 1.00 0.00 H new ATOM 0 HG12 VAL A 22 6.044 1.371 13.854 1.00 0.00 H new ATOM 0 HG13 VAL A 22 5.203 -0.163 14.179 1.00 0.00 H new ATOM 0 HG21 VAL A 22 6.978 -1.852 12.276 1.00 0.00 H new ATOM 0 HG22 VAL A 22 5.203 -1.981 12.305 1.00 0.00 H new ATOM 0 HG23 VAL A 22 6.043 -1.611 10.781 1.00 0.00 H new ATOM 292 N ALA A 23 4.700 -0.037 9.278 1.00 0.00 N ATOM 293 CA ALA A 23 4.792 0.161 7.842 1.00 0.00 C ATOM 294 C ALA A 23 3.747 1.189 7.405 1.00 0.00 C ATOM 295 O ALA A 23 4.033 2.062 6.587 1.00 0.00 O ATOM 296 CB ALA A 23 4.622 -1.182 7.129 1.00 0.00 C ATOM 0 H ALA A 23 4.585 -1.008 9.568 1.00 0.00 H new ATOM 0 HA ALA A 23 5.773 0.552 7.571 1.00 0.00 H new ATOM 0 HB1 ALA A 23 4.691 -1.033 6.051 1.00 0.00 H new ATOM 0 HB2 ALA A 23 5.406 -1.867 7.452 1.00 0.00 H new ATOM 0 HB3 ALA A 23 3.648 -1.604 7.375 1.00 0.00 H new ATOM 302 N VAL A 24 2.556 1.052 7.970 1.00 0.00 N ATOM 303 CA VAL A 24 1.467 1.958 7.649 1.00 0.00 C ATOM 304 C VAL A 24 1.791 3.351 8.193 1.00 0.00 C ATOM 305 O VAL A 24 1.352 4.357 7.636 1.00 0.00 O ATOM 306 CB VAL A 24 0.147 1.400 8.184 1.00 0.00 C ATOM 307 CG1 VAL A 24 -1.018 2.337 7.856 1.00 0.00 C ATOM 308 CG2 VAL A 24 -0.113 -0.008 7.644 1.00 0.00 C ATOM 0 H VAL A 24 2.322 0.327 8.648 1.00 0.00 H new ATOM 0 HA VAL A 24 1.352 2.049 6.569 1.00 0.00 H new ATOM 0 HB VAL A 24 0.228 1.333 9.269 1.00 0.00 H new ATOM 0 HG11 VAL A 24 -1.944 1.917 8.248 1.00 0.00 H new ATOM 0 HG12 VAL A 24 -0.841 3.311 8.311 1.00 0.00 H new ATOM 0 HG13 VAL A 24 -1.100 2.451 6.775 1.00 0.00 H new ATOM 0 HG21 VAL A 24 -1.058 -0.381 8.040 1.00 0.00 H new ATOM 0 HG22 VAL A 24 -0.163 0.023 6.556 1.00 0.00 H new ATOM 0 HG23 VAL A 24 0.696 -0.671 7.951 1.00 0.00 H new ATOM 318 N GLY A 25 2.556 3.366 9.274 1.00 0.00 N ATOM 319 CA GLY A 25 2.944 4.619 9.899 1.00 0.00 C ATOM 320 C GLY A 25 3.914 5.399 9.009 1.00 0.00 C ATOM 321 O GLY A 25 3.703 6.581 8.741 1.00 0.00 O ATOM 0 H GLY A 25 2.918 2.530 9.733 1.00 0.00 H new ATOM 0 HA2 GLY A 25 2.057 5.223 10.093 1.00 0.00 H new ATOM 0 HA3 GLY A 25 3.411 4.419 10.864 1.00 0.00 H new ATOM 325 N THR A 26 4.957 4.705 8.576 1.00 0.00 N ATOM 326 CA THR A 26 5.960 5.318 7.721 1.00 0.00 C ATOM 327 C THR A 26 5.330 5.779 6.406 1.00 0.00 C ATOM 328 O THR A 26 5.625 6.870 5.921 1.00 0.00 O ATOM 329 CB THR A 26 7.097 4.312 7.531 1.00 0.00 C ATOM 330 OG1 THR A 26 7.748 4.281 8.798 1.00 0.00 O ATOM 331 CG2 THR A 26 8.174 4.820 6.571 1.00 0.00 C ATOM 0 H THR A 26 5.129 3.725 8.801 1.00 0.00 H new ATOM 0 HA THR A 26 6.375 6.216 8.178 1.00 0.00 H new ATOM 0 HB THR A 26 6.691 3.372 7.156 1.00 0.00 H new ATOM 0 HG1 THR A 26 8.498 3.651 8.765 1.00 0.00 H new ATOM 0 HG21 THR A 26 8.957 4.068 6.472 1.00 0.00 H new ATOM 0 HG22 THR A 26 7.730 5.012 5.594 1.00 0.00 H new ATOM 0 HG23 THR A 26 8.604 5.742 6.962 1.00 0.00 H new ATOM 339 N VAL A 27 4.474 4.925 5.865 1.00 0.00 N ATOM 340 CA VAL A 27 3.800 5.231 4.615 1.00 0.00 C ATOM 341 C VAL A 27 2.964 6.500 4.788 1.00 0.00 C ATOM 342 O VAL A 27 2.988 7.385 3.935 1.00 0.00 O ATOM 343 CB VAL A 27 2.973 4.028 4.158 1.00 0.00 C ATOM 344 CG1 VAL A 27 1.901 4.450 3.151 1.00 0.00 C ATOM 345 CG2 VAL A 27 3.871 2.934 3.577 1.00 0.00 C ATOM 0 H VAL A 27 4.232 4.021 6.270 1.00 0.00 H new ATOM 0 HA VAL A 27 4.528 5.426 3.827 1.00 0.00 H new ATOM 0 HB VAL A 27 2.468 3.617 5.032 1.00 0.00 H new ATOM 0 HG11 VAL A 27 1.328 3.576 2.842 1.00 0.00 H new ATOM 0 HG12 VAL A 27 1.234 5.177 3.613 1.00 0.00 H new ATOM 0 HG13 VAL A 27 2.377 4.898 2.279 1.00 0.00 H new ATOM 0 HG21 VAL A 27 3.258 2.090 3.260 1.00 0.00 H new ATOM 0 HG22 VAL A 27 4.417 3.328 2.720 1.00 0.00 H new ATOM 0 HG23 VAL A 27 4.579 2.603 4.337 1.00 0.00 H new ATOM 355 N LEU A 28 2.244 6.548 5.900 1.00 0.00 N ATOM 356 CA LEU A 28 1.401 7.695 6.196 1.00 0.00 C ATOM 357 C LEU A 28 2.284 8.919 6.448 1.00 0.00 C ATOM 358 O LEU A 28 2.318 9.841 5.635 1.00 0.00 O ATOM 359 CB LEU A 28 0.449 7.375 7.350 1.00 0.00 C ATOM 360 CG LEU A 28 -0.946 7.996 7.260 1.00 0.00 C ATOM 361 CD1 LEU A 28 -2.002 6.931 6.958 1.00 0.00 C ATOM 362 CD2 LEU A 28 -1.277 8.788 8.527 1.00 0.00 C ATOM 0 H LEU A 28 2.227 5.812 6.606 1.00 0.00 H new ATOM 0 HA LEU A 28 0.764 7.931 5.344 1.00 0.00 H new ATOM 0 HB2 LEU A 28 0.340 6.292 7.415 1.00 0.00 H new ATOM 0 HB3 LEU A 28 0.913 7.705 8.280 1.00 0.00 H new ATOM 0 HG LEU A 28 -0.953 8.701 6.429 1.00 0.00 H new ATOM 0 HD11 LEU A 28 -2.985 7.399 6.899 1.00 0.00 H new ATOM 0 HD12 LEU A 28 -1.772 6.450 6.007 1.00 0.00 H new ATOM 0 HD13 LEU A 28 -2.003 6.184 7.752 1.00 0.00 H new ATOM 0 HD21 LEU A 28 -2.274 9.219 8.437 1.00 0.00 H new ATOM 0 HD22 LEU A 28 -1.246 8.123 9.390 1.00 0.00 H new ATOM 0 HD23 LEU A 28 -0.547 9.587 8.658 1.00 0.00 H new ATOM 374 N VAL A 29 2.976 8.888 7.577 1.00 0.00 N ATOM 375 CA VAL A 29 3.856 9.984 7.946 1.00 0.00 C ATOM 376 C VAL A 29 4.626 10.452 6.710 1.00 0.00 C ATOM 377 O VAL A 29 4.999 11.620 6.612 1.00 0.00 O ATOM 378 CB VAL A 29 4.772 9.555 9.094 1.00 0.00 C ATOM 379 CG1 VAL A 29 5.914 8.674 8.584 1.00 0.00 C ATOM 380 CG2 VAL A 29 5.313 10.772 9.847 1.00 0.00 C ATOM 0 H VAL A 29 2.945 8.121 8.249 1.00 0.00 H new ATOM 0 HA VAL A 29 3.277 10.833 8.309 1.00 0.00 H new ATOM 0 HB VAL A 29 4.180 8.964 9.793 1.00 0.00 H new ATOM 0 HG11 VAL A 29 6.550 8.383 9.420 1.00 0.00 H new ATOM 0 HG12 VAL A 29 5.502 7.781 8.113 1.00 0.00 H new ATOM 0 HG13 VAL A 29 6.504 9.229 7.855 1.00 0.00 H new ATOM 0 HG21 VAL A 29 5.961 10.440 10.658 1.00 0.00 H new ATOM 0 HG22 VAL A 29 5.882 11.400 9.162 1.00 0.00 H new ATOM 0 HG23 VAL A 29 4.482 11.344 10.258 1.00 0.00 H new ATOM 390 N ALA A 30 4.840 9.517 5.796 1.00 0.00 N ATOM 391 CA ALA A 30 5.559 9.819 4.570 1.00 0.00 C ATOM 392 C ALA A 30 4.693 10.717 3.685 1.00 0.00 C ATOM 393 O ALA A 30 5.131 11.786 3.261 1.00 0.00 O ATOM 394 CB ALA A 30 5.950 8.515 3.872 1.00 0.00 C ATOM 0 H ALA A 30 4.528 8.550 5.880 1.00 0.00 H new ATOM 0 HA ALA A 30 6.480 10.360 4.788 1.00 0.00 H new ATOM 0 HB1 ALA A 30 6.489 8.742 2.952 1.00 0.00 H new ATOM 0 HB2 ALA A 30 6.588 7.927 4.531 1.00 0.00 H new ATOM 0 HB3 ALA A 30 5.051 7.946 3.634 1.00 0.00 H new ATOM 400 N LEU A 31 3.479 10.251 3.431 1.00 0.00 N ATOM 401 CA LEU A 31 2.547 10.999 2.604 1.00 0.00 C ATOM 402 C LEU A 31 2.357 12.398 3.195 1.00 0.00 C ATOM 403 O LEU A 31 2.218 13.373 2.458 1.00 0.00 O ATOM 404 CB LEU A 31 1.241 10.222 2.431 1.00 0.00 C ATOM 405 CG LEU A 31 0.507 10.430 1.105 1.00 0.00 C ATOM 406 CD1 LEU A 31 0.717 9.237 0.169 1.00 0.00 C ATOM 407 CD2 LEU A 31 -0.976 10.721 1.338 1.00 0.00 C ATOM 0 H LEU A 31 3.119 9.364 3.784 1.00 0.00 H new ATOM 0 HA LEU A 31 2.949 11.129 1.599 1.00 0.00 H new ATOM 0 HB2 LEU A 31 1.456 9.159 2.541 1.00 0.00 H new ATOM 0 HB3 LEU A 31 0.568 10.497 3.243 1.00 0.00 H new ATOM 0 HG LEU A 31 0.933 11.305 0.613 1.00 0.00 H new ATOM 0 HD11 LEU A 31 0.185 9.410 -0.766 1.00 0.00 H new ATOM 0 HD12 LEU A 31 1.781 9.118 -0.036 1.00 0.00 H new ATOM 0 HD13 LEU A 31 0.335 8.332 0.642 1.00 0.00 H new ATOM 0 HD21 LEU A 31 -1.474 10.865 0.379 1.00 0.00 H new ATOM 0 HD22 LEU A 31 -1.433 9.882 1.862 1.00 0.00 H new ATOM 0 HD23 LEU A 31 -1.079 11.624 1.939 1.00 0.00 H new ATOM 419 N SER A 32 2.357 12.451 4.519 1.00 0.00 N ATOM 420 CA SER A 32 2.186 13.714 5.217 1.00 0.00 C ATOM 421 C SER A 32 3.474 14.536 5.134 1.00 0.00 C ATOM 422 O SER A 32 3.428 15.764 5.086 1.00 0.00 O ATOM 423 CB SER A 32 1.794 13.487 6.678 1.00 0.00 C ATOM 424 OG SER A 32 2.861 12.922 7.435 1.00 0.00 O ATOM 0 H SER A 32 2.473 11.640 5.127 1.00 0.00 H new ATOM 0 HA SER A 32 1.379 14.265 4.734 1.00 0.00 H new ATOM 0 HB2 SER A 32 1.495 14.435 7.125 1.00 0.00 H new ATOM 0 HB3 SER A 32 0.928 12.826 6.723 1.00 0.00 H new ATOM 0 HG SER A 32 3.506 12.502 6.828 1.00 0.00 H new ATOM 430 N ALA A 33 4.592 13.826 5.119 1.00 0.00 N ATOM 431 CA ALA A 33 5.890 14.474 5.042 1.00 0.00 C ATOM 432 C ALA A 33 5.993 15.245 3.725 1.00 0.00 C ATOM 433 O ALA A 33 5.024 15.329 2.973 1.00 0.00 O ATOM 434 CB ALA A 33 6.994 13.426 5.193 1.00 0.00 C ATOM 0 H ALA A 33 4.626 12.807 5.159 1.00 0.00 H new ATOM 0 HA ALA A 33 6.009 15.192 5.854 1.00 0.00 H new ATOM 0 HB1 ALA A 33 7.968 13.912 5.135 1.00 0.00 H new ATOM 0 HB2 ALA A 33 6.894 12.928 6.158 1.00 0.00 H new ATOM 0 HB3 ALA A 33 6.908 12.690 4.394 1.00 0.00 H new ATOM 440 N MET A 34 7.178 15.788 3.485 1.00 0.00 N ATOM 441 CA MET A 34 7.420 16.549 2.271 1.00 0.00 C ATOM 442 C MET A 34 6.572 17.822 2.244 1.00 0.00 C ATOM 443 O MET A 34 6.038 18.193 1.200 1.00 0.00 O ATOM 444 CB MET A 34 7.087 15.686 1.053 1.00 0.00 C ATOM 445 CG MET A 34 8.352 15.065 0.458 1.00 0.00 C ATOM 446 SD MET A 34 8.625 15.694 -1.190 1.00 0.00 S ATOM 447 CE MET A 34 9.793 14.487 -1.793 1.00 0.00 C ATOM 0 H MET A 34 7.980 15.716 4.111 1.00 0.00 H new ATOM 0 HA MET A 34 8.471 16.836 2.247 1.00 0.00 H new ATOM 0 HB2 MET A 34 6.391 14.898 1.341 1.00 0.00 H new ATOM 0 HB3 MET A 34 6.586 16.293 0.299 1.00 0.00 H new ATOM 0 HG2 MET A 34 9.211 15.293 1.090 1.00 0.00 H new ATOM 0 HG3 MET A 34 8.256 13.980 0.430 1.00 0.00 H new ATOM 0 HE1 MET A 34 10.072 14.731 -2.818 1.00 0.00 H new ATOM 0 HE2 MET A 34 10.682 14.495 -1.163 1.00 0.00 H new ATOM 0 HE3 MET A 34 9.339 13.496 -1.767 1.00 0.00 H new ATOM 457 N GLY A 35 6.476 18.456 3.403 1.00 0.00 N ATOM 458 CA GLY A 35 5.702 19.680 3.524 1.00 0.00 C ATOM 459 C GLY A 35 5.797 20.250 4.941 1.00 0.00 C ATOM 460 O GLY A 35 5.915 21.462 5.120 1.00 0.00 O ATOM 0 H GLY A 35 6.921 18.145 4.267 1.00 0.00 H new ATOM 0 HA2 GLY A 35 6.065 20.416 2.807 1.00 0.00 H new ATOM 0 HA3 GLY A 35 4.659 19.481 3.277 1.00 0.00 H new ATOM 464 N PHE A 36 5.743 19.351 5.912 1.00 0.00 N ATOM 465 CA PHE A 36 5.821 19.749 7.307 1.00 0.00 C ATOM 466 C PHE A 36 4.557 20.496 7.736 1.00 0.00 C ATOM 467 O PHE A 36 4.625 21.439 8.522 1.00 0.00 O ATOM 468 CB PHE A 36 7.023 20.688 7.437 1.00 0.00 C ATOM 469 CG PHE A 36 7.878 20.435 8.680 1.00 0.00 C ATOM 470 CD1 PHE A 36 7.370 20.684 9.917 1.00 0.00 C ATOM 471 CD2 PHE A 36 9.146 19.961 8.548 1.00 0.00 C ATOM 472 CE1 PHE A 36 8.164 20.449 11.071 1.00 0.00 C ATOM 473 CE2 PHE A 36 9.940 19.726 9.702 1.00 0.00 C ATOM 474 CZ PHE A 36 9.432 19.976 10.939 1.00 0.00 C ATOM 0 H PHE A 36 5.646 18.347 5.760 1.00 0.00 H new ATOM 0 HA PHE A 36 5.922 18.868 7.940 1.00 0.00 H new ATOM 0 HB2 PHE A 36 7.649 20.585 6.551 1.00 0.00 H new ATOM 0 HB3 PHE A 36 6.666 21.718 7.457 1.00 0.00 H new ATOM 0 HD1 PHE A 36 6.363 21.060 10.022 1.00 0.00 H new ATOM 0 HD2 PHE A 36 9.549 19.763 7.566 1.00 0.00 H new ATOM 0 HE1 PHE A 36 7.761 20.646 12.053 1.00 0.00 H new ATOM 0 HE2 PHE A 36 10.947 19.349 9.597 1.00 0.00 H new ATOM 0 HZ PHE A 36 10.036 19.799 11.817 1.00 0.00 H new ATOM 484 N THR A 37 3.432 20.046 7.200 1.00 0.00 N ATOM 485 CA THR A 37 2.154 20.660 7.517 1.00 0.00 C ATOM 486 C THR A 37 1.049 19.602 7.558 1.00 0.00 C ATOM 487 O THR A 37 0.629 19.097 6.518 1.00 0.00 O ATOM 488 CB THR A 37 1.895 21.769 6.496 1.00 0.00 C ATOM 489 OG1 THR A 37 0.585 22.233 6.811 1.00 0.00 O ATOM 490 CG2 THR A 37 1.766 21.232 5.069 1.00 0.00 C ATOM 0 H THR A 37 3.379 19.263 6.548 1.00 0.00 H new ATOM 0 HA THR A 37 2.168 21.110 8.510 1.00 0.00 H new ATOM 0 HB THR A 37 2.705 22.497 6.539 1.00 0.00 H new ATOM 0 HG1 THR A 37 0.337 22.956 6.197 1.00 0.00 H new ATOM 0 HG21 THR A 37 1.583 22.060 4.384 1.00 0.00 H new ATOM 0 HG22 THR A 37 2.688 20.724 4.786 1.00 0.00 H new ATOM 0 HG23 THR A 37 0.935 20.529 5.019 1.00 0.00 H new ATOM 498 N SER A 38 0.610 19.297 8.771 1.00 0.00 N ATOM 499 CA SER A 38 -0.437 18.309 8.961 1.00 0.00 C ATOM 500 C SER A 38 -0.979 18.388 10.389 1.00 0.00 C ATOM 501 O SER A 38 -2.188 18.309 10.604 1.00 0.00 O ATOM 502 CB SER A 38 0.076 16.898 8.665 1.00 0.00 C ATOM 503 OG SER A 38 1.319 16.636 9.312 1.00 0.00 O ATOM 0 H SER A 38 0.961 19.717 9.632 1.00 0.00 H new ATOM 0 HA SER A 38 -1.243 18.527 8.261 1.00 0.00 H new ATOM 0 HB2 SER A 38 -0.664 16.167 8.991 1.00 0.00 H new ATOM 0 HB3 SER A 38 0.194 16.773 7.589 1.00 0.00 H new ATOM 0 HG SER A 38 1.612 15.725 9.100 1.00 0.00 H new ATOM 509 N VAL A 39 -0.058 18.542 11.330 1.00 0.00 N ATOM 510 CA VAL A 39 -0.428 18.633 12.732 1.00 0.00 C ATOM 511 C VAL A 39 -1.568 19.641 12.890 1.00 0.00 C ATOM 512 O VAL A 39 -2.735 19.257 12.960 1.00 0.00 O ATOM 513 CB VAL A 39 0.800 18.983 13.575 1.00 0.00 C ATOM 514 CG1 VAL A 39 1.557 17.720 13.990 1.00 0.00 C ATOM 515 CG2 VAL A 39 1.718 19.953 12.831 1.00 0.00 C ATOM 0 H VAL A 39 0.944 18.606 11.148 1.00 0.00 H new ATOM 0 HA VAL A 39 -0.792 17.671 13.094 1.00 0.00 H new ATOM 0 HB VAL A 39 0.454 19.480 14.481 1.00 0.00 H new ATOM 0 HG11 VAL A 39 2.425 17.996 14.588 1.00 0.00 H new ATOM 0 HG12 VAL A 39 0.900 17.079 14.578 1.00 0.00 H new ATOM 0 HG13 VAL A 39 1.885 17.184 13.100 1.00 0.00 H new ATOM 0 HG21 VAL A 39 2.583 20.185 13.453 1.00 0.00 H new ATOM 0 HG22 VAL A 39 2.053 19.496 11.900 1.00 0.00 H new ATOM 0 HG23 VAL A 39 1.174 20.871 12.609 1.00 0.00 H new ATOM 525 N GLY A 40 -1.191 20.910 12.941 1.00 0.00 N ATOM 526 CA GLY A 40 -2.168 21.975 13.089 1.00 0.00 C ATOM 527 C GLY A 40 -3.433 21.676 12.282 1.00 0.00 C ATOM 528 O GLY A 40 -4.530 21.630 12.835 1.00 0.00 O ATOM 0 H GLY A 40 -0.222 21.225 12.882 1.00 0.00 H new ATOM 0 HA2 GLY A 40 -2.424 22.095 14.142 1.00 0.00 H new ATOM 0 HA3 GLY A 40 -1.735 22.919 12.757 1.00 0.00 H new ATOM 532 N ILE A 41 -3.237 21.481 10.986 1.00 0.00 N ATOM 533 CA ILE A 41 -4.348 21.188 10.097 1.00 0.00 C ATOM 534 C ILE A 41 -5.280 20.178 10.769 1.00 0.00 C ATOM 535 O ILE A 41 -6.488 20.397 10.844 1.00 0.00 O ATOM 536 CB ILE A 41 -3.834 20.735 8.729 1.00 0.00 C ATOM 537 CG1 ILE A 41 -3.103 21.872 8.013 1.00 0.00 C ATOM 538 CG2 ILE A 41 -4.970 20.159 7.880 1.00 0.00 C ATOM 539 CD1 ILE A 41 -4.095 22.834 7.355 1.00 0.00 C ATOM 0 H ILE A 41 -2.325 21.520 10.531 1.00 0.00 H new ATOM 0 HA ILE A 41 -4.934 22.088 9.910 1.00 0.00 H new ATOM 0 HB ILE A 41 -3.110 19.935 8.884 1.00 0.00 H new ATOM 0 HG12 ILE A 41 -2.482 22.415 8.725 1.00 0.00 H new ATOM 0 HG13 ILE A 41 -2.435 21.460 7.257 1.00 0.00 H new ATOM 0 HG21 ILE A 41 -4.578 19.845 6.913 1.00 0.00 H new ATOM 0 HG22 ILE A 41 -5.407 19.301 8.391 1.00 0.00 H new ATOM 0 HG23 ILE A 41 -5.735 20.921 7.731 1.00 0.00 H new ATOM 0 HD11 ILE A 41 -3.549 23.633 6.853 1.00 0.00 H new ATOM 0 HD12 ILE A 41 -4.698 22.293 6.626 1.00 0.00 H new ATOM 0 HD13 ILE A 41 -4.746 23.263 8.117 1.00 0.00 H new ATOM 551 N ALA A 42 -4.684 19.093 11.241 1.00 0.00 N ATOM 552 CA ALA A 42 -5.446 18.048 11.904 1.00 0.00 C ATOM 553 C ALA A 42 -6.239 18.659 13.061 1.00 0.00 C ATOM 554 O ALA A 42 -7.423 18.368 13.228 1.00 0.00 O ATOM 555 CB ALA A 42 -4.498 16.941 12.367 1.00 0.00 C ATOM 0 H ALA A 42 -3.682 18.915 11.177 1.00 0.00 H new ATOM 0 HA ALA A 42 -6.161 17.597 11.216 1.00 0.00 H new ATOM 0 HB1 ALA A 42 -5.069 16.157 12.864 1.00 0.00 H new ATOM 0 HB2 ALA A 42 -3.980 16.521 11.505 1.00 0.00 H new ATOM 0 HB3 ALA A 42 -3.768 17.355 13.063 1.00 0.00 H new ATOM 561 N ALA A 43 -5.556 19.494 13.830 1.00 0.00 N ATOM 562 CA ALA A 43 -6.182 20.148 14.966 1.00 0.00 C ATOM 563 C ALA A 43 -7.345 21.012 14.474 1.00 0.00 C ATOM 564 O ALA A 43 -8.311 21.232 15.203 1.00 0.00 O ATOM 565 CB ALA A 43 -5.134 20.960 15.729 1.00 0.00 C ATOM 0 H ALA A 43 -4.574 19.733 13.688 1.00 0.00 H new ATOM 0 HA ALA A 43 -6.589 19.410 15.657 1.00 0.00 H new ATOM 0 HB1 ALA A 43 -5.604 21.451 16.581 1.00 0.00 H new ATOM 0 HB2 ALA A 43 -4.345 20.296 16.082 1.00 0.00 H new ATOM 0 HB3 ALA A 43 -4.705 21.713 15.068 1.00 0.00 H new ATOM 571 N SER A 44 -7.214 21.479 13.241 1.00 0.00 N ATOM 572 CA SER A 44 -8.241 22.314 12.644 1.00 0.00 C ATOM 573 C SER A 44 -9.433 21.454 12.218 1.00 0.00 C ATOM 574 O SER A 44 -10.584 21.853 12.389 1.00 0.00 O ATOM 575 CB SER A 44 -7.692 23.091 11.446 1.00 0.00 C ATOM 576 OG SER A 44 -8.028 24.475 11.507 1.00 0.00 O ATOM 0 H SER A 44 -6.411 21.294 12.639 1.00 0.00 H new ATOM 0 HA SER A 44 -8.571 23.036 13.391 1.00 0.00 H new ATOM 0 HB2 SER A 44 -6.608 22.982 11.410 1.00 0.00 H new ATOM 0 HB3 SER A 44 -8.086 22.663 10.525 1.00 0.00 H new ATOM 0 HG SER A 44 -7.658 24.936 10.726 1.00 0.00 H new ATOM 582 N SER A 45 -9.116 20.289 11.672 1.00 0.00 N ATOM 583 CA SER A 45 -10.146 19.369 11.221 1.00 0.00 C ATOM 584 C SER A 45 -10.951 18.857 12.417 1.00 0.00 C ATOM 585 O SER A 45 -12.180 18.905 12.409 1.00 0.00 O ATOM 586 CB SER A 45 -9.537 18.197 10.449 1.00 0.00 C ATOM 587 OG SER A 45 -9.722 18.330 9.043 1.00 0.00 O ATOM 0 H SER A 45 -8.160 19.961 11.532 1.00 0.00 H new ATOM 0 HA SER A 45 -10.813 19.906 10.546 1.00 0.00 H new ATOM 0 HB2 SER A 45 -8.472 18.132 10.670 1.00 0.00 H new ATOM 0 HB3 SER A 45 -9.990 17.265 10.788 1.00 0.00 H new ATOM 0 HG SER A 45 -9.318 17.563 8.586 1.00 0.00 H new ATOM 593 N ILE A 46 -10.225 18.378 13.417 1.00 0.00 N ATOM 594 CA ILE A 46 -10.856 17.858 14.617 1.00 0.00 C ATOM 595 C ILE A 46 -11.567 18.998 15.350 1.00 0.00 C ATOM 596 O ILE A 46 -12.643 18.803 15.912 1.00 0.00 O ATOM 597 CB ILE A 46 -9.834 17.115 15.481 1.00 0.00 C ATOM 598 CG1 ILE A 46 -8.757 18.069 15.999 1.00 0.00 C ATOM 599 CG2 ILE A 46 -9.234 15.930 14.722 1.00 0.00 C ATOM 600 CD1 ILE A 46 -9.083 18.548 17.415 1.00 0.00 C ATOM 0 H ILE A 46 -9.206 18.339 13.420 1.00 0.00 H new ATOM 0 HA ILE A 46 -11.617 17.121 14.358 1.00 0.00 H new ATOM 0 HB ILE A 46 -10.351 16.711 16.352 1.00 0.00 H new ATOM 0 HG12 ILE A 46 -7.789 17.567 15.995 1.00 0.00 H new ATOM 0 HG13 ILE A 46 -8.674 18.927 15.331 1.00 0.00 H new ATOM 0 HG21 ILE A 46 -8.511 15.419 15.358 1.00 0.00 H new ATOM 0 HG22 ILE A 46 -10.028 15.236 14.445 1.00 0.00 H new ATOM 0 HG23 ILE A 46 -8.735 16.289 13.822 1.00 0.00 H new ATOM 0 HD11 ILE A 46 -8.301 19.225 17.759 1.00 0.00 H new ATOM 0 HD12 ILE A 46 -10.040 19.071 17.411 1.00 0.00 H new ATOM 0 HD13 ILE A 46 -9.141 17.690 18.085 1.00 0.00 H new ATOM 612 N ALA A 47 -10.936 20.162 15.319 1.00 0.00 N ATOM 613 CA ALA A 47 -11.495 21.333 15.974 1.00 0.00 C ATOM 614 C ALA A 47 -12.884 21.618 15.400 1.00 0.00 C ATOM 615 O ALA A 47 -13.830 21.861 16.148 1.00 0.00 O ATOM 616 CB ALA A 47 -10.540 22.517 15.804 1.00 0.00 C ATOM 0 H ALA A 47 -10.044 20.320 14.851 1.00 0.00 H new ATOM 0 HA ALA A 47 -11.610 21.157 17.044 1.00 0.00 H new ATOM 0 HB1 ALA A 47 -10.959 23.396 16.295 1.00 0.00 H new ATOM 0 HB2 ALA A 47 -9.577 22.275 16.253 1.00 0.00 H new ATOM 0 HB3 ALA A 47 -10.404 22.725 14.743 1.00 0.00 H new ATOM 622 N ALA A 48 -12.964 21.578 14.078 1.00 0.00 N ATOM 623 CA ALA A 48 -14.222 21.829 13.396 1.00 0.00 C ATOM 624 C ALA A 48 -15.150 20.628 13.590 1.00 0.00 C ATOM 625 O ALA A 48 -16.196 20.743 14.226 1.00 0.00 O ATOM 626 CB ALA A 48 -13.952 22.126 11.920 1.00 0.00 C ATOM 0 H ALA A 48 -12.178 21.375 13.461 1.00 0.00 H new ATOM 0 HA ALA A 48 -14.720 22.702 13.818 1.00 0.00 H new ATOM 0 HB1 ALA A 48 -14.896 22.314 11.408 1.00 0.00 H new ATOM 0 HB2 ALA A 48 -13.312 23.005 11.837 1.00 0.00 H new ATOM 0 HB3 ALA A 48 -13.455 21.271 11.462 1.00 0.00 H new ATOM 632 N LYS A 49 -14.733 19.502 13.028 1.00 0.00 N ATOM 633 CA LYS A 49 -15.514 18.281 13.130 1.00 0.00 C ATOM 634 C LYS A 49 -16.739 18.386 12.220 1.00 0.00 C ATOM 635 O LYS A 49 -17.862 18.532 12.699 1.00 0.00 O ATOM 636 CB LYS A 49 -15.858 17.986 14.592 1.00 0.00 C ATOM 637 CG LYS A 49 -15.735 16.491 14.893 1.00 0.00 C ATOM 638 CD LYS A 49 -17.073 15.913 15.357 1.00 0.00 C ATOM 639 CE LYS A 49 -17.345 14.560 14.698 1.00 0.00 C ATOM 640 NZ LYS A 49 -18.793 14.385 14.450 1.00 0.00 N ATOM 0 H LYS A 49 -13.865 19.410 12.501 1.00 0.00 H new ATOM 0 HA LYS A 49 -14.932 17.427 12.784 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.192 18.548 15.247 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -16.873 18.321 14.805 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -15.397 15.964 14.001 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -14.980 16.332 15.663 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -17.067 15.799 16.441 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -17.877 16.608 15.114 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -16.798 14.491 13.758 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -16.980 13.757 15.339 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -18.959 13.461 14.002 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -19.308 14.430 15.353 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -19.131 15.141 13.821 1.00 0.00 H new ATOM 654 N MET A 50 -16.480 18.308 10.923 1.00 0.00 N ATOM 655 CA MET A 50 -17.548 18.392 9.940 1.00 0.00 C ATOM 656 C MET A 50 -18.128 17.008 9.641 1.00 0.00 C ATOM 657 O MET A 50 -17.471 15.993 9.869 1.00 0.00 O ATOM 658 CB MET A 50 -17.007 19.010 8.649 1.00 0.00 C ATOM 659 CG MET A 50 -17.042 20.538 8.716 1.00 0.00 C ATOM 660 SD MET A 50 -15.433 21.203 8.323 1.00 0.00 S ATOM 661 CE MET A 50 -15.265 20.635 6.640 1.00 0.00 C ATOM 0 H MET A 50 -15.547 18.188 10.530 1.00 0.00 H new ATOM 0 HA MET A 50 -18.342 19.018 10.347 1.00 0.00 H new ATOM 0 HB2 MET A 50 -15.984 18.673 8.481 1.00 0.00 H new ATOM 0 HB3 MET A 50 -17.599 18.666 7.801 1.00 0.00 H new ATOM 0 HG2 MET A 50 -17.785 20.924 8.018 1.00 0.00 H new ATOM 0 HG3 MET A 50 -17.344 20.860 9.713 1.00 0.00 H new ATOM 0 HE1 MET A 50 -14.566 21.279 6.107 1.00 0.00 H new ATOM 0 HE2 MET A 50 -14.890 19.612 6.637 1.00 0.00 H new ATOM 0 HE3 MET A 50 -16.236 20.667 6.147 1.00 0.00 H new ATOM 671 N MET A 51 -19.352 17.012 9.133 1.00 0.00 N ATOM 672 CA MET A 51 -20.027 15.769 8.800 1.00 0.00 C ATOM 673 C MET A 51 -19.929 15.477 7.301 1.00 0.00 C ATOM 674 O MET A 51 -19.453 14.415 6.903 1.00 0.00 O ATOM 675 CB MET A 51 -21.499 15.864 9.206 1.00 0.00 C ATOM 676 CG MET A 51 -22.139 14.475 9.275 1.00 0.00 C ATOM 677 SD MET A 51 -23.845 14.614 9.783 1.00 0.00 S ATOM 678 CE MET A 51 -24.373 12.923 9.559 1.00 0.00 C ATOM 0 H MET A 51 -19.893 17.856 8.944 1.00 0.00 H new ATOM 0 HA MET A 51 -19.542 14.957 9.342 1.00 0.00 H new ATOM 0 HB2 MET A 51 -21.582 16.355 10.176 1.00 0.00 H new ATOM 0 HB3 MET A 51 -22.039 16.482 8.489 1.00 0.00 H new ATOM 0 HG2 MET A 51 -22.079 13.989 8.301 1.00 0.00 H new ATOM 0 HG3 MET A 51 -21.591 13.848 9.978 1.00 0.00 H new ATOM 0 HE1 MET A 51 -25.424 12.831 9.833 1.00 0.00 H new ATOM 0 HE2 MET A 51 -24.243 12.637 8.515 1.00 0.00 H new ATOM 0 HE3 MET A 51 -23.774 12.268 10.192 1.00 0.00 H new ATOM 688 N SER A 52 -20.386 16.438 6.512 1.00 0.00 N ATOM 689 CA SER A 52 -20.355 16.296 5.066 1.00 0.00 C ATOM 690 C SER A 52 -20.007 17.637 4.417 1.00 0.00 C ATOM 691 O SER A 52 -20.525 18.678 4.818 1.00 0.00 O ATOM 692 CB SER A 52 -21.694 15.781 4.535 1.00 0.00 C ATOM 693 OG SER A 52 -21.532 14.984 3.364 1.00 0.00 O ATOM 0 H SER A 52 -20.780 17.318 6.846 1.00 0.00 H new ATOM 0 HA SER A 52 -19.588 15.565 4.810 1.00 0.00 H new ATOM 0 HB2 SER A 52 -22.189 15.193 5.308 1.00 0.00 H new ATOM 0 HB3 SER A 52 -22.345 16.626 4.311 1.00 0.00 H new ATOM 0 HG SER A 52 -22.409 14.673 3.056 1.00 0.00 H new ATOM 699 N THR A 53 -19.131 17.568 3.424 1.00 0.00 N ATOM 700 CA THR A 53 -18.708 18.764 2.716 1.00 0.00 C ATOM 701 C THR A 53 -18.203 18.404 1.317 1.00 0.00 C ATOM 702 O THR A 53 -18.744 18.874 0.317 1.00 0.00 O ATOM 703 CB THR A 53 -17.662 19.477 3.574 1.00 0.00 C ATOM 704 OG1 THR A 53 -18.383 19.882 4.735 1.00 0.00 O ATOM 705 CG2 THR A 53 -17.191 20.793 2.951 1.00 0.00 C ATOM 0 H THR A 53 -18.703 16.703 3.094 1.00 0.00 H new ATOM 0 HA THR A 53 -19.543 19.448 2.561 1.00 0.00 H new ATOM 0 HB THR A 53 -16.806 18.819 3.723 1.00 0.00 H new ATOM 0 HG1 THR A 53 -19.338 19.944 4.522 1.00 0.00 H new ATOM 0 HG21 THR A 53 -16.449 21.258 3.600 1.00 0.00 H new ATOM 0 HG22 THR A 53 -16.746 20.595 1.976 1.00 0.00 H new ATOM 0 HG23 THR A 53 -18.041 21.464 2.833 1.00 0.00 H new ATOM 713 N ALA A 54 -17.171 17.573 1.291 1.00 0.00 N ATOM 714 CA ALA A 54 -16.587 17.144 0.032 1.00 0.00 C ATOM 715 C ALA A 54 -16.010 18.359 -0.697 1.00 0.00 C ATOM 716 O ALA A 54 -16.756 19.202 -1.194 1.00 0.00 O ATOM 717 CB ALA A 54 -17.644 16.413 -0.799 1.00 0.00 C ATOM 0 H ALA A 54 -16.724 17.185 2.122 1.00 0.00 H new ATOM 0 HA ALA A 54 -15.769 16.445 0.207 1.00 0.00 H new ATOM 0 HB1 ALA A 54 -17.206 16.091 -1.744 1.00 0.00 H new ATOM 0 HB2 ALA A 54 -18.001 15.542 -0.249 1.00 0.00 H new ATOM 0 HB3 ALA A 54 -18.480 17.084 -0.997 1.00 0.00 H new ATOM 723 N ALA A 55 -14.687 18.411 -0.738 1.00 0.00 N ATOM 724 CA ALA A 55 -14.001 19.509 -1.398 1.00 0.00 C ATOM 725 C ALA A 55 -14.112 19.336 -2.914 1.00 0.00 C ATOM 726 O ALA A 55 -14.628 18.327 -3.392 1.00 0.00 O ATOM 727 CB ALA A 55 -12.548 19.563 -0.923 1.00 0.00 C ATOM 0 H ALA A 55 -14.071 17.710 -0.325 1.00 0.00 H new ATOM 0 HA ALA A 55 -14.464 20.461 -1.139 1.00 0.00 H new ATOM 0 HB1 ALA A 55 -12.034 20.387 -1.418 1.00 0.00 H new ATOM 0 HB2 ALA A 55 -12.523 19.716 0.156 1.00 0.00 H new ATOM 0 HB3 ALA A 55 -12.050 18.625 -1.168 1.00 0.00 H new ATOM 733 N ILE A 56 -13.619 20.337 -3.630 1.00 0.00 N ATOM 734 CA ILE A 56 -13.657 20.308 -5.082 1.00 0.00 C ATOM 735 C ILE A 56 -15.046 19.863 -5.543 1.00 0.00 C ATOM 736 O ILE A 56 -15.974 19.781 -4.740 1.00 0.00 O ATOM 737 CB ILE A 56 -12.520 19.443 -5.630 1.00 0.00 C ATOM 738 CG1 ILE A 56 -12.102 19.908 -7.026 1.00 0.00 C ATOM 739 CG2 ILE A 56 -12.901 17.961 -5.610 1.00 0.00 C ATOM 740 CD1 ILE A 56 -10.592 20.151 -7.094 1.00 0.00 C ATOM 0 H ILE A 56 -13.191 21.173 -3.231 1.00 0.00 H new ATOM 0 HA ILE A 56 -13.491 21.306 -5.488 1.00 0.00 H new ATOM 0 HB ILE A 56 -11.655 19.562 -4.978 1.00 0.00 H new ATOM 0 HG12 ILE A 56 -12.387 19.158 -7.764 1.00 0.00 H new ATOM 0 HG13 ILE A 56 -12.633 20.825 -7.282 1.00 0.00 H new ATOM 0 HG21 ILE A 56 -12.076 17.368 -6.004 1.00 0.00 H new ATOM 0 HG22 ILE A 56 -13.112 17.653 -4.586 1.00 0.00 H new ATOM 0 HG23 ILE A 56 -13.787 17.805 -6.225 1.00 0.00 H new ATOM 0 HD11 ILE A 56 -10.321 20.481 -8.097 1.00 0.00 H new ATOM 0 HD12 ILE A 56 -10.314 20.919 -6.372 1.00 0.00 H new ATOM 0 HD13 ILE A 56 -10.064 19.226 -6.861 1.00 0.00 H new ATOM 752 N ALA A 57 -15.146 19.588 -6.836 1.00 0.00 N ATOM 753 CA ALA A 57 -16.406 19.154 -7.413 1.00 0.00 C ATOM 754 C ALA A 57 -16.143 18.023 -8.409 1.00 0.00 C ATOM 755 O ALA A 57 -16.650 16.915 -8.243 1.00 0.00 O ATOM 756 CB ALA A 57 -17.110 20.349 -8.061 1.00 0.00 C ATOM 0 H ALA A 57 -14.374 19.658 -7.500 1.00 0.00 H new ATOM 0 HA ALA A 57 -17.068 18.765 -6.639 1.00 0.00 H new ATOM 0 HB1 ALA A 57 -18.056 20.023 -8.494 1.00 0.00 H new ATOM 0 HB2 ALA A 57 -17.300 21.112 -7.306 1.00 0.00 H new ATOM 0 HB3 ALA A 57 -16.476 20.764 -8.845 1.00 0.00 H new ATOM 762 N ASN A 58 -15.349 18.341 -9.421 1.00 0.00 N ATOM 763 CA ASN A 58 -15.013 17.365 -10.444 1.00 0.00 C ATOM 764 C ASN A 58 -14.755 16.010 -9.783 1.00 0.00 C ATOM 765 O ASN A 58 -14.312 15.947 -8.638 1.00 0.00 O ATOM 766 CB ASN A 58 -13.745 17.773 -11.198 1.00 0.00 C ATOM 767 CG ASN A 58 -13.673 17.083 -12.562 1.00 0.00 C ATOM 768 OD1 ASN A 58 -14.676 16.765 -13.179 1.00 0.00 O ATOM 769 ND2 ASN A 58 -12.434 16.872 -12.996 1.00 0.00 N ATOM 0 H ASN A 58 -14.929 19.261 -9.554 1.00 0.00 H new ATOM 0 HA ASN A 58 -15.846 17.308 -11.144 1.00 0.00 H new ATOM 0 HB2 ASN A 58 -13.729 18.855 -11.332 1.00 0.00 H new ATOM 0 HB3 ASN A 58 -12.867 17.512 -10.608 1.00 0.00 H new ATOM 0 HD21 ASN A 58 -12.279 16.418 -13.896 1.00 0.00 H new ATOM 0 HD22 ASN A 58 -11.638 17.164 -12.428 1.00 0.00 H new ATOM 776 N GLY A 59 -15.044 14.957 -10.535 1.00 0.00 N ATOM 777 CA GLY A 59 -14.849 13.606 -10.036 1.00 0.00 C ATOM 778 C GLY A 59 -16.041 13.156 -9.189 1.00 0.00 C ATOM 779 O GLY A 59 -16.846 12.337 -9.630 1.00 0.00 O ATOM 0 H GLY A 59 -15.411 15.012 -11.485 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -14.714 12.921 -10.873 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -13.938 13.563 -9.439 1.00 0.00 H new ATOM 783 N GLY A 60 -16.116 13.712 -7.989 1.00 0.00 N ATOM 784 CA GLY A 60 -17.197 13.379 -7.077 1.00 0.00 C ATOM 785 C GLY A 60 -16.682 12.552 -5.896 1.00 0.00 C ATOM 786 O GLY A 60 -15.710 11.811 -6.030 1.00 0.00 O ATOM 0 H GLY A 60 -15.446 14.391 -7.627 1.00 0.00 H new ATOM 0 HA2 GLY A 60 -17.663 14.294 -6.710 1.00 0.00 H new ATOM 0 HA3 GLY A 60 -17.967 12.820 -7.609 1.00 0.00 H new ATOM 790 N GLY A 61 -17.358 12.708 -4.767 1.00 0.00 N ATOM 791 CA GLY A 61 -16.981 11.985 -3.564 1.00 0.00 C ATOM 792 C GLY A 61 -16.573 10.548 -3.893 1.00 0.00 C ATOM 793 O GLY A 61 -17.330 9.814 -4.527 1.00 0.00 O ATOM 0 H GLY A 61 -18.164 13.324 -4.660 1.00 0.00 H new ATOM 0 HA2 GLY A 61 -16.155 12.498 -3.071 1.00 0.00 H new ATOM 0 HA3 GLY A 61 -17.816 11.978 -2.863 1.00 0.00 H new ATOM 797 N VAL A 62 -15.378 10.189 -3.447 1.00 0.00 N ATOM 798 CA VAL A 62 -14.861 8.853 -3.686 1.00 0.00 C ATOM 799 C VAL A 62 -13.557 8.668 -2.906 1.00 0.00 C ATOM 800 O VAL A 62 -12.511 8.399 -3.494 1.00 0.00 O ATOM 801 CB VAL A 62 -14.697 8.616 -5.188 1.00 0.00 C ATOM 802 CG1 VAL A 62 -13.682 9.590 -5.790 1.00 0.00 C ATOM 803 CG2 VAL A 62 -14.302 7.166 -5.475 1.00 0.00 C ATOM 0 H VAL A 62 -14.753 10.800 -2.921 1.00 0.00 H new ATOM 0 HA VAL A 62 -15.564 8.102 -3.327 1.00 0.00 H new ATOM 0 HB VAL A 62 -15.661 8.801 -5.663 1.00 0.00 H new ATOM 0 HG11 VAL A 62 -13.585 9.400 -6.859 1.00 0.00 H new ATOM 0 HG12 VAL A 62 -14.023 10.613 -5.633 1.00 0.00 H new ATOM 0 HG13 VAL A 62 -12.715 9.452 -5.307 1.00 0.00 H new ATOM 0 HG21 VAL A 62 -14.192 7.025 -6.550 1.00 0.00 H new ATOM 0 HG22 VAL A 62 -13.357 6.942 -4.981 1.00 0.00 H new ATOM 0 HG23 VAL A 62 -15.076 6.497 -5.099 1.00 0.00 H new ATOM 813 N ALA A 63 -13.663 8.821 -1.594 1.00 0.00 N ATOM 814 CA ALA A 63 -12.506 8.675 -0.728 1.00 0.00 C ATOM 815 C ALA A 63 -11.668 9.954 -0.783 1.00 0.00 C ATOM 816 O ALA A 63 -11.495 10.631 0.230 1.00 0.00 O ATOM 817 CB ALA A 63 -11.709 7.437 -1.145 1.00 0.00 C ATOM 0 H ALA A 63 -14.533 9.045 -1.110 1.00 0.00 H new ATOM 0 HA ALA A 63 -12.817 8.529 0.306 1.00 0.00 H new ATOM 0 HB1 ALA A 63 -10.841 7.327 -0.495 1.00 0.00 H new ATOM 0 HB2 ALA A 63 -12.340 6.552 -1.060 1.00 0.00 H new ATOM 0 HB3 ALA A 63 -11.378 7.548 -2.177 1.00 0.00 H new ATOM 823 N ALA A 64 -11.170 10.246 -1.975 1.00 0.00 N ATOM 824 CA ALA A 64 -10.355 11.432 -2.175 1.00 0.00 C ATOM 825 C ALA A 64 -10.114 11.633 -3.673 1.00 0.00 C ATOM 826 O ALA A 64 -10.659 10.901 -4.497 1.00 0.00 O ATOM 827 CB ALA A 64 -9.050 11.294 -1.388 1.00 0.00 C ATOM 0 H ALA A 64 -11.315 9.682 -2.812 1.00 0.00 H new ATOM 0 HA ALA A 64 -10.869 12.318 -1.802 1.00 0.00 H new ATOM 0 HB1 ALA A 64 -8.439 12.184 -1.538 1.00 0.00 H new ATOM 0 HB2 ALA A 64 -9.275 11.183 -0.327 1.00 0.00 H new ATOM 0 HB3 ALA A 64 -8.506 10.417 -1.737 1.00 0.00 H new ATOM 833 N GLY A 65 -9.297 12.630 -3.980 1.00 0.00 N ATOM 834 CA GLY A 65 -8.977 12.937 -5.363 1.00 0.00 C ATOM 835 C GLY A 65 -7.521 12.589 -5.680 1.00 0.00 C ATOM 836 O GLY A 65 -7.222 11.470 -6.095 1.00 0.00 O ATOM 0 H GLY A 65 -8.847 13.236 -3.294 1.00 0.00 H new ATOM 0 HA2 GLY A 65 -9.640 12.380 -6.025 1.00 0.00 H new ATOM 0 HA3 GLY A 65 -9.151 13.996 -5.554 1.00 0.00 H new ATOM 840 N SER A 66 -6.653 13.568 -5.471 1.00 0.00 N ATOM 841 CA SER A 66 -5.236 13.380 -5.729 1.00 0.00 C ATOM 842 C SER A 66 -4.764 12.058 -5.118 1.00 0.00 C ATOM 843 O SER A 66 -4.046 11.295 -5.762 1.00 0.00 O ATOM 844 CB SER A 66 -4.415 14.545 -5.171 1.00 0.00 C ATOM 845 OG SER A 66 -3.650 15.192 -6.185 1.00 0.00 O ATOM 0 H SER A 66 -6.904 14.494 -5.126 1.00 0.00 H new ATOM 0 HA SER A 66 -5.086 13.349 -6.808 1.00 0.00 H new ATOM 0 HB2 SER A 66 -5.083 15.268 -4.704 1.00 0.00 H new ATOM 0 HB3 SER A 66 -3.747 14.178 -4.392 1.00 0.00 H new ATOM 0 HG SER A 66 -3.141 15.931 -5.790 1.00 0.00 H new ATOM 851 N LEU A 67 -5.187 11.829 -3.884 1.00 0.00 N ATOM 852 CA LEU A 67 -4.817 10.613 -3.180 1.00 0.00 C ATOM 853 C LEU A 67 -4.983 9.416 -4.117 1.00 0.00 C ATOM 854 O LEU A 67 -4.098 8.567 -4.208 1.00 0.00 O ATOM 855 CB LEU A 67 -5.607 10.488 -1.875 1.00 0.00 C ATOM 856 CG LEU A 67 -5.147 9.389 -0.916 1.00 0.00 C ATOM 857 CD1 LEU A 67 -4.698 9.981 0.422 1.00 0.00 C ATOM 858 CD2 LEU A 67 -6.234 8.327 -0.736 1.00 0.00 C ATOM 0 H LEU A 67 -5.782 12.465 -3.353 1.00 0.00 H new ATOM 0 HA LEU A 67 -3.767 10.646 -2.888 1.00 0.00 H new ATOM 0 HB2 LEU A 67 -5.559 11.443 -1.352 1.00 0.00 H new ATOM 0 HB3 LEU A 67 -6.654 10.312 -2.122 1.00 0.00 H new ATOM 0 HG LEU A 67 -4.282 8.893 -1.356 1.00 0.00 H new ATOM 0 HD11 LEU A 67 -4.376 9.178 1.085 1.00 0.00 H new ATOM 0 HD12 LEU A 67 -3.869 10.669 0.256 1.00 0.00 H new ATOM 0 HD13 LEU A 67 -5.529 10.518 0.879 1.00 0.00 H new ATOM 0 HD21 LEU A 67 -5.881 7.558 -0.049 1.00 0.00 H new ATOM 0 HD22 LEU A 67 -7.133 8.791 -0.330 1.00 0.00 H new ATOM 0 HD23 LEU A 67 -6.464 7.875 -1.701 1.00 0.00 H new ATOM 870 N VAL A 68 -6.124 9.385 -4.790 1.00 0.00 N ATOM 871 CA VAL A 68 -6.418 8.306 -5.717 1.00 0.00 C ATOM 872 C VAL A 68 -5.196 8.051 -6.601 1.00 0.00 C ATOM 873 O VAL A 68 -4.756 6.912 -6.745 1.00 0.00 O ATOM 874 CB VAL A 68 -7.679 8.634 -6.520 1.00 0.00 C ATOM 875 CG1 VAL A 68 -8.009 7.511 -7.505 1.00 0.00 C ATOM 876 CG2 VAL A 68 -8.862 8.915 -5.592 1.00 0.00 C ATOM 0 H VAL A 68 -6.856 10.091 -4.711 1.00 0.00 H new ATOM 0 HA VAL A 68 -6.625 7.383 -5.175 1.00 0.00 H new ATOM 0 HB VAL A 68 -7.484 9.538 -7.096 1.00 0.00 H new ATOM 0 HG11 VAL A 68 -8.909 7.769 -8.063 1.00 0.00 H new ATOM 0 HG12 VAL A 68 -7.178 7.379 -8.198 1.00 0.00 H new ATOM 0 HG13 VAL A 68 -8.175 6.584 -6.957 1.00 0.00 H new ATOM 0 HG21 VAL A 68 -9.745 9.145 -6.188 1.00 0.00 H new ATOM 0 HG22 VAL A 68 -9.058 8.037 -4.977 1.00 0.00 H new ATOM 0 HG23 VAL A 68 -8.627 9.763 -4.949 1.00 0.00 H new ATOM 886 N ALA A 69 -4.681 9.132 -7.169 1.00 0.00 N ATOM 887 CA ALA A 69 -3.518 9.040 -8.035 1.00 0.00 C ATOM 888 C ALA A 69 -2.390 8.322 -7.292 1.00 0.00 C ATOM 889 O ALA A 69 -1.708 7.472 -7.862 1.00 0.00 O ATOM 890 CB ALA A 69 -3.113 10.441 -8.497 1.00 0.00 C ATOM 0 H ALA A 69 -5.048 10.076 -7.046 1.00 0.00 H new ATOM 0 HA ALA A 69 -3.749 8.457 -8.927 1.00 0.00 H new ATOM 0 HB1 ALA A 69 -2.240 10.372 -9.147 1.00 0.00 H new ATOM 0 HB2 ALA A 69 -3.938 10.896 -9.045 1.00 0.00 H new ATOM 0 HB3 ALA A 69 -2.871 11.055 -7.629 1.00 0.00 H new ATOM 896 N ILE A 70 -2.227 8.691 -6.030 1.00 0.00 N ATOM 897 CA ILE A 70 -1.193 8.094 -5.203 1.00 0.00 C ATOM 898 C ILE A 70 -1.476 6.599 -5.040 1.00 0.00 C ATOM 899 O ILE A 70 -0.568 5.776 -5.147 1.00 0.00 O ATOM 900 CB ILE A 70 -1.069 8.844 -3.875 1.00 0.00 C ATOM 901 CG1 ILE A 70 -0.243 10.121 -4.042 1.00 0.00 C ATOM 902 CG2 ILE A 70 -0.502 7.934 -2.782 1.00 0.00 C ATOM 903 CD1 ILE A 70 -0.695 11.199 -3.054 1.00 0.00 C ATOM 0 H ILE A 70 -2.794 9.397 -5.560 1.00 0.00 H new ATOM 0 HA ILE A 70 -0.220 8.184 -5.686 1.00 0.00 H new ATOM 0 HB ILE A 70 -2.068 9.145 -3.558 1.00 0.00 H new ATOM 0 HG12 ILE A 70 0.813 9.899 -3.886 1.00 0.00 H new ATOM 0 HG13 ILE A 70 -0.343 10.492 -5.062 1.00 0.00 H new ATOM 0 HG21 ILE A 70 -0.424 8.491 -1.849 1.00 0.00 H new ATOM 0 HG22 ILE A 70 -1.164 7.080 -2.640 1.00 0.00 H new ATOM 0 HG23 ILE A 70 0.486 7.582 -3.078 1.00 0.00 H new ATOM 0 HD11 ILE A 70 -0.092 12.096 -3.193 1.00 0.00 H new ATOM 0 HD12 ILE A 70 -1.744 11.436 -3.229 1.00 0.00 H new ATOM 0 HD13 ILE A 70 -0.571 10.833 -2.035 1.00 0.00 H new ATOM 915 N LEU A 71 -2.740 6.293 -4.785 1.00 0.00 N ATOM 916 CA LEU A 71 -3.155 4.912 -4.607 1.00 0.00 C ATOM 917 C LEU A 71 -2.832 4.120 -5.876 1.00 0.00 C ATOM 918 O LEU A 71 -2.374 2.981 -5.801 1.00 0.00 O ATOM 919 CB LEU A 71 -4.627 4.843 -4.196 1.00 0.00 C ATOM 920 CG LEU A 71 -4.987 3.767 -3.170 1.00 0.00 C ATOM 921 CD1 LEU A 71 -5.838 4.351 -2.040 1.00 0.00 C ATOM 922 CD2 LEU A 71 -5.668 2.574 -3.842 1.00 0.00 C ATOM 0 H LEU A 71 -3.490 6.978 -4.697 1.00 0.00 H new ATOM 0 HA LEU A 71 -2.599 4.449 -3.792 1.00 0.00 H new ATOM 0 HB2 LEU A 71 -4.917 5.813 -3.792 1.00 0.00 H new ATOM 0 HB3 LEU A 71 -5.226 4.678 -5.091 1.00 0.00 H new ATOM 0 HG LEU A 71 -4.064 3.400 -2.722 1.00 0.00 H new ATOM 0 HD11 LEU A 71 -6.080 3.566 -1.324 1.00 0.00 H new ATOM 0 HD12 LEU A 71 -5.282 5.142 -1.537 1.00 0.00 H new ATOM 0 HD13 LEU A 71 -6.759 4.762 -2.453 1.00 0.00 H new ATOM 0 HD21 LEU A 71 -5.913 1.824 -3.090 1.00 0.00 H new ATOM 0 HD22 LEU A 71 -6.582 2.907 -4.334 1.00 0.00 H new ATOM 0 HD23 LEU A 71 -4.995 2.140 -4.581 1.00 0.00 H new ATOM 934 N GLN A 72 -3.085 4.754 -7.011 1.00 0.00 N ATOM 935 CA GLN A 72 -2.827 4.122 -8.294 1.00 0.00 C ATOM 936 C GLN A 72 -1.351 3.738 -8.409 1.00 0.00 C ATOM 937 O GLN A 72 -1.021 2.560 -8.543 1.00 0.00 O ATOM 938 CB GLN A 72 -3.248 5.034 -9.448 1.00 0.00 C ATOM 939 CG GLN A 72 -4.513 4.508 -10.130 1.00 0.00 C ATOM 940 CD GLN A 72 -4.833 5.315 -11.390 1.00 0.00 C ATOM 941 OE1 GLN A 72 -4.275 6.370 -11.640 1.00 0.00 O ATOM 942 NE2 GLN A 72 -5.760 4.761 -12.166 1.00 0.00 N ATOM 0 H GLN A 72 -3.466 5.698 -7.069 1.00 0.00 H new ATOM 0 HA GLN A 72 -3.424 3.212 -8.356 1.00 0.00 H new ATOM 0 HB2 GLN A 72 -3.425 6.042 -9.073 1.00 0.00 H new ATOM 0 HB3 GLN A 72 -2.440 5.102 -10.176 1.00 0.00 H new ATOM 0 HG2 GLN A 72 -4.380 3.458 -10.390 1.00 0.00 H new ATOM 0 HG3 GLN A 72 -5.353 4.561 -9.437 1.00 0.00 H new ATOM 0 HE21 GLN A 72 -6.187 3.875 -11.897 1.00 0.00 H new ATOM 0 HE22 GLN A 72 -6.044 5.222 -13.030 1.00 0.00 H new ATOM 951 N SER A 73 -0.501 4.753 -8.354 1.00 0.00 N ATOM 952 CA SER A 73 0.932 4.536 -8.451 1.00 0.00 C ATOM 953 C SER A 73 1.415 3.696 -7.267 1.00 0.00 C ATOM 954 O SER A 73 1.738 2.520 -7.427 1.00 0.00 O ATOM 955 CB SER A 73 1.688 5.865 -8.502 1.00 0.00 C ATOM 956 OG SER A 73 1.864 6.329 -9.838 1.00 0.00 O ATOM 0 H SER A 73 -0.778 5.728 -8.243 1.00 0.00 H new ATOM 0 HA SER A 73 1.135 3.998 -9.377 1.00 0.00 H new ATOM 0 HB2 SER A 73 1.143 6.614 -7.927 1.00 0.00 H new ATOM 0 HB3 SER A 73 2.662 5.746 -8.028 1.00 0.00 H new ATOM 0 HG SER A 73 2.349 7.180 -9.827 1.00 0.00 H new ATOM 962 N VAL A 74 1.449 4.332 -6.105 1.00 0.00 N ATOM 963 CA VAL A 74 1.887 3.658 -4.895 1.00 0.00 C ATOM 964 C VAL A 74 1.290 2.250 -4.856 1.00 0.00 C ATOM 965 O VAL A 74 1.878 1.338 -4.276 1.00 0.00 O ATOM 966 CB VAL A 74 1.522 4.496 -3.668 1.00 0.00 C ATOM 967 CG1 VAL A 74 2.000 3.820 -2.381 1.00 0.00 C ATOM 968 CG2 VAL A 74 2.086 5.914 -3.785 1.00 0.00 C ATOM 0 H VAL A 74 1.180 5.307 -5.976 1.00 0.00 H new ATOM 0 HA VAL A 74 2.972 3.552 -4.889 1.00 0.00 H new ATOM 0 HB VAL A 74 0.435 4.570 -3.624 1.00 0.00 H new ATOM 0 HG11 VAL A 74 1.728 4.436 -1.524 1.00 0.00 H new ATOM 0 HG12 VAL A 74 1.530 2.841 -2.288 1.00 0.00 H new ATOM 0 HG13 VAL A 74 3.083 3.701 -2.413 1.00 0.00 H new ATOM 0 HG21 VAL A 74 1.812 6.489 -2.900 1.00 0.00 H new ATOM 0 HG22 VAL A 74 3.172 5.868 -3.866 1.00 0.00 H new ATOM 0 HG23 VAL A 74 1.676 6.397 -4.672 1.00 0.00 H new ATOM 978 N GLY A 75 0.130 2.116 -5.482 1.00 0.00 N ATOM 979 CA GLY A 75 -0.553 0.834 -5.526 1.00 0.00 C ATOM 980 C GLY A 75 0.255 -0.190 -6.325 1.00 0.00 C ATOM 981 O GLY A 75 0.770 -1.155 -5.762 1.00 0.00 O ATOM 0 H GLY A 75 -0.354 2.874 -5.963 1.00 0.00 H new ATOM 0 HA2 GLY A 75 -0.711 0.467 -4.512 1.00 0.00 H new ATOM 0 HA3 GLY A 75 -1.538 0.958 -5.977 1.00 0.00 H new ATOM 985 N ALA A 76 0.341 0.054 -7.624 1.00 0.00 N ATOM 986 CA ALA A 76 1.078 -0.835 -8.505 1.00 0.00 C ATOM 987 C ALA A 76 2.552 -0.848 -8.094 1.00 0.00 C ATOM 988 O ALA A 76 3.111 -1.906 -7.809 1.00 0.00 O ATOM 989 CB ALA A 76 0.882 -0.393 -9.957 1.00 0.00 C ATOM 0 H ALA A 76 -0.088 0.855 -8.088 1.00 0.00 H new ATOM 0 HA ALA A 76 0.703 -1.855 -8.421 1.00 0.00 H new ATOM 0 HB1 ALA A 76 1.435 -1.060 -10.618 1.00 0.00 H new ATOM 0 HB2 ALA A 76 -0.178 -0.430 -10.209 1.00 0.00 H new ATOM 0 HB3 ALA A 76 1.249 0.626 -10.080 1.00 0.00 H new ATOM 995 N ALA A 77 3.139 0.339 -8.075 1.00 0.00 N ATOM 996 CA ALA A 77 4.536 0.478 -7.702 1.00 0.00 C ATOM 997 C ALA A 77 4.779 -0.241 -6.374 1.00 0.00 C ATOM 998 O ALA A 77 5.747 -0.989 -6.237 1.00 0.00 O ATOM 999 CB ALA A 77 4.903 1.962 -7.638 1.00 0.00 C ATOM 0 H ALA A 77 2.672 1.214 -8.312 1.00 0.00 H new ATOM 0 HA ALA A 77 5.180 0.015 -8.450 1.00 0.00 H new ATOM 0 HB1 ALA A 77 5.951 2.066 -7.358 1.00 0.00 H new ATOM 0 HB2 ALA A 77 4.741 2.419 -8.614 1.00 0.00 H new ATOM 0 HB3 ALA A 77 4.278 2.460 -6.896 1.00 0.00 H new ATOM 1005 N GLY A 78 3.885 0.010 -5.429 1.00 0.00 N ATOM 1006 CA GLY A 78 3.990 -0.604 -4.117 1.00 0.00 C ATOM 1007 C GLY A 78 3.880 -2.127 -4.213 1.00 0.00 C ATOM 1008 O GLY A 78 4.877 -2.835 -4.081 1.00 0.00 O ATOM 0 H GLY A 78 3.084 0.631 -5.546 1.00 0.00 H new ATOM 0 HA2 GLY A 78 4.942 -0.333 -3.660 1.00 0.00 H new ATOM 0 HA3 GLY A 78 3.203 -0.219 -3.468 1.00 0.00 H new ATOM 1012 N LEU A 79 2.659 -2.587 -4.443 1.00 0.00 N ATOM 1013 CA LEU A 79 2.405 -4.013 -4.559 1.00 0.00 C ATOM 1014 C LEU A 79 3.535 -4.664 -5.360 1.00 0.00 C ATOM 1015 O LEU A 79 3.902 -5.809 -5.103 1.00 0.00 O ATOM 1016 CB LEU A 79 1.014 -4.264 -5.143 1.00 0.00 C ATOM 1017 CG LEU A 79 0.057 -5.080 -4.271 1.00 0.00 C ATOM 1018 CD1 LEU A 79 -1.230 -4.301 -3.993 1.00 0.00 C ATOM 1019 CD2 LEU A 79 -0.223 -6.447 -4.896 1.00 0.00 C ATOM 0 H LEU A 79 1.834 -1.997 -4.552 1.00 0.00 H new ATOM 0 HA LEU A 79 2.401 -4.480 -3.574 1.00 0.00 H new ATOM 0 HB2 LEU A 79 0.550 -3.300 -5.352 1.00 0.00 H new ATOM 0 HB3 LEU A 79 1.130 -4.776 -6.098 1.00 0.00 H new ATOM 0 HG LEU A 79 0.538 -5.259 -3.310 1.00 0.00 H new ATOM 0 HD11 LEU A 79 -1.893 -4.903 -3.371 1.00 0.00 H new ATOM 0 HD12 LEU A 79 -0.989 -3.373 -3.474 1.00 0.00 H new ATOM 0 HD13 LEU A 79 -1.727 -4.071 -4.936 1.00 0.00 H new ATOM 0 HD21 LEU A 79 -0.906 -7.007 -4.256 1.00 0.00 H new ATOM 0 HD22 LEU A 79 -0.675 -6.312 -5.879 1.00 0.00 H new ATOM 0 HD23 LEU A 79 0.712 -6.998 -4.999 1.00 0.00 H new ATOM 1031 N SER A 80 4.055 -3.905 -6.313 1.00 0.00 N ATOM 1032 CA SER A 80 5.135 -4.393 -7.153 1.00 0.00 C ATOM 1033 C SER A 80 6.380 -4.658 -6.303 1.00 0.00 C ATOM 1034 O SER A 80 6.649 -5.799 -5.929 1.00 0.00 O ATOM 1035 CB SER A 80 5.457 -3.399 -8.270 1.00 0.00 C ATOM 1036 OG SER A 80 4.588 -3.553 -9.389 1.00 0.00 O ATOM 0 H SER A 80 3.748 -2.955 -6.522 1.00 0.00 H new ATOM 0 HA SER A 80 4.813 -5.326 -7.616 1.00 0.00 H new ATOM 0 HB2 SER A 80 5.376 -2.382 -7.885 1.00 0.00 H new ATOM 0 HB3 SER A 80 6.489 -3.537 -8.591 1.00 0.00 H new ATOM 0 HG SER A 80 3.788 -3.001 -9.261 1.00 0.00 H new ATOM 1042 N VAL A 81 7.105 -3.586 -6.023 1.00 0.00 N ATOM 1043 CA VAL A 81 8.315 -3.688 -5.224 1.00 0.00 C ATOM 1044 C VAL A 81 8.064 -4.632 -4.046 1.00 0.00 C ATOM 1045 O VAL A 81 8.990 -5.276 -3.555 1.00 0.00 O ATOM 1046 CB VAL A 81 8.773 -2.295 -4.787 1.00 0.00 C ATOM 1047 CG1 VAL A 81 7.854 -1.732 -3.701 1.00 0.00 C ATOM 1048 CG2 VAL A 81 10.228 -2.319 -4.317 1.00 0.00 C ATOM 0 H VAL A 81 6.878 -2.642 -6.335 1.00 0.00 H new ATOM 0 HA VAL A 81 9.128 -4.112 -5.814 1.00 0.00 H new ATOM 0 HB VAL A 81 8.712 -1.635 -5.652 1.00 0.00 H new ATOM 0 HG11 VAL A 81 8.201 -0.741 -3.408 1.00 0.00 H new ATOM 0 HG12 VAL A 81 6.837 -1.661 -4.086 1.00 0.00 H new ATOM 0 HG13 VAL A 81 7.868 -2.392 -2.834 1.00 0.00 H new ATOM 0 HG21 VAL A 81 10.528 -1.317 -4.012 1.00 0.00 H new ATOM 0 HG22 VAL A 81 10.326 -3.000 -3.472 1.00 0.00 H new ATOM 0 HG23 VAL A 81 10.868 -2.657 -5.132 1.00 0.00 H new ATOM 1058 N THR A 82 6.808 -4.683 -3.627 1.00 0.00 N ATOM 1059 CA THR A 82 6.425 -5.538 -2.516 1.00 0.00 C ATOM 1060 C THR A 82 6.654 -7.008 -2.870 1.00 0.00 C ATOM 1061 O THR A 82 7.689 -7.579 -2.529 1.00 0.00 O ATOM 1062 CB THR A 82 4.973 -5.219 -2.154 1.00 0.00 C ATOM 1063 OG1 THR A 82 5.004 -3.847 -1.771 1.00 0.00 O ATOM 1064 CG2 THR A 82 4.511 -5.948 -0.890 1.00 0.00 C ATOM 0 H THR A 82 6.043 -4.147 -4.036 1.00 0.00 H new ATOM 0 HA THR A 82 7.044 -5.348 -1.639 1.00 0.00 H new ATOM 0 HB THR A 82 4.324 -5.489 -2.987 1.00 0.00 H new ATOM 0 HG1 THR A 82 5.297 -3.302 -2.531 1.00 0.00 H new ATOM 0 HG21 THR A 82 3.474 -5.687 -0.678 1.00 0.00 H new ATOM 0 HG22 THR A 82 4.590 -7.025 -1.041 1.00 0.00 H new ATOM 0 HG23 THR A 82 5.139 -5.653 -0.049 1.00 0.00 H new ATOM 1072 N SER A 83 5.671 -7.580 -3.549 1.00 0.00 N ATOM 1073 CA SER A 83 5.752 -8.974 -3.954 1.00 0.00 C ATOM 1074 C SER A 83 7.171 -9.300 -4.423 1.00 0.00 C ATOM 1075 O SER A 83 7.714 -10.351 -4.085 1.00 0.00 O ATOM 1076 CB SER A 83 4.742 -9.286 -5.059 1.00 0.00 C ATOM 1077 OG SER A 83 4.828 -8.360 -6.139 1.00 0.00 O ATOM 0 H SER A 83 4.814 -7.104 -3.829 1.00 0.00 H new ATOM 0 HA SER A 83 5.509 -9.596 -3.092 1.00 0.00 H new ATOM 0 HB2 SER A 83 4.914 -10.295 -5.433 1.00 0.00 H new ATOM 0 HB3 SER A 83 3.734 -9.267 -4.645 1.00 0.00 H new ATOM 0 HG SER A 83 4.538 -7.475 -5.835 1.00 0.00 H new ATOM 1083 N LYS A 84 7.731 -8.380 -5.196 1.00 0.00 N ATOM 1084 CA LYS A 84 9.076 -8.557 -5.715 1.00 0.00 C ATOM 1085 C LYS A 84 10.017 -8.930 -4.567 1.00 0.00 C ATOM 1086 O LYS A 84 10.634 -9.994 -4.587 1.00 0.00 O ATOM 1087 CB LYS A 84 9.518 -7.316 -6.493 1.00 0.00 C ATOM 1088 CG LYS A 84 10.278 -7.706 -7.763 1.00 0.00 C ATOM 1089 CD LYS A 84 9.740 -6.949 -8.979 1.00 0.00 C ATOM 1090 CE LYS A 84 10.052 -7.701 -10.274 1.00 0.00 C ATOM 1091 NZ LYS A 84 9.948 -6.792 -11.438 1.00 0.00 N ATOM 0 H LYS A 84 7.277 -7.510 -5.475 1.00 0.00 H new ATOM 0 HA LYS A 84 9.103 -9.380 -6.430 1.00 0.00 H new ATOM 0 HB2 LYS A 84 8.646 -6.718 -6.756 1.00 0.00 H new ATOM 0 HB3 LYS A 84 10.153 -6.694 -5.862 1.00 0.00 H new ATOM 0 HG2 LYS A 84 11.339 -7.491 -7.637 1.00 0.00 H new ATOM 0 HG3 LYS A 84 10.188 -8.779 -7.930 1.00 0.00 H new ATOM 0 HD2 LYS A 84 8.662 -6.816 -8.882 1.00 0.00 H new ATOM 0 HD3 LYS A 84 10.182 -5.953 -9.017 1.00 0.00 H new ATOM 0 HE2 LYS A 84 11.055 -8.124 -10.224 1.00 0.00 H new ATOM 0 HE3 LYS A 84 9.360 -8.535 -10.393 1.00 0.00 H new ATOM 0 HZ1 LYS A 84 10.163 -7.318 -12.309 1.00 0.00 H new ATOM 0 HZ2 LYS A 84 8.983 -6.409 -11.494 1.00 0.00 H new ATOM 0 HZ3 LYS A 84 10.625 -6.010 -11.330 1.00 0.00 H new ATOM 1105 N VAL A 85 10.096 -8.034 -3.595 1.00 0.00 N ATOM 1106 CA VAL A 85 10.951 -8.256 -2.441 1.00 0.00 C ATOM 1107 C VAL A 85 10.555 -9.568 -1.763 1.00 0.00 C ATOM 1108 O VAL A 85 11.377 -10.205 -1.106 1.00 0.00 O ATOM 1109 CB VAL A 85 10.882 -7.051 -1.500 1.00 0.00 C ATOM 1110 CG1 VAL A 85 11.181 -5.751 -2.250 1.00 0.00 C ATOM 1111 CG2 VAL A 85 9.524 -6.980 -0.799 1.00 0.00 C ATOM 0 H VAL A 85 9.582 -7.153 -3.582 1.00 0.00 H new ATOM 0 HA VAL A 85 11.992 -8.352 -2.749 1.00 0.00 H new ATOM 0 HB VAL A 85 11.648 -7.179 -0.735 1.00 0.00 H new ATOM 0 HG11 VAL A 85 11.125 -4.911 -1.558 1.00 0.00 H new ATOM 0 HG12 VAL A 85 12.181 -5.801 -2.680 1.00 0.00 H new ATOM 0 HG13 VAL A 85 10.450 -5.614 -3.047 1.00 0.00 H new ATOM 0 HG21 VAL A 85 9.501 -6.115 -0.136 1.00 0.00 H new ATOM 0 HG22 VAL A 85 8.734 -6.887 -1.544 1.00 0.00 H new ATOM 0 HG23 VAL A 85 9.367 -7.888 -0.216 1.00 0.00 H new ATOM 1121 N ILE A 86 9.294 -9.934 -1.944 1.00 0.00 N ATOM 1122 CA ILE A 86 8.778 -11.159 -1.358 1.00 0.00 C ATOM 1123 C ILE A 86 9.253 -12.355 -2.186 1.00 0.00 C ATOM 1124 O ILE A 86 10.172 -13.067 -1.784 1.00 0.00 O ATOM 1125 CB ILE A 86 7.258 -11.082 -1.205 1.00 0.00 C ATOM 1126 CG1 ILE A 86 6.870 -10.183 -0.029 1.00 0.00 C ATOM 1127 CG2 ILE A 86 6.647 -12.479 -1.085 1.00 0.00 C ATOM 1128 CD1 ILE A 86 5.352 -10.145 0.154 1.00 0.00 C ATOM 0 H ILE A 86 8.614 -9.403 -2.489 1.00 0.00 H new ATOM 0 HA ILE A 86 9.170 -11.293 -0.350 1.00 0.00 H new ATOM 0 HB ILE A 86 6.847 -10.628 -2.107 1.00 0.00 H new ATOM 0 HG12 ILE A 86 7.341 -10.548 0.884 1.00 0.00 H new ATOM 0 HG13 ILE A 86 7.245 -9.174 -0.199 1.00 0.00 H new ATOM 0 HG21 ILE A 86 5.566 -12.395 -0.977 1.00 0.00 H new ATOM 0 HG22 ILE A 86 6.879 -13.056 -1.980 1.00 0.00 H new ATOM 0 HG23 ILE A 86 7.061 -12.983 -0.212 1.00 0.00 H new ATOM 0 HD11 ILE A 86 5.103 -9.499 0.996 1.00 0.00 H new ATOM 0 HD12 ILE A 86 4.886 -9.756 -0.751 1.00 0.00 H new ATOM 0 HD13 ILE A 86 4.984 -11.152 0.348 1.00 0.00 H new ATOM 1140 N GLY A 87 8.605 -12.539 -3.327 1.00 0.00 N ATOM 1141 CA GLY A 87 8.949 -13.636 -4.215 1.00 0.00 C ATOM 1142 C GLY A 87 7.996 -13.694 -5.410 1.00 0.00 C ATOM 1143 O GLY A 87 6.965 -14.364 -5.354 1.00 0.00 O ATOM 0 H GLY A 87 7.843 -11.946 -3.657 1.00 0.00 H new ATOM 0 HA2 GLY A 87 9.973 -13.515 -4.568 1.00 0.00 H new ATOM 0 HA3 GLY A 87 8.909 -14.578 -3.668 1.00 0.00 H new ATOM 1147 N GLY A 88 8.373 -12.984 -6.463 1.00 0.00 N ATOM 1148 CA GLY A 88 7.564 -12.947 -7.669 1.00 0.00 C ATOM 1149 C GLY A 88 6.072 -12.927 -7.329 1.00 0.00 C ATOM 1150 O GLY A 88 5.613 -12.060 -6.587 1.00 0.00 O ATOM 0 H GLY A 88 9.228 -12.430 -6.506 1.00 0.00 H new ATOM 0 HA2 GLY A 88 7.819 -12.064 -8.255 1.00 0.00 H new ATOM 0 HA3 GLY A 88 7.788 -13.816 -8.288 1.00 0.00 H new ATOM 1154 N PHE A 89 5.358 -13.893 -7.887 1.00 0.00 N ATOM 1155 CA PHE A 89 3.928 -13.998 -7.652 1.00 0.00 C ATOM 1156 C PHE A 89 3.509 -15.457 -7.459 1.00 0.00 C ATOM 1157 O PHE A 89 2.455 -15.872 -7.938 1.00 0.00 O ATOM 1158 CB PHE A 89 3.229 -13.438 -8.892 1.00 0.00 C ATOM 1159 CG PHE A 89 2.047 -12.519 -8.578 1.00 0.00 C ATOM 1160 CD1 PHE A 89 2.244 -11.374 -7.872 1.00 0.00 C ATOM 1161 CD2 PHE A 89 0.798 -12.847 -9.006 1.00 0.00 C ATOM 1162 CE1 PHE A 89 1.147 -10.521 -7.581 1.00 0.00 C ATOM 1163 CE2 PHE A 89 -0.299 -11.994 -8.715 1.00 0.00 C ATOM 1164 CZ PHE A 89 -0.102 -10.849 -8.009 1.00 0.00 C ATOM 0 H PHE A 89 5.743 -14.610 -8.501 1.00 0.00 H new ATOM 0 HA PHE A 89 3.658 -13.449 -6.750 1.00 0.00 H new ATOM 0 HB2 PHE A 89 3.956 -12.887 -9.489 1.00 0.00 H new ATOM 0 HB3 PHE A 89 2.878 -14.268 -9.505 1.00 0.00 H new ATOM 0 HD1 PHE A 89 3.235 -11.113 -7.532 1.00 0.00 H new ATOM 0 HD2 PHE A 89 0.641 -13.756 -9.567 1.00 0.00 H new ATOM 0 HE1 PHE A 89 1.304 -9.612 -7.020 1.00 0.00 H new ATOM 0 HE2 PHE A 89 -1.290 -12.255 -9.055 1.00 0.00 H new ATOM 0 HZ PHE A 89 -0.937 -10.200 -7.788 1.00 0.00 H new ATOM 1174 N ALA A 90 4.357 -16.195 -6.757 1.00 0.00 N ATOM 1175 CA ALA A 90 4.088 -17.598 -6.496 1.00 0.00 C ATOM 1176 C ALA A 90 4.925 -18.059 -5.301 1.00 0.00 C ATOM 1177 O ALA A 90 6.152 -18.110 -5.380 1.00 0.00 O ATOM 1178 CB ALA A 90 4.372 -18.417 -7.757 1.00 0.00 C ATOM 0 H ALA A 90 5.230 -15.847 -6.361 1.00 0.00 H new ATOM 0 HA ALA A 90 3.039 -17.746 -6.241 1.00 0.00 H new ATOM 0 HB1 ALA A 90 4.170 -19.470 -7.560 1.00 0.00 H new ATOM 0 HB2 ALA A 90 3.732 -18.070 -8.568 1.00 0.00 H new ATOM 0 HB3 ALA A 90 5.417 -18.295 -8.042 1.00 0.00 H new ATOM 1184 N GLY A 91 4.229 -18.384 -4.221 1.00 0.00 N ATOM 1185 CA GLY A 91 4.892 -18.840 -3.012 1.00 0.00 C ATOM 1186 C GLY A 91 4.393 -18.068 -1.789 1.00 0.00 C ATOM 1187 O GLY A 91 3.851 -16.972 -1.921 1.00 0.00 O ATOM 0 H GLY A 91 3.212 -18.340 -4.159 1.00 0.00 H new ATOM 0 HA2 GLY A 91 4.710 -19.906 -2.873 1.00 0.00 H new ATOM 0 HA3 GLY A 91 5.970 -18.711 -3.113 1.00 0.00 H new ATOM 1191 N THR A 92 4.594 -18.670 -0.626 1.00 0.00 N ATOM 1192 CA THR A 92 4.171 -18.053 0.620 1.00 0.00 C ATOM 1193 C THR A 92 5.337 -17.994 1.609 1.00 0.00 C ATOM 1194 O THR A 92 5.339 -18.703 2.614 1.00 0.00 O ATOM 1195 CB THR A 92 2.965 -18.832 1.148 1.00 0.00 C ATOM 1196 OG1 THR A 92 3.462 -20.154 1.338 1.00 0.00 O ATOM 1197 CG2 THR A 92 1.866 -18.995 0.095 1.00 0.00 C ATOM 0 H THR A 92 5.044 -19.579 -0.520 1.00 0.00 H new ATOM 0 HA THR A 92 3.865 -17.018 0.465 1.00 0.00 H new ATOM 0 HB THR A 92 2.558 -18.322 2.021 1.00 0.00 H new ATOM 0 HG1 THR A 92 4.101 -20.160 2.081 1.00 0.00 H new ATOM 0 HG21 THR A 92 1.034 -19.555 0.521 1.00 0.00 H new ATOM 0 HG22 THR A 92 1.518 -18.012 -0.222 1.00 0.00 H new ATOM 0 HG23 THR A 92 2.263 -19.534 -0.765 1.00 0.00 H new ATOM 1205 N ALA A 93 6.300 -17.142 1.289 1.00 0.00 N ATOM 1206 CA ALA A 93 7.469 -16.981 2.137 1.00 0.00 C ATOM 1207 C ALA A 93 7.018 -16.715 3.574 1.00 0.00 C ATOM 1208 O ALA A 93 7.284 -17.515 4.470 1.00 0.00 O ATOM 1209 CB ALA A 93 8.349 -15.858 1.585 1.00 0.00 C ATOM 0 H ALA A 93 6.295 -16.556 0.454 1.00 0.00 H new ATOM 0 HA ALA A 93 8.068 -17.892 2.143 1.00 0.00 H new ATOM 0 HB1 ALA A 93 9.226 -15.737 2.221 1.00 0.00 H new ATOM 0 HB2 ALA A 93 8.667 -16.109 0.573 1.00 0.00 H new ATOM 0 HB3 ALA A 93 7.782 -14.927 1.567 1.00 0.00 H new ATOM 1215 N LEU A 94 6.343 -15.589 3.750 1.00 0.00 N ATOM 1216 CA LEU A 94 5.853 -15.207 5.064 1.00 0.00 C ATOM 1217 C LEU A 94 6.968 -15.398 6.095 1.00 0.00 C ATOM 1218 O LEU A 94 6.828 -16.188 7.027 1.00 0.00 O ATOM 1219 CB LEU A 94 4.570 -15.970 5.399 1.00 0.00 C ATOM 1220 CG LEU A 94 3.272 -15.161 5.332 1.00 0.00 C ATOM 1221 CD1 LEU A 94 2.089 -16.054 4.954 1.00 0.00 C ATOM 1222 CD2 LEU A 94 3.028 -14.408 6.641 1.00 0.00 C ATOM 0 H LEU A 94 6.124 -14.928 3.004 1.00 0.00 H new ATOM 0 HA LEU A 94 5.583 -14.151 5.078 1.00 0.00 H new ATOM 0 HB2 LEU A 94 4.484 -16.815 4.716 1.00 0.00 H new ATOM 0 HB3 LEU A 94 4.667 -16.381 6.404 1.00 0.00 H new ATOM 0 HG LEU A 94 3.375 -14.413 4.545 1.00 0.00 H new ATOM 0 HD11 LEU A 94 1.179 -15.455 4.913 1.00 0.00 H new ATOM 0 HD12 LEU A 94 2.271 -16.505 3.978 1.00 0.00 H new ATOM 0 HD13 LEU A 94 1.973 -16.840 5.701 1.00 0.00 H new ATOM 0 HD21 LEU A 94 2.100 -13.841 6.567 1.00 0.00 H new ATOM 0 HD22 LEU A 94 2.954 -15.121 7.462 1.00 0.00 H new ATOM 0 HD23 LEU A 94 3.856 -13.725 6.828 1.00 0.00 H new ATOM 1234 N GLY A 95 8.050 -14.660 5.892 1.00 0.00 N ATOM 1235 CA GLY A 95 9.188 -14.737 6.792 1.00 0.00 C ATOM 1236 C GLY A 95 10.502 -14.788 6.011 1.00 0.00 C ATOM 1237 O GLY A 95 10.503 -14.701 4.784 1.00 0.00 O ATOM 0 H GLY A 95 8.162 -14.006 5.117 1.00 0.00 H new ATOM 0 HA2 GLY A 95 9.189 -13.873 7.457 1.00 0.00 H new ATOM 0 HA3 GLY A 95 9.100 -15.623 7.421 1.00 0.00 H new ATOM 1241 N ALA A 96 11.590 -14.929 6.754 1.00 0.00 N ATOM 1242 CA ALA A 96 12.908 -14.993 6.146 1.00 0.00 C ATOM 1243 C ALA A 96 13.152 -13.720 5.332 1.00 0.00 C ATOM 1244 O ALA A 96 12.207 -13.021 4.968 1.00 0.00 O ATOM 1245 CB ALA A 96 13.018 -16.259 5.294 1.00 0.00 C ATOM 0 H ALA A 96 11.586 -15.001 7.771 1.00 0.00 H new ATOM 0 HA ALA A 96 13.681 -15.048 6.913 1.00 0.00 H new ATOM 0 HB1 ALA A 96 14.007 -16.306 4.838 1.00 0.00 H new ATOM 0 HB2 ALA A 96 12.866 -17.136 5.924 1.00 0.00 H new ATOM 0 HB3 ALA A 96 12.259 -16.238 4.512 1.00 0.00 H new ATOM 1251 N TRP A 97 14.424 -13.458 5.069 1.00 0.00 N ATOM 1252 CA TRP A 97 14.803 -12.282 4.305 1.00 0.00 C ATOM 1253 C TRP A 97 15.365 -12.752 2.962 1.00 0.00 C ATOM 1254 O TRP A 97 16.523 -13.158 2.877 1.00 0.00 O ATOM 1255 CB TRP A 97 15.784 -11.410 5.091 1.00 0.00 C ATOM 1256 CG TRP A 97 16.917 -12.194 5.758 1.00 0.00 C ATOM 1257 CD1 TRP A 97 18.127 -12.480 5.260 1.00 0.00 C ATOM 1258 CD2 TRP A 97 16.894 -12.783 7.075 1.00 0.00 C ATOM 1259 NE1 TRP A 97 18.883 -13.208 6.156 1.00 0.00 N ATOM 1260 CE2 TRP A 97 18.110 -13.398 7.295 1.00 0.00 C ATOM 1261 CE3 TRP A 97 15.880 -12.796 8.049 1.00 0.00 C ATOM 1262 CZ2 TRP A 97 18.426 -14.072 8.481 1.00 0.00 C ATOM 1263 CZ3 TRP A 97 16.211 -13.474 9.229 1.00 0.00 C ATOM 1264 CH2 TRP A 97 17.431 -14.098 9.465 1.00 0.00 C ATOM 0 H TRP A 97 15.205 -14.040 5.372 1.00 0.00 H new ATOM 0 HA TRP A 97 13.936 -11.648 4.117 1.00 0.00 H new ATOM 0 HB2 TRP A 97 16.216 -10.669 4.418 1.00 0.00 H new ATOM 0 HB3 TRP A 97 15.235 -10.863 5.857 1.00 0.00 H new ATOM 0 HD1 TRP A 97 18.468 -12.179 4.281 1.00 0.00 H new ATOM 0 HE1 TRP A 97 19.835 -13.545 6.009 1.00 0.00 H new ATOM 0 HE3 TRP A 97 14.922 -12.321 7.899 1.00 0.00 H new ATOM 0 HZ2 TRP A 97 19.385 -14.546 8.628 1.00 0.00 H new ATOM 0 HZ3 TRP A 97 15.467 -13.515 10.010 1.00 0.00 H new ATOM 0 HH2 TRP A 97 17.610 -14.601 10.404 1.00 0.00 H new ATOM 1275 N LEU A 98 14.519 -12.682 1.945 1.00 0.00 N ATOM 1276 CA LEU A 98 14.916 -13.096 0.610 1.00 0.00 C ATOM 1277 C LEU A 98 15.086 -14.616 0.581 1.00 0.00 C ATOM 1278 O LEU A 98 15.517 -15.215 1.565 1.00 0.00 O ATOM 1279 CB LEU A 98 16.162 -12.329 0.161 1.00 0.00 C ATOM 1280 CG LEU A 98 16.550 -12.484 -1.311 1.00 0.00 C ATOM 1281 CD1 LEU A 98 15.602 -11.692 -2.214 1.00 0.00 C ATOM 1282 CD2 LEU A 98 18.013 -12.096 -1.536 1.00 0.00 C ATOM 0 H LEU A 98 13.559 -12.344 2.019 1.00 0.00 H new ATOM 0 HA LEU A 98 14.139 -12.849 -0.113 1.00 0.00 H new ATOM 0 HB2 LEU A 98 16.006 -11.270 0.366 1.00 0.00 H new ATOM 0 HB3 LEU A 98 17.004 -12.651 0.774 1.00 0.00 H new ATOM 0 HG LEU A 98 16.450 -13.535 -1.582 1.00 0.00 H new ATOM 0 HD11 LEU A 98 15.900 -11.819 -3.255 1.00 0.00 H new ATOM 0 HD12 LEU A 98 14.583 -12.057 -2.081 1.00 0.00 H new ATOM 0 HD13 LEU A 98 15.646 -10.635 -1.950 1.00 0.00 H new ATOM 0 HD21 LEU A 98 18.263 -12.215 -2.590 1.00 0.00 H new ATOM 0 HD22 LEU A 98 18.163 -11.057 -1.243 1.00 0.00 H new ATOM 0 HD23 LEU A 98 18.656 -12.739 -0.936 1.00 0.00 H new ATOM 1294 N GLY A 99 14.739 -15.196 -0.558 1.00 0.00 N ATOM 1295 CA GLY A 99 14.847 -16.635 -0.728 1.00 0.00 C ATOM 1296 C GLY A 99 16.043 -16.994 -1.612 1.00 0.00 C ATOM 1297 O GLY A 99 17.138 -17.243 -1.110 1.00 0.00 O ATOM 0 H GLY A 99 14.383 -14.696 -1.372 1.00 0.00 H new ATOM 0 HA2 GLY A 99 14.953 -17.113 0.246 1.00 0.00 H new ATOM 0 HA3 GLY A 99 13.931 -17.022 -1.174 1.00 0.00 H new ATOM 1301 N SER A 100 15.793 -17.010 -2.913 1.00 0.00 N ATOM 1302 CA SER A 100 16.836 -17.334 -3.872 1.00 0.00 C ATOM 1303 C SER A 100 17.556 -16.058 -4.313 1.00 0.00 C ATOM 1304 O SER A 100 17.002 -14.965 -4.220 1.00 0.00 O ATOM 1305 CB SER A 100 16.260 -18.065 -5.086 1.00 0.00 C ATOM 1306 OG SER A 100 15.928 -19.418 -4.786 1.00 0.00 O ATOM 0 H SER A 100 14.883 -16.804 -3.326 1.00 0.00 H new ATOM 0 HA SER A 100 17.552 -17.998 -3.388 1.00 0.00 H new ATOM 0 HB2 SER A 100 15.370 -17.542 -5.435 1.00 0.00 H new ATOM 0 HB3 SER A 100 16.984 -18.041 -5.901 1.00 0.00 H new ATOM 0 HG SER A 100 15.562 -19.850 -5.586 1.00 0.00 H new ATOM 1312 N PRO A 101 18.814 -16.246 -4.796 1.00 0.00 N ATOM 1313 CA PRO A 101 19.616 -15.124 -5.252 1.00 0.00 C ATOM 1314 C PRO A 101 19.131 -14.620 -6.613 1.00 0.00 C ATOM 1315 O PRO A 101 18.447 -15.341 -7.337 1.00 0.00 O ATOM 1316 CB PRO A 101 21.042 -15.647 -5.286 1.00 0.00 C ATOM 1317 CG PRO A 101 20.930 -17.163 -5.297 1.00 0.00 C ATOM 1318 CD PRO A 101 19.503 -17.527 -4.920 1.00 0.00 C ATOM 0 HA PRO A 101 19.540 -14.258 -4.594 1.00 0.00 H new ATOM 0 HB2 PRO A 101 21.569 -15.288 -6.170 1.00 0.00 H new ATOM 0 HB3 PRO A 101 21.605 -15.303 -4.418 1.00 0.00 H new ATOM 0 HG2 PRO A 101 21.177 -17.557 -6.283 1.00 0.00 H new ATOM 0 HG3 PRO A 101 21.635 -17.603 -4.592 1.00 0.00 H new ATOM 0 HD2 PRO A 101 19.040 -18.154 -5.682 1.00 0.00 H new ATOM 0 HD3 PRO A 101 19.471 -18.086 -3.985 1.00 0.00 H new ATOM 1326 N PRO A 102 19.515 -13.354 -6.927 1.00 0.00 N ATOM 1327 CA PRO A 102 19.127 -12.746 -8.189 1.00 0.00 C ATOM 1328 C PRO A 102 19.945 -13.319 -9.348 1.00 0.00 C ATOM 1329 O PRO A 102 21.104 -13.691 -9.171 1.00 0.00 O ATOM 1330 CB PRO A 102 19.343 -11.255 -7.989 1.00 0.00 C ATOM 1331 CG PRO A 102 20.277 -11.125 -6.797 1.00 0.00 C ATOM 1332 CD PRO A 102 20.326 -12.471 -6.094 1.00 0.00 C ATOM 0 HA PRO A 102 18.090 -12.953 -8.455 1.00 0.00 H new ATOM 0 HB2 PRO A 102 19.780 -10.801 -8.879 1.00 0.00 H new ATOM 0 HB3 PRO A 102 18.398 -10.745 -7.802 1.00 0.00 H new ATOM 0 HG2 PRO A 102 21.274 -10.829 -7.124 1.00 0.00 H new ATOM 0 HG3 PRO A 102 19.922 -10.352 -6.116 1.00 0.00 H new ATOM 0 HD2 PRO A 102 21.349 -12.836 -6.009 1.00 0.00 H new ATOM 0 HD3 PRO A 102 19.927 -12.404 -5.082 1.00 0.00 H new ATOM 1340 N SER A 103 19.309 -13.372 -10.509 1.00 0.00 N ATOM 1341 CA SER A 103 19.963 -13.894 -11.697 1.00 0.00 C ATOM 1342 C SER A 103 21.395 -13.363 -11.782 1.00 0.00 C ATOM 1343 O SER A 103 22.347 -14.141 -11.823 1.00 0.00 O ATOM 1344 CB SER A 103 19.184 -13.524 -12.962 1.00 0.00 C ATOM 1345 OG SER A 103 18.408 -14.615 -13.450 1.00 0.00 O ATOM 0 H SER A 103 18.348 -13.062 -10.652 1.00 0.00 H new ATOM 0 HA SER A 103 19.989 -14.981 -11.623 1.00 0.00 H new ATOM 0 HB2 SER A 103 18.529 -12.679 -12.750 1.00 0.00 H new ATOM 0 HB3 SER A 103 19.881 -13.200 -13.735 1.00 0.00 H new ATOM 0 HG SER A 103 17.925 -14.338 -14.256 1.00 0.00 H new ATOM 1351 N SER A 104 21.503 -12.043 -11.805 1.00 0.00 N ATOM 1352 CA SER A 104 22.803 -11.399 -11.883 1.00 0.00 C ATOM 1353 C SER A 104 23.240 -10.931 -10.494 1.00 0.00 C ATOM 1354 O SER A 104 24.212 -11.443 -9.940 1.00 0.00 O ATOM 1355 CB SER A 104 22.776 -10.219 -12.857 1.00 0.00 C ATOM 1356 OG SER A 104 22.616 -10.645 -14.207 1.00 0.00 O ATOM 0 H SER A 104 20.711 -11.401 -11.771 1.00 0.00 H new ATOM 0 HA SER A 104 23.523 -12.127 -12.257 1.00 0.00 H new ATOM 0 HB2 SER A 104 21.960 -9.547 -12.590 1.00 0.00 H new ATOM 0 HB3 SER A 104 23.701 -9.650 -12.763 1.00 0.00 H new ATOM 0 HG SER A 104 22.602 -9.863 -14.797 1.00 0.00 H new TER 1362 SER A 104