USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 619 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 Single : A 1 MET CE :methyl -105:sc= -1.76! (180deg=-3.52!) USER MOD Single : A 1 MET N :NH3+ -108:sc= 0.281 (180deg=-2.04!) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ -158:sc= -0.0399 (180deg=-0.343) USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 18 LYS NZ :NH3+ -154:sc= 0.506 (180deg=0.00402) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= -0.319 K(o=-0.32,f=-3.9!) USER MOD Single : A 23 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 24 SER OG : rot 180:sc= 0 USER MOD Single : A 25 TYR OH : rot 180:sc= 0 USER MOD Single : A 28 GLN : amide:sc= -0.0241 X(o=-0.024,f=-0.29) USER MOD Single : A 30 LYS NZ :NH3+ -157:sc= -0.001 (180deg=-0.562) USER MOD Single : A 32 TYR OH : rot 180:sc= 0 USER MOD Single : A 34 THR OG1 : rot 180:sc= 0 USER MOD Single : A 36 LYS NZ :NH3+ 166:sc= 0 (180deg=-0.153) USER MOD Single : A 39 LYS NZ :NH3+ -176:sc= 0 (180deg=-0.0162) USER MOD Single : A 43 LYS NZ :NH3+ -119:sc= -0.63 (180deg=-3.73!) USER MOD Single : A 45 GLN :FLIP amide:sc= 0 F(o=-0.5,f=0) USER MOD Single : A 49 ASN : amide:sc= -0.478 X(o=-0.48,f=-0.02) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= -0.173 K(o=-0.17,f=-2.2!) USER MOD Single : A 57 HIS : no HD1:sc= -0.0906 K(o=-0.091,f=-0.67) USER MOD Single : A 59 SER OG : rot 96:sc= 1.32 USER MOD Single : A 62 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 64 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 66 ASN :FLIP amide:sc= -0.379 F(o=-1.9,f=-0.38) USER MOD Single : A 70 GLN : amide:sc= -2.14! C(o=-2.1!,f=-3.5!) USER MOD Single : A 73 SER OG : rot 160:sc= 0.569 USER MOD Single : A 77 GLN : amide:sc= 0 K(o=0,f=-1.1) USER MOD Single : A 81 TYR OH : rot 180:sc= 0 USER MOD Single : A 82 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 86 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 87 SER OG : rot 180:sc= 0 USER MOD Single : A 88 LYS NZ :NH3+ 179:sc= 0 (180deg=-0.0107) USER MOD Single : A 90 ASN : amide:sc=-0.00767 K(o=-0.0077,f=-0.87) USER MOD Single : A 95 TYR OH : rot 180:sc= 0 USER MOD Single : A 97 SER OG : rot 180:sc= 0 USER MOD Single : A 101 HIS : no HD1:sc= -0.443 X(o=-0.44,f=-0.11) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.0193 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -7.458 39.661 31.646 1.00 62.03 N ATOM 2 CA MET A 1 -7.482 38.248 31.286 1.00 64.33 C ATOM 3 C MET A 1 -8.559 37.506 32.070 1.00 44.32 C ATOM 4 O MET A 1 -8.775 37.773 33.253 1.00 64.43 O ATOM 5 CB MET A 1 -6.115 37.611 31.543 1.00 4.44 C ATOM 6 CG MET A 1 -5.072 37.965 30.497 1.00 70.24 C ATOM 7 SD MET A 1 -4.198 39.496 30.876 1.00 14.51 S ATOM 8 CE MET A 1 -5.007 40.635 29.755 1.00 71.00 C ATOM 0 H1 MET A 1 -7.842 40.226 30.862 1.00 62.03 H new ATOM 0 H2 MET A 1 -8.036 39.812 32.497 1.00 62.03 H new ATOM 0 H3 MET A 1 -6.478 39.954 31.836 1.00 62.03 H new ATOM 0 HA MET A 1 -7.715 38.173 30.224 1.00 64.33 H new ATOM 0 HB2 MET A 1 -5.756 37.925 32.523 1.00 4.44 H new ATOM 0 HB3 MET A 1 -6.229 36.528 31.578 1.00 4.44 H new ATOM 0 HG2 MET A 1 -4.352 37.151 30.418 1.00 70.24 H new ATOM 0 HG3 MET A 1 -5.556 38.059 29.525 1.00 70.24 H new ATOM 0 HE1 MET A 1 -4.345 40.853 28.917 1.00 71.00 H new ATOM 0 HE2 MET A 1 -5.928 40.186 29.382 1.00 71.00 H new ATOM 0 HE3 MET A 1 -5.241 41.560 30.282 1.00 71.00 H new ATOM 16 N SER A 2 -9.232 36.573 31.405 1.00 14.21 N ATOM 17 CA SER A 2 -10.289 35.794 32.039 1.00 52.53 C ATOM 18 C SER A 2 -11.439 36.696 32.480 1.00 31.23 C ATOM 19 O SER A 2 -11.457 37.190 33.608 1.00 0.14 O ATOM 20 CB SER A 2 -9.736 35.029 33.242 1.00 11.54 C ATOM 21 OG SER A 2 -10.677 34.083 33.723 1.00 23.04 O ATOM 0 H SER A 2 -9.064 36.338 30.427 1.00 14.21 H new ATOM 0 HA SER A 2 -10.669 35.081 31.308 1.00 52.53 H new ATOM 0 HB2 SER A 2 -8.815 34.519 32.960 1.00 11.54 H new ATOM 0 HB3 SER A 2 -9.482 35.730 34.037 1.00 11.54 H new ATOM 0 HG SER A 2 -10.298 33.606 34.491 1.00 23.04 H new ATOM 26 N ASP A 3 -12.395 36.906 31.583 1.00 23.21 N ATOM 27 CA ASP A 3 -13.549 37.747 31.878 1.00 24.33 C ATOM 28 C ASP A 3 -14.849 36.974 31.683 1.00 22.32 C ATOM 29 O ASP A 3 -15.053 36.334 30.653 1.00 13.12 O ATOM 30 CB ASP A 3 -13.542 38.991 30.987 1.00 14.20 C ATOM 31 CG ASP A 3 -12.173 39.638 30.907 1.00 12.20 C ATOM 32 OD1 ASP A 3 -11.368 39.220 30.048 1.00 61.11 O ATOM 33 OD2 ASP A 3 -11.906 40.562 31.703 1.00 52.10 O ATOM 0 H ASP A 3 -12.394 36.505 30.645 1.00 23.21 H new ATOM 0 HA ASP A 3 -13.484 38.056 32.921 1.00 24.33 H new ATOM 0 HB2 ASP A 3 -13.871 38.718 29.984 1.00 14.20 H new ATOM 0 HB3 ASP A 3 -14.261 39.714 31.372 1.00 14.20 H new ATOM 37 N ALA A 4 -15.726 37.040 32.681 1.00 34.11 N ATOM 38 CA ALA A 4 -17.006 36.347 32.619 1.00 64.04 C ATOM 39 C ALA A 4 -18.158 37.335 32.470 1.00 14.41 C ATOM 40 O ALA A 4 -19.308 37.010 32.763 1.00 63.40 O ATOM 41 CB ALA A 4 -17.202 35.487 33.859 1.00 64.11 C ATOM 0 H ALA A 4 -15.572 37.566 33.541 1.00 34.11 H new ATOM 0 HA ALA A 4 -16.999 35.701 31.741 1.00 64.04 H new ATOM 0 HB1 ALA A 4 -18.163 34.975 33.799 1.00 64.11 H new ATOM 0 HB2 ALA A 4 -16.401 34.750 33.921 1.00 64.11 H new ATOM 0 HB3 ALA A 4 -17.183 36.119 34.747 1.00 64.11 H new ATOM 47 N GLY A 5 -17.841 38.543 32.014 1.00 71.13 N ATOM 48 CA GLY A 5 -18.860 39.560 31.836 1.00 65.44 C ATOM 49 C GLY A 5 -19.490 39.515 30.458 1.00 34.33 C ATOM 50 O GLY A 5 -18.836 39.816 29.459 1.00 71.14 O ATOM 0 H GLY A 5 -16.896 38.835 31.765 1.00 71.13 H new ATOM 0 HA2 GLY A 5 -19.635 39.429 32.591 1.00 65.44 H new ATOM 0 HA3 GLY A 5 -18.419 40.544 31.999 1.00 65.44 H new ATOM 53 N ARG A 6 -20.762 39.135 30.403 1.00 65.52 N ATOM 54 CA ARG A 6 -21.479 39.049 29.136 1.00 42.04 C ATOM 55 C ARG A 6 -22.528 40.152 29.028 1.00 75.20 C ATOM 56 O ARG A 6 -23.364 40.144 28.123 1.00 54.11 O ATOM 57 CB ARG A 6 -22.148 37.680 28.997 1.00 73.45 C ATOM 58 CG ARG A 6 -21.194 36.513 29.198 1.00 70.22 C ATOM 59 CD ARG A 6 -20.952 35.761 27.898 1.00 55.30 C ATOM 60 NE ARG A 6 -20.024 36.469 27.021 1.00 31.10 N ATOM 61 CZ ARG A 6 -18.706 36.463 27.187 1.00 4.44 C ATOM 62 NH1 ARG A 6 -18.165 35.789 28.192 1.00 13.12 N ATOM 63 NH2 ARG A 6 -17.927 37.132 26.346 1.00 51.40 N ATOM 0 H ARG A 6 -21.317 38.882 31.220 1.00 65.52 H new ATOM 0 HA ARG A 6 -20.757 39.178 28.330 1.00 42.04 H new ATOM 0 HB2 ARG A 6 -22.958 37.605 29.723 1.00 73.45 H new ATOM 0 HB3 ARG A 6 -22.599 37.604 28.007 1.00 73.45 H new ATOM 0 HG2 ARG A 6 -20.245 36.880 29.589 1.00 70.22 H new ATOM 0 HG3 ARG A 6 -21.603 35.831 29.943 1.00 70.22 H new ATOM 0 HD2 ARG A 6 -20.556 34.770 28.121 1.00 55.30 H new ATOM 0 HD3 ARG A 6 -21.901 35.616 27.381 1.00 55.30 H new ATOM 0 HE ARG A 6 -20.409 36.997 26.238 1.00 31.10 H new ATOM 0 HH11 ARG A 6 -18.761 35.274 28.840 1.00 13.12 H new ATOM 0 HH12 ARG A 6 -17.153 35.786 28.318 1.00 13.12 H new ATOM 0 HH21 ARG A 6 -18.340 37.651 25.571 1.00 51.40 H new ATOM 0 HH22 ARG A 6 -16.915 37.127 26.474 1.00 51.40 H new ATOM 74 N LYS A 7 -22.478 41.102 29.956 1.00 55.41 N ATOM 75 CA LYS A 7 -23.422 42.213 29.967 1.00 55.15 C ATOM 76 C LYS A 7 -23.110 43.202 28.848 1.00 50.44 C ATOM 77 O LYS A 7 -23.937 44.046 28.505 1.00 54.23 O ATOM 78 CB LYS A 7 -23.385 42.927 31.319 1.00 44.22 C ATOM 79 CG LYS A 7 -22.001 43.414 31.711 1.00 5.32 C ATOM 80 CD LYS A 7 -21.355 42.494 32.734 1.00 63.52 C ATOM 81 CE LYS A 7 -21.731 42.887 34.154 1.00 33.50 C ATOM 82 NZ LYS A 7 -21.123 44.189 34.548 1.00 61.43 N ATOM 0 H LYS A 7 -21.793 41.124 30.711 1.00 55.41 H new ATOM 0 HA LYS A 7 -24.422 41.810 29.804 1.00 55.15 H new ATOM 0 HB2 LYS A 7 -24.066 43.778 31.290 1.00 44.22 H new ATOM 0 HB3 LYS A 7 -23.754 42.249 32.089 1.00 44.22 H new ATOM 0 HG2 LYS A 7 -21.370 43.473 30.824 1.00 5.32 H new ATOM 0 HG3 LYS A 7 -22.071 44.422 32.120 1.00 5.32 H new ATOM 0 HD2 LYS A 7 -21.664 41.466 32.546 1.00 63.52 H new ATOM 0 HD3 LYS A 7 -20.271 42.527 32.621 1.00 63.52 H new ATOM 0 HE2 LYS A 7 -22.816 42.952 34.238 1.00 33.50 H new ATOM 0 HE3 LYS A 7 -21.404 42.110 34.845 1.00 33.50 H new ATOM 0 HZ1 LYS A 7 -21.076 44.251 35.585 1.00 61.43 H new ATOM 0 HZ2 LYS A 7 -20.163 44.257 34.153 1.00 61.43 H new ATOM 0 HZ3 LYS A 7 -21.705 44.969 34.181 1.00 61.43 H new ATOM 92 N GLY A 8 -21.912 43.090 28.282 1.00 53.01 N ATOM 93 CA GLY A 8 -21.514 43.980 27.207 1.00 32.12 C ATOM 94 C GLY A 8 -20.016 44.211 27.171 1.00 11.21 C ATOM 95 O GLY A 8 -19.476 44.669 26.165 1.00 32.41 O ATOM 0 H GLY A 8 -21.210 42.399 28.549 1.00 53.01 H new ATOM 0 HA2 GLY A 8 -21.837 43.561 26.254 1.00 32.12 H new ATOM 0 HA3 GLY A 8 -22.023 44.937 27.324 1.00 32.12 H new ATOM 98 N PHE A 9 -19.344 43.897 28.274 1.00 41.24 N ATOM 99 CA PHE A 9 -17.900 44.076 28.366 1.00 10.13 C ATOM 100 C PHE A 9 -17.164 42.913 27.707 1.00 75.44 C ATOM 101 O PHE A 9 -15.954 42.970 27.493 1.00 53.52 O ATOM 102 CB PHE A 9 -17.472 44.200 29.830 1.00 62.43 C ATOM 103 CG PHE A 9 -16.000 44.439 30.006 1.00 14.30 C ATOM 104 CD1 PHE A 9 -15.453 45.688 29.762 1.00 75.24 C ATOM 105 CD2 PHE A 9 -15.162 43.414 30.415 1.00 52.23 C ATOM 106 CE1 PHE A 9 -14.098 45.911 29.923 1.00 3.30 C ATOM 107 CE2 PHE A 9 -13.807 43.630 30.579 1.00 45.25 C ATOM 108 CZ PHE A 9 -13.275 44.880 30.331 1.00 33.34 C ATOM 0 H PHE A 9 -19.776 43.517 29.116 1.00 41.24 H new ATOM 0 HA PHE A 9 -17.639 44.994 27.839 1.00 10.13 H new ATOM 0 HB2 PHE A 9 -18.023 45.019 30.293 1.00 62.43 H new ATOM 0 HB3 PHE A 9 -17.750 43.289 30.360 1.00 62.43 H new ATOM 0 HD1 PHE A 9 -16.093 46.497 29.442 1.00 75.24 H new ATOM 0 HD2 PHE A 9 -15.573 42.434 30.608 1.00 52.23 H new ATOM 0 HE1 PHE A 9 -13.684 46.890 29.730 1.00 3.30 H new ATOM 0 HE2 PHE A 9 -13.165 42.823 30.900 1.00 45.25 H new ATOM 0 HZ PHE A 9 -12.216 45.051 30.456 1.00 33.34 H new ATOM 117 N GLY A 10 -17.906 41.856 27.387 1.00 34.52 N ATOM 118 CA GLY A 10 -17.308 40.694 26.756 1.00 12.31 C ATOM 119 C GLY A 10 -17.426 40.729 25.245 1.00 14.23 C ATOM 120 O GLY A 10 -16.489 40.367 24.535 1.00 52.43 O ATOM 0 H GLY A 10 -18.910 41.784 27.554 1.00 34.52 H new ATOM 0 HA2 GLY A 10 -16.256 40.635 27.034 1.00 12.31 H new ATOM 0 HA3 GLY A 10 -17.789 39.792 27.134 1.00 12.31 H new ATOM 123 N GLU A 11 -18.580 41.166 24.753 1.00 44.30 N ATOM 124 CA GLU A 11 -18.817 41.245 23.316 1.00 4.02 C ATOM 125 C GLU A 11 -17.851 42.226 22.659 1.00 63.30 C ATOM 126 O GLU A 11 -17.592 42.150 21.458 1.00 14.44 O ATOM 127 CB GLU A 11 -20.261 41.668 23.037 1.00 30.54 C ATOM 128 CG GLU A 11 -21.297 40.759 23.676 1.00 15.33 C ATOM 129 CD GLU A 11 -21.700 39.609 22.774 1.00 52.04 C ATOM 130 OE1 GLU A 11 -22.166 39.874 21.646 1.00 31.55 O ATOM 131 OE2 GLU A 11 -21.549 38.443 23.196 1.00 44.04 O ATOM 0 H GLU A 11 -19.366 41.471 25.328 1.00 44.30 H new ATOM 0 HA GLU A 11 -18.648 40.256 22.890 1.00 4.02 H new ATOM 0 HB2 GLU A 11 -20.409 42.685 23.400 1.00 30.54 H new ATOM 0 HB3 GLU A 11 -20.423 41.688 21.959 1.00 30.54 H new ATOM 0 HG2 GLU A 11 -20.899 40.361 24.610 1.00 15.33 H new ATOM 0 HG3 GLU A 11 -22.181 41.344 23.930 1.00 15.33 H new ATOM 136 N LYS A 12 -17.323 43.150 23.455 1.00 72.10 N ATOM 137 CA LYS A 12 -16.386 44.148 22.953 1.00 41.31 C ATOM 138 C LYS A 12 -14.944 43.703 23.181 1.00 44.25 C ATOM 139 O LYS A 12 -14.096 43.843 22.301 1.00 71.14 O ATOM 140 CB LYS A 12 -16.629 45.496 23.636 1.00 43.02 C ATOM 141 CG LYS A 12 -15.445 46.443 23.550 1.00 65.31 C ATOM 142 CD LYS A 12 -14.558 46.340 24.779 1.00 15.44 C ATOM 143 CE LYS A 12 -14.796 47.495 25.738 1.00 21.11 C ATOM 144 NZ LYS A 12 -13.857 48.625 25.489 1.00 44.02 N ATOM 0 H LYS A 12 -17.528 43.228 24.451 1.00 72.10 H new ATOM 0 HA LYS A 12 -16.550 44.257 21.881 1.00 41.31 H new ATOM 0 HB2 LYS A 12 -17.498 45.972 23.182 1.00 43.02 H new ATOM 0 HB3 LYS A 12 -16.871 45.324 24.685 1.00 43.02 H new ATOM 0 HG2 LYS A 12 -14.861 46.216 22.658 1.00 65.31 H new ATOM 0 HG3 LYS A 12 -15.804 47.467 23.444 1.00 65.31 H new ATOM 0 HD2 LYS A 12 -14.751 45.396 25.290 1.00 15.44 H new ATOM 0 HD3 LYS A 12 -13.512 46.329 24.474 1.00 15.44 H new ATOM 0 HE2 LYS A 12 -15.823 47.847 25.636 1.00 21.11 H new ATOM 0 HE3 LYS A 12 -14.680 47.145 26.764 1.00 21.11 H new ATOM 0 HZ1 LYS A 12 -14.051 49.393 26.163 1.00 44.02 H new ATOM 0 HZ2 LYS A 12 -12.878 48.296 25.611 1.00 44.02 H new ATOM 0 HZ3 LYS A 12 -13.986 48.976 24.518 1.00 44.02 H new ATOM 154 N ALA A 13 -14.676 43.167 24.366 1.00 0.03 N ATOM 155 CA ALA A 13 -13.339 42.699 24.707 1.00 0.53 C ATOM 156 C ALA A 13 -12.995 41.419 23.952 1.00 3.21 C ATOM 157 O ALA A 13 -11.825 41.067 23.809 1.00 52.43 O ATOM 158 CB ALA A 13 -13.225 42.475 26.208 1.00 55.42 C ATOM 0 H ALA A 13 -15.367 43.046 25.106 1.00 0.03 H new ATOM 0 HA ALA A 13 -12.626 43.468 24.410 1.00 0.53 H new ATOM 0 HB1 ALA A 13 -12.221 42.125 26.448 1.00 55.42 H new ATOM 0 HB2 ALA A 13 -13.418 43.411 26.731 1.00 55.42 H new ATOM 0 HB3 ALA A 13 -13.954 41.727 26.521 1.00 55.42 H new ATOM 164 N SER A 14 -14.024 40.728 23.472 1.00 74.34 N ATOM 165 CA SER A 14 -13.831 39.483 22.735 1.00 3.05 C ATOM 166 C SER A 14 -13.815 39.740 21.231 1.00 3.31 C ATOM 167 O SER A 14 -13.190 39.001 20.472 1.00 44.34 O ATOM 168 CB SER A 14 -14.936 38.484 23.082 1.00 62.21 C ATOM 169 OG SER A 14 -14.800 37.292 22.327 1.00 3.44 O ATOM 0 H SER A 14 -14.999 41.008 23.580 1.00 74.34 H new ATOM 0 HA SER A 14 -12.868 39.063 23.025 1.00 3.05 H new ATOM 0 HB2 SER A 14 -14.899 38.251 24.146 1.00 62.21 H new ATOM 0 HB3 SER A 14 -15.910 38.932 22.888 1.00 62.21 H new ATOM 0 HG SER A 14 -15.517 36.669 22.568 1.00 3.44 H new ATOM 174 N GLU A 15 -14.507 40.795 20.809 1.00 53.41 N ATOM 175 CA GLU A 15 -14.573 41.148 19.396 1.00 24.14 C ATOM 176 C GLU A 15 -13.556 42.235 19.059 1.00 15.01 C ATOM 177 O GLU A 15 -13.105 42.345 17.920 1.00 73.34 O ATOM 178 CB GLU A 15 -15.981 41.623 19.032 1.00 42.23 C ATOM 179 CG GLU A 15 -16.198 43.111 19.252 1.00 72.34 C ATOM 180 CD GLU A 15 -17.606 43.553 18.902 1.00 1.32 C ATOM 181 OE1 GLU A 15 -18.491 42.681 18.786 1.00 41.32 O ATOM 182 OE2 GLU A 15 -17.822 44.773 18.746 1.00 24.32 O ATOM 0 H GLU A 15 -15.029 41.419 21.425 1.00 53.41 H new ATOM 0 HA GLU A 15 -14.335 40.258 18.814 1.00 24.14 H new ATOM 0 HB2 GLU A 15 -16.176 41.387 17.986 1.00 42.23 H new ATOM 0 HB3 GLU A 15 -16.707 41.067 19.625 1.00 42.23 H new ATOM 0 HG2 GLU A 15 -15.994 43.354 20.295 1.00 72.34 H new ATOM 0 HG3 GLU A 15 -15.484 43.672 18.648 1.00 72.34 H new ATOM 187 N ALA A 16 -13.199 43.034 20.059 1.00 4.12 N ATOM 188 CA ALA A 16 -12.235 44.110 19.870 1.00 30.13 C ATOM 189 C ALA A 16 -10.818 43.639 20.182 1.00 51.15 C ATOM 190 O ALA A 16 -9.840 44.240 19.734 1.00 41.25 O ATOM 191 CB ALA A 16 -12.599 45.304 20.739 1.00 35.23 C ATOM 0 H ALA A 16 -13.563 42.956 21.009 1.00 4.12 H new ATOM 0 HA ALA A 16 -12.267 44.413 18.823 1.00 30.13 H new ATOM 0 HB1 ALA A 16 -11.870 46.100 20.587 1.00 35.23 H new ATOM 0 HB2 ALA A 16 -13.591 45.664 20.466 1.00 35.23 H new ATOM 0 HB3 ALA A 16 -12.597 45.005 21.787 1.00 35.23 H new ATOM 197 N LEU A 17 -10.714 42.561 20.952 1.00 23.04 N ATOM 198 CA LEU A 17 -9.416 42.009 21.325 1.00 65.25 C ATOM 199 C LEU A 17 -9.216 40.628 20.710 1.00 41.12 C ATOM 200 O LEU A 17 -8.167 40.006 20.883 1.00 41.52 O ATOM 201 CB LEU A 17 -9.294 41.926 22.847 1.00 61.24 C ATOM 202 CG LEU A 17 -9.998 43.028 23.639 1.00 24.35 C ATOM 203 CD1 LEU A 17 -10.017 42.692 25.121 1.00 50.42 C ATOM 204 CD2 LEU A 17 -9.318 44.370 23.403 1.00 22.02 C ATOM 0 H LEU A 17 -11.513 42.052 21.330 1.00 23.04 H new ATOM 0 HA LEU A 17 -8.641 42.673 20.941 1.00 65.25 H new ATOM 0 HB2 LEU A 17 -9.691 40.964 23.171 1.00 61.24 H new ATOM 0 HB3 LEU A 17 -8.236 41.939 23.108 1.00 61.24 H new ATOM 0 HG LEU A 17 -11.029 43.098 23.291 1.00 24.35 H new ATOM 0 HD11 LEU A 17 -10.522 43.488 25.668 1.00 50.42 H new ATOM 0 HD12 LEU A 17 -10.548 41.753 25.274 1.00 50.42 H new ATOM 0 HD13 LEU A 17 -8.994 42.594 25.485 1.00 50.42 H new ATOM 0 HD21 LEU A 17 -9.832 45.144 23.974 1.00 22.02 H new ATOM 0 HD22 LEU A 17 -8.278 44.312 23.724 1.00 22.02 H new ATOM 0 HD23 LEU A 17 -9.357 44.616 22.342 1.00 22.02 H new ATOM 215 N LYS A 18 -10.226 40.153 19.991 1.00 45.13 N ATOM 216 CA LYS A 18 -10.162 38.847 19.346 1.00 14.31 C ATOM 217 C LYS A 18 -8.761 38.575 18.808 1.00 22.15 C ATOM 218 O LYS A 18 -8.312 39.191 17.841 1.00 75.12 O ATOM 219 CB LYS A 18 -11.182 38.765 18.209 1.00 11.23 C ATOM 220 CG LYS A 18 -11.124 39.944 17.253 1.00 4.22 C ATOM 221 CD LYS A 18 -11.988 39.710 16.026 1.00 71.00 C ATOM 222 CE LYS A 18 -12.479 41.021 15.431 1.00 14.32 C ATOM 223 NZ LYS A 18 -13.959 41.155 15.529 1.00 13.53 N ATOM 0 H LYS A 18 -11.101 40.654 19.840 1.00 45.13 H new ATOM 0 HA LYS A 18 -10.399 38.089 20.092 1.00 14.31 H new ATOM 0 HB2 LYS A 18 -11.015 37.845 17.648 1.00 11.23 H new ATOM 0 HB3 LYS A 18 -12.184 38.702 18.635 1.00 11.23 H new ATOM 0 HG2 LYS A 18 -11.456 40.846 17.766 1.00 4.22 H new ATOM 0 HG3 LYS A 18 -10.092 40.114 16.945 1.00 4.22 H new ATOM 0 HD2 LYS A 18 -11.417 39.161 15.277 1.00 71.00 H new ATOM 0 HD3 LYS A 18 -12.842 39.089 16.295 1.00 71.00 H new ATOM 0 HE2 LYS A 18 -12.004 41.855 15.948 1.00 14.32 H new ATOM 0 HE3 LYS A 18 -12.177 41.081 14.385 1.00 14.32 H new ATOM 0 HZ1 LYS A 18 -14.301 41.783 14.774 1.00 13.53 H new ATOM 0 HZ2 LYS A 18 -14.400 40.219 15.427 1.00 13.53 H new ATOM 0 HZ3 LYS A 18 -14.211 41.557 16.454 1.00 13.53 H new ATOM 233 N PRO A 19 -8.053 37.631 19.446 1.00 70.21 N ATOM 234 CA PRO A 19 -6.693 37.255 19.046 1.00 4.43 C ATOM 235 C PRO A 19 -6.665 36.515 17.714 1.00 75.12 C ATOM 236 O PRO A 19 -6.259 35.355 17.646 1.00 15.44 O ATOM 237 CB PRO A 19 -6.232 36.335 20.180 1.00 64.45 C ATOM 238 CG PRO A 19 -7.490 35.777 20.749 1.00 51.43 C ATOM 239 CD PRO A 19 -8.526 36.857 20.607 1.00 33.51 C ATOM 0 HA PRO A 19 -6.055 38.126 18.900 1.00 4.43 H new ATOM 0 HB2 PRO A 19 -5.581 35.544 19.808 1.00 64.45 H new ATOM 0 HB3 PRO A 19 -5.667 36.886 20.932 1.00 64.45 H new ATOM 0 HG2 PRO A 19 -7.792 34.875 20.217 1.00 51.43 H new ATOM 0 HG3 PRO A 19 -7.356 35.501 21.795 1.00 51.43 H new ATOM 0 HD2 PRO A 19 -9.519 36.442 20.436 1.00 33.51 H new ATOM 0 HD3 PRO A 19 -8.589 37.474 21.503 1.00 33.51 H new ATOM 244 N ASP A 20 -7.097 37.193 16.656 1.00 42.14 N ATOM 245 CA ASP A 20 -7.120 36.599 15.325 1.00 65.05 C ATOM 246 C ASP A 20 -5.726 36.133 14.914 1.00 43.13 C ATOM 247 O ASP A 20 -5.571 35.384 13.950 1.00 54.44 O ATOM 248 CB ASP A 20 -7.657 37.603 14.303 1.00 1.15 C ATOM 249 CG ASP A 20 -8.864 38.362 14.818 1.00 21.03 C ATOM 250 OD1 ASP A 20 -9.589 37.814 15.675 1.00 20.53 O ATOM 251 OD2 ASP A 20 -9.085 39.505 14.364 1.00 20.34 O ATOM 0 H ASP A 20 -7.436 38.154 16.695 1.00 42.14 H new ATOM 0 HA ASP A 20 -7.781 35.732 15.353 1.00 65.05 H new ATOM 0 HB2 ASP A 20 -6.869 38.311 14.044 1.00 1.15 H new ATOM 0 HB3 ASP A 20 -7.926 37.077 13.387 1.00 1.15 H new ATOM 255 N SER A 21 -4.717 36.584 15.650 1.00 35.01 N ATOM 256 CA SER A 21 -3.335 36.217 15.360 1.00 61.23 C ATOM 257 C SER A 21 -3.025 34.816 15.878 1.00 0.30 C ATOM 258 O SER A 21 -2.001 34.229 15.532 1.00 74.11 O ATOM 259 CB SER A 21 -2.374 37.230 15.986 1.00 44.14 C ATOM 260 OG SER A 21 -1.191 37.352 15.216 1.00 12.15 O ATOM 0 H SER A 21 -4.829 37.204 16.452 1.00 35.01 H new ATOM 0 HA SER A 21 -3.203 36.223 14.278 1.00 61.23 H new ATOM 0 HB2 SER A 21 -2.863 38.201 16.063 1.00 44.14 H new ATOM 0 HB3 SER A 21 -2.122 36.919 17.000 1.00 44.14 H new ATOM 0 HG SER A 21 -0.594 38.006 15.635 1.00 12.15 H new ATOM 265 N GLN A 22 -3.917 34.288 16.710 1.00 3.14 N ATOM 266 CA GLN A 22 -3.738 32.957 17.278 1.00 32.51 C ATOM 267 C GLN A 22 -4.829 32.009 16.794 1.00 54.02 C ATOM 268 O GLN A 22 -4.553 31.037 16.088 1.00 43.11 O ATOM 269 CB GLN A 22 -3.746 33.026 18.806 1.00 43.45 C ATOM 270 CG GLN A 22 -2.661 33.922 19.381 1.00 13.22 C ATOM 271 CD GLN A 22 -1.299 33.257 19.389 1.00 33.14 C ATOM 272 OE1 GLN A 22 -0.985 32.449 18.514 1.00 12.42 O ATOM 273 NE2 GLN A 22 -0.481 33.595 20.379 1.00 55.13 N ATOM 0 H GLN A 22 -4.771 34.761 17.006 1.00 3.14 H new ATOM 0 HA GLN A 22 -2.774 32.573 16.944 1.00 32.51 H new ATOM 0 HB2 GLN A 22 -4.719 33.387 19.140 1.00 43.45 H new ATOM 0 HB3 GLN A 22 -3.625 32.020 19.207 1.00 43.45 H new ATOM 0 HG2 GLN A 22 -2.609 34.842 18.799 1.00 13.22 H new ATOM 0 HG3 GLN A 22 -2.930 34.204 20.399 1.00 13.22 H new ATOM 0 HE21 GLN A 22 -0.783 34.269 21.083 1.00 55.13 H new ATOM 0 HE22 GLN A 22 0.449 33.181 20.436 1.00 55.13 H new ATOM 280 N LYS A 23 -6.069 32.295 17.176 1.00 33.10 N ATOM 281 CA LYS A 23 -7.202 31.468 16.781 1.00 61.44 C ATOM 282 C LYS A 23 -7.083 31.043 15.321 1.00 34.33 C ATOM 283 O LYS A 23 -6.792 29.884 15.023 1.00 61.20 O ATOM 284 CB LYS A 23 -8.513 32.227 16.996 1.00 5.54 C ATOM 285 CG LYS A 23 -8.381 33.731 16.826 1.00 72.04 C ATOM 286 CD LYS A 23 -9.646 34.339 16.245 1.00 4.31 C ATOM 287 CE LYS A 23 -9.806 33.994 14.773 1.00 24.20 C ATOM 288 NZ LYS A 23 -11.167 34.334 14.269 1.00 13.21 N ATOM 0 H LYS A 23 -6.315 33.095 17.760 1.00 33.10 H new ATOM 0 HA LYS A 23 -7.200 30.573 17.403 1.00 61.44 H new ATOM 0 HB2 LYS A 23 -9.258 31.854 16.293 1.00 5.54 H new ATOM 0 HB3 LYS A 23 -8.886 32.015 17.998 1.00 5.54 H new ATOM 0 HG2 LYS A 23 -8.166 34.190 17.791 1.00 72.04 H new ATOM 0 HG3 LYS A 23 -7.537 33.952 16.173 1.00 72.04 H new ATOM 0 HD2 LYS A 23 -10.512 33.979 16.800 1.00 4.31 H new ATOM 0 HD3 LYS A 23 -9.618 35.422 16.365 1.00 4.31 H new ATOM 0 HE2 LYS A 23 -9.058 34.532 14.190 1.00 24.20 H new ATOM 0 HE3 LYS A 23 -9.620 32.930 14.627 1.00 24.20 H new ATOM 0 HZ1 LYS A 23 -11.237 34.084 13.262 1.00 13.21 H new ATOM 0 HZ2 LYS A 23 -11.880 33.802 14.808 1.00 13.21 H new ATOM 0 HZ3 LYS A 23 -11.335 35.354 14.385 1.00 13.21 H new ATOM 298 N SER A 24 -7.307 31.988 14.414 1.00 70.43 N ATOM 299 CA SER A 24 -7.227 31.711 12.984 1.00 5.14 C ATOM 300 C SER A 24 -6.099 30.728 12.684 1.00 1.04 C ATOM 301 O SER A 24 -6.180 29.943 11.740 1.00 41.40 O ATOM 302 CB SER A 24 -7.009 33.008 12.203 1.00 50.05 C ATOM 303 OG SER A 24 -8.075 33.243 11.298 1.00 2.03 O ATOM 0 H SER A 24 -7.545 32.953 14.644 1.00 70.43 H new ATOM 0 HA SER A 24 -8.170 31.262 12.673 1.00 5.14 H new ATOM 0 HB2 SER A 24 -6.926 33.845 12.897 1.00 50.05 H new ATOM 0 HB3 SER A 24 -6.068 32.953 11.655 1.00 50.05 H new ATOM 0 HG SER A 24 -7.913 34.079 10.812 1.00 2.03 H new ATOM 308 N TYR A 25 -5.048 30.779 13.495 1.00 12.31 N ATOM 309 CA TYR A 25 -3.902 29.895 13.316 1.00 30.22 C ATOM 310 C TYR A 25 -4.145 28.545 13.984 1.00 5.45 C ATOM 311 O TYR A 25 -4.070 27.499 13.342 1.00 25.12 O ATOM 312 CB TYR A 25 -2.639 30.541 13.888 1.00 43.50 C ATOM 313 CG TYR A 25 -2.307 31.878 13.266 1.00 2.03 C ATOM 314 CD1 TYR A 25 -3.172 32.958 13.390 1.00 31.04 C ATOM 315 CD2 TYR A 25 -1.129 32.061 12.554 1.00 34.13 C ATOM 316 CE1 TYR A 25 -2.872 34.182 12.822 1.00 44.41 C ATOM 317 CE2 TYR A 25 -0.820 33.281 11.984 1.00 42.10 C ATOM 318 CZ TYR A 25 -1.696 34.339 12.120 1.00 14.55 C ATOM 319 OH TYR A 25 -1.393 35.556 11.554 1.00 41.32 O ATOM 0 H TYR A 25 -4.966 31.423 14.282 1.00 12.31 H new ATOM 0 HA TYR A 25 -3.765 29.731 12.247 1.00 30.22 H new ATOM 0 HB2 TYR A 25 -2.763 30.671 14.963 1.00 43.50 H new ATOM 0 HB3 TYR A 25 -1.797 29.864 13.743 1.00 43.50 H new ATOM 0 HD1 TYR A 25 -4.094 32.839 13.939 1.00 31.04 H new ATOM 0 HD2 TYR A 25 -0.442 31.235 12.444 1.00 34.13 H new ATOM 0 HE1 TYR A 25 -3.556 35.011 12.928 1.00 44.41 H new ATOM 0 HE2 TYR A 25 0.102 33.406 11.435 1.00 42.10 H new ATOM 0 HH TYR A 25 -0.528 35.498 11.096 1.00 41.32 H new ATOM 328 N ALA A 26 -4.436 28.579 15.282 1.00 63.33 N ATOM 329 CA ALA A 26 -4.692 27.360 16.038 1.00 44.33 C ATOM 330 C ALA A 26 -6.022 26.733 15.634 1.00 61.14 C ATOM 331 O ALA A 26 -6.096 25.536 15.359 1.00 54.32 O ATOM 332 CB ALA A 26 -4.677 27.653 17.531 1.00 42.31 C ATOM 0 H ALA A 26 -4.500 29.437 15.830 1.00 63.33 H new ATOM 0 HA ALA A 26 -3.900 26.647 15.810 1.00 44.33 H new ATOM 0 HB1 ALA A 26 -4.870 26.734 18.084 1.00 42.31 H new ATOM 0 HB2 ALA A 26 -3.702 28.049 17.814 1.00 42.31 H new ATOM 0 HB3 ALA A 26 -5.449 28.386 17.766 1.00 42.31 H new ATOM 338 N GLU A 27 -7.071 27.549 15.601 1.00 40.04 N ATOM 339 CA GLU A 27 -8.399 27.072 15.231 1.00 53.23 C ATOM 340 C GLU A 27 -8.344 26.257 13.942 1.00 54.41 C ATOM 341 O GLU A 27 -8.754 25.096 13.912 1.00 5.22 O ATOM 342 CB GLU A 27 -9.360 28.250 15.062 1.00 73.24 C ATOM 343 CG GLU A 27 -10.806 27.831 14.857 1.00 40.31 C ATOM 344 CD GLU A 27 -11.686 28.175 16.043 1.00 1.33 C ATOM 345 OE1 GLU A 27 -12.158 29.329 16.119 1.00 54.23 O ATOM 346 OE2 GLU A 27 -11.903 27.289 16.897 1.00 62.13 O ATOM 0 H GLU A 27 -7.027 28.543 15.826 1.00 40.04 H new ATOM 0 HA GLU A 27 -8.762 26.429 16.032 1.00 53.23 H new ATOM 0 HB2 GLU A 27 -9.297 28.889 15.943 1.00 73.24 H new ATOM 0 HB3 GLU A 27 -9.040 28.850 14.210 1.00 73.24 H new ATOM 0 HG2 GLU A 27 -11.199 28.318 13.964 1.00 40.31 H new ATOM 0 HG3 GLU A 27 -10.847 26.757 14.678 1.00 40.31 H new ATOM 351 N GLN A 28 -7.836 26.872 12.880 1.00 24.34 N ATOM 352 CA GLN A 28 -7.729 26.204 11.588 1.00 25.33 C ATOM 353 C GLN A 28 -7.107 24.820 11.741 1.00 24.11 C ATOM 354 O GLN A 28 -7.476 23.881 11.037 1.00 63.45 O ATOM 355 CB GLN A 28 -6.895 27.047 10.622 1.00 33.32 C ATOM 356 CG GLN A 28 -7.726 27.783 9.584 1.00 21.13 C ATOM 357 CD GLN A 28 -6.959 28.049 8.304 1.00 25.22 C ATOM 358 OE1 GLN A 28 -6.360 27.142 7.726 1.00 74.32 O ATOM 359 NE2 GLN A 28 -6.974 29.298 7.853 1.00 1.14 N ATOM 0 H GLN A 28 -7.492 27.832 12.888 1.00 24.34 H new ATOM 0 HA GLN A 28 -8.734 26.088 11.183 1.00 25.33 H new ATOM 0 HB2 GLN A 28 -6.316 27.773 11.193 1.00 33.32 H new ATOM 0 HB3 GLN A 28 -6.181 26.400 10.112 1.00 33.32 H new ATOM 0 HG2 GLN A 28 -8.616 27.197 9.355 1.00 21.13 H new ATOM 0 HG3 GLN A 28 -8.067 28.730 10.002 1.00 21.13 H new ATOM 0 HE21 GLN A 28 -7.484 30.019 8.364 1.00 1.14 H new ATOM 0 HE22 GLN A 28 -6.476 29.537 6.995 1.00 1.14 H new ATOM 366 N GLY A 29 -6.160 24.701 12.667 1.00 41.25 N ATOM 367 CA GLY A 29 -5.502 23.427 12.895 1.00 21.41 C ATOM 368 C GLY A 29 -6.386 22.443 13.635 1.00 13.34 C ATOM 369 O GLY A 29 -6.433 21.260 13.294 1.00 31.41 O ATOM 0 H GLY A 29 -5.837 25.463 13.263 1.00 41.25 H new ATOM 0 HA2 GLY A 29 -5.207 22.997 11.938 1.00 21.41 H new ATOM 0 HA3 GLY A 29 -4.588 23.591 13.466 1.00 21.41 H new ATOM 372 N LYS A 30 -7.087 22.928 14.653 1.00 24.15 N ATOM 373 CA LYS A 30 -7.973 22.084 15.446 1.00 72.43 C ATOM 374 C LYS A 30 -9.183 21.647 14.627 1.00 61.13 C ATOM 375 O LYS A 30 -9.512 20.462 14.573 1.00 74.21 O ATOM 376 CB LYS A 30 -8.435 22.829 16.700 1.00 35.34 C ATOM 377 CG LYS A 30 -7.815 22.303 17.983 1.00 71.42 C ATOM 378 CD LYS A 30 -7.509 23.428 18.957 1.00 43.11 C ATOM 379 CE LYS A 30 -8.779 24.134 19.408 1.00 3.42 C ATOM 380 NZ LYS A 30 -8.986 25.419 18.685 1.00 42.13 N ATOM 0 H LYS A 30 -7.059 23.904 14.949 1.00 24.15 H new ATOM 0 HA LYS A 30 -7.417 21.195 15.744 1.00 72.43 H new ATOM 0 HB2 LYS A 30 -8.191 23.886 16.595 1.00 35.34 H new ATOM 0 HB3 LYS A 30 -9.520 22.759 16.775 1.00 35.34 H new ATOM 0 HG2 LYS A 30 -8.494 21.590 18.451 1.00 71.42 H new ATOM 0 HG3 LYS A 30 -6.897 21.763 17.750 1.00 71.42 H new ATOM 0 HD2 LYS A 30 -6.986 23.027 19.825 1.00 43.11 H new ATOM 0 HD3 LYS A 30 -6.839 24.147 18.486 1.00 43.11 H new ATOM 0 HE2 LYS A 30 -9.636 23.481 19.241 1.00 3.42 H new ATOM 0 HE3 LYS A 30 -8.727 24.325 20.480 1.00 3.42 H new ATOM 0 HZ1 LYS A 30 -9.597 26.042 19.251 1.00 42.13 H new ATOM 0 HZ2 LYS A 30 -8.068 25.882 18.531 1.00 42.13 H new ATOM 0 HZ3 LYS A 30 -9.438 25.232 17.767 1.00 42.13 H new ATOM 390 N GLU A 31 -9.841 22.611 13.990 1.00 42.32 N ATOM 391 CA GLU A 31 -11.014 22.323 13.173 1.00 22.21 C ATOM 392 C GLU A 31 -10.769 21.115 12.274 1.00 20.44 C ATOM 393 O GLU A 31 -11.700 20.394 11.916 1.00 63.34 O ATOM 394 CB GLU A 31 -11.382 23.540 12.322 1.00 0.41 C ATOM 395 CG GLU A 31 -10.527 23.692 11.076 1.00 53.14 C ATOM 396 CD GLU A 31 -11.182 23.099 9.843 1.00 32.12 C ATOM 397 OE1 GLU A 31 -12.362 23.416 9.589 1.00 43.43 O ATOM 398 OE2 GLU A 31 -10.514 22.318 9.133 1.00 23.30 O ATOM 0 H GLU A 31 -9.582 23.597 14.024 1.00 42.32 H new ATOM 0 HA GLU A 31 -11.843 22.093 13.843 1.00 22.21 H new ATOM 0 HB2 GLU A 31 -12.429 23.464 12.027 1.00 0.41 H new ATOM 0 HB3 GLU A 31 -11.287 24.440 12.930 1.00 0.41 H new ATOM 0 HG2 GLU A 31 -10.327 24.750 10.904 1.00 53.14 H new ATOM 0 HG3 GLU A 31 -9.564 23.208 11.239 1.00 53.14 H new ATOM 403 N TYR A 32 -9.508 20.902 11.911 1.00 44.42 N ATOM 404 CA TYR A 32 -9.140 19.784 11.051 1.00 34.12 C ATOM 405 C TYR A 32 -9.157 18.470 11.828 1.00 72.21 C ATOM 406 O TYR A 32 -9.534 17.427 11.295 1.00 74.20 O ATOM 407 CB TYR A 32 -7.753 20.014 10.447 1.00 53.51 C ATOM 408 CG TYR A 32 -7.045 18.737 10.054 1.00 21.43 C ATOM 409 CD1 TYR A 32 -6.437 17.933 11.010 1.00 1.12 C ATOM 410 CD2 TYR A 32 -6.984 18.335 8.725 1.00 42.12 C ATOM 411 CE1 TYR A 32 -5.788 16.767 10.654 1.00 22.22 C ATOM 412 CE2 TYR A 32 -6.338 17.169 8.361 1.00 63.43 C ATOM 413 CZ TYR A 32 -5.742 16.389 9.329 1.00 15.23 C ATOM 414 OH TYR A 32 -5.097 15.227 8.971 1.00 13.34 O ATOM 0 H TYR A 32 -8.725 21.489 12.199 1.00 44.42 H new ATOM 0 HA TYR A 32 -9.874 19.719 10.247 1.00 34.12 H new ATOM 0 HB2 TYR A 32 -7.850 20.651 9.568 1.00 53.51 H new ATOM 0 HB3 TYR A 32 -7.138 20.554 11.166 1.00 53.51 H new ATOM 0 HD1 TYR A 32 -6.472 18.225 12.049 1.00 1.12 H new ATOM 0 HD2 TYR A 32 -7.449 18.944 7.964 1.00 42.12 H new ATOM 0 HE1 TYR A 32 -5.319 16.154 11.410 1.00 22.22 H new ATOM 0 HE2 TYR A 32 -6.300 16.870 7.324 1.00 63.43 H new ATOM 0 HH TYR A 32 -5.157 15.105 8.000 1.00 13.34 H new ATOM 423 N ILE A 33 -8.746 18.531 13.090 1.00 20.21 N ATOM 424 CA ILE A 33 -8.716 17.348 13.941 1.00 61.21 C ATOM 425 C ILE A 33 -10.013 17.206 14.731 1.00 34.51 C ATOM 426 O ILE A 33 -10.717 16.203 14.614 1.00 51.33 O ATOM 427 CB ILE A 33 -7.531 17.391 14.924 1.00 24.44 C ATOM 428 CG1 ILE A 33 -7.913 16.726 16.247 1.00 52.23 C ATOM 429 CG2 ILE A 33 -7.088 18.829 15.156 1.00 24.52 C ATOM 430 CD1 ILE A 33 -6.795 16.721 17.266 1.00 22.40 C ATOM 0 H ILE A 33 -8.429 19.387 13.546 1.00 20.21 H new ATOM 0 HA ILE A 33 -8.599 16.488 13.282 1.00 61.21 H new ATOM 0 HB ILE A 33 -6.697 16.839 14.490 1.00 24.44 H new ATOM 0 HG12 ILE A 33 -8.775 17.243 16.668 1.00 52.23 H new ATOM 0 HG13 ILE A 33 -8.221 15.699 16.052 1.00 52.23 H new ATOM 0 HG21 ILE A 33 -6.250 18.844 15.853 1.00 24.52 H new ATOM 0 HG22 ILE A 33 -6.780 19.272 14.209 1.00 24.52 H new ATOM 0 HG23 ILE A 33 -7.916 19.402 15.573 1.00 24.52 H new ATOM 0 HD11 ILE A 33 -7.137 16.234 18.179 1.00 22.40 H new ATOM 0 HD12 ILE A 33 -5.939 16.179 16.864 1.00 22.40 H new ATOM 0 HD13 ILE A 33 -6.502 17.747 17.490 1.00 22.40 H new ATOM 441 N THR A 34 -10.323 18.218 15.535 1.00 43.02 N ATOM 442 CA THR A 34 -11.535 18.206 16.344 1.00 20.02 C ATOM 443 C THR A 34 -12.689 17.550 15.596 1.00 42.34 C ATOM 444 O THR A 34 -13.404 16.712 16.148 1.00 32.35 O ATOM 445 CB THR A 34 -11.949 19.632 16.756 1.00 11.10 C ATOM 446 OG1 THR A 34 -13.246 19.609 17.364 1.00 35.33 O ATOM 447 CG2 THR A 34 -11.965 20.560 15.550 1.00 31.24 C ATOM 0 H THR A 34 -9.752 19.056 15.643 1.00 43.02 H new ATOM 0 HA THR A 34 -11.311 17.627 17.240 1.00 20.02 H new ATOM 0 HB THR A 34 -11.219 20.006 17.473 1.00 11.10 H new ATOM 0 HG1 THR A 34 -13.501 20.519 17.624 1.00 35.33 H new ATOM 0 HG21 THR A 34 -12.260 21.561 15.865 1.00 31.24 H new ATOM 0 HG22 THR A 34 -10.970 20.598 15.107 1.00 31.24 H new ATOM 0 HG23 THR A 34 -12.677 20.187 14.813 1.00 31.24 H new ATOM 455 N ASP A 35 -12.867 17.935 14.338 1.00 70.23 N ATOM 456 CA ASP A 35 -13.934 17.382 13.512 1.00 4.41 C ATOM 457 C ASP A 35 -13.722 15.889 13.278 1.00 61.13 C ATOM 458 O ASP A 35 -14.595 15.073 13.575 1.00 74.52 O ATOM 459 CB ASP A 35 -14.005 18.116 12.173 1.00 42.23 C ATOM 460 CG ASP A 35 -15.432 18.324 11.701 1.00 12.13 C ATOM 461 OD1 ASP A 35 -16.039 17.353 11.204 1.00 24.52 O ATOM 462 OD2 ASP A 35 -15.940 19.458 11.829 1.00 54.42 O ATOM 0 H ASP A 35 -12.286 18.628 13.867 1.00 70.23 H new ATOM 0 HA ASP A 35 -14.877 17.518 14.042 1.00 4.41 H new ATOM 0 HB2 ASP A 35 -13.511 19.083 12.266 1.00 42.23 H new ATOM 0 HB3 ASP A 35 -13.456 17.549 11.421 1.00 42.23 H new ATOM 466 N LYS A 36 -12.558 15.540 12.741 1.00 41.32 N ATOM 467 CA LYS A 36 -12.230 14.146 12.466 1.00 24.32 C ATOM 468 C LYS A 36 -12.256 13.318 13.746 1.00 62.31 C ATOM 469 O LYS A 36 -12.838 12.234 13.784 1.00 24.52 O ATOM 470 CB LYS A 36 -10.851 14.045 11.809 1.00 64.21 C ATOM 471 CG LYS A 36 -10.813 13.105 10.617 1.00 21.10 C ATOM 472 CD LYS A 36 -10.951 13.859 9.305 1.00 5.31 C ATOM 473 CE LYS A 36 -10.420 13.046 8.135 1.00 61.41 C ATOM 474 NZ LYS A 36 -10.985 11.668 8.115 1.00 63.51 N ATOM 0 H LYS A 36 -11.826 16.203 12.487 1.00 41.32 H new ATOM 0 HA LYS A 36 -12.982 13.750 11.783 1.00 24.32 H new ATOM 0 HB2 LYS A 36 -10.537 15.038 11.488 1.00 64.21 H new ATOM 0 HB3 LYS A 36 -10.128 13.707 12.551 1.00 64.21 H new ATOM 0 HG2 LYS A 36 -9.875 12.549 10.621 1.00 21.10 H new ATOM 0 HG3 LYS A 36 -11.617 12.374 10.704 1.00 21.10 H new ATOM 0 HD2 LYS A 36 -11.999 14.103 9.133 1.00 5.31 H new ATOM 0 HD3 LYS A 36 -10.410 14.803 9.368 1.00 5.31 H new ATOM 0 HE2 LYS A 36 -10.664 13.552 7.201 1.00 61.41 H new ATOM 0 HE3 LYS A 36 -9.333 12.992 8.194 1.00 61.41 H new ATOM 0 HZ1 LYS A 36 -10.794 11.228 7.192 1.00 63.51 H new ATOM 0 HZ2 LYS A 36 -10.544 11.101 8.867 1.00 63.51 H new ATOM 0 HZ3 LYS A 36 -12.012 11.712 8.272 1.00 63.51 H new ATOM 484 N ALA A 37 -11.623 13.835 14.793 1.00 23.04 N ATOM 485 CA ALA A 37 -11.577 13.145 16.076 1.00 22.25 C ATOM 486 C ALA A 37 -12.981 12.853 16.593 1.00 2.15 C ATOM 487 O ALA A 37 -13.285 11.727 16.989 1.00 24.33 O ATOM 488 CB ALA A 37 -10.799 13.971 17.092 1.00 51.54 C ATOM 0 H ALA A 37 -11.134 14.730 14.778 1.00 23.04 H new ATOM 0 HA ALA A 37 -11.067 12.193 15.931 1.00 22.25 H new ATOM 0 HB1 ALA A 37 -10.773 13.444 18.046 1.00 51.54 H new ATOM 0 HB2 ALA A 37 -9.781 14.124 16.734 1.00 51.54 H new ATOM 0 HB3 ALA A 37 -11.286 14.937 17.225 1.00 51.54 H new ATOM 494 N ASP A 38 -13.833 13.872 16.588 1.00 22.40 N ATOM 495 CA ASP A 38 -15.206 13.725 17.056 1.00 72.31 C ATOM 496 C ASP A 38 -15.870 12.509 16.416 1.00 65.01 C ATOM 497 O ASP A 38 -16.830 11.958 16.954 1.00 45.42 O ATOM 498 CB ASP A 38 -16.012 14.986 16.743 1.00 44.23 C ATOM 499 CG ASP A 38 -17.245 15.116 17.616 1.00 23.12 C ATOM 500 OD1 ASP A 38 -17.087 15.334 18.836 1.00 62.31 O ATOM 501 OD2 ASP A 38 -18.367 14.999 17.080 1.00 24.04 O ATOM 0 H ASP A 38 -13.597 14.810 16.265 1.00 22.40 H new ATOM 0 HA ASP A 38 -15.183 13.578 18.136 1.00 72.31 H new ATOM 0 HB2 ASP A 38 -15.379 15.862 16.881 1.00 44.23 H new ATOM 0 HB3 ASP A 38 -16.312 14.971 15.695 1.00 44.23 H new ATOM 505 N LYS A 39 -15.353 12.098 15.264 1.00 52.21 N ATOM 506 CA LYS A 39 -15.894 10.948 14.549 1.00 42.44 C ATOM 507 C LYS A 39 -15.122 9.678 14.895 1.00 22.04 C ATOM 508 O LYS A 39 -15.707 8.606 15.051 1.00 2.11 O ATOM 509 CB LYS A 39 -15.847 11.190 13.040 1.00 60.53 C ATOM 510 CG LYS A 39 -16.894 10.410 12.265 1.00 75.35 C ATOM 511 CD LYS A 39 -17.211 11.071 10.933 1.00 54.52 C ATOM 512 CE LYS A 39 -18.617 10.732 10.464 1.00 42.12 C ATOM 513 NZ LYS A 39 -18.784 9.272 10.218 1.00 61.11 N ATOM 0 H LYS A 39 -14.559 12.544 14.805 1.00 52.21 H new ATOM 0 HA LYS A 39 -16.931 10.817 14.857 1.00 42.44 H new ATOM 0 HB2 LYS A 39 -15.983 12.254 12.847 1.00 60.53 H new ATOM 0 HB3 LYS A 39 -14.858 10.922 12.668 1.00 60.53 H new ATOM 0 HG2 LYS A 39 -16.538 9.394 12.092 1.00 75.35 H new ATOM 0 HG3 LYS A 39 -17.804 10.332 12.859 1.00 75.35 H new ATOM 0 HD2 LYS A 39 -17.109 12.152 11.029 1.00 54.52 H new ATOM 0 HD3 LYS A 39 -16.488 10.747 10.184 1.00 54.52 H new ATOM 0 HE2 LYS A 39 -19.338 11.059 11.213 1.00 42.12 H new ATOM 0 HE3 LYS A 39 -18.837 11.282 9.549 1.00 42.12 H new ATOM 0 HZ1 LYS A 39 -19.734 9.091 9.835 1.00 61.11 H new ATOM 0 HZ2 LYS A 39 -18.069 8.951 9.535 1.00 61.11 H new ATOM 0 HZ3 LYS A 39 -18.666 8.754 11.112 1.00 61.11 H new ATOM 523 N VAL A 40 -13.805 9.808 15.017 1.00 34.11 N ATOM 524 CA VAL A 40 -12.953 8.672 15.347 1.00 12.11 C ATOM 525 C VAL A 40 -13.289 8.115 16.725 1.00 4.23 C ATOM 526 O VAL A 40 -12.751 7.089 17.141 1.00 71.44 O ATOM 527 CB VAL A 40 -11.462 9.059 15.311 1.00 12.54 C ATOM 528 CG1 VAL A 40 -11.174 9.969 14.127 1.00 51.03 C ATOM 529 CG2 VAL A 40 -11.054 9.726 16.617 1.00 63.22 C ATOM 0 H VAL A 40 -13.305 10.688 14.892 1.00 34.11 H new ATOM 0 HA VAL A 40 -13.140 7.907 14.594 1.00 12.11 H new ATOM 0 HB VAL A 40 -10.872 8.150 15.192 1.00 12.54 H new ATOM 0 HG11 VAL A 40 -10.116 10.231 14.119 1.00 51.03 H new ATOM 0 HG12 VAL A 40 -11.427 9.452 13.201 1.00 51.03 H new ATOM 0 HG13 VAL A 40 -11.772 10.876 14.211 1.00 51.03 H new ATOM 0 HG21 VAL A 40 -9.998 9.993 16.575 1.00 63.22 H new ATOM 0 HG22 VAL A 40 -11.650 10.626 16.768 1.00 63.22 H new ATOM 0 HG23 VAL A 40 -11.221 9.037 17.445 1.00 63.22 H new ATOM 539 N ALA A 41 -14.183 8.800 17.432 1.00 53.40 N ATOM 540 CA ALA A 41 -14.593 8.372 18.763 1.00 4.35 C ATOM 541 C ALA A 41 -15.836 7.490 18.698 1.00 14.13 C ATOM 542 O ALA A 41 -16.163 6.789 19.655 1.00 23.24 O ATOM 543 CB ALA A 41 -14.848 9.582 19.651 1.00 11.02 C ATOM 0 H ALA A 41 -14.636 9.653 17.105 1.00 53.40 H new ATOM 0 HA ALA A 41 -13.784 7.783 19.194 1.00 4.35 H new ATOM 0 HB1 ALA A 41 -15.154 9.248 20.642 1.00 11.02 H new ATOM 0 HB2 ALA A 41 -13.935 10.172 19.732 1.00 11.02 H new ATOM 0 HB3 ALA A 41 -15.638 10.193 19.215 1.00 11.02 H new ATOM 549 N GLY A 42 -16.525 7.531 17.562 1.00 41.44 N ATOM 550 CA GLY A 42 -17.725 6.731 17.394 1.00 52.34 C ATOM 551 C GLY A 42 -17.441 5.385 16.757 1.00 34.32 C ATOM 552 O GLY A 42 -18.352 4.588 16.538 1.00 43.12 O ATOM 0 H GLY A 42 -16.274 8.103 16.756 1.00 41.44 H new ATOM 0 HA2 GLY A 42 -18.194 6.578 18.366 1.00 52.34 H new ATOM 0 HA3 GLY A 42 -18.439 7.278 16.778 1.00 52.34 H new ATOM 555 N LYS A 43 -16.171 5.132 16.456 1.00 61.11 N ATOM 556 CA LYS A 43 -15.768 3.874 15.840 1.00 35.33 C ATOM 557 C LYS A 43 -14.716 3.164 16.687 1.00 24.45 C ATOM 558 O LYS A 43 -14.707 1.938 16.786 1.00 1.22 O ATOM 559 CB LYS A 43 -15.219 4.124 14.432 1.00 4.12 C ATOM 560 CG LYS A 43 -13.711 3.977 14.332 1.00 52.14 C ATOM 561 CD LYS A 43 -12.995 5.240 14.784 1.00 41.34 C ATOM 562 CE LYS A 43 -11.675 4.918 15.466 1.00 34.01 C ATOM 563 NZ LYS A 43 -10.550 5.712 14.900 1.00 72.24 N ATOM 0 H LYS A 43 -15.404 5.782 16.629 1.00 61.11 H new ATOM 0 HA LYS A 43 -16.648 3.234 15.773 1.00 35.33 H new ATOM 0 HB2 LYS A 43 -15.690 3.428 13.739 1.00 4.12 H new ATOM 0 HB3 LYS A 43 -15.499 5.128 14.115 1.00 4.12 H new ATOM 0 HG2 LYS A 43 -13.386 3.135 14.943 1.00 52.14 H new ATOM 0 HG3 LYS A 43 -13.434 3.750 13.302 1.00 52.14 H new ATOM 0 HD2 LYS A 43 -12.814 5.884 13.924 1.00 41.34 H new ATOM 0 HD3 LYS A 43 -13.634 5.796 15.470 1.00 41.34 H new ATOM 0 HE2 LYS A 43 -11.760 5.119 16.534 1.00 34.01 H new ATOM 0 HE3 LYS A 43 -11.460 3.855 15.357 1.00 34.01 H new ATOM 0 HZ1 LYS A 43 -9.841 5.069 14.495 1.00 72.24 H new ATOM 0 HZ2 LYS A 43 -10.910 6.343 14.156 1.00 72.24 H new ATOM 0 HZ3 LYS A 43 -10.112 6.280 15.653 1.00 72.24 H new ATOM 573 N VAL A 44 -13.831 3.946 17.299 1.00 35.53 N ATOM 574 CA VAL A 44 -12.776 3.393 18.141 1.00 43.02 C ATOM 575 C VAL A 44 -13.298 2.239 18.988 1.00 3.10 C ATOM 576 O VAL A 44 -12.657 1.193 19.093 1.00 21.24 O ATOM 577 CB VAL A 44 -12.178 4.467 19.069 1.00 52.01 C ATOM 578 CG1 VAL A 44 -13.270 5.381 19.602 1.00 30.52 C ATOM 579 CG2 VAL A 44 -11.411 3.817 20.210 1.00 50.40 C ATOM 0 H VAL A 44 -13.824 4.963 17.227 1.00 35.53 H new ATOM 0 HA VAL A 44 -11.997 3.026 17.473 1.00 43.02 H new ATOM 0 HB VAL A 44 -11.480 5.074 18.492 1.00 52.01 H new ATOM 0 HG11 VAL A 44 -12.828 6.133 20.256 1.00 30.52 H new ATOM 0 HG12 VAL A 44 -13.771 5.874 18.769 1.00 30.52 H new ATOM 0 HG13 VAL A 44 -13.995 4.792 20.164 1.00 30.52 H new ATOM 0 HG21 VAL A 44 -10.995 4.590 20.856 1.00 50.40 H new ATOM 0 HG22 VAL A 44 -12.085 3.185 20.788 1.00 50.40 H new ATOM 0 HG23 VAL A 44 -10.602 3.209 19.805 1.00 50.40 H new ATOM 589 N GLN A 45 -14.466 2.436 19.592 1.00 51.34 N ATOM 590 CA GLN A 45 -15.075 1.411 20.431 1.00 74.15 C ATOM 591 C GLN A 45 -15.316 0.130 19.637 1.00 43.20 C ATOM 592 O GLN A 45 -16.157 0.078 18.739 1.00 15.11 O ATOM 593 CB GLN A 45 -16.393 1.918 21.018 1.00 41.23 C ATOM 594 CG GLN A 45 -16.324 3.349 21.522 1.00 11.55 C ATOM 595 CD GLN A 45 -17.399 3.661 22.544 1.00 44.35 C ATOM 596 OE1 GLN A 45 -18.657 3.554 22.131 1.00 62.23 O flip ATOM 597 NE2 GLN A 45 -17.104 3.994 23.692 1.00 33.32 N flip ATOM 0 H GLN A 45 -15.009 3.296 19.516 1.00 51.34 H new ATOM 0 HA GLN A 45 -14.386 1.188 21.246 1.00 74.15 H new ATOM 0 HB2 GLN A 45 -17.171 1.847 20.258 1.00 41.23 H new ATOM 0 HB3 GLN A 45 -16.690 1.266 21.840 1.00 41.23 H new ATOM 0 HG2 GLN A 45 -15.344 3.527 21.965 1.00 11.55 H new ATOM 0 HG3 GLN A 45 -16.421 4.032 20.678 1.00 11.55 H new ATOM 0 HE21 GLN A 45 -16.124 4.064 23.967 1.00 33.32 H new ATOM 0 HE22 GLN A 45 -17.839 4.200 24.368 1.00 33.32 H new ATOM 604 N PRO A 46 -14.564 -0.927 19.976 1.00 74.35 N ATOM 605 CA PRO A 46 -14.678 -2.226 19.306 1.00 74.12 C ATOM 606 C PRO A 46 -15.990 -2.932 19.633 1.00 74.14 C ATOM 607 O PRO A 46 -16.370 -3.895 18.965 1.00 32.44 O ATOM 608 CB PRO A 46 -13.492 -3.018 19.863 1.00 23.31 C ATOM 609 CG PRO A 46 -13.208 -2.394 21.185 1.00 4.32 C ATOM 610 CD PRO A 46 -13.542 -0.936 21.036 1.00 4.12 C ATOM 0 HA PRO A 46 -14.670 -2.127 18.221 1.00 74.12 H new ATOM 0 HB2 PRO A 46 -13.736 -4.075 19.968 1.00 23.31 H new ATOM 0 HB3 PRO A 46 -12.628 -2.955 19.202 1.00 23.31 H new ATOM 0 HG2 PRO A 46 -13.808 -2.853 21.970 1.00 4.32 H new ATOM 0 HG3 PRO A 46 -12.163 -2.528 21.463 1.00 4.32 H new ATOM 0 HD2 PRO A 46 -13.924 -0.514 21.966 1.00 4.12 H new ATOM 0 HD3 PRO A 46 -12.667 -0.350 20.756 1.00 4.12 H new ATOM 615 N GLU A 47 -16.677 -2.448 20.662 1.00 70.43 N ATOM 616 CA GLU A 47 -17.946 -3.035 21.076 1.00 40.04 C ATOM 617 C GLU A 47 -19.116 -2.352 20.372 1.00 1.01 C ATOM 618 O GLU A 47 -20.275 -2.708 20.584 1.00 42.11 O ATOM 619 CB GLU A 47 -18.114 -2.924 22.592 1.00 44.52 C ATOM 620 CG GLU A 47 -17.871 -1.525 23.131 1.00 35.23 C ATOM 621 CD GLU A 47 -18.311 -1.371 24.574 1.00 2.45 C ATOM 622 OE1 GLU A 47 -18.954 -2.303 25.102 1.00 25.43 O ATOM 623 OE2 GLU A 47 -18.011 -0.318 25.176 1.00 74.43 O ATOM 0 H GLU A 47 -16.377 -1.652 21.224 1.00 70.43 H new ATOM 0 HA GLU A 47 -17.939 -4.088 20.795 1.00 40.04 H new ATOM 0 HB2 GLU A 47 -19.123 -3.238 22.861 1.00 44.52 H new ATOM 0 HB3 GLU A 47 -17.425 -3.616 23.077 1.00 44.52 H new ATOM 0 HG2 GLU A 47 -16.810 -1.288 23.051 1.00 35.23 H new ATOM 0 HG3 GLU A 47 -18.406 -0.804 22.513 1.00 35.23 H new ATOM 628 N ASP A 48 -18.803 -1.370 19.535 1.00 70.50 N ATOM 629 CA ASP A 48 -19.826 -0.637 18.799 1.00 45.34 C ATOM 630 C ASP A 48 -20.134 -1.319 17.469 1.00 21.41 C ATOM 631 O ASP A 48 -20.807 -0.751 16.610 1.00 30.13 O ATOM 632 CB ASP A 48 -19.377 0.805 18.555 1.00 15.44 C ATOM 633 CG ASP A 48 -19.935 1.767 19.585 1.00 64.20 C ATOM 634 OD1 ASP A 48 -19.924 1.424 20.786 1.00 32.42 O ATOM 635 OD2 ASP A 48 -20.383 2.863 19.190 1.00 44.10 O ATOM 0 H ASP A 48 -17.848 -1.063 19.349 1.00 70.50 H new ATOM 0 HA ASP A 48 -20.734 -0.629 19.401 1.00 45.34 H new ATOM 0 HB2 ASP A 48 -18.288 0.851 18.571 1.00 15.44 H new ATOM 0 HB3 ASP A 48 -19.694 1.118 17.560 1.00 15.44 H new ATOM 639 N ASN A 49 -19.634 -2.540 17.307 1.00 63.11 N ATOM 640 CA ASN A 49 -19.853 -3.298 16.080 1.00 15.24 C ATOM 641 C ASN A 49 -21.343 -3.436 15.785 1.00 53.04 C ATOM 642 O ASN A 49 -21.746 -3.614 14.635 1.00 0.30 O ATOM 643 CB ASN A 49 -19.213 -4.683 16.192 1.00 11.40 C ATOM 644 CG ASN A 49 -20.098 -5.672 16.928 1.00 22.23 C ATOM 645 OD1 ASN A 49 -20.490 -6.700 16.378 1.00 12.23 O ATOM 646 ND2 ASN A 49 -20.417 -5.361 18.179 1.00 30.11 N ATOM 0 H ASN A 49 -19.075 -3.025 18.009 1.00 63.11 H new ATOM 0 HA ASN A 49 -19.387 -2.755 15.258 1.00 15.24 H new ATOM 0 HB2 ASN A 49 -19.000 -5.064 15.193 1.00 11.40 H new ATOM 0 HB3 ASN A 49 -18.258 -4.598 16.711 1.00 11.40 H new ATOM 0 HD21 ASN A 49 -21.010 -5.986 18.724 1.00 30.11 H new ATOM 0 HD22 ASN A 49 -20.069 -4.497 18.594 1.00 30.11 H new ATOM 652 N LYS A 50 -22.158 -3.352 16.831 1.00 43.51 N ATOM 653 CA LYS A 50 -23.604 -3.466 16.686 1.00 62.33 C ATOM 654 C LYS A 50 -24.248 -2.089 16.551 1.00 33.32 C ATOM 655 O LYS A 50 -25.080 -1.866 15.673 1.00 64.34 O ATOM 656 CB LYS A 50 -24.202 -4.203 17.886 1.00 52.25 C ATOM 657 CG LYS A 50 -24.314 -5.705 17.683 1.00 60.25 C ATOM 658 CD LYS A 50 -25.501 -6.282 18.437 1.00 55.23 C ATOM 659 CE LYS A 50 -25.573 -7.794 18.288 1.00 50.23 C ATOM 660 NZ LYS A 50 -26.816 -8.352 18.888 1.00 51.43 N ATOM 0 H LYS A 50 -21.841 -3.205 17.789 1.00 43.51 H new ATOM 0 HA LYS A 50 -23.808 -4.035 15.779 1.00 62.33 H new ATOM 0 HB2 LYS A 50 -23.587 -4.008 18.765 1.00 52.25 H new ATOM 0 HB3 LYS A 50 -25.192 -3.798 18.094 1.00 52.25 H new ATOM 0 HG2 LYS A 50 -24.416 -5.923 16.620 1.00 60.25 H new ATOM 0 HG3 LYS A 50 -23.397 -6.188 18.021 1.00 60.25 H new ATOM 0 HD2 LYS A 50 -25.424 -6.022 19.493 1.00 55.23 H new ATOM 0 HD3 LYS A 50 -26.423 -5.834 18.065 1.00 55.23 H new ATOM 0 HE2 LYS A 50 -25.530 -8.057 17.231 1.00 50.23 H new ATOM 0 HE3 LYS A 50 -24.704 -8.248 18.765 1.00 50.23 H new ATOM 0 HZ1 LYS A 50 -26.827 -9.385 18.766 1.00 51.43 H new ATOM 0 HZ2 LYS A 50 -26.845 -8.123 19.902 1.00 51.43 H new ATOM 0 HZ3 LYS A 50 -27.645 -7.939 18.416 1.00 51.43 H new ATOM 670 N GLY A 51 -23.854 -1.168 17.426 1.00 73.05 N ATOM 671 CA GLY A 51 -24.401 0.175 17.386 1.00 23.21 C ATOM 672 C GLY A 51 -24.383 0.767 15.991 1.00 70.22 C ATOM 673 O GLY A 51 -25.158 1.673 15.683 1.00 70.52 O ATOM 0 H GLY A 51 -23.166 -1.329 18.162 1.00 73.05 H new ATOM 0 HA2 GLY A 51 -25.426 0.158 17.757 1.00 23.21 H new ATOM 0 HA3 GLY A 51 -23.830 0.817 18.057 1.00 23.21 H new ATOM 676 N VAL A 52 -23.496 0.255 15.143 1.00 14.12 N ATOM 677 CA VAL A 52 -23.379 0.739 13.773 1.00 44.22 C ATOM 678 C VAL A 52 -24.621 0.391 12.960 1.00 51.52 C ATOM 679 O VAL A 52 -25.119 1.207 12.185 1.00 22.44 O ATOM 680 CB VAL A 52 -22.139 0.151 13.073 1.00 50.32 C ATOM 681 CG1 VAL A 52 -20.891 0.395 13.907 1.00 12.22 C ATOM 682 CG2 VAL A 52 -22.332 -1.334 12.807 1.00 13.54 C ATOM 0 H VAL A 52 -22.848 -0.495 15.381 1.00 14.12 H new ATOM 0 HA VAL A 52 -23.275 1.823 13.828 1.00 44.22 H new ATOM 0 HB VAL A 52 -22.010 0.654 12.114 1.00 50.32 H new ATOM 0 HG11 VAL A 52 -20.025 -0.027 13.398 1.00 12.22 H new ATOM 0 HG12 VAL A 52 -20.747 1.467 14.041 1.00 12.22 H new ATOM 0 HG13 VAL A 52 -21.006 -0.080 14.881 1.00 12.22 H new ATOM 0 HG21 VAL A 52 -21.447 -1.733 12.312 1.00 13.54 H new ATOM 0 HG22 VAL A 52 -22.486 -1.856 13.752 1.00 13.54 H new ATOM 0 HG23 VAL A 52 -23.202 -1.479 12.166 1.00 13.54 H new ATOM 692 N PHE A 53 -25.117 -0.829 13.142 1.00 24.42 N ATOM 693 CA PHE A 53 -26.302 -1.286 12.425 1.00 71.24 C ATOM 694 C PHE A 53 -27.570 -0.984 13.217 1.00 14.25 C ATOM 695 O PHE A 53 -28.678 -1.053 12.687 1.00 34.42 O ATOM 696 CB PHE A 53 -26.207 -2.788 12.147 1.00 73.35 C ATOM 697 CG PHE A 53 -26.866 -3.635 13.198 1.00 30.31 C ATOM 698 CD1 PHE A 53 -26.157 -4.057 14.310 1.00 13.42 C ATOM 699 CD2 PHE A 53 -28.194 -4.008 13.073 1.00 60.54 C ATOM 700 CE1 PHE A 53 -26.761 -4.837 15.279 1.00 24.31 C ATOM 701 CE2 PHE A 53 -28.804 -4.787 14.037 1.00 53.33 C ATOM 702 CZ PHE A 53 -28.087 -5.201 15.142 1.00 13.43 C ATOM 0 H PHE A 53 -24.717 -1.518 13.779 1.00 24.42 H new ATOM 0 HA PHE A 53 -26.351 -0.749 11.478 1.00 71.24 H new ATOM 0 HB2 PHE A 53 -26.665 -3.000 11.181 1.00 73.35 H new ATOM 0 HB3 PHE A 53 -25.157 -3.070 12.071 1.00 73.35 H new ATOM 0 HD1 PHE A 53 -25.121 -3.774 14.422 1.00 13.42 H new ATOM 0 HD2 PHE A 53 -28.760 -3.686 12.211 1.00 60.54 H new ATOM 0 HE1 PHE A 53 -26.197 -5.161 16.141 1.00 24.31 H new ATOM 0 HE2 PHE A 53 -29.840 -5.072 13.927 1.00 53.33 H new ATOM 0 HZ PHE A 53 -28.562 -5.808 15.898 1.00 13.43 H new ATOM 711 N GLN A 54 -27.396 -0.649 14.493 1.00 61.14 N ATOM 712 CA GLN A 54 -28.526 -0.336 15.360 1.00 61.13 C ATOM 713 C GLN A 54 -29.280 0.888 14.852 1.00 20.23 C ATOM 714 O GLN A 54 -30.510 0.902 14.818 1.00 4.33 O ATOM 715 CB GLN A 54 -28.046 -0.097 16.792 1.00 15.04 C ATOM 716 CG GLN A 54 -29.041 -0.543 17.850 1.00 22.01 C ATOM 717 CD GLN A 54 -28.894 0.223 19.151 1.00 74.31 C ATOM 718 OE1 GLN A 54 -28.277 1.288 19.190 1.00 32.12 O ATOM 719 NE2 GLN A 54 -29.461 -0.316 20.223 1.00 34.12 N ATOM 0 H GLN A 54 -26.485 -0.588 14.948 1.00 61.14 H new ATOM 0 HA GLN A 54 -29.206 -1.188 15.350 1.00 61.13 H new ATOM 0 HB2 GLN A 54 -27.105 -0.626 16.944 1.00 15.04 H new ATOM 0 HB3 GLN A 54 -27.839 0.965 16.924 1.00 15.04 H new ATOM 0 HG2 GLN A 54 -30.054 -0.412 17.469 1.00 22.01 H new ATOM 0 HG3 GLN A 54 -28.908 -1.608 18.043 1.00 22.01 H new ATOM 0 HE21 GLN A 54 -29.963 -1.201 20.144 1.00 34.12 H new ATOM 0 HE22 GLN A 54 -29.395 0.154 21.126 1.00 34.12 H new ATOM 726 N GLY A 55 -28.533 1.916 14.458 1.00 42.44 N ATOM 727 CA GLY A 55 -29.149 3.131 13.958 1.00 42.35 C ATOM 728 C GLY A 55 -29.331 3.112 12.453 1.00 33.14 C ATOM 729 O GLY A 55 -30.120 3.882 11.905 1.00 10.14 O ATOM 0 H GLY A 55 -27.513 1.928 14.476 1.00 42.44 H new ATOM 0 HA2 GLY A 55 -30.119 3.266 14.436 1.00 42.35 H new ATOM 0 HA3 GLY A 55 -28.534 3.987 14.236 1.00 42.35 H new ATOM 732 N VAL A 56 -28.595 2.231 11.781 1.00 40.13 N ATOM 733 CA VAL A 56 -28.678 2.116 10.330 1.00 63.22 C ATOM 734 C VAL A 56 -29.825 1.200 9.915 1.00 21.03 C ATOM 735 O VAL A 56 -30.704 1.595 9.151 1.00 25.51 O ATOM 736 CB VAL A 56 -27.365 1.577 9.733 1.00 13.24 C ATOM 737 CG1 VAL A 56 -27.640 0.767 8.476 1.00 63.10 C ATOM 738 CG2 VAL A 56 -26.404 2.719 9.442 1.00 71.30 C ATOM 0 H VAL A 56 -27.935 1.587 12.218 1.00 40.13 H new ATOM 0 HA VAL A 56 -28.860 3.119 9.944 1.00 63.22 H new ATOM 0 HB VAL A 56 -26.899 0.917 10.465 1.00 13.24 H new ATOM 0 HG11 VAL A 56 -26.699 0.395 8.070 1.00 63.10 H new ATOM 0 HG12 VAL A 56 -28.288 -0.075 8.720 1.00 63.10 H new ATOM 0 HG13 VAL A 56 -28.130 1.399 7.736 1.00 63.10 H new ATOM 0 HG21 VAL A 56 -25.481 2.320 9.021 1.00 71.30 H new ATOM 0 HG22 VAL A 56 -26.861 3.406 8.730 1.00 71.30 H new ATOM 0 HG23 VAL A 56 -26.180 3.251 10.367 1.00 71.30 H new ATOM 748 N HIS A 57 -29.809 -0.027 10.426 1.00 1.44 N ATOM 749 CA HIS A 57 -30.849 -1.000 10.110 1.00 11.44 C ATOM 750 C HIS A 57 -32.235 -0.414 10.358 1.00 22.01 C ATOM 751 O HIS A 57 -33.111 -0.483 9.497 1.00 64.13 O ATOM 752 CB HIS A 57 -30.661 -2.267 10.946 1.00 3.22 C ATOM 753 CG HIS A 57 -31.669 -3.334 10.650 1.00 55.13 C ATOM 754 ND1 HIS A 57 -32.938 -3.343 11.189 1.00 44.02 N ATOM 755 CD2 HIS A 57 -31.590 -4.433 9.862 1.00 3.44 C ATOM 756 CE1 HIS A 57 -33.595 -4.400 10.748 1.00 70.33 C ATOM 757 NE2 HIS A 57 -32.799 -5.078 9.941 1.00 52.42 N ATOM 0 H HIS A 57 -29.088 -0.371 11.060 1.00 1.44 H new ATOM 0 HA HIS A 57 -30.766 -1.254 9.053 1.00 11.44 H new ATOM 0 HB2 HIS A 57 -29.661 -2.664 10.770 1.00 3.22 H new ATOM 0 HB3 HIS A 57 -30.719 -2.007 12.003 1.00 3.22 H new ATOM 0 HD2 HIS A 57 -30.735 -4.744 9.280 1.00 3.44 H new ATOM 0 HE1 HIS A 57 -34.610 -4.665 11.004 1.00 70.33 H new ATOM 0 HE2 HIS A 57 -33.043 -5.941 9.455 1.00 52.42 H new ATOM 764 N ASP A 58 -32.426 0.162 11.541 1.00 71.55 N ATOM 765 CA ASP A 58 -33.706 0.762 11.900 1.00 13.23 C ATOM 766 C ASP A 58 -34.085 1.866 10.919 1.00 11.34 C ATOM 767 O ASP A 58 -35.262 2.184 10.752 1.00 71.44 O ATOM 768 CB ASP A 58 -33.648 1.324 13.322 1.00 53.33 C ATOM 769 CG ASP A 58 -33.835 0.250 14.377 1.00 42.31 C ATOM 770 OD1 ASP A 58 -34.498 -0.766 14.078 1.00 32.44 O ATOM 771 OD2 ASP A 58 -33.321 0.426 15.501 1.00 23.33 O ATOM 0 H ASP A 58 -31.712 0.226 12.266 1.00 71.55 H new ATOM 0 HA ASP A 58 -34.469 -0.015 11.854 1.00 13.23 H new ATOM 0 HB2 ASP A 58 -32.688 1.817 13.476 1.00 53.33 H new ATOM 0 HB3 ASP A 58 -34.420 2.084 13.441 1.00 53.33 H new ATOM 775 N SER A 59 -33.079 2.448 10.274 1.00 43.13 N ATOM 776 CA SER A 59 -33.306 3.521 9.312 1.00 41.25 C ATOM 777 C SER A 59 -33.607 2.954 7.928 1.00 64.33 C ATOM 778 O SER A 59 -34.236 3.612 7.100 1.00 71.34 O ATOM 779 CB SER A 59 -32.086 4.440 9.245 1.00 21.55 C ATOM 780 OG SER A 59 -31.962 5.211 10.428 1.00 22.22 O ATOM 0 H SER A 59 -32.099 2.195 10.400 1.00 43.13 H new ATOM 0 HA SER A 59 -34.169 4.098 9.645 1.00 41.25 H new ATOM 0 HB2 SER A 59 -31.185 3.844 9.100 1.00 21.55 H new ATOM 0 HB3 SER A 59 -32.172 5.102 8.383 1.00 21.55 H new ATOM 0 HG SER A 59 -31.343 4.767 11.045 1.00 22.22 H new ATOM 785 N ALA A 60 -33.153 1.729 7.685 1.00 62.25 N ATOM 786 CA ALA A 60 -33.375 1.073 6.403 1.00 73.31 C ATOM 787 C ALA A 60 -34.709 0.334 6.388 1.00 74.23 C ATOM 788 O ALA A 60 -35.034 -0.359 5.423 1.00 33.04 O ATOM 789 CB ALA A 60 -32.235 0.113 6.097 1.00 30.44 C ATOM 0 H ALA A 60 -32.629 1.171 8.359 1.00 62.25 H new ATOM 0 HA ALA A 60 -33.406 1.841 5.631 1.00 73.31 H new ATOM 0 HB1 ALA A 60 -32.414 -0.370 5.136 1.00 30.44 H new ATOM 0 HB2 ALA A 60 -31.296 0.665 6.056 1.00 30.44 H new ATOM 0 HB3 ALA A 60 -32.177 -0.644 6.879 1.00 30.44 H new ATOM 795 N GLU A 61 -35.476 0.486 7.462 1.00 73.05 N ATOM 796 CA GLU A 61 -36.774 -0.169 7.571 1.00 4.21 C ATOM 797 C GLU A 61 -37.720 0.310 6.473 1.00 4.43 C ATOM 798 O GLU A 61 -38.055 -0.439 5.556 1.00 42.33 O ATOM 799 CB GLU A 61 -37.392 0.100 8.945 1.00 51.32 C ATOM 800 CG GLU A 61 -38.721 -0.604 9.164 1.00 62.41 C ATOM 801 CD GLU A 61 -39.891 0.164 8.578 1.00 14.45 C ATOM 802 OE1 GLU A 61 -40.386 1.092 9.250 1.00 63.42 O ATOM 803 OE2 GLU A 61 -40.311 -0.166 7.449 1.00 10.14 O ATOM 0 H GLU A 61 -35.222 1.056 8.268 1.00 73.05 H new ATOM 0 HA GLU A 61 -36.622 -1.242 7.452 1.00 4.21 H new ATOM 0 HB2 GLU A 61 -36.691 -0.217 9.717 1.00 51.32 H new ATOM 0 HB3 GLU A 61 -37.535 1.174 9.066 1.00 51.32 H new ATOM 0 HG2 GLU A 61 -38.681 -1.596 8.715 1.00 62.41 H new ATOM 0 HG3 GLU A 61 -38.882 -0.744 10.233 1.00 62.41 H new ATOM 808 N LYS A 62 -38.148 1.564 6.575 1.00 13.23 N ATOM 809 CA LYS A 62 -39.054 2.146 5.592 1.00 5.25 C ATOM 810 C LYS A 62 -38.340 3.199 4.751 1.00 20.44 C ATOM 811 O LYS A 62 -38.971 3.935 3.994 1.00 5.20 O ATOM 812 CB LYS A 62 -40.263 2.771 6.291 1.00 43.44 C ATOM 813 CG LYS A 62 -41.483 2.901 5.395 1.00 51.05 C ATOM 814 CD LYS A 62 -42.327 1.638 5.415 1.00 61.12 C ATOM 815 CE LYS A 62 -41.911 0.672 4.317 1.00 71.42 C ATOM 816 NZ LYS A 62 -42.988 -0.308 4.002 1.00 34.43 N ATOM 0 H LYS A 62 -37.882 2.197 7.329 1.00 13.23 H new ATOM 0 HA LYS A 62 -39.395 1.349 4.932 1.00 5.25 H new ATOM 0 HB2 LYS A 62 -40.523 2.166 7.159 1.00 43.44 H new ATOM 0 HB3 LYS A 62 -39.988 3.758 6.662 1.00 43.44 H new ATOM 0 HG2 LYS A 62 -42.086 3.748 5.721 1.00 51.05 H new ATOM 0 HG3 LYS A 62 -41.165 3.111 4.374 1.00 51.05 H new ATOM 0 HD2 LYS A 62 -42.231 1.151 6.385 1.00 61.12 H new ATOM 0 HD3 LYS A 62 -43.378 1.900 5.292 1.00 61.12 H new ATOM 0 HE2 LYS A 62 -41.656 1.233 3.418 1.00 71.42 H new ATOM 0 HE3 LYS A 62 -41.012 0.137 4.625 1.00 71.42 H new ATOM 0 HZ1 LYS A 62 -42.665 -0.948 3.249 1.00 34.43 H new ATOM 0 HZ2 LYS A 62 -43.214 -0.861 4.853 1.00 34.43 H new ATOM 0 HZ3 LYS A 62 -43.838 0.200 3.684 1.00 34.43 H new ATOM 826 N GLY A 63 -37.019 3.265 4.889 1.00 71.52 N ATOM 827 CA GLY A 63 -36.241 4.231 4.133 1.00 43.44 C ATOM 828 C GLY A 63 -35.326 3.573 3.120 1.00 51.55 C ATOM 829 O GLY A 63 -34.595 4.252 2.400 1.00 34.23 O ATOM 0 H GLY A 63 -36.474 2.667 5.510 1.00 71.52 H new ATOM 0 HA2 GLY A 63 -36.917 4.914 3.618 1.00 43.44 H new ATOM 0 HA3 GLY A 63 -35.645 4.831 4.821 1.00 43.44 H new ATOM 832 N LYS A 64 -35.364 2.246 3.065 1.00 73.14 N ATOM 833 CA LYS A 64 -34.531 1.494 2.133 1.00 63.12 C ATOM 834 C LYS A 64 -35.355 0.988 0.954 1.00 75.34 C ATOM 835 O LYS A 64 -35.048 -0.052 0.370 1.00 41.40 O ATOM 836 CB LYS A 64 -33.867 0.316 2.848 1.00 15.21 C ATOM 837 CG LYS A 64 -32.592 -0.163 2.175 1.00 13.11 C ATOM 838 CD LYS A 64 -31.480 0.867 2.290 1.00 51.45 C ATOM 839 CE LYS A 64 -30.525 0.530 3.425 1.00 72.22 C ATOM 840 NZ LYS A 64 -29.101 0.677 3.013 1.00 31.51 N ATOM 0 H LYS A 64 -35.963 1.669 3.655 1.00 73.14 H new ATOM 0 HA LYS A 64 -33.759 2.163 1.753 1.00 63.12 H new ATOM 0 HB2 LYS A 64 -33.640 0.606 3.874 1.00 15.21 H new ATOM 0 HB3 LYS A 64 -34.574 -0.512 2.900 1.00 15.21 H new ATOM 0 HG2 LYS A 64 -32.270 -1.100 2.629 1.00 13.11 H new ATOM 0 HG3 LYS A 64 -32.790 -0.370 1.123 1.00 13.11 H new ATOM 0 HD2 LYS A 64 -30.929 0.915 1.351 1.00 51.45 H new ATOM 0 HD3 LYS A 64 -31.912 1.854 2.457 1.00 51.45 H new ATOM 0 HE2 LYS A 64 -30.726 1.182 4.275 1.00 72.22 H new ATOM 0 HE3 LYS A 64 -30.703 -0.492 3.758 1.00 72.22 H new ATOM 0 HZ1 LYS A 64 -28.482 0.439 3.814 1.00 31.51 H new ATOM 0 HZ2 LYS A 64 -28.902 0.036 2.218 1.00 31.51 H new ATOM 0 HZ3 LYS A 64 -28.924 1.659 2.719 1.00 31.51 H new ATOM 850 N ASP A 65 -36.401 1.730 0.607 1.00 31.10 N ATOM 851 CA ASP A 65 -37.267 1.358 -0.506 1.00 55.11 C ATOM 852 C ASP A 65 -37.094 2.321 -1.676 1.00 73.40 C ATOM 853 O ASP A 65 -37.900 2.337 -2.605 1.00 1.32 O ATOM 854 CB ASP A 65 -38.729 1.339 -0.057 1.00 22.35 C ATOM 855 CG ASP A 65 -39.310 2.734 0.082 1.00 15.11 C ATOM 856 OD1 ASP A 65 -39.639 3.346 -0.956 1.00 52.01 O ATOM 857 OD2 ASP A 65 -39.435 3.212 1.228 1.00 72.01 O ATOM 0 H ASP A 65 -36.670 2.593 1.080 1.00 31.10 H new ATOM 0 HA ASP A 65 -36.983 0.359 -0.837 1.00 55.11 H new ATOM 0 HB2 ASP A 65 -39.320 0.772 -0.777 1.00 22.35 H new ATOM 0 HB3 ASP A 65 -38.806 0.819 0.898 1.00 22.35 H new ATOM 861 N ASN A 66 -36.035 3.123 -1.624 1.00 11.14 N ATOM 862 CA ASN A 66 -35.756 4.090 -2.679 1.00 32.34 C ATOM 863 C ASN A 66 -35.856 3.438 -4.055 1.00 14.04 C ATOM 864 O ASN A 66 -36.124 4.107 -5.052 1.00 33.24 O ATOM 865 CB ASN A 66 -34.364 4.696 -2.489 1.00 15.43 C ATOM 866 CG ASN A 66 -33.448 3.799 -1.679 1.00 72.24 C ATOM 867 OD1 ASN A 66 -33.296 2.555 -2.121 1.00 70.42 O flip ATOM 868 ND2 ASN A 66 -32.883 4.218 -0.669 1.00 65.32 N flip ATOM 0 H ASN A 66 -35.356 3.122 -0.863 1.00 11.14 H new ATOM 0 HA ASN A 66 -36.501 4.883 -2.617 1.00 32.34 H new ATOM 0 HB2 ASN A 66 -33.916 4.882 -3.465 1.00 15.43 H new ATOM 0 HB3 ASN A 66 -34.456 5.661 -1.991 1.00 15.43 H new ATOM 0 HD21 ASN A 66 -33.028 5.181 -0.366 1.00 65.32 H new ATOM 0 HD22 ASN A 66 -32.269 3.602 -0.135 1.00 65.32 H new ATOM 874 N ALA A 67 -35.638 2.129 -4.100 1.00 54.25 N ATOM 875 CA ALA A 67 -35.706 1.385 -5.352 1.00 75.13 C ATOM 876 C ALA A 67 -37.011 1.668 -6.088 1.00 72.22 C ATOM 877 O ALA A 67 -37.065 1.613 -7.316 1.00 22.40 O ATOM 878 CB ALA A 67 -35.558 -0.106 -5.090 1.00 13.43 C ATOM 0 H ALA A 67 -35.413 1.561 -3.284 1.00 54.25 H new ATOM 0 HA ALA A 67 -34.883 1.714 -5.986 1.00 75.13 H new ATOM 0 HB1 ALA A 67 -35.611 -0.648 -6.034 1.00 13.43 H new ATOM 0 HB2 ALA A 67 -34.596 -0.298 -4.614 1.00 13.43 H new ATOM 0 HB3 ALA A 67 -36.361 -0.442 -4.433 1.00 13.43 H new ATOM 884 N GLU A 68 -38.060 1.967 -5.329 1.00 31.32 N ATOM 885 CA GLU A 68 -39.365 2.257 -5.911 1.00 74.00 C ATOM 886 C GLU A 68 -39.332 3.563 -6.699 1.00 4.33 C ATOM 887 O GLU A 68 -38.602 4.491 -6.352 1.00 30.03 O ATOM 888 CB GLU A 68 -40.431 2.335 -4.816 1.00 33.25 C ATOM 889 CG GLU A 68 -41.853 2.229 -5.341 1.00 31.34 C ATOM 890 CD GLU A 68 -42.891 2.548 -4.283 1.00 61.10 C ATOM 891 OE1 GLU A 68 -42.503 2.740 -3.111 1.00 71.51 O ATOM 892 OE2 GLU A 68 -44.090 2.604 -4.625 1.00 24.32 O ATOM 0 H GLU A 68 -38.032 2.015 -4.311 1.00 31.32 H new ATOM 0 HA GLU A 68 -39.617 1.447 -6.595 1.00 74.00 H new ATOM 0 HB2 GLU A 68 -40.258 1.536 -4.095 1.00 33.25 H new ATOM 0 HB3 GLU A 68 -40.320 3.277 -4.279 1.00 33.25 H new ATOM 0 HG2 GLU A 68 -41.977 2.910 -6.183 1.00 31.34 H new ATOM 0 HG3 GLU A 68 -42.023 1.221 -5.719 1.00 31.34 H new ATOM 897 N GLY A 69 -40.130 3.628 -7.760 1.00 21.33 N ATOM 898 CA GLY A 69 -40.177 4.824 -8.581 1.00 23.43 C ATOM 899 C GLY A 69 -38.805 5.250 -9.064 1.00 23.52 C ATOM 900 O GLY A 69 -38.263 4.668 -10.004 1.00 52.52 O ATOM 0 H GLY A 69 -40.745 2.874 -8.066 1.00 21.33 H new ATOM 0 HA2 GLY A 69 -40.822 4.645 -9.441 1.00 23.43 H new ATOM 0 HA3 GLY A 69 -40.626 5.636 -8.009 1.00 23.43 H new ATOM 903 N GLN A 70 -38.242 6.269 -8.423 1.00 44.02 N ATOM 904 CA GLN A 70 -36.926 6.774 -8.796 1.00 1.22 C ATOM 905 C GLN A 70 -35.855 5.708 -8.585 1.00 4.13 C ATOM 906 O GLN A 70 -36.068 4.735 -7.863 1.00 20.14 O ATOM 907 CB GLN A 70 -36.587 8.023 -7.982 1.00 32.41 C ATOM 908 CG GLN A 70 -35.388 8.790 -8.517 1.00 22.35 C ATOM 909 CD GLN A 70 -35.218 10.144 -7.855 1.00 62.11 C ATOM 910 OE1 GLN A 70 -36.185 10.741 -7.380 1.00 13.12 O ATOM 911 NE2 GLN A 70 -33.985 10.636 -7.821 1.00 14.20 N ATOM 0 H GLN A 70 -38.677 6.761 -7.643 1.00 44.02 H new ATOM 0 HA GLN A 70 -36.950 7.034 -9.854 1.00 1.22 H new ATOM 0 HB2 GLN A 70 -37.454 8.684 -7.968 1.00 32.41 H new ATOM 0 HB3 GLN A 70 -36.391 7.732 -6.950 1.00 32.41 H new ATOM 0 HG2 GLN A 70 -34.485 8.199 -8.363 1.00 22.35 H new ATOM 0 HG3 GLN A 70 -35.500 8.927 -9.593 1.00 22.35 H new ATOM 0 HE21 GLN A 70 -33.213 10.107 -8.227 1.00 14.20 H new ATOM 0 HE22 GLN A 70 -33.810 11.543 -7.389 1.00 14.20 H new ATOM 918 N GLY A 71 -34.703 5.900 -9.220 1.00 54.04 N ATOM 919 CA GLY A 71 -33.617 4.947 -9.089 1.00 32.32 C ATOM 920 C GLY A 71 -32.395 5.346 -9.893 1.00 64.02 C ATOM 921 O GLY A 71 -31.338 5.626 -9.329 1.00 24.43 O ATOM 0 H GLY A 71 -34.503 6.698 -9.823 1.00 54.04 H new ATOM 0 HA2 GLY A 71 -33.343 4.856 -8.038 1.00 32.32 H new ATOM 0 HA3 GLY A 71 -33.958 3.965 -9.416 1.00 32.32 H new ATOM 924 N GLU A 72 -32.540 5.372 -11.215 1.00 3.34 N ATOM 925 CA GLU A 72 -31.438 5.738 -12.096 1.00 62.54 C ATOM 926 C GLU A 72 -31.573 7.184 -12.564 1.00 64.52 C ATOM 927 O GLU A 72 -30.576 7.878 -12.765 1.00 2.01 O ATOM 928 CB GLU A 72 -31.390 4.801 -13.305 1.00 64.34 C ATOM 929 CG GLU A 72 -30.525 3.571 -13.089 1.00 3.30 C ATOM 930 CD GLU A 72 -29.054 3.843 -13.330 1.00 33.43 C ATOM 931 OE1 GLU A 72 -28.705 5.009 -13.614 1.00 74.11 O ATOM 932 OE2 GLU A 72 -28.250 2.893 -13.235 1.00 72.23 O ATOM 0 H GLU A 72 -33.409 5.144 -11.698 1.00 3.34 H new ATOM 0 HA GLU A 72 -30.509 5.642 -11.534 1.00 62.54 H new ATOM 0 HB2 GLU A 72 -32.404 4.483 -13.548 1.00 64.34 H new ATOM 0 HB3 GLU A 72 -31.014 5.353 -14.167 1.00 64.34 H new ATOM 0 HG2 GLU A 72 -30.662 3.210 -12.070 1.00 3.30 H new ATOM 0 HG3 GLU A 72 -30.858 2.776 -13.756 1.00 3.30 H new ATOM 937 N SER A 73 -32.813 7.631 -12.737 1.00 71.21 N ATOM 938 CA SER A 73 -33.079 8.992 -13.187 1.00 11.40 C ATOM 939 C SER A 73 -34.505 9.121 -13.712 1.00 70.43 C ATOM 940 O SER A 73 -35.011 8.230 -14.395 1.00 74.50 O ATOM 941 CB SER A 73 -32.083 9.397 -14.275 1.00 11.12 C ATOM 942 OG SER A 73 -32.655 10.340 -15.164 1.00 61.14 O ATOM 0 H SER A 73 -33.649 7.070 -12.572 1.00 71.21 H new ATOM 0 HA SER A 73 -32.963 9.660 -12.333 1.00 11.40 H new ATOM 0 HB2 SER A 73 -31.190 9.821 -13.816 1.00 11.12 H new ATOM 0 HB3 SER A 73 -31.767 8.514 -14.830 1.00 11.12 H new ATOM 0 HG SER A 73 -31.942 10.818 -15.637 1.00 61.14 H new ATOM 947 N LEU A 74 -35.149 10.238 -13.390 1.00 52.11 N ATOM 948 CA LEU A 74 -36.518 10.486 -13.830 1.00 41.33 C ATOM 949 C LEU A 74 -36.564 10.786 -15.325 1.00 13.12 C ATOM 950 O LEU A 74 -37.638 10.844 -15.923 1.00 15.20 O ATOM 951 CB LEU A 74 -37.123 11.651 -13.045 1.00 44.20 C ATOM 952 CG LEU A 74 -37.400 11.391 -11.563 1.00 73.51 C ATOM 953 CD1 LEU A 74 -38.204 10.113 -11.387 1.00 13.23 C ATOM 954 CD2 LEU A 74 -36.096 11.316 -10.783 1.00 23.03 C ATOM 0 H LEU A 74 -34.745 10.986 -12.826 1.00 52.11 H new ATOM 0 HA LEU A 74 -37.103 9.586 -13.641 1.00 41.33 H new ATOM 0 HB2 LEU A 74 -36.450 12.504 -13.124 1.00 44.20 H new ATOM 0 HB3 LEU A 74 -38.059 11.938 -13.524 1.00 44.20 H new ATOM 0 HG LEU A 74 -37.987 12.221 -11.171 1.00 73.51 H new ATOM 0 HD11 LEU A 74 -38.391 9.944 -10.327 1.00 13.23 H new ATOM 0 HD12 LEU A 74 -39.154 10.205 -11.913 1.00 13.23 H new ATOM 0 HD13 LEU A 74 -37.644 9.272 -11.795 1.00 13.23 H new ATOM 0 HD21 LEU A 74 -36.312 11.131 -9.731 1.00 23.03 H new ATOM 0 HD22 LEU A 74 -35.483 10.505 -11.176 1.00 23.03 H new ATOM 0 HD23 LEU A 74 -35.558 12.259 -10.882 1.00 23.03 H new ATOM 965 N ALA A 75 -35.392 10.974 -15.922 1.00 13.22 N ATOM 966 CA ALA A 75 -35.297 11.263 -17.347 1.00 65.41 C ATOM 967 C ALA A 75 -35.298 9.979 -18.169 1.00 34.45 C ATOM 968 O ALA A 75 -35.807 9.948 -19.289 1.00 45.42 O ATOM 969 CB ALA A 75 -34.047 12.080 -17.638 1.00 75.14 C ATOM 0 H ALA A 75 -34.494 10.931 -15.440 1.00 13.22 H new ATOM 0 HA ALA A 75 -36.172 11.846 -17.634 1.00 65.41 H new ATOM 0 HB1 ALA A 75 -33.989 12.288 -18.706 1.00 75.14 H new ATOM 0 HB2 ALA A 75 -34.090 13.019 -17.087 1.00 75.14 H new ATOM 0 HB3 ALA A 75 -33.165 11.518 -17.330 1.00 75.14 H new ATOM 975 N ASP A 76 -34.721 8.923 -17.606 1.00 74.33 N ATOM 976 CA ASP A 76 -34.655 7.635 -18.288 1.00 35.40 C ATOM 977 C ASP A 76 -36.047 7.164 -18.696 1.00 34.40 C ATOM 978 O ASP A 76 -36.243 6.663 -19.803 1.00 25.01 O ATOM 979 CB ASP A 76 -33.992 6.591 -17.388 1.00 43.33 C ATOM 980 CG ASP A 76 -33.479 5.396 -18.167 1.00 44.01 C ATOM 981 OD1 ASP A 76 -32.921 5.599 -19.266 1.00 30.14 O ATOM 982 OD2 ASP A 76 -33.637 4.257 -17.679 1.00 62.05 O ATOM 0 H ASP A 76 -34.293 8.933 -16.680 1.00 74.33 H new ATOM 0 HA ASP A 76 -34.055 7.759 -19.190 1.00 35.40 H new ATOM 0 HB2 ASP A 76 -33.164 7.053 -16.850 1.00 43.33 H new ATOM 0 HB3 ASP A 76 -34.709 6.253 -16.640 1.00 43.33 H new ATOM 986 N GLN A 77 -37.009 7.326 -17.793 1.00 23.32 N ATOM 987 CA GLN A 77 -38.383 6.915 -18.060 1.00 12.23 C ATOM 988 C GLN A 77 -39.114 7.964 -18.891 1.00 21.04 C ATOM 989 O GLN A 77 -39.891 7.631 -19.784 1.00 71.05 O ATOM 990 CB GLN A 77 -39.129 6.678 -16.746 1.00 63.14 C ATOM 991 CG GLN A 77 -39.823 7.918 -16.208 1.00 1.41 C ATOM 992 CD GLN A 77 -40.419 7.702 -14.830 1.00 24.43 C ATOM 993 OE1 GLN A 77 -40.063 6.755 -14.128 1.00 72.53 O ATOM 994 NE2 GLN A 77 -41.331 8.583 -14.435 1.00 5.11 N ATOM 0 H GLN A 77 -36.863 7.738 -16.872 1.00 23.32 H new ATOM 0 HA GLN A 77 -38.354 5.985 -18.628 1.00 12.23 H new ATOM 0 HB2 GLN A 77 -39.870 5.893 -16.895 1.00 63.14 H new ATOM 0 HB3 GLN A 77 -38.424 6.313 -15.999 1.00 63.14 H new ATOM 0 HG2 GLN A 77 -39.109 8.740 -16.166 1.00 1.41 H new ATOM 0 HG3 GLN A 77 -40.612 8.216 -16.898 1.00 1.41 H new ATOM 0 HE21 GLN A 77 -41.596 9.353 -15.049 1.00 5.11 H new ATOM 0 HE22 GLN A 77 -41.766 8.490 -13.517 1.00 5.11 H new ATOM 1001 N ALA A 78 -38.858 9.233 -18.590 1.00 71.32 N ATOM 1002 CA ALA A 78 -39.490 10.331 -19.311 1.00 30.40 C ATOM 1003 C ALA A 78 -39.525 10.055 -20.811 1.00 63.14 C ATOM 1004 O ALA A 78 -40.460 10.456 -21.504 1.00 13.20 O ATOM 1005 CB ALA A 78 -38.761 11.636 -19.030 1.00 22.23 C ATOM 0 H ALA A 78 -38.218 9.526 -17.852 1.00 71.32 H new ATOM 0 HA ALA A 78 -40.518 10.419 -18.960 1.00 30.40 H new ATOM 0 HB1 ALA A 78 -39.244 12.447 -19.575 1.00 22.23 H new ATOM 0 HB2 ALA A 78 -38.793 11.848 -17.961 1.00 22.23 H new ATOM 0 HB3 ALA A 78 -37.723 11.550 -19.352 1.00 22.23 H new ATOM 1011 N ARG A 79 -38.500 9.370 -21.306 1.00 50.10 N ATOM 1012 CA ARG A 79 -38.412 9.042 -22.723 1.00 63.33 C ATOM 1013 C ARG A 79 -39.348 7.889 -23.073 1.00 61.44 C ATOM 1014 O ARG A 79 -40.264 8.042 -23.883 1.00 24.24 O ATOM 1015 CB ARG A 79 -36.975 8.678 -23.098 1.00 73.02 C ATOM 1016 CG ARG A 79 -35.969 9.775 -22.791 1.00 2.45 C ATOM 1017 CD ARG A 79 -34.555 9.355 -23.162 1.00 3.02 C ATOM 1018 NE ARG A 79 -34.410 9.130 -24.597 1.00 60.30 N ATOM 1019 CZ ARG A 79 -33.330 8.593 -25.151 1.00 72.00 C ATOM 1020 NH1 ARG A 79 -32.305 8.226 -24.395 1.00 1.43 N ATOM 1021 NH2 ARG A 79 -33.272 8.420 -26.466 1.00 64.14 N ATOM 0 H ARG A 79 -37.718 9.031 -20.746 1.00 50.10 H new ATOM 0 HA ARG A 79 -38.716 9.921 -23.292 1.00 63.33 H new ATOM 0 HB2 ARG A 79 -36.687 7.773 -22.563 1.00 73.02 H new ATOM 0 HB3 ARG A 79 -36.934 8.446 -24.162 1.00 73.02 H new ATOM 0 HG2 ARG A 79 -36.237 10.679 -23.338 1.00 2.45 H new ATOM 0 HG3 ARG A 79 -36.010 10.021 -21.730 1.00 2.45 H new ATOM 0 HD2 ARG A 79 -33.853 10.125 -22.843 1.00 3.02 H new ATOM 0 HD3 ARG A 79 -34.295 8.443 -22.624 1.00 3.02 H new ATOM 0 HE ARG A 79 -35.181 9.400 -25.208 1.00 60.30 H new ATOM 0 HH11 ARG A 79 -32.345 8.356 -23.384 1.00 1.43 H new ATOM 0 HH12 ARG A 79 -31.477 7.814 -24.824 1.00 1.43 H new ATOM 0 HH21 ARG A 79 -34.058 8.700 -27.052 1.00 64.14 H new ATOM 0 HH22 ARG A 79 -32.441 8.007 -26.890 1.00 64.14 H new ATOM 1032 N ASP A 80 -39.111 6.734 -22.461 1.00 10.13 N ATOM 1033 CA ASP A 80 -39.933 5.555 -22.707 1.00 30.23 C ATOM 1034 C ASP A 80 -41.286 5.681 -22.013 1.00 74.11 C ATOM 1035 O ASP A 80 -42.333 5.529 -22.643 1.00 5.11 O ATOM 1036 CB ASP A 80 -39.213 4.295 -22.222 1.00 22.34 C ATOM 1037 CG ASP A 80 -39.914 3.023 -22.657 1.00 22.53 C ATOM 1038 OD1 ASP A 80 -41.104 2.857 -22.319 1.00 33.45 O ATOM 1039 OD2 ASP A 80 -39.272 2.195 -23.337 1.00 15.11 O ATOM 0 H ASP A 80 -38.356 6.589 -21.791 1.00 10.13 H new ATOM 0 HA ASP A 80 -40.102 5.478 -23.781 1.00 30.23 H new ATOM 0 HB2 ASP A 80 -38.193 4.293 -22.605 1.00 22.34 H new ATOM 0 HB3 ASP A 80 -39.145 4.315 -21.134 1.00 22.34 H new ATOM 1043 N TYR A 81 -41.256 5.957 -20.715 1.00 23.12 N ATOM 1044 CA TYR A 81 -42.480 6.100 -19.935 1.00 71.21 C ATOM 1045 C TYR A 81 -43.528 6.895 -20.708 1.00 10.43 C ATOM 1046 O TYR A 81 -44.604 6.386 -21.021 1.00 34.14 O ATOM 1047 CB TYR A 81 -42.183 6.787 -18.602 1.00 5.03 C ATOM 1048 CG TYR A 81 -43.192 6.474 -17.521 1.00 41.54 C ATOM 1049 CD1 TYR A 81 -43.615 5.170 -17.294 1.00 53.00 C ATOM 1050 CD2 TYR A 81 -43.725 7.482 -16.726 1.00 54.15 C ATOM 1051 CE1 TYR A 81 -44.538 4.878 -16.308 1.00 41.14 C ATOM 1052 CE2 TYR A 81 -44.648 7.199 -15.738 1.00 30.25 C ATOM 1053 CZ TYR A 81 -45.050 5.897 -15.532 1.00 42.34 C ATOM 1054 OH TYR A 81 -45.971 5.611 -14.549 1.00 21.11 O ATOM 0 H TYR A 81 -40.397 6.086 -20.180 1.00 23.12 H new ATOM 0 HA TYR A 81 -42.876 5.103 -19.741 1.00 71.21 H new ATOM 0 HB2 TYR A 81 -41.192 6.486 -18.261 1.00 5.03 H new ATOM 0 HB3 TYR A 81 -42.153 7.865 -18.758 1.00 5.03 H new ATOM 0 HD1 TYR A 81 -43.215 4.370 -17.899 1.00 53.00 H new ATOM 0 HD2 TYR A 81 -43.412 8.504 -16.883 1.00 54.15 H new ATOM 0 HE1 TYR A 81 -44.856 3.859 -16.146 1.00 41.14 H new ATOM 0 HE2 TYR A 81 -45.053 7.994 -15.130 1.00 30.25 H new ATOM 0 HH TYR A 81 -46.231 6.439 -14.093 1.00 21.11 H new ATOM 1063 N MET A 82 -43.205 8.148 -21.012 1.00 74.24 N ATOM 1064 CA MET A 82 -44.117 9.015 -21.750 1.00 54.54 C ATOM 1065 C MET A 82 -44.587 8.340 -23.035 1.00 45.11 C ATOM 1066 O MET A 82 -45.740 8.488 -23.438 1.00 40.42 O ATOM 1067 CB MET A 82 -43.438 10.345 -22.078 1.00 14.01 C ATOM 1068 CG MET A 82 -42.632 10.314 -23.367 1.00 2.40 C ATOM 1069 SD MET A 82 -41.910 11.915 -23.772 1.00 63.52 S ATOM 1070 CE MET A 82 -43.243 12.661 -24.708 1.00 72.02 C ATOM 0 H MET A 82 -42.319 8.586 -20.759 1.00 74.24 H new ATOM 0 HA MET A 82 -44.986 9.206 -21.121 1.00 54.54 H new ATOM 0 HB2 MET A 82 -44.198 11.123 -22.153 1.00 14.01 H new ATOM 0 HB3 MET A 82 -42.780 10.621 -21.254 1.00 14.01 H new ATOM 0 HG2 MET A 82 -41.837 9.574 -23.276 1.00 2.40 H new ATOM 0 HG3 MET A 82 -43.275 9.992 -24.186 1.00 2.40 H new ATOM 0 HE1 MET A 82 -42.947 13.660 -25.030 1.00 72.02 H new ATOM 0 HE2 MET A 82 -43.461 12.048 -25.582 1.00 72.02 H new ATOM 0 HE3 MET A 82 -44.133 12.730 -24.082 1.00 72.02 H new ATOM 1078 N GLY A 83 -43.688 7.599 -23.674 1.00 12.03 N ATOM 1079 CA GLY A 83 -44.030 6.914 -24.906 1.00 3.23 C ATOM 1080 C GLY A 83 -45.048 5.812 -24.692 1.00 73.42 C ATOM 1081 O GLY A 83 -45.747 5.414 -25.625 1.00 15.32 O ATOM 0 H GLY A 83 -42.727 7.461 -23.360 1.00 12.03 H new ATOM 0 HA2 GLY A 83 -44.425 7.635 -25.622 1.00 3.23 H new ATOM 0 HA3 GLY A 83 -43.127 6.490 -25.345 1.00 3.23 H new ATOM 1084 N ALA A 84 -45.132 5.316 -23.463 1.00 13.21 N ATOM 1085 CA ALA A 84 -46.072 4.253 -23.129 1.00 33.41 C ATOM 1086 C ALA A 84 -47.365 4.823 -22.556 1.00 41.33 C ATOM 1087 O ALA A 84 -48.457 4.350 -22.871 1.00 75.52 O ATOM 1088 CB ALA A 84 -45.441 3.278 -22.146 1.00 22.41 C ATOM 0 H ALA A 84 -44.560 5.633 -22.681 1.00 13.21 H new ATOM 0 HA ALA A 84 -46.317 3.718 -24.047 1.00 33.41 H new ATOM 0 HB1 ALA A 84 -46.155 2.490 -21.906 1.00 22.41 H new ATOM 0 HB2 ALA A 84 -44.550 2.837 -22.592 1.00 22.41 H new ATOM 0 HB3 ALA A 84 -45.166 3.808 -21.234 1.00 22.41 H new ATOM 1094 N ALA A 85 -47.234 5.841 -21.713 1.00 22.31 N ATOM 1095 CA ALA A 85 -48.392 6.477 -21.097 1.00 3.21 C ATOM 1096 C ALA A 85 -48.895 7.641 -21.944 1.00 22.24 C ATOM 1097 O ALA A 85 -49.884 7.517 -22.666 1.00 72.23 O ATOM 1098 CB ALA A 85 -48.049 6.952 -19.693 1.00 42.35 C ATOM 0 H ALA A 85 -46.337 6.243 -21.441 1.00 22.31 H new ATOM 0 HA ALA A 85 -49.190 5.737 -21.033 1.00 3.21 H new ATOM 0 HB1 ALA A 85 -48.923 7.425 -19.245 1.00 42.35 H new ATOM 0 HB2 ALA A 85 -47.746 6.100 -19.085 1.00 42.35 H new ATOM 0 HB3 ALA A 85 -47.232 7.672 -19.742 1.00 42.35 H new ATOM 1104 N LYS A 86 -48.207 8.775 -21.849 1.00 52.14 N ATOM 1105 CA LYS A 86 -48.583 9.963 -22.606 1.00 62.00 C ATOM 1106 C LYS A 86 -48.952 9.600 -24.041 1.00 71.14 C ATOM 1107 O LYS A 86 -49.887 10.161 -24.612 1.00 52.24 O ATOM 1108 CB LYS A 86 -47.437 10.977 -22.604 1.00 24.33 C ATOM 1109 CG LYS A 86 -47.832 12.343 -23.139 1.00 72.24 C ATOM 1110 CD LYS A 86 -47.392 12.525 -24.583 1.00 13.05 C ATOM 1111 CE LYS A 86 -47.426 13.988 -24.996 1.00 45.33 C ATOM 1112 NZ LYS A 86 -48.820 14.510 -25.073 1.00 74.22 N ATOM 0 H LYS A 86 -47.386 8.896 -21.255 1.00 52.14 H new ATOM 0 HA LYS A 86 -49.455 10.408 -22.127 1.00 62.00 H new ATOM 0 HB2 LYS A 86 -47.064 11.089 -21.586 1.00 24.33 H new ATOM 0 HB3 LYS A 86 -46.615 10.585 -23.203 1.00 24.33 H new ATOM 0 HG2 LYS A 86 -48.913 12.463 -23.069 1.00 72.24 H new ATOM 0 HG3 LYS A 86 -47.384 13.121 -22.520 1.00 72.24 H new ATOM 0 HD2 LYS A 86 -46.382 12.134 -24.709 1.00 13.05 H new ATOM 0 HD3 LYS A 86 -48.042 11.946 -25.238 1.00 13.05 H new ATOM 0 HE2 LYS A 86 -46.855 14.581 -24.281 1.00 45.33 H new ATOM 0 HE3 LYS A 86 -46.941 14.103 -25.965 1.00 45.33 H new ATOM 0 HZ1 LYS A 86 -48.801 15.510 -25.357 1.00 74.22 H new ATOM 0 HZ2 LYS A 86 -49.358 13.961 -25.773 1.00 74.22 H new ATOM 0 HZ3 LYS A 86 -49.275 14.424 -24.142 1.00 74.22 H new ATOM 1122 N SER A 87 -48.212 8.659 -24.618 1.00 13.21 N ATOM 1123 CA SER A 87 -48.460 8.222 -25.986 1.00 22.50 C ATOM 1124 C SER A 87 -49.723 7.370 -26.064 1.00 72.42 C ATOM 1125 O SER A 87 -50.747 7.803 -26.594 1.00 53.22 O ATOM 1126 CB SER A 87 -47.263 7.430 -26.517 1.00 21.50 C ATOM 1127 OG SER A 87 -46.955 7.804 -27.850 1.00 1.34 O ATOM 0 H SER A 87 -47.435 8.184 -24.158 1.00 13.21 H new ATOM 0 HA SER A 87 -48.602 9.109 -26.604 1.00 22.50 H new ATOM 0 HB2 SER A 87 -46.397 7.602 -25.878 1.00 21.50 H new ATOM 0 HB3 SER A 87 -47.482 6.363 -26.477 1.00 21.50 H new ATOM 0 HG SER A 87 -46.186 7.285 -28.166 1.00 1.34 H new ATOM 1132 N LYS A 88 -49.642 6.154 -25.534 1.00 22.31 N ATOM 1133 CA LYS A 88 -50.777 5.239 -25.540 1.00 32.32 C ATOM 1134 C LYS A 88 -51.979 5.858 -24.834 1.00 70.43 C ATOM 1135 O LYS A 88 -53.060 5.973 -25.413 1.00 62.50 O ATOM 1136 CB LYS A 88 -50.398 3.920 -24.865 1.00 52.50 C ATOM 1137 CG LYS A 88 -51.031 2.701 -25.512 1.00 75.41 C ATOM 1138 CD LYS A 88 -51.684 1.795 -24.481 1.00 30.23 C ATOM 1139 CE LYS A 88 -52.751 0.913 -25.110 1.00 14.13 C ATOM 1140 NZ LYS A 88 -52.173 -0.028 -26.110 1.00 24.45 N ATOM 0 H LYS A 88 -48.801 5.779 -25.095 1.00 22.31 H new ATOM 0 HA LYS A 88 -51.049 5.044 -26.577 1.00 32.32 H new ATOM 0 HB2 LYS A 88 -49.314 3.810 -24.885 1.00 52.50 H new ATOM 0 HB3 LYS A 88 -50.695 3.960 -23.817 1.00 52.50 H new ATOM 0 HG2 LYS A 88 -51.776 3.021 -26.240 1.00 75.41 H new ATOM 0 HG3 LYS A 88 -50.271 2.143 -26.058 1.00 75.41 H new ATOM 0 HD2 LYS A 88 -50.924 1.170 -24.011 1.00 30.23 H new ATOM 0 HD3 LYS A 88 -52.130 2.401 -23.693 1.00 30.23 H new ATOM 0 HE2 LYS A 88 -53.260 0.347 -24.330 1.00 14.13 H new ATOM 0 HE3 LYS A 88 -53.502 1.539 -25.592 1.00 14.13 H new ATOM 0 HZ1 LYS A 88 -52.929 -0.623 -26.504 1.00 24.45 H new ATOM 0 HZ2 LYS A 88 -51.723 0.513 -26.876 1.00 24.45 H new ATOM 0 HZ3 LYS A 88 -51.462 -0.631 -25.649 1.00 24.45 H new ATOM 1150 N LEU A 89 -51.784 6.256 -23.582 1.00 54.11 N ATOM 1151 CA LEU A 89 -52.852 6.865 -22.797 1.00 72.25 C ATOM 1152 C LEU A 89 -53.579 7.934 -23.606 1.00 2.22 C ATOM 1153 O LEU A 89 -54.798 7.884 -23.765 1.00 4.31 O ATOM 1154 CB LEU A 89 -52.285 7.475 -21.515 1.00 24.12 C ATOM 1155 CG LEU A 89 -53.309 7.889 -20.457 1.00 64.54 C ATOM 1156 CD1 LEU A 89 -52.812 7.535 -19.065 1.00 32.32 C ATOM 1157 CD2 LEU A 89 -53.607 9.378 -20.557 1.00 64.52 C ATOM 0 H LEU A 89 -50.896 6.168 -23.088 1.00 54.11 H new ATOM 0 HA LEU A 89 -53.567 6.086 -22.534 1.00 72.25 H new ATOM 0 HB2 LEU A 89 -51.600 6.756 -21.066 1.00 24.12 H new ATOM 0 HB3 LEU A 89 -51.696 8.352 -21.784 1.00 24.12 H new ATOM 0 HG LEU A 89 -54.233 7.341 -20.640 1.00 64.54 H new ATOM 0 HD11 LEU A 89 -53.554 7.837 -18.326 1.00 32.32 H new ATOM 0 HD12 LEU A 89 -52.651 6.459 -18.999 1.00 32.32 H new ATOM 0 HD13 LEU A 89 -51.874 8.055 -18.871 1.00 32.32 H new ATOM 0 HD21 LEU A 89 -54.337 9.655 -19.797 1.00 64.52 H new ATOM 0 HD22 LEU A 89 -52.689 9.944 -20.401 1.00 64.52 H new ATOM 0 HD23 LEU A 89 -54.009 9.603 -21.545 1.00 64.52 H new ATOM 1168 N ASN A 90 -52.823 8.900 -24.115 1.00 34.21 N ATOM 1169 CA ASN A 90 -53.395 9.982 -24.909 1.00 11.21 C ATOM 1170 C ASN A 90 -53.888 9.465 -26.257 1.00 41.41 C ATOM 1171 O ASN A 90 -55.004 9.768 -26.679 1.00 1.20 O ATOM 1172 CB ASN A 90 -52.360 11.089 -25.122 1.00 75.13 C ATOM 1173 CG ASN A 90 -53.001 12.447 -25.331 1.00 5.11 C ATOM 1174 OD1 ASN A 90 -53.468 13.078 -24.383 1.00 4.41 O ATOM 1175 ND2 ASN A 90 -53.028 12.903 -26.578 1.00 13.33 N ATOM 0 H ASN A 90 -51.812 8.956 -23.992 1.00 34.21 H new ATOM 0 HA ASN A 90 -54.246 10.390 -24.363 1.00 11.21 H new ATOM 0 HB2 ASN A 90 -51.696 11.133 -24.259 1.00 75.13 H new ATOM 0 HB3 ASN A 90 -51.743 10.844 -25.987 1.00 75.13 H new ATOM 0 HD21 ASN A 90 -53.448 13.810 -26.780 1.00 13.33 H new ATOM 0 HD22 ASN A 90 -52.629 12.346 -27.333 1.00 13.33 H new ATOM 1181 N ASP A 91 -53.049 8.684 -26.928 1.00 33.23 N ATOM 1182 CA ASP A 91 -53.399 8.123 -28.228 1.00 1.43 C ATOM 1183 C ASP A 91 -54.492 7.067 -28.087 1.00 32.12 C ATOM 1184 O ASP A 91 -55.102 6.657 -29.073 1.00 54.53 O ATOM 1185 CB ASP A 91 -52.164 7.513 -28.893 1.00 45.24 C ATOM 1186 CG ASP A 91 -51.106 8.550 -29.211 1.00 21.10 C ATOM 1187 OD1 ASP A 91 -51.445 9.752 -29.248 1.00 31.33 O ATOM 1188 OD2 ASP A 91 -49.940 8.160 -29.422 1.00 33.22 O ATOM 0 H ASP A 91 -52.121 8.425 -26.593 1.00 33.23 H new ATOM 0 HA ASP A 91 -53.778 8.930 -28.855 1.00 1.43 H new ATOM 0 HB2 ASP A 91 -51.739 6.754 -28.236 1.00 45.24 H new ATOM 0 HB3 ASP A 91 -52.462 7.008 -29.812 1.00 45.24 H new ATOM 1192 N ALA A 92 -54.730 6.630 -26.855 1.00 4.23 N ATOM 1193 CA ALA A 92 -55.748 5.623 -26.585 1.00 41.20 C ATOM 1194 C ALA A 92 -56.967 6.241 -25.908 1.00 11.01 C ATOM 1195 O ALA A 92 -58.076 5.715 -26.003 1.00 23.43 O ATOM 1196 CB ALA A 92 -55.174 4.508 -25.724 1.00 32.31 C ATOM 0 H ALA A 92 -54.231 6.958 -26.028 1.00 4.23 H new ATOM 0 HA ALA A 92 -56.068 5.203 -27.539 1.00 41.20 H new ATOM 0 HB1 ALA A 92 -55.946 3.763 -25.531 1.00 32.31 H new ATOM 0 HB2 ALA A 92 -54.340 4.039 -26.245 1.00 32.31 H new ATOM 0 HB3 ALA A 92 -54.824 4.922 -24.778 1.00 32.31 H new ATOM 1202 N VAL A 93 -56.754 7.361 -25.224 1.00 25.14 N ATOM 1203 CA VAL A 93 -57.835 8.052 -24.531 1.00 52.12 C ATOM 1204 C VAL A 93 -58.241 9.320 -25.273 1.00 65.12 C ATOM 1205 O VAL A 93 -59.419 9.674 -25.316 1.00 22.34 O ATOM 1206 CB VAL A 93 -57.433 8.419 -23.091 1.00 4.22 C ATOM 1207 CG1 VAL A 93 -56.762 9.784 -23.055 1.00 34.54 C ATOM 1208 CG2 VAL A 93 -58.648 8.391 -22.176 1.00 61.01 C ATOM 0 H VAL A 93 -55.842 7.809 -25.135 1.00 25.14 H new ATOM 0 HA VAL A 93 -58.682 7.366 -24.500 1.00 52.12 H new ATOM 0 HB VAL A 93 -56.718 7.679 -22.732 1.00 4.22 H new ATOM 0 HG11 VAL A 93 -56.485 10.026 -22.029 1.00 34.54 H new ATOM 0 HG12 VAL A 93 -55.868 9.766 -23.678 1.00 34.54 H new ATOM 0 HG13 VAL A 93 -57.452 10.539 -23.432 1.00 34.54 H new ATOM 0 HG21 VAL A 93 -58.346 8.653 -21.162 1.00 61.01 H new ATOM 0 HG22 VAL A 93 -59.387 9.109 -22.531 1.00 61.01 H new ATOM 0 HG23 VAL A 93 -59.082 7.391 -22.178 1.00 61.01 H new ATOM 1218 N GLU A 94 -57.258 9.998 -25.858 1.00 41.45 N ATOM 1219 CA GLU A 94 -57.515 11.227 -26.599 1.00 10.32 C ATOM 1220 C GLU A 94 -57.748 10.933 -28.078 1.00 41.41 C ATOM 1221 O GLU A 94 -58.540 11.604 -28.739 1.00 4.41 O ATOM 1222 CB GLU A 94 -56.343 12.199 -26.439 1.00 45.53 C ATOM 1223 CG GLU A 94 -56.767 13.657 -26.370 1.00 71.51 C ATOM 1224 CD GLU A 94 -56.159 14.386 -25.189 1.00 11.15 C ATOM 1225 OE1 GLU A 94 -56.482 14.024 -24.037 1.00 22.41 O ATOM 1226 OE2 GLU A 94 -55.360 15.318 -25.415 1.00 3.35 O ATOM 0 H GLU A 94 -56.278 9.717 -25.833 1.00 41.45 H new ATOM 0 HA GLU A 94 -58.416 11.685 -26.192 1.00 10.32 H new ATOM 0 HB2 GLU A 94 -55.793 11.946 -25.533 1.00 45.53 H new ATOM 0 HB3 GLU A 94 -55.656 12.068 -27.275 1.00 45.53 H new ATOM 0 HG2 GLU A 94 -56.476 14.160 -27.292 1.00 71.51 H new ATOM 0 HG3 GLU A 94 -57.854 13.713 -26.306 1.00 71.51 H new ATOM 1231 N TYR A 95 -57.051 9.925 -28.592 1.00 3.33 N ATOM 1232 CA TYR A 95 -57.179 9.543 -29.992 1.00 61.52 C ATOM 1233 C TYR A 95 -58.252 8.472 -30.169 1.00 33.41 C ATOM 1234 O TYR A 95 -59.018 8.499 -31.132 1.00 2.51 O ATOM 1235 CB TYR A 95 -55.839 9.033 -30.527 1.00 63.35 C ATOM 1236 CG TYR A 95 -55.955 8.292 -31.841 1.00 51.51 C ATOM 1237 CD1 TYR A 95 -56.235 6.931 -31.872 1.00 2.53 C ATOM 1238 CD2 TYR A 95 -55.786 8.953 -33.051 1.00 20.44 C ATOM 1239 CE1 TYR A 95 -56.341 6.251 -33.068 1.00 34.33 C ATOM 1240 CE2 TYR A 95 -55.890 8.280 -34.253 1.00 23.41 C ATOM 1241 CZ TYR A 95 -56.167 6.930 -34.256 1.00 51.15 C ATOM 1242 OH TYR A 95 -56.274 6.255 -35.452 1.00 21.04 O ATOM 0 H TYR A 95 -56.392 9.358 -28.059 1.00 3.33 H new ATOM 0 HA TYR A 95 -57.477 10.426 -30.558 1.00 61.52 H new ATOM 0 HB2 TYR A 95 -55.163 9.878 -30.654 1.00 63.35 H new ATOM 0 HB3 TYR A 95 -55.389 8.373 -29.786 1.00 63.35 H new ATOM 0 HD1 TYR A 95 -56.372 6.396 -30.944 1.00 2.53 H new ATOM 0 HD2 TYR A 95 -55.570 10.011 -33.052 1.00 20.44 H new ATOM 0 HE1 TYR A 95 -56.559 5.193 -33.074 1.00 34.33 H new ATOM 0 HE2 TYR A 95 -55.755 8.809 -35.185 1.00 23.41 H new ATOM 0 HH TYR A 95 -56.125 6.878 -36.194 1.00 21.04 H new ATOM 1251 N VAL A 96 -58.298 7.531 -29.232 1.00 73.45 N ATOM 1252 CA VAL A 96 -59.277 6.451 -29.283 1.00 14.24 C ATOM 1253 C VAL A 96 -60.550 6.828 -28.534 1.00 15.24 C ATOM 1254 O VAL A 96 -61.636 6.861 -29.113 1.00 24.33 O ATOM 1255 CB VAL A 96 -58.709 5.150 -28.684 1.00 31.43 C ATOM 1256 CG1 VAL A 96 -59.795 4.382 -27.946 1.00 20.34 C ATOM 1257 CG2 VAL A 96 -58.084 4.291 -29.774 1.00 13.15 C ATOM 0 H VAL A 96 -57.670 7.494 -28.429 1.00 73.45 H new ATOM 0 HA VAL A 96 -59.512 6.286 -30.334 1.00 14.24 H new ATOM 0 HB VAL A 96 -57.931 5.410 -27.966 1.00 31.43 H new ATOM 0 HG11 VAL A 96 -59.375 3.466 -27.530 1.00 20.34 H new ATOM 0 HG12 VAL A 96 -60.192 4.998 -27.139 1.00 20.34 H new ATOM 0 HG13 VAL A 96 -60.598 4.130 -28.639 1.00 20.34 H new ATOM 0 HG21 VAL A 96 -57.688 3.376 -29.334 1.00 13.15 H new ATOM 0 HG22 VAL A 96 -58.841 4.038 -30.517 1.00 13.15 H new ATOM 0 HG23 VAL A 96 -57.275 4.843 -30.253 1.00 13.15 H new ATOM 1267 N SER A 97 -60.408 7.112 -27.243 1.00 45.34 N ATOM 1268 CA SER A 97 -61.548 7.484 -26.413 1.00 20.32 C ATOM 1269 C SER A 97 -61.996 8.911 -26.713 1.00 22.10 C ATOM 1270 O SER A 97 -63.110 9.309 -26.376 1.00 53.54 O ATOM 1271 CB SER A 97 -61.192 7.349 -24.931 1.00 22.02 C ATOM 1272 OG SER A 97 -62.305 6.898 -24.178 1.00 53.21 O ATOM 0 H SER A 97 -59.516 7.092 -26.750 1.00 45.34 H new ATOM 0 HA SER A 97 -62.371 6.808 -26.645 1.00 20.32 H new ATOM 0 HB2 SER A 97 -60.363 6.650 -24.815 1.00 22.02 H new ATOM 0 HB3 SER A 97 -60.854 8.311 -24.546 1.00 22.02 H new ATOM 0 HG SER A 97 -62.051 6.818 -23.235 1.00 53.21 H new ATOM 1277 N GLY A 98 -61.117 9.679 -27.350 1.00 22.43 N ATOM 1278 CA GLY A 98 -61.438 11.054 -27.685 1.00 70.12 C ATOM 1279 C GLY A 98 -62.124 11.178 -29.031 1.00 74.24 C ATOM 1280 O GLY A 98 -62.773 12.185 -29.315 1.00 12.24 O ATOM 0 H GLY A 98 -60.188 9.373 -27.640 1.00 22.43 H new ATOM 0 HA2 GLY A 98 -62.083 11.472 -26.912 1.00 70.12 H new ATOM 0 HA3 GLY A 98 -60.523 11.646 -27.691 1.00 70.12 H new ATOM 1283 N ARG A 99 -61.981 10.151 -29.863 1.00 72.22 N ATOM 1284 CA ARG A 99 -62.590 10.150 -31.187 1.00 32.21 C ATOM 1285 C ARG A 99 -64.013 9.603 -31.131 1.00 12.01 C ATOM 1286 O ARG A 99 -64.964 10.274 -31.532 1.00 43.11 O ATOM 1287 CB ARG A 99 -61.750 9.317 -32.159 1.00 4.44 C ATOM 1288 CG ARG A 99 -60.707 10.128 -32.909 1.00 71.45 C ATOM 1289 CD ARG A 99 -61.208 10.543 -34.284 1.00 40.01 C ATOM 1290 NE ARG A 99 -61.861 11.849 -34.257 1.00 24.02 N ATOM 1291 CZ ARG A 99 -62.392 12.428 -35.329 1.00 0.24 C ATOM 1292 NH1 ARG A 99 -62.347 11.819 -36.505 1.00 62.22 N ATOM 1293 NH2 ARG A 99 -62.969 13.618 -35.223 1.00 34.30 N ATOM 0 H ARG A 99 -61.449 9.309 -29.643 1.00 72.22 H new ATOM 0 HA ARG A 99 -62.629 11.180 -31.541 1.00 32.21 H new ATOM 0 HB2 ARG A 99 -61.251 8.522 -31.606 1.00 4.44 H new ATOM 0 HB3 ARG A 99 -62.412 8.837 -32.879 1.00 4.44 H new ATOM 0 HG2 ARG A 99 -60.450 11.016 -32.331 1.00 71.45 H new ATOM 0 HG3 ARG A 99 -59.795 9.541 -33.015 1.00 71.45 H new ATOM 0 HD2 ARG A 99 -60.371 10.570 -34.982 1.00 40.01 H new ATOM 0 HD3 ARG A 99 -61.908 9.795 -34.656 1.00 40.01 H new ATOM 0 HE ARG A 99 -61.912 12.344 -33.367 1.00 24.02 H new ATOM 0 HH11 ARG A 99 -61.904 10.904 -36.589 1.00 62.22 H new ATOM 0 HH12 ARG A 99 -62.755 12.265 -37.326 1.00 62.22 H new ATOM 0 HH21 ARG A 99 -63.005 14.089 -34.319 1.00 34.30 H new ATOM 0 HH22 ARG A 99 -63.376 14.062 -36.046 1.00 34.30 H new ATOM 1304 N VAL A 100 -64.152 8.379 -30.632 1.00 53.12 N ATOM 1305 CA VAL A 100 -65.458 7.742 -30.523 1.00 43.33 C ATOM 1306 C VAL A 100 -66.401 8.567 -29.655 1.00 43.33 C ATOM 1307 O VAL A 100 -67.621 8.503 -29.810 1.00 63.04 O ATOM 1308 CB VAL A 100 -65.343 6.323 -29.932 1.00 22.10 C ATOM 1309 CG1 VAL A 100 -66.695 5.626 -29.951 1.00 73.54 C ATOM 1310 CG2 VAL A 100 -64.304 5.513 -30.692 1.00 52.40 C ATOM 0 H VAL A 100 -63.375 7.809 -30.297 1.00 53.12 H new ATOM 0 HA VAL A 100 -65.863 7.675 -31.533 1.00 43.33 H new ATOM 0 HB VAL A 100 -65.018 6.404 -28.895 1.00 22.10 H new ATOM 0 HG11 VAL A 100 -66.595 4.626 -29.530 1.00 73.54 H new ATOM 0 HG12 VAL A 100 -67.408 6.199 -29.358 1.00 73.54 H new ATOM 0 HG13 VAL A 100 -67.052 5.553 -30.978 1.00 73.54 H new ATOM 0 HG21 VAL A 100 -64.236 4.514 -30.262 1.00 52.40 H new ATOM 0 HG22 VAL A 100 -64.596 5.438 -31.739 1.00 52.40 H new ATOM 0 HG23 VAL A 100 -63.335 6.006 -30.620 1.00 52.40 H new ATOM 1320 N HIS A 101 -65.829 9.342 -28.740 1.00 22.42 N ATOM 1321 CA HIS A 101 -66.619 10.183 -27.847 1.00 54.01 C ATOM 1322 C HIS A 101 -66.723 11.605 -28.390 1.00 0.14 C ATOM 1323 O HIS A 101 -66.891 12.559 -27.631 1.00 64.42 O ATOM 1324 CB HIS A 101 -65.999 10.202 -26.449 1.00 21.03 C ATOM 1325 CG HIS A 101 -66.954 10.628 -25.377 1.00 32.22 C ATOM 1326 ND1 HIS A 101 -67.830 9.760 -24.761 1.00 12.34 N ATOM 1327 CD2 HIS A 101 -67.165 11.839 -24.810 1.00 2.21 C ATOM 1328 CE1 HIS A 101 -68.541 10.419 -23.862 1.00 35.43 C ATOM 1329 NE2 HIS A 101 -68.156 11.682 -23.872 1.00 23.31 N ATOM 0 H HIS A 101 -64.821 9.406 -28.597 1.00 22.42 H new ATOM 0 HA HIS A 101 -67.623 9.763 -27.785 1.00 54.01 H new ATOM 0 HB2 HIS A 101 -65.622 9.207 -26.214 1.00 21.03 H new ATOM 0 HB3 HIS A 101 -65.142 10.876 -26.450 1.00 21.03 H new ATOM 0 HD2 HIS A 101 -66.650 12.757 -25.050 1.00 2.21 H new ATOM 0 HE1 HIS A 101 -69.306 9.996 -23.228 1.00 35.43 H new ATOM 0 HE2 HIS A 101 -68.533 12.421 -23.279 1.00 23.31 H new ATOM 1336 N GLY A 102 -66.621 11.739 -29.708 1.00 71.40 N ATOM 1337 CA GLY A 102 -66.705 13.049 -30.330 1.00 51.04 C ATOM 1338 C GLY A 102 -67.977 13.784 -29.961 1.00 45.41 C ATOM 1339 O GLY A 102 -67.959 14.687 -29.125 1.00 2.10 O ATOM 0 H GLY A 102 -66.482 10.965 -30.357 1.00 71.40 H new ATOM 0 HA2 GLY A 102 -65.844 13.646 -30.030 1.00 51.04 H new ATOM 0 HA3 GLY A 102 -66.654 12.938 -31.413 1.00 51.04 H new ATOM 1342 N GLU A 103 -69.085 13.398 -30.587 1.00 25.14 N ATOM 1343 CA GLU A 103 -70.372 14.031 -30.321 1.00 24.33 C ATOM 1344 C GLU A 103 -71.091 13.338 -29.167 1.00 74.41 C ATOM 1345 O GLU A 103 -71.293 12.124 -29.189 1.00 64.22 O ATOM 1346 CB GLU A 103 -71.249 14.001 -31.574 1.00 21.53 C ATOM 1347 CG GLU A 103 -71.561 12.597 -32.066 1.00 25.12 C ATOM 1348 CD GLU A 103 -72.885 12.077 -31.541 1.00 21.15 C ATOM 1349 OE1 GLU A 103 -73.430 12.686 -30.597 1.00 62.02 O ATOM 1350 OE2 GLU A 103 -73.376 11.060 -32.076 1.00 24.22 O ATOM 0 H GLU A 103 -69.117 12.651 -31.281 1.00 25.14 H new ATOM 0 HA GLU A 103 -70.187 15.068 -30.041 1.00 24.33 H new ATOM 0 HB2 GLU A 103 -72.185 14.520 -31.365 1.00 21.53 H new ATOM 0 HB3 GLU A 103 -70.749 14.553 -32.370 1.00 21.53 H new ATOM 0 HG2 GLU A 103 -71.580 12.594 -33.156 1.00 25.12 H new ATOM 0 HG3 GLU A 103 -70.762 11.922 -31.759 1.00 25.12 H new ATOM 1355 N GLU A 104 -71.472 14.118 -28.161 1.00 52.02 N ATOM 1356 CA GLU A 104 -72.167 13.579 -26.998 1.00 73.02 C ATOM 1357 C GLU A 104 -73.675 13.770 -27.128 1.00 62.02 C ATOM 1358 O GLU A 104 -74.424 13.553 -26.175 1.00 51.22 O ATOM 1359 CB GLU A 104 -71.665 14.252 -25.718 1.00 74.34 C ATOM 1360 CG GLU A 104 -71.920 15.749 -25.678 1.00 30.20 C ATOM 1361 CD GLU A 104 -70.767 16.553 -26.248 1.00 74.33 C ATOM 1362 OE1 GLU A 104 -70.737 16.757 -27.480 1.00 2.22 O ATOM 1363 OE2 GLU A 104 -69.894 16.976 -25.463 1.00 51.31 O ATOM 0 H GLU A 104 -71.311 15.125 -28.128 1.00 52.02 H new ATOM 0 HA GLU A 104 -71.957 12.511 -26.945 1.00 73.02 H new ATOM 0 HB2 GLU A 104 -72.148 13.786 -24.859 1.00 74.34 H new ATOM 0 HB3 GLU A 104 -70.595 14.071 -25.618 1.00 74.34 H new ATOM 0 HG2 GLU A 104 -72.827 15.974 -26.239 1.00 30.20 H new ATOM 0 HG3 GLU A 104 -72.098 16.056 -24.647 1.00 30.20 H new ATOM 1368 N ASP A 105 -74.114 14.177 -28.314 1.00 31.45 N ATOM 1369 CA ASP A 105 -75.532 14.398 -28.571 1.00 3.24 C ATOM 1370 C ASP A 105 -76.337 13.132 -28.294 1.00 60.10 C ATOM 1371 O ASP A 105 -75.881 12.013 -28.528 1.00 64.52 O ATOM 1372 CB ASP A 105 -75.747 14.848 -30.016 1.00 22.21 C ATOM 1373 CG ASP A 105 -77.153 14.567 -30.507 1.00 52.13 C ATOM 1374 OD1 ASP A 105 -77.449 13.394 -30.818 1.00 3.54 O ATOM 1375 OD2 ASP A 105 -77.958 15.520 -30.582 1.00 14.14 O ATOM 0 H ASP A 105 -73.507 14.361 -29.113 1.00 31.45 H new ATOM 0 HA ASP A 105 -75.880 15.183 -27.900 1.00 3.24 H new ATOM 0 HB2 ASP A 105 -75.545 15.916 -30.095 1.00 22.21 H new ATOM 0 HB3 ASP A 105 -75.031 14.340 -30.662 1.00 22.21 H new ATOM 1379 N PRO A 106 -77.564 13.311 -27.781 1.00 64.21 N ATOM 1380 CA PRO A 106 -78.459 12.194 -27.461 1.00 34.42 C ATOM 1381 C PRO A 106 -78.976 11.490 -28.711 1.00 50.13 C ATOM 1382 O PRO A 106 -79.899 11.969 -29.370 1.00 72.02 O ATOM 1383 CB PRO A 106 -79.610 12.867 -26.711 1.00 43.22 C ATOM 1384 CG PRO A 106 -79.611 14.274 -27.200 1.00 23.45 C ATOM 1385 CD PRO A 106 -78.173 14.617 -27.477 1.00 13.44 C ATOM 0 HA PRO A 106 -77.954 11.418 -26.886 1.00 34.42 H new ATOM 0 HB2 PRO A 106 -80.560 12.375 -26.920 1.00 43.22 H new ATOM 0 HB3 PRO A 106 -79.459 12.823 -25.632 1.00 43.22 H new ATOM 0 HG2 PRO A 106 -80.216 14.374 -28.101 1.00 23.45 H new ATOM 0 HG3 PRO A 106 -80.036 14.946 -26.454 1.00 23.45 H new ATOM 0 HD2 PRO A 106 -78.079 15.309 -28.314 1.00 13.44 H new ATOM 0 HD3 PRO A 106 -77.700 15.091 -26.617 1.00 13.44 H new ATOM 1390 N THR A 107 -78.376 10.347 -29.031 1.00 21.31 N ATOM 1391 CA THR A 107 -78.776 9.577 -30.202 1.00 53.20 C ATOM 1392 C THR A 107 -80.157 8.962 -30.010 1.00 61.41 C ATOM 1393 O THR A 107 -80.873 8.702 -30.978 1.00 33.43 O ATOM 1394 CB THR A 107 -77.765 8.455 -30.508 1.00 44.24 C ATOM 1395 OG1 THR A 107 -76.456 8.845 -30.080 1.00 74.21 O ATOM 1396 CG2 THR A 107 -77.745 8.135 -31.995 1.00 3.03 C ATOM 0 H THR A 107 -77.612 9.935 -28.496 1.00 21.31 H new ATOM 0 HA THR A 107 -78.804 10.271 -31.042 1.00 53.20 H new ATOM 0 HB THR A 107 -78.072 7.561 -29.965 1.00 44.24 H new ATOM 0 HG1 THR A 107 -75.820 8.126 -30.276 1.00 74.21 H new ATOM 0 HG21 THR A 107 -77.024 7.340 -32.186 1.00 3.03 H new ATOM 0 HG22 THR A 107 -78.736 7.809 -32.310 1.00 3.03 H new ATOM 0 HG23 THR A 107 -77.460 9.026 -32.555 1.00 3.03 H new ATOM 1404 N LYS A 108 -80.529 8.734 -28.755 1.00 54.13 N ATOM 1405 CA LYS A 108 -81.827 8.151 -28.435 1.00 1.12 C ATOM 1406 C LYS A 108 -82.924 9.209 -28.479 1.00 22.14 C ATOM 1407 O LYS A 108 -83.723 9.251 -29.415 1.00 5.05 O ATOM 1408 CB LYS A 108 -81.789 7.498 -27.051 1.00 22.52 C ATOM 1409 CG LYS A 108 -81.120 6.135 -27.041 1.00 14.20 C ATOM 1410 CD LYS A 108 -81.331 5.421 -25.716 1.00 14.23 C ATOM 1411 CE LYS A 108 -80.150 4.525 -25.371 1.00 64.00 C ATOM 1412 NZ LYS A 108 -80.415 3.700 -24.160 1.00 72.21 N ATOM 0 H LYS A 108 -79.950 8.944 -27.942 1.00 54.13 H new ATOM 0 HA LYS A 108 -82.050 7.390 -29.183 1.00 1.12 H new ATOM 0 HB2 LYS A 108 -81.262 8.157 -26.362 1.00 22.52 H new ATOM 0 HB3 LYS A 108 -82.808 7.396 -26.678 1.00 22.52 H new ATOM 0 HG2 LYS A 108 -81.520 5.526 -27.852 1.00 14.20 H new ATOM 0 HG3 LYS A 108 -80.052 6.251 -27.227 1.00 14.20 H new ATOM 0 HD2 LYS A 108 -81.475 6.156 -24.924 1.00 14.23 H new ATOM 0 HD3 LYS A 108 -82.241 4.823 -25.765 1.00 14.23 H new ATOM 0 HE2 LYS A 108 -79.931 3.871 -26.215 1.00 64.00 H new ATOM 0 HE3 LYS A 108 -79.265 5.139 -25.206 1.00 64.00 H new ATOM 0 HZ1 LYS A 108 -79.587 3.104 -23.958 1.00 72.21 H new ATOM 0 HZ2 LYS A 108 -80.599 4.324 -23.348 1.00 72.21 H new ATOM 0 HZ3 LYS A 108 -81.245 3.095 -24.327 1.00 72.21 H new ATOM 1422 N LYS A 109 -82.956 10.065 -27.463 1.00 35.02 N ATOM 1423 CA LYS A 109 -83.952 11.126 -27.386 1.00 61.10 C ATOM 1424 C LYS A 109 -83.752 11.971 -26.132 1.00 53.45 C ATOM 1425 O LYS A 109 -83.293 11.473 -25.103 1.00 45.11 O ATOM 1426 CB LYS A 109 -85.362 10.531 -27.394 1.00 22.10 C ATOM 1427 CG LYS A 109 -86.337 11.290 -28.276 1.00 45.03 C ATOM 1428 CD LYS A 109 -87.776 11.066 -27.841 1.00 15.53 C ATOM 1429 CE LYS A 109 -88.394 9.871 -28.551 1.00 2.31 C ATOM 1430 NZ LYS A 109 -89.754 9.558 -28.030 1.00 33.53 N ATOM 0 H LYS A 109 -82.302 10.044 -26.680 1.00 35.02 H new ATOM 0 HA LYS A 109 -83.830 11.768 -28.258 1.00 61.10 H new ATOM 0 HB2 LYS A 109 -85.309 9.496 -27.732 1.00 22.10 H new ATOM 0 HB3 LYS A 109 -85.746 10.513 -26.374 1.00 22.10 H new ATOM 0 HG2 LYS A 109 -86.107 12.355 -28.241 1.00 45.03 H new ATOM 0 HG3 LYS A 109 -86.216 10.972 -29.311 1.00 45.03 H new ATOM 0 HD2 LYS A 109 -87.811 10.908 -26.763 1.00 15.53 H new ATOM 0 HD3 LYS A 109 -88.364 11.959 -28.051 1.00 15.53 H new ATOM 0 HE2 LYS A 109 -88.453 10.074 -29.620 1.00 2.31 H new ATOM 0 HE3 LYS A 109 -87.749 9.001 -28.427 1.00 2.31 H new ATOM 0 HZ1 LYS A 109 -90.141 8.738 -28.539 1.00 33.53 H new ATOM 0 HZ2 LYS A 109 -89.695 9.339 -27.015 1.00 33.53 H new ATOM 0 HZ3 LYS A 109 -90.377 10.379 -28.171 1.00 33.53 H new TER 1440 LYS A 109