USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=21 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 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ -167:sc= -0.028 (180deg=-0.265) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 180:sc= 0 (180deg=0) 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+ -163:sc= -0.0128 (180deg=-0.157) USER MOD Single : A 21 SER OG : rot 180:sc= 0 USER MOD Single : A 22 GLN : amide:sc= 0 X(o=0,f=0) 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 X(o=0,f=0) USER MOD Single : A 30 LYS NZ :NH3+ 166:sc=-0.00034 (180deg=-0.118) 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+ -150:sc= -0.148 (180deg=-0.929) USER MOD Single : A 39 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 43 LYS NZ :NH3+ -106:sc= -0.428 (180deg=-2.28!) USER MOD Single : A 45 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 ASN : amide:sc= -0.0123 X(o=-0.012,f=0) USER MOD Single : A 50 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 54 GLN : amide:sc= -0.0512 X(o=-0.051,f=0) USER MOD Single : A 57 HIS : no HD1:sc= -1.04 X(o=-1,f=-0.56) USER MOD Single : A 59 SER OG : rot 180:sc= 0 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= -0.465 F(o=-2.8!,f=-0.47) USER MOD Single : A 70 GLN : amide:sc= -3.41! C(o=-3.4!,f=-9.4!) USER MOD Single : A 73 SER OG : rot 180:sc= -0.587 USER MOD Single : A 77 GLN : amide:sc= 0 X(o=0,f=-0.12) 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+ 180:sc= 0 (180deg=0) USER MOD Single : A 90 ASN : amide:sc= -4.48! C(o=-4.5!,f=-6.8!) 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= -0.475 X(o=-0.47,f=-0.48) USER MOD Single : A 107 THR OG1 : rot 180:sc= 0.0227 USER MOD Single : A 108 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 109 LYS NZ :NH3+ 156:sc= -0.136 (180deg=-0.599) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 19.711 42.883 18.525 1.00 32.20 N ATOM 2 CA MET A 1 20.229 42.773 19.884 1.00 52.13 C ATOM 3 C MET A 1 19.286 43.440 20.881 1.00 31.15 C ATOM 4 O MET A 1 19.238 43.064 22.052 1.00 72.52 O ATOM 5 CB MET A 1 21.618 43.406 19.977 1.00 11.52 C ATOM 6 CG MET A 1 22.554 42.681 20.929 1.00 42.34 C ATOM 7 SD MET A 1 24.269 42.708 20.375 1.00 40.21 S ATOM 8 CE MET A 1 25.011 41.538 21.509 1.00 53.33 C ATOM 0 H1 MET A 1 20.241 42.244 17.899 1.00 32.20 H new ATOM 0 H2 MET A 1 18.704 42.621 18.515 1.00 32.20 H new ATOM 0 H3 MET A 1 19.818 43.862 18.191 1.00 32.20 H new ATOM 0 HA MET A 1 20.303 41.714 20.133 1.00 52.13 H new ATOM 0 HB2 MET A 1 22.067 43.425 18.984 1.00 11.52 H new ATOM 0 HB3 MET A 1 21.515 44.442 20.300 1.00 11.52 H new ATOM 0 HG2 MET A 1 22.488 43.139 21.916 1.00 42.34 H new ATOM 0 HG3 MET A 1 22.227 41.647 21.036 1.00 42.34 H new ATOM 0 HE1 MET A 1 26.075 41.446 21.292 1.00 53.33 H new ATOM 0 HE2 MET A 1 24.878 41.889 22.532 1.00 53.33 H new ATOM 0 HE3 MET A 1 24.532 40.566 21.394 1.00 53.33 H new ATOM 16 N SER A 2 18.539 44.434 20.408 1.00 12.55 N ATOM 17 CA SER A 2 17.601 45.156 21.259 1.00 41.11 C ATOM 18 C SER A 2 16.637 45.990 20.419 1.00 5.34 C ATOM 19 O SER A 2 16.736 46.025 19.193 1.00 13.14 O ATOM 20 CB SER A 2 18.357 46.059 22.236 1.00 74.12 C ATOM 21 OG SER A 2 17.661 46.175 23.465 1.00 24.33 O ATOM 0 H SER A 2 18.566 44.757 19.441 1.00 12.55 H new ATOM 0 HA SER A 2 17.024 44.424 21.824 1.00 41.11 H new ATOM 0 HB2 SER A 2 19.353 45.653 22.415 1.00 74.12 H new ATOM 0 HB3 SER A 2 18.490 47.047 21.795 1.00 74.12 H new ATOM 0 HG SER A 2 18.165 46.755 24.073 1.00 24.33 H new ATOM 26 N ASP A 3 15.708 46.661 21.090 1.00 74.32 N ATOM 27 CA ASP A 3 14.726 47.496 20.408 1.00 12.14 C ATOM 28 C ASP A 3 14.503 48.801 21.165 1.00 5.34 C ATOM 29 O ASP A 3 14.472 48.819 22.395 1.00 4.45 O ATOM 30 CB ASP A 3 13.402 46.746 20.258 1.00 61.55 C ATOM 31 CG ASP A 3 13.130 45.814 21.422 1.00 52.13 C ATOM 32 OD1 ASP A 3 13.048 46.302 22.569 1.00 24.02 O ATOM 33 OD2 ASP A 3 12.999 44.594 21.187 1.00 65.42 O ATOM 0 H ASP A 3 15.614 46.643 22.106 1.00 74.32 H new ATOM 0 HA ASP A 3 15.114 47.733 19.417 1.00 12.14 H new ATOM 0 HB2 ASP A 3 12.588 47.466 20.174 1.00 61.55 H new ATOM 0 HB3 ASP A 3 13.416 46.171 19.332 1.00 61.55 H new ATOM 37 N ALA A 4 14.349 49.892 20.422 1.00 34.23 N ATOM 38 CA ALA A 4 14.128 51.202 21.023 1.00 12.43 C ATOM 39 C ALA A 4 12.642 51.458 21.249 1.00 61.01 C ATOM 40 O ALA A 4 12.239 52.569 21.590 1.00 45.53 O ATOM 41 CB ALA A 4 14.727 52.292 20.146 1.00 44.23 C ATOM 0 H ALA A 4 14.373 49.895 19.402 1.00 34.23 H new ATOM 0 HA ALA A 4 14.624 51.218 21.993 1.00 12.43 H new ATOM 0 HB1 ALA A 4 14.555 53.265 20.606 1.00 44.23 H new ATOM 0 HB2 ALA A 4 15.799 52.125 20.040 1.00 44.23 H new ATOM 0 HB3 ALA A 4 14.257 52.267 19.163 1.00 44.23 H new ATOM 47 N GLY A 5 11.831 50.423 21.053 1.00 42.54 N ATOM 48 CA GLY A 5 10.398 50.557 21.240 1.00 21.15 C ATOM 49 C GLY A 5 10.009 50.643 22.703 1.00 21.22 C ATOM 50 O GLY A 5 9.538 49.666 23.285 1.00 11.53 O ATOM 0 H GLY A 5 12.141 49.494 20.768 1.00 42.54 H new ATOM 0 HA2 GLY A 5 10.049 51.450 20.721 1.00 21.15 H new ATOM 0 HA3 GLY A 5 9.894 49.706 20.783 1.00 21.15 H new ATOM 53 N ARG A 6 10.207 51.814 23.299 1.00 30.43 N ATOM 54 CA ARG A 6 9.876 52.023 24.704 1.00 14.34 C ATOM 55 C ARG A 6 8.671 52.947 24.847 1.00 21.12 C ATOM 56 O ARG A 6 8.347 53.396 25.946 1.00 21.35 O ATOM 57 CB ARG A 6 11.075 52.610 25.450 1.00 34.11 C ATOM 58 CG ARG A 6 12.385 51.900 25.153 1.00 13.23 C ATOM 59 CD ARG A 6 12.335 50.438 25.573 1.00 30.32 C ATOM 60 NE ARG A 6 13.627 49.779 25.414 1.00 53.41 N ATOM 61 CZ ARG A 6 13.965 48.661 26.048 1.00 73.22 C ATOM 62 NH1 ARG A 6 13.110 48.083 26.880 1.00 22.10 N ATOM 63 NH2 ARG A 6 15.160 48.120 25.851 1.00 2.21 N ATOM 0 H ARG A 6 10.595 52.633 22.831 1.00 30.43 H new ATOM 0 HA ARG A 6 9.624 51.056 25.140 1.00 14.34 H new ATOM 0 HB2 ARG A 6 11.175 53.663 25.188 1.00 34.11 H new ATOM 0 HB3 ARG A 6 10.882 52.565 26.522 1.00 34.11 H new ATOM 0 HG2 ARG A 6 12.602 51.966 24.087 1.00 13.23 H new ATOM 0 HG3 ARG A 6 13.199 52.402 25.676 1.00 13.23 H new ATOM 0 HD2 ARG A 6 12.019 50.371 26.614 1.00 30.32 H new ATOM 0 HD3 ARG A 6 11.586 49.915 24.978 1.00 30.32 H new ATOM 0 HE ARG A 6 14.308 50.199 24.782 1.00 53.41 H new ATOM 0 HH11 ARG A 6 12.190 48.496 27.035 1.00 22.10 H new ATOM 0 HH12 ARG A 6 13.372 47.225 27.365 1.00 22.10 H new ATOM 0 HH21 ARG A 6 15.821 48.562 25.212 1.00 2.21 H new ATOM 0 HH22 ARG A 6 15.418 47.262 26.338 1.00 2.21 H new ATOM 74 N LYS A 7 8.011 53.228 23.729 1.00 32.34 N ATOM 75 CA LYS A 7 6.841 54.099 23.728 1.00 34.12 C ATOM 76 C LYS A 7 5.613 53.359 24.248 1.00 20.53 C ATOM 77 O LYS A 7 4.586 53.971 24.541 1.00 73.32 O ATOM 78 CB LYS A 7 6.573 54.627 22.317 1.00 55.21 C ATOM 79 CG LYS A 7 7.798 55.227 21.649 1.00 3.32 C ATOM 80 CD LYS A 7 8.449 54.245 20.689 1.00 72.32 C ATOM 81 CE LYS A 7 8.391 54.746 19.255 1.00 32.52 C ATOM 82 NZ LYS A 7 9.295 53.973 18.359 1.00 50.24 N ATOM 0 H LYS A 7 8.266 52.865 22.811 1.00 32.34 H new ATOM 0 HA LYS A 7 7.044 54.940 24.390 1.00 34.12 H new ATOM 0 HB2 LYS A 7 6.195 53.812 21.699 1.00 55.21 H new ATOM 0 HB3 LYS A 7 5.788 55.382 22.364 1.00 55.21 H new ATOM 0 HG2 LYS A 7 7.513 56.130 21.109 1.00 3.32 H new ATOM 0 HG3 LYS A 7 8.519 55.525 22.410 1.00 3.32 H new ATOM 0 HD2 LYS A 7 9.488 54.086 20.978 1.00 72.32 H new ATOM 0 HD3 LYS A 7 7.948 53.280 20.759 1.00 72.32 H new ATOM 0 HE2 LYS A 7 7.368 54.675 18.887 1.00 32.52 H new ATOM 0 HE3 LYS A 7 8.667 55.800 19.227 1.00 32.52 H new ATOM 0 HZ1 LYS A 7 9.226 54.346 17.391 1.00 50.24 H new ATOM 0 HZ2 LYS A 7 10.275 54.061 18.695 1.00 50.24 H new ATOM 0 HZ3 LYS A 7 9.016 52.971 18.365 1.00 50.24 H new ATOM 92 N GLY A 8 5.726 52.038 24.360 1.00 24.45 N ATOM 93 CA GLY A 8 4.617 51.239 24.845 1.00 72.44 C ATOM 94 C GLY A 8 4.907 49.752 24.790 1.00 42.40 C ATOM 95 O GLY A 8 4.987 49.167 23.709 1.00 61.20 O ATOM 0 H GLY A 8 6.565 51.509 24.124 1.00 24.45 H new ATOM 0 HA2 GLY A 8 4.390 51.524 25.872 1.00 72.44 H new ATOM 0 HA3 GLY A 8 3.730 51.455 24.250 1.00 72.44 H new ATOM 98 N PHE A 9 5.068 49.138 25.958 1.00 35.51 N ATOM 99 CA PHE A 9 5.353 47.710 26.038 1.00 44.40 C ATOM 100 C PHE A 9 4.110 46.888 25.712 1.00 53.51 C ATOM 101 O PHE A 9 4.177 45.665 25.587 1.00 3.45 O ATOM 102 CB PHE A 9 5.867 47.349 27.434 1.00 72.22 C ATOM 103 CG PHE A 9 6.279 45.911 27.567 1.00 30.30 C ATOM 104 CD1 PHE A 9 7.105 45.323 26.622 1.00 61.43 C ATOM 105 CD2 PHE A 9 5.842 45.148 28.638 1.00 74.43 C ATOM 106 CE1 PHE A 9 7.485 44.000 26.743 1.00 22.30 C ATOM 107 CE2 PHE A 9 6.220 43.824 28.764 1.00 34.42 C ATOM 108 CZ PHE A 9 7.042 43.250 27.815 1.00 2.31 C ATOM 0 H PHE A 9 5.006 49.607 26.862 1.00 35.51 H new ATOM 0 HA PHE A 9 6.123 47.476 25.303 1.00 44.40 H new ATOM 0 HB2 PHE A 9 6.718 47.986 27.675 1.00 72.22 H new ATOM 0 HB3 PHE A 9 5.089 47.565 28.166 1.00 72.22 H new ATOM 0 HD1 PHE A 9 7.455 45.905 25.782 1.00 61.43 H new ATOM 0 HD2 PHE A 9 5.199 45.593 29.383 1.00 74.43 H new ATOM 0 HE1 PHE A 9 8.128 43.553 26.000 1.00 22.30 H new ATOM 0 HE2 PHE A 9 5.873 43.240 29.603 1.00 34.42 H new ATOM 0 HZ PHE A 9 7.338 42.216 27.911 1.00 2.31 H new ATOM 117 N GLY A 10 2.977 47.568 25.576 1.00 72.21 N ATOM 118 CA GLY A 10 1.734 46.884 25.266 1.00 33.21 C ATOM 119 C GLY A 10 1.469 46.810 23.775 1.00 52.12 C ATOM 120 O GLY A 10 0.876 45.846 23.292 1.00 43.24 O ATOM 0 H GLY A 10 2.896 48.580 25.675 1.00 72.21 H new ATOM 0 HA2 GLY A 10 1.766 45.875 25.677 1.00 33.21 H new ATOM 0 HA3 GLY A 10 0.907 47.401 25.754 1.00 33.21 H new ATOM 123 N GLU A 11 1.910 47.830 23.046 1.00 61.13 N ATOM 124 CA GLU A 11 1.714 47.877 21.602 1.00 54.45 C ATOM 125 C GLU A 11 2.319 46.646 20.931 1.00 44.42 C ATOM 126 O GLU A 11 1.951 46.290 19.811 1.00 60.25 O ATOM 127 CB GLU A 11 2.338 49.146 21.020 1.00 71.31 C ATOM 128 CG GLU A 11 1.966 50.409 21.779 1.00 13.35 C ATOM 129 CD GLU A 11 0.470 50.554 21.974 1.00 51.34 C ATOM 130 OE1 GLU A 11 -0.291 50.097 21.096 1.00 2.32 O ATOM 131 OE2 GLU A 11 0.059 51.123 23.007 1.00 3.13 O ATOM 0 H GLU A 11 2.405 48.634 23.431 1.00 61.13 H new ATOM 0 HA GLU A 11 0.642 47.887 21.407 1.00 54.45 H new ATOM 0 HB2 GLU A 11 3.423 49.040 21.018 1.00 71.31 H new ATOM 0 HB3 GLU A 11 2.026 49.251 19.981 1.00 71.31 H new ATOM 0 HG2 GLU A 11 2.456 50.401 22.753 1.00 13.35 H new ATOM 0 HG3 GLU A 11 2.344 51.277 21.239 1.00 13.35 H new ATOM 136 N LYS A 12 3.251 46.000 21.624 1.00 61.13 N ATOM 137 CA LYS A 12 3.908 44.810 21.098 1.00 44.42 C ATOM 138 C LYS A 12 3.375 43.550 21.773 1.00 70.11 C ATOM 139 O LYS A 12 3.060 42.564 21.108 1.00 43.34 O ATOM 140 CB LYS A 12 5.422 44.906 21.301 1.00 32.25 C ATOM 141 CG LYS A 12 6.028 46.187 20.750 1.00 14.50 C ATOM 142 CD LYS A 12 5.877 47.340 21.727 1.00 60.52 C ATOM 143 CE LYS A 12 7.024 48.331 21.602 1.00 72.21 C ATOM 144 NZ LYS A 12 6.831 49.261 20.454 1.00 42.34 N ATOM 0 H LYS A 12 3.568 46.281 22.552 1.00 61.13 H new ATOM 0 HA LYS A 12 3.693 44.749 20.031 1.00 44.42 H new ATOM 0 HB2 LYS A 12 5.643 44.838 22.366 1.00 32.25 H new ATOM 0 HB3 LYS A 12 5.900 44.052 20.821 1.00 32.25 H new ATOM 0 HG2 LYS A 12 7.085 46.027 20.535 1.00 14.50 H new ATOM 0 HG3 LYS A 12 5.545 46.443 19.807 1.00 14.50 H new ATOM 0 HD2 LYS A 12 4.932 47.851 21.545 1.00 60.52 H new ATOM 0 HD3 LYS A 12 5.839 46.953 22.745 1.00 60.52 H new ATOM 0 HE2 LYS A 12 7.110 48.905 22.524 1.00 72.21 H new ATOM 0 HE3 LYS A 12 7.961 47.788 21.476 1.00 72.21 H new ATOM 0 HZ1 LYS A 12 7.634 49.920 20.403 1.00 42.34 H new ATOM 0 HZ2 LYS A 12 6.775 48.715 19.571 1.00 42.34 H new ATOM 0 HZ3 LYS A 12 5.950 49.798 20.586 1.00 42.34 H new ATOM 154 N ALA A 13 3.274 43.592 23.097 1.00 43.24 N ATOM 155 CA ALA A 13 2.775 42.456 23.862 1.00 31.10 C ATOM 156 C ALA A 13 1.292 42.223 23.595 1.00 22.31 C ATOM 157 O ALA A 13 0.769 41.137 23.846 1.00 34.22 O ATOM 158 CB ALA A 13 3.017 42.672 25.348 1.00 43.24 C ATOM 0 H ALA A 13 3.531 44.401 23.663 1.00 43.24 H new ATOM 0 HA ALA A 13 3.320 41.568 23.542 1.00 31.10 H new ATOM 0 HB1 ALA A 13 2.639 41.816 25.906 1.00 43.24 H new ATOM 0 HB2 ALA A 13 4.086 42.781 25.530 1.00 43.24 H new ATOM 0 HB3 ALA A 13 2.499 43.574 25.674 1.00 43.24 H new ATOM 164 N SER A 14 0.619 43.249 23.084 1.00 64.23 N ATOM 165 CA SER A 14 -0.806 43.158 22.787 1.00 13.33 C ATOM 166 C SER A 14 -1.032 42.779 21.327 1.00 73.34 C ATOM 167 O SER A 14 -2.002 42.096 20.995 1.00 3.34 O ATOM 168 CB SER A 14 -1.498 44.487 23.094 1.00 32.22 C ATOM 169 OG SER A 14 -2.903 44.378 22.937 1.00 51.30 O ATOM 0 H SER A 14 1.038 44.153 22.867 1.00 64.23 H new ATOM 0 HA SER A 14 -1.235 42.379 23.417 1.00 13.33 H new ATOM 0 HB2 SER A 14 -1.265 44.795 24.113 1.00 32.22 H new ATOM 0 HB3 SER A 14 -1.114 45.262 22.431 1.00 32.22 H new ATOM 0 HG SER A 14 -3.323 45.240 23.140 1.00 51.30 H new ATOM 174 N GLU A 15 -0.131 43.227 20.459 1.00 74.51 N ATOM 175 CA GLU A 15 -0.233 42.936 19.033 1.00 52.55 C ATOM 176 C GLU A 15 0.572 41.690 18.674 1.00 71.32 C ATOM 177 O GLU A 15 0.305 41.035 17.666 1.00 1.12 O ATOM 178 CB GLU A 15 0.256 44.128 18.210 1.00 14.15 C ATOM 179 CG GLU A 15 -0.264 45.466 18.706 1.00 30.32 C ATOM 180 CD GLU A 15 -1.734 45.671 18.397 1.00 73.12 C ATOM 181 OE1 GLU A 15 -2.085 45.734 17.200 1.00 11.35 O ATOM 182 OE2 GLU A 15 -2.534 45.769 19.351 1.00 11.12 O ATOM 0 H GLU A 15 0.678 43.793 20.717 1.00 74.51 H new ATOM 0 HA GLU A 15 -1.281 42.750 18.800 1.00 52.55 H new ATOM 0 HB2 GLU A 15 1.346 44.144 18.222 1.00 14.15 H new ATOM 0 HB3 GLU A 15 -0.049 43.992 17.172 1.00 14.15 H new ATOM 0 HG2 GLU A 15 -0.110 45.535 19.783 1.00 30.32 H new ATOM 0 HG3 GLU A 15 0.315 46.269 18.249 1.00 30.32 H new ATOM 187 N ALA A 16 1.558 41.370 19.505 1.00 52.14 N ATOM 188 CA ALA A 16 2.400 40.202 19.277 1.00 22.04 C ATOM 189 C ALA A 16 1.831 38.969 19.971 1.00 10.14 C ATOM 190 O ALA A 16 2.069 37.839 19.544 1.00 14.32 O ATOM 191 CB ALA A 16 3.818 40.474 19.758 1.00 15.22 C ATOM 0 H ALA A 16 1.794 41.903 20.342 1.00 52.14 H new ATOM 0 HA ALA A 16 2.422 40.004 18.205 1.00 22.04 H new ATOM 0 HB1 ALA A 16 4.437 39.594 19.582 1.00 15.22 H new ATOM 0 HB2 ALA A 16 4.231 41.323 19.213 1.00 15.22 H new ATOM 0 HB3 ALA A 16 3.803 40.700 20.824 1.00 15.22 H new ATOM 197 N LEU A 17 1.079 39.194 21.042 1.00 53.13 N ATOM 198 CA LEU A 17 0.476 38.101 21.796 1.00 42.43 C ATOM 199 C LEU A 17 -1.020 38.003 21.513 1.00 31.24 C ATOM 200 O LEU A 17 -1.698 37.099 22.000 1.00 3.53 O ATOM 201 CB LEU A 17 0.710 38.298 23.295 1.00 2.01 C ATOM 202 CG LEU A 17 2.091 38.818 23.696 1.00 51.40 C ATOM 203 CD1 LEU A 17 2.123 39.161 25.177 1.00 40.42 C ATOM 204 CD2 LEU A 17 3.165 37.793 23.360 1.00 32.14 C ATOM 0 H LEU A 17 0.872 40.123 21.408 1.00 53.13 H new ATOM 0 HA LEU A 17 0.949 37.171 21.479 1.00 42.43 H new ATOM 0 HB2 LEU A 17 -0.041 38.992 23.671 1.00 2.01 H new ATOM 0 HB3 LEU A 17 0.543 37.345 23.797 1.00 2.01 H new ATOM 0 HG LEU A 17 2.295 39.727 23.130 1.00 51.40 H new ATOM 0 HD11 LEU A 17 3.114 39.529 25.444 1.00 40.42 H new ATOM 0 HD12 LEU A 17 1.381 39.931 25.388 1.00 40.42 H new ATOM 0 HD13 LEU A 17 1.898 38.269 25.762 1.00 40.42 H new ATOM 0 HD21 LEU A 17 4.141 38.180 23.652 1.00 32.14 H new ATOM 0 HD22 LEU A 17 2.965 36.867 23.899 1.00 32.14 H new ATOM 0 HD23 LEU A 17 3.158 37.597 22.288 1.00 32.14 H new ATOM 215 N LYS A 18 -1.528 38.939 20.719 1.00 35.14 N ATOM 216 CA LYS A 18 -2.942 38.959 20.364 1.00 41.44 C ATOM 217 C LYS A 18 -3.464 37.544 20.131 1.00 13.32 C ATOM 218 O LYS A 18 -2.728 36.644 19.725 1.00 21.12 O ATOM 219 CB LYS A 18 -3.165 39.809 19.112 1.00 45.31 C ATOM 220 CG LYS A 18 -3.913 41.103 19.382 1.00 21.33 C ATOM 221 CD LYS A 18 -5.158 41.218 18.519 1.00 75.03 C ATOM 222 CE LYS A 18 -4.886 42.009 17.249 1.00 52.20 C ATOM 223 NZ LYS A 18 -4.700 43.460 17.528 1.00 74.14 N ATOM 0 H LYS A 18 -0.980 39.695 20.308 1.00 35.14 H new ATOM 0 HA LYS A 18 -3.493 39.399 21.195 1.00 41.44 H new ATOM 0 HB2 LYS A 18 -2.199 40.044 18.665 1.00 45.31 H new ATOM 0 HB3 LYS A 18 -3.721 39.224 18.380 1.00 45.31 H new ATOM 0 HG2 LYS A 18 -4.193 41.150 20.434 1.00 21.33 H new ATOM 0 HG3 LYS A 18 -3.256 41.951 19.189 1.00 21.33 H new ATOM 0 HD2 LYS A 18 -5.515 40.221 18.259 1.00 75.03 H new ATOM 0 HD3 LYS A 18 -5.952 41.702 19.087 1.00 75.03 H new ATOM 0 HE2 LYS A 18 -3.994 41.616 16.760 1.00 52.20 H new ATOM 0 HE3 LYS A 18 -5.715 41.876 16.554 1.00 52.20 H new ATOM 0 HZ1 LYS A 18 -4.804 43.999 16.645 1.00 74.14 H new ATOM 0 HZ2 LYS A 18 -5.415 43.776 18.214 1.00 74.14 H new ATOM 0 HZ3 LYS A 18 -3.750 43.619 17.920 1.00 74.14 H new ATOM 233 N PRO A 19 -4.764 37.342 20.390 1.00 75.23 N ATOM 234 CA PRO A 19 -5.413 36.038 20.213 1.00 22.34 C ATOM 235 C PRO A 19 -5.545 35.652 18.743 1.00 44.52 C ATOM 236 O PRO A 19 -5.546 34.470 18.400 1.00 45.42 O ATOM 237 CB PRO A 19 -6.795 36.243 20.838 1.00 43.13 C ATOM 238 CG PRO A 19 -7.044 37.708 20.736 1.00 73.24 C ATOM 239 CD PRO A 19 -5.701 38.368 20.877 1.00 33.12 C ATOM 0 HA PRO A 19 -4.839 35.231 20.669 1.00 22.34 H new ATOM 0 HB2 PRO A 19 -7.558 35.674 20.307 1.00 43.13 H new ATOM 0 HB3 PRO A 19 -6.814 35.910 21.876 1.00 43.13 H new ATOM 0 HG2 PRO A 19 -7.504 37.960 19.780 1.00 73.24 H new ATOM 0 HG3 PRO A 19 -7.727 38.043 21.517 1.00 73.24 H new ATOM 0 HD2 PRO A 19 -5.638 39.282 20.286 1.00 33.12 H new ATOM 0 HD3 PRO A 19 -5.495 38.642 21.912 1.00 33.12 H new ATOM 244 N ASP A 20 -5.656 36.656 17.881 1.00 34.24 N ATOM 245 CA ASP A 20 -5.787 36.421 16.447 1.00 72.22 C ATOM 246 C ASP A 20 -4.586 35.649 15.911 1.00 35.34 C ATOM 247 O ASP A 20 -4.638 35.076 14.822 1.00 62.53 O ATOM 248 CB ASP A 20 -5.931 37.749 15.702 1.00 43.21 C ATOM 249 CG ASP A 20 -6.990 38.645 16.314 1.00 54.42 C ATOM 250 OD1 ASP A 20 -8.036 38.117 16.744 1.00 44.02 O ATOM 251 OD2 ASP A 20 -6.772 39.874 16.362 1.00 2.32 O ATOM 0 H ASP A 20 -5.658 37.640 18.149 1.00 34.24 H new ATOM 0 HA ASP A 20 -6.683 35.823 16.282 1.00 72.22 H new ATOM 0 HB2 ASP A 20 -4.973 38.269 15.705 1.00 43.21 H new ATOM 0 HB3 ASP A 20 -6.184 37.552 14.660 1.00 43.21 H new ATOM 255 N SER A 21 -3.502 35.640 16.681 1.00 61.31 N ATOM 256 CA SER A 21 -2.286 34.943 16.281 1.00 64.33 C ATOM 257 C SER A 21 -2.265 33.523 16.838 1.00 5.41 C ATOM 258 O SER A 21 -1.371 32.737 16.528 1.00 21.13 O ATOM 259 CB SER A 21 -1.052 35.710 16.762 1.00 62.11 C ATOM 260 OG SER A 21 -1.019 37.017 16.215 1.00 21.44 O ATOM 0 H SER A 21 -3.442 36.108 17.585 1.00 61.31 H new ATOM 0 HA SER A 21 -2.270 34.888 15.193 1.00 64.33 H new ATOM 0 HB2 SER A 21 -1.057 35.768 17.850 1.00 62.11 H new ATOM 0 HB3 SER A 21 -0.150 35.170 16.476 1.00 62.11 H new ATOM 0 HG SER A 21 -0.222 37.487 16.539 1.00 21.44 H new ATOM 265 N GLN A 22 -3.256 33.204 17.664 1.00 62.21 N ATOM 266 CA GLN A 22 -3.351 31.879 18.265 1.00 65.44 C ATOM 267 C GLN A 22 -4.540 31.109 17.700 1.00 62.15 C ATOM 268 O GLN A 22 -4.460 29.901 17.473 1.00 33.53 O ATOM 269 CB GLN A 22 -3.480 31.993 19.786 1.00 23.54 C ATOM 270 CG GLN A 22 -2.224 32.515 20.464 1.00 41.42 C ATOM 271 CD GLN A 22 -1.194 31.427 20.701 1.00 64.42 C ATOM 272 OE1 GLN A 22 -1.300 30.654 21.655 1.00 13.35 O ATOM 273 NE2 GLN A 22 -0.192 31.361 19.834 1.00 3.03 N ATOM 0 H GLN A 22 -4.004 33.844 17.932 1.00 62.21 H new ATOM 0 HA GLN A 22 -2.439 31.333 18.024 1.00 65.44 H new ATOM 0 HB2 GLN A 22 -4.313 32.655 20.023 1.00 23.54 H new ATOM 0 HB3 GLN A 22 -3.724 31.013 20.196 1.00 23.54 H new ATOM 0 HG2 GLN A 22 -1.783 33.300 19.849 1.00 41.42 H new ATOM 0 HG3 GLN A 22 -2.493 32.970 21.417 1.00 41.42 H new ATOM 0 HE21 GLN A 22 -0.144 32.022 19.059 1.00 3.03 H new ATOM 0 HE22 GLN A 22 0.531 30.649 19.943 1.00 3.03 H new ATOM 280 N LYS A 23 -5.644 31.814 17.476 1.00 13.32 N ATOM 281 CA LYS A 23 -6.849 31.198 16.935 1.00 22.32 C ATOM 282 C LYS A 23 -6.647 30.791 15.479 1.00 43.35 C ATOM 283 O LYS A 23 -6.554 29.604 15.164 1.00 65.24 O ATOM 284 CB LYS A 23 -8.032 32.162 17.047 1.00 72.54 C ATOM 285 CG LYS A 23 -7.670 33.608 16.755 1.00 54.42 C ATOM 286 CD LYS A 23 -8.649 34.243 15.782 1.00 13.21 C ATOM 287 CE LYS A 23 -10.075 34.187 16.311 1.00 31.24 C ATOM 288 NZ LYS A 23 -11.036 34.849 15.385 1.00 15.10 N ATOM 0 H LYS A 23 -5.729 32.813 17.661 1.00 13.32 H new ATOM 0 HA LYS A 23 -7.061 30.301 17.517 1.00 22.32 H new ATOM 0 HB2 LYS A 23 -8.814 31.846 16.356 1.00 72.54 H new ATOM 0 HB3 LYS A 23 -8.449 32.097 18.052 1.00 72.54 H new ATOM 0 HG2 LYS A 23 -7.660 34.176 17.685 1.00 54.42 H new ATOM 0 HG3 LYS A 23 -6.663 33.655 16.342 1.00 54.42 H new ATOM 0 HD2 LYS A 23 -8.366 35.281 15.604 1.00 13.21 H new ATOM 0 HD3 LYS A 23 -8.595 33.729 14.822 1.00 13.21 H new ATOM 0 HE2 LYS A 23 -10.368 33.147 16.456 1.00 31.24 H new ATOM 0 HE3 LYS A 23 -10.120 34.670 17.287 1.00 31.24 H new ATOM 0 HZ1 LYS A 23 -11.996 34.790 15.781 1.00 15.10 H new ATOM 0 HZ2 LYS A 23 -10.772 35.848 15.266 1.00 15.10 H new ATOM 0 HZ3 LYS A 23 -11.012 34.372 14.461 1.00 15.10 H new ATOM 298 N SER A 24 -6.579 31.781 14.597 1.00 35.42 N ATOM 299 CA SER A 24 -6.390 31.525 13.173 1.00 24.31 C ATOM 300 C SER A 24 -5.341 30.441 12.951 1.00 32.11 C ATOM 301 O SER A 24 -5.388 29.709 11.962 1.00 12.11 O ATOM 302 CB SER A 24 -5.973 32.810 12.453 1.00 52.15 C ATOM 303 OG SER A 24 -6.719 32.991 11.262 1.00 3.02 O ATOM 0 H SER A 24 -6.652 32.768 14.842 1.00 35.42 H new ATOM 0 HA SER A 24 -7.338 31.178 12.762 1.00 24.31 H new ATOM 0 HB2 SER A 24 -6.122 33.665 13.113 1.00 52.15 H new ATOM 0 HB3 SER A 24 -4.910 32.770 12.217 1.00 52.15 H new ATOM 0 HG SER A 24 -6.436 33.819 10.821 1.00 3.02 H new ATOM 308 N TYR A 25 -4.394 30.343 13.878 1.00 64.34 N ATOM 309 CA TYR A 25 -3.332 29.349 13.784 1.00 24.14 C ATOM 310 C TYR A 25 -3.769 28.024 14.398 1.00 11.33 C ATOM 311 O TYR A 25 -3.746 26.985 13.739 1.00 42.52 O ATOM 312 CB TYR A 25 -2.068 29.857 14.482 1.00 42.35 C ATOM 313 CG TYR A 25 -1.514 31.129 13.883 1.00 12.20 C ATOM 314 CD1 TYR A 25 -2.252 32.305 13.893 1.00 22.21 C ATOM 315 CD2 TYR A 25 -0.249 31.154 13.308 1.00 74.31 C ATOM 316 CE1 TYR A 25 -1.750 33.469 13.346 1.00 25.14 C ATOM 317 CE2 TYR A 25 0.263 32.314 12.760 1.00 12.04 C ATOM 318 CZ TYR A 25 -0.491 33.469 12.780 1.00 23.52 C ATOM 319 OH TYR A 25 0.014 34.627 12.235 1.00 23.12 O ATOM 0 H TYR A 25 -4.341 30.940 14.703 1.00 64.34 H new ATOM 0 HA TYR A 25 -3.115 29.184 12.729 1.00 24.14 H new ATOM 0 HB2 TYR A 25 -2.289 30.028 15.536 1.00 42.35 H new ATOM 0 HB3 TYR A 25 -1.303 29.082 14.439 1.00 42.35 H new ATOM 0 HD1 TYR A 25 -3.237 32.309 14.337 1.00 22.21 H new ATOM 0 HD2 TYR A 25 0.344 30.251 13.289 1.00 74.31 H new ATOM 0 HE1 TYR A 25 -2.339 34.374 13.361 1.00 25.14 H new ATOM 0 HE2 TYR A 25 1.248 32.317 12.318 1.00 12.04 H new ATOM 0 HH TYR A 25 0.911 34.457 11.880 1.00 23.12 H new ATOM 328 N ALA A 26 -4.167 28.068 15.665 1.00 33.53 N ATOM 329 CA ALA A 26 -4.614 26.872 16.368 1.00 1.22 C ATOM 330 C ALA A 26 -5.976 26.412 15.860 1.00 63.00 C ATOM 331 O ALA A 26 -6.164 25.239 15.541 1.00 30.43 O ATOM 332 CB ALA A 26 -4.666 27.130 17.867 1.00 70.33 C ATOM 0 H ALA A 26 -4.189 28.920 16.226 1.00 33.53 H new ATOM 0 HA ALA A 26 -3.896 26.076 16.172 1.00 1.22 H new ATOM 0 HB1 ALA A 26 -5.001 26.229 18.380 1.00 70.33 H new ATOM 0 HB2 ALA A 26 -3.673 27.402 18.224 1.00 70.33 H new ATOM 0 HB3 ALA A 26 -5.361 27.944 18.072 1.00 70.33 H new ATOM 338 N GLU A 27 -6.921 27.343 15.790 1.00 31.33 N ATOM 339 CA GLU A 27 -8.266 27.032 15.321 1.00 73.24 C ATOM 340 C GLU A 27 -8.219 26.247 14.013 1.00 64.24 C ATOM 341 O GLU A 27 -8.762 25.147 13.918 1.00 61.12 O ATOM 342 CB GLU A 27 -9.075 28.316 15.130 1.00 35.45 C ATOM 343 CG GLU A 27 -10.543 28.072 14.825 1.00 34.42 C ATOM 344 CD GLU A 27 -11.454 28.493 15.962 1.00 1.41 C ATOM 345 OE1 GLU A 27 -11.533 27.750 16.963 1.00 23.41 O ATOM 346 OE2 GLU A 27 -12.086 29.564 15.852 1.00 22.12 O ATOM 0 H GLU A 27 -6.781 28.319 16.052 1.00 31.33 H new ATOM 0 HA GLU A 27 -8.752 26.415 16.077 1.00 73.24 H new ATOM 0 HB2 GLU A 27 -8.996 28.922 16.032 1.00 35.45 H new ATOM 0 HB3 GLU A 27 -8.635 28.895 14.318 1.00 35.45 H new ATOM 0 HG2 GLU A 27 -10.818 28.618 13.923 1.00 34.42 H new ATOM 0 HG3 GLU A 27 -10.695 27.013 14.616 1.00 34.42 H new ATOM 351 N GLN A 28 -7.567 26.823 13.008 1.00 10.31 N ATOM 352 CA GLN A 28 -7.450 26.179 11.705 1.00 63.23 C ATOM 353 C GLN A 28 -7.022 24.723 11.854 1.00 61.41 C ATOM 354 O GLN A 28 -7.493 23.850 11.127 1.00 10.22 O ATOM 355 CB GLN A 28 -6.446 26.931 10.830 1.00 0.41 C ATOM 356 CG GLN A 28 -7.096 27.772 9.743 1.00 60.34 C ATOM 357 CD GLN A 28 -6.242 27.874 8.495 1.00 33.33 C ATOM 358 OE1 GLN A 28 -6.143 26.924 7.717 1.00 11.15 O ATOM 359 NE2 GLN A 28 -5.620 29.030 8.296 1.00 31.44 N ATOM 0 H GLN A 28 -7.112 27.734 13.071 1.00 10.31 H new ATOM 0 HA GLN A 28 -8.429 26.204 11.226 1.00 63.23 H new ATOM 0 HB2 GLN A 28 -5.838 27.577 11.463 1.00 0.41 H new ATOM 0 HB3 GLN A 28 -5.771 26.212 10.366 1.00 0.41 H new ATOM 0 HG2 GLN A 28 -8.062 27.339 9.483 1.00 60.34 H new ATOM 0 HG3 GLN A 28 -7.289 28.773 10.130 1.00 60.34 H new ATOM 0 HE21 GLN A 28 -5.730 29.791 8.967 1.00 31.44 H new ATOM 0 HE22 GLN A 28 -5.032 29.158 7.472 1.00 31.44 H new ATOM 366 N GLY A 29 -6.125 24.468 12.803 1.00 31.53 N ATOM 367 CA GLY A 29 -5.649 23.117 13.029 1.00 41.34 C ATOM 368 C GLY A 29 -6.705 22.226 13.651 1.00 64.43 C ATOM 369 O GLY A 29 -6.908 21.092 13.215 1.00 60.34 O ATOM 0 H GLY A 29 -5.720 25.174 13.418 1.00 31.53 H new ATOM 0 HA2 GLY A 29 -5.327 22.686 12.081 1.00 41.34 H new ATOM 0 HA3 GLY A 29 -4.775 23.147 13.679 1.00 41.34 H new ATOM 372 N LYS A 30 -7.381 22.738 14.675 1.00 33.10 N ATOM 373 CA LYS A 30 -8.423 21.981 15.358 1.00 64.34 C ATOM 374 C LYS A 30 -9.607 21.725 14.432 1.00 75.10 C ATOM 375 O LYS A 30 -10.112 20.606 14.349 1.00 65.13 O ATOM 376 CB LYS A 30 -8.893 22.733 16.606 1.00 12.13 C ATOM 377 CG LYS A 30 -8.510 22.049 17.908 1.00 23.43 C ATOM 378 CD LYS A 30 -8.476 23.034 19.065 1.00 1.14 C ATOM 379 CE LYS A 30 -9.865 23.264 19.642 1.00 33.33 C ATOM 380 NZ LYS A 30 -10.337 22.094 20.433 1.00 22.52 N ATOM 0 H LYS A 30 -7.225 23.674 15.050 1.00 33.10 H new ATOM 0 HA LYS A 30 -8.003 21.020 15.655 1.00 64.34 H new ATOM 0 HB2 LYS A 30 -8.471 23.738 16.595 1.00 12.13 H new ATOM 0 HB3 LYS A 30 -9.977 22.842 16.568 1.00 12.13 H new ATOM 0 HG2 LYS A 30 -9.223 21.254 18.126 1.00 23.43 H new ATOM 0 HG3 LYS A 30 -7.532 21.579 17.800 1.00 23.43 H new ATOM 0 HD2 LYS A 30 -7.814 22.658 19.845 1.00 1.14 H new ATOM 0 HD3 LYS A 30 -8.060 23.983 18.725 1.00 1.14 H new ATOM 0 HE2 LYS A 30 -9.853 24.150 20.276 1.00 33.33 H new ATOM 0 HE3 LYS A 30 -10.567 23.462 18.832 1.00 33.33 H new ATOM 0 HZ1 LYS A 30 -11.165 22.369 20.999 1.00 22.52 H new ATOM 0 HZ2 LYS A 30 -10.600 21.322 19.788 1.00 22.52 H new ATOM 0 HZ3 LYS A 30 -9.576 21.773 21.066 1.00 22.52 H new ATOM 390 N GLU A 31 -10.045 22.769 13.735 1.00 20.13 N ATOM 391 CA GLU A 31 -11.169 22.656 12.813 1.00 72.05 C ATOM 392 C GLU A 31 -11.044 21.400 11.955 1.00 63.41 C ATOM 393 O GLU A 31 -12.045 20.796 11.570 1.00 64.21 O ATOM 394 CB GLU A 31 -11.250 23.894 11.917 1.00 74.14 C ATOM 395 CG GLU A 31 -11.414 25.193 12.687 1.00 63.34 C ATOM 396 CD GLU A 31 -12.739 25.874 12.407 1.00 34.22 C ATOM 397 OE1 GLU A 31 -13.068 26.062 11.217 1.00 60.45 O ATOM 398 OE2 GLU A 31 -13.446 26.219 13.377 1.00 72.41 O ATOM 0 H GLU A 31 -9.638 23.703 13.791 1.00 20.13 H new ATOM 0 HA GLU A 31 -12.083 22.583 13.402 1.00 72.05 H new ATOM 0 HB2 GLU A 31 -10.346 23.953 11.310 1.00 74.14 H new ATOM 0 HB3 GLU A 31 -12.088 23.780 11.230 1.00 74.14 H new ATOM 0 HG2 GLU A 31 -11.332 24.991 13.755 1.00 63.34 H new ATOM 0 HG3 GLU A 31 -10.600 25.870 12.428 1.00 63.34 H new ATOM 403 N TYR A 32 -9.808 21.014 11.658 1.00 64.13 N ATOM 404 CA TYR A 32 -9.551 19.833 10.843 1.00 40.44 C ATOM 405 C TYR A 32 -9.689 18.559 11.671 1.00 64.34 C ATOM 406 O TYR A 32 -10.194 17.544 11.189 1.00 22.13 O ATOM 407 CB TYR A 32 -8.152 19.906 10.229 1.00 43.30 C ATOM 408 CG TYR A 32 -7.727 18.631 9.538 1.00 75.33 C ATOM 409 CD1 TYR A 32 -7.414 17.491 10.270 1.00 72.30 C ATOM 410 CD2 TYR A 32 -7.638 18.564 8.153 1.00 15.33 C ATOM 411 CE1 TYR A 32 -7.024 16.324 9.642 1.00 63.23 C ATOM 412 CE2 TYR A 32 -7.250 17.400 7.517 1.00 30.21 C ATOM 413 CZ TYR A 32 -6.945 16.283 8.265 1.00 3.21 C ATOM 414 OH TYR A 32 -6.557 15.123 7.636 1.00 74.33 O ATOM 0 H TYR A 32 -8.968 21.502 11.970 1.00 64.13 H new ATOM 0 HA TYR A 32 -10.291 19.807 10.043 1.00 40.44 H new ATOM 0 HB2 TYR A 32 -8.122 20.726 9.511 1.00 43.30 H new ATOM 0 HB3 TYR A 32 -7.432 20.142 11.013 1.00 43.30 H new ATOM 0 HD1 TYR A 32 -7.477 17.518 11.348 1.00 72.30 H new ATOM 0 HD2 TYR A 32 -7.876 19.437 7.563 1.00 15.33 H new ATOM 0 HE1 TYR A 32 -6.782 15.448 10.226 1.00 63.23 H new ATOM 0 HE2 TYR A 32 -7.186 17.366 6.439 1.00 30.21 H new ATOM 0 HH TYR A 32 -6.554 15.262 6.666 1.00 74.33 H new ATOM 423 N ILE A 33 -9.239 18.621 12.920 1.00 10.31 N ATOM 424 CA ILE A 33 -9.313 17.474 13.816 1.00 75.41 C ATOM 425 C ILE A 33 -10.701 17.352 14.438 1.00 1.52 C ATOM 426 O ILE A 33 -11.378 16.336 14.278 1.00 62.31 O ATOM 427 CB ILE A 33 -8.265 17.569 14.940 1.00 44.21 C ATOM 428 CG1 ILE A 33 -6.890 17.143 14.422 1.00 71.24 C ATOM 429 CG2 ILE A 33 -8.681 16.710 16.126 1.00 14.45 C ATOM 430 CD1 ILE A 33 -6.262 18.146 13.480 1.00 43.53 C ATOM 0 H ILE A 33 -8.819 19.453 13.334 1.00 10.31 H new ATOM 0 HA ILE A 33 -9.108 16.589 13.214 1.00 75.41 H new ATOM 0 HB ILE A 33 -8.202 18.605 15.272 1.00 44.21 H new ATOM 0 HG12 ILE A 33 -6.224 16.987 15.270 1.00 71.24 H new ATOM 0 HG13 ILE A 33 -6.984 16.185 13.910 1.00 71.24 H new ATOM 0 HG21 ILE A 33 -7.930 16.787 16.912 1.00 14.45 H new ATOM 0 HG22 ILE A 33 -9.642 17.056 16.506 1.00 14.45 H new ATOM 0 HG23 ILE A 33 -8.769 15.671 15.809 1.00 14.45 H new ATOM 0 HD11 ILE A 33 -5.289 17.778 13.153 1.00 43.53 H new ATOM 0 HD12 ILE A 33 -6.908 18.285 12.613 1.00 43.53 H new ATOM 0 HD13 ILE A 33 -6.135 19.099 13.994 1.00 43.53 H new ATOM 441 N THR A 34 -11.119 18.395 15.148 1.00 41.23 N ATOM 442 CA THR A 34 -12.425 18.406 15.794 1.00 31.23 C ATOM 443 C THR A 34 -13.467 17.694 14.938 1.00 3.30 C ATOM 444 O THR A 34 -14.225 16.859 15.433 1.00 43.11 O ATOM 445 CB THR A 34 -12.902 19.844 16.072 1.00 44.41 C ATOM 446 OG1 THR A 34 -14.258 19.829 16.533 1.00 30.51 O ATOM 447 CG2 THR A 34 -12.794 20.702 14.822 1.00 24.31 C ATOM 0 H THR A 34 -10.571 19.244 15.290 1.00 41.23 H new ATOM 0 HA THR A 34 -12.314 17.878 16.741 1.00 31.23 H new ATOM 0 HB THR A 34 -12.262 20.273 16.842 1.00 44.41 H new ATOM 0 HG1 THR A 34 -14.554 20.747 16.709 1.00 30.51 H new ATOM 0 HG21 THR A 34 -13.137 21.713 15.044 1.00 24.31 H new ATOM 0 HG22 THR A 34 -11.756 20.735 14.492 1.00 24.31 H new ATOM 0 HG23 THR A 34 -13.412 20.274 14.033 1.00 24.31 H new ATOM 455 N ASP A 35 -13.499 18.029 13.654 1.00 72.51 N ATOM 456 CA ASP A 35 -14.448 17.420 12.728 1.00 44.13 C ATOM 457 C ASP A 35 -14.345 15.898 12.768 1.00 31.24 C ATOM 458 O ASP A 35 -15.265 15.213 13.213 1.00 44.12 O ATOM 459 CB ASP A 35 -14.202 17.924 11.306 1.00 4.33 C ATOM 460 CG ASP A 35 -15.441 18.539 10.686 1.00 60.05 C ATOM 461 OD1 ASP A 35 -15.763 19.696 11.028 1.00 30.03 O ATOM 462 OD2 ASP A 35 -16.090 17.862 9.861 1.00 50.11 O ATOM 0 H ASP A 35 -12.879 18.719 13.230 1.00 72.51 H new ATOM 0 HA ASP A 35 -15.454 17.706 13.036 1.00 44.13 H new ATOM 0 HB2 ASP A 35 -13.401 18.663 11.319 1.00 4.33 H new ATOM 0 HB3 ASP A 35 -13.861 17.096 10.684 1.00 4.33 H new ATOM 466 N LYS A 36 -13.218 15.375 12.296 1.00 74.22 N ATOM 467 CA LYS A 36 -12.992 13.934 12.276 1.00 24.33 C ATOM 468 C LYS A 36 -12.779 13.398 13.688 1.00 52.14 C ATOM 469 O LYS A 36 -12.809 12.188 13.914 1.00 13.03 O ATOM 470 CB LYS A 36 -11.780 13.599 11.403 1.00 61.23 C ATOM 471 CG LYS A 36 -10.596 13.064 12.188 1.00 14.41 C ATOM 472 CD LYS A 36 -9.984 14.135 13.076 1.00 34.33 C ATOM 473 CE LYS A 36 -8.465 14.058 13.075 1.00 45.34 C ATOM 474 NZ LYS A 36 -7.981 12.651 13.152 1.00 3.11 N ATOM 0 H LYS A 36 -12.447 15.928 11.922 1.00 74.22 H new ATOM 0 HA LYS A 36 -13.877 13.458 11.855 1.00 24.33 H new ATOM 0 HB2 LYS A 36 -12.073 12.861 10.656 1.00 61.23 H new ATOM 0 HB3 LYS A 36 -11.473 14.495 10.863 1.00 61.23 H new ATOM 0 HG2 LYS A 36 -10.916 12.221 12.801 1.00 14.41 H new ATOM 0 HG3 LYS A 36 -9.841 12.688 11.498 1.00 14.41 H new ATOM 0 HD2 LYS A 36 -10.300 15.120 12.731 1.00 34.33 H new ATOM 0 HD3 LYS A 36 -10.355 14.020 14.095 1.00 34.33 H new ATOM 0 HE2 LYS A 36 -8.078 14.526 12.170 1.00 45.34 H new ATOM 0 HE3 LYS A 36 -8.072 14.624 13.920 1.00 45.34 H new ATOM 0 HZ1 LYS A 36 -7.064 12.626 13.641 1.00 3.11 H new ATOM 0 HZ2 LYS A 36 -8.670 12.075 13.677 1.00 3.11 H new ATOM 0 HZ3 LYS A 36 -7.872 12.268 12.191 1.00 3.11 H new ATOM 484 N ALA A 37 -12.566 14.305 14.635 1.00 3.14 N ATOM 485 CA ALA A 37 -12.352 13.923 16.025 1.00 40.33 C ATOM 486 C ALA A 37 -13.633 13.380 16.649 1.00 21.14 C ATOM 487 O ALA A 37 -13.607 12.391 17.381 1.00 52.34 O ATOM 488 CB ALA A 37 -11.834 15.108 16.825 1.00 24.34 C ATOM 0 H ALA A 37 -12.537 15.310 14.465 1.00 3.14 H new ATOM 0 HA ALA A 37 -11.604 13.130 16.046 1.00 40.33 H new ATOM 0 HB1 ALA A 37 -11.679 14.808 17.861 1.00 24.34 H new ATOM 0 HB2 ALA A 37 -10.890 15.449 16.401 1.00 24.34 H new ATOM 0 HB3 ALA A 37 -12.562 15.919 16.787 1.00 24.34 H new ATOM 494 N ASP A 38 -14.751 14.035 16.356 1.00 53.14 N ATOM 495 CA ASP A 38 -16.043 13.617 16.888 1.00 62.14 C ATOM 496 C ASP A 38 -16.459 12.268 16.309 1.00 53.24 C ATOM 497 O ASP A 38 -17.306 11.573 16.872 1.00 35.42 O ATOM 498 CB ASP A 38 -17.110 14.668 16.579 1.00 44.11 C ATOM 499 CG ASP A 38 -18.239 14.661 17.590 1.00 61.13 C ATOM 500 OD1 ASP A 38 -18.025 14.166 18.716 1.00 61.25 O ATOM 501 OD2 ASP A 38 -19.338 15.151 17.256 1.00 74.31 O ATOM 0 H ASP A 38 -14.789 14.857 15.753 1.00 53.14 H new ATOM 0 HA ASP A 38 -15.946 13.514 17.969 1.00 62.14 H new ATOM 0 HB2 ASP A 38 -16.649 15.655 16.561 1.00 44.11 H new ATOM 0 HB3 ASP A 38 -17.516 14.487 15.584 1.00 44.11 H new ATOM 505 N LYS A 39 -15.859 11.903 15.182 1.00 1.45 N ATOM 506 CA LYS A 39 -16.165 10.638 14.525 1.00 41.14 C ATOM 507 C LYS A 39 -15.179 9.553 14.946 1.00 5.44 C ATOM 508 O LYS A 39 -15.573 8.438 15.283 1.00 54.05 O ATOM 509 CB LYS A 39 -16.134 10.807 13.005 1.00 31.55 C ATOM 510 CG LYS A 39 -16.876 9.714 12.255 1.00 4.33 C ATOM 511 CD LYS A 39 -18.379 9.831 12.442 1.00 51.03 C ATOM 512 CE LYS A 39 -19.004 10.723 11.380 1.00 21.12 C ATOM 513 NZ LYS A 39 -19.359 9.960 10.152 1.00 10.02 N ATOM 0 H LYS A 39 -15.156 12.467 14.703 1.00 1.45 H new ATOM 0 HA LYS A 39 -17.166 10.333 14.830 1.00 41.14 H new ATOM 0 HB2 LYS A 39 -16.569 11.773 12.746 1.00 31.55 H new ATOM 0 HB3 LYS A 39 -15.097 10.825 12.671 1.00 31.55 H new ATOM 0 HG2 LYS A 39 -16.635 9.772 11.194 1.00 4.33 H new ATOM 0 HG3 LYS A 39 -16.540 8.738 12.606 1.00 4.33 H new ATOM 0 HD2 LYS A 39 -18.831 8.840 12.398 1.00 51.03 H new ATOM 0 HD3 LYS A 39 -18.593 10.236 13.431 1.00 51.03 H new ATOM 0 HE2 LYS A 39 -19.899 11.196 11.784 1.00 21.12 H new ATOM 0 HE3 LYS A 39 -18.309 11.522 11.122 1.00 21.12 H new ATOM 0 HZ1 LYS A 39 -19.782 10.604 9.453 1.00 10.02 H new ATOM 0 HZ2 LYS A 39 -18.502 9.529 9.751 1.00 10.02 H new ATOM 0 HZ3 LYS A 39 -20.042 9.213 10.392 1.00 10.02 H new ATOM 523 N VAL A 40 -13.893 9.890 14.927 1.00 15.34 N ATOM 524 CA VAL A 40 -12.849 8.946 15.309 1.00 53.21 C ATOM 525 C VAL A 40 -13.041 8.465 16.743 1.00 0.23 C ATOM 526 O VAL A 40 -12.352 7.554 17.200 1.00 73.53 O ATOM 527 CB VAL A 40 -11.448 9.571 15.171 1.00 72.10 C ATOM 528 CG1 VAL A 40 -11.123 9.836 13.709 1.00 71.10 C ATOM 529 CG2 VAL A 40 -11.354 10.850 15.988 1.00 33.52 C ATOM 0 H VAL A 40 -13.549 10.810 14.651 1.00 15.34 H new ATOM 0 HA VAL A 40 -12.927 8.096 14.631 1.00 53.21 H new ATOM 0 HB VAL A 40 -10.714 8.865 15.558 1.00 72.10 H new ATOM 0 HG11 VAL A 40 -10.129 10.278 13.631 1.00 71.10 H new ATOM 0 HG12 VAL A 40 -11.147 8.898 13.155 1.00 71.10 H new ATOM 0 HG13 VAL A 40 -11.859 10.523 13.291 1.00 71.10 H new ATOM 0 HG21 VAL A 40 -10.358 11.279 15.879 1.00 33.52 H new ATOM 0 HG22 VAL A 40 -12.097 11.564 15.633 1.00 33.52 H new ATOM 0 HG23 VAL A 40 -11.540 10.625 17.038 1.00 33.52 H new ATOM 539 N ALA A 41 -13.982 9.085 17.448 1.00 11.01 N ATOM 540 CA ALA A 41 -14.266 8.720 18.829 1.00 41.23 C ATOM 541 C ALA A 41 -15.331 7.630 18.901 1.00 51.51 C ATOM 542 O ALA A 41 -15.496 6.978 19.931 1.00 72.15 O ATOM 543 CB ALA A 41 -14.708 9.944 19.619 1.00 13.11 C ATOM 0 H ALA A 41 -14.560 9.843 17.084 1.00 11.01 H new ATOM 0 HA ALA A 41 -13.350 8.327 19.270 1.00 41.23 H new ATOM 0 HB1 ALA A 41 -14.917 9.656 20.649 1.00 13.11 H new ATOM 0 HB2 ALA A 41 -13.915 10.692 19.605 1.00 13.11 H new ATOM 0 HB3 ALA A 41 -15.609 10.362 19.169 1.00 13.11 H new ATOM 549 N GLY A 42 -16.050 7.439 17.800 1.00 40.03 N ATOM 550 CA GLY A 42 -17.090 6.427 17.759 1.00 3.22 C ATOM 551 C GLY A 42 -16.590 5.102 17.220 1.00 1.34 C ATOM 552 O GLY A 42 -17.335 4.123 17.165 1.00 42.45 O ATOM 0 H GLY A 42 -15.931 7.967 16.935 1.00 40.03 H new ATOM 0 HA2 GLY A 42 -17.489 6.280 18.763 1.00 3.22 H new ATOM 0 HA3 GLY A 42 -17.913 6.781 17.138 1.00 3.22 H new ATOM 555 N LYS A 43 -15.324 5.070 16.815 1.00 45.41 N ATOM 556 CA LYS A 43 -14.724 3.856 16.276 1.00 13.20 C ATOM 557 C LYS A 43 -13.479 3.466 17.068 1.00 62.31 C ATOM 558 O LYS A 43 -13.221 2.284 17.295 1.00 53.21 O ATOM 559 CB LYS A 43 -14.363 4.052 14.802 1.00 0.22 C ATOM 560 CG LYS A 43 -12.869 4.173 14.553 1.00 54.33 C ATOM 561 CD LYS A 43 -12.378 5.592 14.780 1.00 72.51 C ATOM 562 CE LYS A 43 -10.963 5.610 15.336 1.00 4.44 C ATOM 563 NZ LYS A 43 -10.079 6.536 14.576 1.00 24.54 N ATOM 0 H LYS A 43 -14.694 5.872 16.850 1.00 45.41 H new ATOM 0 HA LYS A 43 -15.454 3.051 16.361 1.00 13.20 H new ATOM 0 HB2 LYS A 43 -14.752 3.212 14.226 1.00 0.22 H new ATOM 0 HB3 LYS A 43 -14.859 4.949 14.431 1.00 0.22 H new ATOM 0 HG2 LYS A 43 -12.333 3.492 15.214 1.00 54.33 H new ATOM 0 HG3 LYS A 43 -12.644 3.869 13.531 1.00 54.33 H new ATOM 0 HD2 LYS A 43 -12.408 6.143 13.840 1.00 72.51 H new ATOM 0 HD3 LYS A 43 -13.048 6.104 15.471 1.00 72.51 H new ATOM 0 HE2 LYS A 43 -10.988 5.911 16.383 1.00 4.44 H new ATOM 0 HE3 LYS A 43 -10.547 4.603 15.303 1.00 4.44 H new ATOM 0 HZ1 LYS A 43 -9.429 5.985 13.980 1.00 24.54 H new ATOM 0 HZ2 LYS A 43 -10.660 7.155 13.975 1.00 24.54 H new ATOM 0 HZ3 LYS A 43 -9.530 7.116 15.242 1.00 24.54 H new ATOM 573 N VAL A 44 -12.712 4.467 17.487 1.00 30.52 N ATOM 574 CA VAL A 44 -11.496 4.229 18.256 1.00 75.30 C ATOM 575 C VAL A 44 -11.669 3.051 19.207 1.00 62.20 C ATOM 576 O VAL A 44 -10.831 2.152 19.256 1.00 1.15 O ATOM 577 CB VAL A 44 -11.091 5.475 19.066 1.00 70.14 C ATOM 578 CG1 VAL A 44 -12.315 6.120 19.699 1.00 24.12 C ATOM 579 CG2 VAL A 44 -10.063 5.109 20.125 1.00 22.12 C ATOM 0 H VAL A 44 -12.911 5.451 17.307 1.00 30.52 H new ATOM 0 HA VAL A 44 -10.708 4.000 17.539 1.00 75.30 H new ATOM 0 HB VAL A 44 -10.639 6.198 18.388 1.00 70.14 H new ATOM 0 HG11 VAL A 44 -12.010 6.999 20.267 1.00 24.12 H new ATOM 0 HG12 VAL A 44 -13.014 6.418 18.918 1.00 24.12 H new ATOM 0 HG13 VAL A 44 -12.798 5.406 20.366 1.00 24.12 H new ATOM 0 HG21 VAL A 44 -9.788 6.001 20.688 1.00 22.12 H new ATOM 0 HG22 VAL A 44 -10.487 4.368 20.803 1.00 22.12 H new ATOM 0 HG23 VAL A 44 -9.177 4.696 19.644 1.00 22.12 H new ATOM 589 N GLN A 45 -12.764 3.062 19.961 1.00 33.30 N ATOM 590 CA GLN A 45 -13.047 1.994 20.912 1.00 73.32 C ATOM 591 C GLN A 45 -13.192 0.654 20.198 1.00 70.25 C ATOM 592 O GLN A 45 -14.137 0.426 19.442 1.00 55.30 O ATOM 593 CB GLN A 45 -14.321 2.307 21.699 1.00 32.53 C ATOM 594 CG GLN A 45 -14.409 3.751 22.165 1.00 3.33 C ATOM 595 CD GLN A 45 -15.375 3.935 23.319 1.00 11.52 C ATOM 596 OE1 GLN A 45 -15.007 4.444 24.378 1.00 51.20 O ATOM 597 NE2 GLN A 45 -16.621 3.520 23.120 1.00 14.33 N ATOM 0 H GLN A 45 -13.469 3.798 19.931 1.00 33.30 H new ATOM 0 HA GLN A 45 -12.208 1.927 21.605 1.00 73.32 H new ATOM 0 HB2 GLN A 45 -15.187 2.081 21.077 1.00 32.53 H new ATOM 0 HB3 GLN A 45 -14.372 1.650 22.567 1.00 32.53 H new ATOM 0 HG2 GLN A 45 -13.419 4.092 22.467 1.00 3.33 H new ATOM 0 HG3 GLN A 45 -14.722 4.379 21.331 1.00 3.33 H new ATOM 0 HE21 GLN A 45 -16.883 3.104 22.227 1.00 14.33 H new ATOM 0 HE22 GLN A 45 -17.315 3.618 23.861 1.00 14.33 H new ATOM 604 N PRO A 46 -12.237 -0.254 20.442 1.00 51.42 N ATOM 605 CA PRO A 46 -12.236 -1.587 19.832 1.00 44.41 C ATOM 606 C PRO A 46 -13.353 -2.473 20.375 1.00 12.22 C ATOM 607 O PRO A 46 -13.723 -3.469 19.754 1.00 42.41 O ATOM 608 CB PRO A 46 -10.868 -2.154 20.220 1.00 12.01 C ATOM 609 CG PRO A 46 -10.496 -1.429 21.466 1.00 22.43 C ATOM 610 CD PRO A 46 -11.082 -0.049 21.334 1.00 14.12 C ATOM 0 HA PRO A 46 -12.405 -1.543 18.756 1.00 44.41 H new ATOM 0 HB2 PRO A 46 -10.919 -3.230 20.388 1.00 12.01 H new ATOM 0 HB3 PRO A 46 -10.133 -1.989 19.432 1.00 12.01 H new ATOM 0 HG2 PRO A 46 -10.890 -1.938 22.346 1.00 22.43 H new ATOM 0 HG3 PRO A 46 -9.413 -1.384 21.582 1.00 22.43 H new ATOM 0 HD2 PRO A 46 -11.387 0.353 22.300 1.00 14.12 H new ATOM 0 HD3 PRO A 46 -10.365 0.653 20.909 1.00 14.12 H new ATOM 615 N GLU A 47 -13.886 -2.102 21.534 1.00 4.31 N ATOM 616 CA GLU A 47 -14.960 -2.864 22.160 1.00 13.01 C ATOM 617 C GLU A 47 -16.324 -2.372 21.684 1.00 2.12 C ATOM 618 O GLU A 47 -17.361 -2.885 22.103 1.00 52.35 O ATOM 619 CB GLU A 47 -14.870 -2.761 23.683 1.00 64.31 C ATOM 620 CG GLU A 47 -14.751 -1.333 24.189 1.00 65.15 C ATOM 621 CD GLU A 47 -14.977 -1.224 25.685 1.00 2.02 C ATOM 622 OE1 GLU A 47 -15.962 -1.810 26.180 1.00 42.44 O ATOM 623 OE2 GLU A 47 -14.170 -0.552 26.360 1.00 1.31 O ATOM 0 H GLU A 47 -13.592 -1.278 22.059 1.00 4.31 H new ATOM 0 HA GLU A 47 -14.847 -3.908 21.868 1.00 13.01 H new ATOM 0 HB2 GLU A 47 -15.755 -3.221 24.123 1.00 64.31 H new ATOM 0 HB3 GLU A 47 -14.008 -3.333 24.027 1.00 64.31 H new ATOM 0 HG2 GLU A 47 -13.761 -0.946 23.946 1.00 65.15 H new ATOM 0 HG3 GLU A 47 -15.475 -0.706 23.669 1.00 65.15 H new ATOM 628 N ASP A 48 -16.313 -1.373 20.808 1.00 52.10 N ATOM 629 CA ASP A 48 -17.548 -0.811 20.275 1.00 74.53 C ATOM 630 C ASP A 48 -18.307 -1.848 19.452 1.00 21.24 C ATOM 631 O ASP A 48 -19.480 -1.663 19.132 1.00 30.13 O ATOM 632 CB ASP A 48 -17.246 0.418 19.417 1.00 12.21 C ATOM 633 CG ASP A 48 -16.721 0.050 18.043 1.00 53.11 C ATOM 634 OD1 ASP A 48 -15.973 -0.946 17.940 1.00 63.33 O ATOM 635 OD2 ASP A 48 -17.058 0.756 17.071 1.00 33.24 O ATOM 0 H ASP A 48 -15.463 -0.936 20.452 1.00 52.10 H new ATOM 0 HA ASP A 48 -18.174 -0.512 21.116 1.00 74.53 H new ATOM 0 HB2 ASP A 48 -18.152 1.014 19.309 1.00 12.21 H new ATOM 0 HB3 ASP A 48 -16.513 1.043 19.927 1.00 12.21 H new ATOM 639 N ASN A 49 -17.626 -2.938 19.111 1.00 60.55 N ATOM 640 CA ASN A 49 -18.236 -4.004 18.324 1.00 30.11 C ATOM 641 C ASN A 49 -19.458 -4.576 19.036 1.00 15.01 C ATOM 642 O ASN A 49 -20.340 -5.161 18.406 1.00 60.35 O ATOM 643 CB ASN A 49 -17.219 -5.115 18.058 1.00 13.22 C ATOM 644 CG ASN A 49 -17.726 -6.136 17.058 1.00 32.43 C ATOM 645 OD1 ASN A 49 -17.840 -7.322 17.368 1.00 22.43 O ATOM 646 ND2 ASN A 49 -18.033 -5.678 15.850 1.00 20.05 N ATOM 0 H ASN A 49 -16.653 -3.106 19.367 1.00 60.55 H new ATOM 0 HA ASN A 49 -18.558 -3.581 17.373 1.00 30.11 H new ATOM 0 HB2 ASN A 49 -16.293 -4.675 17.686 1.00 13.22 H new ATOM 0 HB3 ASN A 49 -16.980 -5.617 18.996 1.00 13.22 H new ATOM 0 HD21 ASN A 49 -18.379 -6.318 15.135 1.00 20.05 H new ATOM 0 HD22 ASN A 49 -17.923 -4.687 15.637 1.00 20.05 H new ATOM 652 N LYS A 50 -19.502 -4.404 20.353 1.00 74.51 N ATOM 653 CA LYS A 50 -20.616 -4.901 21.151 1.00 40.25 C ATOM 654 C LYS A 50 -21.788 -3.926 21.118 1.00 62.14 C ATOM 655 O LYS A 50 -22.924 -4.294 21.418 1.00 41.20 O ATOM 656 CB LYS A 50 -20.171 -5.130 22.598 1.00 14.02 C ATOM 657 CG LYS A 50 -20.157 -3.865 23.438 1.00 73.51 C ATOM 658 CD LYS A 50 -21.291 -3.857 24.450 1.00 21.22 C ATOM 659 CE LYS A 50 -20.873 -3.186 25.750 1.00 1.13 C ATOM 660 NZ LYS A 50 -20.266 -4.155 26.704 1.00 34.33 N ATOM 0 H LYS A 50 -18.779 -3.924 20.890 1.00 74.51 H new ATOM 0 HA LYS A 50 -20.942 -5.848 20.722 1.00 40.25 H new ATOM 0 HB2 LYS A 50 -20.836 -5.857 23.063 1.00 14.02 H new ATOM 0 HB3 LYS A 50 -19.172 -5.567 22.597 1.00 14.02 H new ATOM 0 HG2 LYS A 50 -19.203 -3.783 23.958 1.00 73.51 H new ATOM 0 HG3 LYS A 50 -20.242 -2.994 22.788 1.00 73.51 H new ATOM 0 HD2 LYS A 50 -22.151 -3.335 24.030 1.00 21.22 H new ATOM 0 HD3 LYS A 50 -21.607 -4.880 24.653 1.00 21.22 H new ATOM 0 HE2 LYS A 50 -20.158 -2.392 25.535 1.00 1.13 H new ATOM 0 HE3 LYS A 50 -21.742 -2.717 26.212 1.00 1.13 H new ATOM 0 HZ1 LYS A 50 -19.995 -3.659 27.577 1.00 34.33 H new ATOM 0 HZ2 LYS A 50 -20.956 -4.899 26.929 1.00 34.33 H new ATOM 0 HZ3 LYS A 50 -19.422 -4.584 26.273 1.00 34.33 H new ATOM 670 N GLY A 51 -21.505 -2.680 20.750 1.00 64.33 N ATOM 671 CA GLY A 51 -22.547 -1.672 20.684 1.00 5.31 C ATOM 672 C GLY A 51 -23.752 -2.135 19.890 1.00 64.21 C ATOM 673 O GLY A 51 -24.874 -1.690 20.134 1.00 25.13 O ATOM 0 H GLY A 51 -20.573 -2.351 20.497 1.00 64.33 H new ATOM 0 HA2 GLY A 51 -22.860 -1.411 21.695 1.00 5.31 H new ATOM 0 HA3 GLY A 51 -22.144 -0.766 20.231 1.00 5.31 H new ATOM 676 N VAL A 52 -23.522 -3.031 18.936 1.00 14.12 N ATOM 677 CA VAL A 52 -24.598 -3.555 18.104 1.00 33.42 C ATOM 678 C VAL A 52 -25.616 -4.322 18.940 1.00 14.25 C ATOM 679 O VAL A 52 -26.812 -4.308 18.647 1.00 44.33 O ATOM 680 CB VAL A 52 -24.054 -4.481 16.999 1.00 1.21 C ATOM 681 CG1 VAL A 52 -22.912 -3.808 16.252 1.00 62.22 C ATOM 682 CG2 VAL A 52 -23.604 -5.808 17.592 1.00 72.40 C ATOM 0 H VAL A 52 -22.600 -3.409 18.720 1.00 14.12 H new ATOM 0 HA VAL A 52 -25.086 -2.697 17.641 1.00 33.42 H new ATOM 0 HB VAL A 52 -24.855 -4.679 16.287 1.00 1.21 H new ATOM 0 HG11 VAL A 52 -22.541 -4.477 15.476 1.00 62.22 H new ATOM 0 HG12 VAL A 52 -23.270 -2.885 15.795 1.00 62.22 H new ATOM 0 HG13 VAL A 52 -22.106 -3.579 16.949 1.00 62.22 H new ATOM 0 HG21 VAL A 52 -23.223 -6.450 16.798 1.00 72.40 H new ATOM 0 HG22 VAL A 52 -22.817 -5.631 18.325 1.00 72.40 H new ATOM 0 HG23 VAL A 52 -24.450 -6.295 18.078 1.00 72.40 H new ATOM 692 N PHE A 53 -25.133 -4.992 19.981 1.00 31.34 N ATOM 693 CA PHE A 53 -26.002 -5.767 20.860 1.00 21.04 C ATOM 694 C PHE A 53 -26.504 -4.912 22.019 1.00 2.11 C ATOM 695 O PHE A 53 -27.295 -5.369 22.843 1.00 2.01 O ATOM 696 CB PHE A 53 -25.256 -6.989 21.400 1.00 34.32 C ATOM 697 CG PHE A 53 -25.649 -8.275 20.729 1.00 75.11 C ATOM 698 CD1 PHE A 53 -25.874 -8.319 19.363 1.00 21.45 C ATOM 699 CD2 PHE A 53 -25.793 -9.439 21.465 1.00 41.42 C ATOM 700 CE1 PHE A 53 -26.236 -9.500 18.742 1.00 24.01 C ATOM 701 CE2 PHE A 53 -26.154 -10.624 20.850 1.00 64.22 C ATOM 702 CZ PHE A 53 -26.376 -10.654 19.488 1.00 32.11 C ATOM 0 H PHE A 53 -24.146 -5.014 20.237 1.00 31.34 H new ATOM 0 HA PHE A 53 -26.861 -6.101 20.279 1.00 21.04 H new ATOM 0 HB2 PHE A 53 -24.184 -6.835 21.274 1.00 34.32 H new ATOM 0 HB3 PHE A 53 -25.442 -7.075 22.470 1.00 34.32 H new ATOM 0 HD1 PHE A 53 -25.765 -7.419 18.776 1.00 21.45 H new ATOM 0 HD2 PHE A 53 -25.622 -9.421 22.531 1.00 41.42 H new ATOM 0 HE1 PHE A 53 -26.409 -9.520 17.676 1.00 24.01 H new ATOM 0 HE2 PHE A 53 -26.262 -11.525 21.435 1.00 64.22 H new ATOM 0 HZ PHE A 53 -26.659 -11.578 19.006 1.00 32.11 H new ATOM 711 N GLN A 54 -26.038 -3.668 22.075 1.00 50.14 N ATOM 712 CA GLN A 54 -26.440 -2.749 23.133 1.00 44.42 C ATOM 713 C GLN A 54 -27.957 -2.607 23.184 1.00 64.32 C ATOM 714 O GLN A 54 -28.525 -2.272 24.224 1.00 12.21 O ATOM 715 CB GLN A 54 -25.794 -1.379 22.920 1.00 42.03 C ATOM 716 CG GLN A 54 -25.733 -0.533 24.182 1.00 31.40 C ATOM 717 CD GLN A 54 -25.582 0.947 23.885 1.00 70.11 C ATOM 718 OE1 GLN A 54 -24.591 1.570 24.269 1.00 33.43 O ATOM 719 NE2 GLN A 54 -26.565 1.517 23.199 1.00 51.44 N ATOM 0 H GLN A 54 -25.382 -3.274 21.400 1.00 50.14 H new ATOM 0 HA GLN A 54 -26.100 -3.159 24.084 1.00 44.42 H new ATOM 0 HB2 GLN A 54 -24.783 -1.519 22.537 1.00 42.03 H new ATOM 0 HB3 GLN A 54 -26.352 -0.838 22.156 1.00 42.03 H new ATOM 0 HG2 GLN A 54 -26.640 -0.692 24.766 1.00 31.40 H new ATOM 0 HG3 GLN A 54 -24.896 -0.864 24.797 1.00 31.40 H new ATOM 0 HE21 GLN A 54 -27.367 0.962 22.901 1.00 51.44 H new ATOM 0 HE22 GLN A 54 -26.518 2.510 22.970 1.00 51.44 H new ATOM 726 N GLY A 55 -28.609 -2.863 22.055 1.00 72.10 N ATOM 727 CA GLY A 55 -30.055 -2.757 21.992 1.00 73.03 C ATOM 728 C GLY A 55 -30.746 -4.072 22.295 1.00 41.34 C ATOM 729 O GLY A 55 -31.664 -4.125 23.114 1.00 60.22 O ATOM 0 H GLY A 55 -28.162 -3.142 21.182 1.00 72.10 H new ATOM 0 HA2 GLY A 55 -30.392 -2.001 22.701 1.00 73.03 H new ATOM 0 HA3 GLY A 55 -30.348 -2.416 20.999 1.00 73.03 H new ATOM 732 N VAL A 56 -30.306 -5.137 21.633 1.00 35.13 N ATOM 733 CA VAL A 56 -30.889 -6.458 21.835 1.00 12.21 C ATOM 734 C VAL A 56 -30.673 -6.940 23.265 1.00 54.25 C ATOM 735 O VAL A 56 -31.531 -7.609 23.842 1.00 45.30 O ATOM 736 CB VAL A 56 -30.291 -7.490 20.861 1.00 71.25 C ATOM 737 CG1 VAL A 56 -30.591 -7.101 19.421 1.00 54.21 C ATOM 738 CG2 VAL A 56 -28.793 -7.628 21.084 1.00 32.05 C ATOM 0 H VAL A 56 -29.547 -5.111 20.952 1.00 35.13 H new ATOM 0 HA VAL A 56 -31.958 -6.366 21.643 1.00 12.21 H new ATOM 0 HB VAL A 56 -30.754 -8.458 21.055 1.00 71.25 H new ATOM 0 HG11 VAL A 56 -30.161 -7.842 18.747 1.00 54.21 H new ATOM 0 HG12 VAL A 56 -31.670 -7.059 19.273 1.00 54.21 H new ATOM 0 HG13 VAL A 56 -30.157 -6.123 19.210 1.00 54.21 H new ATOM 0 HG21 VAL A 56 -28.387 -8.361 20.387 1.00 32.05 H new ATOM 0 HG22 VAL A 56 -28.310 -6.665 20.919 1.00 32.05 H new ATOM 0 HG23 VAL A 56 -28.606 -7.957 22.106 1.00 32.05 H new ATOM 748 N HIS A 57 -29.520 -6.598 23.832 1.00 33.10 N ATOM 749 CA HIS A 57 -29.192 -6.995 25.196 1.00 1.34 C ATOM 750 C HIS A 57 -30.324 -6.640 26.154 1.00 24.33 C ATOM 751 O HIS A 57 -30.809 -7.490 26.901 1.00 74.51 O ATOM 752 CB HIS A 57 -27.895 -6.320 25.648 1.00 72.44 C ATOM 753 CG HIS A 57 -26.679 -7.172 25.456 1.00 45.41 C ATOM 754 ND1 HIS A 57 -26.662 -8.528 25.704 1.00 74.24 N ATOM 755 CD2 HIS A 57 -25.432 -6.853 25.037 1.00 64.30 C ATOM 756 CE1 HIS A 57 -25.458 -9.007 25.447 1.00 22.53 C ATOM 757 NE2 HIS A 57 -24.693 -8.010 25.040 1.00 42.31 N ATOM 0 H HIS A 57 -28.798 -6.047 23.368 1.00 33.10 H new ATOM 0 HA HIS A 57 -29.055 -8.076 25.210 1.00 1.34 H new ATOM 0 HB2 HIS A 57 -27.768 -5.389 25.095 1.00 72.44 H new ATOM 0 HB3 HIS A 57 -27.981 -6.056 26.702 1.00 72.44 H new ATOM 0 HD2 HIS A 57 -25.083 -5.871 24.753 1.00 64.30 H new ATOM 0 HE1 HIS A 57 -25.152 -10.037 25.552 1.00 22.53 H new ATOM 0 HE2 HIS A 57 -23.712 -8.087 24.771 1.00 42.31 H new ATOM 764 N ASP A 58 -30.741 -5.379 26.128 1.00 12.12 N ATOM 765 CA ASP A 58 -31.818 -4.911 26.993 1.00 12.53 C ATOM 766 C ASP A 58 -33.161 -5.476 26.543 1.00 24.22 C ATOM 767 O ASP A 58 -34.149 -5.414 27.276 1.00 3.20 O ATOM 768 CB ASP A 58 -31.868 -3.382 26.999 1.00 35.23 C ATOM 769 CG ASP A 58 -32.764 -2.836 28.094 1.00 54.35 C ATOM 770 OD1 ASP A 58 -33.984 -2.717 27.857 1.00 4.22 O ATOM 771 OD2 ASP A 58 -32.244 -2.528 29.187 1.00 34.30 O ATOM 0 H ASP A 58 -30.349 -4.662 25.517 1.00 12.12 H new ATOM 0 HA ASP A 58 -31.618 -5.264 28.005 1.00 12.53 H new ATOM 0 HB2 ASP A 58 -30.860 -2.989 27.129 1.00 35.23 H new ATOM 0 HB3 ASP A 58 -32.225 -3.029 26.032 1.00 35.23 H new ATOM 775 N SER A 59 -33.192 -6.023 25.332 1.00 13.02 N ATOM 776 CA SER A 59 -34.416 -6.594 24.782 1.00 14.43 C ATOM 777 C SER A 59 -34.562 -8.058 25.185 1.00 5.24 C ATOM 778 O SER A 59 -35.667 -8.596 25.220 1.00 63.44 O ATOM 779 CB SER A 59 -34.420 -6.471 23.257 1.00 21.14 C ATOM 780 OG SER A 59 -35.544 -7.126 22.696 1.00 11.00 O ATOM 0 H SER A 59 -32.384 -6.083 24.713 1.00 13.02 H new ATOM 0 HA SER A 59 -35.261 -6.038 25.187 1.00 14.43 H new ATOM 0 HB2 SER A 59 -34.430 -5.418 22.974 1.00 21.14 H new ATOM 0 HB3 SER A 59 -33.504 -6.902 22.852 1.00 21.14 H new ATOM 0 HG SER A 59 -35.524 -7.032 21.721 1.00 11.00 H new ATOM 785 N ALA A 60 -33.436 -8.696 25.491 1.00 13.43 N ATOM 786 CA ALA A 60 -33.437 -10.097 25.894 1.00 35.44 C ATOM 787 C ALA A 60 -33.591 -10.233 27.405 1.00 12.33 C ATOM 788 O ALA A 60 -33.433 -11.320 27.958 1.00 53.23 O ATOM 789 CB ALA A 60 -32.162 -10.782 25.427 1.00 4.20 C ATOM 0 H ALA A 60 -32.512 -8.265 25.467 1.00 13.43 H new ATOM 0 HA ALA A 60 -34.291 -10.584 25.423 1.00 35.44 H new ATOM 0 HB1 ALA A 60 -32.177 -11.827 25.735 1.00 4.20 H new ATOM 0 HB2 ALA A 60 -32.095 -10.725 24.341 1.00 4.20 H new ATOM 0 HB3 ALA A 60 -31.299 -10.285 25.870 1.00 4.20 H new ATOM 795 N GLU A 61 -33.898 -9.121 28.067 1.00 14.00 N ATOM 796 CA GLU A 61 -34.071 -9.118 29.514 1.00 3.20 C ATOM 797 C GLU A 61 -35.081 -10.177 29.944 1.00 52.15 C ATOM 798 O GLU A 61 -34.889 -10.865 30.947 1.00 22.04 O ATOM 799 CB GLU A 61 -34.527 -7.738 29.993 1.00 20.44 C ATOM 800 CG GLU A 61 -33.461 -6.664 29.860 1.00 21.44 C ATOM 801 CD GLU A 61 -33.998 -5.272 30.130 1.00 61.11 C ATOM 802 OE1 GLU A 61 -35.155 -4.999 29.746 1.00 24.21 O ATOM 803 OE2 GLU A 61 -33.263 -4.456 30.723 1.00 23.11 O ATOM 0 H GLU A 61 -34.032 -8.212 27.624 1.00 14.00 H new ATOM 0 HA GLU A 61 -33.109 -9.353 29.969 1.00 3.20 H new ATOM 0 HB2 GLU A 61 -35.406 -7.437 29.423 1.00 20.44 H new ATOM 0 HB3 GLU A 61 -34.832 -7.808 31.037 1.00 20.44 H new ATOM 0 HG2 GLU A 61 -32.648 -6.877 30.554 1.00 21.44 H new ATOM 0 HG3 GLU A 61 -33.040 -6.698 28.855 1.00 21.44 H new ATOM 808 N LYS A 62 -36.160 -10.303 29.179 1.00 55.31 N ATOM 809 CA LYS A 62 -37.201 -11.278 29.478 1.00 73.01 C ATOM 810 C LYS A 62 -36.675 -12.702 29.324 1.00 2.45 C ATOM 811 O LYS A 62 -36.900 -13.553 30.184 1.00 12.14 O ATOM 812 CB LYS A 62 -38.406 -11.067 28.557 1.00 42.33 C ATOM 813 CG LYS A 62 -39.119 -9.745 28.781 1.00 45.32 C ATOM 814 CD LYS A 62 -39.928 -9.334 27.563 1.00 42.21 C ATOM 815 CE LYS A 62 -41.136 -10.237 27.366 1.00 24.50 C ATOM 816 NZ LYS A 62 -41.398 -10.506 25.925 1.00 11.52 N ATOM 0 H LYS A 62 -36.336 -9.741 28.346 1.00 55.31 H new ATOM 0 HA LYS A 62 -37.511 -11.134 30.513 1.00 73.01 H new ATOM 0 HB2 LYS A 62 -38.074 -11.120 27.520 1.00 42.33 H new ATOM 0 HB3 LYS A 62 -39.114 -11.882 28.707 1.00 42.33 H new ATOM 0 HG2 LYS A 62 -39.778 -9.828 29.645 1.00 45.32 H new ATOM 0 HG3 LYS A 62 -38.387 -8.971 29.011 1.00 45.32 H new ATOM 0 HD2 LYS A 62 -40.259 -8.302 27.676 1.00 42.21 H new ATOM 0 HD3 LYS A 62 -39.296 -9.371 26.676 1.00 42.21 H new ATOM 0 HE2 LYS A 62 -40.973 -11.180 27.888 1.00 24.50 H new ATOM 0 HE3 LYS A 62 -42.014 -9.772 27.814 1.00 24.50 H new ATOM 0 HZ1 LYS A 62 -42.229 -11.125 25.833 1.00 11.52 H new ATOM 0 HZ2 LYS A 62 -41.578 -9.608 25.431 1.00 11.52 H new ATOM 0 HZ3 LYS A 62 -40.570 -10.973 25.503 1.00 11.52 H new ATOM 826 N GLY A 63 -35.971 -12.953 28.224 1.00 23.52 N ATOM 827 CA GLY A 63 -35.422 -14.273 27.980 1.00 40.41 C ATOM 828 C GLY A 63 -34.161 -14.535 28.780 1.00 4.11 C ATOM 829 O GLY A 63 -33.583 -15.618 28.705 1.00 0.54 O ATOM 0 H GLY A 63 -35.771 -12.265 27.498 1.00 23.52 H new ATOM 0 HA2 GLY A 63 -36.170 -15.026 28.230 1.00 40.41 H new ATOM 0 HA3 GLY A 63 -35.203 -14.381 26.918 1.00 40.41 H new ATOM 832 N LYS A 64 -33.732 -13.538 29.548 1.00 35.43 N ATOM 833 CA LYS A 64 -32.532 -13.664 30.365 1.00 61.31 C ATOM 834 C LYS A 64 -32.860 -13.490 31.844 1.00 61.34 C ATOM 835 O LYS A 64 -32.028 -13.028 32.625 1.00 12.15 O ATOM 836 CB LYS A 64 -31.489 -12.628 29.938 1.00 61.12 C ATOM 837 CG LYS A 64 -30.709 -13.027 28.697 1.00 23.43 C ATOM 838 CD LYS A 64 -29.876 -11.871 28.167 1.00 64.30 C ATOM 839 CE LYS A 64 -28.658 -11.615 29.042 1.00 31.12 C ATOM 840 NZ LYS A 64 -28.299 -10.171 29.084 1.00 32.04 N ATOM 0 H LYS A 64 -34.199 -12.634 29.621 1.00 35.43 H new ATOM 0 HA LYS A 64 -32.125 -14.664 30.216 1.00 61.31 H new ATOM 0 HB2 LYS A 64 -31.988 -11.677 29.753 1.00 61.12 H new ATOM 0 HB3 LYS A 64 -30.791 -12.467 30.760 1.00 61.12 H new ATOM 0 HG2 LYS A 64 -30.058 -13.869 28.931 1.00 23.43 H new ATOM 0 HG3 LYS A 64 -31.400 -13.363 27.924 1.00 23.43 H new ATOM 0 HD2 LYS A 64 -29.554 -12.090 27.149 1.00 64.30 H new ATOM 0 HD3 LYS A 64 -30.488 -10.971 28.121 1.00 64.30 H new ATOM 0 HE2 LYS A 64 -28.857 -11.969 30.053 1.00 31.12 H new ATOM 0 HE3 LYS A 64 -27.812 -12.189 28.664 1.00 31.12 H new ATOM 0 HZ1 LYS A 64 -27.464 -10.038 29.690 1.00 32.04 H new ATOM 0 HZ2 LYS A 64 -28.085 -9.838 28.122 1.00 32.04 H new ATOM 0 HZ3 LYS A 64 -29.097 -9.626 29.469 1.00 32.04 H new ATOM 850 N ASP A 65 -34.077 -13.865 32.224 1.00 52.21 N ATOM 851 CA ASP A 65 -34.515 -13.753 33.610 1.00 41.40 C ATOM 852 C ASP A 65 -34.412 -15.097 34.323 1.00 52.25 C ATOM 853 O ASP A 65 -34.961 -15.281 35.408 1.00 24.44 O ATOM 854 CB ASP A 65 -35.952 -13.236 33.674 1.00 34.03 C ATOM 855 CG ASP A 65 -36.247 -12.504 34.968 1.00 72.34 C ATOM 856 OD1 ASP A 65 -35.292 -12.006 35.600 1.00 71.41 O ATOM 857 OD2 ASP A 65 -37.435 -12.429 35.349 1.00 2.34 O ATOM 0 H ASP A 65 -34.778 -14.249 31.591 1.00 52.21 H new ATOM 0 HA ASP A 65 -33.860 -13.043 34.115 1.00 41.40 H new ATOM 0 HB2 ASP A 65 -36.132 -12.567 32.832 1.00 34.03 H new ATOM 0 HB3 ASP A 65 -36.641 -14.074 33.569 1.00 34.03 H new ATOM 861 N ASN A 66 -33.705 -16.038 33.704 1.00 33.23 N ATOM 862 CA ASN A 66 -33.532 -17.367 34.277 1.00 42.44 C ATOM 863 C ASN A 66 -33.033 -17.277 35.717 1.00 70.22 C ATOM 864 O ASN A 66 -33.188 -18.215 36.498 1.00 54.41 O ATOM 865 CB ASN A 66 -32.550 -18.185 33.436 1.00 5.33 C ATOM 866 CG ASN A 66 -31.550 -17.311 32.704 1.00 14.44 C ATOM 867 OD1 ASN A 66 -30.931 -16.386 33.427 1.00 43.42 O flip ATOM 868 ND2 ASN A 66 -31.336 -17.468 31.501 1.00 4.44 N flip ATOM 0 H ASN A 66 -33.243 -15.904 32.805 1.00 33.23 H new ATOM 0 HA ASN A 66 -34.502 -17.865 34.277 1.00 42.44 H new ATOM 0 HB2 ASN A 66 -32.016 -18.882 34.082 1.00 5.33 H new ATOM 0 HB3 ASN A 66 -33.105 -18.782 32.712 1.00 5.33 H new ATOM 0 HD21 ASN A 66 -31.835 -18.192 30.984 1.00 4.44 H new ATOM 0 HD22 ASN A 66 -30.660 -16.874 31.022 1.00 4.44 H new ATOM 874 N ALA A 67 -32.436 -16.141 36.060 1.00 41.25 N ATOM 875 CA ALA A 67 -31.918 -15.927 37.406 1.00 11.31 C ATOM 876 C ALA A 67 -33.031 -16.018 38.444 1.00 73.24 C ATOM 877 O ALA A 67 -32.770 -16.200 39.633 1.00 15.44 O ATOM 878 CB ALA A 67 -31.220 -14.578 37.494 1.00 52.44 C ATOM 0 H ALA A 67 -32.299 -15.355 35.425 1.00 41.25 H new ATOM 0 HA ALA A 67 -31.194 -16.713 37.619 1.00 11.31 H new ATOM 0 HB1 ALA A 67 -30.838 -14.431 38.504 1.00 52.44 H new ATOM 0 HB2 ALA A 67 -30.392 -14.550 36.785 1.00 52.44 H new ATOM 0 HB3 ALA A 67 -31.929 -13.785 37.255 1.00 52.44 H new ATOM 884 N GLU A 68 -34.273 -15.889 37.986 1.00 45.34 N ATOM 885 CA GLU A 68 -35.425 -15.956 38.877 1.00 3.02 C ATOM 886 C GLU A 68 -35.378 -17.216 39.736 1.00 54.42 C ATOM 887 O GLU A 68 -34.560 -18.106 39.506 1.00 71.25 O ATOM 888 CB GLU A 68 -36.725 -15.924 38.070 1.00 13.52 C ATOM 889 CG GLU A 68 -37.920 -15.421 38.860 1.00 42.34 C ATOM 890 CD GLU A 68 -39.087 -15.038 37.972 1.00 30.53 C ATOM 891 OE1 GLU A 68 -38.915 -15.030 36.735 1.00 72.03 O ATOM 892 OE2 GLU A 68 -40.174 -14.743 38.514 1.00 53.53 O ATOM 0 H GLU A 68 -34.506 -15.738 37.005 1.00 45.34 H new ATOM 0 HA GLU A 68 -35.392 -15.088 39.535 1.00 3.02 H new ATOM 0 HB2 GLU A 68 -36.584 -15.288 37.196 1.00 13.52 H new ATOM 0 HB3 GLU A 68 -36.939 -16.928 37.703 1.00 13.52 H new ATOM 0 HG2 GLU A 68 -38.239 -16.193 39.560 1.00 42.34 H new ATOM 0 HG3 GLU A 68 -37.621 -14.557 39.453 1.00 42.34 H new ATOM 897 N GLY A 69 -36.261 -17.284 40.728 1.00 34.25 N ATOM 898 CA GLY A 69 -36.303 -18.437 41.606 1.00 41.04 C ATOM 899 C GLY A 69 -36.346 -19.746 40.842 1.00 64.15 C ATOM 900 O GLY A 69 -35.852 -20.768 41.320 1.00 22.50 O ATOM 0 H GLY A 69 -36.948 -16.560 40.939 1.00 34.25 H new ATOM 0 HA2 GLY A 69 -35.428 -18.427 42.255 1.00 41.04 H new ATOM 0 HA3 GLY A 69 -37.179 -18.367 42.251 1.00 41.04 H new ATOM 903 N GLN A 70 -36.941 -19.716 39.654 1.00 41.15 N ATOM 904 CA GLN A 70 -37.049 -20.911 38.825 1.00 31.33 C ATOM 905 C GLN A 70 -35.680 -21.542 38.597 1.00 1.33 C ATOM 906 O GLN A 70 -34.779 -20.911 38.045 1.00 30.33 O ATOM 907 CB GLN A 70 -37.696 -20.568 37.482 1.00 11.35 C ATOM 908 CG GLN A 70 -39.185 -20.869 37.428 1.00 71.03 C ATOM 909 CD GLN A 70 -40.022 -19.796 38.096 1.00 4.42 C ATOM 910 OE1 GLN A 70 -39.613 -19.206 39.097 1.00 11.35 O ATOM 911 NE2 GLN A 70 -41.201 -19.536 37.546 1.00 31.52 N ATOM 0 H GLN A 70 -37.355 -18.879 39.244 1.00 41.15 H new ATOM 0 HA GLN A 70 -37.677 -21.631 39.350 1.00 31.33 H new ATOM 0 HB2 GLN A 70 -37.540 -19.510 37.273 1.00 11.35 H new ATOM 0 HB3 GLN A 70 -37.192 -21.126 36.693 1.00 11.35 H new ATOM 0 HG2 GLN A 70 -39.494 -20.970 36.388 1.00 71.03 H new ATOM 0 HG3 GLN A 70 -39.376 -21.827 37.912 1.00 71.03 H new ATOM 0 HE21 GLN A 70 -41.501 -20.049 36.717 1.00 31.52 H new ATOM 0 HE22 GLN A 70 -41.807 -18.824 37.952 1.00 31.52 H new ATOM 918 N GLY A 71 -35.530 -22.791 39.027 1.00 55.22 N ATOM 919 CA GLY A 71 -34.267 -23.486 38.861 1.00 13.11 C ATOM 920 C GLY A 71 -34.313 -24.907 39.386 1.00 51.42 C ATOM 921 O GLY A 71 -34.188 -25.862 38.620 1.00 2.53 O ATOM 0 H GLY A 71 -36.261 -23.334 39.487 1.00 55.22 H new ATOM 0 HA2 GLY A 71 -34.000 -23.501 37.804 1.00 13.11 H new ATOM 0 HA3 GLY A 71 -33.482 -22.936 39.380 1.00 13.11 H new ATOM 924 N GLU A 72 -34.492 -25.047 40.696 1.00 73.34 N ATOM 925 CA GLU A 72 -34.553 -26.363 41.322 1.00 32.13 C ATOM 926 C GLU A 72 -35.997 -26.767 41.601 1.00 21.03 C ATOM 927 O GLU A 72 -36.356 -27.940 41.495 1.00 2.03 O ATOM 928 CB GLU A 72 -33.749 -26.369 42.624 1.00 35.22 C ATOM 929 CG GLU A 72 -32.386 -25.710 42.501 1.00 15.41 C ATOM 930 CD GLU A 72 -31.451 -26.471 41.581 1.00 11.33 C ATOM 931 OE1 GLU A 72 -31.203 -27.667 41.843 1.00 3.11 O ATOM 932 OE2 GLU A 72 -30.967 -25.871 40.598 1.00 23.21 O ATOM 0 H GLU A 72 -34.597 -24.266 41.344 1.00 73.34 H new ATOM 0 HA GLU A 72 -34.120 -27.086 40.631 1.00 32.13 H new ATOM 0 HB2 GLU A 72 -34.322 -25.857 43.397 1.00 35.22 H new ATOM 0 HB3 GLU A 72 -33.617 -27.399 42.955 1.00 35.22 H new ATOM 0 HG2 GLU A 72 -32.510 -24.694 42.127 1.00 15.41 H new ATOM 0 HG3 GLU A 72 -31.933 -25.633 43.490 1.00 15.41 H new ATOM 937 N SER A 73 -36.821 -25.787 41.957 1.00 61.10 N ATOM 938 CA SER A 73 -38.226 -26.041 42.256 1.00 21.33 C ATOM 939 C SER A 73 -38.847 -24.857 42.992 1.00 44.21 C ATOM 940 O SER A 73 -38.238 -24.286 43.899 1.00 62.43 O ATOM 941 CB SER A 73 -38.370 -27.311 43.095 1.00 45.54 C ATOM 942 OG SER A 73 -37.267 -27.471 43.971 1.00 0.22 O ATOM 0 H SER A 73 -36.541 -24.810 42.045 1.00 61.10 H new ATOM 0 HA SER A 73 -38.754 -26.177 41.312 1.00 21.33 H new ATOM 0 HB2 SER A 73 -39.294 -27.267 43.672 1.00 45.54 H new ATOM 0 HB3 SER A 73 -38.446 -28.178 42.438 1.00 45.54 H new ATOM 0 HG SER A 73 -37.383 -28.289 44.497 1.00 0.22 H new ATOM 947 N LEU A 74 -40.062 -24.494 42.598 1.00 53.40 N ATOM 948 CA LEU A 74 -40.768 -23.379 43.220 1.00 10.31 C ATOM 949 C LEU A 74 -41.203 -23.733 44.638 1.00 3.13 C ATOM 950 O LEU A 74 -41.603 -22.862 45.411 1.00 33.12 O ATOM 951 CB LEU A 74 -41.986 -22.990 42.381 1.00 23.40 C ATOM 952 CG LEU A 74 -41.725 -22.725 40.898 1.00 43.52 C ATOM 953 CD1 LEU A 74 -43.034 -22.647 40.130 1.00 62.11 C ATOM 954 CD2 LEU A 74 -40.923 -21.444 40.719 1.00 1.54 C ATOM 0 H LEU A 74 -40.580 -24.956 41.850 1.00 53.40 H new ATOM 0 HA LEU A 74 -40.085 -22.531 43.271 1.00 10.31 H new ATOM 0 HB2 LEU A 74 -42.727 -23.786 42.462 1.00 23.40 H new ATOM 0 HB3 LEU A 74 -42.431 -22.095 42.816 1.00 23.40 H new ATOM 0 HG LEU A 74 -41.143 -23.555 40.498 1.00 43.52 H new ATOM 0 HD11 LEU A 74 -42.827 -22.458 39.077 1.00 62.11 H new ATOM 0 HD12 LEU A 74 -43.572 -23.590 40.231 1.00 62.11 H new ATOM 0 HD13 LEU A 74 -43.643 -21.837 40.531 1.00 62.11 H new ATOM 0 HD21 LEU A 74 -40.746 -21.271 39.657 1.00 1.54 H new ATOM 0 HD22 LEU A 74 -41.480 -20.605 41.136 1.00 1.54 H new ATOM 0 HD23 LEU A 74 -39.968 -21.538 41.235 1.00 1.54 H new ATOM 965 N ALA A 75 -41.122 -25.016 44.974 1.00 11.01 N ATOM 966 CA ALA A 75 -41.503 -25.485 46.300 1.00 22.41 C ATOM 967 C ALA A 75 -40.371 -25.281 47.301 1.00 30.24 C ATOM 968 O ALA A 75 -40.612 -25.024 48.481 1.00 25.33 O ATOM 969 CB ALA A 75 -41.905 -26.951 46.246 1.00 61.22 C ATOM 0 H ALA A 75 -40.796 -25.750 44.345 1.00 11.01 H new ATOM 0 HA ALA A 75 -42.358 -24.897 46.634 1.00 22.41 H new ATOM 0 HB1 ALA A 75 -42.187 -27.288 47.244 1.00 61.22 H new ATOM 0 HB2 ALA A 75 -42.751 -27.072 45.569 1.00 61.22 H new ATOM 0 HB3 ALA A 75 -41.065 -27.546 45.886 1.00 61.22 H new ATOM 975 N ASP A 76 -39.137 -25.398 46.823 1.00 24.30 N ATOM 976 CA ASP A 76 -37.967 -25.226 47.677 1.00 65.15 C ATOM 977 C ASP A 76 -37.968 -23.846 48.329 1.00 33.23 C ATOM 978 O ASP A 76 -37.630 -23.704 49.503 1.00 72.45 O ATOM 979 CB ASP A 76 -36.685 -25.420 46.866 1.00 2.00 C ATOM 980 CG ASP A 76 -35.503 -25.801 47.736 1.00 3.34 C ATOM 981 OD1 ASP A 76 -35.554 -25.538 48.956 1.00 24.25 O ATOM 982 OD2 ASP A 76 -34.528 -26.363 47.197 1.00 14.43 O ATOM 0 H ASP A 76 -38.921 -25.611 45.849 1.00 24.30 H new ATOM 0 HA ASP A 76 -38.008 -25.979 48.464 1.00 65.15 H new ATOM 0 HB2 ASP A 76 -36.846 -26.195 46.117 1.00 2.00 H new ATOM 0 HB3 ASP A 76 -36.456 -24.500 46.329 1.00 2.00 H new ATOM 986 N GLN A 77 -38.348 -22.833 47.557 1.00 15.31 N ATOM 987 CA GLN A 77 -38.390 -21.465 48.058 1.00 52.23 C ATOM 988 C GLN A 77 -39.689 -21.202 48.814 1.00 52.22 C ATOM 989 O GLN A 77 -39.690 -20.556 49.860 1.00 44.11 O ATOM 990 CB GLN A 77 -38.248 -20.471 46.904 1.00 4.32 C ATOM 991 CG GLN A 77 -37.365 -20.975 45.774 1.00 21.11 C ATOM 992 CD GLN A 77 -36.550 -19.868 45.132 1.00 64.42 C ATOM 993 OE1 GLN A 77 -37.023 -18.740 44.985 1.00 15.15 O ATOM 994 NE2 GLN A 77 -35.320 -20.186 44.747 1.00 21.42 N ATOM 0 H GLN A 77 -38.631 -22.934 46.582 1.00 15.31 H new ATOM 0 HA GLN A 77 -37.556 -21.332 48.747 1.00 52.23 H new ATOM 0 HB2 GLN A 77 -39.237 -20.243 46.507 1.00 4.32 H new ATOM 0 HB3 GLN A 77 -37.836 -19.538 47.288 1.00 4.32 H new ATOM 0 HG2 GLN A 77 -36.691 -21.741 46.158 1.00 21.11 H new ATOM 0 HG3 GLN A 77 -37.988 -21.449 45.015 1.00 21.11 H new ATOM 0 HE21 GLN A 77 -34.970 -21.134 44.889 1.00 21.42 H new ATOM 0 HE22 GLN A 77 -34.725 -19.483 44.309 1.00 21.42 H new ATOM 1001 N ALA A 78 -40.794 -21.707 48.274 1.00 2.32 N ATOM 1002 CA ALA A 78 -42.099 -21.529 48.899 1.00 12.14 C ATOM 1003 C ALA A 78 -42.015 -21.711 50.410 1.00 11.13 C ATOM 1004 O ALA A 78 -42.749 -21.071 51.164 1.00 11.34 O ATOM 1005 CB ALA A 78 -43.107 -22.501 48.303 1.00 41.40 C ATOM 0 H ALA A 78 -40.811 -22.242 47.406 1.00 2.32 H new ATOM 0 HA ALA A 78 -42.432 -20.510 48.701 1.00 12.14 H new ATOM 0 HB1 ALA A 78 -44.077 -22.357 48.779 1.00 41.40 H new ATOM 0 HB2 ALA A 78 -43.198 -22.320 47.232 1.00 41.40 H new ATOM 0 HB3 ALA A 78 -42.769 -23.524 48.470 1.00 41.40 H new ATOM 1011 N ARG A 79 -41.116 -22.587 50.847 1.00 14.53 N ATOM 1012 CA ARG A 79 -40.937 -22.854 52.268 1.00 61.52 C ATOM 1013 C ARG A 79 -40.148 -21.732 52.938 1.00 11.30 C ATOM 1014 O ARG A 79 -40.654 -21.051 53.829 1.00 24.01 O ATOM 1015 CB ARG A 79 -40.219 -24.190 52.472 1.00 21.24 C ATOM 1016 CG ARG A 79 -40.927 -25.368 51.824 1.00 60.22 C ATOM 1017 CD ARG A 79 -40.170 -26.667 52.051 1.00 42.11 C ATOM 1018 NE ARG A 79 -40.644 -27.377 53.236 1.00 11.41 N ATOM 1019 CZ ARG A 79 -40.192 -28.569 53.607 1.00 60.31 C ATOM 1020 NH1 ARG A 79 -39.261 -29.182 52.890 1.00 10.23 N ATOM 1021 NH2 ARG A 79 -40.673 -29.152 54.699 1.00 23.03 N ATOM 0 H ARG A 79 -40.500 -23.124 50.236 1.00 14.53 H new ATOM 0 HA ARG A 79 -41.923 -22.906 52.729 1.00 61.52 H new ATOM 0 HB2 ARG A 79 -39.210 -24.116 52.067 1.00 21.24 H new ATOM 0 HB3 ARG A 79 -40.120 -24.380 53.541 1.00 21.24 H new ATOM 0 HG2 ARG A 79 -41.934 -25.457 52.231 1.00 60.22 H new ATOM 0 HG3 ARG A 79 -41.030 -25.188 50.754 1.00 60.22 H new ATOM 0 HD2 ARG A 79 -40.280 -27.308 51.176 1.00 42.11 H new ATOM 0 HD3 ARG A 79 -39.107 -26.453 52.158 1.00 42.11 H new ATOM 0 HE ARG A 79 -41.361 -26.933 53.810 1.00 11.41 H new ATOM 0 HH11 ARG A 79 -38.889 -28.738 52.050 1.00 10.23 H new ATOM 0 HH12 ARG A 79 -38.916 -30.098 53.178 1.00 10.23 H new ATOM 0 HH21 ARG A 79 -41.390 -28.684 55.253 1.00 23.03 H new ATOM 0 HH22 ARG A 79 -40.325 -30.068 54.983 1.00 23.03 H new ATOM 1032 N ASP A 80 -38.907 -21.548 52.503 1.00 13.24 N ATOM 1033 CA ASP A 80 -38.047 -20.509 53.058 1.00 71.05 C ATOM 1034 C ASP A 80 -38.476 -19.130 52.567 1.00 12.23 C ATOM 1035 O ASP A 80 -38.678 -18.212 53.362 1.00 32.34 O ATOM 1036 CB ASP A 80 -36.588 -20.769 52.681 1.00 71.21 C ATOM 1037 CG ASP A 80 -35.620 -20.259 53.730 1.00 43.15 C ATOM 1038 OD1 ASP A 80 -35.305 -21.022 54.668 1.00 30.51 O ATOM 1039 OD2 ASP A 80 -35.178 -19.097 53.615 1.00 2.40 O ATOM 0 H ASP A 80 -38.473 -22.105 51.767 1.00 13.24 H new ATOM 0 HA ASP A 80 -38.142 -20.534 54.144 1.00 71.05 H new ATOM 0 HB2 ASP A 80 -36.437 -21.839 52.541 1.00 71.21 H new ATOM 0 HB3 ASP A 80 -36.371 -20.289 51.727 1.00 71.21 H new ATOM 1043 N TYR A 81 -38.609 -18.991 51.253 1.00 72.31 N ATOM 1044 CA TYR A 81 -39.009 -17.723 50.655 1.00 21.14 C ATOM 1045 C TYR A 81 -40.154 -17.088 51.438 1.00 31.12 C ATOM 1046 O TYR A 81 -40.024 -15.982 51.962 1.00 31.31 O ATOM 1047 CB TYR A 81 -39.426 -17.930 49.198 1.00 54.14 C ATOM 1048 CG TYR A 81 -39.283 -16.692 48.344 1.00 2.21 C ATOM 1049 CD1 TYR A 81 -38.128 -15.919 48.394 1.00 51.03 C ATOM 1050 CD2 TYR A 81 -40.301 -16.291 47.487 1.00 74.03 C ATOM 1051 CE1 TYR A 81 -37.993 -14.786 47.617 1.00 52.42 C ATOM 1052 CE2 TYR A 81 -40.173 -15.161 46.704 1.00 63.33 C ATOM 1053 CZ TYR A 81 -39.017 -14.411 46.773 1.00 2.14 C ATOM 1054 OH TYR A 81 -38.886 -13.283 45.996 1.00 63.33 O ATOM 0 H TYR A 81 -38.446 -19.741 50.581 1.00 72.31 H new ATOM 0 HA TYR A 81 -38.153 -17.050 50.688 1.00 21.14 H new ATOM 0 HB2 TYR A 81 -38.824 -18.730 48.767 1.00 54.14 H new ATOM 0 HB3 TYR A 81 -40.464 -18.262 49.170 1.00 54.14 H new ATOM 0 HD1 TYR A 81 -37.323 -16.210 49.052 1.00 51.03 H new ATOM 0 HD2 TYR A 81 -41.209 -16.874 47.433 1.00 74.03 H new ATOM 0 HE1 TYR A 81 -37.090 -14.196 47.670 1.00 52.42 H new ATOM 0 HE2 TYR A 81 -40.973 -14.866 46.041 1.00 63.33 H new ATOM 0 HH TYR A 81 -39.696 -13.161 45.458 1.00 63.33 H new ATOM 1063 N MET A 82 -41.275 -17.798 51.514 1.00 42.11 N ATOM 1064 CA MET A 82 -42.443 -17.306 52.235 1.00 42.42 C ATOM 1065 C MET A 82 -42.068 -16.880 53.651 1.00 65.31 C ATOM 1066 O MET A 82 -42.639 -15.937 54.197 1.00 3.34 O ATOM 1067 CB MET A 82 -43.529 -18.382 52.285 1.00 52.22 C ATOM 1068 CG MET A 82 -43.331 -19.394 53.402 1.00 42.52 C ATOM 1069 SD MET A 82 -44.187 -18.932 54.919 1.00 25.33 S ATOM 1070 CE MET A 82 -45.080 -20.442 55.279 1.00 33.11 C ATOM 0 H MET A 82 -41.399 -18.715 51.085 1.00 42.11 H new ATOM 0 HA MET A 82 -42.828 -16.436 51.702 1.00 42.42 H new ATOM 0 HB2 MET A 82 -44.500 -17.902 52.409 1.00 52.22 H new ATOM 0 HB3 MET A 82 -43.553 -18.907 51.330 1.00 52.22 H new ATOM 0 HG2 MET A 82 -43.688 -20.369 53.071 1.00 42.52 H new ATOM 0 HG3 MET A 82 -42.266 -19.498 53.608 1.00 42.52 H new ATOM 0 HE1 MET A 82 -45.659 -20.313 56.193 1.00 33.11 H new ATOM 0 HE2 MET A 82 -45.752 -20.673 54.453 1.00 33.11 H new ATOM 0 HE3 MET A 82 -44.372 -21.261 55.411 1.00 33.11 H new ATOM 1078 N GLY A 83 -41.105 -17.582 54.241 1.00 23.03 N ATOM 1079 CA GLY A 83 -40.672 -17.261 55.588 1.00 4.13 C ATOM 1080 C GLY A 83 -39.949 -15.930 55.663 1.00 71.00 C ATOM 1081 O GLY A 83 -39.882 -15.310 56.724 1.00 72.55 O ATOM 0 H GLY A 83 -40.617 -18.367 53.810 1.00 23.03 H new ATOM 0 HA2 GLY A 83 -41.538 -17.238 56.249 1.00 4.13 H new ATOM 0 HA3 GLY A 83 -40.014 -18.050 55.952 1.00 4.13 H new ATOM 1084 N ALA A 84 -39.405 -15.489 54.534 1.00 15.11 N ATOM 1085 CA ALA A 84 -38.683 -14.224 54.476 1.00 72.40 C ATOM 1086 C ALA A 84 -39.591 -13.098 53.993 1.00 21.51 C ATOM 1087 O ALA A 84 -39.495 -11.964 54.466 1.00 54.21 O ATOM 1088 CB ALA A 84 -37.468 -14.350 53.570 1.00 14.13 C ATOM 0 H ALA A 84 -39.451 -15.989 53.646 1.00 15.11 H new ATOM 0 HA ALA A 84 -38.346 -13.979 55.483 1.00 72.40 H new ATOM 0 HB1 ALA A 84 -36.939 -13.398 53.536 1.00 14.13 H new ATOM 0 HB2 ALA A 84 -36.803 -15.121 53.958 1.00 14.13 H new ATOM 0 HB3 ALA A 84 -37.790 -14.622 52.565 1.00 14.13 H new ATOM 1094 N ALA A 85 -40.470 -13.415 53.049 1.00 73.22 N ATOM 1095 CA ALA A 85 -41.396 -12.430 52.503 1.00 65.32 C ATOM 1096 C ALA A 85 -42.736 -12.474 53.230 1.00 74.12 C ATOM 1097 O ALA A 85 -43.022 -11.630 54.079 1.00 40.04 O ATOM 1098 CB ALA A 85 -41.593 -12.659 51.013 1.00 74.55 C ATOM 0 H ALA A 85 -40.561 -14.347 52.646 1.00 73.22 H new ATOM 0 HA ALA A 85 -40.964 -11.440 52.652 1.00 65.32 H new ATOM 0 HB1 ALA A 85 -42.287 -11.916 50.619 1.00 74.55 H new ATOM 0 HB2 ALA A 85 -40.635 -12.568 50.501 1.00 74.55 H new ATOM 0 HB3 ALA A 85 -41.999 -13.657 50.849 1.00 74.55 H new ATOM 1104 N LYS A 86 -43.555 -13.463 52.889 1.00 44.12 N ATOM 1105 CA LYS A 86 -44.866 -13.619 53.509 1.00 30.33 C ATOM 1106 C LYS A 86 -44.780 -13.427 55.020 1.00 41.20 C ATOM 1107 O LYS A 86 -45.719 -12.938 55.647 1.00 62.15 O ATOM 1108 CB LYS A 86 -45.442 -15.001 53.192 1.00 1.21 C ATOM 1109 CG LYS A 86 -46.888 -15.172 53.625 1.00 32.51 C ATOM 1110 CD LYS A 86 -46.996 -16.000 54.893 1.00 22.13 C ATOM 1111 CE LYS A 86 -48.383 -16.605 55.047 1.00 64.41 C ATOM 1112 NZ LYS A 86 -48.378 -17.776 55.968 1.00 24.40 N ATOM 0 H LYS A 86 -43.334 -14.169 52.187 1.00 44.12 H new ATOM 0 HA LYS A 86 -45.526 -12.854 53.100 1.00 30.33 H new ATOM 0 HB2 LYS A 86 -45.370 -15.178 52.119 1.00 1.21 H new ATOM 0 HB3 LYS A 86 -44.833 -15.760 53.682 1.00 1.21 H new ATOM 0 HG2 LYS A 86 -47.338 -14.193 53.789 1.00 32.51 H new ATOM 0 HG3 LYS A 86 -47.453 -15.652 52.826 1.00 32.51 H new ATOM 0 HD2 LYS A 86 -46.251 -16.795 54.874 1.00 22.13 H new ATOM 0 HD3 LYS A 86 -46.773 -15.375 55.757 1.00 22.13 H new ATOM 0 HE2 LYS A 86 -49.070 -15.848 55.426 1.00 64.41 H new ATOM 0 HE3 LYS A 86 -48.756 -16.913 54.070 1.00 64.41 H new ATOM 0 HZ1 LYS A 86 -49.341 -18.160 56.047 1.00 24.40 H new ATOM 0 HZ2 LYS A 86 -47.742 -18.509 55.594 1.00 24.40 H new ATOM 0 HZ3 LYS A 86 -48.047 -17.477 56.908 1.00 24.40 H new ATOM 1122 N SER A 87 -43.648 -13.815 55.598 1.00 71.11 N ATOM 1123 CA SER A 87 -43.440 -13.688 57.035 1.00 23.10 C ATOM 1124 C SER A 87 -43.037 -12.263 57.403 1.00 12.25 C ATOM 1125 O SER A 87 -43.817 -11.517 57.995 1.00 4.52 O ATOM 1126 CB SER A 87 -42.367 -14.671 57.506 1.00 64.45 C ATOM 1127 OG SER A 87 -42.768 -15.333 58.693 1.00 42.10 O ATOM 0 H SER A 87 -42.860 -14.220 55.092 1.00 71.11 H new ATOM 0 HA SER A 87 -44.380 -13.921 57.534 1.00 23.10 H new ATOM 0 HB2 SER A 87 -42.173 -15.405 56.724 1.00 64.45 H new ATOM 0 HB3 SER A 87 -41.433 -14.138 57.681 1.00 64.45 H new ATOM 0 HG SER A 87 -42.066 -15.957 58.973 1.00 42.10 H new ATOM 1132 N LYS A 88 -41.812 -11.891 57.045 1.00 3.41 N ATOM 1133 CA LYS A 88 -41.302 -10.556 57.334 1.00 70.42 C ATOM 1134 C LYS A 88 -42.152 -9.490 56.650 1.00 0.15 C ATOM 1135 O LYS A 88 -42.753 -8.642 57.311 1.00 52.12 O ATOM 1136 CB LYS A 88 -39.846 -10.434 56.878 1.00 74.41 C ATOM 1137 CG LYS A 88 -38.922 -9.866 57.941 1.00 13.11 C ATOM 1138 CD LYS A 88 -38.773 -10.816 59.116 1.00 51.35 C ATOM 1139 CE LYS A 88 -38.540 -10.063 60.417 1.00 14.41 C ATOM 1140 NZ LYS A 88 -37.826 -10.899 61.422 1.00 34.42 N ATOM 0 H LYS A 88 -41.154 -12.496 56.554 1.00 3.41 H new ATOM 0 HA LYS A 88 -41.352 -10.400 58.412 1.00 70.42 H new ATOM 0 HB2 LYS A 88 -39.483 -11.418 56.581 1.00 74.41 H new ATOM 0 HB3 LYS A 88 -39.803 -9.798 55.994 1.00 74.41 H new ATOM 0 HG2 LYS A 88 -37.943 -9.669 57.505 1.00 13.11 H new ATOM 0 HG3 LYS A 88 -39.313 -8.911 58.292 1.00 13.11 H new ATOM 0 HD2 LYS A 88 -39.670 -11.429 59.205 1.00 51.35 H new ATOM 0 HD3 LYS A 88 -37.940 -11.494 58.933 1.00 51.35 H new ATOM 0 HE2 LYS A 88 -37.960 -9.162 60.216 1.00 14.41 H new ATOM 0 HE3 LYS A 88 -39.497 -9.741 60.827 1.00 14.41 H new ATOM 0 HZ1 LYS A 88 -37.686 -10.350 62.294 1.00 34.42 H new ATOM 0 HZ2 LYS A 88 -38.391 -11.746 61.633 1.00 34.42 H new ATOM 0 HZ3 LYS A 88 -36.901 -11.185 61.042 1.00 34.42 H new ATOM 1150 N LEU A 89 -42.197 -9.538 55.323 1.00 31.42 N ATOM 1151 CA LEU A 89 -42.975 -8.577 54.549 1.00 22.40 C ATOM 1152 C LEU A 89 -44.338 -8.337 55.190 1.00 62.34 C ATOM 1153 O LEU A 89 -44.722 -7.197 55.447 1.00 64.42 O ATOM 1154 CB LEU A 89 -43.154 -9.074 53.114 1.00 21.43 C ATOM 1155 CG LEU A 89 -43.699 -8.053 52.113 1.00 2.10 C ATOM 1156 CD1 LEU A 89 -43.113 -8.296 50.731 1.00 32.15 C ATOM 1157 CD2 LEU A 89 -45.219 -8.109 52.068 1.00 23.24 C ATOM 0 H LEU A 89 -41.704 -10.232 54.761 1.00 31.42 H new ATOM 0 HA LEU A 89 -42.430 -7.633 54.535 1.00 22.40 H new ATOM 0 HB2 LEU A 89 -42.190 -9.430 52.751 1.00 21.43 H new ATOM 0 HB3 LEU A 89 -43.826 -9.932 53.129 1.00 21.43 H new ATOM 0 HG LEU A 89 -43.402 -7.057 52.441 1.00 2.10 H new ATOM 0 HD11 LEU A 89 -43.512 -7.561 50.032 1.00 32.15 H new ATOM 0 HD12 LEU A 89 -42.028 -8.204 50.775 1.00 32.15 H new ATOM 0 HD13 LEU A 89 -43.379 -9.298 50.394 1.00 32.15 H new ATOM 0 HD21 LEU A 89 -45.589 -7.376 51.351 1.00 23.24 H new ATOM 0 HD22 LEU A 89 -45.538 -9.106 51.765 1.00 23.24 H new ATOM 0 HD23 LEU A 89 -45.621 -7.885 53.056 1.00 23.24 H new ATOM 1168 N ASN A 90 -45.064 -9.420 55.448 1.00 14.13 N ATOM 1169 CA ASN A 90 -46.384 -9.327 56.060 1.00 41.04 C ATOM 1170 C ASN A 90 -46.277 -8.906 57.523 1.00 31.44 C ATOM 1171 O ASN A 90 -46.752 -7.837 57.908 1.00 1.43 O ATOM 1172 CB ASN A 90 -47.112 -10.669 55.957 1.00 65.13 C ATOM 1173 CG ASN A 90 -48.619 -10.506 55.882 1.00 1.34 C ATOM 1174 OD1 ASN A 90 -49.152 -10.025 54.882 1.00 71.11 O ATOM 1175 ND2 ASN A 90 -49.311 -10.905 56.942 1.00 53.11 N ATOM 0 H ASN A 90 -44.760 -10.372 55.243 1.00 14.13 H new ATOM 0 HA ASN A 90 -46.954 -8.569 55.522 1.00 41.04 H new ATOM 0 HB2 ASN A 90 -46.763 -11.202 55.073 1.00 65.13 H new ATOM 0 HB3 ASN A 90 -46.858 -11.284 56.821 1.00 65.13 H new ATOM 0 HD21 ASN A 90 -50.327 -10.819 56.950 1.00 53.11 H new ATOM 0 HD22 ASN A 90 -48.826 -11.298 57.749 1.00 53.11 H new ATOM 1181 N ASP A 91 -45.648 -9.751 58.333 1.00 75.44 N ATOM 1182 CA ASP A 91 -45.477 -9.466 59.752 1.00 53.20 C ATOM 1183 C ASP A 91 -44.823 -8.102 59.957 1.00 40.54 C ATOM 1184 O ASP A 91 -44.884 -7.532 61.045 1.00 5.31 O ATOM 1185 CB ASP A 91 -44.632 -10.556 60.414 1.00 24.21 C ATOM 1186 CG ASP A 91 -45.259 -11.930 60.288 1.00 51.13 C ATOM 1187 OD1 ASP A 91 -46.473 -12.005 60.009 1.00 31.12 O ATOM 1188 OD2 ASP A 91 -44.534 -12.931 60.470 1.00 62.15 O ATOM 0 H ASP A 91 -45.248 -10.639 58.030 1.00 75.44 H new ATOM 0 HA ASP A 91 -46.463 -9.449 60.216 1.00 53.20 H new ATOM 0 HB2 ASP A 91 -43.641 -10.569 59.961 1.00 24.21 H new ATOM 0 HB3 ASP A 91 -44.497 -10.317 61.469 1.00 24.21 H new ATOM 1192 N ALA A 92 -44.197 -7.588 58.904 1.00 64.21 N ATOM 1193 CA ALA A 92 -43.533 -6.292 58.968 1.00 43.34 C ATOM 1194 C ALA A 92 -44.414 -5.194 58.383 1.00 2.10 C ATOM 1195 O ALA A 92 -44.373 -4.048 58.830 1.00 24.21 O ATOM 1196 CB ALA A 92 -42.199 -6.347 58.238 1.00 20.43 C ATOM 0 H ALA A 92 -44.136 -8.049 57.996 1.00 64.21 H new ATOM 0 HA ALA A 92 -43.352 -6.055 60.016 1.00 43.34 H new ATOM 0 HB1 ALA A 92 -41.713 -5.373 58.293 1.00 20.43 H new ATOM 0 HB2 ALA A 92 -41.560 -7.098 58.703 1.00 20.43 H new ATOM 0 HB3 ALA A 92 -42.366 -6.610 57.194 1.00 20.43 H new ATOM 1202 N VAL A 93 -45.210 -5.552 57.381 1.00 34.53 N ATOM 1203 CA VAL A 93 -46.102 -4.596 56.734 1.00 23.03 C ATOM 1204 C VAL A 93 -47.550 -4.829 57.148 1.00 45.04 C ATOM 1205 O VAL A 93 -48.267 -3.889 57.489 1.00 53.32 O ATOM 1206 CB VAL A 93 -45.999 -4.681 55.200 1.00 4.34 C ATOM 1207 CG1 VAL A 93 -47.011 -5.674 54.650 1.00 31.42 C ATOM 1208 CG2 VAL A 93 -46.193 -3.307 54.577 1.00 33.51 C ATOM 0 H VAL A 93 -45.256 -6.497 56.999 1.00 34.53 H new ATOM 0 HA VAL A 93 -45.789 -3.603 57.057 1.00 23.03 H new ATOM 0 HB VAL A 93 -45.002 -5.035 54.939 1.00 4.34 H new ATOM 0 HG11 VAL A 93 -46.923 -5.720 53.565 1.00 31.42 H new ATOM 0 HG12 VAL A 93 -46.819 -6.661 55.072 1.00 31.42 H new ATOM 0 HG13 VAL A 93 -48.018 -5.354 54.919 1.00 31.42 H new ATOM 0 HG21 VAL A 93 -46.117 -3.385 53.492 1.00 33.51 H new ATOM 0 HG22 VAL A 93 -47.177 -2.922 54.845 1.00 33.51 H new ATOM 0 HG23 VAL A 93 -45.424 -2.628 54.946 1.00 33.51 H new ATOM 1218 N GLU A 94 -47.974 -6.089 57.118 1.00 15.23 N ATOM 1219 CA GLU A 94 -49.337 -6.445 57.490 1.00 32.21 C ATOM 1220 C GLU A 94 -49.551 -6.285 58.992 1.00 65.32 C ATOM 1221 O GLU A 94 -50.608 -5.837 59.436 1.00 24.44 O ATOM 1222 CB GLU A 94 -49.644 -7.885 57.071 1.00 21.50 C ATOM 1223 CG GLU A 94 -51.089 -8.101 56.652 1.00 42.30 C ATOM 1224 CD GLU A 94 -51.249 -8.215 55.149 1.00 33.11 C ATOM 1225 OE1 GLU A 94 -50.698 -7.358 54.427 1.00 3.15 O ATOM 1226 OE2 GLU A 94 -51.927 -9.160 54.693 1.00 44.32 O ATOM 0 H GLU A 94 -47.393 -6.880 56.840 1.00 15.23 H new ATOM 0 HA GLU A 94 -50.016 -5.770 56.970 1.00 32.21 H new ATOM 0 HB2 GLU A 94 -48.989 -8.162 56.244 1.00 21.50 H new ATOM 0 HB3 GLU A 94 -49.411 -8.553 57.900 1.00 21.50 H new ATOM 0 HG2 GLU A 94 -51.469 -9.007 57.124 1.00 42.30 H new ATOM 0 HG3 GLU A 94 -51.697 -7.273 57.017 1.00 42.30 H new ATOM 1231 N TYR A 95 -48.540 -6.655 59.770 1.00 51.31 N ATOM 1232 CA TYR A 95 -48.617 -6.556 61.224 1.00 14.34 C ATOM 1233 C TYR A 95 -48.304 -5.137 61.689 1.00 42.12 C ATOM 1234 O TYR A 95 -48.990 -4.589 62.552 1.00 42.35 O ATOM 1235 CB TYR A 95 -47.648 -7.543 61.875 1.00 52.55 C ATOM 1236 CG TYR A 95 -47.323 -7.212 63.314 1.00 43.32 C ATOM 1237 CD1 TYR A 95 -48.188 -7.569 64.341 1.00 24.14 C ATOM 1238 CD2 TYR A 95 -46.151 -6.543 63.646 1.00 55.41 C ATOM 1239 CE1 TYR A 95 -47.895 -7.267 65.658 1.00 23.40 C ATOM 1240 CE2 TYR A 95 -45.850 -6.240 64.960 1.00 32.23 C ATOM 1241 CZ TYR A 95 -46.725 -6.604 65.962 1.00 22.11 C ATOM 1242 OH TYR A 95 -46.429 -6.301 67.272 1.00 74.32 O ATOM 0 H TYR A 95 -47.657 -7.026 59.419 1.00 51.31 H new ATOM 0 HA TYR A 95 -49.634 -6.803 61.527 1.00 14.34 H new ATOM 0 HB2 TYR A 95 -48.077 -8.544 61.829 1.00 52.55 H new ATOM 0 HB3 TYR A 95 -46.723 -7.565 61.298 1.00 52.55 H new ATOM 0 HD1 TYR A 95 -49.104 -8.091 64.107 1.00 24.14 H new ATOM 0 HD2 TYR A 95 -45.464 -6.255 62.864 1.00 55.41 H new ATOM 0 HE1 TYR A 95 -48.579 -7.549 66.445 1.00 23.40 H new ATOM 0 HE2 TYR A 95 -44.934 -5.721 65.201 1.00 32.23 H new ATOM 0 HH TYR A 95 -45.568 -5.834 67.313 1.00 74.32 H new ATOM 1251 N VAL A 96 -47.264 -4.547 61.110 1.00 11.13 N ATOM 1252 CA VAL A 96 -46.860 -3.191 61.464 1.00 31.34 C ATOM 1253 C VAL A 96 -47.666 -2.156 60.686 1.00 53.44 C ATOM 1254 O VAL A 96 -48.453 -1.406 61.262 1.00 4.52 O ATOM 1255 CB VAL A 96 -45.360 -2.964 61.195 1.00 65.22 C ATOM 1256 CG1 VAL A 96 -44.878 -1.701 61.893 1.00 72.02 C ATOM 1257 CG2 VAL A 96 -44.550 -4.172 61.642 1.00 70.04 C ATOM 0 H VAL A 96 -46.686 -4.986 60.394 1.00 11.13 H new ATOM 0 HA VAL A 96 -47.053 -3.072 62.530 1.00 31.34 H new ATOM 0 HB VAL A 96 -45.216 -2.835 60.122 1.00 65.22 H new ATOM 0 HG11 VAL A 96 -43.816 -1.557 61.692 1.00 72.02 H new ATOM 0 HG12 VAL A 96 -45.438 -0.843 61.520 1.00 72.02 H new ATOM 0 HG13 VAL A 96 -45.034 -1.797 62.968 1.00 72.02 H new ATOM 0 HG21 VAL A 96 -43.493 -3.994 61.445 1.00 70.04 H new ATOM 0 HG22 VAL A 96 -44.698 -4.334 62.710 1.00 70.04 H new ATOM 0 HG23 VAL A 96 -44.879 -5.054 61.092 1.00 70.04 H new ATOM 1267 N SER A 97 -47.466 -2.124 59.373 1.00 14.33 N ATOM 1268 CA SER A 97 -48.172 -1.180 58.514 1.00 0.30 C ATOM 1269 C SER A 97 -49.681 -1.365 58.630 1.00 75.23 C ATOM 1270 O SER A 97 -50.456 -0.479 58.274 1.00 63.30 O ATOM 1271 CB SER A 97 -47.734 -1.355 57.059 1.00 70.54 C ATOM 1272 OG SER A 97 -47.470 -0.103 56.451 1.00 2.11 O ATOM 0 H SER A 97 -46.821 -2.741 58.880 1.00 14.33 H new ATOM 0 HA SER A 97 -47.921 -0.171 58.841 1.00 0.30 H new ATOM 0 HB2 SER A 97 -46.841 -1.978 57.017 1.00 70.54 H new ATOM 0 HB3 SER A 97 -48.513 -1.876 56.502 1.00 70.54 H new ATOM 0 HG SER A 97 -47.190 -0.243 55.522 1.00 2.11 H new ATOM 1277 N GLY A 98 -50.092 -2.528 59.128 1.00 64.35 N ATOM 1278 CA GLY A 98 -51.508 -2.810 59.282 1.00 14.43 C ATOM 1279 C GLY A 98 -52.048 -2.356 60.624 1.00 15.02 C ATOM 1280 O GLY A 98 -53.235 -2.059 60.754 1.00 24.42 O ATOM 0 H GLY A 98 -49.470 -3.279 59.427 1.00 64.35 H new ATOM 0 HA2 GLY A 98 -52.062 -2.315 58.485 1.00 14.43 H new ATOM 0 HA3 GLY A 98 -51.676 -3.881 59.170 1.00 14.43 H new ATOM 1283 N ARG A 99 -51.175 -2.303 61.624 1.00 42.13 N ATOM 1284 CA ARG A 99 -51.571 -1.885 62.964 1.00 32.23 C ATOM 1285 C ARG A 99 -51.535 -0.365 63.090 1.00 60.55 C ATOM 1286 O ARG A 99 -52.236 0.216 63.920 1.00 32.33 O ATOM 1287 CB ARG A 99 -50.653 -2.517 64.011 1.00 64.31 C ATOM 1288 CG ARG A 99 -49.252 -1.926 64.028 1.00 50.34 C ATOM 1289 CD ARG A 99 -48.884 -1.409 65.410 1.00 24.02 C ATOM 1290 NE ARG A 99 -47.629 -0.661 65.397 1.00 33.44 N ATOM 1291 CZ ARG A 99 -47.535 0.610 65.020 1.00 3.23 C ATOM 1292 NH1 ARG A 99 -48.615 1.271 64.628 1.00 52.25 N ATOM 1293 NH2 ARG A 99 -46.358 1.222 65.035 1.00 41.43 N ATOM 0 H ARG A 99 -50.188 -2.544 61.532 1.00 42.13 H new ATOM 0 HA ARG A 99 -52.593 -2.223 63.137 1.00 32.23 H new ATOM 0 HB2 ARG A 99 -51.102 -2.395 64.997 1.00 64.31 H new ATOM 0 HB3 ARG A 99 -50.584 -3.588 63.823 1.00 64.31 H new ATOM 0 HG2 ARG A 99 -48.532 -2.684 63.718 1.00 50.34 H new ATOM 0 HG3 ARG A 99 -49.190 -1.112 63.305 1.00 50.34 H new ATOM 0 HD2 ARG A 99 -49.684 -0.769 65.783 1.00 24.02 H new ATOM 0 HD3 ARG A 99 -48.799 -2.248 66.100 1.00 24.02 H new ATOM 0 HE ARG A 99 -46.779 -1.140 65.693 1.00 33.44 H new ATOM 0 HH11 ARG A 99 -49.522 0.804 64.615 1.00 52.25 H new ATOM 0 HH12 ARG A 99 -48.539 2.246 64.339 1.00 52.25 H new ATOM 0 HH21 ARG A 99 -45.524 0.717 65.336 1.00 41.43 H new ATOM 0 HH22 ARG A 99 -46.287 2.197 64.746 1.00 41.43 H new ATOM 1304 N VAL A 100 -50.715 0.274 62.263 1.00 4.35 N ATOM 1305 CA VAL A 100 -50.588 1.727 62.282 1.00 63.25 C ATOM 1306 C VAL A 100 -51.705 2.386 61.483 1.00 22.43 C ATOM 1307 O VAL A 100 -52.166 3.478 61.821 1.00 41.34 O ATOM 1308 CB VAL A 100 -49.229 2.179 61.715 1.00 64.03 C ATOM 1309 CG1 VAL A 100 -49.197 2.008 60.204 1.00 71.43 C ATOM 1310 CG2 VAL A 100 -48.945 3.623 62.103 1.00 53.11 C ATOM 0 H VAL A 100 -50.128 -0.191 61.571 1.00 4.35 H new ATOM 0 HA VAL A 100 -50.659 2.038 63.324 1.00 63.25 H new ATOM 0 HB VAL A 100 -48.448 1.551 62.144 1.00 64.03 H new ATOM 0 HG11 VAL A 100 -48.229 2.332 59.822 1.00 71.43 H new ATOM 0 HG12 VAL A 100 -49.353 0.959 59.953 1.00 71.43 H new ATOM 0 HG13 VAL A 100 -49.986 2.610 59.753 1.00 71.43 H new ATOM 0 HG21 VAL A 100 -47.981 3.927 61.695 1.00 53.11 H new ATOM 0 HG22 VAL A 100 -49.728 4.268 61.704 1.00 53.11 H new ATOM 0 HG23 VAL A 100 -48.922 3.710 63.189 1.00 53.11 H new ATOM 1320 N HIS A 101 -52.138 1.717 60.418 1.00 63.43 N ATOM 1321 CA HIS A 101 -53.204 2.239 59.570 1.00 74.43 C ATOM 1322 C HIS A 101 -54.456 1.372 59.675 1.00 11.34 C ATOM 1323 O HIS A 101 -55.258 1.307 58.745 1.00 10.54 O ATOM 1324 CB HIS A 101 -52.738 2.308 58.115 1.00 64.44 C ATOM 1325 CG HIS A 101 -51.718 3.374 57.863 1.00 21.21 C ATOM 1326 ND1 HIS A 101 -51.826 4.654 58.366 1.00 41.03 N ATOM 1327 CD2 HIS A 101 -50.563 3.346 57.158 1.00 75.11 C ATOM 1328 CE1 HIS A 101 -50.783 5.366 57.980 1.00 72.13 C ATOM 1329 NE2 HIS A 101 -50.001 4.596 57.246 1.00 34.01 N ATOM 0 H HIS A 101 -51.767 0.814 60.122 1.00 63.43 H new ATOM 0 HA HIS A 101 -53.450 3.244 59.914 1.00 74.43 H new ATOM 0 HB2 HIS A 101 -52.320 1.342 57.830 1.00 64.44 H new ATOM 0 HB3 HIS A 101 -53.601 2.484 57.474 1.00 64.44 H new ATOM 0 HD2 HIS A 101 -50.158 2.498 56.625 1.00 75.11 H new ATOM 0 HE1 HIS A 101 -50.601 6.402 58.223 1.00 72.13 H new ATOM 0 HE2 HIS A 101 -49.122 4.883 56.815 1.00 34.01 H new ATOM 1336 N GLY A 102 -54.615 0.706 60.815 1.00 10.00 N ATOM 1337 CA GLY A 102 -55.770 -0.147 61.020 1.00 54.33 C ATOM 1338 C GLY A 102 -56.815 0.495 61.910 1.00 40.14 C ATOM 1339 O GLY A 102 -57.053 0.037 63.027 1.00 44.41 O ATOM 0 H GLY A 102 -53.964 0.742 61.600 1.00 10.00 H new ATOM 0 HA2 GLY A 102 -56.217 -0.386 60.055 1.00 54.33 H new ATOM 0 HA3 GLY A 102 -55.448 -1.089 61.464 1.00 54.33 H new ATOM 1342 N GLU A 103 -57.440 1.558 61.414 1.00 64.05 N ATOM 1343 CA GLU A 103 -58.464 2.264 62.174 1.00 65.41 C ATOM 1344 C GLU A 103 -59.825 1.596 62.007 1.00 21.40 C ATOM 1345 O GLU A 103 -60.311 1.428 60.889 1.00 74.35 O ATOM 1346 CB GLU A 103 -58.543 3.727 61.729 1.00 75.45 C ATOM 1347 CG GLU A 103 -58.877 3.896 60.257 1.00 21.33 C ATOM 1348 CD GLU A 103 -58.136 5.057 59.621 1.00 13.41 C ATOM 1349 OE1 GLU A 103 -57.634 5.921 60.370 1.00 74.51 O ATOM 1350 OE2 GLU A 103 -58.058 5.101 58.375 1.00 70.12 O ATOM 0 H GLU A 103 -57.255 1.949 60.490 1.00 64.05 H new ATOM 0 HA GLU A 103 -58.188 2.226 63.228 1.00 65.41 H new ATOM 0 HB2 GLU A 103 -59.298 4.240 62.326 1.00 75.45 H new ATOM 0 HB3 GLU A 103 -57.589 4.213 61.935 1.00 75.45 H new ATOM 0 HG2 GLU A 103 -58.631 2.977 59.725 1.00 21.33 H new ATOM 0 HG3 GLU A 103 -59.950 4.051 60.147 1.00 21.33 H new ATOM 1355 N GLU A 104 -60.433 1.216 63.127 1.00 73.12 N ATOM 1356 CA GLU A 104 -61.738 0.565 63.103 1.00 53.34 C ATOM 1357 C GLU A 104 -62.856 1.579 63.323 1.00 60.15 C ATOM 1358 O GLU A 104 -64.014 1.209 63.524 1.00 54.42 O ATOM 1359 CB GLU A 104 -61.806 -0.528 64.173 1.00 21.02 C ATOM 1360 CG GLU A 104 -62.844 -1.599 63.884 1.00 43.13 C ATOM 1361 CD GLU A 104 -63.085 -2.513 65.070 1.00 24.42 C ATOM 1362 OE1 GLU A 104 -62.231 -3.387 65.327 1.00 72.21 O ATOM 1363 OE2 GLU A 104 -64.126 -2.353 65.740 1.00 51.05 O ATOM 0 H GLU A 104 -60.044 1.347 64.061 1.00 73.12 H new ATOM 0 HA GLU A 104 -61.872 0.111 62.121 1.00 53.34 H new ATOM 0 HB2 GLU A 104 -60.827 -0.998 64.263 1.00 21.02 H new ATOM 0 HB3 GLU A 104 -62.029 -0.069 65.136 1.00 21.02 H new ATOM 0 HG2 GLU A 104 -63.783 -1.123 63.600 1.00 43.13 H new ATOM 0 HG3 GLU A 104 -62.518 -2.195 63.031 1.00 43.13 H new ATOM 1368 N ASP A 105 -62.503 2.858 63.286 1.00 14.53 N ATOM 1369 CA ASP A 105 -63.476 3.926 63.480 1.00 25.14 C ATOM 1370 C ASP A 105 -64.670 3.752 62.546 1.00 54.53 C ATOM 1371 O ASP A 105 -64.600 3.050 61.536 1.00 60.44 O ATOM 1372 CB ASP A 105 -62.823 5.289 63.245 1.00 35.42 C ATOM 1373 CG ASP A 105 -62.202 5.859 64.504 1.00 45.22 C ATOM 1374 OD1 ASP A 105 -62.961 6.239 65.420 1.00 41.24 O ATOM 1375 OD2 ASP A 105 -60.957 5.927 64.574 1.00 13.14 O ATOM 0 H ASP A 105 -61.549 3.181 63.123 1.00 14.53 H new ATOM 0 HA ASP A 105 -63.833 3.875 64.509 1.00 25.14 H new ATOM 0 HB2 ASP A 105 -62.056 5.193 62.477 1.00 35.42 H new ATOM 0 HB3 ASP A 105 -63.570 5.986 62.865 1.00 35.42 H new ATOM 1379 N PRO A 106 -65.790 4.403 62.889 1.00 50.03 N ATOM 1380 CA PRO A 106 -67.020 4.335 62.094 1.00 62.33 C ATOM 1381 C PRO A 106 -66.890 5.061 60.760 1.00 3.54 C ATOM 1382 O PRO A 106 -67.025 6.283 60.690 1.00 70.53 O ATOM 1383 CB PRO A 106 -68.056 5.030 62.983 1.00 13.25 C ATOM 1384 CG PRO A 106 -67.259 5.947 63.845 1.00 41.14 C ATOM 1385 CD PRO A 106 -65.944 5.257 64.079 1.00 23.33 C ATOM 0 HA PRO A 106 -67.281 3.309 61.834 1.00 62.33 H new ATOM 0 HB2 PRO A 106 -68.784 5.580 62.387 1.00 13.25 H new ATOM 0 HB3 PRO A 106 -68.613 4.308 63.581 1.00 13.25 H new ATOM 0 HG2 PRO A 106 -67.113 6.911 63.358 1.00 41.14 H new ATOM 0 HG3 PRO A 106 -67.771 6.140 64.787 1.00 41.14 H new ATOM 0 HD2 PRO A 106 -65.126 5.972 64.169 1.00 23.33 H new ATOM 0 HD3 PRO A 106 -65.956 4.669 64.997 1.00 23.33 H new ATOM 1390 N THR A 107 -66.625 4.302 59.701 1.00 12.24 N ATOM 1391 CA THR A 107 -66.475 4.873 58.369 1.00 33.24 C ATOM 1392 C THR A 107 -67.773 5.520 57.899 1.00 51.20 C ATOM 1393 O THR A 107 -67.761 6.432 57.072 1.00 2.20 O ATOM 1394 CB THR A 107 -66.046 3.805 57.345 1.00 20.24 C ATOM 1395 OG1 THR A 107 -65.150 2.872 57.956 1.00 40.32 O ATOM 1396 CG2 THR A 107 -65.373 4.449 56.142 1.00 20.31 C ATOM 0 H THR A 107 -66.510 3.289 59.741 1.00 12.24 H new ATOM 0 HA THR A 107 -65.697 5.634 58.437 1.00 33.24 H new ATOM 0 HB THR A 107 -66.939 3.280 57.005 1.00 20.24 H new ATOM 0 HG1 THR A 107 -64.884 2.196 57.299 1.00 40.32 H new ATOM 0 HG21 THR A 107 -65.079 3.676 55.432 1.00 20.31 H new ATOM 0 HG22 THR A 107 -66.068 5.137 55.661 1.00 20.31 H new ATOM 0 HG23 THR A 107 -64.489 4.996 56.469 1.00 20.31 H new ATOM 1404 N LYS A 108 -68.893 5.043 58.431 1.00 73.23 N ATOM 1405 CA LYS A 108 -70.201 5.575 58.068 1.00 74.11 C ATOM 1406 C LYS A 108 -71.259 5.157 59.084 1.00 20.52 C ATOM 1407 O LYS A 108 -71.002 4.332 59.961 1.00 22.43 O ATOM 1408 CB LYS A 108 -70.601 5.093 56.672 1.00 21.15 C ATOM 1409 CG LYS A 108 -70.611 3.581 56.530 1.00 14.14 C ATOM 1410 CD LYS A 108 -71.989 3.005 56.803 1.00 35.30 C ATOM 1411 CE LYS A 108 -72.828 2.941 55.536 1.00 35.23 C ATOM 1412 NZ LYS A 108 -73.772 1.789 55.551 1.00 43.13 N ATOM 0 H LYS A 108 -68.921 4.288 59.116 1.00 73.23 H new ATOM 0 HA LYS A 108 -70.135 6.663 58.065 1.00 74.11 H new ATOM 0 HB2 LYS A 108 -71.592 5.478 56.434 1.00 21.15 H new ATOM 0 HB3 LYS A 108 -69.911 5.514 55.940 1.00 21.15 H new ATOM 0 HG2 LYS A 108 -70.294 3.307 55.524 1.00 14.14 H new ATOM 0 HG3 LYS A 108 -69.890 3.145 57.221 1.00 14.14 H new ATOM 0 HD2 LYS A 108 -71.889 2.005 57.225 1.00 35.30 H new ATOM 0 HD3 LYS A 108 -72.499 3.616 57.548 1.00 35.30 H new ATOM 0 HE2 LYS A 108 -73.389 3.869 55.425 1.00 35.23 H new ATOM 0 HE3 LYS A 108 -72.171 2.861 54.670 1.00 35.23 H new ATOM 0 HZ1 LYS A 108 -74.325 1.782 54.670 1.00 43.13 H new ATOM 0 HZ2 LYS A 108 -73.236 0.902 55.631 1.00 43.13 H new ATOM 0 HZ3 LYS A 108 -74.416 1.878 56.363 1.00 43.13 H new ATOM 1422 N LYS A 109 -72.451 5.731 58.959 1.00 23.32 N ATOM 1423 CA LYS A 109 -73.551 5.417 59.864 1.00 23.13 C ATOM 1424 C LYS A 109 -74.866 5.297 59.101 1.00 2.10 C ATOM 1425 O LYS A 109 -75.147 6.089 58.200 1.00 45.13 O ATOM 1426 CB LYS A 109 -73.673 6.494 60.945 1.00 14.05 C ATOM 1427 CG LYS A 109 -72.831 6.215 62.177 1.00 5.14 C ATOM 1428 CD LYS A 109 -71.462 6.869 62.077 1.00 41.15 C ATOM 1429 CE LYS A 109 -71.528 8.354 62.398 1.00 71.33 C ATOM 1430 NZ LYS A 109 -71.966 8.600 63.800 1.00 22.23 N ATOM 0 H LYS A 109 -72.680 6.417 58.239 1.00 23.32 H new ATOM 0 HA LYS A 109 -73.337 4.459 60.337 1.00 23.13 H new ATOM 0 HB2 LYS A 109 -73.378 7.455 60.524 1.00 14.05 H new ATOM 0 HB3 LYS A 109 -74.718 6.583 61.242 1.00 14.05 H new ATOM 0 HG2 LYS A 109 -73.348 6.584 63.063 1.00 5.14 H new ATOM 0 HG3 LYS A 109 -72.713 5.139 62.302 1.00 5.14 H new ATOM 0 HD2 LYS A 109 -70.772 6.378 62.763 1.00 41.15 H new ATOM 0 HD3 LYS A 109 -71.064 6.730 61.072 1.00 41.15 H new ATOM 0 HE2 LYS A 109 -70.548 8.804 62.240 1.00 71.33 H new ATOM 0 HE3 LYS A 109 -72.218 8.844 61.711 1.00 71.33 H new ATOM 0 HZ1 LYS A 109 -71.624 9.531 64.112 1.00 22.23 H new ATOM 0 HZ2 LYS A 109 -73.005 8.579 63.848 1.00 22.23 H new ATOM 0 HZ3 LYS A 109 -71.575 7.862 64.420 1.00 22.23 H new TER 1440 LYS A 109