USER MOD reduce.3.24.130724 H: found=0, std=0, add=1044, rem=0, adj=25 USER MOD reduce.3.24.130724 removed 0 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 32 SER OG : rot 50:sc= 1.28 USER MOD Set 1.2: B 36 GLN : amide:sc= 0.986 K(o=2.3,f=-1.5) USER MOD Set 2.1: A 43 SER OG : rot 5:sc= 1.21 USER MOD Set 2.2: B 18 LYS NZ :NH3+ -168:sc= 0.69 (180deg=0) USER MOD Set 3.1: B 11 MET CE :methyl -146:sc= -3.81! (180deg=-5.92!) USER MOD Set 3.2: B 30 MET CE :methyl -128:sc= -4.04! (180deg=-9.96!) USER MOD Set 4.1: A 63 SER OG : rot -160:sc= 0.762 USER MOD Set 4.2: B 51 TYR OH : rot -178:sc= 1.07 USER MOD Set 5.1: A 44 LYS NZ :NH3+ -164:sc= -0.342 (180deg=-0.78) USER MOD Set 5.2: A 46 SER OG : rot 180:sc= -0.0212 USER MOD Set 6.1: A 11 MET CE :methyl -124:sc= -2.49 (180deg=-9.33!) USER MOD Set 6.2: A 30 MET CE :methyl -126:sc= -3.78 (180deg=-10.5!) USER MOD Single : A 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 6 HIS : no HD1:sc= 0.245 K(o=0.25,f=-3.2!) USER MOD Single : A 8 ASN : amide:sc= 0.058 X(o=0.058,f=-0.054) USER MOD Single : A 13 MET CE :methyl -158:sc= -0.742 (180deg=-2.23!) USER MOD Single : A 18 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0151) USER MOD Single : A 20 LYS NZ :NH3+ -124:sc= 0 (180deg=-0.373) USER MOD Single : A 26 ASN : amide:sc= -7.66! C(o=-7.7!,f=-8!) USER MOD Single : A 29 SER OG : rot 180:sc= 0 USER MOD Single : A 31 ASN : amide:sc= 0.177 K(o=0.18,f=-5.1!) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 36 GLN : amide:sc= -0.812 K(o=-0.81,f=-2.6!) USER MOD Single : A 39 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 49 THR OG1 : rot 180:sc= 0 USER MOD Single : A 51 TYR OH : rot 180:sc= -0.0388 USER MOD Single : A 53 ASN : amide:sc= -1.34 K(o=-1.3,f=-8.2!) USER MOD Single : A 62 GLN : amide:sc= -3.17! K(o=-3.2!,f=-0.18) USER MOD Single : B 1 ALA N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 6 HIS : no HD1:sc= -0.154 X(o=-0.15,f=-0.51) USER MOD Single : B 8 ASN : amide:sc= 0 X(o=0,f=-0.0031) USER MOD Single : B 13 MET CE :methyl -119:sc= -0.956 (180deg=-3.05!) USER MOD Single : B 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 26 ASN : amide:sc= -0.708 X(o=-0.71,f=-1) USER MOD Single : B 29 SER OG : rot 180:sc= 0 USER MOD Single : B 31 ASN : amide:sc= 0.224 K(o=0.22,f=-3.3!) USER MOD Single : B 39 GLN : amide:sc= 0 X(o=0,f=-0.11) USER MOD Single : B 43 SER OG : rot 8:sc= 1.33 USER MOD Single : B 44 LYS NZ :NH3+ -125:sc= -0.383 (180deg=-2.51!) USER MOD Single : B 46 SER OG : rot 98:sc= 0.907 USER MOD Single : B 49 THR OG1 : rot 180:sc= -0.0134 USER MOD Single : B 53 ASN : amide:sc= -2.55 K(o=-2.6,f=-10!) USER MOD Single : B 62 GLN : amide:sc= -1.62 K(o=-1.6,f=-3.9) USER MOD Single : B 63 SER OG : rot -19:sc= 1.04 USER MOD ----------------------------------------------------------------- ATOM 1 N ALA A 1 18.562 -19.948 -6.503 1.00 0.00 N ATOM 2 CA ALA A 1 18.906 -18.952 -5.462 1.00 0.00 C ATOM 3 C ALA A 1 17.749 -17.959 -5.136 1.00 0.00 C ATOM 4 O ALA A 1 17.058 -17.442 -6.022 1.00 0.00 O ATOM 5 CB ALA A 1 20.170 -18.218 -5.944 1.00 0.00 C ATOM 0 H1 ALA A 1 19.376 -20.573 -6.668 1.00 0.00 H new ATOM 0 H2 ALA A 1 17.749 -20.514 -6.187 1.00 0.00 H new ATOM 0 H3 ALA A 1 18.319 -19.457 -7.387 1.00 0.00 H new ATOM 0 HA ALA A 1 19.085 -19.468 -4.519 1.00 0.00 H new ATOM 0 HB1 ALA A 1 20.461 -17.471 -5.205 1.00 0.00 H new ATOM 0 HB2 ALA A 1 20.980 -18.936 -6.074 1.00 0.00 H new ATOM 0 HB3 ALA A 1 19.965 -17.726 -6.895 1.00 0.00 H new ATOM 6 N ARG A 2 17.564 -17.647 -3.843 1.00 0.00 N ATOM 7 CA ARG A 2 16.450 -16.769 -3.384 1.00 0.00 C ATOM 8 C ARG A 2 16.755 -15.239 -3.466 1.00 0.00 C ATOM 9 O ARG A 2 16.976 -14.552 -2.467 1.00 0.00 O ATOM 10 CB ARG A 2 15.992 -17.249 -1.979 1.00 0.00 C ATOM 11 CG ARG A 2 15.031 -18.460 -1.987 1.00 0.00 C ATOM 12 CD ARG A 2 13.639 -18.123 -2.557 1.00 0.00 C ATOM 13 NE ARG A 2 12.647 -19.129 -2.111 1.00 0.00 N ATOM 14 CZ ARG A 2 11.428 -19.283 -2.614 1.00 0.00 C ATOM 15 NH1 ARG A 2 10.948 -18.595 -3.606 1.00 0.00 N ATOM 16 NH2 ARG A 2 10.668 -20.165 -2.073 1.00 0.00 N ATOM 0 H ARG A 2 18.165 -17.984 -3.090 1.00 0.00 H new ATOM 0 HA ARG A 2 15.619 -16.874 -4.082 1.00 0.00 H new ATOM 0 HB2 ARG A 2 16.874 -17.508 -1.394 1.00 0.00 H new ATOM 0 HB3 ARG A 2 15.503 -16.419 -1.469 1.00 0.00 H new ATOM 0 HG2 ARG A 2 15.473 -19.264 -2.576 1.00 0.00 H new ATOM 0 HG3 ARG A 2 14.920 -18.835 -0.969 1.00 0.00 H new ATOM 0 HD2 ARG A 2 13.334 -17.130 -2.228 1.00 0.00 H new ATOM 0 HD3 ARG A 2 13.680 -18.099 -3.646 1.00 0.00 H new ATOM 0 HE ARG A 2 12.923 -19.755 -1.355 1.00 0.00 H new ATOM 0 HH11 ARG A 2 11.520 -17.878 -4.054 1.00 0.00 H new ATOM 0 HH12 ARG A 2 10.000 -18.771 -3.937 1.00 0.00 H new ATOM 0 HH21 ARG A 2 11.008 -20.717 -1.286 1.00 0.00 H new ATOM 0 HH22 ARG A 2 9.724 -20.313 -2.431 1.00 0.00 H new ATOM 17 N ASP A 3 16.666 -14.692 -4.687 1.00 0.00 N ATOM 18 CA ASP A 3 16.377 -13.250 -4.906 1.00 0.00 C ATOM 19 C ASP A 3 14.921 -12.952 -5.417 1.00 0.00 C ATOM 20 O ASP A 3 14.671 -11.862 -5.931 1.00 0.00 O ATOM 21 CB ASP A 3 17.497 -12.682 -5.826 1.00 0.00 C ATOM 22 CG ASP A 3 18.836 -12.396 -5.149 1.00 0.00 C ATOM 23 OD1 ASP A 3 19.426 -13.526 -4.672 1.00 0.00 O ATOM 24 OD2 ASP A 3 19.315 -11.271 -5.058 1.00 0.00 O ATOM 0 H ASP A 3 16.790 -15.223 -5.549 1.00 0.00 H new ATOM 0 HA ASP A 3 16.393 -12.732 -3.947 1.00 0.00 H new ATOM 0 HB2 ASP A 3 17.666 -13.389 -6.638 1.00 0.00 H new ATOM 0 HB3 ASP A 3 17.136 -11.758 -6.278 1.00 0.00 H new ATOM 25 N ASP A 4 13.932 -13.840 -5.186 1.00 0.00 N ATOM 26 CA ASP A 4 12.498 -13.472 -5.136 1.00 0.00 C ATOM 27 C ASP A 4 11.676 -14.431 -4.209 1.00 0.00 C ATOM 28 O ASP A 4 11.131 -15.421 -4.711 1.00 0.00 O ATOM 29 CB ASP A 4 11.911 -13.273 -6.560 1.00 0.00 C ATOM 30 CG ASP A 4 12.002 -14.386 -7.610 1.00 0.00 C ATOM 31 OD1 ASP A 4 11.355 -15.526 -7.238 1.00 0.00 O ATOM 32 OD2 ASP A 4 12.566 -14.238 -8.688 1.00 0.00 O ATOM 0 H ASP A 4 14.103 -14.833 -5.029 1.00 0.00 H new ATOM 0 HA ASP A 4 12.411 -12.496 -4.658 1.00 0.00 H new ATOM 0 HB2 ASP A 4 10.855 -13.032 -6.440 1.00 0.00 H new ATOM 0 HB3 ASP A 4 12.393 -12.392 -6.985 1.00 0.00 H new ATOM 33 N PRO A 5 11.560 -14.218 -2.870 1.00 0.00 N ATOM 34 CA PRO A 5 10.959 -15.218 -1.953 1.00 0.00 C ATOM 35 C PRO A 5 9.422 -15.109 -1.795 1.00 0.00 C ATOM 36 O PRO A 5 8.823 -14.028 -1.847 1.00 0.00 O ATOM 37 CB PRO A 5 11.740 -14.977 -0.642 1.00 0.00 C ATOM 38 CG PRO A 5 12.842 -13.981 -1.009 1.00 0.00 C ATOM 39 CD PRO A 5 12.249 -13.152 -2.121 1.00 0.00 C ATOM 0 HA PRO A 5 11.052 -16.237 -2.329 1.00 0.00 H new ATOM 0 HB2 PRO A 5 11.090 -14.576 0.136 1.00 0.00 H new ATOM 0 HB3 PRO A 5 12.161 -15.906 -0.258 1.00 0.00 H new ATOM 0 HG2 PRO A 5 13.117 -13.361 -0.155 1.00 0.00 H new ATOM 0 HG3 PRO A 5 13.747 -14.493 -1.335 1.00 0.00 H new ATOM 0 HD2 PRO A 5 11.565 -12.386 -1.755 1.00 0.00 H new ATOM 0 HD3 PRO A 5 13.008 -12.644 -2.716 1.00 0.00 H new ATOM 40 N HIS A 6 8.829 -16.281 -1.570 1.00 0.00 N ATOM 41 CA HIS A 6 7.396 -16.432 -1.249 1.00 0.00 C ATOM 42 C HIS A 6 7.036 -15.982 0.202 1.00 0.00 C ATOM 43 O HIS A 6 7.638 -16.431 1.183 1.00 0.00 O ATOM 44 CB HIS A 6 7.065 -17.949 -1.414 1.00 0.00 C ATOM 45 CG HIS A 6 6.837 -18.437 -2.839 1.00 0.00 C ATOM 46 ND1 HIS A 6 7.795 -19.021 -3.652 1.00 0.00 N ATOM 47 CD2 HIS A 6 5.605 -18.380 -3.490 1.00 0.00 C ATOM 48 CE1 HIS A 6 7.028 -19.257 -4.765 1.00 0.00 C ATOM 49 NE2 HIS A 6 5.704 -18.915 -4.763 1.00 0.00 N ATOM 0 H HIS A 6 9.330 -17.169 -1.604 1.00 0.00 H new ATOM 0 HA HIS A 6 6.816 -15.794 -1.915 1.00 0.00 H new ATOM 0 HB2 HIS A 6 7.881 -18.527 -0.981 1.00 0.00 H new ATOM 0 HB3 HIS A 6 6.172 -18.170 -0.829 1.00 0.00 H new ATOM 0 HD2 HIS A 6 4.700 -17.975 -3.061 1.00 0.00 H new ATOM 0 HE1 HIS A 6 7.469 -19.712 -5.640 1.00 0.00 H new ATOM 0 HE2 HIS A 6 4.995 -19.023 -5.489 1.00 0.00 H new ATOM 50 N PHE A 7 5.879 -15.336 0.366 1.00 0.00 N ATOM 51 CA PHE A 7 4.814 -15.961 1.189 1.00 0.00 C ATOM 52 C PHE A 7 3.473 -16.055 0.399 1.00 0.00 C ATOM 53 O PHE A 7 3.236 -15.398 -0.621 1.00 0.00 O ATOM 54 CB PHE A 7 4.751 -15.325 2.606 1.00 0.00 C ATOM 55 CG PHE A 7 4.207 -13.897 2.781 1.00 0.00 C ATOM 56 CD1 PHE A 7 4.977 -12.768 2.455 1.00 0.00 C ATOM 57 CD2 PHE A 7 2.963 -13.710 3.397 1.00 0.00 C ATOM 58 CE1 PHE A 7 4.522 -11.497 2.771 1.00 0.00 C ATOM 59 CE2 PHE A 7 2.516 -12.437 3.696 1.00 0.00 C ATOM 60 CZ PHE A 7 3.310 -11.343 3.429 1.00 0.00 C ATOM 0 H PHE A 7 5.651 -14.425 -0.033 1.00 0.00 H new ATOM 0 HA PHE A 7 5.062 -17.003 1.392 1.00 0.00 H new ATOM 0 HB2 PHE A 7 4.146 -15.982 3.230 1.00 0.00 H new ATOM 0 HB3 PHE A 7 5.762 -15.340 3.014 1.00 0.00 H new ATOM 0 HD1 PHE A 7 5.927 -12.891 1.956 1.00 0.00 H new ATOM 0 HD2 PHE A 7 2.350 -14.565 3.640 1.00 0.00 H new ATOM 0 HE1 PHE A 7 5.109 -10.630 2.506 1.00 0.00 H new ATOM 0 HE2 PHE A 7 1.541 -12.299 4.140 1.00 0.00 H new ATOM 0 HZ PHE A 7 2.987 -10.359 3.734 1.00 0.00 H new ATOM 61 N ASN A 8 2.549 -16.883 0.892 1.00 0.00 N ATOM 62 CA ASN A 8 1.117 -16.745 0.531 1.00 0.00 C ATOM 63 C ASN A 8 0.487 -15.509 1.259 1.00 0.00 C ATOM 64 O ASN A 8 -0.062 -15.644 2.356 1.00 0.00 O ATOM 65 CB ASN A 8 0.383 -18.103 0.737 1.00 0.00 C ATOM 66 CG ASN A 8 0.502 -18.841 2.080 1.00 0.00 C ATOM 67 OD1 ASN A 8 1.227 -19.816 2.218 1.00 0.00 O ATOM 68 ND2 ASN A 8 -0.173 -18.415 3.113 1.00 0.00 N ATOM 0 H ASN A 8 2.752 -17.649 1.534 1.00 0.00 H new ATOM 0 HA ASN A 8 1.001 -16.523 -0.530 1.00 0.00 H new ATOM 0 HB2 ASN A 8 -0.678 -17.930 0.554 1.00 0.00 H new ATOM 0 HB3 ASN A 8 0.734 -18.783 -0.040 1.00 0.00 H new ATOM 0 HD21 ASN A 8 -0.089 -18.894 4.010 1.00 0.00 H new ATOM 0 HD22 ASN A 8 -0.785 -17.604 3.023 1.00 0.00 H new ATOM 69 N PHE A 9 0.503 -14.307 0.635 1.00 0.00 N ATOM 70 CA PHE A 9 -0.509 -13.281 0.955 1.00 0.00 C ATOM 71 C PHE A 9 -1.923 -13.745 0.489 1.00 0.00 C ATOM 72 O PHE A 9 -2.167 -14.863 0.038 1.00 0.00 O ATOM 73 CB PHE A 9 0.003 -11.902 0.455 1.00 0.00 C ATOM 74 CG PHE A 9 -0.602 -10.668 1.156 1.00 0.00 C ATOM 75 CD1 PHE A 9 -0.640 -10.576 2.559 1.00 0.00 C ATOM 76 CD2 PHE A 9 -0.820 -9.503 0.410 1.00 0.00 C ATOM 77 CE1 PHE A 9 -0.888 -9.365 3.180 1.00 0.00 C ATOM 78 CE2 PHE A 9 -1.105 -8.299 1.033 1.00 0.00 C ATOM 79 CZ PHE A 9 -1.051 -8.227 2.408 1.00 0.00 C ATOM 0 H PHE A 9 1.185 -14.032 -0.072 1.00 0.00 H new ATOM 0 HA PHE A 9 -0.648 -13.147 2.028 1.00 0.00 H new ATOM 0 HB2 PHE A 9 1.086 -11.871 0.577 1.00 0.00 H new ATOM 0 HB3 PHE A 9 -0.200 -11.826 -0.613 1.00 0.00 H new ATOM 0 HD1 PHE A 9 -0.474 -11.460 3.157 1.00 0.00 H new ATOM 0 HD2 PHE A 9 -0.765 -9.544 -0.668 1.00 0.00 H new ATOM 0 HE1 PHE A 9 -0.954 -9.308 4.256 1.00 0.00 H new ATOM 0 HE2 PHE A 9 -1.366 -7.429 0.449 1.00 0.00 H new ATOM 0 HZ PHE A 9 -1.137 -7.266 2.892 1.00 0.00 H new ATOM 80 N ARG A 10 -2.897 -13.007 0.955 1.00 0.00 N ATOM 81 CA ARG A 10 -3.978 -13.578 1.803 1.00 0.00 C ATOM 82 C ARG A 10 -4.666 -12.377 2.492 1.00 0.00 C ATOM 83 O ARG A 10 -4.093 -11.682 3.339 1.00 0.00 O ATOM 84 CB ARG A 10 -3.544 -14.708 2.780 1.00 0.00 C ATOM 85 CG ARG A 10 -4.571 -15.186 3.816 1.00 0.00 C ATOM 86 CD ARG A 10 -5.994 -15.546 3.344 1.00 0.00 C ATOM 87 NE ARG A 10 -6.927 -15.575 4.508 1.00 0.00 N ATOM 88 CZ ARG A 10 -7.005 -16.521 5.439 1.00 0.00 C ATOM 89 NH1 ARG A 10 -6.296 -17.605 5.438 1.00 0.00 N ATOM 90 NH2 ARG A 10 -7.831 -16.343 6.408 1.00 0.00 N ATOM 0 H ARG A 10 -2.987 -12.007 0.776 1.00 0.00 H new ATOM 0 HA ARG A 10 -4.681 -14.122 1.172 1.00 0.00 H new ATOM 0 HB2 ARG A 10 -3.242 -15.569 2.184 1.00 0.00 H new ATOM 0 HB3 ARG A 10 -2.659 -14.366 3.317 1.00 0.00 H new ATOM 0 HG2 ARG A 10 -4.156 -16.064 4.310 1.00 0.00 H new ATOM 0 HG3 ARG A 10 -4.662 -14.407 4.573 1.00 0.00 H new ATOM 0 HD2 ARG A 10 -6.338 -14.817 2.610 1.00 0.00 H new ATOM 0 HD3 ARG A 10 -5.987 -16.517 2.849 1.00 0.00 H new ATOM 0 HE ARG A 10 -7.571 -14.789 4.599 1.00 0.00 H new ATOM 0 HH11 ARG A 10 -5.625 -17.775 4.689 1.00 0.00 H new ATOM 0 HH12 ARG A 10 -6.409 -18.289 6.186 1.00 0.00 H new ATOM 0 HH21 ARG A 10 -8.400 -15.497 6.444 1.00 0.00 H new ATOM 0 HH22 ARG A 10 -7.918 -17.048 7.140 1.00 0.00 H new ATOM 91 N MET A 11 -5.886 -12.120 2.040 1.00 0.00 N ATOM 92 CA MET A 11 -6.512 -10.795 2.175 1.00 0.00 C ATOM 93 C MET A 11 -8.044 -10.982 2.418 1.00 0.00 C ATOM 94 O MET A 11 -8.701 -11.547 1.534 1.00 0.00 O ATOM 95 CB MET A 11 -6.225 -10.038 0.849 1.00 0.00 C ATOM 96 CG MET A 11 -4.899 -9.265 0.744 1.00 0.00 C ATOM 97 SD MET A 11 -4.664 -8.755 -0.960 1.00 0.00 S ATOM 98 CE MET A 11 -3.350 -9.860 -1.493 1.00 0.00 C ATOM 0 H MET A 11 -6.472 -12.812 1.572 1.00 0.00 H new ATOM 0 HA MET A 11 -6.117 -10.227 3.017 1.00 0.00 H new ATOM 0 HB2 MET A 11 -6.257 -10.762 0.035 1.00 0.00 H new ATOM 0 HB3 MET A 11 -7.039 -9.333 0.681 1.00 0.00 H new ATOM 0 HG2 MET A 11 -4.916 -8.395 1.400 1.00 0.00 H new ATOM 0 HG3 MET A 11 -4.069 -9.893 1.069 1.00 0.00 H new ATOM 0 HE1 MET A 11 -2.513 -9.274 -1.872 1.00 0.00 H new ATOM 0 HE2 MET A 11 -3.017 -10.464 -0.649 1.00 0.00 H new ATOM 0 HE3 MET A 11 -3.722 -10.514 -2.282 1.00 0.00 H new ATOM 99 N PRO A 12 -8.686 -10.468 3.512 1.00 0.00 N ATOM 100 CA PRO A 12 -10.162 -10.248 3.549 1.00 0.00 C ATOM 101 C PRO A 12 -10.790 -9.608 2.270 1.00 0.00 C ATOM 102 O PRO A 12 -10.123 -8.839 1.562 1.00 0.00 O ATOM 103 CB PRO A 12 -10.316 -9.360 4.799 1.00 0.00 C ATOM 104 CG PRO A 12 -9.131 -9.718 5.695 1.00 0.00 C ATOM 105 CD PRO A 12 -7.990 -9.974 4.714 1.00 0.00 C ATOM 0 HA PRO A 12 -10.709 -11.190 3.585 1.00 0.00 H new ATOM 0 HB2 PRO A 12 -10.304 -8.303 4.534 1.00 0.00 H new ATOM 0 HB3 PRO A 12 -11.263 -9.552 5.304 1.00 0.00 H new ATOM 0 HG2 PRO A 12 -8.892 -8.907 6.383 1.00 0.00 H new ATOM 0 HG3 PRO A 12 -9.341 -10.599 6.302 1.00 0.00 H new ATOM 0 HD2 PRO A 12 -7.425 -9.065 4.507 1.00 0.00 H new ATOM 0 HD3 PRO A 12 -7.283 -10.708 5.101 1.00 0.00 H new ATOM 106 N MET A 13 -12.045 -9.967 1.949 1.00 0.00 N ATOM 107 CA MET A 13 -12.654 -9.659 0.620 1.00 0.00 C ATOM 108 C MET A 13 -12.529 -8.190 0.100 1.00 0.00 C ATOM 109 O MET A 13 -12.210 -7.974 -1.065 1.00 0.00 O ATOM 110 CB MET A 13 -14.135 -10.133 0.584 1.00 0.00 C ATOM 111 CG MET A 13 -14.791 -10.219 -0.820 1.00 0.00 C ATOM 112 SD MET A 13 -14.464 -11.760 -1.711 1.00 0.00 S ATOM 113 CE MET A 13 -12.752 -11.607 -2.256 1.00 0.00 C ATOM 0 H MET A 13 -12.666 -10.470 2.583 1.00 0.00 H new ATOM 0 HA MET A 13 -12.042 -10.224 -0.083 1.00 0.00 H new ATOM 0 HB2 MET A 13 -14.192 -11.117 1.050 1.00 0.00 H new ATOM 0 HB3 MET A 13 -14.727 -9.455 1.198 1.00 0.00 H new ATOM 0 HG2 MET A 13 -15.869 -10.099 -0.711 1.00 0.00 H new ATOM 0 HG3 MET A 13 -14.437 -9.383 -1.424 1.00 0.00 H new ATOM 0 HE1 MET A 13 -12.579 -12.270 -3.104 1.00 0.00 H new ATOM 0 HE2 MET A 13 -12.556 -10.577 -2.555 1.00 0.00 H new ATOM 0 HE3 MET A 13 -12.084 -11.881 -1.439 1.00 0.00 H new ATOM 114 N GLU A 14 -12.699 -7.202 0.984 1.00 0.00 N ATOM 115 CA GLU A 14 -12.344 -5.793 0.710 1.00 0.00 C ATOM 116 C GLU A 14 -10.871 -5.481 0.296 1.00 0.00 C ATOM 117 O GLU A 14 -10.711 -4.824 -0.722 1.00 0.00 O ATOM 118 CB GLU A 14 -12.860 -4.914 1.889 1.00 0.00 C ATOM 119 CG GLU A 14 -12.348 -5.252 3.325 1.00 0.00 C ATOM 120 CD GLU A 14 -13.174 -6.285 4.088 1.00 0.00 C ATOM 121 OE1 GLU A 14 -14.253 -5.726 4.704 1.00 0.00 O ATOM 122 OE2 GLU A 14 -12.894 -7.479 4.123 1.00 0.00 O ATOM 0 H GLU A 14 -13.088 -7.350 1.915 1.00 0.00 H new ATOM 0 HA GLU A 14 -12.854 -5.534 -0.218 1.00 0.00 H new ATOM 0 HB2 GLU A 14 -12.598 -3.878 1.675 1.00 0.00 H new ATOM 0 HB3 GLU A 14 -13.948 -4.972 1.899 1.00 0.00 H new ATOM 0 HG2 GLU A 14 -11.323 -5.614 3.251 1.00 0.00 H new ATOM 0 HG3 GLU A 14 -12.320 -4.332 3.908 1.00 0.00 H new ATOM 123 N VAL A 15 -9.810 -5.943 0.981 1.00 0.00 N ATOM 124 CA VAL A 15 -8.389 -5.763 0.521 1.00 0.00 C ATOM 125 C VAL A 15 -8.097 -6.453 -0.826 1.00 0.00 C ATOM 126 O VAL A 15 -7.422 -5.851 -1.643 1.00 0.00 O ATOM 127 CB VAL A 15 -7.323 -6.283 1.549 1.00 0.00 C ATOM 128 CG1 VAL A 15 -6.045 -5.425 1.498 1.00 0.00 C ATOM 129 CG2 VAL A 15 -7.766 -6.461 3.020 1.00 0.00 C ATOM 0 H VAL A 15 -9.893 -6.449 1.863 1.00 0.00 H new ATOM 0 HA VAL A 15 -8.298 -4.682 0.417 1.00 0.00 H new ATOM 0 HB VAL A 15 -7.144 -7.301 1.203 1.00 0.00 H new ATOM 0 HG11 VAL A 15 -5.322 -5.806 2.220 1.00 0.00 H new ATOM 0 HG12 VAL A 15 -5.616 -5.470 0.497 1.00 0.00 H new ATOM 0 HG13 VAL A 15 -6.291 -4.391 1.742 1.00 0.00 H new ATOM 0 HG21 VAL A 15 -6.926 -6.825 3.611 1.00 0.00 H new ATOM 0 HG22 VAL A 15 -8.101 -5.503 3.418 1.00 0.00 H new ATOM 0 HG23 VAL A 15 -8.584 -7.180 3.069 1.00 0.00 H new ATOM 130 N ARG A 16 -8.514 -7.701 -1.057 1.00 0.00 N ATOM 131 CA ARG A 16 -8.302 -8.338 -2.375 1.00 0.00 C ATOM 132 C ARG A 16 -9.274 -7.920 -3.511 1.00 0.00 C ATOM 133 O ARG A 16 -8.843 -7.929 -4.661 1.00 0.00 O ATOM 134 CB ARG A 16 -8.129 -9.862 -2.184 1.00 0.00 C ATOM 135 CG ARG A 16 -6.911 -10.411 -2.972 1.00 0.00 C ATOM 136 CD ARG A 16 -7.407 -11.132 -4.225 1.00 0.00 C ATOM 137 NE ARG A 16 -6.277 -11.574 -5.076 1.00 0.00 N ATOM 138 CZ ARG A 16 -6.227 -12.702 -5.779 1.00 0.00 C ATOM 139 NH1 ARG A 16 -7.091 -13.666 -5.692 1.00 0.00 N ATOM 140 NH2 ARG A 16 -5.258 -12.844 -6.610 1.00 0.00 N ATOM 0 H ARG A 16 -8.991 -8.286 -0.370 1.00 0.00 H new ATOM 0 HA ARG A 16 -7.372 -7.933 -2.775 1.00 0.00 H new ATOM 0 HB2 ARG A 16 -8.005 -10.083 -1.124 1.00 0.00 H new ATOM 0 HB3 ARG A 16 -9.034 -10.374 -2.512 1.00 0.00 H new ATOM 0 HG2 ARG A 16 -6.243 -9.595 -3.248 1.00 0.00 H new ATOM 0 HG3 ARG A 16 -6.337 -11.095 -2.347 1.00 0.00 H new ATOM 0 HD2 ARG A 16 -8.007 -11.995 -3.937 1.00 0.00 H new ATOM 0 HD3 ARG A 16 -8.057 -10.468 -4.796 1.00 0.00 H new ATOM 0 HE ARG A 16 -5.465 -10.958 -5.127 1.00 0.00 H new ATOM 0 HH11 ARG A 16 -7.879 -13.588 -5.049 1.00 0.00 H new ATOM 0 HH12 ARG A 16 -6.983 -14.502 -6.267 1.00 0.00 H new ATOM 0 HH21 ARG A 16 -4.562 -12.106 -6.712 1.00 0.00 H new ATOM 0 HH22 ARG A 16 -5.185 -13.695 -7.168 1.00 0.00 H new ATOM 141 N GLU A 17 -10.497 -7.430 -3.246 1.00 0.00 N ATOM 142 CA GLU A 17 -11.180 -6.534 -4.205 1.00 0.00 C ATOM 143 C GLU A 17 -10.523 -5.128 -4.350 1.00 0.00 C ATOM 144 O GLU A 17 -10.484 -4.664 -5.471 1.00 0.00 O ATOM 145 CB GLU A 17 -12.683 -6.389 -3.889 1.00 0.00 C ATOM 146 CG GLU A 17 -13.547 -7.663 -4.068 1.00 0.00 C ATOM 147 CD GLU A 17 -15.034 -7.421 -3.831 1.00 0.00 C ATOM 148 OE1 GLU A 17 -15.535 -7.250 -2.725 1.00 0.00 O ATOM 149 OE2 GLU A 17 -15.749 -7.413 -4.988 1.00 0.00 O ATOM 0 H GLU A 17 -11.026 -7.631 -2.397 1.00 0.00 H new ATOM 0 HA GLU A 17 -11.064 -7.029 -5.169 1.00 0.00 H new ATOM 0 HB2 GLU A 17 -12.785 -6.048 -2.859 1.00 0.00 H new ATOM 0 HB3 GLU A 17 -13.093 -5.605 -4.526 1.00 0.00 H new ATOM 0 HG2 GLU A 17 -13.405 -8.051 -5.077 1.00 0.00 H new ATOM 0 HG3 GLU A 17 -13.197 -8.431 -3.379 1.00 0.00 H new ATOM 150 N LYS A 18 -9.999 -4.426 -3.334 1.00 0.00 N ATOM 151 CA LYS A 18 -9.333 -3.100 -3.533 1.00 0.00 C ATOM 152 C LYS A 18 -7.846 -3.114 -4.017 1.00 0.00 C ATOM 153 O LYS A 18 -7.500 -2.342 -4.908 1.00 0.00 O ATOM 154 CB LYS A 18 -9.871 -2.048 -2.526 1.00 0.00 C ATOM 155 CG LYS A 18 -9.391 -2.104 -1.057 1.00 0.00 C ATOM 156 CD LYS A 18 -10.474 -1.728 -0.024 1.00 0.00 C ATOM 157 CE LYS A 18 -10.028 -2.045 1.413 1.00 0.00 C ATOM 158 NZ LYS A 18 -11.004 -1.502 2.378 1.00 0.00 N ATOM 0 H LYS A 18 -10.016 -4.741 -2.364 1.00 0.00 H new ATOM 0 HA LYS A 18 -9.653 -2.665 -4.480 1.00 0.00 H new ATOM 0 HB2 LYS A 18 -9.622 -1.061 -2.916 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -10.958 -2.124 -2.520 1.00 0.00 H new ATOM 0 HG2 LYS A 18 -9.033 -3.111 -0.841 1.00 0.00 H new ATOM 0 HG3 LYS A 18 -8.542 -1.431 -0.938 1.00 0.00 H new ATOM 0 HD2 LYS A 18 -10.702 -0.665 -0.107 1.00 0.00 H new ATOM 0 HD3 LYS A 18 -11.393 -2.270 -0.247 1.00 0.00 H new ATOM 0 HE2 LYS A 18 -9.936 -3.123 1.544 1.00 0.00 H new ATOM 0 HE3 LYS A 18 -9.043 -1.616 1.599 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 -10.739 -1.793 3.341 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 -11.009 -0.464 2.320 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 -11.952 -1.866 2.155 1.00 0.00 H new ATOM 159 N LEU A 19 -7.015 -4.076 -3.600 1.00 0.00 N ATOM 160 CA LEU A 19 -5.751 -4.458 -4.286 1.00 0.00 C ATOM 161 C LEU A 19 -5.936 -5.047 -5.726 1.00 0.00 C ATOM 162 O LEU A 19 -5.148 -4.694 -6.611 1.00 0.00 O ATOM 163 CB LEU A 19 -4.937 -5.263 -3.223 1.00 0.00 C ATOM 164 CG LEU A 19 -3.388 -5.364 -3.302 1.00 0.00 C ATOM 165 CD1 LEU A 19 -2.532 -4.085 -3.281 1.00 0.00 C ATOM 166 CD2 LEU A 19 -2.973 -6.282 -2.134 1.00 0.00 C ATOM 0 H LEU A 19 -7.195 -4.628 -2.761 1.00 0.00 H new ATOM 0 HA LEU A 19 -5.148 -3.601 -4.586 1.00 0.00 H new ATOM 0 HB2 LEU A 19 -5.179 -4.839 -2.249 1.00 0.00 H new ATOM 0 HB3 LEU A 19 -5.323 -6.282 -3.231 1.00 0.00 H new ATOM 0 HG LEU A 19 -3.178 -5.732 -4.306 1.00 0.00 H new ATOM 0 HD11 LEU A 19 -1.477 -4.352 -3.344 1.00 0.00 H new ATOM 0 HD12 LEU A 19 -2.798 -3.455 -4.130 1.00 0.00 H new ATOM 0 HD13 LEU A 19 -2.713 -3.541 -2.354 1.00 0.00 H new ATOM 0 HD21 LEU A 19 -1.889 -6.398 -2.129 1.00 0.00 H new ATOM 0 HD22 LEU A 19 -3.295 -5.839 -1.191 1.00 0.00 H new ATOM 0 HD23 LEU A 19 -3.441 -7.259 -2.255 1.00 0.00 H new ATOM 167 N LYS A 20 -6.965 -5.886 -6.003 1.00 0.00 N ATOM 168 CA LYS A 20 -7.241 -6.402 -7.361 1.00 0.00 C ATOM 169 C LYS A 20 -8.184 -5.542 -8.272 1.00 0.00 C ATOM 170 O LYS A 20 -8.062 -5.736 -9.485 1.00 0.00 O ATOM 171 CB LYS A 20 -7.711 -7.874 -7.368 1.00 0.00 C ATOM 172 CG LYS A 20 -7.480 -8.546 -8.746 1.00 0.00 C ATOM 173 CD LYS A 20 -7.554 -10.076 -8.824 1.00 0.00 C ATOM 174 CE LYS A 20 -8.708 -10.694 -8.025 1.00 0.00 C ATOM 175 NZ LYS A 20 -8.844 -12.120 -8.364 1.00 0.00 N ATOM 0 H LYS A 20 -7.620 -6.220 -5.296 1.00 0.00 H new ATOM 0 HA LYS A 20 -6.254 -6.326 -7.818 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -7.176 -8.430 -6.598 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -8.770 -7.918 -7.115 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -8.214 -8.141 -9.442 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -6.497 -8.241 -9.106 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -7.653 -10.370 -9.869 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -6.614 -10.492 -8.463 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -8.524 -10.581 -6.957 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -9.637 -10.168 -8.246 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -9.813 -12.308 -8.692 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -8.170 -12.364 -9.117 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -8.646 -12.697 -7.522 1.00 0.00 H new ATOM 176 N PHE A 21 -9.044 -4.628 -7.743 1.00 0.00 N ATOM 177 CA PHE A 21 -9.774 -3.501 -8.474 1.00 0.00 C ATOM 178 C PHE A 21 -9.270 -2.046 -8.349 1.00 0.00 C ATOM 179 O PHE A 21 -9.685 -1.165 -9.109 1.00 0.00 O ATOM 180 CB PHE A 21 -11.284 -3.401 -8.040 1.00 0.00 C ATOM 181 CG PHE A 21 -12.295 -4.564 -8.142 1.00 0.00 C ATOM 182 CD1 PHE A 21 -12.000 -5.890 -7.809 1.00 0.00 C ATOM 183 CD2 PHE A 21 -13.587 -4.245 -8.567 1.00 0.00 C ATOM 184 CE1 PHE A 21 -13.003 -6.847 -7.769 1.00 0.00 C ATOM 185 CE2 PHE A 21 -14.597 -5.198 -8.522 1.00 0.00 C ATOM 186 CZ PHE A 21 -14.309 -6.499 -8.109 1.00 0.00 C ATOM 0 H PHE A 21 -9.272 -4.639 -6.749 1.00 0.00 H new ATOM 0 HA PHE A 21 -9.584 -3.829 -9.496 1.00 0.00 H new ATOM 0 HB2 PHE A 21 -11.279 -3.094 -6.994 1.00 0.00 H new ATOM 0 HB3 PHE A 21 -11.710 -2.577 -8.612 1.00 0.00 H new ATOM 0 HD1 PHE A 21 -10.982 -6.171 -7.581 1.00 0.00 H new ATOM 0 HD2 PHE A 21 -13.802 -3.252 -8.933 1.00 0.00 H new ATOM 0 HE1 PHE A 21 -12.772 -7.860 -7.475 1.00 0.00 H new ATOM 0 HE2 PHE A 21 -15.604 -4.932 -8.807 1.00 0.00 H new ATOM 0 HZ PHE A 21 -15.097 -7.235 -8.053 1.00 0.00 H new ATOM 187 N ARG A 22 -8.138 -1.966 -7.698 1.00 0.00 N ATOM 188 CA ARG A 22 -6.900 -1.671 -8.446 1.00 0.00 C ATOM 189 C ARG A 22 -6.435 -2.887 -9.295 1.00 0.00 C ATOM 190 O ARG A 22 -7.317 -3.483 -9.867 1.00 0.00 O ATOM 191 CB ARG A 22 -5.947 -1.135 -7.352 1.00 0.00 C ATOM 192 CG ARG A 22 -4.497 -0.829 -7.790 1.00 0.00 C ATOM 193 CD ARG A 22 -4.061 0.627 -7.669 1.00 0.00 C ATOM 194 NE ARG A 22 -4.225 1.259 -6.334 1.00 0.00 N ATOM 195 CZ ARG A 22 -4.462 2.557 -6.138 1.00 0.00 C ATOM 196 NH1 ARG A 22 -4.631 3.430 -7.086 1.00 0.00 N ATOM 197 NH2 ARG A 22 -4.535 2.980 -4.930 1.00 0.00 N ATOM 0 H ARG A 22 -8.027 -2.092 -6.692 1.00 0.00 H new ATOM 0 HA ARG A 22 -6.990 -0.922 -9.233 1.00 0.00 H new ATOM 0 HB2 ARG A 22 -6.379 -0.223 -6.941 1.00 0.00 H new ATOM 0 HB3 ARG A 22 -5.912 -1.864 -6.543 1.00 0.00 H new ATOM 0 HG2 ARG A 22 -3.820 -1.442 -7.194 1.00 0.00 H new ATOM 0 HG3 ARG A 22 -4.378 -1.139 -8.828 1.00 0.00 H new ATOM 0 HD2 ARG A 22 -3.010 0.693 -7.951 1.00 0.00 H new ATOM 0 HD3 ARG A 22 -4.624 1.213 -8.396 1.00 0.00 H new ATOM 0 HE ARG A 22 -4.151 0.660 -5.512 1.00 0.00 H new ATOM 0 HH11 ARG A 22 -4.586 3.138 -8.062 1.00 0.00 H new ATOM 0 HH12 ARG A 22 -4.809 4.407 -6.854 1.00 0.00 H new ATOM 0 HH21 ARG A 22 -4.413 2.330 -4.154 1.00 0.00 H new ATOM 0 HH22 ARG A 22 -4.715 3.967 -4.745 1.00 0.00 H new ATOM 198 N ALA A 23 -5.188 -3.305 -9.480 1.00 0.00 N ATOM 199 CA ALA A 23 -4.748 -4.251 -10.558 1.00 0.00 C ATOM 200 C ALA A 23 -5.373 -4.143 -12.019 1.00 0.00 C ATOM 201 O ALA A 23 -4.749 -4.200 -13.067 1.00 0.00 O ATOM 202 CB ALA A 23 -4.407 -5.544 -9.763 1.00 0.00 C ATOM 0 H ALA A 23 -4.419 -3.002 -8.883 1.00 0.00 H new ATOM 0 HA ALA A 23 -3.867 -4.000 -11.148 1.00 0.00 H new ATOM 0 HB1 ALA A 23 -4.069 -6.317 -10.453 1.00 0.00 H new ATOM 0 HB2 ALA A 23 -3.617 -5.331 -9.043 1.00 0.00 H new ATOM 0 HB3 ALA A 23 -5.295 -5.892 -9.235 1.00 0.00 H new ATOM 203 N GLU A 24 -6.666 -4.061 -12.132 1.00 0.00 N ATOM 204 CA GLU A 24 -7.386 -2.930 -12.796 1.00 0.00 C ATOM 205 C GLU A 24 -8.657 -2.308 -12.123 1.00 0.00 C ATOM 206 O GLU A 24 -8.664 -1.127 -11.796 1.00 0.00 O ATOM 207 CB GLU A 24 -7.921 -3.453 -14.135 1.00 0.00 C ATOM 208 CG GLU A 24 -7.297 -2.595 -15.200 1.00 0.00 C ATOM 209 CD GLU A 24 -7.521 -2.961 -16.662 1.00 0.00 C ATOM 210 OE1 GLU A 24 -8.843 -3.050 -16.981 1.00 0.00 O ATOM 211 OE2 GLU A 24 -6.602 -3.140 -17.453 1.00 0.00 O ATOM 0 H GLU A 24 -7.295 -4.777 -11.768 1.00 0.00 H new ATOM 0 HA GLU A 24 -6.627 -2.147 -12.796 1.00 0.00 H new ATOM 0 HB2 GLU A 24 -7.658 -4.501 -14.276 1.00 0.00 H new ATOM 0 HB3 GLU A 24 -9.009 -3.389 -14.171 1.00 0.00 H new ATOM 0 HG2 GLU A 24 -7.657 -1.576 -15.056 1.00 0.00 H new ATOM 0 HG3 GLU A 24 -6.221 -2.581 -15.024 1.00 0.00 H new ATOM 212 N ALA A 25 -9.795 -3.009 -11.932 1.00 0.00 N ATOM 213 CA ALA A 25 -9.823 -4.504 -11.828 1.00 0.00 C ATOM 214 C ALA A 25 -9.523 -5.676 -12.828 1.00 0.00 C ATOM 215 O ALA A 25 -10.119 -5.899 -13.881 1.00 0.00 O ATOM 216 CB ALA A 25 -10.859 -4.961 -10.878 1.00 0.00 C ATOM 0 H ALA A 25 -10.713 -2.573 -11.845 1.00 0.00 H new ATOM 0 HA ALA A 25 -8.750 -4.376 -11.689 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -10.851 -6.050 -10.827 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -10.653 -4.550 -9.890 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -11.838 -4.620 -11.216 1.00 0.00 H new ATOM 217 N ASN A 26 -8.458 -6.327 -12.383 1.00 0.00 N ATOM 218 CA ASN A 26 -7.576 -7.201 -13.178 1.00 0.00 C ATOM 219 C ASN A 26 -7.255 -7.192 -14.722 1.00 0.00 C ATOM 220 O ASN A 26 -7.602 -8.103 -15.472 1.00 0.00 O ATOM 221 CB ASN A 26 -7.020 -8.426 -12.401 1.00 0.00 C ATOM 222 CG ASN A 26 -5.595 -8.314 -11.806 1.00 0.00 C ATOM 223 OD1 ASN A 26 -5.101 -9.223 -11.151 1.00 0.00 O ATOM 224 ND2 ASN A 26 -4.874 -7.220 -11.984 1.00 0.00 N ATOM 0 H ASN A 26 -8.162 -6.263 -11.409 1.00 0.00 H new ATOM 0 HA ASN A 26 -7.378 -6.179 -13.502 1.00 0.00 H new ATOM 0 HB2 ASN A 26 -7.708 -8.646 -11.585 1.00 0.00 H new ATOM 0 HB3 ASN A 26 -7.037 -9.285 -13.072 1.00 0.00 H new ATOM 0 HD21 ASN A 26 -3.939 -7.154 -11.581 1.00 0.00 H new ATOM 0 HD22 ASN A 26 -5.253 -6.442 -12.524 1.00 0.00 H new ATOM 225 N GLY A 27 -6.394 -6.228 -15.091 1.00 0.00 N ATOM 226 CA GLY A 27 -5.430 -6.348 -16.225 1.00 0.00 C ATOM 227 C GLY A 27 -3.919 -6.487 -15.872 1.00 0.00 C ATOM 228 O GLY A 27 -3.192 -7.176 -16.588 1.00 0.00 O ATOM 0 H GLY A 27 -6.339 -5.329 -14.612 1.00 0.00 H new ATOM 0 HA2 GLY A 27 -5.717 -7.214 -16.821 1.00 0.00 H new ATOM 0 HA3 GLY A 27 -5.548 -5.471 -16.861 1.00 0.00 H new ATOM 229 N ARG A 28 -3.419 -5.813 -14.824 1.00 0.00 N ATOM 230 CA ARG A 28 -1.975 -5.753 -14.474 1.00 0.00 C ATOM 231 C ARG A 28 -1.855 -6.382 -13.087 1.00 0.00 C ATOM 232 O ARG A 28 -2.398 -5.917 -12.106 1.00 0.00 O ATOM 233 CB ARG A 28 -1.413 -4.370 -14.881 1.00 0.00 C ATOM 234 CG ARG A 28 -1.968 -3.057 -14.263 1.00 0.00 C ATOM 235 CD ARG A 28 -1.627 -2.744 -12.782 1.00 0.00 C ATOM 236 NE ARG A 28 -0.274 -3.172 -12.422 1.00 0.00 N ATOM 237 CZ ARG A 28 0.859 -2.623 -12.871 1.00 0.00 C ATOM 238 NH1 ARG A 28 0.925 -1.501 -13.519 1.00 0.00 N ATOM 239 NH2 ARG A 28 1.952 -3.260 -12.669 1.00 0.00 N ATOM 0 H ARG A 28 -4.008 -5.284 -14.181 1.00 0.00 H new ATOM 0 HA ARG A 28 -1.255 -6.353 -15.031 1.00 0.00 H new ATOM 0 HB2 ARG A 28 -0.343 -4.390 -14.676 1.00 0.00 H new ATOM 0 HB3 ARG A 28 -1.529 -4.286 -15.962 1.00 0.00 H new ATOM 0 HG2 ARG A 28 -1.610 -2.226 -14.870 1.00 0.00 H new ATOM 0 HG3 ARG A 28 -3.054 -3.077 -14.358 1.00 0.00 H new ATOM 0 HD2 ARG A 28 -1.726 -1.673 -12.607 1.00 0.00 H new ATOM 0 HD3 ARG A 28 -2.348 -3.241 -12.133 1.00 0.00 H new ATOM 0 HE ARG A 28 -0.189 -3.955 -11.774 1.00 0.00 H new ATOM 0 HH11 ARG A 28 0.073 -0.975 -13.717 1.00 0.00 H new ATOM 0 HH12 ARG A 28 1.828 -1.144 -13.831 1.00 0.00 H new ATOM 0 HH21 ARG A 28 1.938 -4.155 -12.180 1.00 0.00 H new ATOM 0 HH22 ARG A 28 2.836 -2.872 -12.997 1.00 0.00 H new ATOM 240 N SER A 29 -1.262 -7.565 -13.003 1.00 0.00 N ATOM 241 CA SER A 29 -1.960 -8.778 -12.497 1.00 0.00 C ATOM 242 C SER A 29 -1.477 -8.983 -11.055 1.00 0.00 C ATOM 243 O SER A 29 -0.277 -9.130 -10.929 1.00 0.00 O ATOM 244 CB SER A 29 -1.640 -9.959 -13.441 1.00 0.00 C ATOM 245 OG SER A 29 -2.365 -11.127 -13.050 1.00 0.00 O ATOM 0 H SER A 29 -0.293 -7.729 -13.276 1.00 0.00 H new ATOM 0 HA SER A 29 -3.046 -8.687 -12.485 1.00 0.00 H new ATOM 0 HB2 SER A 29 -1.896 -9.692 -14.466 1.00 0.00 H new ATOM 0 HB3 SER A 29 -0.570 -10.166 -13.423 1.00 0.00 H new ATOM 0 HG SER A 29 -2.151 -11.864 -13.660 1.00 0.00 H new ATOM 246 N MET A 30 -2.262 -8.842 -9.974 1.00 0.00 N ATOM 247 CA MET A 30 -1.736 -8.309 -8.667 1.00 0.00 C ATOM 248 C MET A 30 -0.300 -8.690 -8.185 1.00 0.00 C ATOM 249 O MET A 30 0.415 -7.805 -7.765 1.00 0.00 O ATOM 250 CB MET A 30 -2.639 -8.634 -7.483 1.00 0.00 C ATOM 251 CG MET A 30 -4.031 -8.084 -7.454 1.00 0.00 C ATOM 252 SD MET A 30 -4.913 -9.149 -6.310 1.00 0.00 S ATOM 253 CE MET A 30 -4.833 -8.091 -4.880 1.00 0.00 C ATOM 0 H MET A 30 -3.253 -9.081 -9.959 1.00 0.00 H new ATOM 0 HA MET A 30 -1.707 -7.257 -8.950 1.00 0.00 H new ATOM 0 HB2 MET A 30 -2.714 -9.719 -7.415 1.00 0.00 H new ATOM 0 HB3 MET A 30 -2.132 -8.292 -6.580 1.00 0.00 H new ATOM 0 HG2 MET A 30 -4.041 -7.047 -7.118 1.00 0.00 H new ATOM 0 HG3 MET A 30 -4.486 -8.103 -8.444 1.00 0.00 H new ATOM 0 HE1 MET A 30 -4.402 -8.642 -4.044 1.00 0.00 H new ATOM 0 HE2 MET A 30 -4.211 -7.224 -5.103 1.00 0.00 H new ATOM 0 HE3 MET A 30 -5.837 -7.759 -4.617 1.00 0.00 H new ATOM 254 N ASN A 31 0.240 -9.903 -8.286 1.00 0.00 N ATOM 255 CA ASN A 31 1.726 -10.078 -8.238 1.00 0.00 C ATOM 256 C ASN A 31 2.587 -9.011 -9.057 1.00 0.00 C ATOM 257 O ASN A 31 3.353 -8.272 -8.448 1.00 0.00 O ATOM 258 CB ASN A 31 2.009 -11.569 -8.557 1.00 0.00 C ATOM 259 CG ASN A 31 3.452 -12.023 -8.401 1.00 0.00 C ATOM 260 OD1 ASN A 31 4.079 -12.505 -9.334 1.00 0.00 O ATOM 261 ND2 ASN A 31 4.015 -11.881 -7.236 1.00 0.00 N ATOM 0 H ASN A 31 -0.292 -10.766 -8.399 1.00 0.00 H new ATOM 0 HA ASN A 31 2.087 -9.843 -7.237 1.00 0.00 H new ATOM 0 HB2 ASN A 31 1.384 -12.183 -7.909 1.00 0.00 H new ATOM 0 HB3 ASN A 31 1.696 -11.766 -9.582 1.00 0.00 H new ATOM 0 HD21 ASN A 31 4.983 -12.172 -7.098 1.00 0.00 H new ATOM 0 HD22 ASN A 31 3.488 -11.479 -6.461 1.00 0.00 H new ATOM 262 N SER A 32 2.283 -8.787 -10.346 1.00 0.00 N ATOM 263 CA SER A 32 2.385 -7.448 -11.014 1.00 0.00 C ATOM 264 C SER A 32 1.810 -6.172 -10.296 1.00 0.00 C ATOM 265 O SER A 32 2.624 -5.302 -9.969 1.00 0.00 O ATOM 266 CB SER A 32 2.058 -7.616 -12.520 1.00 0.00 C ATOM 267 OG SER A 32 1.915 -6.362 -13.190 1.00 0.00 O ATOM 0 H SER A 32 1.956 -9.524 -10.971 1.00 0.00 H new ATOM 0 HA SER A 32 3.425 -7.142 -10.902 1.00 0.00 H new ATOM 0 HB2 SER A 32 2.850 -8.192 -12.999 1.00 0.00 H new ATOM 0 HB3 SER A 32 1.137 -8.189 -12.627 1.00 0.00 H new ATOM 0 HG SER A 32 1.711 -6.518 -14.136 1.00 0.00 H new ATOM 268 N GLU A 33 0.494 -5.982 -10.045 1.00 0.00 N ATOM 269 CA GLU A 33 0.031 -4.688 -9.414 1.00 0.00 C ATOM 270 C GLU A 33 0.356 -4.414 -7.941 1.00 0.00 C ATOM 271 O GLU A 33 0.888 -3.355 -7.627 1.00 0.00 O ATOM 272 CB GLU A 33 -1.447 -4.378 -9.462 1.00 0.00 C ATOM 273 CG GLU A 33 -1.954 -2.913 -9.252 1.00 0.00 C ATOM 274 CD GLU A 33 -1.055 -1.701 -9.101 1.00 0.00 C ATOM 275 OE1 GLU A 33 -0.199 -1.502 -10.142 1.00 0.00 O ATOM 276 OE2 GLU A 33 -1.142 -0.975 -8.131 1.00 0.00 O ATOM 0 H GLU A 33 -0.243 -6.656 -10.250 1.00 0.00 H new ATOM 0 HA GLU A 33 0.632 -4.072 -10.083 1.00 0.00 H new ATOM 0 HB2 GLU A 33 -1.815 -4.711 -10.433 1.00 0.00 H new ATOM 0 HB3 GLU A 33 -1.931 -4.998 -8.708 1.00 0.00 H new ATOM 0 HG2 GLU A 33 -2.610 -2.698 -10.096 1.00 0.00 H new ATOM 0 HG3 GLU A 33 -2.580 -2.936 -8.360 1.00 0.00 H new ATOM 277 N LEU A 34 -0.018 -5.337 -7.032 1.00 0.00 N ATOM 278 CA LEU A 34 0.523 -5.407 -5.664 1.00 0.00 C ATOM 279 C LEU A 34 2.031 -5.051 -5.704 1.00 0.00 C ATOM 280 O LEU A 34 2.354 -4.063 -5.074 1.00 0.00 O ATOM 281 CB LEU A 34 0.241 -6.828 -5.092 1.00 0.00 C ATOM 282 CG LEU A 34 -0.143 -7.046 -3.619 1.00 0.00 C ATOM 283 CD1 LEU A 34 0.096 -8.475 -3.111 1.00 0.00 C ATOM 284 CD2 LEU A 34 0.504 -6.143 -2.552 1.00 0.00 C ATOM 0 H LEU A 34 -0.710 -6.060 -7.231 1.00 0.00 H new ATOM 0 HA LEU A 34 0.043 -4.689 -5.000 1.00 0.00 H new ATOM 0 HB2 LEU A 34 -0.560 -7.257 -5.694 1.00 0.00 H new ATOM 0 HB3 LEU A 34 1.134 -7.426 -5.277 1.00 0.00 H new ATOM 0 HG LEU A 34 -1.198 -6.787 -3.703 1.00 0.00 H new ATOM 0 HD11 LEU A 34 -0.201 -8.543 -2.064 1.00 0.00 H new ATOM 0 HD12 LEU A 34 -0.495 -9.175 -3.702 1.00 0.00 H new ATOM 0 HD13 LEU A 34 1.153 -8.723 -3.205 1.00 0.00 H new ATOM 0 HD21 LEU A 34 0.132 -6.421 -1.566 1.00 0.00 H new ATOM 0 HD22 LEU A 34 1.587 -6.266 -2.579 1.00 0.00 H new ATOM 0 HD23 LEU A 34 0.252 -5.102 -2.755 1.00 0.00 H new ATOM 285 N LEU A 35 2.923 -5.673 -6.536 1.00 0.00 N ATOM 286 CA LEU A 35 4.342 -5.236 -6.567 1.00 0.00 C ATOM 287 C LEU A 35 4.566 -3.792 -7.015 1.00 0.00 C ATOM 288 O LEU A 35 5.278 -3.054 -6.349 1.00 0.00 O ATOM 289 CB LEU A 35 5.269 -6.140 -7.413 1.00 0.00 C ATOM 290 CG LEU A 35 5.867 -7.355 -6.696 1.00 0.00 C ATOM 291 CD1 LEU A 35 6.803 -8.044 -7.668 1.00 0.00 C ATOM 292 CD2 LEU A 35 6.635 -6.909 -5.428 1.00 0.00 C ATOM 0 H LEU A 35 2.693 -6.443 -7.164 1.00 0.00 H new ATOM 0 HA LEU A 35 4.611 -5.321 -5.514 1.00 0.00 H new ATOM 0 HB2 LEU A 35 4.707 -6.494 -8.277 1.00 0.00 H new ATOM 0 HB3 LEU A 35 6.088 -5.530 -7.794 1.00 0.00 H new ATOM 0 HG LEU A 35 5.078 -8.038 -6.380 1.00 0.00 H new ATOM 0 HD11 LEU A 35 7.248 -8.916 -7.189 1.00 0.00 H new ATOM 0 HD12 LEU A 35 6.245 -8.359 -8.549 1.00 0.00 H new ATOM 0 HD13 LEU A 35 7.591 -7.353 -7.966 1.00 0.00 H new ATOM 0 HD21 LEU A 35 7.054 -7.783 -4.930 1.00 0.00 H new ATOM 0 HD22 LEU A 35 7.441 -6.231 -5.710 1.00 0.00 H new ATOM 0 HD23 LEU A 35 5.952 -6.398 -4.750 1.00 0.00 H new ATOM 293 N GLN A 36 3.997 -3.418 -8.146 1.00 0.00 N ATOM 294 CA GLN A 36 4.157 -2.064 -8.691 1.00 0.00 C ATOM 295 C GLN A 36 3.488 -0.920 -7.840 1.00 0.00 C ATOM 296 O GLN A 36 4.170 0.095 -7.663 1.00 0.00 O ATOM 297 CB GLN A 36 3.837 -2.228 -10.190 1.00 0.00 C ATOM 298 CG GLN A 36 4.398 -1.109 -11.104 1.00 0.00 C ATOM 299 CD GLN A 36 3.437 -0.020 -11.546 1.00 0.00 C ATOM 300 OE1 GLN A 36 3.457 0.438 -12.678 1.00 0.00 O ATOM 301 NE2 GLN A 36 2.546 0.403 -10.704 1.00 0.00 N ATOM 0 H GLN A 36 3.414 -4.031 -8.716 1.00 0.00 H new ATOM 0 HA GLN A 36 5.163 -1.654 -8.608 1.00 0.00 H new ATOM 0 HB2 GLN A 36 4.233 -3.186 -10.528 1.00 0.00 H new ATOM 0 HB3 GLN A 36 2.755 -2.269 -10.313 1.00 0.00 H new ATOM 0 HG2 GLN A 36 5.229 -0.634 -10.583 1.00 0.00 H new ATOM 0 HG3 GLN A 36 4.809 -1.579 -11.998 1.00 0.00 H new ATOM 0 HE21 GLN A 36 2.521 0.027 -9.756 1.00 0.00 H new ATOM 0 HE22 GLN A 36 1.870 1.112 -10.990 1.00 0.00 H new ATOM 302 N ILE A 37 2.304 -1.052 -7.178 1.00 0.00 N ATOM 303 CA ILE A 37 2.019 -0.201 -5.971 1.00 0.00 C ATOM 304 C ILE A 37 2.985 -0.398 -4.769 1.00 0.00 C ATOM 305 O ILE A 37 3.281 0.606 -4.178 1.00 0.00 O ATOM 306 CB ILE A 37 0.546 -0.203 -5.437 1.00 0.00 C ATOM 307 CG1 ILE A 37 0.169 1.099 -4.665 1.00 0.00 C ATOM 308 CG2 ILE A 37 0.238 -1.457 -4.598 1.00 0.00 C ATOM 309 CD1 ILE A 37 -1.307 1.211 -4.259 1.00 0.00 C ATOM 0 H ILE A 37 1.562 -1.702 -7.436 1.00 0.00 H new ATOM 0 HA ILE A 37 2.202 0.779 -6.411 1.00 0.00 H new ATOM 0 HB ILE A 37 -0.087 -0.230 -6.324 1.00 0.00 H new ATOM 0 HG12 ILE A 37 0.783 1.161 -3.766 1.00 0.00 H new ATOM 0 HG13 ILE A 37 0.425 1.958 -5.285 1.00 0.00 H new ATOM 0 HG21 ILE A 37 -0.794 -1.416 -4.248 1.00 0.00 H new ATOM 0 HG22 ILE A 37 0.379 -2.348 -5.210 1.00 0.00 H new ATOM 0 HG23 ILE A 37 0.910 -1.496 -3.741 1.00 0.00 H new ATOM 0 HD11 ILE A 37 -1.468 2.149 -3.729 1.00 0.00 H new ATOM 0 HD12 ILE A 37 -1.933 1.186 -5.151 1.00 0.00 H new ATOM 0 HD13 ILE A 37 -1.570 0.377 -3.609 1.00 0.00 H new ATOM 310 N VAL A 38 3.374 -1.595 -4.330 1.00 0.00 N ATOM 311 CA VAL A 38 4.175 -1.864 -3.089 1.00 0.00 C ATOM 312 C VAL A 38 5.635 -1.269 -3.163 1.00 0.00 C ATOM 313 O VAL A 38 6.108 -0.601 -2.246 1.00 0.00 O ATOM 314 CB VAL A 38 4.241 -3.411 -2.910 1.00 0.00 C ATOM 315 CG1 VAL A 38 5.370 -4.139 -2.166 1.00 0.00 C ATOM 316 CG2 VAL A 38 2.928 -3.975 -2.354 1.00 0.00 C ATOM 0 H VAL A 38 3.142 -2.451 -4.833 1.00 0.00 H new ATOM 0 HA VAL A 38 3.691 -1.377 -2.242 1.00 0.00 H new ATOM 0 HB VAL A 38 4.474 -3.626 -3.953 1.00 0.00 H new ATOM 0 HG11 VAL A 38 5.183 -5.213 -2.182 1.00 0.00 H new ATOM 0 HG12 VAL A 38 6.322 -3.929 -2.654 1.00 0.00 H new ATOM 0 HG13 VAL A 38 5.408 -3.792 -1.133 1.00 0.00 H new ATOM 0 HG21 VAL A 38 3.014 -5.056 -2.244 1.00 0.00 H new ATOM 0 HG22 VAL A 38 2.722 -3.526 -1.382 1.00 0.00 H new ATOM 0 HG23 VAL A 38 2.113 -3.744 -3.040 1.00 0.00 H new ATOM 317 N GLN A 39 6.328 -1.535 -4.291 1.00 0.00 N ATOM 318 CA GLN A 39 7.451 -0.721 -4.829 1.00 0.00 C ATOM 319 C GLN A 39 7.153 0.816 -4.904 1.00 0.00 C ATOM 320 O GLN A 39 7.925 1.599 -4.347 1.00 0.00 O ATOM 321 CB GLN A 39 7.806 -1.354 -6.215 1.00 0.00 C ATOM 322 CG GLN A 39 8.524 -2.735 -6.141 1.00 0.00 C ATOM 323 CD GLN A 39 8.893 -3.400 -7.469 1.00 0.00 C ATOM 324 OE1 GLN A 39 10.025 -3.799 -7.708 1.00 0.00 O ATOM 325 NE2 GLN A 39 7.959 -3.591 -8.363 1.00 0.00 N ATOM 0 H GLN A 39 6.119 -2.346 -4.874 1.00 0.00 H new ATOM 0 HA GLN A 39 8.303 -0.755 -4.150 1.00 0.00 H new ATOM 0 HB2 GLN A 39 6.888 -1.469 -6.792 1.00 0.00 H new ATOM 0 HB3 GLN A 39 8.442 -0.659 -6.763 1.00 0.00 H new ATOM 0 HG2 GLN A 39 9.437 -2.611 -5.559 1.00 0.00 H new ATOM 0 HG3 GLN A 39 7.883 -3.420 -5.586 1.00 0.00 H new ATOM 0 HE21 GLN A 39 7.008 -3.267 -8.185 1.00 0.00 H new ATOM 0 HE22 GLN A 39 8.181 -4.064 -9.239 1.00 0.00 H new ATOM 326 N ASP A 40 5.987 1.247 -5.447 1.00 0.00 N ATOM 327 CA ASP A 40 5.429 2.595 -5.110 1.00 0.00 C ATOM 328 C ASP A 40 5.242 2.979 -3.591 1.00 0.00 C ATOM 329 O ASP A 40 5.435 4.138 -3.208 1.00 0.00 O ATOM 330 CB ASP A 40 4.291 3.071 -6.047 1.00 0.00 C ATOM 331 CG ASP A 40 4.673 3.501 -7.463 1.00 0.00 C ATOM 332 OD1 ASP A 40 5.004 2.458 -8.273 1.00 0.00 O ATOM 333 OD2 ASP A 40 4.650 4.669 -7.825 1.00 0.00 O ATOM 0 H ASP A 40 5.424 0.704 -6.102 1.00 0.00 H new ATOM 0 HA ASP A 40 6.289 3.221 -5.348 1.00 0.00 H new ATOM 0 HB2 ASP A 40 3.562 2.265 -6.126 1.00 0.00 H new ATOM 0 HB3 ASP A 40 3.788 3.910 -5.565 1.00 0.00 H new ATOM 334 N ALA A 41 4.889 2.012 -2.733 1.00 0.00 N ATOM 335 CA ALA A 41 4.315 2.264 -1.403 1.00 0.00 C ATOM 336 C ALA A 41 5.380 2.506 -0.303 1.00 0.00 C ATOM 337 O ALA A 41 5.417 3.572 0.317 1.00 0.00 O ATOM 338 CB ALA A 41 3.287 1.140 -1.136 1.00 0.00 C ATOM 0 H ALA A 41 4.995 1.020 -2.945 1.00 0.00 H new ATOM 0 HA ALA A 41 3.785 3.216 -1.374 1.00 0.00 H new ATOM 0 HB1 ALA A 41 2.834 1.287 -0.156 1.00 0.00 H new ATOM 0 HB2 ALA A 41 2.512 1.166 -1.902 1.00 0.00 H new ATOM 0 HB3 ALA A 41 3.790 0.173 -1.162 1.00 0.00 H new ATOM 339 N LEU A 42 6.274 1.530 -0.128 1.00 0.00 N ATOM 340 CA LEU A 42 7.546 1.730 0.609 1.00 0.00 C ATOM 341 C LEU A 42 8.771 2.301 -0.187 1.00 0.00 C ATOM 342 O LEU A 42 9.819 2.495 0.441 1.00 0.00 O ATOM 343 CB LEU A 42 7.840 0.415 1.380 1.00 0.00 C ATOM 344 CG LEU A 42 8.013 -0.929 0.625 1.00 0.00 C ATOM 345 CD1 LEU A 42 9.276 -0.986 -0.247 1.00 0.00 C ATOM 346 CD2 LEU A 42 8.077 -2.055 1.657 1.00 0.00 C ATOM 0 H LEU A 42 6.148 0.583 -0.486 1.00 0.00 H new ATOM 0 HA LEU A 42 7.393 2.564 1.294 1.00 0.00 H new ATOM 0 HB2 LEU A 42 8.751 0.578 1.955 1.00 0.00 H new ATOM 0 HB3 LEU A 42 7.031 0.277 2.097 1.00 0.00 H new ATOM 0 HG LEU A 42 7.161 -1.034 -0.047 1.00 0.00 H new ATOM 0 HD11 LEU A 42 9.331 -1.954 -0.744 1.00 0.00 H new ATOM 0 HD12 LEU A 42 9.237 -0.195 -0.996 1.00 0.00 H new ATOM 0 HD13 LEU A 42 10.157 -0.849 0.380 1.00 0.00 H new ATOM 0 HD21 LEU A 42 8.199 -3.010 1.146 1.00 0.00 H new ATOM 0 HD22 LEU A 42 8.923 -1.890 2.324 1.00 0.00 H new ATOM 0 HD23 LEU A 42 7.155 -2.069 2.238 1.00 0.00 H new ATOM 347 N SER A 43 8.723 2.576 -1.514 1.00 0.00 N ATOM 348 CA SER A 43 9.852 3.258 -2.219 1.00 0.00 C ATOM 349 C SER A 43 9.464 4.329 -3.294 1.00 0.00 C ATOM 350 O SER A 43 10.185 4.499 -4.282 1.00 0.00 O ATOM 351 CB SER A 43 10.848 2.172 -2.709 1.00 0.00 C ATOM 352 OG SER A 43 11.465 1.519 -1.596 1.00 0.00 O ATOM 0 H SER A 43 7.932 2.343 -2.114 1.00 0.00 H new ATOM 0 HA SER A 43 10.346 3.903 -1.493 1.00 0.00 H new ATOM 0 HB2 SER A 43 10.324 1.440 -3.323 1.00 0.00 H new ATOM 0 HB3 SER A 43 11.611 2.628 -3.339 1.00 0.00 H new ATOM 0 HG SER A 43 11.068 1.848 -0.763 1.00 0.00 H new ATOM 353 N LYS A 44 8.470 5.200 -3.029 1.00 0.00 N ATOM 354 CA LYS A 44 8.578 6.646 -3.439 1.00 0.00 C ATOM 355 C LYS A 44 8.618 7.605 -2.187 1.00 0.00 C ATOM 356 O LYS A 44 8.201 7.192 -1.095 1.00 0.00 O ATOM 357 CB LYS A 44 7.525 6.919 -4.546 1.00 0.00 C ATOM 358 CG LYS A 44 7.851 6.225 -5.894 1.00 0.00 C ATOM 359 CD LYS A 44 6.952 6.614 -7.082 1.00 0.00 C ATOM 360 CE LYS A 44 7.349 7.912 -7.798 1.00 0.00 C ATOM 361 NZ LYS A 44 6.748 9.074 -7.118 1.00 0.00 N ATOM 0 H LYS A 44 7.604 4.955 -2.550 1.00 0.00 H new ATOM 0 HA LYS A 44 9.536 6.878 -3.905 1.00 0.00 H new ATOM 0 HB2 LYS A 44 6.549 6.581 -4.199 1.00 0.00 H new ATOM 0 HB3 LYS A 44 7.451 7.994 -4.709 1.00 0.00 H new ATOM 0 HG2 LYS A 44 8.885 6.450 -6.156 1.00 0.00 H new ATOM 0 HG3 LYS A 44 7.786 5.146 -5.751 1.00 0.00 H new ATOM 0 HD2 LYS A 44 6.961 5.800 -7.807 1.00 0.00 H new ATOM 0 HD3 LYS A 44 5.927 6.712 -6.725 1.00 0.00 H new ATOM 0 HE2 LYS A 44 8.434 8.011 -7.811 1.00 0.00 H new ATOM 0 HE3 LYS A 44 7.019 7.879 -8.836 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 6.790 9.903 -7.745 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 5.756 8.865 -6.885 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 7.274 9.275 -6.243 1.00 0.00 H new ATOM 362 N PRO A 45 9.274 8.813 -2.230 1.00 0.00 N ATOM 363 CA PRO A 45 8.875 9.913 -3.171 1.00 0.00 C ATOM 364 C PRO A 45 9.562 10.066 -4.567 1.00 0.00 C ATOM 365 O PRO A 45 10.688 9.627 -4.802 1.00 0.00 O ATOM 366 CB PRO A 45 9.184 11.198 -2.348 1.00 0.00 C ATOM 367 CG PRO A 45 9.212 10.761 -0.889 1.00 0.00 C ATOM 368 CD PRO A 45 9.855 9.382 -0.997 1.00 0.00 C ATOM 0 HA PRO A 45 7.849 9.697 -3.469 1.00 0.00 H new ATOM 0 HB2 PRO A 45 10.139 11.632 -2.644 1.00 0.00 H new ATOM 0 HB3 PRO A 45 8.423 11.960 -2.513 1.00 0.00 H new ATOM 0 HG2 PRO A 45 9.798 11.439 -0.269 1.00 0.00 H new ATOM 0 HG3 PRO A 45 8.213 10.715 -0.455 1.00 0.00 H new ATOM 0 HD2 PRO A 45 10.941 9.452 -1.063 1.00 0.00 H new ATOM 0 HD3 PRO A 45 9.627 8.766 -0.127 1.00 0.00 H new ATOM 369 N SER A 46 8.916 10.878 -5.420 1.00 0.00 N ATOM 370 CA SER A 46 9.632 11.785 -6.362 1.00 0.00 C ATOM 371 C SER A 46 9.442 13.269 -5.868 1.00 0.00 C ATOM 372 O SER A 46 8.285 13.694 -5.792 1.00 0.00 O ATOM 373 CB SER A 46 9.072 11.637 -7.794 1.00 0.00 C ATOM 374 OG SER A 46 9.281 10.328 -8.315 1.00 0.00 O ATOM 0 H SER A 46 7.899 10.932 -5.484 1.00 0.00 H new ATOM 0 HA SER A 46 10.690 11.524 -6.382 1.00 0.00 H new ATOM 0 HB2 SER A 46 8.005 11.860 -7.791 1.00 0.00 H new ATOM 0 HB3 SER A 46 9.549 12.368 -8.447 1.00 0.00 H new ATOM 0 HG SER A 46 8.912 10.274 -9.221 1.00 0.00 H new ATOM 375 N PRO A 47 10.470 14.105 -5.527 1.00 0.00 N ATOM 376 CA PRO A 47 10.258 15.516 -5.064 1.00 0.00 C ATOM 377 C PRO A 47 9.341 16.459 -5.930 1.00 0.00 C ATOM 378 O PRO A 47 9.763 16.948 -6.979 1.00 0.00 O ATOM 379 CB PRO A 47 11.715 16.012 -4.952 1.00 0.00 C ATOM 380 CG PRO A 47 12.533 14.766 -4.613 1.00 0.00 C ATOM 381 CD PRO A 47 11.877 13.665 -5.445 1.00 0.00 C ATOM 0 HA PRO A 47 9.670 15.540 -4.146 1.00 0.00 H new ATOM 0 HB2 PRO A 47 12.051 16.463 -5.886 1.00 0.00 H new ATOM 0 HB3 PRO A 47 11.815 16.772 -4.177 1.00 0.00 H new ATOM 0 HG2 PRO A 47 13.584 14.893 -4.874 1.00 0.00 H new ATOM 0 HG3 PRO A 47 12.495 14.539 -3.547 1.00 0.00 H new ATOM 0 HD2 PRO A 47 12.332 13.580 -6.432 1.00 0.00 H new ATOM 0 HD3 PRO A 47 11.968 12.690 -4.967 1.00 0.00 H new ATOM 382 N VAL A 48 8.087 16.652 -5.469 1.00 0.00 N ATOM 383 CA VAL A 48 6.968 17.371 -6.200 1.00 0.00 C ATOM 384 C VAL A 48 7.351 18.466 -7.280 1.00 0.00 C ATOM 385 O VAL A 48 7.880 19.520 -6.926 1.00 0.00 O ATOM 386 CB VAL A 48 5.939 18.031 -5.195 1.00 0.00 C ATOM 387 CG1 VAL A 48 4.593 18.459 -5.839 1.00 0.00 C ATOM 388 CG2 VAL A 48 5.500 17.201 -3.970 1.00 0.00 C ATOM 0 H VAL A 48 7.794 16.310 -4.554 1.00 0.00 H new ATOM 0 HA VAL A 48 6.540 16.545 -6.767 1.00 0.00 H new ATOM 0 HB VAL A 48 6.558 18.870 -4.878 1.00 0.00 H new ATOM 0 HG11 VAL A 48 3.950 18.901 -5.078 1.00 0.00 H new ATOM 0 HG12 VAL A 48 4.782 19.191 -6.624 1.00 0.00 H new ATOM 0 HG13 VAL A 48 4.101 17.586 -6.268 1.00 0.00 H new ATOM 0 HG21 VAL A 48 4.795 17.779 -3.372 1.00 0.00 H new ATOM 0 HG22 VAL A 48 5.021 16.281 -4.306 1.00 0.00 H new ATOM 0 HG23 VAL A 48 6.373 16.955 -3.365 1.00 0.00 H new ATOM 389 N THR A 49 7.092 18.424 -8.593 1.00 0.00 N ATOM 390 CA THR A 49 6.629 17.238 -9.392 1.00 0.00 C ATOM 391 C THR A 49 5.190 16.691 -9.071 1.00 0.00 C ATOM 392 O THR A 49 4.291 17.395 -8.614 1.00 0.00 O ATOM 393 CB THR A 49 7.841 16.262 -9.680 1.00 0.00 C ATOM 394 OG1 THR A 49 7.797 15.837 -11.036 1.00 0.00 O ATOM 395 CG2 THR A 49 7.937 14.961 -8.865 1.00 0.00 C ATOM 0 H THR A 49 7.200 19.253 -9.177 1.00 0.00 H new ATOM 0 HA THR A 49 6.342 17.556 -10.394 1.00 0.00 H new ATOM 0 HB THR A 49 8.696 16.877 -9.398 1.00 0.00 H new ATOM 0 HG1 THR A 49 8.549 15.234 -11.214 1.00 0.00 H new ATOM 0 HG21 THR A 49 8.818 14.401 -9.177 1.00 0.00 H new ATOM 0 HG22 THR A 49 8.016 15.201 -7.805 1.00 0.00 H new ATOM 0 HG23 THR A 49 7.045 14.358 -9.035 1.00 0.00 H new ATOM 396 N GLY A 50 4.984 15.409 -9.307 1.00 0.00 N ATOM 397 CA GLY A 50 4.269 14.537 -8.339 1.00 0.00 C ATOM 398 C GLY A 50 5.088 13.276 -7.913 1.00 0.00 C ATOM 399 O GLY A 50 5.610 12.548 -8.751 1.00 0.00 O ATOM 0 H GLY A 50 5.293 14.931 -10.153 1.00 0.00 H new ATOM 0 HA2 GLY A 50 4.024 15.119 -7.450 1.00 0.00 H new ATOM 0 HA3 GLY A 50 3.325 14.216 -8.780 1.00 0.00 H new ATOM 400 N TYR A 51 5.269 12.870 -6.653 1.00 0.00 N ATOM 401 CA TYR A 51 4.830 13.618 -5.444 1.00 0.00 C ATOM 402 C TYR A 51 5.702 13.265 -4.166 1.00 0.00 C ATOM 403 O TYR A 51 6.490 12.317 -4.133 1.00 0.00 O ATOM 404 CB TYR A 51 3.315 13.400 -5.103 1.00 0.00 C ATOM 405 CG TYR A 51 2.124 13.361 -6.092 1.00 0.00 C ATOM 406 CD1 TYR A 51 2.023 12.391 -7.095 1.00 0.00 C ATOM 407 CD2 TYR A 51 1.026 14.204 -5.881 1.00 0.00 C ATOM 408 CE1 TYR A 51 0.927 12.342 -7.932 1.00 0.00 C ATOM 409 CE2 TYR A 51 -0.099 14.122 -6.687 1.00 0.00 C ATOM 410 CZ TYR A 51 -0.135 13.221 -7.741 1.00 0.00 C ATOM 411 OH TYR A 51 -1.222 13.195 -8.567 1.00 0.00 O ATOM 0 H TYR A 51 5.735 11.992 -6.427 1.00 0.00 H new ATOM 0 HA TYR A 51 4.978 14.667 -5.699 1.00 0.00 H new ATOM 0 HB2 TYR A 51 3.275 12.451 -4.568 1.00 0.00 H new ATOM 0 HB3 TYR A 51 3.067 14.182 -4.385 1.00 0.00 H new ATOM 0 HD1 TYR A 51 2.816 11.668 -7.216 1.00 0.00 H new ATOM 0 HD2 TYR A 51 1.056 14.928 -5.080 1.00 0.00 H new ATOM 0 HE1 TYR A 51 0.893 11.621 -8.736 1.00 0.00 H new ATOM 0 HE2 TYR A 51 -0.948 14.760 -6.494 1.00 0.00 H new ATOM 0 HH TYR A 51 -1.865 13.878 -8.283 1.00 0.00 H new ATOM 412 N ARG A 52 5.480 13.996 -3.060 1.00 0.00 N ATOM 413 CA ARG A 52 5.928 13.580 -1.681 1.00 0.00 C ATOM 414 C ARG A 52 4.800 12.825 -0.872 1.00 0.00 C ATOM 415 O ARG A 52 3.833 12.363 -1.477 1.00 0.00 O ATOM 416 CB ARG A 52 6.549 14.841 -1.012 1.00 0.00 C ATOM 417 CG ARG A 52 7.682 14.570 0.015 1.00 0.00 C ATOM 418 CD ARG A 52 8.278 15.852 0.635 1.00 0.00 C ATOM 419 NE ARG A 52 8.968 16.708 -0.370 1.00 0.00 N ATOM 420 CZ ARG A 52 10.244 16.637 -0.727 1.00 0.00 C ATOM 421 NH1 ARG A 52 11.095 15.778 -0.251 1.00 0.00 N ATOM 422 NH2 ARG A 52 10.658 17.483 -1.601 1.00 0.00 N ATOM 0 H ARG A 52 4.989 14.890 -3.075 1.00 0.00 H new ATOM 0 HA ARG A 52 6.701 12.812 -1.716 1.00 0.00 H new ATOM 0 HB2 ARG A 52 6.941 15.489 -1.796 1.00 0.00 H new ATOM 0 HB3 ARG A 52 5.754 15.393 -0.511 1.00 0.00 H new ATOM 0 HG2 ARG A 52 7.293 13.938 0.813 1.00 0.00 H new ATOM 0 HG3 ARG A 52 8.478 14.010 -0.475 1.00 0.00 H new ATOM 0 HD2 ARG A 52 7.482 16.425 1.110 1.00 0.00 H new ATOM 0 HD3 ARG A 52 8.984 15.578 1.419 1.00 0.00 H new ATOM 0 HE ARG A 52 8.402 17.421 -0.830 1.00 0.00 H new ATOM 0 HH11 ARG A 52 10.796 15.097 0.447 1.00 0.00 H new ATOM 0 HH12 ARG A 52 12.062 15.785 -0.575 1.00 0.00 H new ATOM 0 HH21 ARG A 52 10.013 18.171 -1.990 1.00 0.00 H new ATOM 0 HH22 ARG A 52 11.631 17.466 -1.906 1.00 0.00 H new ATOM 423 N ASN A 53 4.865 12.660 0.470 1.00 0.00 N ATOM 424 CA ASN A 53 3.830 11.897 1.265 1.00 0.00 C ATOM 425 C ASN A 53 4.079 10.355 1.178 1.00 0.00 C ATOM 426 O ASN A 53 5.171 9.900 1.513 1.00 0.00 O ATOM 427 CB ASN A 53 2.378 12.442 1.128 1.00 0.00 C ATOM 428 CG ASN A 53 2.185 13.978 1.268 1.00 0.00 C ATOM 429 OD1 ASN A 53 1.290 14.556 0.679 1.00 0.00 O ATOM 430 ND2 ASN A 53 2.926 14.722 2.047 1.00 0.00 N ATOM 0 H ASN A 53 5.620 13.040 1.041 1.00 0.00 H new ATOM 0 HA ASN A 53 3.971 12.104 2.326 1.00 0.00 H new ATOM 0 HB2 ASN A 53 1.993 12.140 0.154 1.00 0.00 H new ATOM 0 HB3 ASN A 53 1.760 11.953 1.881 1.00 0.00 H new ATOM 0 HD21 ASN A 53 2.736 15.721 2.130 1.00 0.00 H new ATOM 0 HD22 ASN A 53 3.694 14.304 2.571 1.00 0.00 H new ATOM 431 N ASP A 54 3.030 9.536 1.003 1.00 0.00 N ATOM 432 CA ASP A 54 2.438 8.764 2.140 1.00 0.00 C ATOM 433 C ASP A 54 2.899 9.182 3.573 1.00 0.00 C ATOM 434 O ASP A 54 3.697 8.503 4.215 1.00 0.00 O ATOM 435 CB ASP A 54 2.439 7.233 1.922 1.00 0.00 C ATOM 436 CG ASP A 54 3.761 6.546 1.540 1.00 0.00 C ATOM 437 OD1 ASP A 54 4.880 6.994 1.754 1.00 0.00 O ATOM 438 OD2 ASP A 54 3.544 5.331 0.978 1.00 0.00 O ATOM 0 H ASP A 54 2.570 9.383 0.105 1.00 0.00 H new ATOM 0 HA ASP A 54 1.394 9.076 2.115 1.00 0.00 H new ATOM 0 HB2 ASP A 54 2.077 6.768 2.839 1.00 0.00 H new ATOM 0 HB3 ASP A 54 1.712 7.009 1.142 1.00 0.00 H new ATOM 439 N ALA A 55 2.506 10.392 4.019 1.00 0.00 N ATOM 440 CA ALA A 55 3.294 11.129 5.018 1.00 0.00 C ATOM 441 C ALA A 55 3.016 10.747 6.489 1.00 0.00 C ATOM 442 O ALA A 55 3.724 9.953 7.091 1.00 0.00 O ATOM 443 CB ALA A 55 3.235 12.657 4.687 1.00 0.00 C ATOM 0 H ALA A 55 1.661 10.871 3.707 1.00 0.00 H new ATOM 0 HA ALA A 55 4.334 10.814 4.934 1.00 0.00 H new ATOM 0 HB1 ALA A 55 3.817 13.211 5.423 1.00 0.00 H new ATOM 0 HB2 ALA A 55 3.648 12.830 3.693 1.00 0.00 H new ATOM 0 HB3 ALA A 55 2.199 12.995 4.714 1.00 0.00 H new ATOM 444 N GLU A 56 2.077 11.427 7.115 1.00 0.00 N ATOM 445 CA GLU A 56 0.629 11.125 6.994 1.00 0.00 C ATOM 446 C GLU A 56 0.091 9.675 6.768 1.00 0.00 C ATOM 447 O GLU A 56 -0.623 9.110 7.596 1.00 0.00 O ATOM 448 CB GLU A 56 0.070 12.195 5.991 1.00 0.00 C ATOM 449 CG GLU A 56 0.187 13.677 6.443 1.00 0.00 C ATOM 450 CD GLU A 56 -0.692 14.682 5.702 1.00 0.00 C ATOM 451 OE1 GLU A 56 -1.838 14.958 6.027 1.00 0.00 O ATOM 452 OE2 GLU A 56 -0.065 15.233 4.628 1.00 0.00 O ATOM 0 H GLU A 56 2.279 12.214 7.731 1.00 0.00 H new ATOM 0 HA GLU A 56 0.232 11.186 8.007 1.00 0.00 H new ATOM 0 HB2 GLU A 56 0.593 12.083 5.042 1.00 0.00 H new ATOM 0 HB3 GLU A 56 -0.981 11.975 5.804 1.00 0.00 H new ATOM 0 HG2 GLU A 56 -0.053 13.731 7.505 1.00 0.00 H new ATOM 0 HG3 GLU A 56 1.226 13.987 6.335 1.00 0.00 H new ATOM 453 N ARG A 57 0.422 9.059 5.646 1.00 0.00 N ATOM 454 CA ARG A 57 -0.040 7.699 5.292 1.00 0.00 C ATOM 455 C ARG A 57 0.874 6.553 5.772 1.00 0.00 C ATOM 456 O ARG A 57 0.406 5.643 6.459 1.00 0.00 O ATOM 457 CB ARG A 57 -0.682 7.734 3.882 1.00 0.00 C ATOM 458 CG ARG A 57 -2.231 7.833 3.926 1.00 0.00 C ATOM 459 CD ARG A 57 -2.679 9.073 4.733 1.00 0.00 C ATOM 460 NE ARG A 57 -4.039 9.505 4.319 1.00 0.00 N ATOM 461 CZ ARG A 57 -5.176 9.163 4.901 1.00 0.00 C ATOM 462 NH1 ARG A 57 -5.250 8.378 5.927 1.00 0.00 N ATOM 463 NH2 ARG A 57 -6.265 9.646 4.419 1.00 0.00 N ATOM 0 H ARG A 57 1.024 9.480 4.939 1.00 0.00 H new ATOM 0 HA ARG A 57 -0.876 7.360 5.904 1.00 0.00 H new ATOM 0 HB2 ARG A 57 -0.284 8.584 3.328 1.00 0.00 H new ATOM 0 HB3 ARG A 57 -0.396 6.835 3.335 1.00 0.00 H new ATOM 0 HG2 ARG A 57 -2.625 7.892 2.911 1.00 0.00 H new ATOM 0 HG3 ARG A 57 -2.645 6.931 4.377 1.00 0.00 H new ATOM 0 HD2 ARG A 57 -2.674 8.841 5.798 1.00 0.00 H new ATOM 0 HD3 ARG A 57 -1.971 9.888 4.581 1.00 0.00 H new ATOM 0 HE ARG A 57 -4.101 10.123 3.510 1.00 0.00 H new ATOM 0 HH11 ARG A 57 -4.400 7.986 6.331 1.00 0.00 H new ATOM 0 HH12 ARG A 57 -6.159 8.152 6.331 1.00 0.00 H new ATOM 0 HH21 ARG A 57 -6.233 10.271 3.614 1.00 0.00 H new ATOM 0 HH22 ARG A 57 -7.161 9.404 4.842 1.00 0.00 H new ATOM 464 N LEU A 58 2.195 6.629 5.631 1.00 0.00 N ATOM 465 CA LEU A 58 3.086 5.758 6.448 1.00 0.00 C ATOM 466 C LEU A 58 3.395 6.331 7.916 1.00 0.00 C ATOM 467 O LEU A 58 3.800 5.595 8.825 1.00 0.00 O ATOM 468 CB LEU A 58 4.079 5.094 5.440 1.00 0.00 C ATOM 469 CG LEU A 58 3.434 4.296 4.224 1.00 0.00 C ATOM 470 CD1 LEU A 58 4.432 3.492 3.389 1.00 0.00 C ATOM 471 CD2 LEU A 58 2.180 3.455 4.483 1.00 0.00 C ATOM 0 H LEU A 58 2.675 7.257 4.986 1.00 0.00 H new ATOM 0 HA LEU A 58 2.689 4.865 6.931 1.00 0.00 H new ATOM 0 HB2 LEU A 58 4.723 5.874 5.032 1.00 0.00 H new ATOM 0 HB3 LEU A 58 4.720 4.409 5.995 1.00 0.00 H new ATOM 0 HG LEU A 58 3.078 5.149 3.647 1.00 0.00 H new ATOM 0 HD11 LEU A 58 3.904 2.981 2.584 1.00 0.00 H new ATOM 0 HD12 LEU A 58 5.177 4.165 2.965 1.00 0.00 H new ATOM 0 HD13 LEU A 58 4.927 2.756 4.023 1.00 0.00 H new ATOM 0 HD21 LEU A 58 1.866 2.976 3.556 1.00 0.00 H new ATOM 0 HD22 LEU A 58 2.401 2.692 5.229 1.00 0.00 H new ATOM 0 HD23 LEU A 58 1.380 4.098 4.848 1.00 0.00 H new ATOM 472 N ALA A 59 2.873 7.529 8.289 1.00 0.00 N ATOM 473 CA ALA A 59 2.363 7.784 9.664 1.00 0.00 C ATOM 474 C ALA A 59 1.118 6.969 10.114 1.00 0.00 C ATOM 475 O ALA A 59 1.034 6.629 11.295 1.00 0.00 O ATOM 476 CB ALA A 59 1.969 9.244 9.770 1.00 0.00 C ATOM 0 H ALA A 59 2.794 8.329 7.662 1.00 0.00 H new ATOM 0 HA ALA A 59 3.185 7.478 10.310 1.00 0.00 H new ATOM 0 HB1 ALA A 59 1.593 9.447 10.773 1.00 0.00 H new ATOM 0 HB2 ALA A 59 2.839 9.871 9.575 1.00 0.00 H new ATOM 0 HB3 ALA A 59 1.191 9.465 9.039 1.00 0.00 H new ATOM 477 N ASP A 60 0.186 6.580 9.220 1.00 0.00 N ATOM 478 CA ASP A 60 -0.658 5.382 9.511 1.00 0.00 C ATOM 479 C ASP A 60 0.078 3.997 9.609 1.00 0.00 C ATOM 480 O ASP A 60 -0.444 3.033 10.174 1.00 0.00 O ATOM 481 CB ASP A 60 -1.718 5.229 8.434 1.00 0.00 C ATOM 482 CG ASP A 60 -3.136 4.979 8.895 1.00 0.00 C ATOM 483 OD1 ASP A 60 -3.321 3.696 9.310 1.00 0.00 O ATOM 484 OD2 ASP A 60 -4.009 5.836 8.893 1.00 0.00 O ATOM 0 H ASP A 60 -0.003 7.044 8.332 1.00 0.00 H new ATOM 0 HA ASP A 60 -1.054 5.595 10.504 1.00 0.00 H new ATOM 0 HB2 ASP A 60 -1.715 6.133 7.825 1.00 0.00 H new ATOM 0 HB3 ASP A 60 -1.423 4.405 7.784 1.00 0.00 H new ATOM 485 N GLU A 61 1.292 3.883 9.060 1.00 0.00 N ATOM 486 CA GLU A 61 2.249 2.894 9.633 1.00 0.00 C ATOM 487 C GLU A 61 2.489 3.122 11.158 1.00 0.00 C ATOM 488 O GLU A 61 2.163 2.202 11.909 1.00 0.00 O ATOM 489 CB GLU A 61 3.455 2.611 8.702 1.00 0.00 C ATOM 490 CG GLU A 61 4.876 2.472 9.304 1.00 0.00 C ATOM 491 CD GLU A 61 5.762 1.641 8.399 1.00 0.00 C ATOM 492 OE1 GLU A 61 5.792 0.417 8.442 1.00 0.00 O ATOM 493 OE2 GLU A 61 6.418 2.390 7.478 1.00 0.00 O ATOM 0 H GLU A 61 1.635 4.423 8.265 1.00 0.00 H new ATOM 0 HA GLU A 61 1.791 1.905 9.646 1.00 0.00 H new ATOM 0 HB2 GLU A 61 3.239 1.689 8.161 1.00 0.00 H new ATOM 0 HB3 GLU A 61 3.491 3.412 7.964 1.00 0.00 H new ATOM 0 HG2 GLU A 61 5.315 3.460 9.444 1.00 0.00 H new ATOM 0 HG3 GLU A 61 4.816 2.008 10.288 1.00 0.00 H new ATOM 494 N GLN A 62 2.827 4.341 11.654 1.00 0.00 N ATOM 495 CA GLN A 62 2.855 4.602 13.104 1.00 0.00 C ATOM 496 C GLN A 62 1.524 4.198 13.810 1.00 0.00 C ATOM 497 O GLN A 62 1.552 3.223 14.547 1.00 0.00 O ATOM 498 CB GLN A 62 3.360 6.052 13.381 1.00 0.00 C ATOM 499 CG GLN A 62 4.763 6.114 14.037 1.00 0.00 C ATOM 500 CD GLN A 62 4.825 5.668 15.500 1.00 0.00 C ATOM 501 OE1 GLN A 62 4.992 6.462 16.416 1.00 0.00 O ATOM 502 NE2 GLN A 62 4.671 4.398 15.776 1.00 0.00 N ATOM 0 H GLN A 62 3.079 5.142 11.076 1.00 0.00 H new ATOM 0 HA GLN A 62 3.586 3.945 13.575 1.00 0.00 H new ATOM 0 HB2 GLN A 62 3.385 6.603 12.441 1.00 0.00 H new ATOM 0 HB3 GLN A 62 2.644 6.558 14.029 1.00 0.00 H new ATOM 0 HG2 GLN A 62 5.445 5.492 13.456 1.00 0.00 H new ATOM 0 HG3 GLN A 62 5.131 7.138 13.971 1.00 0.00 H new ATOM 0 HE21 GLN A 62 4.531 3.726 15.022 1.00 0.00 H new ATOM 0 HE22 GLN A 62 4.691 4.081 16.745 1.00 0.00 H new ATOM 503 N SER A 63 0.374 4.811 13.504 1.00 0.00 N ATOM 504 CA SER A 63 -0.997 4.277 13.836 1.00 0.00 C ATOM 505 C SER A 63 -1.238 2.753 14.134 1.00 0.00 C ATOM 506 O SER A 63 -1.870 2.376 15.121 1.00 0.00 O ATOM 507 CB SER A 63 -1.930 4.553 12.672 1.00 0.00 C ATOM 508 OG SER A 63 -2.336 5.919 12.535 1.00 0.00 O ATOM 0 H SER A 63 0.345 5.704 13.013 1.00 0.00 H new ATOM 0 HA SER A 63 -1.164 4.792 14.782 1.00 0.00 H new ATOM 0 HB2 SER A 63 -1.439 4.241 11.750 1.00 0.00 H new ATOM 0 HB3 SER A 63 -2.820 3.934 12.784 1.00 0.00 H new ATOM 0 HG SER A 63 -3.151 5.965 11.993 1.00 0.00 H new ATOM 509 N GLU A 64 -0.819 1.921 13.188 1.00 0.00 N ATOM 510 CA GLU A 64 -0.951 0.451 13.262 1.00 0.00 C ATOM 511 C GLU A 64 0.175 -0.251 14.131 1.00 0.00 C ATOM 512 O GLU A 64 0.050 -1.421 14.501 1.00 0.00 O ATOM 513 CB GLU A 64 -1.173 0.125 11.744 1.00 0.00 C ATOM 514 CG GLU A 64 -2.600 0.445 11.200 1.00 0.00 C ATOM 515 CD GLU A 64 -2.833 0.103 9.731 1.00 0.00 C ATOM 516 OE1 GLU A 64 -1.926 0.691 8.906 1.00 0.00 O ATOM 517 OE2 GLU A 64 -3.725 -0.640 9.335 1.00 0.00 O ATOM 0 H GLU A 64 -0.370 2.243 12.331 1.00 0.00 H new ATOM 0 HA GLU A 64 -1.767 0.024 13.845 1.00 0.00 H new ATOM 0 HB2 GLU A 64 -0.444 0.684 11.158 1.00 0.00 H new ATOM 0 HB3 GLU A 64 -0.968 -0.933 11.582 1.00 0.00 H new ATOM 0 HG2 GLU A 64 -3.330 -0.097 11.802 1.00 0.00 H new ATOM 0 HG3 GLU A 64 -2.795 1.508 11.343 1.00 0.00 H new ATOM 518 N LEU A 65 1.228 0.479 14.544 1.00 0.00 N ATOM 519 CA LEU A 65 2.043 0.249 15.773 1.00 0.00 C ATOM 520 C LEU A 65 1.723 1.264 16.977 1.00 0.00 C ATOM 521 O LEU A 65 2.562 1.483 17.852 1.00 0.00 O ATOM 522 CB LEU A 65 3.562 0.193 15.326 1.00 0.00 C ATOM 523 CG LEU A 65 4.035 0.974 14.060 1.00 0.00 C ATOM 524 CD1 LEU A 65 5.445 1.547 14.057 1.00 0.00 C ATOM 525 CD2 LEU A 65 3.859 0.152 12.775 1.00 0.00 C ATOM 0 H LEU A 65 1.557 1.285 14.012 1.00 0.00 H new ATOM 0 HA LEU A 65 1.772 -0.705 16.226 1.00 0.00 H new ATOM 0 HB2 LEU A 65 4.160 0.546 16.166 1.00 0.00 H new ATOM 0 HB3 LEU A 65 3.816 -0.856 15.173 1.00 0.00 H new ATOM 0 HG LEU A 65 3.369 1.836 14.096 1.00 0.00 H new ATOM 0 HD11 LEU A 65 5.627 2.060 13.113 1.00 0.00 H new ATOM 0 HD12 LEU A 65 5.553 2.253 14.880 1.00 0.00 H new ATOM 0 HD13 LEU A 65 6.167 0.739 14.176 1.00 0.00 H new ATOM 0 HD21 LEU A 65 4.201 0.735 11.920 1.00 0.00 H new ATOM 0 HD22 LEU A 65 4.444 -0.765 12.846 1.00 0.00 H new ATOM 0 HD23 LEU A 65 2.806 -0.099 12.645 1.00 0.00 H new ATOM 526 N VAL A 66 0.503 1.854 17.045 1.00 0.00 N ATOM 527 CA VAL A 66 0.137 3.041 17.928 1.00 0.00 C ATOM 528 C VAL A 66 -1.264 2.886 18.621 1.00 0.00 C ATOM 529 O VAL A 66 -1.344 2.886 19.851 1.00 0.00 O ATOM 530 CB VAL A 66 0.261 4.341 17.035 1.00 0.00 C ATOM 531 CG1 VAL A 66 -0.598 5.616 17.023 1.00 0.00 C ATOM 532 CG2 VAL A 66 1.675 4.855 16.904 1.00 0.00 C ATOM 0 H VAL A 66 -0.284 1.528 16.485 1.00 0.00 H new ATOM 0 HA VAL A 66 0.825 3.108 18.771 1.00 0.00 H new ATOM 0 HB VAL A 66 -0.236 3.764 16.255 1.00 0.00 H new ATOM 0 HG11 VAL A 66 -0.215 6.305 16.270 1.00 0.00 H new ATOM 0 HG12 VAL A 66 -1.630 5.357 16.787 1.00 0.00 H new ATOM 0 HG13 VAL A 66 -0.558 6.091 18.003 1.00 0.00 H new ATOM 0 HG21 VAL A 66 1.681 5.747 16.278 1.00 0.00 H new ATOM 0 HG22 VAL A 66 2.065 5.102 17.891 1.00 0.00 H new ATOM 0 HG23 VAL A 66 2.300 4.088 16.448 1.00 0.00 H new TER 533 VAL A 66 ATOM 534 N ALA B 1 -10.787 -18.429 -3.370 1.00 0.00 N ATOM 535 CA ALA B 1 -11.801 -18.672 -2.306 1.00 0.00 C ATOM 536 C ALA B 1 -13.004 -17.676 -2.197 1.00 0.00 C ATOM 537 O ALA B 1 -14.067 -18.066 -1.711 1.00 0.00 O ATOM 538 CB ALA B 1 -11.022 -18.774 -0.984 1.00 0.00 C ATOM 0 H1 ALA B 1 -10.052 -19.163 -3.323 1.00 0.00 H new ATOM 0 H2 ALA B 1 -11.248 -18.459 -4.302 1.00 0.00 H new ATOM 0 H3 ALA B 1 -10.352 -17.495 -3.228 1.00 0.00 H new ATOM 0 HA ALA B 1 -12.325 -19.589 -2.575 1.00 0.00 H new ATOM 0 HB1 ALA B 1 -11.718 -18.953 -0.164 1.00 0.00 H new ATOM 0 HB2 ALA B 1 -10.311 -19.598 -1.043 1.00 0.00 H new ATOM 0 HB3 ALA B 1 -10.484 -17.843 -0.806 1.00 0.00 H new ATOM 539 N ARG B 2 -12.847 -16.407 -2.612 1.00 0.00 N ATOM 540 CA ARG B 2 -13.966 -15.403 -2.695 1.00 0.00 C ATOM 541 C ARG B 2 -14.686 -14.981 -1.364 1.00 0.00 C ATOM 542 O ARG B 2 -15.879 -14.672 -1.321 1.00 0.00 O ATOM 543 CB ARG B 2 -14.942 -15.741 -3.856 1.00 0.00 C ATOM 544 CG ARG B 2 -14.317 -15.901 -5.265 1.00 0.00 C ATOM 545 CD ARG B 2 -13.813 -14.607 -5.936 1.00 0.00 C ATOM 546 NE ARG B 2 -12.442 -14.253 -5.472 1.00 0.00 N ATOM 547 CZ ARG B 2 -11.651 -13.349 -6.036 1.00 0.00 C ATOM 548 NH1 ARG B 2 -11.974 -12.622 -7.063 1.00 0.00 N ATOM 549 NH2 ARG B 2 -10.478 -13.197 -5.541 1.00 0.00 N ATOM 0 H ARG B 2 -11.945 -16.030 -2.904 1.00 0.00 H new ATOM 0 HA ARG B 2 -13.448 -14.473 -2.929 1.00 0.00 H new ATOM 0 HB2 ARG B 2 -15.460 -16.667 -3.606 1.00 0.00 H new ATOM 0 HB3 ARG B 2 -15.697 -14.956 -3.906 1.00 0.00 H new ATOM 0 HG2 ARG B 2 -13.482 -16.597 -5.192 1.00 0.00 H new ATOM 0 HG3 ARG B 2 -15.059 -16.360 -5.919 1.00 0.00 H new ATOM 0 HD2 ARG B 2 -13.811 -14.734 -7.019 1.00 0.00 H new ATOM 0 HD3 ARG B 2 -14.497 -13.789 -5.712 1.00 0.00 H new ATOM 0 HE ARG B 2 -12.082 -14.746 -4.654 1.00 0.00 H new ATOM 0 HH11 ARG B 2 -12.893 -12.726 -7.493 1.00 0.00 H new ATOM 0 HH12 ARG B 2 -11.309 -11.947 -7.439 1.00 0.00 H new ATOM 0 HH21 ARG B 2 -10.184 -13.761 -4.743 1.00 0.00 H new ATOM 0 HH22 ARG B 2 -9.839 -12.513 -5.945 1.00 0.00 H new ATOM 550 N ASP B 3 -13.890 -14.861 -0.299 1.00 0.00 N ATOM 551 CA ASP B 3 -14.260 -14.169 0.969 1.00 0.00 C ATOM 552 C ASP B 3 -13.000 -13.762 1.806 1.00 0.00 C ATOM 553 O ASP B 3 -12.923 -12.668 2.359 1.00 0.00 O ATOM 554 CB ASP B 3 -15.304 -14.979 1.791 1.00 0.00 C ATOM 555 CG ASP B 3 -15.952 -14.201 2.934 1.00 0.00 C ATOM 556 OD1 ASP B 3 -16.945 -13.498 2.787 1.00 0.00 O ATOM 557 OD2 ASP B 3 -15.294 -14.367 4.118 1.00 0.00 O ATOM 0 H ASP B 3 -12.946 -15.246 -0.279 1.00 0.00 H new ATOM 0 HA ASP B 3 -14.752 -13.235 0.696 1.00 0.00 H new ATOM 0 HB2 ASP B 3 -16.086 -15.329 1.117 1.00 0.00 H new ATOM 0 HB3 ASP B 3 -14.817 -15.864 2.201 1.00 0.00 H new ATOM 558 N ASP B 4 -12.006 -14.643 1.894 1.00 0.00 N ATOM 559 CA ASP B 4 -10.601 -14.256 2.179 1.00 0.00 C ATOM 560 C ASP B 4 -9.596 -15.077 1.297 1.00 0.00 C ATOM 561 O ASP B 4 -9.001 -16.045 1.780 1.00 0.00 O ATOM 562 CB ASP B 4 -10.359 -14.235 3.704 1.00 0.00 C ATOM 563 CG ASP B 4 -10.712 -15.479 4.526 1.00 0.00 C ATOM 564 OD1 ASP B 4 -9.992 -16.577 4.165 1.00 0.00 O ATOM 565 OD2 ASP B 4 -11.574 -15.477 5.399 1.00 0.00 O ATOM 0 H ASP B 4 -12.138 -15.647 1.772 1.00 0.00 H new ATOM 0 HA ASP B 4 -10.403 -13.230 1.868 1.00 0.00 H new ATOM 0 HB2 ASP B 4 -9.303 -14.021 3.867 1.00 0.00 H new ATOM 0 HB3 ASP B 4 -10.922 -13.397 4.116 1.00 0.00 H new ATOM 566 N PRO B 5 -9.392 -14.731 -0.005 1.00 0.00 N ATOM 567 CA PRO B 5 -8.460 -15.454 -0.909 1.00 0.00 C ATOM 568 C PRO B 5 -6.940 -15.304 -0.618 1.00 0.00 C ATOM 569 O PRO B 5 -6.410 -14.207 -0.415 1.00 0.00 O ATOM 570 CB PRO B 5 -8.852 -14.881 -2.286 1.00 0.00 C ATOM 571 CG PRO B 5 -9.347 -13.481 -1.938 1.00 0.00 C ATOM 572 CD PRO B 5 -10.157 -13.677 -0.692 1.00 0.00 C ATOM 0 HA PRO B 5 -8.569 -16.533 -0.799 1.00 0.00 H new ATOM 0 HB2 PRO B 5 -8.003 -14.852 -2.969 1.00 0.00 H new ATOM 0 HB3 PRO B 5 -9.628 -15.477 -2.767 1.00 0.00 H new ATOM 0 HG2 PRO B 5 -8.517 -12.795 -1.770 1.00 0.00 H new ATOM 0 HG3 PRO B 5 -9.950 -13.060 -2.743 1.00 0.00 H new ATOM 0 HD2 PRO B 5 -10.223 -12.765 -0.098 1.00 0.00 H new ATOM 0 HD3 PRO B 5 -11.178 -13.989 -0.912 1.00 0.00 H new ATOM 573 N HIS B 6 -6.263 -16.451 -0.706 1.00 0.00 N ATOM 574 CA HIS B 6 -4.790 -16.537 -0.809 1.00 0.00 C ATOM 575 C HIS B 6 -4.282 -16.194 -2.262 1.00 0.00 C ATOM 576 O HIS B 6 -4.799 -16.738 -3.246 1.00 0.00 O ATOM 577 CB HIS B 6 -4.389 -18.011 -0.503 1.00 0.00 C ATOM 578 CG HIS B 6 -4.583 -18.494 0.929 1.00 0.00 C ATOM 579 ND1 HIS B 6 -5.698 -19.182 1.380 1.00 0.00 N ATOM 580 CD2 HIS B 6 -3.649 -18.330 1.952 1.00 0.00 C ATOM 581 CE1 HIS B 6 -5.318 -19.373 2.684 1.00 0.00 C ATOM 582 NE2 HIS B 6 -4.107 -18.905 3.121 1.00 0.00 N ATOM 0 H HIS B 6 -6.721 -17.362 -0.708 1.00 0.00 H new ATOM 0 HA HIS B 6 -4.348 -15.825 -0.113 1.00 0.00 H new ATOM 0 HB2 HIS B 6 -4.963 -18.663 -1.162 1.00 0.00 H new ATOM 0 HB3 HIS B 6 -3.339 -18.138 -0.765 1.00 0.00 H new ATOM 0 HD2 HIS B 6 -2.701 -17.824 1.845 1.00 0.00 H new ATOM 0 HE1 HIS B 6 -5.974 -19.893 3.367 1.00 0.00 H new ATOM 0 HE2 HIS B 6 -3.671 -18.964 4.041 1.00 0.00 H new ATOM 583 N PHE B 7 -3.207 -15.404 -2.422 1.00 0.00 N ATOM 584 CA PHE B 7 -2.297 -15.544 -3.593 1.00 0.00 C ATOM 585 C PHE B 7 -0.786 -15.468 -3.172 1.00 0.00 C ATOM 586 O PHE B 7 -0.397 -14.890 -2.151 1.00 0.00 O ATOM 587 CB PHE B 7 -2.738 -14.618 -4.771 1.00 0.00 C ATOM 588 CG PHE B 7 -2.156 -13.198 -4.854 1.00 0.00 C ATOM 589 CD1 PHE B 7 -0.886 -12.995 -5.412 1.00 0.00 C ATOM 590 CD2 PHE B 7 -2.885 -12.086 -4.417 1.00 0.00 C ATOM 591 CE1 PHE B 7 -0.357 -11.721 -5.499 1.00 0.00 C ATOM 592 CE2 PHE B 7 -2.374 -10.808 -4.584 1.00 0.00 C ATOM 593 CZ PHE B 7 -1.128 -10.631 -5.161 1.00 0.00 C ATOM 0 H PHE B 7 -2.941 -14.667 -1.769 1.00 0.00 H new ATOM 0 HA PHE B 7 -2.391 -16.549 -4.003 1.00 0.00 H new ATOM 0 HB2 PHE B 7 -2.494 -15.130 -5.702 1.00 0.00 H new ATOM 0 HB3 PHE B 7 -3.824 -14.528 -4.732 1.00 0.00 H new ATOM 0 HD1 PHE B 7 -0.318 -13.838 -5.776 1.00 0.00 H new ATOM 0 HD2 PHE B 7 -3.848 -12.224 -3.948 1.00 0.00 H new ATOM 0 HE1 PHE B 7 0.661 -11.580 -5.832 1.00 0.00 H new ATOM 0 HE2 PHE B 7 -2.948 -9.951 -4.264 1.00 0.00 H new ATOM 0 HZ PHE B 7 -0.759 -9.633 -5.347 1.00 0.00 H new ATOM 594 N ASN B 8 0.096 -16.017 -4.017 1.00 0.00 N ATOM 595 CA ASN B 8 1.567 -15.920 -3.812 1.00 0.00 C ATOM 596 C ASN B 8 2.122 -14.465 -4.020 1.00 0.00 C ATOM 597 O ASN B 8 2.319 -14.009 -5.150 1.00 0.00 O ATOM 598 CB ASN B 8 2.250 -16.944 -4.761 1.00 0.00 C ATOM 599 CG ASN B 8 2.048 -18.416 -4.395 1.00 0.00 C ATOM 600 OD1 ASN B 8 2.202 -18.833 -3.255 1.00 0.00 O ATOM 601 ND2 ASN B 8 1.728 -19.261 -5.339 1.00 0.00 N ATOM 0 H ASN B 8 -0.173 -16.536 -4.853 1.00 0.00 H new ATOM 0 HA ASN B 8 1.798 -16.158 -2.774 1.00 0.00 H new ATOM 0 HB2 ASN B 8 1.874 -16.784 -5.771 1.00 0.00 H new ATOM 0 HB3 ASN B 8 3.320 -16.736 -4.782 1.00 0.00 H new ATOM 0 HD21 ASN B 8 1.611 -20.250 -5.120 1.00 0.00 H new ATOM 0 HD22 ASN B 8 1.596 -18.931 -6.295 1.00 0.00 H new ATOM 602 N PHE B 9 2.430 -13.767 -2.920 1.00 0.00 N ATOM 603 CA PHE B 9 3.319 -12.600 -2.903 1.00 0.00 C ATOM 604 C PHE B 9 4.497 -12.903 -1.960 1.00 0.00 C ATOM 605 O PHE B 9 4.398 -12.740 -0.747 1.00 0.00 O ATOM 606 CB PHE B 9 2.422 -11.399 -2.504 1.00 0.00 C ATOM 607 CG PHE B 9 2.964 -10.088 -3.038 1.00 0.00 C ATOM 608 CD1 PHE B 9 2.966 -9.871 -4.422 1.00 0.00 C ATOM 609 CD2 PHE B 9 3.216 -9.007 -2.186 1.00 0.00 C ATOM 610 CE1 PHE B 9 3.226 -8.616 -4.924 1.00 0.00 C ATOM 611 CE2 PHE B 9 3.585 -7.781 -2.694 1.00 0.00 C ATOM 612 CZ PHE B 9 3.484 -7.574 -4.049 1.00 0.00 C ATOM 0 H PHE B 9 2.061 -14.003 -1.999 1.00 0.00 H new ATOM 0 HA PHE B 9 3.785 -12.357 -3.858 1.00 0.00 H new ATOM 0 HB2 PHE B 9 1.413 -11.557 -2.885 1.00 0.00 H new ATOM 0 HB3 PHE B 9 2.348 -11.346 -1.418 1.00 0.00 H new ATOM 0 HD1 PHE B 9 2.763 -10.690 -5.096 1.00 0.00 H new ATOM 0 HD2 PHE B 9 3.120 -9.135 -1.118 1.00 0.00 H new ATOM 0 HE1 PHE B 9 3.229 -8.445 -5.990 1.00 0.00 H new ATOM 0 HE2 PHE B 9 3.946 -6.999 -2.042 1.00 0.00 H new ATOM 0 HZ PHE B 9 3.609 -6.575 -4.441 1.00 0.00 H new ATOM 613 N ARG B 10 5.728 -13.203 -2.355 1.00 0.00 N ATOM 614 CA ARG B 10 6.243 -13.515 -3.722 1.00 0.00 C ATOM 615 C ARG B 10 6.750 -12.232 -4.438 1.00 0.00 C ATOM 616 O ARG B 10 5.989 -11.508 -5.082 1.00 0.00 O ATOM 617 CB ARG B 10 5.470 -14.490 -4.635 1.00 0.00 C ATOM 618 CG ARG B 10 6.354 -15.508 -5.392 1.00 0.00 C ATOM 619 CD ARG B 10 7.460 -14.970 -6.316 1.00 0.00 C ATOM 620 NE ARG B 10 6.884 -14.272 -7.495 1.00 0.00 N ATOM 621 CZ ARG B 10 7.545 -13.950 -8.601 1.00 0.00 C ATOM 622 NH1 ARG B 10 8.795 -14.227 -8.817 1.00 0.00 N ATOM 623 NH2 ARG B 10 6.906 -13.327 -9.525 1.00 0.00 N ATOM 0 H ARG B 10 6.483 -13.243 -1.671 1.00 0.00 H new ATOM 0 HA ARG B 10 7.086 -14.169 -3.499 1.00 0.00 H new ATOM 0 HB2 ARG B 10 4.747 -15.037 -4.029 1.00 0.00 H new ATOM 0 HB3 ARG B 10 4.902 -13.911 -5.363 1.00 0.00 H new ATOM 0 HG2 ARG B 10 6.825 -16.154 -4.651 1.00 0.00 H new ATOM 0 HG3 ARG B 10 5.697 -16.137 -5.992 1.00 0.00 H new ATOM 0 HD2 ARG B 10 8.099 -14.284 -5.761 1.00 0.00 H new ATOM 0 HD3 ARG B 10 8.091 -15.794 -6.650 1.00 0.00 H new ATOM 0 HE ARG B 10 5.897 -14.019 -7.451 1.00 0.00 H new ATOM 0 HH11 ARG B 10 9.336 -14.725 -8.110 1.00 0.00 H new ATOM 0 HH12 ARG B 10 9.235 -13.947 -9.693 1.00 0.00 H new ATOM 0 HH21 ARG B 10 5.921 -13.095 -9.396 1.00 0.00 H new ATOM 0 HH22 ARG B 10 7.383 -13.065 -10.387 1.00 0.00 H new ATOM 624 N MET B 11 8.023 -11.896 -4.199 1.00 0.00 N ATOM 625 CA MET B 11 8.495 -10.493 -4.323 1.00 0.00 C ATOM 626 C MET B 11 10.043 -10.462 -4.595 1.00 0.00 C ATOM 627 O MET B 11 10.766 -11.039 -3.776 1.00 0.00 O ATOM 628 CB MET B 11 8.168 -9.785 -2.976 1.00 0.00 C ATOM 629 CG MET B 11 6.714 -9.388 -2.680 1.00 0.00 C ATOM 630 SD MET B 11 6.664 -8.513 -1.108 1.00 0.00 S ATOM 631 CE MET B 11 5.578 -9.576 -0.141 1.00 0.00 C ATOM 0 H MET B 11 8.745 -12.561 -3.921 1.00 0.00 H new ATOM 0 HA MET B 11 8.005 -9.989 -5.156 1.00 0.00 H new ATOM 0 HB2 MET B 11 8.502 -10.439 -2.170 1.00 0.00 H new ATOM 0 HB3 MET B 11 8.774 -8.880 -2.924 1.00 0.00 H new ATOM 0 HG2 MET B 11 6.325 -8.755 -3.478 1.00 0.00 H new ATOM 0 HG3 MET B 11 6.081 -10.274 -2.640 1.00 0.00 H new ATOM 0 HE1 MET B 11 4.983 -8.966 0.539 1.00 0.00 H new ATOM 0 HE2 MET B 11 4.915 -10.124 -0.810 1.00 0.00 H new ATOM 0 HE3 MET B 11 6.177 -10.282 0.434 1.00 0.00 H new ATOM 632 N PRO B 12 10.626 -9.794 -5.643 1.00 0.00 N ATOM 633 CA PRO B 12 12.100 -9.566 -5.768 1.00 0.00 C ATOM 634 C PRO B 12 12.880 -9.143 -4.487 1.00 0.00 C ATOM 635 O PRO B 12 12.310 -8.489 -3.607 1.00 0.00 O ATOM 636 CB PRO B 12 12.178 -8.516 -6.892 1.00 0.00 C ATOM 637 CG PRO B 12 10.941 -8.773 -7.749 1.00 0.00 C ATOM 638 CD PRO B 12 9.869 -9.186 -6.744 1.00 0.00 C ATOM 0 HA PRO B 12 12.610 -10.507 -5.975 1.00 0.00 H new ATOM 0 HB2 PRO B 12 12.177 -7.503 -6.489 1.00 0.00 H new ATOM 0 HB3 PRO B 12 13.093 -8.626 -7.474 1.00 0.00 H new ATOM 0 HG2 PRO B 12 10.647 -7.881 -8.301 1.00 0.00 H new ATOM 0 HG3 PRO B 12 11.121 -9.558 -8.484 1.00 0.00 H new ATOM 0 HD2 PRO B 12 9.290 -8.328 -6.403 1.00 0.00 H new ATOM 0 HD3 PRO B 12 9.164 -9.893 -7.181 1.00 0.00 H new ATOM 639 N MET B 13 14.156 -9.561 -4.367 1.00 0.00 N ATOM 640 CA MET B 13 14.884 -9.554 -3.063 1.00 0.00 C ATOM 641 C MET B 13 14.752 -8.289 -2.152 1.00 0.00 C ATOM 642 O MET B 13 14.334 -8.383 -0.999 1.00 0.00 O ATOM 643 CB MET B 13 16.381 -9.898 -3.294 1.00 0.00 C ATOM 644 CG MET B 13 17.127 -10.609 -2.134 1.00 0.00 C ATOM 645 SD MET B 13 16.468 -10.330 -0.472 1.00 0.00 S ATOM 646 CE MET B 13 15.136 -11.550 -0.334 1.00 0.00 C ATOM 0 H MET B 13 14.710 -9.908 -5.150 1.00 0.00 H new ATOM 0 HA MET B 13 14.368 -10.320 -2.485 1.00 0.00 H new ATOM 0 HB2 MET B 13 16.451 -10.530 -4.179 1.00 0.00 H new ATOM 0 HB3 MET B 13 16.910 -8.972 -3.520 1.00 0.00 H new ATOM 0 HG2 MET B 13 17.122 -11.681 -2.329 1.00 0.00 H new ATOM 0 HG3 MET B 13 18.168 -10.288 -2.148 1.00 0.00 H new ATOM 0 HE1 MET B 13 14.187 -11.037 -0.176 1.00 0.00 H new ATOM 0 HE2 MET B 13 15.083 -12.136 -1.251 1.00 0.00 H new ATOM 0 HE3 MET B 13 15.335 -12.212 0.509 1.00 0.00 H new ATOM 647 N GLU B 14 15.036 -7.109 -2.717 1.00 0.00 N ATOM 648 CA GLU B 14 14.814 -5.814 -2.031 1.00 0.00 C ATOM 649 C GLU B 14 13.342 -5.464 -1.648 1.00 0.00 C ATOM 650 O GLU B 14 13.169 -4.963 -0.548 1.00 0.00 O ATOM 651 CB GLU B 14 15.564 -4.689 -2.792 1.00 0.00 C ATOM 652 CG GLU B 14 14.905 -4.204 -4.110 1.00 0.00 C ATOM 653 CD GLU B 14 15.750 -3.224 -4.915 1.00 0.00 C ATOM 654 OE1 GLU B 14 15.662 -1.951 -4.446 1.00 0.00 O ATOM 655 OE2 GLU B 14 16.434 -3.547 -5.880 1.00 0.00 O ATOM 0 H GLU B 14 15.424 -7.017 -3.656 1.00 0.00 H new ATOM 0 HA GLU B 14 15.249 -5.920 -1.037 1.00 0.00 H new ATOM 0 HB2 GLU B 14 15.668 -3.833 -2.125 1.00 0.00 H new ATOM 0 HB3 GLU B 14 16.570 -5.040 -3.020 1.00 0.00 H new ATOM 0 HG2 GLU B 14 14.685 -5.071 -4.732 1.00 0.00 H new ATOM 0 HG3 GLU B 14 13.951 -3.732 -3.873 1.00 0.00 H new ATOM 656 N VAL B 15 12.283 -5.732 -2.439 1.00 0.00 N ATOM 657 CA VAL B 15 10.866 -5.579 -1.963 1.00 0.00 C ATOM 658 C VAL B 15 10.574 -6.484 -0.749 1.00 0.00 C ATOM 659 O VAL B 15 10.070 -5.976 0.235 1.00 0.00 O ATOM 660 CB VAL B 15 9.770 -5.872 -3.049 1.00 0.00 C ATOM 661 CG1 VAL B 15 8.573 -4.921 -2.909 1.00 0.00 C ATOM 662 CG2 VAL B 15 10.199 -5.851 -4.537 1.00 0.00 C ATOM 0 H VAL B 15 12.366 -6.053 -3.404 1.00 0.00 H new ATOM 0 HA VAL B 15 10.799 -4.524 -1.697 1.00 0.00 H new ATOM 0 HB VAL B 15 9.523 -6.909 -2.824 1.00 0.00 H new ATOM 0 HG11 VAL B 15 7.834 -5.151 -3.676 1.00 0.00 H new ATOM 0 HG12 VAL B 15 8.124 -5.044 -1.923 1.00 0.00 H new ATOM 0 HG13 VAL B 15 8.910 -3.891 -3.028 1.00 0.00 H new ATOM 0 HG21 VAL B 15 9.337 -6.070 -5.167 1.00 0.00 H new ATOM 0 HG22 VAL B 15 10.591 -4.866 -4.789 1.00 0.00 H new ATOM 0 HG23 VAL B 15 10.971 -6.602 -4.704 1.00 0.00 H new ATOM 663 N ARG B 16 10.846 -7.792 -0.793 1.00 0.00 N ATOM 664 CA ARG B 16 10.588 -8.664 0.369 1.00 0.00 C ATOM 665 C ARG B 16 11.543 -8.497 1.582 1.00 0.00 C ATOM 666 O ARG B 16 11.053 -8.603 2.698 1.00 0.00 O ATOM 667 CB ARG B 16 10.408 -10.115 -0.123 1.00 0.00 C ATOM 668 CG ARG B 16 9.239 -10.828 0.610 1.00 0.00 C ATOM 669 CD ARG B 16 9.818 -11.715 1.706 1.00 0.00 C ATOM 670 NE ARG B 16 8.737 -12.361 2.487 1.00 0.00 N ATOM 671 CZ ARG B 16 8.807 -13.571 3.033 1.00 0.00 C ATOM 672 NH1 ARG B 16 9.786 -14.408 2.860 1.00 0.00 N ATOM 673 NH2 ARG B 16 7.846 -13.936 3.798 1.00 0.00 N ATOM 0 H ARG B 16 11.239 -8.269 -1.604 1.00 0.00 H new ATOM 0 HA ARG B 16 9.654 -8.328 0.820 1.00 0.00 H new ATOM 0 HB2 ARG B 16 10.219 -10.115 -1.196 1.00 0.00 H new ATOM 0 HB3 ARG B 16 11.332 -10.671 0.037 1.00 0.00 H new ATOM 0 HG2 ARG B 16 8.558 -10.093 1.039 1.00 0.00 H new ATOM 0 HG3 ARG B 16 8.660 -11.426 -0.094 1.00 0.00 H new ATOM 0 HD2 ARG B 16 10.458 -12.478 1.262 1.00 0.00 H new ATOM 0 HD3 ARG B 16 10.445 -11.119 2.369 1.00 0.00 H new ATOM 0 HE ARG B 16 7.872 -11.836 2.616 1.00 0.00 H new ATOM 0 HH11 ARG B 16 10.577 -14.153 2.268 1.00 0.00 H new ATOM 0 HH12 ARG B 16 9.764 -15.320 3.316 1.00 0.00 H new ATOM 0 HH21 ARG B 16 7.063 -13.305 3.970 1.00 0.00 H new ATOM 0 HH22 ARG B 16 7.864 -14.857 4.235 1.00 0.00 H new ATOM 674 N GLU B 17 12.823 -8.113 1.443 1.00 0.00 N ATOM 675 CA GLU B 17 13.542 -7.446 2.568 1.00 0.00 C ATOM 676 C GLU B 17 12.910 -6.090 3.013 1.00 0.00 C ATOM 677 O GLU B 17 12.675 -5.931 4.201 1.00 0.00 O ATOM 678 CB GLU B 17 15.036 -7.254 2.236 1.00 0.00 C ATOM 679 CG GLU B 17 15.913 -8.516 2.391 1.00 0.00 C ATOM 680 CD GLU B 17 17.393 -8.248 2.132 1.00 0.00 C ATOM 681 OE1 GLU B 17 17.888 -8.146 1.016 1.00 0.00 O ATOM 682 OE2 GLU B 17 18.107 -8.122 3.283 1.00 0.00 O ATOM 0 H GLU B 17 13.376 -8.242 0.596 1.00 0.00 H new ATOM 0 HA GLU B 17 13.440 -8.123 3.416 1.00 0.00 H new ATOM 0 HB2 GLU B 17 15.120 -6.897 1.210 1.00 0.00 H new ATOM 0 HB3 GLU B 17 15.437 -6.471 2.880 1.00 0.00 H new ATOM 0 HG2 GLU B 17 15.792 -8.914 3.398 1.00 0.00 H new ATOM 0 HG3 GLU B 17 15.562 -9.283 1.701 1.00 0.00 H new ATOM 683 N LYS B 18 12.594 -5.131 2.134 1.00 0.00 N ATOM 684 CA LYS B 18 11.874 -3.886 2.519 1.00 0.00 C ATOM 685 C LYS B 18 10.473 -4.089 3.180 1.00 0.00 C ATOM 686 O LYS B 18 10.248 -3.546 4.253 1.00 0.00 O ATOM 687 CB LYS B 18 11.915 -2.860 1.370 1.00 0.00 C ATOM 688 CG LYS B 18 13.293 -2.286 0.933 1.00 0.00 C ATOM 689 CD LYS B 18 13.263 -1.341 -0.296 1.00 0.00 C ATOM 690 CE LYS B 18 12.758 -1.945 -1.613 1.00 0.00 C ATOM 691 NZ LYS B 18 12.763 -0.935 -2.686 1.00 0.00 N ATOM 0 H LYS B 18 12.823 -5.184 1.141 1.00 0.00 H new ATOM 0 HA LYS B 18 12.428 -3.455 3.353 1.00 0.00 H new ATOM 0 HB2 LYS B 18 11.457 -3.323 0.496 1.00 0.00 H new ATOM 0 HB3 LYS B 18 11.281 -2.020 1.654 1.00 0.00 H new ATOM 0 HG2 LYS B 18 13.725 -1.745 1.775 1.00 0.00 H new ATOM 0 HG3 LYS B 18 13.961 -3.119 0.713 1.00 0.00 H new ATOM 0 HD2 LYS B 18 12.636 -0.484 -0.052 1.00 0.00 H new ATOM 0 HD3 LYS B 18 14.272 -0.962 -0.459 1.00 0.00 H new ATOM 0 HE2 LYS B 18 13.388 -2.788 -1.897 1.00 0.00 H new ATOM 0 HE3 LYS B 18 11.749 -2.333 -1.477 1.00 0.00 H new ATOM 0 HZ1 LYS B 18 12.235 -1.297 -3.506 1.00 0.00 H new ATOM 0 HZ2 LYS B 18 12.314 -0.062 -2.343 1.00 0.00 H new ATOM 0 HZ3 LYS B 18 13.743 -0.733 -2.968 1.00 0.00 H new ATOM 692 N LEU B 19 9.572 -4.892 2.609 1.00 0.00 N ATOM 693 CA LEU B 19 8.259 -5.266 3.189 1.00 0.00 C ATOM 694 C LEU B 19 8.340 -6.141 4.491 1.00 0.00 C ATOM 695 O LEU B 19 7.541 -5.959 5.410 1.00 0.00 O ATOM 696 CB LEU B 19 7.398 -5.792 1.983 1.00 0.00 C ATOM 697 CG LEU B 19 5.997 -5.180 1.767 1.00 0.00 C ATOM 698 CD1 LEU B 19 5.306 -5.902 0.608 1.00 0.00 C ATOM 699 CD2 LEU B 19 5.057 -5.223 2.973 1.00 0.00 C ATOM 0 H LEU B 19 9.733 -5.320 1.697 1.00 0.00 H new ATOM 0 HA LEU B 19 7.740 -4.414 3.628 1.00 0.00 H new ATOM 0 HB2 LEU B 19 7.973 -5.637 1.070 1.00 0.00 H new ATOM 0 HB3 LEU B 19 7.276 -6.868 2.105 1.00 0.00 H new ATOM 0 HG LEU B 19 6.184 -4.125 1.566 1.00 0.00 H new ATOM 0 HD11 LEU B 19 4.316 -5.474 0.451 1.00 0.00 H new ATOM 0 HD12 LEU B 19 5.900 -5.786 -0.299 1.00 0.00 H new ATOM 0 HD13 LEU B 19 5.210 -6.962 0.845 1.00 0.00 H new ATOM 0 HD21 LEU B 19 4.103 -4.767 2.708 1.00 0.00 H new ATOM 0 HD22 LEU B 19 4.893 -6.259 3.270 1.00 0.00 H new ATOM 0 HD23 LEU B 19 5.504 -4.674 3.802 1.00 0.00 H new ATOM 700 N LYS B 20 9.321 -7.055 4.598 1.00 0.00 N ATOM 701 CA LYS B 20 9.542 -7.917 5.773 1.00 0.00 C ATOM 702 C LYS B 20 10.444 -7.283 6.882 1.00 0.00 C ATOM 703 O LYS B 20 10.224 -7.579 8.050 1.00 0.00 O ATOM 704 CB LYS B 20 10.103 -9.278 5.321 1.00 0.00 C ATOM 705 CG LYS B 20 9.973 -10.422 6.348 1.00 0.00 C ATOM 706 CD LYS B 20 10.600 -11.770 5.928 1.00 0.00 C ATOM 707 CE LYS B 20 11.882 -11.685 5.085 1.00 0.00 C ATOM 708 NZ LYS B 20 12.456 -13.028 4.884 1.00 0.00 N ATOM 0 H LYS B 20 9.998 -7.219 3.853 1.00 0.00 H new ATOM 0 HA LYS B 20 8.567 -8.048 6.243 1.00 0.00 H new ATOM 0 HB2 LYS B 20 9.593 -9.576 4.405 1.00 0.00 H new ATOM 0 HB3 LYS B 20 11.157 -9.153 5.073 1.00 0.00 H new ATOM 0 HG2 LYS B 20 10.435 -10.102 7.282 1.00 0.00 H new ATOM 0 HG3 LYS B 20 8.915 -10.582 6.554 1.00 0.00 H new ATOM 0 HD2 LYS B 20 10.819 -12.342 6.829 1.00 0.00 H new ATOM 0 HD3 LYS B 20 9.856 -12.334 5.365 1.00 0.00 H new ATOM 0 HE2 LYS B 20 11.660 -11.229 4.120 1.00 0.00 H new ATOM 0 HE3 LYS B 20 12.609 -11.043 5.581 1.00 0.00 H new ATOM 0 HZ1 LYS B 20 13.322 -12.954 4.313 1.00 0.00 H new ATOM 0 HZ2 LYS B 20 12.685 -13.449 5.807 1.00 0.00 H new ATOM 0 HZ3 LYS B 20 11.766 -13.630 4.391 1.00 0.00 H new ATOM 709 N PHE B 21 11.430 -6.414 6.569 1.00 0.00 N ATOM 710 CA PHE B 21 11.952 -5.393 7.516 1.00 0.00 C ATOM 711 C PHE B 21 10.839 -4.451 7.972 1.00 0.00 C ATOM 712 O PHE B 21 10.441 -4.642 9.097 1.00 0.00 O ATOM 713 CB PHE B 21 13.123 -4.548 6.940 1.00 0.00 C ATOM 714 CG PHE B 21 14.472 -5.228 6.814 1.00 0.00 C ATOM 715 CD1 PHE B 21 14.987 -6.048 7.820 1.00 0.00 C ATOM 716 CD2 PHE B 21 15.215 -4.999 5.660 1.00 0.00 C ATOM 717 CE1 PHE B 21 16.191 -6.706 7.626 1.00 0.00 C ATOM 718 CE2 PHE B 21 16.422 -5.649 5.466 1.00 0.00 C ATOM 719 CZ PHE B 21 16.915 -6.514 6.445 1.00 0.00 C ATOM 0 H PHE B 21 11.888 -6.397 5.658 1.00 0.00 H new ATOM 0 HA PHE B 21 12.342 -5.959 8.362 1.00 0.00 H new ATOM 0 HB2 PHE B 21 12.830 -4.194 5.952 1.00 0.00 H new ATOM 0 HB3 PHE B 21 13.246 -3.667 7.571 1.00 0.00 H new ATOM 0 HD1 PHE B 21 14.448 -6.169 8.748 1.00 0.00 H new ATOM 0 HD2 PHE B 21 14.849 -4.311 4.912 1.00 0.00 H new ATOM 0 HE1 PHE B 21 16.571 -7.369 8.389 1.00 0.00 H new ATOM 0 HE2 PHE B 21 16.982 -5.487 4.557 1.00 0.00 H new ATOM 0 HZ PHE B 21 17.850 -7.032 6.291 1.00 0.00 H new ATOM 720 N ARG B 22 10.272 -3.511 7.215 1.00 0.00 N ATOM 721 CA ARG B 22 9.003 -2.813 7.592 1.00 0.00 C ATOM 722 C ARG B 22 8.029 -3.574 8.592 1.00 0.00 C ATOM 723 O ARG B 22 7.863 -3.156 9.735 1.00 0.00 O ATOM 724 CB ARG B 22 8.466 -2.316 6.245 1.00 0.00 C ATOM 725 CG ARG B 22 7.573 -1.083 6.382 1.00 0.00 C ATOM 726 CD ARG B 22 7.076 -0.665 5.002 1.00 0.00 C ATOM 727 NE ARG B 22 6.813 0.790 4.931 1.00 0.00 N ATOM 728 CZ ARG B 22 7.758 1.723 4.733 1.00 0.00 C ATOM 729 NH1 ARG B 22 9.029 1.472 4.632 1.00 0.00 N ATOM 730 NH2 ARG B 22 7.401 2.954 4.656 1.00 0.00 N ATOM 0 H ARG B 22 10.662 -3.200 6.325 1.00 0.00 H new ATOM 0 HA ARG B 22 9.158 -1.974 8.270 1.00 0.00 H new ATOM 0 HB2 ARG B 22 9.304 -2.081 5.589 1.00 0.00 H new ATOM 0 HB3 ARG B 22 7.902 -3.116 5.766 1.00 0.00 H new ATOM 0 HG2 ARG B 22 6.728 -1.303 7.034 1.00 0.00 H new ATOM 0 HG3 ARG B 22 8.129 -0.267 6.844 1.00 0.00 H new ATOM 0 HD2 ARG B 22 7.817 -0.938 4.251 1.00 0.00 H new ATOM 0 HD3 ARG B 22 6.164 -1.212 4.763 1.00 0.00 H new ATOM 0 HE ARG B 22 5.849 1.105 5.040 1.00 0.00 H new ATOM 0 HH11 ARG B 22 9.367 0.512 4.703 1.00 0.00 H new ATOM 0 HH12 ARG B 22 9.689 2.235 4.481 1.00 0.00 H new ATOM 0 HH21 ARG B 22 6.417 3.206 4.745 1.00 0.00 H new ATOM 0 HH22 ARG B 22 8.102 3.680 4.506 1.00 0.00 H new ATOM 731 N ALA B 23 7.691 -4.844 8.329 1.00 0.00 N ATOM 732 CA ALA B 23 7.272 -5.803 9.388 1.00 0.00 C ATOM 733 C ALA B 23 8.213 -6.033 10.645 1.00 0.00 C ATOM 734 O ALA B 23 7.930 -5.513 11.728 1.00 0.00 O ATOM 735 CB ALA B 23 6.831 -7.038 8.591 1.00 0.00 C ATOM 0 H ALA B 23 7.696 -5.243 7.390 1.00 0.00 H new ATOM 0 HA ALA B 23 6.466 -5.383 9.990 1.00 0.00 H new ATOM 0 HB1 ALA B 23 6.499 -7.816 9.279 1.00 0.00 H new ATOM 0 HB2 ALA B 23 6.011 -6.768 7.926 1.00 0.00 H new ATOM 0 HB3 ALA B 23 7.669 -7.409 8.001 1.00 0.00 H new ATOM 736 N GLU B 24 9.312 -6.785 10.504 1.00 0.00 N ATOM 737 CA GLU B 24 10.278 -7.123 11.599 1.00 0.00 C ATOM 738 C GLU B 24 11.223 -5.995 12.168 1.00 0.00 C ATOM 739 O GLU B 24 11.453 -5.936 13.377 1.00 0.00 O ATOM 740 CB GLU B 24 11.096 -8.370 11.145 1.00 0.00 C ATOM 741 CG GLU B 24 10.322 -9.667 10.755 1.00 0.00 C ATOM 742 CD GLU B 24 9.299 -10.201 11.758 1.00 0.00 C ATOM 743 OE1 GLU B 24 9.862 -10.523 12.953 1.00 0.00 O ATOM 744 OE2 GLU B 24 8.104 -10.338 11.509 1.00 0.00 O ATOM 0 H GLU B 24 9.576 -7.194 9.608 1.00 0.00 H new ATOM 0 HA GLU B 24 9.648 -7.308 12.469 1.00 0.00 H new ATOM 0 HB2 GLU B 24 11.701 -8.075 10.288 1.00 0.00 H new ATOM 0 HB3 GLU B 24 11.786 -8.625 11.950 1.00 0.00 H new ATOM 0 HG2 GLU B 24 9.806 -9.482 9.813 1.00 0.00 H new ATOM 0 HG3 GLU B 24 11.054 -10.453 10.568 1.00 0.00 H new ATOM 745 N ALA B 25 11.759 -5.108 11.316 1.00 0.00 N ATOM 746 CA ALA B 25 12.204 -3.732 11.685 1.00 0.00 C ATOM 747 C ALA B 25 11.288 -2.917 12.679 1.00 0.00 C ATOM 748 O ALA B 25 11.797 -2.276 13.600 1.00 0.00 O ATOM 749 CB ALA B 25 12.272 -2.873 10.395 1.00 0.00 C ATOM 0 H ALA B 25 11.903 -5.320 10.329 1.00 0.00 H new ATOM 0 HA ALA B 25 13.152 -3.900 12.195 1.00 0.00 H new ATOM 0 HB1 ALA B 25 12.596 -1.863 10.647 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.982 -3.319 9.698 1.00 0.00 H new ATOM 0 HB3 ALA B 25 11.286 -2.833 9.932 1.00 0.00 H new ATOM 750 N ASN B 26 9.960 -2.847 12.398 1.00 0.00 N ATOM 751 CA ASN B 26 9.081 -1.753 12.900 1.00 0.00 C ATOM 752 C ASN B 26 7.915 -2.207 13.861 1.00 0.00 C ATOM 753 O ASN B 26 7.597 -1.479 14.804 1.00 0.00 O ATOM 754 CB ASN B 26 8.755 -0.945 11.596 1.00 0.00 C ATOM 755 CG ASN B 26 7.375 -0.354 11.371 1.00 0.00 C ATOM 756 OD1 ASN B 26 7.148 0.847 11.409 1.00 0.00 O ATOM 757 ND2 ASN B 26 6.451 -1.191 10.993 1.00 0.00 N ATOM 0 H ASN B 26 9.472 -3.536 11.825 1.00 0.00 H new ATOM 0 HA ASN B 26 9.547 -1.092 13.630 1.00 0.00 H new ATOM 0 HB2 ASN B 26 9.468 -0.122 11.543 1.00 0.00 H new ATOM 0 HB3 ASN B 26 8.963 -1.602 10.752 1.00 0.00 H new ATOM 0 HD21 ASN B 26 5.529 -0.846 10.726 1.00 0.00 H new ATOM 0 HD22 ASN B 26 6.650 -2.191 10.964 1.00 0.00 H new ATOM 758 N GLY B 27 7.284 -3.373 13.639 1.00 0.00 N ATOM 759 CA GLY B 27 6.278 -3.960 14.578 1.00 0.00 C ATOM 760 C GLY B 27 4.927 -4.465 14.013 1.00 0.00 C ATOM 761 O GLY B 27 3.916 -4.416 14.714 1.00 0.00 O ATOM 0 H GLY B 27 7.448 -3.943 12.809 1.00 0.00 H new ATOM 0 HA2 GLY B 27 6.754 -4.797 15.089 1.00 0.00 H new ATOM 0 HA3 GLY B 27 6.057 -3.208 15.335 1.00 0.00 H new ATOM 762 N ARG B 28 4.893 -4.968 12.773 1.00 0.00 N ATOM 763 CA ARG B 28 3.734 -5.718 12.189 1.00 0.00 C ATOM 764 C ARG B 28 4.402 -7.014 11.568 1.00 0.00 C ATOM 765 O ARG B 28 5.626 -7.137 11.489 1.00 0.00 O ATOM 766 CB ARG B 28 2.829 -4.712 11.383 1.00 0.00 C ATOM 767 CG ARG B 28 2.441 -3.363 12.074 1.00 0.00 C ATOM 768 CD ARG B 28 1.335 -2.413 11.539 1.00 0.00 C ATOM 769 NE ARG B 28 1.307 -1.730 10.222 1.00 0.00 N ATOM 770 CZ ARG B 28 2.282 -1.194 9.532 1.00 0.00 C ATOM 771 NH1 ARG B 28 3.511 -1.147 9.895 1.00 0.00 N ATOM 772 NH2 ARG B 28 1.967 -0.702 8.401 1.00 0.00 N ATOM 0 H ARG B 28 5.674 -4.873 12.123 1.00 0.00 H new ATOM 0 HA ARG B 28 2.955 -6.122 12.835 1.00 0.00 H new ATOM 0 HB2 ARG B 28 3.341 -4.475 10.450 1.00 0.00 H new ATOM 0 HB3 ARG B 28 1.907 -5.230 11.118 1.00 0.00 H new ATOM 0 HG2 ARG B 28 2.163 -3.612 13.098 1.00 0.00 H new ATOM 0 HG3 ARG B 28 3.355 -2.771 12.127 1.00 0.00 H new ATOM 0 HD2 ARG B 28 0.411 -2.989 11.586 1.00 0.00 H new ATOM 0 HD3 ARG B 28 1.253 -1.617 12.280 1.00 0.00 H new ATOM 0 HE ARG B 28 0.386 -1.669 9.787 1.00 0.00 H new ATOM 0 HH11 ARG B 28 3.795 -1.549 10.788 1.00 0.00 H new ATOM 0 HH12 ARG B 28 4.205 -0.708 9.290 1.00 0.00 H new ATOM 0 HH21 ARG B 28 1.000 -0.740 8.080 1.00 0.00 H new ATOM 0 HH22 ARG B 28 2.682 -0.270 7.816 1.00 0.00 H new ATOM 773 N SER B 29 3.682 -8.084 11.226 1.00 0.00 N ATOM 774 CA SER B 29 4.329 -9.407 10.886 1.00 0.00 C ATOM 775 C SER B 29 3.793 -9.867 9.517 1.00 0.00 C ATOM 776 O SER B 29 2.603 -10.120 9.438 1.00 0.00 O ATOM 777 CB SER B 29 4.128 -10.410 12.050 1.00 0.00 C ATOM 778 OG SER B 29 2.752 -10.714 12.300 1.00 0.00 O ATOM 0 H SER B 29 2.664 -8.088 11.170 1.00 0.00 H new ATOM 0 HA SER B 29 5.411 -9.323 10.782 1.00 0.00 H new ATOM 0 HB2 SER B 29 4.662 -11.333 11.822 1.00 0.00 H new ATOM 0 HB3 SER B 29 4.573 -9.999 12.956 1.00 0.00 H new ATOM 0 HG SER B 29 2.687 -11.351 13.042 1.00 0.00 H new ATOM 779 N MET B 30 4.550 -9.841 8.401 1.00 0.00 N ATOM 780 CA MET B 30 4.033 -9.283 7.110 1.00 0.00 C ATOM 781 C MET B 30 2.582 -9.626 6.652 1.00 0.00 C ATOM 782 O MET B 30 1.884 -8.727 6.227 1.00 0.00 O ATOM 783 CB MET B 30 4.890 -9.669 5.899 1.00 0.00 C ATOM 784 CG MET B 30 6.303 -9.186 5.791 1.00 0.00 C ATOM 785 SD MET B 30 7.087 -10.161 4.493 1.00 0.00 S ATOM 786 CE MET B 30 7.085 -8.942 3.182 1.00 0.00 C ATOM 0 H MET B 30 5.507 -10.191 8.355 1.00 0.00 H new ATOM 0 HA MET B 30 4.066 -8.229 7.387 1.00 0.00 H new ATOM 0 HB2 MET B 30 4.917 -10.758 5.856 1.00 0.00 H new ATOM 0 HB3 MET B 30 4.363 -9.328 5.008 1.00 0.00 H new ATOM 0 HG2 MET B 30 6.331 -8.124 5.548 1.00 0.00 H new ATOM 0 HG3 MET B 30 6.828 -9.310 6.738 1.00 0.00 H new ATOM 0 HE1 MET B 30 6.636 -9.372 2.286 1.00 0.00 H new ATOM 0 HE2 MET B 30 6.508 -8.072 3.495 1.00 0.00 H new ATOM 0 HE3 MET B 30 8.109 -8.639 2.965 1.00 0.00 H new ATOM 787 N ASN B 31 2.023 -10.834 6.728 1.00 0.00 N ATOM 788 CA ASN B 31 0.541 -10.977 6.570 1.00 0.00 C ATOM 789 C ASN B 31 -0.329 -9.983 7.460 1.00 0.00 C ATOM 790 O ASN B 31 -1.153 -9.275 6.892 1.00 0.00 O ATOM 791 CB ASN B 31 0.113 -12.465 6.615 1.00 0.00 C ATOM 792 CG ASN B 31 -0.947 -12.855 5.585 1.00 0.00 C ATOM 793 OD1 ASN B 31 -0.753 -13.759 4.786 1.00 0.00 O ATOM 794 ND2 ASN B 31 -2.051 -12.161 5.507 1.00 0.00 N ATOM 0 H ASN B 31 2.531 -11.704 6.890 1.00 0.00 H new ATOM 0 HA ASN B 31 0.299 -10.628 5.566 1.00 0.00 H new ATOM 0 HB2 ASN B 31 0.995 -13.088 6.463 1.00 0.00 H new ATOM 0 HB3 ASN B 31 -0.268 -12.690 7.611 1.00 0.00 H new ATOM 0 HD21 ASN B 31 -2.739 -12.376 4.785 1.00 0.00 H new ATOM 0 HD22 ASN B 31 -2.225 -11.404 6.168 1.00 0.00 H new ATOM 795 N SER B 32 0.010 -9.765 8.748 1.00 0.00 N ATOM 796 CA SER B 32 -0.096 -8.423 9.413 1.00 0.00 C ATOM 797 C SER B 32 0.548 -7.198 8.679 1.00 0.00 C ATOM 798 O SER B 32 -0.221 -6.390 8.165 1.00 0.00 O ATOM 799 CB SER B 32 0.244 -8.547 10.921 1.00 0.00 C ATOM 800 OG SER B 32 0.355 -7.271 11.557 1.00 0.00 O ATOM 0 H SER B 32 0.363 -10.499 9.362 1.00 0.00 H new ATOM 0 HA SER B 32 -1.144 -8.136 9.322 1.00 0.00 H new ATOM 0 HB2 SER B 32 -0.529 -9.133 11.419 1.00 0.00 H new ATOM 0 HB3 SER B 32 1.181 -9.091 11.037 1.00 0.00 H new ATOM 0 HG SER B 32 -0.433 -6.729 11.342 1.00 0.00 H new ATOM 801 N GLU B 33 1.874 -6.986 8.602 1.00 0.00 N ATOM 802 CA GLU B 33 2.405 -5.689 8.051 1.00 0.00 C ATOM 803 C GLU B 33 2.156 -5.331 6.571 1.00 0.00 C ATOM 804 O GLU B 33 1.777 -4.207 6.280 1.00 0.00 O ATOM 805 CB GLU B 33 3.926 -5.570 8.156 1.00 0.00 C ATOM 806 CG GLU B 33 4.399 -4.093 8.241 1.00 0.00 C ATOM 807 CD GLU B 33 4.885 -3.427 6.968 1.00 0.00 C ATOM 808 OE1 GLU B 33 5.512 -3.982 6.078 1.00 0.00 O ATOM 809 OE2 GLU B 33 4.561 -2.117 6.947 1.00 0.00 O ATOM 0 H GLU B 33 2.586 -7.654 8.896 1.00 0.00 H new ATOM 0 HA GLU B 33 1.823 -5.021 8.686 1.00 0.00 H new ATOM 0 HB2 GLU B 33 4.270 -6.110 9.038 1.00 0.00 H new ATOM 0 HB3 GLU B 33 4.386 -6.047 7.290 1.00 0.00 H new ATOM 0 HG2 GLU B 33 3.573 -3.500 8.634 1.00 0.00 H new ATOM 0 HG3 GLU B 33 5.205 -4.042 8.973 1.00 0.00 H new ATOM 810 N LEU B 34 2.427 -6.254 5.635 1.00 0.00 N ATOM 811 CA LEU B 34 1.848 -6.244 4.284 1.00 0.00 C ATOM 812 C LEU B 34 0.343 -5.863 4.391 1.00 0.00 C ATOM 813 O LEU B 34 0.031 -4.808 3.869 1.00 0.00 O ATOM 814 CB LEU B 34 2.138 -7.602 3.576 1.00 0.00 C ATOM 815 CG LEU B 34 2.599 -7.693 2.099 1.00 0.00 C ATOM 816 CD1 LEU B 34 2.266 -9.042 1.440 1.00 0.00 C ATOM 817 CD2 LEU B 34 2.082 -6.632 1.107 1.00 0.00 C ATOM 0 H LEU B 34 3.061 -7.036 5.797 1.00 0.00 H new ATOM 0 HA LEU B 34 2.310 -5.489 3.648 1.00 0.00 H new ATOM 0 HB2 LEU B 34 2.899 -8.107 4.171 1.00 0.00 H new ATOM 0 HB3 LEU B 34 1.227 -8.195 3.655 1.00 0.00 H new ATOM 0 HG LEU B 34 3.666 -7.529 2.249 1.00 0.00 H new ATOM 0 HD11 LEU B 34 2.616 -9.039 0.408 1.00 0.00 H new ATOM 0 HD12 LEU B 34 2.758 -9.846 1.987 1.00 0.00 H new ATOM 0 HD13 LEU B 34 1.187 -9.199 1.457 1.00 0.00 H new ATOM 0 HD21 LEU B 34 2.492 -6.830 0.117 1.00 0.00 H new ATOM 0 HD22 LEU B 34 0.994 -6.674 1.064 1.00 0.00 H new ATOM 0 HD23 LEU B 34 2.395 -5.642 1.438 1.00 0.00 H new ATOM 818 N LEU B 35 -0.574 -6.541 5.143 1.00 0.00 N ATOM 819 CA LEU B 35 -1.987 -6.067 5.183 1.00 0.00 C ATOM 820 C LEU B 35 -2.218 -4.646 5.736 1.00 0.00 C ATOM 821 O LEU B 35 -2.952 -3.864 5.147 1.00 0.00 O ATOM 822 CB LEU B 35 -2.944 -7.018 5.942 1.00 0.00 C ATOM 823 CG LEU B 35 -3.550 -8.187 5.156 1.00 0.00 C ATOM 824 CD1 LEU B 35 -4.605 -8.846 6.042 1.00 0.00 C ATOM 825 CD2 LEU B 35 -4.241 -7.658 3.888 1.00 0.00 C ATOM 0 H LEU B 35 -0.375 -7.372 5.700 1.00 0.00 H new ATOM 0 HA LEU B 35 -2.220 -6.053 4.118 1.00 0.00 H new ATOM 0 HB2 LEU B 35 -2.403 -7.430 6.794 1.00 0.00 H new ATOM 0 HB3 LEU B 35 -3.763 -6.421 6.343 1.00 0.00 H new ATOM 0 HG LEU B 35 -2.769 -8.894 4.875 1.00 0.00 H new ATOM 0 HD11 LEU B 35 -5.056 -9.684 5.510 1.00 0.00 H new ATOM 0 HD12 LEU B 35 -4.137 -9.208 6.958 1.00 0.00 H new ATOM 0 HD13 LEU B 35 -5.376 -8.118 6.292 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -4.670 -8.492 3.333 1.00 0.00 H new ATOM 0 HD22 LEU B 35 -5.033 -6.963 4.168 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -3.511 -7.144 3.263 1.00 0.00 H new ATOM 826 N GLN B 36 -1.628 -4.338 6.877 1.00 0.00 N ATOM 827 CA GLN B 36 -1.745 -3.003 7.501 1.00 0.00 C ATOM 828 C GLN B 36 -1.032 -1.876 6.716 1.00 0.00 C ATOM 829 O GLN B 36 -1.590 -0.788 6.686 1.00 0.00 O ATOM 830 CB GLN B 36 -1.263 -3.055 8.968 1.00 0.00 C ATOM 831 CG GLN B 36 -2.232 -3.608 10.036 1.00 0.00 C ATOM 832 CD GLN B 36 -2.335 -5.124 10.135 1.00 0.00 C ATOM 833 OE1 GLN B 36 -1.810 -5.788 11.023 1.00 0.00 O ATOM 834 NE2 GLN B 36 -2.991 -5.721 9.185 1.00 0.00 N ATOM 0 H GLN B 36 -1.053 -4.993 7.407 1.00 0.00 H new ATOM 0 HA GLN B 36 -2.803 -2.744 7.476 1.00 0.00 H new ATOM 0 HB2 GLN B 36 -0.355 -3.657 8.999 1.00 0.00 H new ATOM 0 HB3 GLN B 36 -0.985 -2.043 9.263 1.00 0.00 H new ATOM 0 HG2 GLN B 36 -1.926 -3.222 11.008 1.00 0.00 H new ATOM 0 HG3 GLN B 36 -3.227 -3.210 9.834 1.00 0.00 H new ATOM 0 HE21 GLN B 36 -3.429 -5.172 8.445 1.00 0.00 H new ATOM 0 HE22 GLN B 36 -3.068 -6.738 9.180 1.00 0.00 H new ATOM 835 N ILE B 37 0.111 -2.098 6.047 1.00 0.00 N ATOM 836 CA ILE B 37 0.624 -1.172 5.007 1.00 0.00 C ATOM 837 C ILE B 37 -0.189 -1.150 3.668 1.00 0.00 C ATOM 838 O ILE B 37 -0.026 -0.180 2.970 1.00 0.00 O ATOM 839 CB ILE B 37 2.160 -1.430 4.747 1.00 0.00 C ATOM 840 CG1 ILE B 37 3.013 -0.167 4.469 1.00 0.00 C ATOM 841 CG2 ILE B 37 2.421 -2.400 3.580 1.00 0.00 C ATOM 842 CD1 ILE B 37 3.315 0.633 5.737 1.00 0.00 C ATOM 0 H ILE B 37 0.704 -2.913 6.204 1.00 0.00 H new ATOM 0 HA ILE B 37 0.484 -0.172 5.419 1.00 0.00 H new ATOM 0 HB ILE B 37 2.471 -1.860 5.699 1.00 0.00 H new ATOM 0 HG12 ILE B 37 3.951 -0.463 3.999 1.00 0.00 H new ATOM 0 HG13 ILE B 37 2.488 0.471 3.758 1.00 0.00 H new ATOM 0 HG21 ILE B 37 3.495 -2.535 3.453 1.00 0.00 H new ATOM 0 HG22 ILE B 37 1.957 -3.362 3.796 1.00 0.00 H new ATOM 0 HG23 ILE B 37 1.996 -1.990 2.664 1.00 0.00 H new ATOM 0 HD11 ILE B 37 3.915 1.506 5.482 1.00 0.00 H new ATOM 0 HD12 ILE B 37 2.380 0.956 6.195 1.00 0.00 H new ATOM 0 HD13 ILE B 37 3.865 0.007 6.440 1.00 0.00 H new ATOM 843 N VAL B 38 -0.878 -2.217 3.244 1.00 0.00 N ATOM 844 CA VAL B 38 -1.606 -2.385 1.940 1.00 0.00 C ATOM 845 C VAL B 38 -3.068 -1.819 2.037 1.00 0.00 C ATOM 846 O VAL B 38 -3.486 -0.992 1.229 1.00 0.00 O ATOM 847 CB VAL B 38 -1.691 -3.924 1.647 1.00 0.00 C ATOM 848 CG1 VAL B 38 -2.792 -4.589 0.792 1.00 0.00 C ATOM 849 CG2 VAL B 38 -0.364 -4.471 1.117 1.00 0.00 C ATOM 0 H VAL B 38 -0.959 -3.051 3.826 1.00 0.00 H new ATOM 0 HA VAL B 38 -1.076 -1.847 1.154 1.00 0.00 H new ATOM 0 HB VAL B 38 -1.987 -4.198 2.660 1.00 0.00 H new ATOM 0 HG11 VAL B 38 -2.618 -5.664 0.747 1.00 0.00 H new ATOM 0 HG12 VAL B 38 -3.767 -4.398 1.241 1.00 0.00 H new ATOM 0 HG13 VAL B 38 -2.769 -4.175 -0.216 1.00 0.00 H new ATOM 0 HG21 VAL B 38 -0.461 -5.540 0.926 1.00 0.00 H new ATOM 0 HG22 VAL B 38 -0.103 -3.959 0.191 1.00 0.00 H new ATOM 0 HG23 VAL B 38 0.419 -4.305 1.856 1.00 0.00 H new ATOM 850 N GLN B 39 -3.838 -2.277 3.059 1.00 0.00 N ATOM 851 CA GLN B 39 -4.998 -1.539 3.614 1.00 0.00 C ATOM 852 C GLN B 39 -4.645 -0.075 4.029 1.00 0.00 C ATOM 853 O GLN B 39 -5.435 0.813 3.729 1.00 0.00 O ATOM 854 CB GLN B 39 -5.575 -2.291 4.854 1.00 0.00 C ATOM 855 CG GLN B 39 -6.108 -3.728 4.652 1.00 0.00 C ATOM 856 CD GLN B 39 -6.678 -4.416 5.896 1.00 0.00 C ATOM 857 OE1 GLN B 39 -7.850 -4.759 5.980 1.00 0.00 O ATOM 858 NE2 GLN B 39 -5.876 -4.664 6.899 1.00 0.00 N ATOM 0 H GLN B 39 -3.669 -3.171 3.520 1.00 0.00 H new ATOM 0 HA GLN B 39 -5.740 -1.490 2.817 1.00 0.00 H new ATOM 0 HB2 GLN B 39 -4.794 -2.329 5.614 1.00 0.00 H new ATOM 0 HB3 GLN B 39 -6.387 -1.688 5.261 1.00 0.00 H new ATOM 0 HG2 GLN B 39 -6.885 -3.702 3.888 1.00 0.00 H new ATOM 0 HG3 GLN B 39 -5.297 -4.343 4.261 1.00 0.00 H new ATOM 0 HE21 GLN B 39 -4.896 -4.386 6.849 1.00 0.00 H new ATOM 0 HE22 GLN B 39 -6.231 -5.135 7.731 1.00 0.00 H new ATOM 859 N ASP B 40 -3.452 0.216 4.594 1.00 0.00 N ATOM 860 CA ASP B 40 -2.870 1.583 4.482 1.00 0.00 C ATOM 861 C ASP B 40 -2.675 2.167 3.055 1.00 0.00 C ATOM 862 O ASP B 40 -3.126 3.274 2.752 1.00 0.00 O ATOM 863 CB ASP B 40 -1.678 1.789 5.407 1.00 0.00 C ATOM 864 CG ASP B 40 -1.125 3.171 5.587 1.00 0.00 C ATOM 865 OD1 ASP B 40 -1.580 4.202 5.101 1.00 0.00 O ATOM 866 OD2 ASP B 40 -0.044 3.133 6.398 1.00 0.00 O ATOM 0 H ASP B 40 -2.884 -0.450 5.118 1.00 0.00 H new ATOM 0 HA ASP B 40 -3.677 2.217 4.849 1.00 0.00 H new ATOM 0 HB2 ASP B 40 -1.958 1.416 6.392 1.00 0.00 H new ATOM 0 HB3 ASP B 40 -0.868 1.156 5.045 1.00 0.00 H new ATOM 867 N ALA B 41 -1.970 1.437 2.199 1.00 0.00 N ATOM 868 CA ALA B 41 -1.481 1.961 0.915 1.00 0.00 C ATOM 869 C ALA B 41 -2.570 2.372 -0.120 1.00 0.00 C ATOM 870 O ALA B 41 -2.504 3.441 -0.724 1.00 0.00 O ATOM 871 CB ALA B 41 -0.332 1.034 0.462 1.00 0.00 C ATOM 0 H ALA B 41 -1.717 0.464 2.369 1.00 0.00 H new ATOM 0 HA ALA B 41 -1.066 2.961 1.037 1.00 0.00 H new ATOM 0 HB1 ALA B 41 0.064 1.385 -0.491 1.00 0.00 H new ATOM 0 HB2 ALA B 41 0.460 1.044 1.210 1.00 0.00 H new ATOM 0 HB3 ALA B 41 -0.709 0.018 0.346 1.00 0.00 H new ATOM 872 N LEU B 42 -3.625 1.577 -0.222 1.00 0.00 N ATOM 873 CA LEU B 42 -4.834 1.914 -1.025 1.00 0.00 C ATOM 874 C LEU B 42 -6.201 2.047 -0.280 1.00 0.00 C ATOM 875 O LEU B 42 -7.178 2.432 -0.929 1.00 0.00 O ATOM 876 CB LEU B 42 -4.841 0.977 -2.253 1.00 0.00 C ATOM 877 CG LEU B 42 -4.691 -0.544 -2.041 1.00 0.00 C ATOM 878 CD1 LEU B 42 -5.903 -1.195 -1.375 1.00 0.00 C ATOM 879 CD2 LEU B 42 -4.464 -1.170 -3.407 1.00 0.00 C ATOM 0 H LEU B 42 -3.686 0.672 0.245 1.00 0.00 H new ATOM 0 HA LEU B 42 -4.739 2.955 -1.332 1.00 0.00 H new ATOM 0 HB2 LEU B 42 -5.777 1.143 -2.787 1.00 0.00 H new ATOM 0 HB3 LEU B 42 -4.036 1.297 -2.914 1.00 0.00 H new ATOM 0 HG LEU B 42 -3.854 -0.711 -1.363 1.00 0.00 H new ATOM 0 HD11 LEU B 42 -5.724 -2.264 -1.259 1.00 0.00 H new ATOM 0 HD12 LEU B 42 -6.065 -0.746 -0.395 1.00 0.00 H new ATOM 0 HD13 LEU B 42 -6.786 -1.040 -1.995 1.00 0.00 H new ATOM 0 HD21 LEU B 42 -4.353 -2.249 -3.299 1.00 0.00 H new ATOM 0 HD22 LEU B 42 -5.317 -0.956 -4.052 1.00 0.00 H new ATOM 0 HD23 LEU B 42 -3.560 -0.755 -3.852 1.00 0.00 H new ATOM 880 N SER B 43 -6.303 1.825 1.047 1.00 0.00 N ATOM 881 CA SER B 43 -7.486 2.289 1.837 1.00 0.00 C ATOM 882 C SER B 43 -7.203 3.216 3.065 1.00 0.00 C ATOM 883 O SER B 43 -8.167 3.596 3.728 1.00 0.00 O ATOM 884 CB SER B 43 -8.412 1.091 2.146 1.00 0.00 C ATOM 885 OG SER B 43 -7.861 0.190 3.107 1.00 0.00 O ATOM 0 H SER B 43 -5.597 1.336 1.597 1.00 0.00 H new ATOM 0 HA SER B 43 -8.014 2.988 1.189 1.00 0.00 H new ATOM 0 HB2 SER B 43 -9.368 1.464 2.513 1.00 0.00 H new ATOM 0 HB3 SER B 43 -8.615 0.548 1.223 1.00 0.00 H new ATOM 0 HG SER B 43 -7.041 0.573 3.482 1.00 0.00 H new ATOM 886 N LYS B 44 -5.959 3.684 3.321 1.00 0.00 N ATOM 887 CA LYS B 44 -5.710 4.998 3.976 1.00 0.00 C ATOM 888 C LYS B 44 -6.059 5.123 5.523 1.00 0.00 C ATOM 889 O LYS B 44 -5.208 4.669 6.297 1.00 0.00 O ATOM 890 CB LYS B 44 -6.048 6.131 2.955 1.00 0.00 C ATOM 891 CG LYS B 44 -5.253 6.125 1.623 1.00 0.00 C ATOM 892 CD LYS B 44 -5.739 7.214 0.652 1.00 0.00 C ATOM 893 CE LYS B 44 -5.023 7.120 -0.701 1.00 0.00 C ATOM 894 NZ LYS B 44 -5.592 8.103 -1.643 1.00 0.00 N ATOM 0 H LYS B 44 -5.108 3.173 3.085 1.00 0.00 H new ATOM 0 HA LYS B 44 -4.650 5.136 4.189 1.00 0.00 H new ATOM 0 HB2 LYS B 44 -7.110 6.070 2.718 1.00 0.00 H new ATOM 0 HB3 LYS B 44 -5.885 7.091 3.445 1.00 0.00 H new ATOM 0 HG2 LYS B 44 -4.194 6.274 1.833 1.00 0.00 H new ATOM 0 HG3 LYS B 44 -5.349 5.148 1.149 1.00 0.00 H new ATOM 0 HD2 LYS B 44 -6.814 7.117 0.503 1.00 0.00 H new ATOM 0 HD3 LYS B 44 -5.565 8.197 1.089 1.00 0.00 H new ATOM 0 HE2 LYS B 44 -3.957 7.304 -0.571 1.00 0.00 H new ATOM 0 HE3 LYS B 44 -5.126 6.114 -1.107 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 -5.903 7.616 -2.507 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 -6.405 8.577 -1.201 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 -4.869 8.810 -1.886 1.00 0.00 H new ATOM 895 N PRO B 45 -7.164 5.732 6.076 1.00 0.00 N ATOM 896 CA PRO B 45 -7.228 6.108 7.522 1.00 0.00 C ATOM 897 C PRO B 45 -7.559 4.991 8.572 1.00 0.00 C ATOM 898 O PRO B 45 -8.692 4.528 8.725 1.00 0.00 O ATOM 899 CB PRO B 45 -8.265 7.253 7.530 1.00 0.00 C ATOM 900 CG PRO B 45 -9.174 6.951 6.338 1.00 0.00 C ATOM 901 CD PRO B 45 -8.226 6.381 5.285 1.00 0.00 C ATOM 0 HA PRO B 45 -6.229 6.373 7.870 1.00 0.00 H new ATOM 0 HB2 PRO B 45 -8.827 7.273 8.463 1.00 0.00 H new ATOM 0 HB3 PRO B 45 -7.784 8.226 7.427 1.00 0.00 H new ATOM 0 HG2 PRO B 45 -9.954 6.236 6.602 1.00 0.00 H new ATOM 0 HG3 PRO B 45 -9.674 7.851 5.980 1.00 0.00 H new ATOM 0 HD2 PRO B 45 -8.733 5.667 4.636 1.00 0.00 H new ATOM 0 HD3 PRO B 45 -7.824 7.165 4.644 1.00 0.00 H new ATOM 902 N SER B 46 -6.582 4.730 9.448 1.00 0.00 N ATOM 903 CA SER B 46 -6.857 4.565 10.903 1.00 0.00 C ATOM 904 C SER B 46 -7.144 5.972 11.566 1.00 0.00 C ATOM 905 O SER B 46 -6.325 6.881 11.373 1.00 0.00 O ATOM 906 CB SER B 46 -5.640 3.885 11.572 1.00 0.00 C ATOM 907 OG SER B 46 -5.311 2.630 10.970 1.00 0.00 O ATOM 0 H SER B 46 -5.600 4.627 9.191 1.00 0.00 H new ATOM 0 HA SER B 46 -7.739 3.939 11.042 1.00 0.00 H new ATOM 0 HB2 SER B 46 -4.778 4.550 11.511 1.00 0.00 H new ATOM 0 HB3 SER B 46 -5.851 3.732 12.630 1.00 0.00 H new ATOM 0 HG SER B 46 -4.585 2.757 10.324 1.00 0.00 H new ATOM 908 N PRO B 47 -8.270 6.237 12.292 1.00 0.00 N ATOM 909 CA PRO B 47 -8.734 7.633 12.549 1.00 0.00 C ATOM 910 C PRO B 47 -7.928 8.468 13.605 1.00 0.00 C ATOM 911 O PRO B 47 -8.202 8.434 14.806 1.00 0.00 O ATOM 912 CB PRO B 47 -10.221 7.411 12.904 1.00 0.00 C ATOM 913 CG PRO B 47 -10.295 5.989 13.462 1.00 0.00 C ATOM 914 CD PRO B 47 -9.289 5.218 12.614 1.00 0.00 C ATOM 0 HA PRO B 47 -8.571 8.278 11.686 1.00 0.00 H new ATOM 0 HB2 PRO B 47 -10.563 8.140 13.639 1.00 0.00 H new ATOM 0 HB3 PRO B 47 -10.856 7.522 12.025 1.00 0.00 H new ATOM 0 HG2 PRO B 47 -10.034 5.959 14.520 1.00 0.00 H new ATOM 0 HG3 PRO B 47 -11.299 5.574 13.370 1.00 0.00 H new ATOM 0 HD2 PRO B 47 -8.860 4.378 13.161 1.00 0.00 H new ATOM 0 HD3 PRO B 47 -9.749 4.810 11.714 1.00 0.00 H new ATOM 915 N VAL B 48 -6.971 9.278 13.125 1.00 0.00 N ATOM 916 CA VAL B 48 -6.247 10.287 13.968 1.00 0.00 C ATOM 917 C VAL B 48 -7.005 11.657 14.080 1.00 0.00 C ATOM 918 O VAL B 48 -7.322 12.078 15.189 1.00 0.00 O ATOM 919 CB VAL B 48 -4.723 10.359 13.595 1.00 0.00 C ATOM 920 CG1 VAL B 48 -3.925 11.444 14.356 1.00 0.00 C ATOM 921 CG2 VAL B 48 -3.983 9.022 13.847 1.00 0.00 C ATOM 0 H VAL B 48 -6.667 9.265 12.151 1.00 0.00 H new ATOM 0 HA VAL B 48 -6.254 9.937 15.000 1.00 0.00 H new ATOM 0 HB VAL B 48 -4.751 10.606 12.534 1.00 0.00 H new ATOM 0 HG11 VAL B 48 -2.883 11.421 14.036 1.00 0.00 H new ATOM 0 HG12 VAL B 48 -4.349 12.425 14.142 1.00 0.00 H new ATOM 0 HG13 VAL B 48 -3.979 11.251 15.427 1.00 0.00 H new ATOM 0 HG21 VAL B 48 -2.934 9.129 13.572 1.00 0.00 H new ATOM 0 HG22 VAL B 48 -4.056 8.759 14.902 1.00 0.00 H new ATOM 0 HG23 VAL B 48 -4.437 8.235 13.244 1.00 0.00 H new ATOM 922 N THR B 49 -7.362 12.492 13.103 1.00 0.00 N ATOM 923 CA THR B 49 -7.063 12.340 11.647 1.00 0.00 C ATOM 924 C THR B 49 -6.494 13.687 11.070 1.00 0.00 C ATOM 925 O THR B 49 -7.226 14.478 10.468 1.00 0.00 O ATOM 926 CB THR B 49 -8.336 11.862 10.864 1.00 0.00 C ATOM 927 OG1 THR B 49 -8.982 10.772 11.507 1.00 0.00 O ATOM 928 CG2 THR B 49 -8.045 11.372 9.436 1.00 0.00 C ATOM 0 H THR B 49 -7.894 13.340 13.298 1.00 0.00 H new ATOM 0 HA THR B 49 -6.300 11.572 11.520 1.00 0.00 H new ATOM 0 HB THR B 49 -8.960 12.755 10.838 1.00 0.00 H new ATOM 0 HG1 THR B 49 -9.770 10.507 10.988 1.00 0.00 H new ATOM 0 HG21 THR B 49 -8.975 11.059 8.962 1.00 0.00 H new ATOM 0 HG22 THR B 49 -7.597 12.180 8.858 1.00 0.00 H new ATOM 0 HG23 THR B 49 -7.356 10.528 9.474 1.00 0.00 H new ATOM 929 N GLY B 50 -5.174 13.934 11.177 1.00 0.00 N ATOM 930 CA GLY B 50 -4.486 14.925 10.281 1.00 0.00 C ATOM 931 C GLY B 50 -3.834 14.295 9.045 1.00 0.00 C ATOM 932 O GLY B 50 -2.615 14.345 8.881 1.00 0.00 O ATOM 0 H GLY B 50 -4.561 13.480 11.854 1.00 0.00 H new ATOM 0 HA2 GLY B 50 -5.211 15.672 9.957 1.00 0.00 H new ATOM 0 HA3 GLY B 50 -3.722 15.450 10.855 1.00 0.00 H new ATOM 933 N TYR B 51 -4.672 13.683 8.206 1.00 0.00 N ATOM 934 CA TYR B 51 -4.215 12.776 7.132 1.00 0.00 C ATOM 935 C TYR B 51 -4.984 13.101 5.803 1.00 0.00 C ATOM 936 O TYR B 51 -6.000 12.481 5.479 1.00 0.00 O ATOM 937 CB TYR B 51 -4.423 11.301 7.594 1.00 0.00 C ATOM 938 CG TYR B 51 -3.690 10.630 8.778 1.00 0.00 C ATOM 939 CD1 TYR B 51 -2.443 11.059 9.244 1.00 0.00 C ATOM 940 CD2 TYR B 51 -4.214 9.423 9.264 1.00 0.00 C ATOM 941 CE1 TYR B 51 -1.737 10.299 10.175 1.00 0.00 C ATOM 942 CE2 TYR B 51 -3.499 8.658 10.184 1.00 0.00 C ATOM 943 CZ TYR B 51 -2.261 9.100 10.637 1.00 0.00 C ATOM 944 OH TYR B 51 -1.524 8.343 11.506 1.00 0.00 O ATOM 0 H TYR B 51 -5.685 13.797 8.245 1.00 0.00 H new ATOM 0 HA TYR B 51 -3.153 12.918 6.932 1.00 0.00 H new ATOM 0 HB2 TYR B 51 -5.488 11.201 7.806 1.00 0.00 H new ATOM 0 HB3 TYR B 51 -4.212 10.682 6.722 1.00 0.00 H new ATOM 0 HD1 TYR B 51 -2.024 11.986 8.880 1.00 0.00 H new ATOM 0 HD2 TYR B 51 -5.180 9.083 8.922 1.00 0.00 H new ATOM 0 HE1 TYR B 51 -0.780 10.644 10.538 1.00 0.00 H new ATOM 0 HE2 TYR B 51 -3.906 7.724 10.544 1.00 0.00 H new ATOM 0 HH TYR B 51 -2.010 7.518 11.715 1.00 0.00 H new ATOM 945 N ARG B 52 -4.493 14.070 5.013 1.00 0.00 N ATOM 946 CA ARG B 52 -4.857 14.185 3.559 1.00 0.00 C ATOM 947 C ARG B 52 -3.635 14.621 2.674 1.00 0.00 C ATOM 948 O ARG B 52 -2.881 15.540 3.016 1.00 0.00 O ATOM 949 CB ARG B 52 -6.123 15.057 3.353 1.00 0.00 C ATOM 950 CG ARG B 52 -6.774 14.988 1.941 1.00 0.00 C ATOM 951 CD ARG B 52 -7.305 13.602 1.504 1.00 0.00 C ATOM 952 NE ARG B 52 -6.245 12.786 0.845 1.00 0.00 N ATOM 953 CZ ARG B 52 -6.325 11.489 0.572 1.00 0.00 C ATOM 954 NH1 ARG B 52 -7.352 10.743 0.845 1.00 0.00 N ATOM 955 NH2 ARG B 52 -5.318 10.936 -0.004 1.00 0.00 N ATOM 0 H ARG B 52 -3.846 14.789 5.338 1.00 0.00 H new ATOM 0 HA ARG B 52 -5.123 13.189 3.205 1.00 0.00 H new ATOM 0 HB2 ARG B 52 -6.869 14.760 4.090 1.00 0.00 H new ATOM 0 HB3 ARG B 52 -5.864 16.095 3.562 1.00 0.00 H new ATOM 0 HG2 ARG B 52 -7.601 15.698 1.909 1.00 0.00 H new ATOM 0 HG3 ARG B 52 -6.039 15.321 1.208 1.00 0.00 H new ATOM 0 HD2 ARG B 52 -7.687 13.068 2.374 1.00 0.00 H new ATOM 0 HD3 ARG B 52 -8.142 13.733 0.818 1.00 0.00 H new ATOM 0 HE ARG B 52 -5.384 13.266 0.581 1.00 0.00 H new ATOM 0 HH11 ARG B 52 -8.170 11.148 1.300 1.00 0.00 H new ATOM 0 HH12 ARG B 52 -7.341 9.752 0.605 1.00 0.00 H new ATOM 0 HH21 ARG B 52 -4.494 11.492 -0.235 1.00 0.00 H new ATOM 0 HH22 ARG B 52 -5.342 9.942 -0.230 1.00 0.00 H new ATOM 956 N ASN B 53 -3.338 13.849 1.603 1.00 0.00 N ATOM 957 CA ASN B 53 -1.934 13.653 1.111 1.00 0.00 C ATOM 958 C ASN B 53 -1.718 12.774 -0.165 1.00 0.00 C ATOM 959 O ASN B 53 -2.597 12.042 -0.598 1.00 0.00 O ATOM 960 CB ASN B 53 -1.091 13.068 2.330 1.00 0.00 C ATOM 961 CG ASN B 53 -1.189 11.571 2.593 1.00 0.00 C ATOM 962 OD1 ASN B 53 -0.230 10.947 3.024 1.00 0.00 O ATOM 963 ND2 ASN B 53 -2.296 10.959 2.267 1.00 0.00 N ATOM 0 H ASN B 53 -4.041 13.349 1.058 1.00 0.00 H new ATOM 0 HA ASN B 53 -1.604 14.634 0.770 1.00 0.00 H new ATOM 0 HB2 ASN B 53 -0.042 13.313 2.163 1.00 0.00 H new ATOM 0 HB3 ASN B 53 -1.400 13.590 3.235 1.00 0.00 H new ATOM 0 HD21 ASN B 53 -2.369 9.947 2.371 1.00 0.00 H new ATOM 0 HD22 ASN B 53 -3.088 11.493 1.909 1.00 0.00 H new ATOM 964 N ASP B 54 -0.449 12.714 -0.584 1.00 0.00 N ATOM 965 CA ASP B 54 0.142 11.869 -1.652 1.00 0.00 C ATOM 966 C ASP B 54 0.681 10.465 -1.225 1.00 0.00 C ATOM 967 O ASP B 54 1.507 9.768 -1.806 1.00 0.00 O ATOM 968 CB ASP B 54 0.934 12.759 -2.645 1.00 0.00 C ATOM 969 CG ASP B 54 1.144 14.268 -2.427 1.00 0.00 C ATOM 970 OD1 ASP B 54 0.272 15.105 -2.632 1.00 0.00 O ATOM 971 OD2 ASP B 54 2.405 14.557 -1.997 1.00 0.00 O ATOM 0 H ASP B 54 0.262 13.304 -0.152 1.00 0.00 H new ATOM 0 HA ASP B 54 -0.653 11.443 -2.264 1.00 0.00 H new ATOM 0 HB2 ASP B 54 1.926 12.317 -2.734 1.00 0.00 H new ATOM 0 HB3 ASP B 54 0.448 12.650 -3.615 1.00 0.00 H new ATOM 972 N ALA B 55 -0.127 9.853 -0.397 1.00 0.00 N ATOM 973 CA ALA B 55 -0.745 8.580 -0.805 1.00 0.00 C ATOM 974 C ALA B 55 -1.806 8.595 -1.985 1.00 0.00 C ATOM 975 O ALA B 55 -1.864 7.669 -2.796 1.00 0.00 O ATOM 976 CB ALA B 55 -1.198 8.119 0.549 1.00 0.00 C ATOM 0 H ALA B 55 -0.377 10.185 0.534 1.00 0.00 H new ATOM 0 HA ALA B 55 -0.080 7.896 -1.331 1.00 0.00 H new ATOM 0 HB1 ALA B 55 -1.699 7.155 0.456 1.00 0.00 H new ATOM 0 HB2 ALA B 55 -0.335 8.018 1.207 1.00 0.00 H new ATOM 0 HB3 ALA B 55 -1.890 8.849 0.969 1.00 0.00 H new ATOM 977 N GLU B 56 -2.458 9.742 -2.249 1.00 0.00 N ATOM 978 CA GLU B 56 -2.701 10.251 -3.647 1.00 0.00 C ATOM 979 C GLU B 56 -1.496 10.349 -4.692 1.00 0.00 C ATOM 980 O GLU B 56 -1.679 10.678 -5.869 1.00 0.00 O ATOM 981 CB GLU B 56 -3.351 11.635 -3.337 1.00 0.00 C ATOM 982 CG GLU B 56 -3.988 12.465 -4.450 1.00 0.00 C ATOM 983 CD GLU B 56 -5.121 11.791 -5.222 1.00 0.00 C ATOM 984 OE1 GLU B 56 -6.295 11.814 -4.528 1.00 0.00 O ATOM 985 OE2 GLU B 56 -4.979 11.275 -6.325 1.00 0.00 O ATOM 0 H GLU B 56 -2.835 10.349 -1.521 1.00 0.00 H new ATOM 0 HA GLU B 56 -3.292 9.527 -4.207 1.00 0.00 H new ATOM 0 HB2 GLU B 56 -4.120 11.466 -2.583 1.00 0.00 H new ATOM 0 HB3 GLU B 56 -2.582 12.254 -2.875 1.00 0.00 H new ATOM 0 HG2 GLU B 56 -4.370 13.388 -4.014 1.00 0.00 H new ATOM 0 HG3 GLU B 56 -3.209 12.746 -5.159 1.00 0.00 H new ATOM 986 N ARG B 57 -0.307 9.856 -4.327 1.00 0.00 N ATOM 987 CA ARG B 57 0.809 9.553 -5.265 1.00 0.00 C ATOM 988 C ARG B 57 1.012 8.065 -5.546 1.00 0.00 C ATOM 989 O ARG B 57 1.170 7.734 -6.712 1.00 0.00 O ATOM 990 CB ARG B 57 2.098 9.953 -4.590 1.00 0.00 C ATOM 991 CG ARG B 57 3.497 9.767 -5.209 1.00 0.00 C ATOM 992 CD ARG B 57 4.471 9.900 -4.047 1.00 0.00 C ATOM 993 NE ARG B 57 4.657 8.580 -3.389 1.00 0.00 N ATOM 994 CZ ARG B 57 5.170 8.386 -2.185 1.00 0.00 C ATOM 995 NH1 ARG B 57 5.655 9.331 -1.449 1.00 0.00 N ATOM 996 NH2 ARG B 57 5.205 7.187 -1.730 1.00 0.00 N ATOM 0 H ARG B 57 -0.077 9.648 -3.355 1.00 0.00 H new ATOM 0 HA ARG B 57 0.563 10.076 -6.189 1.00 0.00 H new ATOM 0 HB2 ARG B 57 2.005 11.016 -4.365 1.00 0.00 H new ATOM 0 HB3 ARG B 57 2.116 9.426 -3.636 1.00 0.00 H new ATOM 0 HG2 ARG B 57 3.588 8.793 -5.689 1.00 0.00 H new ATOM 0 HG3 ARG B 57 3.692 10.519 -5.974 1.00 0.00 H new ATOM 0 HD2 ARG B 57 5.429 10.276 -4.406 1.00 0.00 H new ATOM 0 HD3 ARG B 57 4.094 10.625 -3.326 1.00 0.00 H new ATOM 0 HE ARG B 57 4.364 7.754 -3.910 1.00 0.00 H new ATOM 0 HH11 ARG B 57 5.656 10.293 -1.789 1.00 0.00 H new ATOM 0 HH12 ARG B 57 6.037 9.115 -0.528 1.00 0.00 H new ATOM 0 HH21 ARG B 57 4.844 6.417 -2.293 1.00 0.00 H new ATOM 0 HH22 ARG B 57 5.594 7.004 -0.805 1.00 0.00 H new ATOM 997 N LEU B 58 1.096 7.155 -4.544 1.00 0.00 N ATOM 998 CA LEU B 58 1.054 5.700 -4.928 1.00 0.00 C ATOM 999 C LEU B 58 -0.239 5.285 -5.747 1.00 0.00 C ATOM 1000 O LEU B 58 -0.124 4.550 -6.729 1.00 0.00 O ATOM 1001 CB LEU B 58 1.649 4.696 -3.903 1.00 0.00 C ATOM 1002 CG LEU B 58 1.207 4.634 -2.428 1.00 0.00 C ATOM 1003 CD1 LEU B 58 1.917 5.690 -1.582 1.00 0.00 C ATOM 1004 CD2 LEU B 58 -0.298 4.707 -2.227 1.00 0.00 C ATOM 0 H LEU B 58 1.185 7.361 -3.549 1.00 0.00 H new ATOM 0 HA LEU B 58 1.826 5.588 -5.689 1.00 0.00 H new ATOM 0 HB2 LEU B 58 1.485 3.701 -4.316 1.00 0.00 H new ATOM 0 HB3 LEU B 58 2.726 4.865 -3.895 1.00 0.00 H new ATOM 0 HG LEU B 58 1.510 3.645 -2.084 1.00 0.00 H new ATOM 0 HD11 LEU B 58 1.580 5.615 -0.548 1.00 0.00 H new ATOM 0 HD12 LEU B 58 2.994 5.527 -1.625 1.00 0.00 H new ATOM 0 HD13 LEU B 58 1.685 6.682 -1.969 1.00 0.00 H new ATOM 0 HD21 LEU B 58 -0.526 4.657 -1.162 1.00 0.00 H new ATOM 0 HD22 LEU B 58 -0.674 5.645 -2.635 1.00 0.00 H new ATOM 0 HD23 LEU B 58 -0.774 3.871 -2.739 1.00 0.00 H new ATOM 1005 N ALA B 59 -1.373 6.001 -5.588 1.00 0.00 N ATOM 1006 CA ALA B 59 -2.154 6.495 -6.757 1.00 0.00 C ATOM 1007 C ALA B 59 -1.450 6.991 -8.069 1.00 0.00 C ATOM 1008 O ALA B 59 -1.183 6.185 -8.964 1.00 0.00 O ATOM 1009 CB ALA B 59 -2.951 7.670 -6.136 1.00 0.00 C ATOM 0 H ALA B 59 -1.768 6.250 -4.681 1.00 0.00 H new ATOM 0 HA ALA B 59 -2.685 5.634 -7.162 1.00 0.00 H new ATOM 0 HB1 ALA B 59 -3.577 8.130 -6.901 1.00 0.00 H new ATOM 0 HB2 ALA B 59 -3.580 7.296 -5.328 1.00 0.00 H new ATOM 0 HB3 ALA B 59 -2.257 8.412 -5.741 1.00 0.00 H new ATOM 1010 N ASP B 60 -1.212 8.302 -8.272 1.00 0.00 N ATOM 1011 CA ASP B 60 -0.903 8.802 -9.634 1.00 0.00 C ATOM 1012 C ASP B 60 0.528 8.567 -10.164 1.00 0.00 C ATOM 1013 O ASP B 60 0.767 8.816 -11.338 1.00 0.00 O ATOM 1014 CB ASP B 60 -1.243 10.306 -9.630 1.00 0.00 C ATOM 1015 CG ASP B 60 -2.617 10.614 -10.203 1.00 0.00 C ATOM 1016 OD1 ASP B 60 -2.894 10.510 -11.395 1.00 0.00 O ATOM 1017 OD2 ASP B 60 -3.504 10.993 -9.246 1.00 0.00 O ATOM 0 H ASP B 60 -1.225 9.014 -7.542 1.00 0.00 H new ATOM 0 HA ASP B 60 -1.503 8.216 -10.330 1.00 0.00 H new ATOM 0 HB2 ASP B 60 -1.191 10.680 -8.608 1.00 0.00 H new ATOM 0 HB3 ASP B 60 -0.489 10.843 -10.205 1.00 0.00 H new ATOM 1018 N GLU B 61 1.441 8.028 -9.367 1.00 0.00 N ATOM 1019 CA GLU B 61 2.673 7.411 -9.874 1.00 0.00 C ATOM 1020 C GLU B 61 2.637 5.857 -9.964 1.00 0.00 C ATOM 1021 O GLU B 61 3.415 5.383 -10.784 1.00 0.00 O ATOM 1022 CB GLU B 61 3.898 8.085 -9.196 1.00 0.00 C ATOM 1023 CG GLU B 61 4.538 9.269 -9.992 1.00 0.00 C ATOM 1024 CD GLU B 61 3.625 10.387 -10.505 1.00 0.00 C ATOM 1025 OE1 GLU B 61 3.222 11.301 -9.798 1.00 0.00 O ATOM 1026 OE2 GLU B 61 3.315 10.252 -11.828 1.00 0.00 O ATOM 0 H GLU B 61 1.354 8.003 -8.351 1.00 0.00 H new ATOM 0 HA GLU B 61 2.782 7.623 -10.938 1.00 0.00 H new ATOM 0 HB2 GLU B 61 3.593 8.451 -8.216 1.00 0.00 H new ATOM 0 HB3 GLU B 61 4.663 7.326 -9.029 1.00 0.00 H new ATOM 0 HG2 GLU B 61 5.294 9.726 -9.354 1.00 0.00 H new ATOM 0 HG3 GLU B 61 5.059 8.847 -10.851 1.00 0.00 H new ATOM 1027 N GLN B 62 1.750 5.011 -9.366 1.00 0.00 N ATOM 1028 CA GLN B 62 1.631 3.616 -9.897 1.00 0.00 C ATOM 1029 C GLN B 62 0.723 3.512 -11.189 1.00 0.00 C ATOM 1030 O GLN B 62 0.812 2.524 -11.899 1.00 0.00 O ATOM 1031 CB GLN B 62 1.376 2.690 -8.669 1.00 0.00 C ATOM 1032 CG GLN B 62 0.107 1.807 -8.583 1.00 0.00 C ATOM 1033 CD GLN B 62 -1.228 2.226 -9.174 1.00 0.00 C ATOM 1034 OE1 GLN B 62 -1.905 1.480 -9.870 1.00 0.00 O ATOM 1035 NE2 GLN B 62 -1.629 3.442 -8.970 1.00 0.00 N ATOM 0 H GLN B 62 1.148 5.242 -8.576 1.00 0.00 H new ATOM 0 HA GLN B 62 2.547 3.237 -10.351 1.00 0.00 H new ATOM 0 HB2 GLN B 62 2.234 2.023 -8.589 1.00 0.00 H new ATOM 0 HB3 GLN B 62 1.383 3.326 -7.784 1.00 0.00 H new ATOM 0 HG2 GLN B 62 0.362 0.851 -9.040 1.00 0.00 H new ATOM 0 HG3 GLN B 62 -0.068 1.617 -7.524 1.00 0.00 H new ATOM 0 HE21 GLN B 62 -1.073 4.072 -8.392 1.00 0.00 H new ATOM 0 HE22 GLN B 62 -2.500 3.768 -9.388 1.00 0.00 H new ATOM 1036 N SER B 63 -0.124 4.528 -11.430 1.00 0.00 N ATOM 1037 CA SER B 63 -1.347 4.568 -12.277 1.00 0.00 C ATOM 1038 C SER B 63 -1.598 5.863 -13.147 1.00 0.00 C ATOM 1039 O SER B 63 -2.465 5.891 -14.023 1.00 0.00 O ATOM 1040 CB SER B 63 -2.377 3.410 -12.247 1.00 0.00 C ATOM 1041 OG SER B 63 -3.287 3.429 -13.350 1.00 0.00 O ATOM 0 H SER B 63 0.040 5.437 -10.997 1.00 0.00 H new ATOM 0 HA SER B 63 -1.319 3.730 -12.974 1.00 0.00 H new ATOM 0 HB2 SER B 63 -1.844 2.459 -12.242 1.00 0.00 H new ATOM 0 HB3 SER B 63 -2.944 3.462 -11.317 1.00 0.00 H new ATOM 0 HG SER B 63 -3.288 4.320 -13.758 1.00 0.00 H new ATOM 1042 N GLU B 64 -0.816 6.930 -12.964 1.00 0.00 N ATOM 1043 CA GLU B 64 0.003 7.468 -14.081 1.00 0.00 C ATOM 1044 C GLU B 64 1.548 7.320 -13.809 1.00 0.00 C ATOM 1045 O GLU B 64 2.324 8.244 -14.062 1.00 0.00 O ATOM 1046 CB GLU B 64 -0.414 8.938 -14.317 1.00 0.00 C ATOM 1047 CG GLU B 64 -1.855 9.197 -14.828 1.00 0.00 C ATOM 1048 CD GLU B 64 -2.148 10.666 -15.117 1.00 0.00 C ATOM 1049 OE1 GLU B 64 -2.501 11.359 -13.995 1.00 0.00 O ATOM 1050 OE2 GLU B 64 -2.075 11.157 -16.239 1.00 0.00 O ATOM 0 H GLU B 64 -0.725 7.435 -12.083 1.00 0.00 H new ATOM 0 HA GLU B 64 -0.184 6.888 -14.985 1.00 0.00 H new ATOM 0 HB2 GLU B 64 -0.287 9.479 -13.379 1.00 0.00 H new ATOM 0 HB3 GLU B 64 0.281 9.375 -15.034 1.00 0.00 H new ATOM 0 HG2 GLU B 64 -2.019 8.617 -15.737 1.00 0.00 H new ATOM 0 HG3 GLU B 64 -2.565 8.833 -14.086 1.00 0.00 H new ATOM 1051 N LEU B 65 2.059 6.129 -13.445 1.00 0.00 N ATOM 1052 CA LEU B 65 3.225 5.563 -14.228 1.00 0.00 C ATOM 1053 C LEU B 65 2.852 4.270 -15.010 1.00 0.00 C ATOM 1054 O LEU B 65 2.847 4.287 -16.242 1.00 0.00 O ATOM 1055 CB LEU B 65 4.601 5.452 -13.519 1.00 0.00 C ATOM 1056 CG LEU B 65 5.134 6.737 -12.852 1.00 0.00 C ATOM 1057 CD1 LEU B 65 6.284 6.424 -11.883 1.00 0.00 C ATOM 1058 CD2 LEU B 65 5.568 7.831 -13.840 1.00 0.00 C ATOM 0 H LEU B 65 1.726 5.555 -12.670 1.00 0.00 H new ATOM 0 HA LEU B 65 3.412 6.364 -14.943 1.00 0.00 H new ATOM 0 HB2 LEU B 65 4.531 4.675 -12.757 1.00 0.00 H new ATOM 0 HB3 LEU B 65 5.336 5.116 -14.250 1.00 0.00 H new ATOM 0 HG LEU B 65 4.284 7.140 -12.301 1.00 0.00 H new ATOM 0 HD11 LEU B 65 6.639 7.349 -11.428 1.00 0.00 H new ATOM 0 HD12 LEU B 65 5.930 5.749 -11.104 1.00 0.00 H new ATOM 0 HD13 LEU B 65 7.101 5.951 -12.428 1.00 0.00 H new ATOM 0 HD21 LEU B 65 5.929 8.698 -13.287 1.00 0.00 H new ATOM 0 HD22 LEU B 65 6.365 7.450 -14.478 1.00 0.00 H new ATOM 0 HD23 LEU B 65 4.718 8.122 -14.457 1.00 0.00 H new ATOM 1059 N VAL B 66 2.427 3.202 -14.316 1.00 0.00 N ATOM 1060 CA VAL B 66 1.668 2.060 -14.956 1.00 0.00 C ATOM 1061 C VAL B 66 2.298 1.203 -16.116 1.00 0.00 C ATOM 1062 O VAL B 66 2.650 0.036 -15.931 1.00 0.00 O ATOM 1063 CB VAL B 66 0.142 2.392 -15.243 1.00 0.00 C ATOM 1064 CG1 VAL B 66 -0.796 1.507 -14.419 1.00 0.00 C ATOM 1065 CG2 VAL B 66 -0.292 3.843 -15.041 1.00 0.00 C ATOM 0 H VAL B 66 2.584 3.084 -13.315 1.00 0.00 H new ATOM 0 HA VAL B 66 1.767 1.358 -14.128 1.00 0.00 H new ATOM 0 HB VAL B 66 0.062 2.188 -16.311 1.00 0.00 H new ATOM 0 HG11 VAL B 66 -1.831 1.765 -14.644 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -0.621 0.460 -14.668 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -0.605 1.664 -13.357 1.00 0.00 H new ATOM 0 HG21 VAL B 66 -1.354 3.940 -15.269 1.00 0.00 H new ATOM 0 HG22 VAL B 66 -0.115 4.135 -14.006 1.00 0.00 H new ATOM 0 HG23 VAL B 66 0.282 4.490 -15.704 1.00 0.00 H new TER 1066 VAL B 66