USER MOD reduce.3.24.130724 H: found=0, std=0, add=1215, rem=0, adj=27 USER MOD reduce.3.24.130724 removed 1224 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 62 THR OG1 : rot -106:sc= 0.179 USER MOD Set 1.2: A 102 HIS : no HE2:sc= 0.143 K(o=0.38,f=-2.5!) USER MOD Set 1.3: A 106 HIS :FLIP no HE2:sc= 0.0615 F(o=-2.3,f=0.38) USER MOD Set 2.1: A 89 ASN :FLIP amide:sc= -1.2! C(o=-1.9!,f=-1.2!) USER MOD Set 2.2: A 145 SER OG : rot 150:sc= -0.0317 USER MOD Single : A 1 MET CE :methyl 140:sc= -1.82 (180deg=-4.71!) USER MOD Single : A 1 MET N :NH3+ 179:sc= -2.59 (180deg=-2.63) USER MOD Single : A 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 11 SER OG : rot 180:sc= 0.109 USER MOD Single : A 12 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 16 ASN : amide:sc= -0.12 K(o=-0.12,f=-2.2!) USER MOD Single : A 18 LYS NZ :NH3+ -141:sc= -1.56 (180deg=-4.64!) USER MOD Single : A 20 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 27 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 33 HIS : no HD1:sc= -0.0945 X(o=-0.094,f=-0.006) USER MOD Single : A 35 ASN : amide:sc= -0.718 K(o=-0.72,f=-2.4!) USER MOD Single : A 40 SER OG : rot 180:sc= -1.15 USER MOD Single : A 45 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 48 ASN : amide:sc= -4.56! C(o=-4.6!,f=-6.8!) USER MOD Single : A 49 GLN : amide:sc= 0 X(o=0,f=-0.16) USER MOD Single : A 50 GLN : amide:sc= -0.136 K(o=-0.14,f=-1.6!) USER MOD Single : A 54 GLN : amide:sc= -2.15 X(o=-2.2,f=-2) USER MOD Single : A 58 THR OG1 : rot 180:sc= -0.445 USER MOD Single : A 66 MET CE :methyl 151:sc= -2.38! (180deg=-3.78!) USER MOD Single : A 71 TYR OH : rot 180:sc= 0 USER MOD Single : A 75 TYR OH : rot -71:sc= 1.19 USER MOD Single : A 77 CYS SG : rot 140:sc= -7.06! USER MOD Single : A 84 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 90 ASN : amide:sc= -0.0873 X(o=-0.087,f=-0.074) USER MOD Single : A 91 THR OG1 : rot 180:sc= 0.0206 USER MOD Single : A 94 LYS NZ :NH3+ -127:sc= -0.42 (180deg=-2.27!) USER MOD Single : A 110 TYR OH : rot 178:sc= -0.304 USER MOD Single : A 112 HIS : no HD1:sc= -0.0404 X(o=-0.04,f=0) USER MOD Single : A 117 LYS NZ :NH3+ 151:sc= 1.13 (180deg=0.531) USER MOD Single : A 118 ASN : amide:sc= -0.306 X(o=-0.31,f=0) USER MOD Single : A 119 SER OG : rot 54:sc= 0.0439 USER MOD Single : A 120 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 122 MET CE :methyl -118:sc= -1.22 (180deg=-4.55!) USER MOD Single : A 125 LYS NZ :NH3+ 148:sc= -0.305 (180deg=-1.79!) USER MOD Single : A 126 GLN :FLIP amide:sc= -0.15 F(o=-0.89,f=-0.15) USER MOD Single : A 127 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 128 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 129 TYR OH : rot 60:sc= -0.277 USER MOD Single : A 139 SER OG : rot 180:sc= 0 USER MOD Single : A 140 ASN :FLIP amide:sc= -0.516 F(o=-1.2,f=-0.52) USER MOD Single : A 142 SER OG : rot 180:sc= 0 USER MOD Single : A 149 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -2.003 -3.194 13.473 1.00 0.00 N ATOM 2 CA MET A 1 -1.330 -4.399 13.021 1.00 0.00 C ATOM 3 C MET A 1 -0.649 -4.173 11.670 1.00 0.00 C ATOM 4 O MET A 1 -1.044 -4.762 10.665 1.00 0.00 O ATOM 5 CB MET A 1 -2.346 -5.536 12.897 1.00 0.00 C ATOM 6 CG MET A 1 -2.375 -6.387 14.168 1.00 0.00 C ATOM 7 SD MET A 1 -3.370 -5.588 15.416 1.00 0.00 S ATOM 8 CE MET A 1 -4.999 -5.879 14.746 1.00 0.00 C ATOM 0 H1 MET A 1 -2.471 -3.378 14.383 1.00 0.00 H new ATOM 0 H2 MET A 1 -1.307 -2.431 13.590 1.00 0.00 H new ATOM 0 H3 MET A 1 -2.714 -2.909 12.770 1.00 0.00 H new ATOM 0 HA MET A 1 -0.566 -4.661 13.752 1.00 0.00 H new ATOM 0 HB2 MET A 1 -3.337 -5.124 12.709 1.00 0.00 H new ATOM 0 HB3 MET A 1 -2.093 -6.162 12.041 1.00 0.00 H new ATOM 0 HG2 MET A 1 -2.780 -7.374 13.945 1.00 0.00 H new ATOM 0 HG3 MET A 1 -1.361 -6.535 14.540 1.00 0.00 H new ATOM 0 HE1 MET A 1 -5.686 -6.126 15.555 1.00 0.00 H new ATOM 0 HE2 MET A 1 -5.348 -4.982 14.235 1.00 0.00 H new ATOM 0 HE3 MET A 1 -4.959 -6.707 14.038 1.00 0.00 H new ATOM 18 N ILE A 2 0.363 -3.318 11.689 1.00 0.00 N ATOM 19 CA ILE A 2 1.103 -3.007 10.478 1.00 0.00 C ATOM 20 C ILE A 2 2.600 -2.974 10.794 1.00 0.00 C ATOM 21 O ILE A 2 2.992 -2.736 11.935 1.00 0.00 O ATOM 22 CB ILE A 2 0.579 -1.715 9.847 1.00 0.00 C ATOM 23 CG1 ILE A 2 -0.935 -1.782 9.639 1.00 0.00 C ATOM 24 CG2 ILE A 2 1.323 -1.398 8.548 1.00 0.00 C ATOM 25 CD1 ILE A 2 -1.679 -1.164 10.825 1.00 0.00 C ATOM 0 H ILE A 2 0.688 -2.831 12.524 1.00 0.00 H new ATOM 0 HA ILE A 2 0.952 -3.785 9.729 1.00 0.00 H new ATOM 0 HB ILE A 2 0.773 -0.894 10.537 1.00 0.00 H new ATOM 0 HG12 ILE A 2 -1.203 -1.256 8.723 1.00 0.00 H new ATOM 0 HG13 ILE A 2 -1.243 -2.820 9.513 1.00 0.00 H new ATOM 0 HG21 ILE A 2 0.931 -0.475 8.120 1.00 0.00 H new ATOM 0 HG22 ILE A 2 2.386 -1.278 8.757 1.00 0.00 H new ATOM 0 HG23 ILE A 2 1.183 -2.214 7.840 1.00 0.00 H new ATOM 0 HD11 ILE A 2 -2.753 -1.224 10.652 1.00 0.00 H new ATOM 0 HD12 ILE A 2 -1.427 -1.707 11.736 1.00 0.00 H new ATOM 0 HD13 ILE A 2 -1.387 -0.119 10.933 1.00 0.00 H new ATOM 37 N ARG A 3 3.395 -3.216 9.762 1.00 0.00 N ATOM 38 CA ARG A 3 4.840 -3.217 9.916 1.00 0.00 C ATOM 39 C ARG A 3 5.509 -2.692 8.644 1.00 0.00 C ATOM 40 O ARG A 3 4.994 -2.883 7.543 1.00 0.00 O ATOM 41 CB ARG A 3 5.361 -4.624 10.215 1.00 0.00 C ATOM 42 CG ARG A 3 6.466 -4.586 11.273 1.00 0.00 C ATOM 43 CD ARG A 3 5.883 -4.337 12.665 1.00 0.00 C ATOM 44 NE ARG A 3 6.844 -3.567 13.486 1.00 0.00 N ATOM 45 CZ ARG A 3 6.528 -2.958 14.649 1.00 0.00 C ATOM 46 NH1 ARG A 3 5.272 -3.024 15.138 1.00 0.00 N ATOM 47 NH2 ARG A 3 7.466 -2.296 15.300 1.00 0.00 N ATOM 0 H ARG A 3 3.066 -3.413 8.817 1.00 0.00 H new ATOM 0 HA ARG A 3 5.085 -2.566 10.755 1.00 0.00 H new ATOM 0 HB2 ARG A 3 4.541 -5.253 10.562 1.00 0.00 H new ATOM 0 HB3 ARG A 3 5.744 -5.076 9.300 1.00 0.00 H new ATOM 0 HG2 ARG A 3 7.013 -5.529 11.267 1.00 0.00 H new ATOM 0 HG3 ARG A 3 7.182 -3.801 11.029 1.00 0.00 H new ATOM 0 HD2 ARG A 3 4.943 -3.791 12.582 1.00 0.00 H new ATOM 0 HD3 ARG A 3 5.658 -5.287 13.149 1.00 0.00 H new ATOM 0 HE ARG A 3 7.805 -3.492 13.152 1.00 0.00 H new ATOM 0 HH11 ARG A 3 4.553 -3.537 14.628 1.00 0.00 H new ATOM 0 HH12 ARG A 3 5.042 -2.561 16.017 1.00 0.00 H new ATOM 0 HH21 ARG A 3 8.413 -2.250 14.923 1.00 0.00 H new ATOM 0 HH22 ARG A 3 7.244 -1.830 16.180 1.00 0.00 H new ATOM 60 N ILE A 4 6.647 -2.041 8.837 1.00 0.00 N ATOM 61 CA ILE A 4 7.392 -1.487 7.719 1.00 0.00 C ATOM 62 C ILE A 4 8.735 -2.209 7.600 1.00 0.00 C ATOM 63 O ILE A 4 9.291 -2.662 8.599 1.00 0.00 O ATOM 64 CB ILE A 4 7.519 0.031 7.859 1.00 0.00 C ATOM 65 CG1 ILE A 4 7.585 0.442 9.331 1.00 0.00 C ATOM 66 CG2 ILE A 4 6.391 0.747 7.114 1.00 0.00 C ATOM 67 CD1 ILE A 4 6.182 0.577 9.927 1.00 0.00 C ATOM 0 H ILE A 4 7.071 -1.885 9.751 1.00 0.00 H new ATOM 0 HA ILE A 4 6.857 -1.653 6.784 1.00 0.00 H new ATOM 0 HB ILE A 4 8.456 0.339 7.396 1.00 0.00 H new ATOM 0 HG12 ILE A 4 8.153 -0.299 9.894 1.00 0.00 H new ATOM 0 HG13 ILE A 4 8.116 1.389 9.424 1.00 0.00 H new ATOM 0 HG21 ILE A 4 6.505 1.825 7.230 1.00 0.00 H new ATOM 0 HG22 ILE A 4 6.433 0.489 6.056 1.00 0.00 H new ATOM 0 HG23 ILE A 4 5.430 0.438 7.525 1.00 0.00 H new ATOM 0 HD11 ILE A 4 6.258 0.870 10.974 1.00 0.00 H new ATOM 0 HD12 ILE A 4 5.625 1.336 9.378 1.00 0.00 H new ATOM 0 HD13 ILE A 4 5.662 -0.378 9.854 1.00 0.00 H new ATOM 79 N LEU A 5 9.219 -2.293 6.369 1.00 0.00 N ATOM 80 CA LEU A 5 10.487 -2.951 6.106 1.00 0.00 C ATOM 81 C LEU A 5 11.371 -2.029 5.265 1.00 0.00 C ATOM 82 O LEU A 5 10.882 -1.075 4.662 1.00 0.00 O ATOM 83 CB LEU A 5 10.256 -4.326 5.475 1.00 0.00 C ATOM 84 CG LEU A 5 9.782 -5.429 6.424 1.00 0.00 C ATOM 85 CD1 LEU A 5 9.805 -6.794 5.733 1.00 0.00 C ATOM 86 CD2 LEU A 5 10.599 -5.427 7.717 1.00 0.00 C ATOM 0 H LEU A 5 8.755 -1.916 5.543 1.00 0.00 H new ATOM 0 HA LEU A 5 11.019 -3.139 7.038 1.00 0.00 H new ATOM 0 HB2 LEU A 5 9.520 -4.219 4.678 1.00 0.00 H new ATOM 0 HB3 LEU A 5 11.186 -4.651 5.009 1.00 0.00 H new ATOM 0 HG LEU A 5 8.747 -5.224 6.697 1.00 0.00 H new ATOM 0 HD11 LEU A 5 9.464 -7.560 6.429 1.00 0.00 H new ATOM 0 HD12 LEU A 5 9.146 -6.773 4.865 1.00 0.00 H new ATOM 0 HD13 LEU A 5 10.821 -7.022 5.412 1.00 0.00 H new ATOM 0 HD21 LEU A 5 10.242 -6.220 8.374 1.00 0.00 H new ATOM 0 HD22 LEU A 5 11.650 -5.595 7.483 1.00 0.00 H new ATOM 0 HD23 LEU A 5 10.488 -4.465 8.216 1.00 0.00 H new ATOM 98 N GLY A 6 12.657 -2.346 5.250 1.00 0.00 N ATOM 99 CA GLY A 6 13.614 -1.558 4.493 1.00 0.00 C ATOM 100 C GLY A 6 13.536 -0.080 4.880 1.00 0.00 C ATOM 101 O GLY A 6 13.507 0.255 6.064 1.00 0.00 O ATOM 0 H GLY A 6 13.059 -3.139 5.751 1.00 0.00 H new ATOM 0 HA2 GLY A 6 14.622 -1.932 4.673 1.00 0.00 H new ATOM 0 HA3 GLY A 6 13.419 -1.669 3.426 1.00 0.00 H new ATOM 105 N GLU A 7 13.504 0.766 3.861 1.00 0.00 N ATOM 106 CA GLU A 7 13.429 2.200 4.080 1.00 0.00 C ATOM 107 C GLU A 7 12.996 2.911 2.796 1.00 0.00 C ATOM 108 O GLU A 7 13.170 2.381 1.700 1.00 0.00 O ATOM 109 CB GLU A 7 14.765 2.748 4.586 1.00 0.00 C ATOM 110 CG GLU A 7 15.932 2.190 3.768 1.00 0.00 C ATOM 111 CD GLU A 7 17.072 1.733 4.681 1.00 0.00 C ATOM 112 OE1 GLU A 7 16.876 0.838 5.517 1.00 0.00 O ATOM 113 OE2 GLU A 7 18.194 2.341 4.497 1.00 0.00 O ATOM 0 H GLU A 7 13.529 0.485 2.881 1.00 0.00 H new ATOM 0 HA GLU A 7 12.680 2.392 4.849 1.00 0.00 H new ATOM 0 HB2 GLU A 7 14.762 3.836 4.526 1.00 0.00 H new ATOM 0 HB3 GLU A 7 14.895 2.487 5.636 1.00 0.00 H new ATOM 0 HG2 GLU A 7 15.588 1.352 3.162 1.00 0.00 H new ATOM 0 HG3 GLU A 7 16.296 2.953 3.080 1.00 0.00 H new ATOM 121 N GLY A 8 12.442 4.101 2.975 1.00 0.00 N ATOM 122 CA GLY A 8 11.983 4.890 1.844 1.00 0.00 C ATOM 123 C GLY A 8 10.734 5.696 2.209 1.00 0.00 C ATOM 124 O GLY A 8 9.827 5.182 2.861 1.00 0.00 O ATOM 0 H GLY A 8 12.301 4.538 3.886 1.00 0.00 H new ATOM 0 HA2 GLY A 8 12.775 5.566 1.522 1.00 0.00 H new ATOM 0 HA3 GLY A 8 11.763 4.233 1.003 1.00 0.00 H new ATOM 128 N LYS A 9 10.728 6.948 1.773 1.00 0.00 N ATOM 129 CA LYS A 9 9.607 7.830 2.046 1.00 0.00 C ATOM 130 C LYS A 9 8.303 7.035 1.946 1.00 0.00 C ATOM 131 O LYS A 9 7.846 6.720 0.849 1.00 0.00 O ATOM 132 CB LYS A 9 9.652 9.054 1.129 1.00 0.00 C ATOM 133 CG LYS A 9 9.243 10.320 1.883 1.00 0.00 C ATOM 134 CD LYS A 9 9.043 11.492 0.920 1.00 0.00 C ATOM 135 CE LYS A 9 7.557 11.811 0.745 1.00 0.00 C ATOM 136 NZ LYS A 9 7.171 12.964 1.588 1.00 0.00 N ATOM 0 H LYS A 9 11.482 7.372 1.233 1.00 0.00 H new ATOM 0 HA LYS A 9 9.667 8.219 3.062 1.00 0.00 H new ATOM 0 HB2 LYS A 9 10.658 9.175 0.727 1.00 0.00 H new ATOM 0 HB3 LYS A 9 8.986 8.901 0.280 1.00 0.00 H new ATOM 0 HG2 LYS A 9 8.321 10.137 2.435 1.00 0.00 H new ATOM 0 HG3 LYS A 9 10.008 10.574 2.616 1.00 0.00 H new ATOM 0 HD2 LYS A 9 9.565 12.371 1.298 1.00 0.00 H new ATOM 0 HD3 LYS A 9 9.483 11.251 -0.048 1.00 0.00 H new ATOM 0 HE2 LYS A 9 7.347 12.032 -0.302 1.00 0.00 H new ATOM 0 HE3 LYS A 9 6.958 10.941 1.013 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 6.159 13.167 1.457 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 7.352 12.740 2.587 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 7.729 13.797 1.313 1.00 0.00 H new ATOM 149 N GLY A 10 7.741 6.734 3.108 1.00 0.00 N ATOM 150 CA GLY A 10 6.499 5.983 3.165 1.00 0.00 C ATOM 151 C GLY A 10 6.273 5.403 4.563 1.00 0.00 C ATOM 152 O GLY A 10 5.133 5.204 4.980 1.00 0.00 O ATOM 0 H GLY A 10 8.123 6.997 4.017 1.00 0.00 H new ATOM 0 HA2 GLY A 10 5.665 6.632 2.897 1.00 0.00 H new ATOM 0 HA3 GLY A 10 6.524 5.176 2.432 1.00 0.00 H new ATOM 156 N SER A 11 7.377 5.149 5.249 1.00 0.00 N ATOM 157 CA SER A 11 7.314 4.597 6.591 1.00 0.00 C ATOM 158 C SER A 11 6.451 5.489 7.485 1.00 0.00 C ATOM 159 O SER A 11 5.494 5.020 8.098 1.00 0.00 O ATOM 160 CB SER A 11 8.714 4.442 7.190 1.00 0.00 C ATOM 161 OG SER A 11 9.729 4.894 6.298 1.00 0.00 O ATOM 0 H SER A 11 8.321 5.315 4.900 1.00 0.00 H new ATOM 0 HA SER A 11 6.862 3.607 6.531 1.00 0.00 H new ATOM 0 HB2 SER A 11 8.774 5.004 8.122 1.00 0.00 H new ATOM 0 HB3 SER A 11 8.889 3.395 7.437 1.00 0.00 H new ATOM 0 HG SER A 11 10.607 4.780 6.717 1.00 0.00 H new ATOM 167 N LYS A 12 6.820 6.761 7.530 1.00 0.00 N ATOM 168 CA LYS A 12 6.091 7.724 8.338 1.00 0.00 C ATOM 169 C LYS A 12 4.694 7.925 7.748 1.00 0.00 C ATOM 170 O LYS A 12 3.707 7.972 8.480 1.00 0.00 O ATOM 171 CB LYS A 12 6.892 9.020 8.480 1.00 0.00 C ATOM 172 CG LYS A 12 7.601 9.372 7.170 1.00 0.00 C ATOM 173 CD LYS A 12 7.802 10.883 7.045 1.00 0.00 C ATOM 174 CE LYS A 12 9.027 11.204 6.186 1.00 0.00 C ATOM 175 NZ LYS A 12 9.988 12.036 6.944 1.00 0.00 N ATOM 0 H LYS A 12 7.614 7.147 7.020 1.00 0.00 H new ATOM 0 HA LYS A 12 5.957 7.347 9.352 1.00 0.00 H new ATOM 0 HB2 LYS A 12 6.226 9.834 8.768 1.00 0.00 H new ATOM 0 HB3 LYS A 12 7.627 8.912 9.278 1.00 0.00 H new ATOM 0 HG2 LYS A 12 8.567 8.868 7.128 1.00 0.00 H new ATOM 0 HG3 LYS A 12 7.015 9.008 6.326 1.00 0.00 H new ATOM 0 HD2 LYS A 12 6.915 11.336 6.603 1.00 0.00 H new ATOM 0 HD3 LYS A 12 7.923 11.321 8.036 1.00 0.00 H new ATOM 0 HE2 LYS A 12 9.509 10.279 5.869 1.00 0.00 H new ATOM 0 HE3 LYS A 12 8.717 11.728 5.282 1.00 0.00 H new ATOM 0 HZ1 LYS A 12 10.813 12.245 6.347 1.00 0.00 H new ATOM 0 HZ2 LYS A 12 9.530 12.926 7.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 12 10.297 11.522 7.794 1.00 0.00 H new ATOM 188 N LEU A 13 4.655 8.039 6.428 1.00 0.00 N ATOM 189 CA LEU A 13 3.395 8.234 5.731 1.00 0.00 C ATOM 190 C LEU A 13 2.383 7.194 6.214 1.00 0.00 C ATOM 191 O LEU A 13 1.188 7.473 6.288 1.00 0.00 O ATOM 192 CB LEU A 13 3.614 8.223 4.217 1.00 0.00 C ATOM 193 CG LEU A 13 2.644 7.362 3.405 1.00 0.00 C ATOM 194 CD1 LEU A 13 1.193 7.767 3.676 1.00 0.00 C ATOM 195 CD2 LEU A 13 2.983 7.409 1.914 1.00 0.00 C ATOM 0 H LEU A 13 5.476 8.000 5.823 1.00 0.00 H new ATOM 0 HA LEU A 13 2.979 9.214 5.963 1.00 0.00 H new ATOM 0 HB2 LEU A 13 3.550 9.249 3.853 1.00 0.00 H new ATOM 0 HB3 LEU A 13 4.629 7.877 4.019 1.00 0.00 H new ATOM 0 HG LEU A 13 2.756 6.327 3.727 1.00 0.00 H new ATOM 0 HD11 LEU A 13 0.524 7.140 3.087 1.00 0.00 H new ATOM 0 HD12 LEU A 13 0.971 7.639 4.735 1.00 0.00 H new ATOM 0 HD13 LEU A 13 1.049 8.811 3.399 1.00 0.00 H new ATOM 0 HD21 LEU A 13 2.278 6.788 1.361 1.00 0.00 H new ATOM 0 HD22 LEU A 13 2.918 8.437 1.558 1.00 0.00 H new ATOM 0 HD23 LEU A 13 3.995 7.035 1.759 1.00 0.00 H new ATOM 207 N LEU A 14 2.900 6.015 6.530 1.00 0.00 N ATOM 208 CA LEU A 14 2.056 4.931 7.004 1.00 0.00 C ATOM 209 C LEU A 14 1.665 5.194 8.460 1.00 0.00 C ATOM 210 O LEU A 14 0.494 5.086 8.821 1.00 0.00 O ATOM 211 CB LEU A 14 2.744 3.582 6.786 1.00 0.00 C ATOM 212 CG LEU A 14 1.819 2.368 6.673 1.00 0.00 C ATOM 213 CD1 LEU A 14 0.579 2.540 7.552 1.00 0.00 C ATOM 214 CD2 LEU A 14 1.454 2.092 5.214 1.00 0.00 C ATOM 0 H LEU A 14 3.892 5.787 6.467 1.00 0.00 H new ATOM 0 HA LEU A 14 1.132 4.888 6.428 1.00 0.00 H new ATOM 0 HB2 LEU A 14 3.342 3.644 5.877 1.00 0.00 H new ATOM 0 HB3 LEU A 14 3.435 3.412 7.611 1.00 0.00 H new ATOM 0 HG LEU A 14 2.355 1.494 7.042 1.00 0.00 H new ATOM 0 HD11 LEU A 14 -0.061 1.664 7.453 1.00 0.00 H new ATOM 0 HD12 LEU A 14 0.883 2.652 8.593 1.00 0.00 H new ATOM 0 HD13 LEU A 14 0.030 3.428 7.237 1.00 0.00 H new ATOM 0 HD21 LEU A 14 0.796 1.225 5.161 1.00 0.00 H new ATOM 0 HD22 LEU A 14 0.944 2.960 4.796 1.00 0.00 H new ATOM 0 HD23 LEU A 14 2.361 1.894 4.643 1.00 0.00 H new ATOM 226 N GLU A 15 2.668 5.535 9.256 1.00 0.00 N ATOM 227 CA GLU A 15 2.443 5.814 10.664 1.00 0.00 C ATOM 228 C GLU A 15 1.325 6.846 10.829 1.00 0.00 C ATOM 229 O GLU A 15 0.672 6.897 11.870 1.00 0.00 O ATOM 230 CB GLU A 15 3.731 6.288 11.341 1.00 0.00 C ATOM 231 CG GLU A 15 4.859 5.273 11.146 1.00 0.00 C ATOM 232 CD GLU A 15 5.821 5.288 12.336 1.00 0.00 C ATOM 233 OE1 GLU A 15 5.402 5.566 13.469 1.00 0.00 O ATOM 234 OE2 GLU A 15 7.044 4.995 12.051 1.00 0.00 O ATOM 0 H GLU A 15 3.638 5.624 8.953 1.00 0.00 H new ATOM 0 HA GLU A 15 2.133 4.890 11.153 1.00 0.00 H new ATOM 0 HB2 GLU A 15 4.029 7.252 10.929 1.00 0.00 H new ATOM 0 HB3 GLU A 15 3.552 6.438 12.406 1.00 0.00 H new ATOM 0 HG2 GLU A 15 4.438 4.275 11.026 1.00 0.00 H new ATOM 0 HG3 GLU A 15 5.404 5.501 10.230 1.00 0.00 H new ATOM 242 N ASN A 16 1.139 7.642 9.786 1.00 0.00 N ATOM 243 CA ASN A 16 0.112 8.669 9.803 1.00 0.00 C ATOM 244 C ASN A 16 -1.267 8.006 9.779 1.00 0.00 C ATOM 245 O ASN A 16 -2.142 8.357 10.569 1.00 0.00 O ATOM 246 CB ASN A 16 0.221 9.577 8.576 1.00 0.00 C ATOM 247 CG ASN A 16 1.194 10.729 8.831 1.00 0.00 C ATOM 248 OD1 ASN A 16 1.508 11.072 9.958 1.00 0.00 O ATOM 249 ND2 ASN A 16 1.652 11.305 7.723 1.00 0.00 N ATOM 0 H ASN A 16 1.682 7.596 8.924 1.00 0.00 H new ATOM 0 HA ASN A 16 0.246 9.265 10.706 1.00 0.00 H new ATOM 0 HB2 ASN A 16 0.557 8.995 7.718 1.00 0.00 H new ATOM 0 HB3 ASN A 16 -0.762 9.975 8.326 1.00 0.00 H new ATOM 0 HD21 ASN A 16 2.307 12.084 7.787 1.00 0.00 H new ATOM 0 HD22 ASN A 16 1.348 10.968 6.810 1.00 0.00 H new ATOM 256 N LEU A 17 -1.417 7.058 8.866 1.00 0.00 N ATOM 257 CA LEU A 17 -2.674 6.342 8.729 1.00 0.00 C ATOM 258 C LEU A 17 -2.474 4.884 9.149 1.00 0.00 C ATOM 259 O LEU A 17 -2.992 3.973 8.506 1.00 0.00 O ATOM 260 CB LEU A 17 -3.231 6.504 7.313 1.00 0.00 C ATOM 261 CG LEU A 17 -2.195 6.626 6.194 1.00 0.00 C ATOM 262 CD1 LEU A 17 -1.339 5.362 6.099 1.00 0.00 C ATOM 263 CD2 LEU A 17 -2.865 6.967 4.862 1.00 0.00 C ATOM 0 H LEU A 17 -0.688 6.769 8.213 1.00 0.00 H new ATOM 0 HA LEU A 17 -3.428 6.765 9.393 1.00 0.00 H new ATOM 0 HB2 LEU A 17 -3.872 5.649 7.096 1.00 0.00 H new ATOM 0 HB3 LEU A 17 -3.865 7.391 7.293 1.00 0.00 H new ATOM 0 HG LEU A 17 -1.525 7.450 6.437 1.00 0.00 H new ATOM 0 HD11 LEU A 17 -0.611 5.475 5.296 1.00 0.00 H new ATOM 0 HD12 LEU A 17 -0.817 5.204 7.043 1.00 0.00 H new ATOM 0 HD13 LEU A 17 -1.979 4.504 5.891 1.00 0.00 H new ATOM 0 HD21 LEU A 17 -2.106 7.048 4.083 1.00 0.00 H new ATOM 0 HD22 LEU A 17 -3.573 6.181 4.599 1.00 0.00 H new ATOM 0 HD23 LEU A 17 -3.394 7.916 4.953 1.00 0.00 H new ATOM 275 N LYS A 18 -1.721 4.710 10.225 1.00 0.00 N ATOM 276 CA LYS A 18 -1.446 3.378 10.738 1.00 0.00 C ATOM 277 C LYS A 18 -2.680 2.856 11.476 1.00 0.00 C ATOM 278 O LYS A 18 -3.108 1.725 11.254 1.00 0.00 O ATOM 279 CB LYS A 18 -0.176 3.384 11.591 1.00 0.00 C ATOM 280 CG LYS A 18 0.846 2.377 11.060 1.00 0.00 C ATOM 281 CD LYS A 18 1.549 1.652 12.209 1.00 0.00 C ATOM 282 CE LYS A 18 3.070 1.737 12.062 1.00 0.00 C ATOM 283 NZ LYS A 18 3.583 0.574 11.305 1.00 0.00 N ATOM 0 H LYS A 18 -1.293 5.469 10.756 1.00 0.00 H new ATOM 0 HA LYS A 18 -1.248 2.687 9.918 1.00 0.00 H new ATOM 0 HB2 LYS A 18 0.260 4.383 11.593 1.00 0.00 H new ATOM 0 HB3 LYS A 18 -0.426 3.143 12.624 1.00 0.00 H new ATOM 0 HG2 LYS A 18 0.347 1.651 10.418 1.00 0.00 H new ATOM 0 HG3 LYS A 18 1.584 2.892 10.445 1.00 0.00 H new ATOM 0 HD2 LYS A 18 1.247 2.091 13.160 1.00 0.00 H new ATOM 0 HD3 LYS A 18 1.240 0.607 12.228 1.00 0.00 H new ATOM 0 HE2 LYS A 18 3.341 2.660 11.550 1.00 0.00 H new ATOM 0 HE3 LYS A 18 3.535 1.771 13.047 1.00 0.00 H new ATOM 0 HZ1 LYS A 18 4.481 0.257 11.722 1.00 0.00 H new ATOM 0 HZ2 LYS A 18 2.890 -0.200 11.346 1.00 0.00 H new ATOM 0 HZ3 LYS A 18 3.739 0.847 10.314 1.00 0.00 H new ATOM 296 N GLU A 19 -3.217 3.706 12.339 1.00 0.00 N ATOM 297 CA GLU A 19 -4.394 3.345 13.111 1.00 0.00 C ATOM 298 C GLU A 19 -5.616 3.235 12.197 1.00 0.00 C ATOM 299 O GLU A 19 -6.492 2.402 12.423 1.00 0.00 O ATOM 300 CB GLU A 19 -4.641 4.350 14.238 1.00 0.00 C ATOM 301 CG GLU A 19 -3.577 4.221 15.330 1.00 0.00 C ATOM 302 CD GLU A 19 -4.218 3.909 16.685 1.00 0.00 C ATOM 303 OE1 GLU A 19 -3.900 2.880 17.298 1.00 0.00 O ATOM 304 OE2 GLU A 19 -5.073 4.782 17.097 1.00 0.00 O ATOM 0 H GLU A 19 -2.859 4.644 12.521 1.00 0.00 H new ATOM 0 HA GLU A 19 -4.219 2.372 13.569 1.00 0.00 H new ATOM 0 HB2 GLU A 19 -4.633 5.363 13.835 1.00 0.00 H new ATOM 0 HB3 GLU A 19 -5.629 4.185 14.667 1.00 0.00 H new ATOM 0 HG2 GLU A 19 -2.873 3.432 15.066 1.00 0.00 H new ATOM 0 HG3 GLU A 19 -3.006 5.147 15.398 1.00 0.00 H new ATOM 312 N LYS A 20 -5.635 4.088 11.183 1.00 0.00 N ATOM 313 CA LYS A 20 -6.735 4.097 10.234 1.00 0.00 C ATOM 314 C LYS A 20 -6.879 2.706 9.613 1.00 0.00 C ATOM 315 O LYS A 20 -7.991 2.255 9.343 1.00 0.00 O ATOM 316 CB LYS A 20 -6.545 5.213 9.205 1.00 0.00 C ATOM 317 CG LYS A 20 -7.762 6.140 9.171 1.00 0.00 C ATOM 318 CD LYS A 20 -7.715 7.151 10.318 1.00 0.00 C ATOM 319 CE LYS A 20 -8.842 6.895 11.321 1.00 0.00 C ATOM 320 NZ LYS A 20 -9.970 7.822 11.079 1.00 0.00 N ATOM 0 H LYS A 20 -4.906 4.777 10.998 1.00 0.00 H new ATOM 0 HA LYS A 20 -7.674 4.319 10.741 1.00 0.00 H new ATOM 0 HB2 LYS A 20 -5.652 5.788 9.448 1.00 0.00 H new ATOM 0 HB3 LYS A 20 -6.386 4.779 8.218 1.00 0.00 H new ATOM 0 HG2 LYS A 20 -7.795 6.668 8.218 1.00 0.00 H new ATOM 0 HG3 LYS A 20 -8.675 5.549 9.240 1.00 0.00 H new ATOM 0 HD2 LYS A 20 -6.752 7.088 10.824 1.00 0.00 H new ATOM 0 HD3 LYS A 20 -7.800 8.162 9.920 1.00 0.00 H new ATOM 0 HE2 LYS A 20 -9.186 5.864 11.236 1.00 0.00 H new ATOM 0 HE3 LYS A 20 -8.469 7.024 12.337 1.00 0.00 H new ATOM 0 HZ1 LYS A 20 -10.727 7.635 11.768 1.00 0.00 H new ATOM 0 HZ2 LYS A 20 -9.641 8.803 11.183 1.00 0.00 H new ATOM 0 HZ3 LYS A 20 -10.336 7.680 10.116 1.00 0.00 H new ATOM 333 N LEU A 21 -5.739 2.065 9.405 1.00 0.00 N ATOM 334 CA LEU A 21 -5.724 0.735 8.822 1.00 0.00 C ATOM 335 C LEU A 21 -6.067 -0.295 9.900 1.00 0.00 C ATOM 336 O LEU A 21 -6.598 -1.362 9.598 1.00 0.00 O ATOM 337 CB LEU A 21 -4.389 0.471 8.122 1.00 0.00 C ATOM 338 CG LEU A 21 -3.922 1.548 7.140 1.00 0.00 C ATOM 339 CD1 LEU A 21 -2.395 1.619 7.090 1.00 0.00 C ATOM 340 CD2 LEU A 21 -4.532 1.327 5.754 1.00 0.00 C ATOM 0 H LEU A 21 -4.818 2.442 9.630 1.00 0.00 H new ATOM 0 HA LEU A 21 -6.486 0.651 8.047 1.00 0.00 H new ATOM 0 HB2 LEU A 21 -3.620 0.345 8.884 1.00 0.00 H new ATOM 0 HB3 LEU A 21 -4.464 -0.475 7.585 1.00 0.00 H new ATOM 0 HG LEU A 21 -4.277 2.514 7.498 1.00 0.00 H new ATOM 0 HD11 LEU A 21 -2.090 2.392 6.385 1.00 0.00 H new ATOM 0 HD12 LEU A 21 -2.009 1.859 8.081 1.00 0.00 H new ATOM 0 HD13 LEU A 21 -1.996 0.657 6.769 1.00 0.00 H new ATOM 0 HD21 LEU A 21 -4.184 2.106 5.075 1.00 0.00 H new ATOM 0 HD22 LEU A 21 -4.228 0.352 5.374 1.00 0.00 H new ATOM 0 HD23 LEU A 21 -5.619 1.366 5.824 1.00 0.00 H new ATOM 352 N GLU A 22 -5.749 0.062 11.136 1.00 0.00 N ATOM 353 CA GLU A 22 -6.017 -0.818 12.261 1.00 0.00 C ATOM 354 C GLU A 22 -7.525 -0.976 12.463 1.00 0.00 C ATOM 355 O GLU A 22 -7.973 -1.929 13.099 1.00 0.00 O ATOM 356 CB GLU A 22 -5.345 -0.300 13.534 1.00 0.00 C ATOM 357 CG GLU A 22 -3.825 -0.455 13.453 1.00 0.00 C ATOM 358 CD GLU A 22 -3.255 -0.976 14.774 1.00 0.00 C ATOM 359 OE1 GLU A 22 -3.600 -2.087 15.202 1.00 0.00 O ATOM 360 OE2 GLU A 22 -2.425 -0.182 15.361 1.00 0.00 O ATOM 0 H GLU A 22 -5.308 0.948 11.383 1.00 0.00 H new ATOM 0 HA GLU A 22 -5.595 -1.798 12.039 1.00 0.00 H new ATOM 0 HB2 GLU A 22 -5.600 0.749 13.683 1.00 0.00 H new ATOM 0 HB3 GLU A 22 -5.724 -0.846 14.398 1.00 0.00 H new ATOM 0 HG2 GLU A 22 -3.569 -1.142 12.646 1.00 0.00 H new ATOM 0 HG3 GLU A 22 -3.370 0.506 13.211 1.00 0.00 H new ATOM 368 N GLU A 23 -8.267 -0.028 11.911 1.00 0.00 N ATOM 369 CA GLU A 23 -9.716 -0.051 12.022 1.00 0.00 C ATOM 370 C GLU A 23 -10.306 -1.085 11.063 1.00 0.00 C ATOM 371 O GLU A 23 -11.075 -1.952 11.475 1.00 0.00 O ATOM 372 CB GLU A 23 -10.307 1.337 11.765 1.00 0.00 C ATOM 373 CG GLU A 23 -9.350 2.436 12.230 1.00 0.00 C ATOM 374 CD GLU A 23 -10.120 3.619 12.821 1.00 0.00 C ATOM 375 OE1 GLU A 23 -11.295 3.826 12.481 1.00 0.00 O ATOM 376 OE2 GLU A 23 -9.455 4.337 13.661 1.00 0.00 O ATOM 0 H GLU A 23 -7.892 0.762 11.385 1.00 0.00 H new ATOM 0 HA GLU A 23 -9.979 -0.339 13.040 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -10.514 1.457 10.702 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -11.258 1.433 12.288 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -8.664 2.034 12.976 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -8.744 2.775 11.390 1.00 0.00 H new ATOM 384 N ILE A 24 -9.924 -0.960 9.800 1.00 0.00 N ATOM 385 CA ILE A 24 -10.406 -1.874 8.778 1.00 0.00 C ATOM 386 C ILE A 24 -10.180 -3.315 9.240 1.00 0.00 C ATOM 387 O ILE A 24 -11.069 -4.156 9.121 1.00 0.00 O ATOM 388 CB ILE A 24 -9.764 -1.553 7.427 1.00 0.00 C ATOM 389 CG1 ILE A 24 -8.247 -1.410 7.561 1.00 0.00 C ATOM 390 CG2 ILE A 24 -10.404 -0.315 6.796 1.00 0.00 C ATOM 391 CD1 ILE A 24 -7.589 -1.242 6.190 1.00 0.00 C ATOM 0 H ILE A 24 -9.286 -0.240 9.461 1.00 0.00 H new ATOM 0 HA ILE A 24 -11.479 -1.751 8.632 1.00 0.00 H new ATOM 0 HB ILE A 24 -9.950 -2.389 6.753 1.00 0.00 H new ATOM 0 HG12 ILE A 24 -8.013 -0.550 8.188 1.00 0.00 H new ATOM 0 HG13 ILE A 24 -7.838 -2.289 8.059 1.00 0.00 H new ATOM 0 HG21 ILE A 24 -9.929 -0.109 5.837 1.00 0.00 H new ATOM 0 HG22 ILE A 24 -11.468 -0.494 6.643 1.00 0.00 H new ATOM 0 HG23 ILE A 24 -10.271 0.541 7.458 1.00 0.00 H new ATOM 0 HD11 ILE A 24 -6.511 -1.142 6.314 1.00 0.00 H new ATOM 0 HD12 ILE A 24 -7.804 -2.115 5.574 1.00 0.00 H new ATOM 0 HD13 ILE A 24 -7.982 -0.349 5.705 1.00 0.00 H new ATOM 403 N VAL A 25 -8.984 -3.555 9.758 1.00 0.00 N ATOM 404 CA VAL A 25 -8.629 -4.879 10.239 1.00 0.00 C ATOM 405 C VAL A 25 -9.473 -5.213 11.471 1.00 0.00 C ATOM 406 O VAL A 25 -10.056 -6.293 11.554 1.00 0.00 O ATOM 407 CB VAL A 25 -7.124 -4.953 10.507 1.00 0.00 C ATOM 408 CG1 VAL A 25 -6.327 -4.736 9.220 1.00 0.00 C ATOM 409 CG2 VAL A 25 -6.710 -3.949 11.585 1.00 0.00 C ATOM 0 H VAL A 25 -8.249 -2.855 9.855 1.00 0.00 H new ATOM 0 HA VAL A 25 -8.848 -5.632 9.481 1.00 0.00 H new ATOM 0 HB VAL A 25 -6.897 -5.953 10.876 1.00 0.00 H new ATOM 0 HG11 VAL A 25 -5.261 -4.794 9.438 1.00 0.00 H new ATOM 0 HG12 VAL A 25 -6.591 -5.505 8.495 1.00 0.00 H new ATOM 0 HG13 VAL A 25 -6.561 -3.754 8.809 1.00 0.00 H new ATOM 0 HG21 VAL A 25 -5.636 -4.022 11.757 1.00 0.00 H new ATOM 0 HG22 VAL A 25 -6.957 -2.940 11.256 1.00 0.00 H new ATOM 0 HG23 VAL A 25 -7.241 -4.170 12.511 1.00 0.00 H new ATOM 419 N LYS A 26 -9.511 -4.266 12.397 1.00 0.00 N ATOM 420 CA LYS A 26 -10.274 -4.447 13.620 1.00 0.00 C ATOM 421 C LYS A 26 -11.735 -4.736 13.267 1.00 0.00 C ATOM 422 O LYS A 26 -12.367 -5.595 13.881 1.00 0.00 O ATOM 423 CB LYS A 26 -10.093 -3.243 14.547 1.00 0.00 C ATOM 424 CG LYS A 26 -10.841 -3.449 15.866 1.00 0.00 C ATOM 425 CD LYS A 26 -9.865 -3.569 17.037 1.00 0.00 C ATOM 426 CE LYS A 26 -9.455 -2.189 17.554 1.00 0.00 C ATOM 427 NZ LYS A 26 -8.401 -2.314 18.586 1.00 0.00 N ATOM 0 H LYS A 26 -9.026 -3.372 12.325 1.00 0.00 H new ATOM 0 HA LYS A 26 -9.903 -5.308 14.176 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -9.032 -3.089 14.746 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -10.459 -2.342 14.054 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -11.519 -2.613 16.038 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -11.453 -4.349 15.804 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -10.327 -4.140 17.842 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -8.979 -4.121 16.722 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -9.092 -1.578 16.728 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -10.323 -1.678 17.972 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -8.134 -1.368 18.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -8.760 -2.880 19.382 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -7.568 -2.782 18.176 1.00 0.00 H new ATOM 440 N LYS A 27 -12.228 -4.004 12.280 1.00 0.00 N ATOM 441 CA LYS A 27 -13.602 -4.171 11.838 1.00 0.00 C ATOM 442 C LYS A 27 -13.806 -5.608 11.353 1.00 0.00 C ATOM 443 O LYS A 27 -14.765 -6.270 11.747 1.00 0.00 O ATOM 444 CB LYS A 27 -13.962 -3.113 10.793 1.00 0.00 C ATOM 445 CG LYS A 27 -15.446 -3.185 10.429 1.00 0.00 C ATOM 446 CD LYS A 27 -15.876 -1.949 9.636 1.00 0.00 C ATOM 447 CE LYS A 27 -17.314 -1.553 9.976 1.00 0.00 C ATOM 448 NZ LYS A 27 -18.252 -2.082 8.961 1.00 0.00 N ATOM 0 H LYS A 27 -11.700 -3.293 11.773 1.00 0.00 H new ATOM 0 HA LYS A 27 -14.290 -4.013 12.668 1.00 0.00 H new ATOM 0 HB2 LYS A 27 -13.726 -2.121 11.178 1.00 0.00 H new ATOM 0 HB3 LYS A 27 -13.357 -3.260 9.898 1.00 0.00 H new ATOM 0 HG2 LYS A 27 -15.637 -4.083 9.842 1.00 0.00 H new ATOM 0 HG3 LYS A 27 -16.044 -3.265 11.337 1.00 0.00 H new ATOM 0 HD2 LYS A 27 -15.205 -1.119 9.857 1.00 0.00 H new ATOM 0 HD3 LYS A 27 -15.793 -2.151 8.568 1.00 0.00 H new ATOM 0 HE2 LYS A 27 -17.580 -1.937 10.961 1.00 0.00 H new ATOM 0 HE3 LYS A 27 -17.396 -0.467 10.025 1.00 0.00 H new ATOM 0 HZ1 LYS A 27 -19.223 -1.804 9.207 1.00 0.00 H new ATOM 0 HZ2 LYS A 27 -18.007 -1.695 8.027 1.00 0.00 H new ATOM 0 HZ3 LYS A 27 -18.185 -3.120 8.934 1.00 0.00 H new ATOM 461 N GLU A 28 -12.888 -6.049 10.506 1.00 0.00 N ATOM 462 CA GLU A 28 -12.954 -7.395 9.963 1.00 0.00 C ATOM 463 C GLU A 28 -12.676 -8.424 11.061 1.00 0.00 C ATOM 464 O GLU A 28 -13.530 -9.254 11.369 1.00 0.00 O ATOM 465 CB GLU A 28 -11.982 -7.564 8.794 1.00 0.00 C ATOM 466 CG GLU A 28 -12.337 -8.795 7.959 1.00 0.00 C ATOM 467 CD GLU A 28 -13.579 -8.537 7.103 1.00 0.00 C ATOM 468 OE1 GLU A 28 -14.520 -9.344 7.117 1.00 0.00 O ATOM 469 OE2 GLU A 28 -13.545 -7.452 6.405 1.00 0.00 O ATOM 0 H GLU A 28 -12.094 -5.497 10.182 1.00 0.00 H new ATOM 0 HA GLU A 28 -13.961 -7.563 9.581 1.00 0.00 H new ATOM 0 HB2 GLU A 28 -12.006 -6.674 8.165 1.00 0.00 H new ATOM 0 HB3 GLU A 28 -10.965 -7.659 9.173 1.00 0.00 H new ATOM 0 HG2 GLU A 28 -11.496 -9.058 7.317 1.00 0.00 H new ATOM 0 HG3 GLU A 28 -12.514 -9.646 8.616 1.00 0.00 H new ATOM 477 N ILE A 29 -11.479 -8.336 11.620 1.00 0.00 N ATOM 478 CA ILE A 29 -11.077 -9.249 12.677 1.00 0.00 C ATOM 479 C ILE A 29 -10.130 -8.527 13.637 1.00 0.00 C ATOM 480 O ILE A 29 -10.395 -8.450 14.835 1.00 0.00 O ATOM 481 CB ILE A 29 -10.492 -10.532 12.083 1.00 0.00 C ATOM 482 CG1 ILE A 29 -10.062 -11.501 13.186 1.00 0.00 C ATOM 483 CG2 ILE A 29 -9.346 -10.216 11.119 1.00 0.00 C ATOM 484 CD1 ILE A 29 -11.274 -12.020 13.962 1.00 0.00 C ATOM 0 H ILE A 29 -10.774 -7.646 11.361 1.00 0.00 H new ATOM 0 HA ILE A 29 -11.943 -9.562 13.260 1.00 0.00 H new ATOM 0 HB ILE A 29 -11.272 -11.028 11.505 1.00 0.00 H new ATOM 0 HG12 ILE A 29 -9.520 -12.339 12.748 1.00 0.00 H new ATOM 0 HG13 ILE A 29 -9.376 -11.000 13.869 1.00 0.00 H new ATOM 0 HG21 ILE A 29 -8.948 -11.145 10.711 1.00 0.00 H new ATOM 0 HG22 ILE A 29 -9.716 -9.591 10.306 1.00 0.00 H new ATOM 0 HG23 ILE A 29 -8.557 -9.686 11.653 1.00 0.00 H new ATOM 0 HD11 ILE A 29 -10.941 -12.707 14.740 1.00 0.00 H new ATOM 0 HD12 ILE A 29 -11.800 -11.182 14.419 1.00 0.00 H new ATOM 0 HD13 ILE A 29 -11.946 -12.542 13.281 1.00 0.00 H new ATOM 496 N GLY A 30 -9.044 -8.017 13.074 1.00 0.00 N ATOM 497 CA GLY A 30 -8.056 -7.304 13.864 1.00 0.00 C ATOM 498 C GLY A 30 -6.981 -8.258 14.389 1.00 0.00 C ATOM 499 O GLY A 30 -6.734 -8.318 15.593 1.00 0.00 O ATOM 0 H GLY A 30 -8.827 -8.084 12.080 1.00 0.00 H new ATOM 0 HA2 GLY A 30 -7.592 -6.526 13.257 1.00 0.00 H new ATOM 0 HA3 GLY A 30 -8.545 -6.806 14.701 1.00 0.00 H new ATOM 503 N ASP A 31 -6.372 -8.981 13.461 1.00 0.00 N ATOM 504 CA ASP A 31 -5.330 -9.929 13.815 1.00 0.00 C ATOM 505 C ASP A 31 -4.638 -10.420 12.541 1.00 0.00 C ATOM 506 O ASP A 31 -4.742 -11.593 12.187 1.00 0.00 O ATOM 507 CB ASP A 31 -5.914 -11.147 14.534 1.00 0.00 C ATOM 508 CG ASP A 31 -4.955 -11.853 15.494 1.00 0.00 C ATOM 509 OD1 ASP A 31 -4.125 -12.674 15.078 1.00 0.00 O ATOM 510 OD2 ASP A 31 -5.086 -11.525 16.735 1.00 0.00 O ATOM 0 H ASP A 31 -6.580 -8.929 12.464 1.00 0.00 H new ATOM 0 HA ASP A 31 -4.625 -9.423 14.475 1.00 0.00 H new ATOM 0 HB2 ASP A 31 -6.796 -10.832 15.092 1.00 0.00 H new ATOM 0 HB3 ASP A 31 -6.249 -11.865 13.786 1.00 0.00 H new ATOM 516 N VAL A 32 -3.948 -9.496 11.888 1.00 0.00 N ATOM 517 CA VAL A 32 -3.240 -9.820 10.661 1.00 0.00 C ATOM 518 C VAL A 32 -1.850 -9.181 10.696 1.00 0.00 C ATOM 519 O VAL A 32 -1.612 -8.247 11.460 1.00 0.00 O ATOM 520 CB VAL A 32 -4.067 -9.387 9.449 1.00 0.00 C ATOM 521 CG1 VAL A 32 -4.388 -7.892 9.511 1.00 0.00 C ATOM 522 CG2 VAL A 32 -3.354 -9.741 8.143 1.00 0.00 C ATOM 0 H VAL A 32 -3.864 -8.524 12.185 1.00 0.00 H new ATOM 0 HA VAL A 32 -3.101 -10.898 10.574 1.00 0.00 H new ATOM 0 HB VAL A 32 -5.010 -9.934 9.474 1.00 0.00 H new ATOM 0 HG11 VAL A 32 -4.977 -7.610 8.638 1.00 0.00 H new ATOM 0 HG12 VAL A 32 -4.957 -7.679 10.416 1.00 0.00 H new ATOM 0 HG13 VAL A 32 -3.460 -7.321 9.523 1.00 0.00 H new ATOM 0 HG21 VAL A 32 -3.964 -9.422 7.298 1.00 0.00 H new ATOM 0 HG22 VAL A 32 -2.389 -9.235 8.106 1.00 0.00 H new ATOM 0 HG23 VAL A 32 -3.200 -10.819 8.093 1.00 0.00 H new ATOM 532 N HIS A 33 -0.970 -9.709 9.859 1.00 0.00 N ATOM 533 CA HIS A 33 0.390 -9.202 9.784 1.00 0.00 C ATOM 534 C HIS A 33 0.733 -8.866 8.332 1.00 0.00 C ATOM 535 O HIS A 33 1.029 -9.757 7.537 1.00 0.00 O ATOM 536 CB HIS A 33 1.374 -10.191 10.412 1.00 0.00 C ATOM 537 CG HIS A 33 1.539 -10.029 11.905 1.00 0.00 C ATOM 538 ND1 HIS A 33 2.778 -9.972 12.520 1.00 0.00 N ATOM 539 CD2 HIS A 33 0.611 -9.912 12.897 1.00 0.00 C ATOM 540 CE1 HIS A 33 2.591 -9.828 13.823 1.00 0.00 C ATOM 541 NE2 HIS A 33 1.247 -9.791 14.055 1.00 0.00 N ATOM 0 H HIS A 33 -1.172 -10.483 9.226 1.00 0.00 H new ATOM 0 HA HIS A 33 0.471 -8.282 10.362 1.00 0.00 H new ATOM 0 HB2 HIS A 33 1.037 -11.206 10.202 1.00 0.00 H new ATOM 0 HB3 HIS A 33 2.347 -10.073 9.934 1.00 0.00 H new ATOM 0 HD2 HIS A 33 -0.461 -9.917 12.763 1.00 0.00 H new ATOM 0 HE1 HIS A 33 3.366 -9.753 14.571 1.00 0.00 H new ATOM 0 HE2 HIS A 33 0.804 -9.687 14.968 1.00 0.00 H new ATOM 549 N VAL A 34 0.682 -7.577 8.029 1.00 0.00 N ATOM 550 CA VAL A 34 0.984 -7.111 6.686 1.00 0.00 C ATOM 551 C VAL A 34 2.168 -6.143 6.740 1.00 0.00 C ATOM 552 O VAL A 34 2.020 -5.000 7.167 1.00 0.00 O ATOM 553 CB VAL A 34 -0.265 -6.494 6.053 1.00 0.00 C ATOM 554 CG1 VAL A 34 0.106 -5.603 4.865 1.00 0.00 C ATOM 555 CG2 VAL A 34 -1.261 -7.578 5.636 1.00 0.00 C ATOM 0 H VAL A 34 0.436 -6.841 8.691 1.00 0.00 H new ATOM 0 HA VAL A 34 1.276 -7.946 6.049 1.00 0.00 H new ATOM 0 HB VAL A 34 -0.747 -5.868 6.804 1.00 0.00 H new ATOM 0 HG11 VAL A 34 -0.799 -5.177 4.433 1.00 0.00 H new ATOM 0 HG12 VAL A 34 0.760 -4.799 5.203 1.00 0.00 H new ATOM 0 HG13 VAL A 34 0.622 -6.198 4.111 1.00 0.00 H new ATOM 0 HG21 VAL A 34 -2.139 -7.112 5.189 1.00 0.00 H new ATOM 0 HG22 VAL A 34 -0.793 -8.242 4.909 1.00 0.00 H new ATOM 0 HG23 VAL A 34 -1.561 -8.153 6.512 1.00 0.00 H new ATOM 565 N ASN A 35 3.316 -6.638 6.301 1.00 0.00 N ATOM 566 CA ASN A 35 4.524 -5.831 6.294 1.00 0.00 C ATOM 567 C ASN A 35 4.755 -5.278 4.887 1.00 0.00 C ATOM 568 O ASN A 35 4.565 -5.986 3.899 1.00 0.00 O ATOM 569 CB ASN A 35 5.746 -6.666 6.681 1.00 0.00 C ATOM 570 CG ASN A 35 5.353 -7.818 7.607 1.00 0.00 C ATOM 571 OD1 ASN A 35 4.393 -7.746 8.357 1.00 0.00 O ATOM 572 ND2 ASN A 35 6.145 -8.883 7.512 1.00 0.00 N ATOM 0 H ASN A 35 3.435 -7.587 5.948 1.00 0.00 H new ATOM 0 HA ASN A 35 4.395 -5.025 7.016 1.00 0.00 H new ATOM 0 HB2 ASN A 35 6.219 -7.062 5.783 1.00 0.00 H new ATOM 0 HB3 ASN A 35 6.482 -6.032 7.176 1.00 0.00 H new ATOM 0 HD21 ASN A 35 5.965 -9.705 8.088 1.00 0.00 H new ATOM 0 HD22 ASN A 35 6.932 -8.877 6.863 1.00 0.00 H new ATOM 579 N VAL A 36 5.163 -4.018 4.840 1.00 0.00 N ATOM 580 CA VAL A 36 5.422 -3.362 3.569 1.00 0.00 C ATOM 581 C VAL A 36 6.930 -3.165 3.400 1.00 0.00 C ATOM 582 O VAL A 36 7.620 -2.785 4.345 1.00 0.00 O ATOM 583 CB VAL A 36 4.635 -2.053 3.486 1.00 0.00 C ATOM 584 CG1 VAL A 36 5.308 -1.069 2.527 1.00 0.00 C ATOM 585 CG2 VAL A 36 3.183 -2.311 3.078 1.00 0.00 C ATOM 0 H VAL A 36 5.321 -3.434 5.661 1.00 0.00 H new ATOM 0 HA VAL A 36 5.081 -3.984 2.741 1.00 0.00 H new ATOM 0 HB VAL A 36 4.629 -1.602 4.478 1.00 0.00 H new ATOM 0 HG11 VAL A 36 4.729 -0.147 2.486 1.00 0.00 H new ATOM 0 HG12 VAL A 36 6.316 -0.849 2.879 1.00 0.00 H new ATOM 0 HG13 VAL A 36 5.360 -1.509 1.531 1.00 0.00 H new ATOM 0 HG21 VAL A 36 2.646 -1.364 3.026 1.00 0.00 H new ATOM 0 HG22 VAL A 36 3.160 -2.795 2.102 1.00 0.00 H new ATOM 0 HG23 VAL A 36 2.707 -2.958 3.815 1.00 0.00 H new ATOM 595 N ILE A 37 7.397 -3.432 2.189 1.00 0.00 N ATOM 596 CA ILE A 37 8.811 -3.289 1.884 1.00 0.00 C ATOM 597 C ILE A 37 9.041 -1.957 1.168 1.00 0.00 C ATOM 598 O ILE A 37 8.696 -1.810 -0.003 1.00 0.00 O ATOM 599 CB ILE A 37 9.316 -4.503 1.102 1.00 0.00 C ATOM 600 CG1 ILE A 37 8.384 -5.703 1.289 1.00 0.00 C ATOM 601 CG2 ILE A 37 10.761 -4.836 1.479 1.00 0.00 C ATOM 602 CD1 ILE A 37 8.066 -5.924 2.770 1.00 0.00 C ATOM 0 H ILE A 37 6.822 -3.746 1.408 1.00 0.00 H new ATOM 0 HA ILE A 37 9.398 -3.264 2.802 1.00 0.00 H new ATOM 0 HB ILE A 37 9.309 -4.252 0.041 1.00 0.00 H new ATOM 0 HG12 ILE A 37 7.459 -5.540 0.735 1.00 0.00 H new ATOM 0 HG13 ILE A 37 8.850 -6.598 0.876 1.00 0.00 H new ATOM 0 HG21 ILE A 37 11.095 -5.703 0.909 1.00 0.00 H new ATOM 0 HG22 ILE A 37 11.402 -3.984 1.253 1.00 0.00 H new ATOM 0 HG23 ILE A 37 10.817 -5.059 2.544 1.00 0.00 H new ATOM 0 HD11 ILE A 37 7.402 -6.782 2.876 1.00 0.00 H new ATOM 0 HD12 ILE A 37 8.990 -6.111 3.317 1.00 0.00 H new ATOM 0 HD13 ILE A 37 7.579 -5.037 3.174 1.00 0.00 H new ATOM 614 N LEU A 38 9.623 -1.020 1.902 1.00 0.00 N ATOM 615 CA LEU A 38 9.903 0.295 1.352 1.00 0.00 C ATOM 616 C LEU A 38 11.207 0.242 0.553 1.00 0.00 C ATOM 617 O LEU A 38 12.288 0.132 1.129 1.00 0.00 O ATOM 618 CB LEU A 38 9.904 1.351 2.459 1.00 0.00 C ATOM 619 CG LEU A 38 8.668 1.378 3.360 1.00 0.00 C ATOM 620 CD1 LEU A 38 8.927 2.204 4.622 1.00 0.00 C ATOM 621 CD2 LEU A 38 7.441 1.874 2.593 1.00 0.00 C ATOM 0 H LEU A 38 9.908 -1.146 2.873 1.00 0.00 H new ATOM 0 HA LEU A 38 9.115 0.593 0.660 1.00 0.00 H new ATOM 0 HB2 LEU A 38 10.782 1.192 3.085 1.00 0.00 H new ATOM 0 HB3 LEU A 38 10.015 2.332 1.998 1.00 0.00 H new ATOM 0 HG LEU A 38 8.457 0.358 3.680 1.00 0.00 H new ATOM 0 HD11 LEU A 38 8.033 2.207 5.245 1.00 0.00 H new ATOM 0 HD12 LEU A 38 9.756 1.767 5.179 1.00 0.00 H new ATOM 0 HD13 LEU A 38 9.177 3.227 4.342 1.00 0.00 H new ATOM 0 HD21 LEU A 38 6.576 1.883 3.257 1.00 0.00 H new ATOM 0 HD22 LEU A 38 7.626 2.883 2.224 1.00 0.00 H new ATOM 0 HD23 LEU A 38 7.245 1.210 1.751 1.00 0.00 H new ATOM 633 N VAL A 39 11.061 0.321 -0.762 1.00 0.00 N ATOM 634 CA VAL A 39 12.214 0.283 -1.646 1.00 0.00 C ATOM 635 C VAL A 39 11.966 1.206 -2.840 1.00 0.00 C ATOM 636 O VAL A 39 10.871 1.222 -3.401 1.00 0.00 O ATOM 637 CB VAL A 39 12.510 -1.161 -2.058 1.00 0.00 C ATOM 638 CG1 VAL A 39 12.660 -2.061 -0.830 1.00 0.00 C ATOM 639 CG2 VAL A 39 11.429 -1.694 -3.000 1.00 0.00 C ATOM 0 H VAL A 39 10.162 0.411 -1.236 1.00 0.00 H new ATOM 0 HA VAL A 39 13.102 0.649 -1.131 1.00 0.00 H new ATOM 0 HB VAL A 39 13.457 -1.169 -2.597 1.00 0.00 H new ATOM 0 HG11 VAL A 39 12.870 -3.082 -1.150 1.00 0.00 H new ATOM 0 HG12 VAL A 39 13.481 -1.699 -0.211 1.00 0.00 H new ATOM 0 HG13 VAL A 39 11.736 -2.045 -0.252 1.00 0.00 H new ATOM 0 HG21 VAL A 39 11.663 -2.722 -3.278 1.00 0.00 H new ATOM 0 HG22 VAL A 39 10.462 -1.665 -2.498 1.00 0.00 H new ATOM 0 HG23 VAL A 39 11.391 -1.076 -3.897 1.00 0.00 H new ATOM 649 N SER A 40 13.001 1.954 -3.194 1.00 0.00 N ATOM 650 CA SER A 40 12.910 2.878 -4.312 1.00 0.00 C ATOM 651 C SER A 40 12.769 2.102 -5.623 1.00 0.00 C ATOM 652 O SER A 40 12.454 0.913 -5.614 1.00 0.00 O ATOM 653 CB SER A 40 14.131 3.797 -4.368 1.00 0.00 C ATOM 654 OG SER A 40 15.164 3.263 -5.190 1.00 0.00 O ATOM 0 H SER A 40 13.907 1.939 -2.726 1.00 0.00 H new ATOM 0 HA SER A 40 12.027 3.501 -4.169 1.00 0.00 H new ATOM 0 HB2 SER A 40 13.832 4.773 -4.750 1.00 0.00 H new ATOM 0 HB3 SER A 40 14.514 3.952 -3.359 1.00 0.00 H new ATOM 0 HG SER A 40 15.925 3.880 -5.201 1.00 0.00 H new ATOM 660 N GLU A 41 13.010 2.806 -6.719 1.00 0.00 N ATOM 661 CA GLU A 41 12.915 2.197 -8.035 1.00 0.00 C ATOM 662 C GLU A 41 14.084 1.236 -8.262 1.00 0.00 C ATOM 663 O GLU A 41 13.882 0.092 -8.666 1.00 0.00 O ATOM 664 CB GLU A 41 12.862 3.265 -9.130 1.00 0.00 C ATOM 665 CG GLU A 41 13.115 2.650 -10.508 1.00 0.00 C ATOM 666 CD GLU A 41 13.026 3.711 -11.606 1.00 0.00 C ATOM 667 OE1 GLU A 41 14.014 3.953 -12.316 1.00 0.00 O ATOM 668 OE2 GLU A 41 11.880 4.293 -11.711 1.00 0.00 O ATOM 0 H GLU A 41 13.271 3.792 -6.723 1.00 0.00 H new ATOM 0 HA GLU A 41 11.988 1.626 -8.084 1.00 0.00 H new ATOM 0 HB2 GLU A 41 11.888 3.754 -9.119 1.00 0.00 H new ATOM 0 HB3 GLU A 41 13.607 4.035 -8.929 1.00 0.00 H new ATOM 0 HG2 GLU A 41 14.100 2.184 -10.527 1.00 0.00 H new ATOM 0 HG3 GLU A 41 12.386 1.862 -10.698 1.00 0.00 H new ATOM 676 N ASP A 42 15.280 1.737 -7.992 1.00 0.00 N ATOM 677 CA ASP A 42 16.481 0.937 -8.162 1.00 0.00 C ATOM 678 C ASP A 42 16.514 -0.159 -7.095 1.00 0.00 C ATOM 679 O ASP A 42 16.974 -1.270 -7.355 1.00 0.00 O ATOM 680 CB ASP A 42 17.740 1.792 -8.000 1.00 0.00 C ATOM 681 CG ASP A 42 18.642 1.855 -9.234 1.00 0.00 C ATOM 682 OD1 ASP A 42 18.247 2.374 -10.289 1.00 0.00 O ATOM 683 OD2 ASP A 42 19.813 1.336 -9.080 1.00 0.00 O ATOM 0 H ASP A 42 15.443 2.686 -7.657 1.00 0.00 H new ATOM 0 HA ASP A 42 16.462 0.509 -9.164 1.00 0.00 H new ATOM 0 HB2 ASP A 42 17.441 2.806 -7.735 1.00 0.00 H new ATOM 0 HB3 ASP A 42 18.320 1.402 -7.164 1.00 0.00 H new ATOM 689 N GLU A 43 16.019 0.191 -5.917 1.00 0.00 N ATOM 690 CA GLU A 43 15.986 -0.749 -4.810 1.00 0.00 C ATOM 691 C GLU A 43 15.132 -1.965 -5.172 1.00 0.00 C ATOM 692 O GLU A 43 15.458 -3.091 -4.798 1.00 0.00 O ATOM 693 CB GLU A 43 15.471 -0.077 -3.535 1.00 0.00 C ATOM 694 CG GLU A 43 16.394 1.066 -3.107 1.00 0.00 C ATOM 695 CD GLU A 43 16.407 1.219 -1.585 1.00 0.00 C ATOM 696 OE1 GLU A 43 17.100 0.460 -0.891 1.00 0.00 O ATOM 697 OE2 GLU A 43 15.663 2.168 -1.126 1.00 0.00 O ATOM 0 H GLU A 43 15.637 1.113 -5.705 1.00 0.00 H new ATOM 0 HA GLU A 43 17.004 -1.089 -4.617 1.00 0.00 H new ATOM 0 HB2 GLU A 43 14.465 0.307 -3.703 1.00 0.00 H new ATOM 0 HB3 GLU A 43 15.402 -0.813 -2.734 1.00 0.00 H new ATOM 0 HG2 GLU A 43 17.405 0.875 -3.466 1.00 0.00 H new ATOM 0 HG3 GLU A 43 16.063 1.997 -3.567 1.00 0.00 H new ATOM 705 N ILE A 44 14.054 -1.698 -5.895 1.00 0.00 N ATOM 706 CA ILE A 44 13.151 -2.756 -6.312 1.00 0.00 C ATOM 707 C ILE A 44 13.695 -3.416 -7.581 1.00 0.00 C ATOM 708 O ILE A 44 13.470 -4.602 -7.813 1.00 0.00 O ATOM 709 CB ILE A 44 11.727 -2.217 -6.462 1.00 0.00 C ATOM 710 CG1 ILE A 44 10.722 -3.360 -6.621 1.00 0.00 C ATOM 711 CG2 ILE A 44 11.639 -1.212 -7.612 1.00 0.00 C ATOM 712 CD1 ILE A 44 9.957 -3.603 -5.319 1.00 0.00 C ATOM 0 H ILE A 44 13.786 -0.763 -6.203 1.00 0.00 H new ATOM 0 HA ILE A 44 13.095 -3.531 -5.548 1.00 0.00 H new ATOM 0 HB ILE A 44 11.466 -1.683 -5.548 1.00 0.00 H new ATOM 0 HG12 ILE A 44 10.020 -3.123 -7.420 1.00 0.00 H new ATOM 0 HG13 ILE A 44 11.245 -4.270 -6.915 1.00 0.00 H new ATOM 0 HG21 ILE A 44 10.616 -0.845 -7.697 1.00 0.00 H new ATOM 0 HG22 ILE A 44 12.310 -0.376 -7.416 1.00 0.00 H new ATOM 0 HG23 ILE A 44 11.928 -1.699 -8.544 1.00 0.00 H new ATOM 0 HD11 ILE A 44 9.250 -4.420 -5.460 1.00 0.00 H new ATOM 0 HD12 ILE A 44 10.660 -3.863 -4.527 1.00 0.00 H new ATOM 0 HD13 ILE A 44 9.416 -2.699 -5.041 1.00 0.00 H new ATOM 724 N LYS A 45 14.401 -2.617 -8.368 1.00 0.00 N ATOM 725 CA LYS A 45 14.979 -3.109 -9.607 1.00 0.00 C ATOM 726 C LYS A 45 15.692 -4.436 -9.341 1.00 0.00 C ATOM 727 O LYS A 45 15.495 -5.408 -10.069 1.00 0.00 O ATOM 728 CB LYS A 45 15.878 -2.044 -10.238 1.00 0.00 C ATOM 729 CG LYS A 45 16.569 -2.582 -11.493 1.00 0.00 C ATOM 730 CD LYS A 45 17.940 -3.170 -11.154 1.00 0.00 C ATOM 731 CE LYS A 45 18.761 -3.412 -12.423 1.00 0.00 C ATOM 732 NZ LYS A 45 19.781 -2.353 -12.590 1.00 0.00 N ATOM 0 H LYS A 45 14.586 -1.633 -8.172 1.00 0.00 H new ATOM 0 HA LYS A 45 14.197 -3.308 -10.339 1.00 0.00 H new ATOM 0 HB2 LYS A 45 15.284 -1.167 -10.494 1.00 0.00 H new ATOM 0 HB3 LYS A 45 16.628 -1.722 -9.516 1.00 0.00 H new ATOM 0 HG2 LYS A 45 15.946 -3.347 -11.956 1.00 0.00 H new ATOM 0 HG3 LYS A 45 16.683 -1.780 -12.222 1.00 0.00 H new ATOM 0 HD2 LYS A 45 18.478 -2.491 -10.493 1.00 0.00 H new ATOM 0 HD3 LYS A 45 17.814 -4.108 -10.613 1.00 0.00 H new ATOM 0 HE2 LYS A 45 19.246 -4.387 -12.369 1.00 0.00 H new ATOM 0 HE3 LYS A 45 18.102 -3.431 -13.291 1.00 0.00 H new ATOM 0 HZ1 LYS A 45 20.329 -2.532 -13.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 45 19.312 -1.428 -12.663 1.00 0.00 H new ATOM 0 HZ3 LYS A 45 20.420 -2.354 -11.769 1.00 0.00 H new ATOM 745 N GLU A 46 16.507 -4.434 -8.296 1.00 0.00 N ATOM 746 CA GLU A 46 17.250 -5.627 -7.925 1.00 0.00 C ATOM 747 C GLU A 46 16.357 -6.584 -7.134 1.00 0.00 C ATOM 748 O GLU A 46 16.295 -7.775 -7.438 1.00 0.00 O ATOM 749 CB GLU A 46 18.506 -5.264 -7.129 1.00 0.00 C ATOM 750 CG GLU A 46 19.368 -4.259 -7.894 1.00 0.00 C ATOM 751 CD GLU A 46 20.857 -4.552 -7.697 1.00 0.00 C ATOM 752 OE1 GLU A 46 21.359 -4.479 -6.565 1.00 0.00 O ATOM 753 OE2 GLU A 46 21.498 -4.865 -8.771 1.00 0.00 O ATOM 0 H GLU A 46 16.669 -3.626 -7.695 1.00 0.00 H new ATOM 0 HA GLU A 46 17.570 -6.131 -8.837 1.00 0.00 H new ATOM 0 HB2 GLU A 46 18.221 -4.844 -6.164 1.00 0.00 H new ATOM 0 HB3 GLU A 46 19.085 -6.165 -6.926 1.00 0.00 H new ATOM 0 HG2 GLU A 46 19.123 -4.298 -8.955 1.00 0.00 H new ATOM 0 HG3 GLU A 46 19.144 -3.248 -7.553 1.00 0.00 H new ATOM 761 N LEU A 47 15.688 -6.029 -6.134 1.00 0.00 N ATOM 762 CA LEU A 47 14.801 -6.819 -5.297 1.00 0.00 C ATOM 763 C LEU A 47 13.917 -7.698 -6.185 1.00 0.00 C ATOM 764 O LEU A 47 13.592 -8.827 -5.820 1.00 0.00 O ATOM 765 CB LEU A 47 14.012 -5.914 -4.349 1.00 0.00 C ATOM 766 CG LEU A 47 13.586 -6.544 -3.021 1.00 0.00 C ATOM 767 CD1 LEU A 47 12.634 -7.719 -3.251 1.00 0.00 C ATOM 768 CD2 LEU A 47 14.806 -6.948 -2.190 1.00 0.00 C ATOM 0 H LEU A 47 15.742 -5.041 -5.885 1.00 0.00 H new ATOM 0 HA LEU A 47 15.377 -7.488 -4.657 1.00 0.00 H new ATOM 0 HB2 LEU A 47 14.616 -5.033 -4.133 1.00 0.00 H new ATOM 0 HB3 LEU A 47 13.118 -5.569 -4.868 1.00 0.00 H new ATOM 0 HG LEU A 47 13.039 -5.795 -2.448 1.00 0.00 H new ATOM 0 HD11 LEU A 47 12.347 -8.148 -2.291 1.00 0.00 H new ATOM 0 HD12 LEU A 47 11.743 -7.369 -3.773 1.00 0.00 H new ATOM 0 HD13 LEU A 47 13.132 -8.478 -3.853 1.00 0.00 H new ATOM 0 HD21 LEU A 47 14.476 -7.393 -1.251 1.00 0.00 H new ATOM 0 HD22 LEU A 47 15.401 -7.673 -2.746 1.00 0.00 H new ATOM 0 HD23 LEU A 47 15.411 -6.066 -1.980 1.00 0.00 H new ATOM 780 N ASN A 48 13.554 -7.147 -7.334 1.00 0.00 N ATOM 781 CA ASN A 48 12.715 -7.867 -8.277 1.00 0.00 C ATOM 782 C ASN A 48 13.395 -9.184 -8.656 1.00 0.00 C ATOM 783 O ASN A 48 12.805 -10.254 -8.515 1.00 0.00 O ATOM 784 CB ASN A 48 12.506 -7.057 -9.558 1.00 0.00 C ATOM 785 CG ASN A 48 11.252 -7.521 -10.302 1.00 0.00 C ATOM 786 OD1 ASN A 48 11.085 -8.685 -10.623 1.00 0.00 O ATOM 787 ND2 ASN A 48 10.383 -6.546 -10.556 1.00 0.00 N ATOM 0 H ASN A 48 13.826 -6.210 -7.633 1.00 0.00 H new ATOM 0 HA ASN A 48 11.750 -8.046 -7.802 1.00 0.00 H new ATOM 0 HB2 ASN A 48 12.417 -5.999 -9.313 1.00 0.00 H new ATOM 0 HB3 ASN A 48 13.377 -7.162 -10.205 1.00 0.00 H new ATOM 0 HD21 ASN A 48 9.514 -6.753 -11.048 1.00 0.00 H new ATOM 0 HD22 ASN A 48 10.586 -5.592 -10.259 1.00 0.00 H new ATOM 794 N GLN A 49 14.626 -9.063 -9.129 1.00 0.00 N ATOM 795 CA GLN A 49 15.392 -10.231 -9.529 1.00 0.00 C ATOM 796 C GLN A 49 15.776 -11.060 -8.302 1.00 0.00 C ATOM 797 O GLN A 49 15.964 -12.271 -8.401 1.00 0.00 O ATOM 798 CB GLN A 49 16.633 -9.826 -10.328 1.00 0.00 C ATOM 799 CG GLN A 49 17.490 -8.831 -9.542 1.00 0.00 C ATOM 800 CD GLN A 49 18.875 -8.680 -10.175 1.00 0.00 C ATOM 801 OE1 GLN A 49 19.047 -8.766 -11.380 1.00 0.00 O ATOM 802 NE2 GLN A 49 19.848 -8.451 -9.299 1.00 0.00 N ATOM 0 H GLN A 49 15.112 -8.174 -9.244 1.00 0.00 H new ATOM 0 HA GLN A 49 14.768 -10.846 -10.177 1.00 0.00 H new ATOM 0 HB2 GLN A 49 17.223 -10.712 -10.565 1.00 0.00 H new ATOM 0 HB3 GLN A 49 16.331 -9.381 -11.276 1.00 0.00 H new ATOM 0 HG2 GLN A 49 16.992 -7.862 -9.512 1.00 0.00 H new ATOM 0 HG3 GLN A 49 17.592 -9.169 -8.511 1.00 0.00 H new ATOM 0 HE21 GLN A 49 19.634 -8.391 -8.303 1.00 0.00 H new ATOM 0 HE22 GLN A 49 20.808 -8.335 -9.622 1.00 0.00 H new ATOM 811 N GLN A 50 15.882 -10.373 -7.174 1.00 0.00 N ATOM 812 CA GLN A 50 16.241 -11.031 -5.929 1.00 0.00 C ATOM 813 C GLN A 50 15.259 -12.165 -5.625 1.00 0.00 C ATOM 814 O GLN A 50 15.574 -13.075 -4.861 1.00 0.00 O ATOM 815 CB GLN A 50 16.294 -10.028 -4.774 1.00 0.00 C ATOM 816 CG GLN A 50 17.513 -9.112 -4.900 1.00 0.00 C ATOM 817 CD GLN A 50 17.946 -8.585 -3.530 1.00 0.00 C ATOM 818 OE1 GLN A 50 17.777 -9.228 -2.507 1.00 0.00 O ATOM 819 NE2 GLN A 50 18.513 -7.383 -3.567 1.00 0.00 N ATOM 0 H GLN A 50 15.726 -9.368 -7.096 1.00 0.00 H new ATOM 0 HA GLN A 50 17.237 -11.459 -6.042 1.00 0.00 H new ATOM 0 HB2 GLN A 50 15.384 -9.429 -4.766 1.00 0.00 H new ATOM 0 HB3 GLN A 50 16.333 -10.562 -3.825 1.00 0.00 H new ATOM 0 HG2 GLN A 50 18.336 -9.658 -5.361 1.00 0.00 H new ATOM 0 HG3 GLN A 50 17.277 -8.275 -5.558 1.00 0.00 H new ATOM 0 HE21 GLN A 50 18.624 -6.899 -4.458 1.00 0.00 H new ATOM 0 HE22 GLN A 50 18.837 -6.945 -2.705 1.00 0.00 H new ATOM 828 N PHE A 51 14.089 -12.072 -6.240 1.00 0.00 N ATOM 829 CA PHE A 51 13.059 -13.078 -6.045 1.00 0.00 C ATOM 830 C PHE A 51 12.517 -13.575 -7.387 1.00 0.00 C ATOM 831 O PHE A 51 12.460 -14.779 -7.630 1.00 0.00 O ATOM 832 CB PHE A 51 11.924 -12.411 -5.266 1.00 0.00 C ATOM 833 CG PHE A 51 12.310 -11.983 -3.849 1.00 0.00 C ATOM 834 CD1 PHE A 51 13.285 -11.053 -3.661 1.00 0.00 C ATOM 835 CD2 PHE A 51 11.679 -12.532 -2.776 1.00 0.00 C ATOM 836 CE1 PHE A 51 13.643 -10.655 -2.346 1.00 0.00 C ATOM 837 CE2 PHE A 51 12.037 -12.134 -1.461 1.00 0.00 C ATOM 838 CZ PHE A 51 13.012 -11.204 -1.274 1.00 0.00 C ATOM 0 H PHE A 51 13.832 -11.315 -6.874 1.00 0.00 H new ATOM 0 HA PHE A 51 13.471 -13.934 -5.511 1.00 0.00 H new ATOM 0 HB2 PHE A 51 11.583 -11.536 -5.819 1.00 0.00 H new ATOM 0 HB3 PHE A 51 11.082 -13.100 -5.210 1.00 0.00 H new ATOM 0 HD1 PHE A 51 13.787 -10.617 -4.512 1.00 0.00 H new ATOM 0 HD2 PHE A 51 10.905 -13.271 -2.925 1.00 0.00 H new ATOM 0 HE1 PHE A 51 14.417 -9.916 -2.197 1.00 0.00 H new ATOM 0 HE2 PHE A 51 11.535 -12.569 -0.609 1.00 0.00 H new ATOM 0 HZ PHE A 51 13.285 -10.902 -0.274 1.00 0.00 H new ATOM 848 N ARG A 52 12.133 -12.621 -8.223 1.00 0.00 N ATOM 849 CA ARG A 52 11.598 -12.947 -9.534 1.00 0.00 C ATOM 850 C ARG A 52 12.707 -13.484 -10.442 1.00 0.00 C ATOM 851 O ARG A 52 12.437 -14.228 -11.384 1.00 0.00 O ATOM 852 CB ARG A 52 10.961 -11.720 -10.190 1.00 0.00 C ATOM 853 CG ARG A 52 9.789 -11.199 -9.356 1.00 0.00 C ATOM 854 CD ARG A 52 8.512 -11.988 -9.652 1.00 0.00 C ATOM 855 NE ARG A 52 7.347 -11.316 -9.036 1.00 0.00 N ATOM 856 CZ ARG A 52 6.810 -10.163 -9.491 1.00 0.00 C ATOM 857 NH1 ARG A 52 7.330 -9.545 -10.572 1.00 0.00 N ATOM 858 NH2 ARG A 52 5.769 -9.650 -8.862 1.00 0.00 N ATOM 0 H ARG A 52 12.182 -11.623 -8.018 1.00 0.00 H new ATOM 0 HA ARG A 52 10.833 -13.711 -9.399 1.00 0.00 H new ATOM 0 HB2 ARG A 52 11.708 -10.935 -10.304 1.00 0.00 H new ATOM 0 HB3 ARG A 52 10.614 -11.977 -11.191 1.00 0.00 H new ATOM 0 HG2 ARG A 52 10.030 -11.275 -8.296 1.00 0.00 H new ATOM 0 HG3 ARG A 52 9.626 -10.143 -9.571 1.00 0.00 H new ATOM 0 HD2 ARG A 52 8.367 -12.070 -10.729 1.00 0.00 H new ATOM 0 HD3 ARG A 52 8.604 -13.003 -9.264 1.00 0.00 H new ATOM 0 HE ARG A 52 6.923 -11.750 -8.216 1.00 0.00 H new ATOM 0 HH11 ARG A 52 8.135 -9.948 -11.052 1.00 0.00 H new ATOM 0 HH12 ARG A 52 6.918 -8.675 -10.909 1.00 0.00 H new ATOM 0 HH21 ARG A 52 5.382 -10.124 -8.046 1.00 0.00 H new ATOM 0 HH22 ARG A 52 5.351 -8.780 -9.192 1.00 0.00 H new ATOM 871 N GLY A 53 13.930 -13.085 -10.127 1.00 0.00 N ATOM 872 CA GLY A 53 15.081 -13.516 -10.903 1.00 0.00 C ATOM 873 C GLY A 53 15.170 -12.750 -12.224 1.00 0.00 C ATOM 874 O GLY A 53 16.094 -12.963 -13.008 1.00 0.00 O ATOM 0 H GLY A 53 14.150 -12.468 -9.345 1.00 0.00 H new ATOM 0 HA2 GLY A 53 15.992 -13.360 -10.326 1.00 0.00 H new ATOM 0 HA3 GLY A 53 15.010 -14.585 -11.103 1.00 0.00 H new ATOM 878 N GLN A 54 14.196 -11.876 -12.431 1.00 0.00 N ATOM 879 CA GLN A 54 14.153 -11.077 -13.644 1.00 0.00 C ATOM 880 C GLN A 54 14.550 -9.631 -13.342 1.00 0.00 C ATOM 881 O GLN A 54 14.366 -9.154 -12.224 1.00 0.00 O ATOM 882 CB GLN A 54 12.769 -11.142 -14.294 1.00 0.00 C ATOM 883 CG GLN A 54 11.749 -10.329 -13.494 1.00 0.00 C ATOM 884 CD GLN A 54 10.337 -10.521 -14.050 1.00 0.00 C ATOM 885 OE1 GLN A 54 9.388 -10.784 -13.330 1.00 0.00 O ATOM 886 NE2 GLN A 54 10.251 -10.374 -15.370 1.00 0.00 N ATOM 0 H GLN A 54 13.431 -11.704 -11.779 1.00 0.00 H new ATOM 0 HA GLN A 54 14.871 -11.489 -14.353 1.00 0.00 H new ATOM 0 HB2 GLN A 54 12.824 -10.761 -15.314 1.00 0.00 H new ATOM 0 HB3 GLN A 54 12.442 -12.180 -14.359 1.00 0.00 H new ATOM 0 HG2 GLN A 54 11.776 -10.633 -12.448 1.00 0.00 H new ATOM 0 HG3 GLN A 54 12.016 -9.273 -13.526 1.00 0.00 H new ATOM 0 HE21 GLN A 54 11.085 -10.154 -15.914 1.00 0.00 H new ATOM 0 HE22 GLN A 54 9.351 -10.482 -15.838 1.00 0.00 H new ATOM 895 N ASP A 55 15.087 -8.974 -14.360 1.00 0.00 N ATOM 896 CA ASP A 55 15.512 -7.592 -14.217 1.00 0.00 C ATOM 897 C ASP A 55 14.469 -6.673 -14.858 1.00 0.00 C ATOM 898 O ASP A 55 14.440 -6.517 -16.078 1.00 0.00 O ATOM 899 CB ASP A 55 16.849 -7.351 -14.920 1.00 0.00 C ATOM 900 CG ASP A 55 17.576 -6.069 -14.507 1.00 0.00 C ATOM 901 OD1 ASP A 55 18.073 -5.953 -13.377 1.00 0.00 O ATOM 902 OD2 ASP A 55 17.621 -5.152 -15.413 1.00 0.00 O ATOM 0 H ASP A 55 15.237 -9.373 -15.287 1.00 0.00 H new ATOM 0 HA ASP A 55 15.621 -7.381 -13.153 1.00 0.00 H new ATOM 0 HB2 ASP A 55 17.503 -8.201 -14.725 1.00 0.00 H new ATOM 0 HB3 ASP A 55 16.677 -7.322 -15.996 1.00 0.00 H new ATOM 908 N ARG A 56 13.638 -6.090 -14.007 1.00 0.00 N ATOM 909 CA ARG A 56 12.596 -5.192 -14.475 1.00 0.00 C ATOM 910 C ARG A 56 11.898 -4.524 -13.288 1.00 0.00 C ATOM 911 O ARG A 56 11.427 -5.204 -12.378 1.00 0.00 O ATOM 912 CB ARG A 56 11.558 -5.941 -15.312 1.00 0.00 C ATOM 913 CG ARG A 56 11.127 -7.236 -14.621 1.00 0.00 C ATOM 914 CD ARG A 56 9.611 -7.425 -14.706 1.00 0.00 C ATOM 915 NE ARG A 56 8.922 -6.190 -14.272 1.00 0.00 N ATOM 916 CZ ARG A 56 7.641 -5.891 -14.576 1.00 0.00 C ATOM 917 NH1 ARG A 56 6.898 -6.738 -15.320 1.00 0.00 N ATOM 918 NH2 ARG A 56 7.126 -4.758 -14.136 1.00 0.00 N ATOM 0 H ARG A 56 13.665 -6.222 -12.996 1.00 0.00 H new ATOM 0 HA ARG A 56 13.069 -4.432 -15.098 1.00 0.00 H new ATOM 0 HB2 ARG A 56 10.688 -5.304 -15.474 1.00 0.00 H new ATOM 0 HB3 ARG A 56 11.973 -6.169 -16.294 1.00 0.00 H new ATOM 0 HG2 ARG A 56 11.629 -8.085 -15.085 1.00 0.00 H new ATOM 0 HG3 ARG A 56 11.436 -7.215 -13.576 1.00 0.00 H new ATOM 0 HD2 ARG A 56 9.324 -7.671 -15.728 1.00 0.00 H new ATOM 0 HD3 ARG A 56 9.305 -8.262 -14.078 1.00 0.00 H new ATOM 0 HE ARG A 56 9.448 -5.522 -13.708 1.00 0.00 H new ATOM 0 HH11 ARG A 56 7.304 -7.611 -15.657 1.00 0.00 H new ATOM 0 HH12 ARG A 56 5.931 -6.505 -15.545 1.00 0.00 H new ATOM 0 HH21 ARG A 56 7.694 -4.123 -13.575 1.00 0.00 H new ATOM 0 HH22 ARG A 56 6.160 -4.517 -14.357 1.00 0.00 H new ATOM 931 N PRO A 57 11.854 -3.166 -13.337 1.00 0.00 N ATOM 932 CA PRO A 57 11.222 -2.399 -12.278 1.00 0.00 C ATOM 933 C PRO A 57 9.697 -2.487 -12.371 1.00 0.00 C ATOM 934 O PRO A 57 9.162 -3.057 -13.321 1.00 0.00 O ATOM 935 CB PRO A 57 11.747 -0.983 -12.450 1.00 0.00 C ATOM 936 CG PRO A 57 12.284 -0.907 -13.870 1.00 0.00 C ATOM 937 CD PRO A 57 12.402 -2.327 -14.400 1.00 0.00 C ATOM 0 HA PRO A 57 11.460 -2.780 -11.285 1.00 0.00 H new ATOM 0 HB2 PRO A 57 10.955 -0.251 -12.292 1.00 0.00 H new ATOM 0 HB3 PRO A 57 12.531 -0.766 -11.724 1.00 0.00 H new ATOM 0 HG2 PRO A 57 11.616 -0.319 -14.500 1.00 0.00 H new ATOM 0 HG3 PRO A 57 13.255 -0.412 -13.885 1.00 0.00 H new ATOM 0 HD2 PRO A 57 11.845 -2.451 -15.329 1.00 0.00 H new ATOM 0 HD3 PRO A 57 13.439 -2.585 -14.613 1.00 0.00 H new ATOM 945 N THR A 58 9.041 -1.913 -11.373 1.00 0.00 N ATOM 946 CA THR A 58 7.588 -1.920 -11.331 1.00 0.00 C ATOM 947 C THR A 58 7.080 -0.919 -10.291 1.00 0.00 C ATOM 948 O THR A 58 7.864 -0.372 -9.516 1.00 0.00 O ATOM 949 CB THR A 58 7.129 -3.355 -11.069 1.00 0.00 C ATOM 950 OG1 THR A 58 5.720 -3.242 -10.891 1.00 0.00 O ATOM 951 CG2 THR A 58 7.632 -3.895 -9.728 1.00 0.00 C ATOM 0 H THR A 58 9.488 -1.440 -10.588 1.00 0.00 H new ATOM 0 HA THR A 58 7.163 -1.597 -12.281 1.00 0.00 H new ATOM 0 HB THR A 58 7.479 -4.001 -11.875 1.00 0.00 H new ATOM 0 HG1 THR A 58 5.340 -4.129 -10.718 1.00 0.00 H new ATOM 0 HG21 THR A 58 7.278 -4.917 -9.591 1.00 0.00 H new ATOM 0 HG22 THR A 58 8.722 -3.884 -9.717 1.00 0.00 H new ATOM 0 HG23 THR A 58 7.255 -3.269 -8.919 1.00 0.00 H new ATOM 959 N ASP A 59 5.772 -0.711 -10.307 1.00 0.00 N ATOM 960 CA ASP A 59 5.150 0.214 -9.375 1.00 0.00 C ATOM 961 C ASP A 59 5.223 -0.368 -7.961 1.00 0.00 C ATOM 962 O ASP A 59 5.796 0.246 -7.062 1.00 0.00 O ATOM 963 CB ASP A 59 3.676 0.436 -9.719 1.00 0.00 C ATOM 964 CG ASP A 59 2.940 -0.801 -10.238 1.00 0.00 C ATOM 965 OD1 ASP A 59 2.295 -1.529 -9.469 1.00 0.00 O ATOM 966 OD2 ASP A 59 3.049 -1.008 -11.506 1.00 0.00 O ATOM 0 H ASP A 59 5.126 -1.167 -10.951 1.00 0.00 H new ATOM 0 HA ASP A 59 5.681 1.164 -9.438 1.00 0.00 H new ATOM 0 HB2 ASP A 59 3.162 0.800 -8.830 1.00 0.00 H new ATOM 0 HB3 ASP A 59 3.608 1.223 -10.471 1.00 0.00 H new ATOM 972 N VAL A 60 4.633 -1.545 -7.809 1.00 0.00 N ATOM 973 CA VAL A 60 4.624 -2.216 -6.521 1.00 0.00 C ATOM 974 C VAL A 60 4.711 -3.728 -6.738 1.00 0.00 C ATOM 975 O VAL A 60 4.033 -4.274 -7.607 1.00 0.00 O ATOM 976 CB VAL A 60 3.388 -1.797 -5.721 1.00 0.00 C ATOM 977 CG1 VAL A 60 2.126 -1.877 -6.582 1.00 0.00 C ATOM 978 CG2 VAL A 60 3.243 -2.642 -4.454 1.00 0.00 C ATOM 0 H VAL A 60 4.158 -2.051 -8.557 1.00 0.00 H new ATOM 0 HA VAL A 60 5.492 -1.922 -5.931 1.00 0.00 H new ATOM 0 HB VAL A 60 3.521 -0.759 -5.417 1.00 0.00 H new ATOM 0 HG11 VAL A 60 1.262 -1.574 -5.990 1.00 0.00 H new ATOM 0 HG12 VAL A 60 2.229 -1.213 -7.440 1.00 0.00 H new ATOM 0 HG13 VAL A 60 1.987 -2.901 -6.930 1.00 0.00 H new ATOM 0 HG21 VAL A 60 2.357 -2.324 -3.904 1.00 0.00 H new ATOM 0 HG22 VAL A 60 3.143 -3.693 -4.727 1.00 0.00 H new ATOM 0 HG23 VAL A 60 4.125 -2.512 -3.827 1.00 0.00 H new ATOM 988 N LEU A 61 5.551 -4.362 -5.933 1.00 0.00 N ATOM 989 CA LEU A 61 5.735 -5.800 -6.026 1.00 0.00 C ATOM 990 C LEU A 61 4.849 -6.492 -4.988 1.00 0.00 C ATOM 991 O LEU A 61 4.867 -6.132 -3.812 1.00 0.00 O ATOM 992 CB LEU A 61 7.217 -6.159 -5.905 1.00 0.00 C ATOM 993 CG LEU A 61 7.911 -6.590 -7.199 1.00 0.00 C ATOM 994 CD1 LEU A 61 8.957 -5.559 -7.630 1.00 0.00 C ATOM 995 CD2 LEU A 61 8.509 -7.991 -7.061 1.00 0.00 C ATOM 0 H LEU A 61 6.112 -3.906 -5.213 1.00 0.00 H new ATOM 0 HA LEU A 61 5.421 -6.161 -7.005 1.00 0.00 H new ATOM 0 HB2 LEU A 61 7.748 -5.297 -5.502 1.00 0.00 H new ATOM 0 HB3 LEU A 61 7.317 -6.964 -5.177 1.00 0.00 H new ATOM 0 HG LEU A 61 7.161 -6.637 -7.989 1.00 0.00 H new ATOM 0 HD11 LEU A 61 9.435 -5.890 -8.552 1.00 0.00 H new ATOM 0 HD12 LEU A 61 8.472 -4.597 -7.797 1.00 0.00 H new ATOM 0 HD13 LEU A 61 9.709 -5.455 -6.848 1.00 0.00 H new ATOM 0 HD21 LEU A 61 8.996 -8.272 -7.995 1.00 0.00 H new ATOM 0 HD22 LEU A 61 9.241 -7.996 -6.254 1.00 0.00 H new ATOM 0 HD23 LEU A 61 7.716 -8.704 -6.836 1.00 0.00 H new ATOM 1007 N THR A 62 4.093 -7.472 -5.461 1.00 0.00 N ATOM 1008 CA THR A 62 3.201 -8.217 -4.589 1.00 0.00 C ATOM 1009 C THR A 62 3.812 -9.574 -4.235 1.00 0.00 C ATOM 1010 O THR A 62 4.256 -10.308 -5.117 1.00 0.00 O ATOM 1011 CB THR A 62 1.842 -8.325 -5.284 1.00 0.00 C ATOM 1012 OG1 THR A 62 1.296 -7.013 -5.185 1.00 0.00 O ATOM 1013 CG2 THR A 62 0.855 -9.199 -4.507 1.00 0.00 C ATOM 0 H THR A 62 4.080 -7.767 -6.437 1.00 0.00 H new ATOM 0 HA THR A 62 3.056 -7.703 -3.639 1.00 0.00 H new ATOM 0 HB THR A 62 1.978 -8.733 -6.285 1.00 0.00 H new ATOM 0 HG1 THR A 62 0.581 -7.006 -4.515 1.00 0.00 H new ATOM 0 HG21 THR A 62 -0.093 -9.242 -5.043 1.00 0.00 H new ATOM 0 HG22 THR A 62 1.261 -10.205 -4.406 1.00 0.00 H new ATOM 0 HG23 THR A 62 0.693 -8.773 -3.517 1.00 0.00 H new ATOM 1021 N PHE A 63 3.815 -9.867 -2.943 1.00 0.00 N ATOM 1022 CA PHE A 63 4.365 -11.123 -2.462 1.00 0.00 C ATOM 1023 C PHE A 63 3.334 -12.248 -2.566 1.00 0.00 C ATOM 1024 O PHE A 63 2.147 -12.033 -2.324 1.00 0.00 O ATOM 1025 CB PHE A 63 4.730 -10.916 -0.990 1.00 0.00 C ATOM 1026 CG PHE A 63 5.719 -11.948 -0.444 1.00 0.00 C ATOM 1027 CD1 PHE A 63 5.291 -13.198 -0.124 1.00 0.00 C ATOM 1028 CD2 PHE A 63 7.027 -11.614 -0.278 1.00 0.00 C ATOM 1029 CE1 PHE A 63 6.209 -14.155 0.384 1.00 0.00 C ATOM 1030 CE2 PHE A 63 7.945 -12.571 0.229 1.00 0.00 C ATOM 1031 CZ PHE A 63 7.517 -13.821 0.549 1.00 0.00 C ATOM 0 H PHE A 63 3.445 -9.256 -2.214 1.00 0.00 H new ATOM 0 HA PHE A 63 5.231 -11.404 -3.061 1.00 0.00 H new ATOM 0 HB2 PHE A 63 5.156 -9.920 -0.868 1.00 0.00 H new ATOM 0 HB3 PHE A 63 3.819 -10.949 -0.392 1.00 0.00 H new ATOM 0 HD1 PHE A 63 4.252 -13.463 -0.256 1.00 0.00 H new ATOM 0 HD2 PHE A 63 7.367 -10.621 -0.532 1.00 0.00 H new ATOM 0 HE1 PHE A 63 5.869 -15.148 0.639 1.00 0.00 H new ATOM 0 HE2 PHE A 63 8.984 -12.306 0.360 1.00 0.00 H new ATOM 0 HZ PHE A 63 8.216 -14.549 0.934 1.00 0.00 H new ATOM 1041 N PRO A 64 3.837 -13.456 -2.937 1.00 0.00 N ATOM 1042 CA PRO A 64 2.973 -14.616 -3.077 1.00 0.00 C ATOM 1043 C PRO A 64 2.568 -15.166 -1.708 1.00 0.00 C ATOM 1044 O PRO A 64 3.399 -15.713 -0.984 1.00 0.00 O ATOM 1045 CB PRO A 64 3.776 -15.608 -3.902 1.00 0.00 C ATOM 1046 CG PRO A 64 5.225 -15.159 -3.799 1.00 0.00 C ATOM 1047 CD PRO A 64 5.237 -13.749 -3.232 1.00 0.00 C ATOM 0 HA PRO A 64 2.030 -14.381 -3.570 1.00 0.00 H new ATOM 0 HB2 PRO A 64 3.653 -16.622 -3.522 1.00 0.00 H new ATOM 0 HB3 PRO A 64 3.442 -15.614 -4.939 1.00 0.00 H new ATOM 0 HG2 PRO A 64 5.789 -15.834 -3.155 1.00 0.00 H new ATOM 0 HG3 PRO A 64 5.702 -15.180 -4.779 1.00 0.00 H new ATOM 0 HD2 PRO A 64 5.852 -13.689 -2.334 1.00 0.00 H new ATOM 0 HD3 PRO A 64 5.648 -13.038 -3.948 1.00 0.00 H new ATOM 1055 N LEU A 65 1.291 -15.002 -1.393 1.00 0.00 N ATOM 1056 CA LEU A 65 0.766 -15.475 -0.124 1.00 0.00 C ATOM 1057 C LEU A 65 -0.518 -16.269 -0.372 1.00 0.00 C ATOM 1058 O LEU A 65 -1.575 -15.927 0.154 1.00 0.00 O ATOM 1059 CB LEU A 65 0.590 -14.309 0.851 1.00 0.00 C ATOM 1060 CG LEU A 65 1.830 -13.449 1.100 1.00 0.00 C ATOM 1061 CD1 LEU A 65 1.489 -12.231 1.961 1.00 0.00 C ATOM 1062 CD2 LEU A 65 2.962 -14.281 1.706 1.00 0.00 C ATOM 0 H LEU A 65 0.605 -14.548 -1.996 1.00 0.00 H new ATOM 0 HA LEU A 65 1.474 -16.154 0.352 1.00 0.00 H new ATOM 0 HB2 LEU A 65 -0.205 -13.665 0.476 1.00 0.00 H new ATOM 0 HB3 LEU A 65 0.252 -14.709 1.807 1.00 0.00 H new ATOM 0 HG LEU A 65 2.184 -13.075 0.140 1.00 0.00 H new ATOM 0 HD11 LEU A 65 2.388 -11.637 2.123 1.00 0.00 H new ATOM 0 HD12 LEU A 65 0.740 -11.624 1.453 1.00 0.00 H new ATOM 0 HD13 LEU A 65 1.096 -12.563 2.922 1.00 0.00 H new ATOM 0 HD21 LEU A 65 3.832 -13.645 1.873 1.00 0.00 H new ATOM 0 HD22 LEU A 65 2.634 -14.704 2.655 1.00 0.00 H new ATOM 0 HD23 LEU A 65 3.228 -15.087 1.022 1.00 0.00 H new ATOM 1074 N MET A 66 -0.383 -17.315 -1.175 1.00 0.00 N ATOM 1075 CA MET A 66 -1.519 -18.160 -1.499 1.00 0.00 C ATOM 1076 C MET A 66 -1.931 -19.011 -0.296 1.00 0.00 C ATOM 1077 O MET A 66 -1.970 -20.237 -0.383 1.00 0.00 O ATOM 1078 CB MET A 66 -1.157 -19.074 -2.671 1.00 0.00 C ATOM 1079 CG MET A 66 -1.191 -18.308 -3.995 1.00 0.00 C ATOM 1080 SD MET A 66 -2.875 -18.150 -4.566 1.00 0.00 S ATOM 1081 CE MET A 66 -2.954 -16.384 -4.812 1.00 0.00 C ATOM 0 H MET A 66 0.496 -17.596 -1.610 1.00 0.00 H new ATOM 0 HA MET A 66 -2.358 -17.520 -1.771 1.00 0.00 H new ATOM 0 HB2 MET A 66 -0.163 -19.494 -2.515 1.00 0.00 H new ATOM 0 HB3 MET A 66 -1.854 -19.911 -2.713 1.00 0.00 H new ATOM 0 HG2 MET A 66 -0.748 -17.320 -3.865 1.00 0.00 H new ATOM 0 HG3 MET A 66 -0.592 -18.830 -4.742 1.00 0.00 H new ATOM 0 HE1 MET A 66 -3.670 -16.158 -5.602 1.00 0.00 H new ATOM 0 HE2 MET A 66 -3.270 -15.902 -3.887 1.00 0.00 H new ATOM 0 HE3 MET A 66 -1.970 -16.012 -5.097 1.00 0.00 H new ATOM 1091 N GLU A 67 -2.229 -18.326 0.798 1.00 0.00 N ATOM 1092 CA GLU A 67 -2.636 -19.004 2.017 1.00 0.00 C ATOM 1093 C GLU A 67 -4.098 -18.685 2.338 1.00 0.00 C ATOM 1094 O GLU A 67 -4.796 -18.074 1.530 1.00 0.00 O ATOM 1095 CB GLU A 67 -1.724 -18.626 3.186 1.00 0.00 C ATOM 1096 CG GLU A 67 -0.548 -19.598 3.300 1.00 0.00 C ATOM 1097 CD GLU A 67 0.566 -19.228 2.319 1.00 0.00 C ATOM 1098 OE1 GLU A 67 0.352 -18.400 1.421 1.00 0.00 O ATOM 1099 OE2 GLU A 67 1.688 -19.834 2.515 1.00 0.00 O ATOM 0 H GLU A 67 -2.197 -17.309 0.866 1.00 0.00 H new ATOM 0 HA GLU A 67 -2.544 -20.079 1.860 1.00 0.00 H new ATOM 0 HB2 GLU A 67 -1.350 -17.612 3.047 1.00 0.00 H new ATOM 0 HB3 GLU A 67 -2.296 -18.631 4.114 1.00 0.00 H new ATOM 0 HG2 GLU A 67 -0.159 -19.586 4.318 1.00 0.00 H new ATOM 0 HG3 GLU A 67 -0.890 -20.614 3.101 1.00 0.00 H new ATOM 1107 N GLU A 68 -4.519 -19.114 3.519 1.00 0.00 N ATOM 1108 CA GLU A 68 -5.885 -18.883 3.956 1.00 0.00 C ATOM 1109 C GLU A 68 -6.374 -17.518 3.468 1.00 0.00 C ATOM 1110 O GLU A 68 -7.450 -17.414 2.880 1.00 0.00 O ATOM 1111 CB GLU A 68 -6.000 -18.995 5.478 1.00 0.00 C ATOM 1112 CG GLU A 68 -7.372 -19.533 5.886 1.00 0.00 C ATOM 1113 CD GLU A 68 -7.298 -21.023 6.226 1.00 0.00 C ATOM 1114 OE1 GLU A 68 -7.410 -21.396 7.404 1.00 0.00 O ATOM 1115 OE2 GLU A 68 -7.118 -21.804 5.216 1.00 0.00 O ATOM 0 H GLU A 68 -3.938 -19.620 4.187 1.00 0.00 H new ATOM 0 HA GLU A 68 -6.521 -19.653 3.519 1.00 0.00 H new ATOM 0 HB2 GLU A 68 -5.219 -19.654 5.858 1.00 0.00 H new ATOM 0 HB3 GLU A 68 -5.840 -18.017 5.931 1.00 0.00 H new ATOM 0 HG2 GLU A 68 -7.743 -18.978 6.748 1.00 0.00 H new ATOM 0 HG3 GLU A 68 -8.084 -19.376 5.075 1.00 0.00 H new ATOM 1123 N ASP A 69 -5.561 -16.505 3.730 1.00 0.00 N ATOM 1124 CA ASP A 69 -5.898 -15.151 3.325 1.00 0.00 C ATOM 1125 C ASP A 69 -4.619 -14.405 2.940 1.00 0.00 C ATOM 1126 O ASP A 69 -4.210 -14.423 1.780 1.00 0.00 O ATOM 1127 CB ASP A 69 -6.567 -14.384 4.467 1.00 0.00 C ATOM 1128 CG ASP A 69 -8.092 -14.501 4.519 1.00 0.00 C ATOM 1129 OD1 ASP A 69 -8.649 -15.213 5.368 1.00 0.00 O ATOM 1130 OD2 ASP A 69 -8.722 -13.814 3.628 1.00 0.00 O ATOM 0 H ASP A 69 -4.670 -16.595 4.218 1.00 0.00 H new ATOM 0 HA ASP A 69 -6.586 -15.213 2.481 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -6.158 -14.740 5.412 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -6.301 -13.330 4.382 1.00 0.00 H new ATOM 1136 N VAL A 70 -4.022 -13.767 3.936 1.00 0.00 N ATOM 1137 CA VAL A 70 -2.798 -13.016 3.717 1.00 0.00 C ATOM 1138 C VAL A 70 -2.254 -12.531 5.062 1.00 0.00 C ATOM 1139 O VAL A 70 -2.989 -11.951 5.860 1.00 0.00 O ATOM 1140 CB VAL A 70 -3.053 -11.876 2.729 1.00 0.00 C ATOM 1141 CG1 VAL A 70 -2.245 -10.632 3.107 1.00 0.00 C ATOM 1142 CG2 VAL A 70 -2.747 -12.313 1.295 1.00 0.00 C ATOM 0 H VAL A 70 -4.364 -13.755 4.897 1.00 0.00 H new ATOM 0 HA VAL A 70 -2.035 -13.652 3.269 1.00 0.00 H new ATOM 0 HB VAL A 70 -4.111 -11.618 2.782 1.00 0.00 H new ATOM 0 HG11 VAL A 70 -2.444 -9.837 2.389 1.00 0.00 H new ATOM 0 HG12 VAL A 70 -2.533 -10.301 4.105 1.00 0.00 H new ATOM 0 HG13 VAL A 70 -1.182 -10.872 3.097 1.00 0.00 H new ATOM 0 HG21 VAL A 70 -2.937 -11.484 0.614 1.00 0.00 H new ATOM 0 HG22 VAL A 70 -1.701 -12.612 1.221 1.00 0.00 H new ATOM 0 HG23 VAL A 70 -3.385 -13.156 1.028 1.00 0.00 H new ATOM 1152 N TYR A 71 -0.971 -12.787 5.273 1.00 0.00 N ATOM 1153 CA TYR A 71 -0.320 -12.384 6.508 1.00 0.00 C ATOM 1154 C TYR A 71 1.202 -12.407 6.358 1.00 0.00 C ATOM 1155 O TYR A 71 1.908 -12.910 7.231 1.00 0.00 O ATOM 1156 CB TYR A 71 -0.733 -13.417 7.558 1.00 0.00 C ATOM 1157 CG TYR A 71 -0.035 -14.770 7.408 1.00 0.00 C ATOM 1158 CD1 TYR A 71 -0.203 -15.509 6.255 1.00 0.00 C ATOM 1159 CD2 TYR A 71 0.763 -15.251 8.427 1.00 0.00 C ATOM 1160 CE1 TYR A 71 0.454 -16.782 6.114 1.00 0.00 C ATOM 1161 CE2 TYR A 71 1.420 -16.525 8.286 1.00 0.00 C ATOM 1162 CZ TYR A 71 1.233 -17.227 7.137 1.00 0.00 C ATOM 1163 OH TYR A 71 1.854 -18.430 7.004 1.00 0.00 O ATOM 0 H TYR A 71 -0.365 -13.269 4.609 1.00 0.00 H new ATOM 0 HA TYR A 71 -0.610 -11.370 6.782 1.00 0.00 H new ATOM 0 HB2 TYR A 71 -0.519 -13.018 8.549 1.00 0.00 H new ATOM 0 HB3 TYR A 71 -1.811 -13.567 7.500 1.00 0.00 H new ATOM 0 HD1 TYR A 71 -0.827 -15.132 5.458 1.00 0.00 H new ATOM 0 HD2 TYR A 71 0.894 -14.672 9.329 1.00 0.00 H new ATOM 0 HE1 TYR A 71 0.331 -17.370 5.217 1.00 0.00 H new ATOM 0 HE2 TYR A 71 2.047 -16.914 9.075 1.00 0.00 H new ATOM 0 HH TYR A 71 2.377 -18.619 7.811 1.00 0.00 H new ATOM 1173 N GLY A 72 1.664 -11.855 5.245 1.00 0.00 N ATOM 1174 CA GLY A 72 3.090 -11.806 4.970 1.00 0.00 C ATOM 1175 C GLY A 72 3.571 -10.361 4.829 1.00 0.00 C ATOM 1176 O GLY A 72 3.561 -9.602 5.797 1.00 0.00 O ATOM 0 H GLY A 72 1.076 -11.438 4.523 1.00 0.00 H new ATOM 0 HA2 GLY A 72 3.636 -12.298 5.775 1.00 0.00 H new ATOM 0 HA3 GLY A 72 3.307 -12.356 4.054 1.00 0.00 H new ATOM 1180 N GLU A 73 3.982 -10.023 3.616 1.00 0.00 N ATOM 1181 CA GLU A 73 4.466 -8.682 3.336 1.00 0.00 C ATOM 1182 C GLU A 73 4.352 -8.377 1.841 1.00 0.00 C ATOM 1183 O GLU A 73 4.254 -9.291 1.023 1.00 0.00 O ATOM 1184 CB GLU A 73 5.906 -8.506 3.823 1.00 0.00 C ATOM 1185 CG GLU A 73 6.881 -9.296 2.947 1.00 0.00 C ATOM 1186 CD GLU A 73 7.567 -10.403 3.750 1.00 0.00 C ATOM 1187 OE1 GLU A 73 8.110 -10.137 4.833 1.00 0.00 O ATOM 1188 OE2 GLU A 73 7.522 -11.574 3.213 1.00 0.00 O ATOM 0 H GLU A 73 3.990 -10.655 2.815 1.00 0.00 H new ATOM 0 HA GLU A 73 3.843 -7.972 3.880 1.00 0.00 H new ATOM 0 HB2 GLU A 73 6.172 -7.449 3.808 1.00 0.00 H new ATOM 0 HB3 GLU A 73 5.988 -8.841 4.857 1.00 0.00 H new ATOM 0 HG2 GLU A 73 6.346 -9.732 2.103 1.00 0.00 H new ATOM 0 HG3 GLU A 73 7.632 -8.623 2.534 1.00 0.00 H new ATOM 1196 N ILE A 74 4.368 -7.089 1.529 1.00 0.00 N ATOM 1197 CA ILE A 74 4.268 -6.653 0.147 1.00 0.00 C ATOM 1198 C ILE A 74 5.270 -5.523 -0.101 1.00 0.00 C ATOM 1199 O ILE A 74 5.452 -4.653 0.748 1.00 0.00 O ATOM 1200 CB ILE A 74 2.824 -6.280 -0.194 1.00 0.00 C ATOM 1201 CG1 ILE A 74 2.458 -4.913 0.390 1.00 0.00 C ATOM 1202 CG2 ILE A 74 1.854 -7.374 0.257 1.00 0.00 C ATOM 1203 CD1 ILE A 74 2.177 -3.900 -0.722 1.00 0.00 C ATOM 0 H ILE A 74 4.449 -6.334 2.210 1.00 0.00 H new ATOM 0 HA ILE A 74 4.531 -7.467 -0.529 1.00 0.00 H new ATOM 0 HB ILE A 74 2.739 -6.201 -1.278 1.00 0.00 H new ATOM 0 HG12 ILE A 74 1.580 -5.010 1.029 1.00 0.00 H new ATOM 0 HG13 ILE A 74 3.272 -4.552 1.019 1.00 0.00 H new ATOM 0 HG21 ILE A 74 0.835 -7.084 0.003 1.00 0.00 H new ATOM 0 HG22 ILE A 74 2.101 -8.309 -0.245 1.00 0.00 H new ATOM 0 HG23 ILE A 74 1.934 -7.509 1.336 1.00 0.00 H new ATOM 0 HD11 ILE A 74 1.919 -2.937 -0.281 1.00 0.00 H new ATOM 0 HD12 ILE A 74 3.065 -3.788 -1.345 1.00 0.00 H new ATOM 0 HD13 ILE A 74 1.347 -4.252 -1.334 1.00 0.00 H new ATOM 1215 N TYR A 75 5.893 -5.574 -1.269 1.00 0.00 N ATOM 1216 CA TYR A 75 6.872 -4.566 -1.639 1.00 0.00 C ATOM 1217 C TYR A 75 6.193 -3.346 -2.264 1.00 0.00 C ATOM 1218 O TYR A 75 5.347 -3.485 -3.146 1.00 0.00 O ATOM 1219 CB TYR A 75 7.777 -5.221 -2.685 1.00 0.00 C ATOM 1220 CG TYR A 75 8.412 -6.534 -2.223 1.00 0.00 C ATOM 1221 CD1 TYR A 75 9.585 -6.516 -1.496 1.00 0.00 C ATOM 1222 CD2 TYR A 75 7.812 -7.738 -2.534 1.00 0.00 C ATOM 1223 CE1 TYR A 75 10.182 -7.752 -1.061 1.00 0.00 C ATOM 1224 CE2 TYR A 75 8.409 -8.974 -2.099 1.00 0.00 C ATOM 1225 CZ TYR A 75 9.565 -8.920 -1.384 1.00 0.00 C ATOM 1226 OH TYR A 75 10.129 -10.087 -0.974 1.00 0.00 O ATOM 0 H TYR A 75 5.739 -6.297 -1.971 1.00 0.00 H new ATOM 0 HA TYR A 75 7.423 -4.227 -0.762 1.00 0.00 H new ATOM 0 HB2 TYR A 75 7.195 -5.408 -3.588 1.00 0.00 H new ATOM 0 HB3 TYR A 75 8.568 -4.522 -2.955 1.00 0.00 H new ATOM 0 HD1 TYR A 75 10.055 -5.575 -1.253 1.00 0.00 H new ATOM 0 HD2 TYR A 75 6.895 -7.753 -3.104 1.00 0.00 H new ATOM 0 HE1 TYR A 75 11.099 -7.751 -0.491 1.00 0.00 H new ATOM 0 HE2 TYR A 75 7.949 -9.922 -2.335 1.00 0.00 H new ATOM 0 HH TYR A 75 10.948 -10.252 -1.487 1.00 0.00 H new ATOM 1236 N VAL A 76 6.588 -2.177 -1.781 1.00 0.00 N ATOM 1237 CA VAL A 76 6.028 -0.933 -2.281 1.00 0.00 C ATOM 1238 C VAL A 76 7.165 0.030 -2.629 1.00 0.00 C ATOM 1239 O VAL A 76 8.237 -0.027 -2.029 1.00 0.00 O ATOM 1240 CB VAL A 76 5.046 -0.354 -1.260 1.00 0.00 C ATOM 1241 CG1 VAL A 76 4.370 0.906 -1.804 1.00 0.00 C ATOM 1242 CG2 VAL A 76 4.008 -1.398 -0.845 1.00 0.00 C ATOM 0 H VAL A 76 7.289 -2.065 -1.049 1.00 0.00 H new ATOM 0 HA VAL A 76 5.461 -1.110 -3.195 1.00 0.00 H new ATOM 0 HB VAL A 76 5.612 -0.073 -0.372 1.00 0.00 H new ATOM 0 HG11 VAL A 76 3.677 1.298 -1.059 1.00 0.00 H new ATOM 0 HG12 VAL A 76 5.127 1.658 -2.026 1.00 0.00 H new ATOM 0 HG13 VAL A 76 3.823 0.661 -2.715 1.00 0.00 H new ATOM 0 HG21 VAL A 76 3.322 -0.961 -0.119 1.00 0.00 H new ATOM 0 HG22 VAL A 76 3.449 -1.724 -1.722 1.00 0.00 H new ATOM 0 HG23 VAL A 76 4.512 -2.255 -0.398 1.00 0.00 H new ATOM 1252 N CYS A 77 6.892 0.892 -3.597 1.00 0.00 N ATOM 1253 CA CYS A 77 7.879 1.866 -4.032 1.00 0.00 C ATOM 1254 C CYS A 77 7.145 3.147 -4.433 1.00 0.00 C ATOM 1255 O CYS A 77 6.586 3.231 -5.525 1.00 0.00 O ATOM 1256 CB CYS A 77 8.744 1.324 -5.172 1.00 0.00 C ATOM 1257 SG CYS A 77 8.962 -0.484 -4.987 1.00 0.00 S ATOM 0 H CYS A 77 6.002 0.936 -4.093 1.00 0.00 H new ATOM 0 HA CYS A 77 8.566 2.082 -3.213 1.00 0.00 H new ATOM 0 HB2 CYS A 77 8.277 1.546 -6.131 1.00 0.00 H new ATOM 0 HB3 CYS A 77 9.716 1.818 -5.169 1.00 0.00 H new ATOM 0 HG CYS A 77 8.889 -1.052 -6.154 1.00 0.00 H new ATOM 1263 N PRO A 78 7.172 4.140 -3.503 1.00 0.00 N ATOM 1264 CA PRO A 78 6.516 5.413 -3.749 1.00 0.00 C ATOM 1265 C PRO A 78 7.322 6.265 -4.731 1.00 0.00 C ATOM 1266 O PRO A 78 6.896 7.355 -5.109 1.00 0.00 O ATOM 1267 CB PRO A 78 6.381 6.056 -2.378 1.00 0.00 C ATOM 1268 CG PRO A 78 7.375 5.337 -1.480 1.00 0.00 C ATOM 1269 CD PRO A 78 7.825 4.076 -2.199 1.00 0.00 C ATOM 0 HA PRO A 78 5.540 5.299 -4.220 1.00 0.00 H new ATOM 0 HB2 PRO A 78 6.598 7.123 -2.424 1.00 0.00 H new ATOM 0 HB3 PRO A 78 5.365 5.953 -1.997 1.00 0.00 H new ATOM 0 HG2 PRO A 78 8.229 5.979 -1.265 1.00 0.00 H new ATOM 0 HG3 PRO A 78 6.915 5.088 -0.524 1.00 0.00 H new ATOM 0 HD2 PRO A 78 8.910 4.044 -2.301 1.00 0.00 H new ATOM 0 HD3 PRO A 78 7.529 3.181 -1.652 1.00 0.00 H new ATOM 1277 N LEU A 79 8.474 5.735 -5.118 1.00 0.00 N ATOM 1278 CA LEU A 79 9.343 6.433 -6.050 1.00 0.00 C ATOM 1279 C LEU A 79 8.701 6.432 -7.438 1.00 0.00 C ATOM 1280 O LEU A 79 8.536 7.487 -8.050 1.00 0.00 O ATOM 1281 CB LEU A 79 10.750 5.831 -6.023 1.00 0.00 C ATOM 1282 CG LEU A 79 11.862 6.699 -6.616 1.00 0.00 C ATOM 1283 CD1 LEU A 79 11.692 6.848 -8.129 1.00 0.00 C ATOM 1284 CD2 LEU A 79 11.935 8.054 -5.911 1.00 0.00 C ATOM 0 H LEU A 79 8.825 4.831 -4.803 1.00 0.00 H new ATOM 0 HA LEU A 79 9.461 7.475 -5.754 1.00 0.00 H new ATOM 0 HB2 LEU A 79 11.007 5.603 -4.988 1.00 0.00 H new ATOM 0 HB3 LEU A 79 10.729 4.884 -6.562 1.00 0.00 H new ATOM 0 HG LEU A 79 12.815 6.197 -6.447 1.00 0.00 H new ATOM 0 HD11 LEU A 79 12.495 7.469 -8.526 1.00 0.00 H new ATOM 0 HD12 LEU A 79 11.728 5.865 -8.598 1.00 0.00 H new ATOM 0 HD13 LEU A 79 10.731 7.316 -8.343 1.00 0.00 H new ATOM 0 HD21 LEU A 79 12.733 8.651 -6.352 1.00 0.00 H new ATOM 0 HD22 LEU A 79 10.985 8.576 -6.027 1.00 0.00 H new ATOM 0 HD23 LEU A 79 12.138 7.902 -4.851 1.00 0.00 H new ATOM 1296 N ILE A 80 8.356 5.237 -7.895 1.00 0.00 N ATOM 1297 CA ILE A 80 7.735 5.086 -9.201 1.00 0.00 C ATOM 1298 C ILE A 80 6.277 5.543 -9.123 1.00 0.00 C ATOM 1299 O ILE A 80 5.772 6.179 -10.047 1.00 0.00 O ATOM 1300 CB ILE A 80 7.905 3.654 -9.712 1.00 0.00 C ATOM 1301 CG1 ILE A 80 9.383 3.262 -9.765 1.00 0.00 C ATOM 1302 CG2 ILE A 80 7.214 3.469 -11.064 1.00 0.00 C ATOM 1303 CD1 ILE A 80 9.701 2.178 -8.733 1.00 0.00 C ATOM 0 H ILE A 80 8.494 4.365 -7.385 1.00 0.00 H new ATOM 0 HA ILE A 80 8.230 5.722 -9.935 1.00 0.00 H new ATOM 0 HB ILE A 80 7.419 2.980 -9.007 1.00 0.00 H new ATOM 0 HG12 ILE A 80 9.632 2.903 -10.763 1.00 0.00 H new ATOM 0 HG13 ILE A 80 10.002 4.139 -9.579 1.00 0.00 H new ATOM 0 HG21 ILE A 80 7.350 2.443 -11.405 1.00 0.00 H new ATOM 0 HG22 ILE A 80 6.149 3.679 -10.960 1.00 0.00 H new ATOM 0 HG23 ILE A 80 7.649 4.154 -11.792 1.00 0.00 H new ATOM 0 HD11 ILE A 80 10.758 1.918 -8.792 1.00 0.00 H new ATOM 0 HD12 ILE A 80 9.474 2.549 -7.734 1.00 0.00 H new ATOM 0 HD13 ILE A 80 9.098 1.293 -8.937 1.00 0.00 H new ATOM 1315 N VAL A 81 5.642 5.200 -8.012 1.00 0.00 N ATOM 1316 CA VAL A 81 4.251 5.567 -7.802 1.00 0.00 C ATOM 1317 C VAL A 81 4.092 7.077 -7.994 1.00 0.00 C ATOM 1318 O VAL A 81 3.203 7.524 -8.717 1.00 0.00 O ATOM 1319 CB VAL A 81 3.786 5.087 -6.426 1.00 0.00 C ATOM 1320 CG1 VAL A 81 2.312 5.429 -6.195 1.00 0.00 C ATOM 1321 CG2 VAL A 81 4.034 3.587 -6.255 1.00 0.00 C ATOM 0 H VAL A 81 6.064 4.672 -7.248 1.00 0.00 H new ATOM 0 HA VAL A 81 3.611 5.077 -8.536 1.00 0.00 H new ATOM 0 HB VAL A 81 4.374 5.611 -5.673 1.00 0.00 H new ATOM 0 HG11 VAL A 81 2.007 5.077 -5.210 1.00 0.00 H new ATOM 0 HG12 VAL A 81 2.176 6.509 -6.253 1.00 0.00 H new ATOM 0 HG13 VAL A 81 1.702 4.945 -6.958 1.00 0.00 H new ATOM 0 HG21 VAL A 81 3.694 3.272 -5.268 1.00 0.00 H new ATOM 0 HG22 VAL A 81 3.485 3.038 -7.020 1.00 0.00 H new ATOM 0 HG23 VAL A 81 5.100 3.381 -6.355 1.00 0.00 H new ATOM 1331 N GLU A 82 4.967 7.821 -7.333 1.00 0.00 N ATOM 1332 CA GLU A 82 4.935 9.271 -7.422 1.00 0.00 C ATOM 1333 C GLU A 82 5.349 9.726 -8.823 1.00 0.00 C ATOM 1334 O GLU A 82 4.678 10.555 -9.434 1.00 0.00 O ATOM 1335 CB GLU A 82 5.826 9.905 -6.353 1.00 0.00 C ATOM 1336 CG GLU A 82 5.052 10.119 -5.050 1.00 0.00 C ATOM 1337 CD GLU A 82 5.992 10.533 -3.916 1.00 0.00 C ATOM 1338 OE1 GLU A 82 6.271 9.725 -3.017 1.00 0.00 O ATOM 1339 OE2 GLU A 82 6.439 11.740 -3.991 1.00 0.00 O ATOM 0 H GLU A 82 5.702 7.447 -6.734 1.00 0.00 H new ATOM 0 HA GLU A 82 3.913 9.605 -7.241 1.00 0.00 H new ATOM 0 HB2 GLU A 82 6.688 9.265 -6.167 1.00 0.00 H new ATOM 0 HB3 GLU A 82 6.209 10.860 -6.713 1.00 0.00 H new ATOM 0 HG2 GLU A 82 4.292 10.887 -5.196 1.00 0.00 H new ATOM 0 HG3 GLU A 82 4.530 9.202 -4.778 1.00 0.00 H new ATOM 1347 N GLU A 83 6.454 9.163 -9.291 1.00 0.00 N ATOM 1348 CA GLU A 83 6.966 9.501 -10.608 1.00 0.00 C ATOM 1349 C GLU A 83 5.884 9.288 -11.668 1.00 0.00 C ATOM 1350 O GLU A 83 5.699 10.127 -12.549 1.00 0.00 O ATOM 1351 CB GLU A 83 8.220 8.687 -10.933 1.00 0.00 C ATOM 1352 CG GLU A 83 8.829 9.129 -12.266 1.00 0.00 C ATOM 1353 CD GLU A 83 10.178 9.818 -12.050 1.00 0.00 C ATOM 1354 OE1 GLU A 83 10.307 10.659 -11.148 1.00 0.00 O ATOM 1355 OE2 GLU A 83 11.113 9.452 -12.859 1.00 0.00 O ATOM 0 H GLU A 83 7.009 8.475 -8.781 1.00 0.00 H new ATOM 0 HA GLU A 83 7.246 10.554 -10.609 1.00 0.00 H new ATOM 0 HB2 GLU A 83 8.953 8.808 -10.136 1.00 0.00 H new ATOM 0 HB3 GLU A 83 7.969 7.627 -10.977 1.00 0.00 H new ATOM 0 HG2 GLU A 83 8.958 8.263 -12.916 1.00 0.00 H new ATOM 0 HG3 GLU A 83 8.146 9.810 -12.774 1.00 0.00 H new ATOM 1363 N ASN A 84 5.197 8.162 -11.549 1.00 0.00 N ATOM 1364 CA ASN A 84 4.138 7.829 -12.487 1.00 0.00 C ATOM 1365 C ASN A 84 2.912 8.697 -12.195 1.00 0.00 C ATOM 1366 O ASN A 84 2.222 9.132 -13.116 1.00 0.00 O ATOM 1367 CB ASN A 84 3.722 6.363 -12.350 1.00 0.00 C ATOM 1368 CG ASN A 84 4.335 5.512 -13.465 1.00 0.00 C ATOM 1369 OD1 ASN A 84 3.661 5.056 -14.374 1.00 0.00 O ATOM 1370 ND2 ASN A 84 5.646 5.326 -13.345 1.00 0.00 N ATOM 0 H ASN A 84 5.353 7.468 -10.817 1.00 0.00 H new ATOM 0 HA ASN A 84 4.513 8.005 -13.495 1.00 0.00 H new ATOM 0 HB2 ASN A 84 4.039 5.981 -11.380 1.00 0.00 H new ATOM 0 HB3 ASN A 84 2.635 6.285 -12.384 1.00 0.00 H new ATOM 0 HD21 ASN A 84 6.148 4.773 -14.039 1.00 0.00 H new ATOM 0 HD22 ASN A 84 6.149 5.737 -12.559 1.00 0.00 H new ATOM 1377 N ALA A 85 2.679 8.923 -10.911 1.00 0.00 N ATOM 1378 CA ALA A 85 1.549 9.731 -10.486 1.00 0.00 C ATOM 1379 C ALA A 85 1.768 11.179 -10.930 1.00 0.00 C ATOM 1380 O ALA A 85 0.808 11.912 -11.163 1.00 0.00 O ATOM 1381 CB ALA A 85 1.371 9.605 -8.972 1.00 0.00 C ATOM 0 H ALA A 85 3.254 8.560 -10.150 1.00 0.00 H new ATOM 0 HA ALA A 85 0.629 9.379 -10.952 1.00 0.00 H new ATOM 0 HB1 ALA A 85 0.523 10.211 -8.654 1.00 0.00 H new ATOM 0 HB2 ALA A 85 1.189 8.562 -8.713 1.00 0.00 H new ATOM 0 HB3 ALA A 85 2.274 9.952 -8.469 1.00 0.00 H new ATOM 1387 N ARG A 86 3.036 11.547 -11.032 1.00 0.00 N ATOM 1388 CA ARG A 86 3.393 12.894 -11.443 1.00 0.00 C ATOM 1389 C ARG A 86 2.996 13.127 -12.902 1.00 0.00 C ATOM 1390 O ARG A 86 2.592 14.229 -13.271 1.00 0.00 O ATOM 1391 CB ARG A 86 4.896 13.138 -11.285 1.00 0.00 C ATOM 1392 CG ARG A 86 5.269 13.323 -9.813 1.00 0.00 C ATOM 1393 CD ARG A 86 6.164 14.551 -9.625 1.00 0.00 C ATOM 1394 NE ARG A 86 7.566 14.127 -9.414 1.00 0.00 N ATOM 1395 CZ ARG A 86 8.538 14.936 -8.941 1.00 0.00 C ATOM 1396 NH1 ARG A 86 8.267 16.221 -8.625 1.00 0.00 N ATOM 1397 NH2 ARG A 86 9.757 14.453 -8.791 1.00 0.00 N ATOM 0 H ARG A 86 3.829 10.936 -10.837 1.00 0.00 H new ATOM 0 HA ARG A 86 2.854 13.590 -10.801 1.00 0.00 H new ATOM 0 HB2 ARG A 86 5.450 12.297 -11.702 1.00 0.00 H new ATOM 0 HB3 ARG A 86 5.186 14.023 -11.851 1.00 0.00 H new ATOM 0 HG2 ARG A 86 4.364 13.433 -9.216 1.00 0.00 H new ATOM 0 HG3 ARG A 86 5.784 12.434 -9.450 1.00 0.00 H new ATOM 0 HD2 ARG A 86 6.098 15.197 -10.501 1.00 0.00 H new ATOM 0 HD3 ARG A 86 5.820 15.135 -8.772 1.00 0.00 H new ATOM 0 HE ARG A 86 7.813 13.164 -9.640 1.00 0.00 H new ATOM 0 HH11 ARG A 86 7.322 16.587 -8.743 1.00 0.00 H new ATOM 0 HH12 ARG A 86 9.007 16.825 -8.268 1.00 0.00 H new ATOM 0 HH21 ARG A 86 9.954 13.481 -9.031 1.00 0.00 H new ATOM 0 HH22 ARG A 86 10.502 15.051 -8.435 1.00 0.00 H new ATOM 1410 N GLU A 87 3.126 12.072 -13.693 1.00 0.00 N ATOM 1411 CA GLU A 87 2.785 12.147 -15.103 1.00 0.00 C ATOM 1412 C GLU A 87 1.287 11.910 -15.301 1.00 0.00 C ATOM 1413 O GLU A 87 0.720 12.311 -16.317 1.00 0.00 O ATOM 1414 CB GLU A 87 3.611 11.151 -15.921 1.00 0.00 C ATOM 1415 CG GLU A 87 3.239 9.710 -15.566 1.00 0.00 C ATOM 1416 CD GLU A 87 3.509 8.769 -16.742 1.00 0.00 C ATOM 1417 OE1 GLU A 87 4.377 9.056 -17.579 1.00 0.00 O ATOM 1418 OE2 GLU A 87 2.780 7.705 -16.767 1.00 0.00 O ATOM 0 H GLU A 87 3.463 11.160 -13.384 1.00 0.00 H new ATOM 0 HA GLU A 87 3.025 13.148 -15.461 1.00 0.00 H new ATOM 0 HB2 GLU A 87 3.445 11.322 -16.985 1.00 0.00 H new ATOM 0 HB3 GLU A 87 4.673 11.313 -15.734 1.00 0.00 H new ATOM 0 HG2 GLU A 87 3.812 9.386 -14.697 1.00 0.00 H new ATOM 0 HG3 GLU A 87 2.186 9.660 -15.290 1.00 0.00 H new ATOM 1426 N PHE A 88 0.688 11.259 -14.315 1.00 0.00 N ATOM 1427 CA PHE A 88 -0.734 10.964 -14.368 1.00 0.00 C ATOM 1428 C PHE A 88 -1.499 11.761 -13.310 1.00 0.00 C ATOM 1429 O PHE A 88 -2.646 11.444 -12.998 1.00 0.00 O ATOM 1430 CB PHE A 88 -0.892 9.470 -14.077 1.00 0.00 C ATOM 1431 CG PHE A 88 -1.962 8.781 -14.926 1.00 0.00 C ATOM 1432 CD1 PHE A 88 -1.642 8.282 -16.150 1.00 0.00 C ATOM 1433 CD2 PHE A 88 -3.233 8.667 -14.456 1.00 0.00 C ATOM 1434 CE1 PHE A 88 -2.636 7.643 -16.938 1.00 0.00 C ATOM 1435 CE2 PHE A 88 -4.227 8.028 -15.244 1.00 0.00 C ATOM 1436 CZ PHE A 88 -3.907 7.529 -16.468 1.00 0.00 C ATOM 0 H PHE A 88 1.161 10.927 -13.475 1.00 0.00 H new ATOM 0 HA PHE A 88 -1.133 11.233 -15.346 1.00 0.00 H new ATOM 0 HB2 PHE A 88 0.064 8.975 -14.244 1.00 0.00 H new ATOM 0 HB3 PHE A 88 -1.139 9.340 -13.023 1.00 0.00 H new ATOM 0 HD1 PHE A 88 -0.632 8.372 -16.523 1.00 0.00 H new ATOM 0 HD2 PHE A 88 -3.487 9.062 -13.483 1.00 0.00 H new ATOM 0 HE1 PHE A 88 -2.382 7.248 -17.911 1.00 0.00 H new ATOM 0 HE2 PHE A 88 -5.237 7.938 -14.871 1.00 0.00 H new ATOM 0 HZ PHE A 88 -4.662 7.042 -17.067 1.00 0.00 H new ATOM 1446 N ASN A 89 -0.834 12.780 -12.786 1.00 0.00 N ATOM 1447 CA ASN A 89 -1.437 13.625 -11.770 1.00 0.00 C ATOM 1448 C ASN A 89 -2.247 12.756 -10.805 1.00 0.00 C ATOM 1449 O ASN A 89 -3.240 13.210 -10.240 1.00 0.00 O ATOM 1450 CB ASN A 89 -2.387 14.648 -12.396 1.00 0.00 C ATOM 1451 CG ASN A 89 -3.052 15.509 -11.320 1.00 0.00 C ATOM 1452 OD1 ASN A 89 -2.211 15.970 -10.399 1.00 0.00 O flip ATOM 1453 ND2 ASN A 89 -4.250 15.740 -11.326 1.00 0.00 N flip ATOM 0 H ASN A 89 0.117 13.040 -13.046 1.00 0.00 H new ATOM 0 HA ASN A 89 -0.636 14.149 -11.249 1.00 0.00 H new ATOM 0 HB2 ASN A 89 -1.836 15.285 -13.088 1.00 0.00 H new ATOM 0 HB3 ASN A 89 -3.151 14.132 -12.977 1.00 0.00 H new ATOM 0 HD21 ASN A 89 -4.840 15.355 -12.063 1.00 0.00 H new ATOM 0 HD22 ASN A 89 -4.662 16.319 -10.594 1.00 0.00 H new ATOM 1460 N ASN A 90 -1.792 11.522 -10.647 1.00 0.00 N ATOM 1461 CA ASN A 90 -2.462 10.585 -9.761 1.00 0.00 C ATOM 1462 C ASN A 90 -2.133 10.938 -8.310 1.00 0.00 C ATOM 1463 O ASN A 90 -1.131 11.599 -8.040 1.00 0.00 O ATOM 1464 CB ASN A 90 -1.992 9.152 -10.018 1.00 0.00 C ATOM 1465 CG ASN A 90 -3.062 8.141 -9.600 1.00 0.00 C ATOM 1466 OD1 ASN A 90 -4.179 8.141 -10.092 1.00 0.00 O ATOM 1467 ND2 ASN A 90 -2.660 7.281 -8.669 1.00 0.00 N ATOM 0 H ASN A 90 -0.967 11.149 -11.118 1.00 0.00 H new ATOM 0 HA ASN A 90 -3.534 10.652 -9.948 1.00 0.00 H new ATOM 0 HB2 ASN A 90 -1.760 9.026 -11.076 1.00 0.00 H new ATOM 0 HB3 ASN A 90 -1.072 8.963 -9.465 1.00 0.00 H new ATOM 0 HD21 ASN A 90 -3.301 6.566 -8.324 1.00 0.00 H new ATOM 0 HD22 ASN A 90 -1.711 7.336 -8.299 1.00 0.00 H new ATOM 1474 N THR A 91 -2.994 10.481 -7.413 1.00 0.00 N ATOM 1475 CA THR A 91 -2.807 10.740 -5.995 1.00 0.00 C ATOM 1476 C THR A 91 -1.824 9.734 -5.394 1.00 0.00 C ATOM 1477 O THR A 91 -2.205 8.614 -5.057 1.00 0.00 O ATOM 1478 CB THR A 91 -4.183 10.721 -5.326 1.00 0.00 C ATOM 1479 OG1 THR A 91 -5.082 11.088 -6.368 1.00 0.00 O ATOM 1480 CG2 THR A 91 -4.344 11.832 -4.286 1.00 0.00 C ATOM 0 H THR A 91 -3.823 9.933 -7.640 1.00 0.00 H new ATOM 0 HA THR A 91 -2.362 11.721 -5.827 1.00 0.00 H new ATOM 0 HB THR A 91 -4.341 9.753 -4.851 1.00 0.00 H new ATOM 0 HG1 THR A 91 -5.998 11.099 -6.021 1.00 0.00 H new ATOM 0 HG21 THR A 91 -5.338 11.773 -3.842 1.00 0.00 H new ATOM 0 HG22 THR A 91 -3.591 11.713 -3.507 1.00 0.00 H new ATOM 0 HG23 THR A 91 -4.218 12.802 -4.767 1.00 0.00 H new ATOM 1488 N PHE A 92 -0.578 10.169 -5.279 1.00 0.00 N ATOM 1489 CA PHE A 92 0.463 9.320 -4.725 1.00 0.00 C ATOM 1490 C PHE A 92 0.044 8.755 -3.366 1.00 0.00 C ATOM 1491 O PHE A 92 0.531 7.706 -2.949 1.00 0.00 O ATOM 1492 CB PHE A 92 1.703 10.196 -4.539 1.00 0.00 C ATOM 1493 CG PHE A 92 2.498 9.888 -3.269 1.00 0.00 C ATOM 1494 CD1 PHE A 92 2.904 8.615 -3.012 1.00 0.00 C ATOM 1495 CD2 PHE A 92 2.799 10.887 -2.396 1.00 0.00 C ATOM 1496 CE1 PHE A 92 3.641 8.330 -1.833 1.00 0.00 C ATOM 1497 CE2 PHE A 92 3.537 10.601 -1.217 1.00 0.00 C ATOM 1498 CZ PHE A 92 3.942 9.328 -0.960 1.00 0.00 C ATOM 0 H PHE A 92 -0.266 11.098 -5.560 1.00 0.00 H new ATOM 0 HA PHE A 92 0.654 8.481 -5.394 1.00 0.00 H new ATOM 0 HB2 PHE A 92 2.356 10.072 -5.403 1.00 0.00 H new ATOM 0 HB3 PHE A 92 1.397 11.242 -4.519 1.00 0.00 H new ATOM 0 HD1 PHE A 92 2.666 7.822 -3.705 1.00 0.00 H new ATOM 0 HD2 PHE A 92 2.477 11.897 -2.600 1.00 0.00 H new ATOM 0 HE1 PHE A 92 3.963 7.319 -1.629 1.00 0.00 H new ATOM 0 HE2 PHE A 92 3.777 11.394 -0.524 1.00 0.00 H new ATOM 0 HZ PHE A 92 4.502 9.110 -0.063 1.00 0.00 H new ATOM 1508 N GLU A 93 -0.856 9.476 -2.713 1.00 0.00 N ATOM 1509 CA GLU A 93 -1.346 9.060 -1.410 1.00 0.00 C ATOM 1510 C GLU A 93 -2.302 7.875 -1.556 1.00 0.00 C ATOM 1511 O GLU A 93 -2.150 6.863 -0.875 1.00 0.00 O ATOM 1512 CB GLU A 93 -2.022 10.224 -0.682 1.00 0.00 C ATOM 1513 CG GLU A 93 -3.260 10.702 -1.443 1.00 0.00 C ATOM 1514 CD GLU A 93 -3.669 12.107 -0.997 1.00 0.00 C ATOM 1515 OE1 GLU A 93 -4.081 12.296 0.157 1.00 0.00 O ATOM 1516 OE2 GLU A 93 -3.546 13.022 -1.898 1.00 0.00 O ATOM 0 H GLU A 93 -1.259 10.346 -3.062 1.00 0.00 H new ATOM 0 HA GLU A 93 -0.495 8.742 -0.807 1.00 0.00 H new ATOM 0 HB2 GLU A 93 -2.306 9.913 0.323 1.00 0.00 H new ATOM 0 HB3 GLU A 93 -1.317 11.048 -0.573 1.00 0.00 H new ATOM 0 HG2 GLU A 93 -3.056 10.701 -2.514 1.00 0.00 H new ATOM 0 HG3 GLU A 93 -4.084 10.009 -1.275 1.00 0.00 H new ATOM 1524 N LYS A 94 -3.267 8.040 -2.450 1.00 0.00 N ATOM 1525 CA LYS A 94 -4.248 6.997 -2.694 1.00 0.00 C ATOM 1526 C LYS A 94 -3.552 5.785 -3.319 1.00 0.00 C ATOM 1527 O LYS A 94 -3.824 4.646 -2.942 1.00 0.00 O ATOM 1528 CB LYS A 94 -5.409 7.538 -3.530 1.00 0.00 C ATOM 1529 CG LYS A 94 -6.454 6.450 -3.786 1.00 0.00 C ATOM 1530 CD LYS A 94 -7.829 7.063 -4.056 1.00 0.00 C ATOM 1531 CE LYS A 94 -7.798 7.957 -5.297 1.00 0.00 C ATOM 1532 NZ LYS A 94 -9.140 8.520 -5.565 1.00 0.00 N ATOM 0 H LYS A 94 -3.390 8.881 -3.014 1.00 0.00 H new ATOM 0 HA LYS A 94 -4.690 6.663 -1.756 1.00 0.00 H new ATOM 0 HB2 LYS A 94 -5.873 8.378 -3.014 1.00 0.00 H new ATOM 0 HB3 LYS A 94 -5.032 7.916 -4.480 1.00 0.00 H new ATOM 0 HG2 LYS A 94 -6.150 5.842 -4.638 1.00 0.00 H new ATOM 0 HG3 LYS A 94 -6.511 5.786 -2.924 1.00 0.00 H new ATOM 0 HD2 LYS A 94 -8.564 6.270 -4.193 1.00 0.00 H new ATOM 0 HD3 LYS A 94 -8.147 7.646 -3.192 1.00 0.00 H new ATOM 0 HE2 LYS A 94 -7.081 8.765 -5.152 1.00 0.00 H new ATOM 0 HE3 LYS A 94 -7.460 7.381 -6.159 1.00 0.00 H new ATOM 0 HZ1 LYS A 94 -9.411 8.318 -6.548 1.00 0.00 H new ATOM 0 HZ2 LYS A 94 -9.832 8.089 -4.919 1.00 0.00 H new ATOM 0 HZ3 LYS A 94 -9.121 9.549 -5.416 1.00 0.00 H new ATOM 1545 N GLU A 95 -2.669 6.073 -4.263 1.00 0.00 N ATOM 1546 CA GLU A 95 -1.932 5.021 -4.944 1.00 0.00 C ATOM 1547 C GLU A 95 -1.212 4.134 -3.927 1.00 0.00 C ATOM 1548 O GLU A 95 -1.217 2.910 -4.051 1.00 0.00 O ATOM 1549 CB GLU A 95 -0.946 5.608 -5.955 1.00 0.00 C ATOM 1550 CG GLU A 95 -0.870 4.742 -7.214 1.00 0.00 C ATOM 1551 CD GLU A 95 -0.033 5.423 -8.298 1.00 0.00 C ATOM 1552 OE1 GLU A 95 0.347 6.594 -8.145 1.00 0.00 O ATOM 1553 OE2 GLU A 95 0.222 4.692 -9.330 1.00 0.00 O ATOM 0 H GLU A 95 -2.447 7.019 -4.573 1.00 0.00 H new ATOM 0 HA GLU A 95 -2.642 4.405 -5.495 1.00 0.00 H new ATOM 0 HB2 GLU A 95 -1.253 6.619 -6.223 1.00 0.00 H new ATOM 0 HB3 GLU A 95 0.042 5.685 -5.502 1.00 0.00 H new ATOM 0 HG2 GLU A 95 -0.434 3.774 -6.968 1.00 0.00 H new ATOM 0 HG3 GLU A 95 -1.875 4.553 -7.591 1.00 0.00 H new ATOM 1561 N LEU A 96 -0.609 4.785 -2.943 1.00 0.00 N ATOM 1562 CA LEU A 96 0.114 4.071 -1.905 1.00 0.00 C ATOM 1563 C LEU A 96 -0.887 3.408 -0.956 1.00 0.00 C ATOM 1564 O LEU A 96 -0.700 2.260 -0.555 1.00 0.00 O ATOM 1565 CB LEU A 96 1.102 5.003 -1.202 1.00 0.00 C ATOM 1566 CG LEU A 96 2.095 4.333 -0.250 1.00 0.00 C ATOM 1567 CD1 LEU A 96 3.365 5.174 -0.101 1.00 0.00 C ATOM 1568 CD2 LEU A 96 1.443 4.035 1.102 1.00 0.00 C ATOM 0 H LEU A 96 -0.607 5.800 -2.843 1.00 0.00 H new ATOM 0 HA LEU A 96 0.717 3.275 -2.341 1.00 0.00 H new ATOM 0 HB2 LEU A 96 1.666 5.543 -1.963 1.00 0.00 H new ATOM 0 HB3 LEU A 96 0.534 5.745 -0.640 1.00 0.00 H new ATOM 0 HG LEU A 96 2.391 3.377 -0.683 1.00 0.00 H new ATOM 0 HD11 LEU A 96 4.054 4.675 0.581 1.00 0.00 H new ATOM 0 HD12 LEU A 96 3.840 5.291 -1.075 1.00 0.00 H new ATOM 0 HD13 LEU A 96 3.107 6.155 0.297 1.00 0.00 H new ATOM 0 HD21 LEU A 96 2.170 3.559 1.760 1.00 0.00 H new ATOM 0 HD22 LEU A 96 1.100 4.966 1.554 1.00 0.00 H new ATOM 0 HD23 LEU A 96 0.594 3.368 0.957 1.00 0.00 H new ATOM 1580 N LEU A 97 -1.927 4.159 -0.625 1.00 0.00 N ATOM 1581 CA LEU A 97 -2.957 3.658 0.269 1.00 0.00 C ATOM 1582 C LEU A 97 -3.446 2.298 -0.234 1.00 0.00 C ATOM 1583 O LEU A 97 -3.819 1.436 0.561 1.00 0.00 O ATOM 1584 CB LEU A 97 -4.074 4.691 0.431 1.00 0.00 C ATOM 1585 CG LEU A 97 -4.026 5.537 1.705 1.00 0.00 C ATOM 1586 CD1 LEU A 97 -3.373 6.895 1.437 1.00 0.00 C ATOM 1587 CD2 LEU A 97 -5.419 5.683 2.320 1.00 0.00 C ATOM 0 H LEU A 97 -2.079 5.111 -0.960 1.00 0.00 H new ATOM 0 HA LEU A 97 -2.551 3.502 1.268 1.00 0.00 H new ATOM 0 HB2 LEU A 97 -4.049 5.362 -0.428 1.00 0.00 H new ATOM 0 HB3 LEU A 97 -5.031 4.170 0.401 1.00 0.00 H new ATOM 0 HG LEU A 97 -3.405 5.019 2.435 1.00 0.00 H new ATOM 0 HD11 LEU A 97 -3.351 7.477 2.359 1.00 0.00 H new ATOM 0 HD12 LEU A 97 -2.355 6.745 1.079 1.00 0.00 H new ATOM 0 HD13 LEU A 97 -3.947 7.432 0.682 1.00 0.00 H new ATOM 0 HD21 LEU A 97 -5.356 6.289 3.224 1.00 0.00 H new ATOM 0 HD22 LEU A 97 -6.084 6.167 1.605 1.00 0.00 H new ATOM 0 HD23 LEU A 97 -5.811 4.697 2.570 1.00 0.00 H new ATOM 1599 N GLU A 98 -3.427 2.148 -1.550 1.00 0.00 N ATOM 1600 CA GLU A 98 -3.863 0.907 -2.168 1.00 0.00 C ATOM 1601 C GLU A 98 -2.968 -0.251 -1.722 1.00 0.00 C ATOM 1602 O GLU A 98 -3.461 -1.273 -1.247 1.00 0.00 O ATOM 1603 CB GLU A 98 -3.882 1.031 -3.693 1.00 0.00 C ATOM 1604 CG GLU A 98 -5.197 1.643 -4.177 1.00 0.00 C ATOM 1605 CD GLU A 98 -5.306 1.572 -5.702 1.00 0.00 C ATOM 1606 OE1 GLU A 98 -5.309 2.615 -6.373 1.00 0.00 O ATOM 1607 OE2 GLU A 98 -5.390 0.380 -6.188 1.00 0.00 O ATOM 0 H GLU A 98 -3.117 2.865 -2.206 1.00 0.00 H new ATOM 0 HA GLU A 98 -4.882 0.699 -1.841 1.00 0.00 H new ATOM 0 HB2 GLU A 98 -3.046 1.649 -4.022 1.00 0.00 H new ATOM 0 HB3 GLU A 98 -3.747 0.047 -4.143 1.00 0.00 H new ATOM 0 HG2 GLU A 98 -6.036 1.116 -3.724 1.00 0.00 H new ATOM 0 HG3 GLU A 98 -5.260 2.682 -3.852 1.00 0.00 H new ATOM 1615 N VAL A 99 -1.669 -0.053 -1.893 1.00 0.00 N ATOM 1616 CA VAL A 99 -0.701 -1.068 -1.514 1.00 0.00 C ATOM 1617 C VAL A 99 -0.771 -1.295 -0.002 1.00 0.00 C ATOM 1618 O VAL A 99 -0.427 -2.371 0.484 1.00 0.00 O ATOM 1619 CB VAL A 99 0.694 -0.665 -1.994 1.00 0.00 C ATOM 1620 CG1 VAL A 99 0.681 -0.314 -3.483 1.00 0.00 C ATOM 1621 CG2 VAL A 99 1.247 0.493 -1.162 1.00 0.00 C ATOM 0 H VAL A 99 -1.264 0.795 -2.289 1.00 0.00 H new ATOM 0 HA VAL A 99 -0.935 -2.017 -1.996 1.00 0.00 H new ATOM 0 HB VAL A 99 1.355 -1.521 -1.857 1.00 0.00 H new ATOM 0 HG11 VAL A 99 1.685 -0.031 -3.799 1.00 0.00 H new ATOM 0 HG12 VAL A 99 0.350 -1.179 -4.058 1.00 0.00 H new ATOM 0 HG13 VAL A 99 -0.001 0.518 -3.655 1.00 0.00 H new ATOM 0 HG21 VAL A 99 2.240 0.760 -1.524 1.00 0.00 H new ATOM 0 HG22 VAL A 99 0.585 1.354 -1.251 1.00 0.00 H new ATOM 0 HG23 VAL A 99 1.311 0.192 -0.116 1.00 0.00 H new ATOM 1631 N VAL A 100 -1.219 -0.263 0.698 1.00 0.00 N ATOM 1632 CA VAL A 100 -1.338 -0.336 2.145 1.00 0.00 C ATOM 1633 C VAL A 100 -2.495 -1.269 2.510 1.00 0.00 C ATOM 1634 O VAL A 100 -2.305 -2.243 3.237 1.00 0.00 O ATOM 1635 CB VAL A 100 -1.497 1.069 2.728 1.00 0.00 C ATOM 1636 CG1 VAL A 100 -1.924 1.008 4.196 1.00 0.00 C ATOM 1637 CG2 VAL A 100 -0.209 1.879 2.565 1.00 0.00 C ATOM 0 H VAL A 100 -1.504 0.628 0.291 1.00 0.00 H new ATOM 0 HA VAL A 100 -0.432 -0.754 2.583 1.00 0.00 H new ATOM 0 HB VAL A 100 -2.285 1.576 2.171 1.00 0.00 H new ATOM 0 HG11 VAL A 100 -2.030 2.020 4.586 1.00 0.00 H new ATOM 0 HG12 VAL A 100 -2.878 0.486 4.276 1.00 0.00 H new ATOM 0 HG13 VAL A 100 -1.169 0.474 4.773 1.00 0.00 H new ATOM 0 HG21 VAL A 100 -0.349 2.874 2.988 1.00 0.00 H new ATOM 0 HG22 VAL A 100 0.606 1.375 3.085 1.00 0.00 H new ATOM 0 HG23 VAL A 100 0.035 1.966 1.506 1.00 0.00 H new ATOM 1647 N ILE A 101 -3.667 -0.938 1.990 1.00 0.00 N ATOM 1648 CA ILE A 101 -4.854 -1.734 2.253 1.00 0.00 C ATOM 1649 C ILE A 101 -4.797 -3.017 1.421 1.00 0.00 C ATOM 1650 O ILE A 101 -5.537 -3.964 1.682 1.00 0.00 O ATOM 1651 CB ILE A 101 -6.118 -0.904 2.018 1.00 0.00 C ATOM 1652 CG1 ILE A 101 -6.343 -0.658 0.525 1.00 0.00 C ATOM 1653 CG2 ILE A 101 -6.073 0.401 2.814 1.00 0.00 C ATOM 1654 CD1 ILE A 101 -7.671 0.061 0.281 1.00 0.00 C ATOM 0 H ILE A 101 -3.821 -0.129 1.388 1.00 0.00 H new ATOM 0 HA ILE A 101 -4.888 -2.034 3.300 1.00 0.00 H new ATOM 0 HB ILE A 101 -6.973 -1.473 2.382 1.00 0.00 H new ATOM 0 HG12 ILE A 101 -5.524 -0.062 0.124 1.00 0.00 H new ATOM 0 HG13 ILE A 101 -6.337 -1.608 -0.009 1.00 0.00 H new ATOM 0 HG21 ILE A 101 -6.983 0.972 2.629 1.00 0.00 H new ATOM 0 HG22 ILE A 101 -5.996 0.176 3.878 1.00 0.00 H new ATOM 0 HG23 ILE A 101 -5.208 0.987 2.504 1.00 0.00 H new ATOM 0 HD11 ILE A 101 -7.806 0.223 -0.788 1.00 0.00 H new ATOM 0 HD12 ILE A 101 -8.490 -0.549 0.661 1.00 0.00 H new ATOM 0 HD13 ILE A 101 -7.665 1.022 0.796 1.00 0.00 H new ATOM 1666 N HIS A 102 -3.911 -3.006 0.435 1.00 0.00 N ATOM 1667 CA HIS A 102 -3.748 -4.157 -0.436 1.00 0.00 C ATOM 1668 C HIS A 102 -3.558 -5.418 0.409 1.00 0.00 C ATOM 1669 O HIS A 102 -3.988 -6.502 0.017 1.00 0.00 O ATOM 1670 CB HIS A 102 -2.604 -3.930 -1.427 1.00 0.00 C ATOM 1671 CG HIS A 102 -2.191 -5.170 -2.183 1.00 0.00 C ATOM 1672 ND1 HIS A 102 -2.989 -5.760 -3.148 1.00 0.00 N ATOM 1673 CD2 HIS A 102 -1.058 -5.925 -2.107 1.00 0.00 C ATOM 1674 CE1 HIS A 102 -2.354 -6.821 -3.624 1.00 0.00 C ATOM 1675 NE2 HIS A 102 -1.158 -6.922 -2.976 1.00 0.00 N ATOM 0 H HIS A 102 -3.299 -2.218 0.221 1.00 0.00 H new ATOM 0 HA HIS A 102 -4.649 -4.295 -1.034 1.00 0.00 H new ATOM 0 HB2 HIS A 102 -2.903 -3.164 -2.142 1.00 0.00 H new ATOM 0 HB3 HIS A 102 -1.741 -3.542 -0.887 1.00 0.00 H new ATOM 0 HD1 HIS A 102 -3.909 -5.433 -3.443 1.00 0.00 H new ATOM 0 HD2 HIS A 102 -0.221 -5.742 -1.450 1.00 0.00 H new ATOM 0 HE1 HIS A 102 -2.719 -7.489 -4.390 1.00 0.00 H new ATOM 1683 N GLY A 103 -2.915 -5.235 1.552 1.00 0.00 N ATOM 1684 CA GLY A 103 -2.663 -6.344 2.456 1.00 0.00 C ATOM 1685 C GLY A 103 -3.909 -6.673 3.281 1.00 0.00 C ATOM 1686 O GLY A 103 -4.350 -7.820 3.315 1.00 0.00 O ATOM 0 H GLY A 103 -2.560 -4.334 1.873 1.00 0.00 H new ATOM 0 HA2 GLY A 103 -2.358 -7.221 1.885 1.00 0.00 H new ATOM 0 HA3 GLY A 103 -1.837 -6.095 3.122 1.00 0.00 H new ATOM 1690 N ILE A 104 -4.442 -5.645 3.925 1.00 0.00 N ATOM 1691 CA ILE A 104 -5.628 -5.810 4.747 1.00 0.00 C ATOM 1692 C ILE A 104 -6.791 -6.277 3.869 1.00 0.00 C ATOM 1693 O ILE A 104 -7.438 -7.278 4.171 1.00 0.00 O ATOM 1694 CB ILE A 104 -5.923 -4.526 5.526 1.00 0.00 C ATOM 1695 CG1 ILE A 104 -4.777 -4.189 6.482 1.00 0.00 C ATOM 1696 CG2 ILE A 104 -7.266 -4.622 6.252 1.00 0.00 C ATOM 1697 CD1 ILE A 104 -4.842 -2.726 6.922 1.00 0.00 C ATOM 0 H ILE A 104 -4.074 -4.694 3.894 1.00 0.00 H new ATOM 0 HA ILE A 104 -5.466 -6.582 5.499 1.00 0.00 H new ATOM 0 HB ILE A 104 -6.000 -3.704 4.814 1.00 0.00 H new ATOM 0 HG12 ILE A 104 -4.826 -4.838 7.356 1.00 0.00 H new ATOM 0 HG13 ILE A 104 -3.822 -4.383 5.993 1.00 0.00 H new ATOM 0 HG21 ILE A 104 -7.452 -3.697 6.798 1.00 0.00 H new ATOM 0 HG22 ILE A 104 -8.062 -4.780 5.525 1.00 0.00 H new ATOM 0 HG23 ILE A 104 -7.242 -5.457 6.952 1.00 0.00 H new ATOM 0 HD11 ILE A 104 -4.016 -2.513 7.601 1.00 0.00 H new ATOM 0 HD12 ILE A 104 -4.769 -2.079 6.048 1.00 0.00 H new ATOM 0 HD13 ILE A 104 -5.788 -2.541 7.432 1.00 0.00 H new ATOM 1709 N LEU A 105 -7.021 -5.529 2.800 1.00 0.00 N ATOM 1710 CA LEU A 105 -8.094 -5.855 1.876 1.00 0.00 C ATOM 1711 C LEU A 105 -8.002 -7.333 1.494 1.00 0.00 C ATOM 1712 O LEU A 105 -9.022 -7.998 1.321 1.00 0.00 O ATOM 1713 CB LEU A 105 -8.073 -4.907 0.675 1.00 0.00 C ATOM 1714 CG LEU A 105 -7.283 -5.387 -0.544 1.00 0.00 C ATOM 1715 CD1 LEU A 105 -7.964 -6.588 -1.201 1.00 0.00 C ATOM 1716 CD2 LEU A 105 -7.056 -4.243 -1.535 1.00 0.00 C ATOM 0 H LEU A 105 -6.483 -4.698 2.553 1.00 0.00 H new ATOM 0 HA LEU A 105 -9.064 -5.709 2.352 1.00 0.00 H new ATOM 0 HB2 LEU A 105 -9.102 -4.721 0.366 1.00 0.00 H new ATOM 0 HB3 LEU A 105 -7.659 -3.952 0.998 1.00 0.00 H new ATOM 0 HG LEU A 105 -6.302 -5.720 -0.206 1.00 0.00 H new ATOM 0 HD11 LEU A 105 -7.382 -6.909 -2.065 1.00 0.00 H new ATOM 0 HD12 LEU A 105 -8.030 -7.406 -0.484 1.00 0.00 H new ATOM 0 HD13 LEU A 105 -8.966 -6.306 -1.524 1.00 0.00 H new ATOM 0 HD21 LEU A 105 -6.492 -4.611 -2.392 1.00 0.00 H new ATOM 0 HD22 LEU A 105 -8.018 -3.857 -1.872 1.00 0.00 H new ATOM 0 HD23 LEU A 105 -6.496 -3.445 -1.048 1.00 0.00 H new ATOM 1728 N HIS A 106 -6.770 -7.805 1.374 1.00 0.00 N ATOM 1729 CA HIS A 106 -6.531 -9.193 1.016 1.00 0.00 C ATOM 1730 C HIS A 106 -7.156 -10.109 2.070 1.00 0.00 C ATOM 1731 O HIS A 106 -7.848 -11.068 1.732 1.00 0.00 O ATOM 1732 CB HIS A 106 -5.037 -9.453 0.814 1.00 0.00 C ATOM 1733 CG HIS A 106 -4.644 -9.696 -0.623 1.00 0.00 C ATOM 1734 ND1 HIS A 106 -5.352 -10.225 -1.663 1.00 0.00 N flip ATOM 1735 CD2 HIS A 106 -3.391 -9.385 -1.122 1.00 0.00 C flip ATOM 1736 CE1 HIS A 106 -4.573 -10.234 -2.738 1.00 0.00 C flip ATOM 1737 NE2 HIS A 106 -3.357 -9.714 -2.404 1.00 0.00 N flip ATOM 0 H HIS A 106 -5.926 -7.251 1.518 1.00 0.00 H new ATOM 0 HA HIS A 106 -7.010 -9.414 0.062 1.00 0.00 H new ATOM 0 HB2 HIS A 106 -4.476 -8.599 1.194 1.00 0.00 H new ATOM 0 HB3 HIS A 106 -4.745 -10.317 1.411 1.00 0.00 H new ATOM 0 HD1 HIS A 106 -6.316 -10.557 -1.621 1.00 0.00 H new ATOM 0 HD2 HIS A 106 -2.578 -8.948 -0.561 1.00 0.00 H new ATOM 0 HE1 HIS A 106 -4.856 -10.594 -3.716 1.00 0.00 H new ATOM 1745 N LEU A 107 -6.888 -9.782 3.325 1.00 0.00 N ATOM 1746 CA LEU A 107 -7.415 -10.564 4.431 1.00 0.00 C ATOM 1747 C LEU A 107 -8.875 -10.175 4.675 1.00 0.00 C ATOM 1748 O LEU A 107 -9.612 -10.903 5.337 1.00 0.00 O ATOM 1749 CB LEU A 107 -6.524 -10.414 5.666 1.00 0.00 C ATOM 1750 CG LEU A 107 -6.945 -11.217 6.898 1.00 0.00 C ATOM 1751 CD1 LEU A 107 -5.803 -12.110 7.387 1.00 0.00 C ATOM 1752 CD2 LEU A 107 -7.465 -10.295 8.002 1.00 0.00 C ATOM 0 H LEU A 107 -6.313 -8.986 3.601 1.00 0.00 H new ATOM 0 HA LEU A 107 -7.404 -11.626 4.186 1.00 0.00 H new ATOM 0 HB2 LEU A 107 -5.510 -10.707 5.395 1.00 0.00 H new ATOM 0 HB3 LEU A 107 -6.489 -9.359 5.939 1.00 0.00 H new ATOM 0 HG LEU A 107 -7.767 -11.873 6.613 1.00 0.00 H new ATOM 0 HD11 LEU A 107 -6.129 -12.670 8.264 1.00 0.00 H new ATOM 0 HD12 LEU A 107 -5.521 -12.805 6.597 1.00 0.00 H new ATOM 0 HD13 LEU A 107 -4.945 -11.492 7.650 1.00 0.00 H new ATOM 0 HD21 LEU A 107 -7.758 -10.891 8.866 1.00 0.00 H new ATOM 0 HD22 LEU A 107 -6.680 -9.596 8.292 1.00 0.00 H new ATOM 0 HD23 LEU A 107 -8.328 -9.740 7.636 1.00 0.00 H new ATOM 1764 N ALA A 108 -9.248 -9.028 4.126 1.00 0.00 N ATOM 1765 CA ALA A 108 -10.606 -8.534 4.276 1.00 0.00 C ATOM 1766 C ALA A 108 -11.567 -9.462 3.531 1.00 0.00 C ATOM 1767 O ALA A 108 -12.741 -9.558 3.884 1.00 0.00 O ATOM 1768 CB ALA A 108 -10.682 -7.090 3.775 1.00 0.00 C ATOM 0 H ALA A 108 -8.633 -8.427 3.577 1.00 0.00 H new ATOM 0 HA ALA A 108 -10.900 -8.530 5.326 1.00 0.00 H new ATOM 0 HB1 ALA A 108 -11.701 -6.719 3.887 1.00 0.00 H new ATOM 0 HB2 ALA A 108 -10.003 -6.467 4.357 1.00 0.00 H new ATOM 0 HB3 ALA A 108 -10.397 -7.054 2.724 1.00 0.00 H new ATOM 1774 N GLY A 109 -11.032 -10.121 2.513 1.00 0.00 N ATOM 1775 CA GLY A 109 -11.828 -11.037 1.715 1.00 0.00 C ATOM 1776 C GLY A 109 -11.826 -10.625 0.241 1.00 0.00 C ATOM 1777 O GLY A 109 -11.647 -9.450 -0.078 1.00 0.00 O ATOM 0 H GLY A 109 -10.058 -10.038 2.223 1.00 0.00 H new ATOM 0 HA2 GLY A 109 -11.433 -12.048 1.814 1.00 0.00 H new ATOM 0 HA3 GLY A 109 -12.851 -11.056 2.090 1.00 0.00 H new ATOM 1781 N TYR A 110 -12.027 -11.614 -0.617 1.00 0.00 N ATOM 1782 CA TYR A 110 -12.051 -11.368 -2.049 1.00 0.00 C ATOM 1783 C TYR A 110 -12.614 -12.575 -2.803 1.00 0.00 C ATOM 1784 O TYR A 110 -13.080 -13.533 -2.189 1.00 0.00 O ATOM 1785 CB TYR A 110 -10.594 -11.157 -2.465 1.00 0.00 C ATOM 1786 CG TYR A 110 -9.601 -12.069 -1.741 1.00 0.00 C ATOM 1787 CD1 TYR A 110 -9.808 -13.433 -1.718 1.00 0.00 C ATOM 1788 CD2 TYR A 110 -8.500 -11.527 -1.111 1.00 0.00 C ATOM 1789 CE1 TYR A 110 -8.874 -14.292 -1.037 1.00 0.00 C ATOM 1790 CE2 TYR A 110 -7.566 -12.386 -0.429 1.00 0.00 C ATOM 1791 CZ TYR A 110 -7.799 -13.726 -0.426 1.00 0.00 C ATOM 1792 OH TYR A 110 -6.917 -14.536 0.218 1.00 0.00 O ATOM 0 H TYR A 110 -12.175 -12.587 -0.348 1.00 0.00 H new ATOM 0 HA TYR A 110 -12.681 -10.509 -2.280 1.00 0.00 H new ATOM 0 HB2 TYR A 110 -10.506 -11.322 -3.539 1.00 0.00 H new ATOM 0 HB3 TYR A 110 -10.320 -10.119 -2.278 1.00 0.00 H new ATOM 0 HD1 TYR A 110 -10.671 -13.857 -2.211 1.00 0.00 H new ATOM 0 HD2 TYR A 110 -8.338 -10.459 -1.129 1.00 0.00 H new ATOM 0 HE1 TYR A 110 -9.024 -15.361 -1.012 1.00 0.00 H new ATOM 0 HE2 TYR A 110 -6.700 -11.975 0.069 1.00 0.00 H new ATOM 0 HH TYR A 110 -6.182 -13.998 0.579 1.00 0.00 H new ATOM 1802 N ASP A 111 -12.552 -12.488 -4.124 1.00 0.00 N ATOM 1803 CA ASP A 111 -13.050 -13.561 -4.968 1.00 0.00 C ATOM 1804 C ASP A 111 -12.008 -14.680 -5.031 1.00 0.00 C ATOM 1805 O ASP A 111 -11.487 -14.988 -6.102 1.00 0.00 O ATOM 1806 CB ASP A 111 -13.301 -13.068 -6.394 1.00 0.00 C ATOM 1807 CG ASP A 111 -14.693 -12.482 -6.640 1.00 0.00 C ATOM 1808 OD1 ASP A 111 -15.706 -13.022 -6.170 1.00 0.00 O ATOM 1809 OD2 ASP A 111 -14.715 -11.410 -7.358 1.00 0.00 O ATOM 0 H ASP A 111 -12.165 -11.692 -4.630 1.00 0.00 H new ATOM 0 HA ASP A 111 -13.986 -13.920 -4.540 1.00 0.00 H new ATOM 0 HB2 ASP A 111 -12.556 -12.310 -6.637 1.00 0.00 H new ATOM 0 HB3 ASP A 111 -13.146 -13.899 -7.082 1.00 0.00 H new ATOM 1815 N HIS A 112 -11.736 -15.257 -3.871 1.00 0.00 N ATOM 1816 CA HIS A 112 -10.766 -16.336 -3.780 1.00 0.00 C ATOM 1817 C HIS A 112 -9.580 -16.037 -4.700 1.00 0.00 C ATOM 1818 O HIS A 112 -9.471 -16.611 -5.783 1.00 0.00 O ATOM 1819 CB HIS A 112 -11.423 -17.684 -4.079 1.00 0.00 C ATOM 1820 CG HIS A 112 -11.405 -18.647 -2.916 1.00 0.00 C ATOM 1821 ND1 HIS A 112 -10.940 -19.946 -3.026 1.00 0.00 N ATOM 1822 CD2 HIS A 112 -11.797 -18.487 -1.620 1.00 0.00 C ATOM 1823 CE1 HIS A 112 -11.053 -20.532 -1.843 1.00 0.00 C ATOM 1824 NE2 HIS A 112 -11.585 -19.627 -0.973 1.00 0.00 N ATOM 0 H HIS A 112 -12.170 -14.998 -2.985 1.00 0.00 H new ATOM 0 HA HIS A 112 -10.384 -16.402 -2.761 1.00 0.00 H new ATOM 0 HB2 HIS A 112 -12.457 -17.514 -4.381 1.00 0.00 H new ATOM 0 HB3 HIS A 112 -10.915 -18.144 -4.927 1.00 0.00 H new ATOM 0 HD2 HIS A 112 -12.210 -17.586 -1.192 1.00 0.00 H new ATOM 0 HE1 HIS A 112 -10.773 -21.548 -1.609 1.00 0.00 H new ATOM 0 HE2 HIS A 112 -11.787 -19.798 0.012 1.00 0.00 H new ATOM 1832 N GLU A 113 -8.723 -15.140 -4.236 1.00 0.00 N ATOM 1833 CA GLU A 113 -7.549 -14.759 -5.003 1.00 0.00 C ATOM 1834 C GLU A 113 -7.966 -14.182 -6.358 1.00 0.00 C ATOM 1835 O GLU A 113 -8.588 -14.870 -7.165 1.00 0.00 O ATOM 1836 CB GLU A 113 -6.601 -15.946 -5.181 1.00 0.00 C ATOM 1837 CG GLU A 113 -6.210 -16.544 -3.828 1.00 0.00 C ATOM 1838 CD GLU A 113 -6.885 -17.900 -3.612 1.00 0.00 C ATOM 1839 OE1 GLU A 113 -8.023 -18.105 -4.059 1.00 0.00 O ATOM 1840 OE2 GLU A 113 -6.183 -18.759 -2.954 1.00 0.00 O ATOM 0 H GLU A 113 -8.818 -14.666 -3.338 1.00 0.00 H new ATOM 0 HA GLU A 113 -7.012 -13.988 -4.451 1.00 0.00 H new ATOM 0 HB2 GLU A 113 -7.079 -16.709 -5.795 1.00 0.00 H new ATOM 0 HB3 GLU A 113 -5.706 -15.624 -5.713 1.00 0.00 H new ATOM 0 HG2 GLU A 113 -5.127 -16.660 -3.777 1.00 0.00 H new ATOM 0 HG3 GLU A 113 -6.495 -15.860 -3.028 1.00 0.00 H new ATOM 1848 N PHE A 114 -7.605 -12.924 -6.565 1.00 0.00 N ATOM 1849 CA PHE A 114 -7.933 -12.246 -7.808 1.00 0.00 C ATOM 1850 C PHE A 114 -6.673 -11.706 -8.487 1.00 0.00 C ATOM 1851 O PHE A 114 -6.550 -11.762 -9.709 1.00 0.00 O ATOM 1852 CB PHE A 114 -8.848 -11.074 -7.449 1.00 0.00 C ATOM 1853 CG PHE A 114 -8.239 -10.093 -6.445 1.00 0.00 C ATOM 1854 CD1 PHE A 114 -8.142 -10.438 -5.132 1.00 0.00 C ATOM 1855 CD2 PHE A 114 -7.795 -8.878 -6.863 1.00 0.00 C ATOM 1856 CE1 PHE A 114 -7.577 -9.528 -4.200 1.00 0.00 C ATOM 1857 CE2 PHE A 114 -7.230 -7.969 -5.931 1.00 0.00 C ATOM 1858 CZ PHE A 114 -7.133 -8.313 -4.619 1.00 0.00 C ATOM 0 H PHE A 114 -7.089 -12.356 -5.893 1.00 0.00 H new ATOM 0 HA PHE A 114 -8.414 -12.941 -8.496 1.00 0.00 H new ATOM 0 HB2 PHE A 114 -9.103 -10.533 -8.360 1.00 0.00 H new ATOM 0 HB3 PHE A 114 -9.779 -11.466 -7.039 1.00 0.00 H new ATOM 0 HD1 PHE A 114 -8.494 -11.403 -4.799 1.00 0.00 H new ATOM 0 HD2 PHE A 114 -7.872 -8.604 -7.905 1.00 0.00 H new ATOM 0 HE1 PHE A 114 -7.500 -9.801 -3.158 1.00 0.00 H new ATOM 0 HE2 PHE A 114 -6.877 -7.004 -6.264 1.00 0.00 H new ATOM 0 HZ PHE A 114 -6.703 -7.621 -3.910 1.00 0.00 H new ATOM 1868 N GLU A 115 -5.769 -11.195 -7.664 1.00 0.00 N ATOM 1869 CA GLU A 115 -4.523 -10.645 -8.170 1.00 0.00 C ATOM 1870 C GLU A 115 -4.790 -9.359 -8.955 1.00 0.00 C ATOM 1871 O GLU A 115 -4.604 -9.319 -10.170 1.00 0.00 O ATOM 1872 CB GLU A 115 -3.781 -11.669 -9.031 1.00 0.00 C ATOM 1873 CG GLU A 115 -2.524 -12.175 -8.321 1.00 0.00 C ATOM 1874 CD GLU A 115 -2.218 -13.622 -8.713 1.00 0.00 C ATOM 1875 OE1 GLU A 115 -3.118 -14.476 -8.683 1.00 0.00 O ATOM 1876 OE2 GLU A 115 -0.996 -13.847 -9.058 1.00 0.00 O ATOM 0 H GLU A 115 -5.875 -11.150 -6.650 1.00 0.00 H new ATOM 0 HA GLU A 115 -3.884 -10.403 -7.321 1.00 0.00 H new ATOM 0 HB2 GLU A 115 -4.440 -12.508 -9.253 1.00 0.00 H new ATOM 0 HB3 GLU A 115 -3.507 -11.217 -9.985 1.00 0.00 H new ATOM 0 HG2 GLU A 115 -1.677 -11.538 -8.576 1.00 0.00 H new ATOM 0 HG3 GLU A 115 -2.660 -12.108 -7.242 1.00 0.00 H new ATOM 1884 N ASP A 116 -5.223 -8.339 -8.228 1.00 0.00 N ATOM 1885 CA ASP A 116 -5.518 -7.055 -8.842 1.00 0.00 C ATOM 1886 C ASP A 116 -6.614 -7.237 -9.893 1.00 0.00 C ATOM 1887 O ASP A 116 -7.796 -7.071 -9.598 1.00 0.00 O ATOM 1888 CB ASP A 116 -4.283 -6.482 -9.540 1.00 0.00 C ATOM 1889 CG ASP A 116 -3.294 -5.764 -8.619 1.00 0.00 C ATOM 1890 OD1 ASP A 116 -3.426 -5.802 -7.386 1.00 0.00 O ATOM 1891 OD2 ASP A 116 -2.343 -5.137 -9.224 1.00 0.00 O ATOM 0 H ASP A 116 -5.377 -8.376 -7.220 1.00 0.00 H new ATOM 0 HA ASP A 116 -5.838 -6.371 -8.056 1.00 0.00 H new ATOM 0 HB2 ASP A 116 -3.761 -7.294 -10.046 1.00 0.00 H new ATOM 0 HB3 ASP A 116 -4.611 -5.784 -10.311 1.00 0.00 H new ATOM 1897 N LYS A 117 -6.182 -7.575 -11.100 1.00 0.00 N ATOM 1898 CA LYS A 117 -7.112 -7.781 -12.197 1.00 0.00 C ATOM 1899 C LYS A 117 -8.130 -6.639 -12.218 1.00 0.00 C ATOM 1900 O LYS A 117 -7.975 -5.651 -11.502 1.00 0.00 O ATOM 1901 CB LYS A 117 -7.747 -9.170 -12.107 1.00 0.00 C ATOM 1902 CG LYS A 117 -7.757 -9.858 -13.474 1.00 0.00 C ATOM 1903 CD LYS A 117 -8.081 -11.347 -13.336 1.00 0.00 C ATOM 1904 CE LYS A 117 -6.817 -12.159 -13.047 1.00 0.00 C ATOM 1905 NZ LYS A 117 -7.099 -13.221 -12.056 1.00 0.00 N ATOM 0 H LYS A 117 -5.200 -7.711 -11.342 1.00 0.00 H new ATOM 0 HA LYS A 117 -6.587 -7.757 -13.152 1.00 0.00 H new ATOM 0 HB2 LYS A 117 -7.195 -9.781 -11.393 1.00 0.00 H new ATOM 0 HB3 LYS A 117 -8.767 -9.084 -11.732 1.00 0.00 H new ATOM 0 HG2 LYS A 117 -8.493 -9.380 -14.120 1.00 0.00 H new ATOM 0 HG3 LYS A 117 -6.786 -9.736 -13.953 1.00 0.00 H new ATOM 0 HD2 LYS A 117 -8.803 -11.493 -12.532 1.00 0.00 H new ATOM 0 HD3 LYS A 117 -8.548 -11.708 -14.253 1.00 0.00 H new ATOM 0 HE2 LYS A 117 -6.445 -12.604 -13.970 1.00 0.00 H new ATOM 0 HE3 LYS A 117 -6.033 -11.501 -12.671 1.00 0.00 H new ATOM 0 HZ1 LYS A 117 -6.459 -14.025 -12.217 1.00 0.00 H new ATOM 0 HZ2 LYS A 117 -6.951 -12.848 -11.096 1.00 0.00 H new ATOM 0 HZ3 LYS A 117 -8.085 -13.537 -12.157 1.00 0.00 H new ATOM 1918 N ASN A 118 -9.150 -6.813 -13.046 1.00 0.00 N ATOM 1919 CA ASN A 118 -10.193 -5.810 -13.170 1.00 0.00 C ATOM 1920 C ASN A 118 -10.990 -5.746 -11.866 1.00 0.00 C ATOM 1921 O ASN A 118 -10.917 -4.757 -11.137 1.00 0.00 O ATOM 1922 CB ASN A 118 -11.163 -6.160 -14.300 1.00 0.00 C ATOM 1923 CG ASN A 118 -11.520 -4.919 -15.121 1.00 0.00 C ATOM 1924 OD1 ASN A 118 -11.157 -4.782 -16.277 1.00 0.00 O ATOM 1925 ND2 ASN A 118 -12.250 -4.025 -14.460 1.00 0.00 N ATOM 0 H ASN A 118 -9.276 -7.634 -13.638 1.00 0.00 H new ATOM 0 HA ASN A 118 -9.717 -4.854 -13.387 1.00 0.00 H new ATOM 0 HB2 ASN A 118 -10.715 -6.913 -14.949 1.00 0.00 H new ATOM 0 HB3 ASN A 118 -12.070 -6.598 -13.883 1.00 0.00 H new ATOM 0 HD21 ASN A 118 -12.540 -3.162 -14.921 1.00 0.00 H new ATOM 0 HD22 ASN A 118 -12.520 -4.202 -13.493 1.00 0.00 H new ATOM 1932 N SER A 119 -11.733 -6.813 -11.610 1.00 0.00 N ATOM 1933 CA SER A 119 -12.543 -6.891 -10.407 1.00 0.00 C ATOM 1934 C SER A 119 -13.128 -5.515 -10.080 1.00 0.00 C ATOM 1935 O SER A 119 -12.567 -4.774 -9.273 1.00 0.00 O ATOM 1936 CB SER A 119 -11.724 -7.414 -9.225 1.00 0.00 C ATOM 1937 OG SER A 119 -11.038 -6.366 -8.545 1.00 0.00 O ATOM 0 H SER A 119 -11.791 -7.631 -12.216 1.00 0.00 H new ATOM 0 HA SER A 119 -13.358 -7.592 -10.588 1.00 0.00 H new ATOM 0 HB2 SER A 119 -12.384 -7.928 -8.526 1.00 0.00 H new ATOM 0 HB3 SER A 119 -11.002 -8.149 -9.581 1.00 0.00 H new ATOM 0 HG SER A 119 -11.677 -5.666 -8.293 1.00 0.00 H new ATOM 1943 N LYS A 120 -14.247 -5.215 -10.723 1.00 0.00 N ATOM 1944 CA LYS A 120 -14.913 -3.941 -10.510 1.00 0.00 C ATOM 1945 C LYS A 120 -15.549 -3.929 -9.119 1.00 0.00 C ATOM 1946 O LYS A 120 -15.296 -3.025 -8.324 1.00 0.00 O ATOM 1947 CB LYS A 120 -15.903 -3.659 -11.642 1.00 0.00 C ATOM 1948 CG LYS A 120 -15.191 -3.064 -12.858 1.00 0.00 C ATOM 1949 CD LYS A 120 -16.200 -2.581 -13.902 1.00 0.00 C ATOM 1950 CE LYS A 120 -15.639 -1.407 -14.705 1.00 0.00 C ATOM 1951 NZ LYS A 120 -15.162 -1.865 -16.029 1.00 0.00 N ATOM 0 H LYS A 120 -14.709 -5.832 -11.391 1.00 0.00 H new ATOM 0 HA LYS A 120 -14.192 -3.124 -10.537 1.00 0.00 H new ATOM 0 HB2 LYS A 120 -16.407 -4.582 -11.927 1.00 0.00 H new ATOM 0 HB3 LYS A 120 -16.672 -2.970 -11.294 1.00 0.00 H new ATOM 0 HG2 LYS A 120 -14.561 -2.232 -12.544 1.00 0.00 H new ATOM 0 HG3 LYS A 120 -14.534 -3.812 -13.301 1.00 0.00 H new ATOM 0 HD2 LYS A 120 -16.451 -3.400 -14.576 1.00 0.00 H new ATOM 0 HD3 LYS A 120 -17.124 -2.280 -13.408 1.00 0.00 H new ATOM 0 HE2 LYS A 120 -16.408 -0.645 -14.833 1.00 0.00 H new ATOM 0 HE3 LYS A 120 -14.819 -0.943 -14.157 1.00 0.00 H new ATOM 0 HZ1 LYS A 120 -14.784 -1.055 -16.561 1.00 0.00 H new ATOM 0 HZ2 LYS A 120 -14.413 -2.575 -15.902 1.00 0.00 H new ATOM 0 HZ3 LYS A 120 -15.953 -2.287 -16.556 1.00 0.00 H new ATOM 1964 N GLU A 121 -16.364 -4.944 -8.867 1.00 0.00 N ATOM 1965 CA GLU A 121 -17.038 -5.061 -7.585 1.00 0.00 C ATOM 1966 C GLU A 121 -16.016 -5.071 -6.447 1.00 0.00 C ATOM 1967 O GLU A 121 -16.183 -4.367 -5.452 1.00 0.00 O ATOM 1968 CB GLU A 121 -17.919 -6.311 -7.542 1.00 0.00 C ATOM 1969 CG GLU A 121 -19.189 -6.116 -8.373 1.00 0.00 C ATOM 1970 CD GLU A 121 -19.261 -7.135 -9.512 1.00 0.00 C ATOM 1971 OE1 GLU A 121 -18.298 -7.275 -10.280 1.00 0.00 O ATOM 1972 OE2 GLU A 121 -20.367 -7.797 -9.582 1.00 0.00 O ATOM 0 H GLU A 121 -16.572 -5.692 -9.529 1.00 0.00 H new ATOM 0 HA GLU A 121 -17.687 -4.194 -7.457 1.00 0.00 H new ATOM 0 HB2 GLU A 121 -17.360 -7.167 -7.920 1.00 0.00 H new ATOM 0 HB3 GLU A 121 -18.187 -6.536 -6.510 1.00 0.00 H new ATOM 0 HG2 GLU A 121 -20.066 -6.218 -7.733 1.00 0.00 H new ATOM 0 HG3 GLU A 121 -19.209 -5.106 -8.782 1.00 0.00 H new ATOM 1980 N MET A 122 -14.981 -5.877 -6.630 1.00 0.00 N ATOM 1981 CA MET A 122 -13.932 -5.987 -5.631 1.00 0.00 C ATOM 1982 C MET A 122 -13.214 -4.650 -5.439 1.00 0.00 C ATOM 1983 O MET A 122 -12.712 -4.361 -4.354 1.00 0.00 O ATOM 1984 CB MET A 122 -12.922 -7.051 -6.066 1.00 0.00 C ATOM 1985 CG MET A 122 -12.529 -7.947 -4.889 1.00 0.00 C ATOM 1986 SD MET A 122 -10.801 -8.381 -5.004 1.00 0.00 S ATOM 1987 CE MET A 122 -10.145 -7.397 -3.667 1.00 0.00 C ATOM 0 H MET A 122 -14.846 -6.460 -7.456 1.00 0.00 H new ATOM 0 HA MET A 122 -14.388 -6.272 -4.683 1.00 0.00 H new ATOM 0 HB2 MET A 122 -13.349 -7.659 -6.864 1.00 0.00 H new ATOM 0 HB3 MET A 122 -12.033 -6.569 -6.474 1.00 0.00 H new ATOM 0 HG2 MET A 122 -12.721 -7.431 -3.948 1.00 0.00 H new ATOM 0 HG3 MET A 122 -13.140 -8.850 -4.888 1.00 0.00 H new ATOM 0 HE1 MET A 122 -9.433 -6.673 -4.063 1.00 0.00 H new ATOM 0 HE2 MET A 122 -10.959 -6.871 -3.169 1.00 0.00 H new ATOM 0 HE3 MET A 122 -9.641 -8.046 -2.951 1.00 0.00 H new ATOM 1997 N PHE A 123 -13.190 -3.869 -6.509 1.00 0.00 N ATOM 1998 CA PHE A 123 -12.542 -2.569 -6.472 1.00 0.00 C ATOM 1999 C PHE A 123 -13.165 -1.676 -5.397 1.00 0.00 C ATOM 2000 O PHE A 123 -12.472 -0.875 -4.772 1.00 0.00 O ATOM 2001 CB PHE A 123 -12.757 -1.923 -7.842 1.00 0.00 C ATOM 2002 CG PHE A 123 -11.690 -0.893 -8.218 1.00 0.00 C ATOM 2003 CD1 PHE A 123 -11.572 0.256 -7.501 1.00 0.00 C ATOM 2004 CD2 PHE A 123 -10.861 -1.126 -9.271 1.00 0.00 C ATOM 2005 CE1 PHE A 123 -10.582 1.213 -7.850 1.00 0.00 C ATOM 2006 CE2 PHE A 123 -9.871 -0.170 -9.620 1.00 0.00 C ATOM 2007 CZ PHE A 123 -9.752 0.979 -8.902 1.00 0.00 C ATOM 0 H PHE A 123 -13.609 -4.111 -7.407 1.00 0.00 H new ATOM 0 HA PHE A 123 -11.484 -2.687 -6.239 1.00 0.00 H new ATOM 0 HB2 PHE A 123 -12.777 -2.704 -8.602 1.00 0.00 H new ATOM 0 HB3 PHE A 123 -13.734 -1.440 -7.855 1.00 0.00 H new ATOM 0 HD1 PHE A 123 -12.231 0.441 -6.666 1.00 0.00 H new ATOM 0 HD2 PHE A 123 -10.956 -2.038 -9.842 1.00 0.00 H new ATOM 0 HE1 PHE A 123 -10.488 2.126 -7.280 1.00 0.00 H new ATOM 0 HE2 PHE A 123 -9.212 -0.355 -10.456 1.00 0.00 H new ATOM 0 HZ PHE A 123 -8.998 1.706 -9.167 1.00 0.00 H new ATOM 2017 N GLU A 124 -14.466 -1.845 -5.213 1.00 0.00 N ATOM 2018 CA GLU A 124 -15.190 -1.065 -4.225 1.00 0.00 C ATOM 2019 C GLU A 124 -14.626 -1.325 -2.826 1.00 0.00 C ATOM 2020 O GLU A 124 -14.391 -0.388 -2.064 1.00 0.00 O ATOM 2021 CB GLU A 124 -16.689 -1.369 -4.276 1.00 0.00 C ATOM 2022 CG GLU A 124 -17.249 -1.130 -5.680 1.00 0.00 C ATOM 2023 CD GLU A 124 -18.279 0.001 -5.674 1.00 0.00 C ATOM 2024 OE1 GLU A 124 -19.488 -0.262 -5.588 1.00 0.00 O ATOM 2025 OE2 GLU A 124 -17.785 1.189 -5.761 1.00 0.00 O ATOM 0 H GLU A 124 -15.038 -2.511 -5.732 1.00 0.00 H new ATOM 0 HA GLU A 124 -15.059 -0.008 -4.459 1.00 0.00 H new ATOM 0 HB2 GLU A 124 -16.864 -2.404 -3.982 1.00 0.00 H new ATOM 0 HB3 GLU A 124 -17.216 -0.740 -3.558 1.00 0.00 H new ATOM 0 HG2 GLU A 124 -16.436 -0.883 -6.362 1.00 0.00 H new ATOM 0 HG3 GLU A 124 -17.710 -2.045 -6.052 1.00 0.00 H new ATOM 2033 N LYS A 125 -14.424 -2.601 -2.532 1.00 0.00 N ATOM 2034 CA LYS A 125 -13.892 -2.996 -1.239 1.00 0.00 C ATOM 2035 C LYS A 125 -12.528 -2.334 -1.030 1.00 0.00 C ATOM 2036 O LYS A 125 -12.129 -2.070 0.104 1.00 0.00 O ATOM 2037 CB LYS A 125 -13.861 -4.520 -1.115 1.00 0.00 C ATOM 2038 CG LYS A 125 -14.844 -5.004 -0.047 1.00 0.00 C ATOM 2039 CD LYS A 125 -14.394 -6.340 0.548 1.00 0.00 C ATOM 2040 CE LYS A 125 -14.918 -7.514 -0.282 1.00 0.00 C ATOM 2041 NZ LYS A 125 -14.256 -7.548 -1.606 1.00 0.00 N ATOM 0 H LYS A 125 -14.619 -3.375 -3.167 1.00 0.00 H new ATOM 0 HA LYS A 125 -14.543 -2.648 -0.437 1.00 0.00 H new ATOM 0 HB2 LYS A 125 -14.110 -4.972 -2.075 1.00 0.00 H new ATOM 0 HB3 LYS A 125 -12.853 -4.847 -0.861 1.00 0.00 H new ATOM 0 HG2 LYS A 125 -14.923 -4.258 0.744 1.00 0.00 H new ATOM 0 HG3 LYS A 125 -15.837 -5.112 -0.484 1.00 0.00 H new ATOM 0 HD2 LYS A 125 -13.305 -6.376 0.589 1.00 0.00 H new ATOM 0 HD3 LYS A 125 -14.754 -6.425 1.573 1.00 0.00 H new ATOM 0 HE2 LYS A 125 -14.737 -8.450 0.246 1.00 0.00 H new ATOM 0 HE3 LYS A 125 -15.997 -7.424 -0.410 1.00 0.00 H new ATOM 0 HZ1 LYS A 125 -14.170 -8.534 -1.926 1.00 0.00 H new ATOM 0 HZ2 LYS A 125 -14.823 -7.010 -2.292 1.00 0.00 H new ATOM 0 HZ3 LYS A 125 -13.309 -7.124 -1.532 1.00 0.00 H new ATOM 2054 N GLN A 126 -11.851 -2.084 -2.141 1.00 0.00 N ATOM 2055 CA GLN A 126 -10.541 -1.457 -2.094 1.00 0.00 C ATOM 2056 C GLN A 126 -10.682 0.057 -1.926 1.00 0.00 C ATOM 2057 O GLN A 126 -9.858 0.692 -1.269 1.00 0.00 O ATOM 2058 CB GLN A 126 -9.726 -1.797 -3.343 1.00 0.00 C ATOM 2059 CG GLN A 126 -8.564 -0.818 -3.522 1.00 0.00 C ATOM 2060 CD GLN A 126 -7.521 -1.376 -4.494 1.00 0.00 C ATOM 2061 OE1 GLN A 126 -6.270 -1.297 -4.049 1.00 0.00 O flip ATOM 2062 NE2 GLN A 126 -7.832 -1.848 -5.575 1.00 0.00 N flip ATOM 0 H GLN A 126 -12.185 -2.304 -3.079 1.00 0.00 H new ATOM 0 HA GLN A 126 -10.003 -1.849 -1.231 1.00 0.00 H new ATOM 0 HB2 GLN A 126 -9.341 -2.814 -3.265 1.00 0.00 H new ATOM 0 HB3 GLN A 126 -10.370 -1.767 -4.222 1.00 0.00 H new ATOM 0 HG2 GLN A 126 -8.941 0.135 -3.895 1.00 0.00 H new ATOM 0 HG3 GLN A 126 -8.098 -0.621 -2.557 1.00 0.00 H new ATOM 0 HE21 GLN A 126 -8.812 -1.878 -5.855 1.00 0.00 H new ATOM 0 HE22 GLN A 126 -7.112 -2.213 -6.198 1.00 0.00 H new ATOM 2071 N LYS A 127 -11.732 0.592 -2.531 1.00 0.00 N ATOM 2072 CA LYS A 127 -11.992 2.020 -2.457 1.00 0.00 C ATOM 2073 C LYS A 127 -12.637 2.347 -1.109 1.00 0.00 C ATOM 2074 O LYS A 127 -12.654 3.503 -0.690 1.00 0.00 O ATOM 2075 CB LYS A 127 -12.818 2.477 -3.661 1.00 0.00 C ATOM 2076 CG LYS A 127 -11.982 3.352 -4.598 1.00 0.00 C ATOM 2077 CD LYS A 127 -12.682 4.685 -4.872 1.00 0.00 C ATOM 2078 CE LYS A 127 -12.954 4.864 -6.367 1.00 0.00 C ATOM 2079 NZ LYS A 127 -11.702 5.187 -7.087 1.00 0.00 N ATOM 0 H LYS A 127 -12.413 0.062 -3.075 1.00 0.00 H new ATOM 0 HA LYS A 127 -11.059 2.581 -2.509 1.00 0.00 H new ATOM 0 HB2 LYS A 127 -13.189 1.607 -4.204 1.00 0.00 H new ATOM 0 HB3 LYS A 127 -13.690 3.034 -3.318 1.00 0.00 H new ATOM 0 HG2 LYS A 127 -11.004 3.535 -4.154 1.00 0.00 H new ATOM 0 HG3 LYS A 127 -11.812 2.826 -5.538 1.00 0.00 H new ATOM 0 HD2 LYS A 127 -13.621 4.727 -4.320 1.00 0.00 H new ATOM 0 HD3 LYS A 127 -12.063 5.506 -4.510 1.00 0.00 H new ATOM 0 HE2 LYS A 127 -13.390 3.952 -6.775 1.00 0.00 H new ATOM 0 HE3 LYS A 127 -13.683 5.661 -6.517 1.00 0.00 H new ATOM 0 HZ1 LYS A 127 -11.905 5.305 -8.100 1.00 0.00 H new ATOM 0 HZ2 LYS A 127 -11.302 6.069 -6.709 1.00 0.00 H new ATOM 0 HZ3 LYS A 127 -11.018 4.414 -6.959 1.00 0.00 H new ATOM 2092 N LYS A 128 -13.151 1.308 -0.467 1.00 0.00 N ATOM 2093 CA LYS A 128 -13.796 1.471 0.825 1.00 0.00 C ATOM 2094 C LYS A 128 -12.749 1.876 1.864 1.00 0.00 C ATOM 2095 O LYS A 128 -12.855 2.938 2.476 1.00 0.00 O ATOM 2096 CB LYS A 128 -14.576 0.209 1.197 1.00 0.00 C ATOM 2097 CG LYS A 128 -15.789 0.550 2.064 1.00 0.00 C ATOM 2098 CD LYS A 128 -16.757 -0.632 2.142 1.00 0.00 C ATOM 2099 CE LYS A 128 -18.194 -0.184 1.868 1.00 0.00 C ATOM 2100 NZ LYS A 128 -19.052 -1.351 1.565 1.00 0.00 N ATOM 0 H LYS A 128 -13.134 0.350 -0.817 1.00 0.00 H new ATOM 0 HA LYS A 128 -14.533 2.273 0.785 1.00 0.00 H new ATOM 0 HB2 LYS A 128 -14.904 -0.301 0.291 1.00 0.00 H new ATOM 0 HB3 LYS A 128 -13.924 -0.481 1.733 1.00 0.00 H new ATOM 0 HG2 LYS A 128 -15.459 0.821 3.067 1.00 0.00 H new ATOM 0 HG3 LYS A 128 -16.303 1.419 1.652 1.00 0.00 H new ATOM 0 HD2 LYS A 128 -16.466 -1.393 1.418 1.00 0.00 H new ATOM 0 HD3 LYS A 128 -16.697 -1.091 3.129 1.00 0.00 H new ATOM 0 HE2 LYS A 128 -18.587 0.348 2.734 1.00 0.00 H new ATOM 0 HE3 LYS A 128 -18.210 0.514 1.031 1.00 0.00 H new ATOM 0 HZ1 LYS A 128 -20.024 -1.029 1.382 1.00 0.00 H new ATOM 0 HZ2 LYS A 128 -18.686 -1.842 0.725 1.00 0.00 H new ATOM 0 HZ3 LYS A 128 -19.050 -2.003 2.375 1.00 0.00 H new ATOM 2113 N TYR A 129 -11.762 1.009 2.033 1.00 0.00 N ATOM 2114 CA TYR A 129 -10.697 1.263 2.988 1.00 0.00 C ATOM 2115 C TYR A 129 -9.832 2.444 2.543 1.00 0.00 C ATOM 2116 O TYR A 129 -9.374 3.229 3.371 1.00 0.00 O ATOM 2117 CB TYR A 129 -9.838 -0.004 3.009 1.00 0.00 C ATOM 2118 CG TYR A 129 -10.646 -1.303 2.999 1.00 0.00 C ATOM 2119 CD1 TYR A 129 -11.801 -1.403 3.748 1.00 0.00 C ATOM 2120 CD2 TYR A 129 -10.220 -2.375 2.241 1.00 0.00 C ATOM 2121 CE1 TYR A 129 -12.561 -2.626 3.739 1.00 0.00 C ATOM 2122 CE2 TYR A 129 -10.980 -3.598 2.232 1.00 0.00 C ATOM 2123 CZ TYR A 129 -12.113 -3.663 2.981 1.00 0.00 C ATOM 2124 OH TYR A 129 -12.831 -4.818 2.972 1.00 0.00 O ATOM 0 H TYR A 129 -11.677 0.129 1.524 1.00 0.00 H new ATOM 0 HA TYR A 129 -11.109 1.505 3.968 1.00 0.00 H new ATOM 0 HB2 TYR A 129 -9.174 0.005 2.145 1.00 0.00 H new ATOM 0 HB3 TYR A 129 -9.206 0.012 3.897 1.00 0.00 H new ATOM 0 HD1 TYR A 129 -12.135 -0.564 4.341 1.00 0.00 H new ATOM 0 HD2 TYR A 129 -9.316 -2.296 1.655 1.00 0.00 H new ATOM 0 HE1 TYR A 129 -13.466 -2.718 4.321 1.00 0.00 H new ATOM 0 HE2 TYR A 129 -10.657 -4.444 1.644 1.00 0.00 H new ATOM 0 HH TYR A 129 -13.736 -4.638 2.641 1.00 0.00 H new ATOM 2134 N VAL A 130 -9.633 2.531 1.236 1.00 0.00 N ATOM 2135 CA VAL A 130 -8.831 3.603 0.671 1.00 0.00 C ATOM 2136 C VAL A 130 -9.376 4.950 1.150 1.00 0.00 C ATOM 2137 O VAL A 130 -8.647 5.743 1.743 1.00 0.00 O ATOM 2138 CB VAL A 130 -8.795 3.481 -0.854 1.00 0.00 C ATOM 2139 CG1 VAL A 130 -8.899 4.857 -1.516 1.00 0.00 C ATOM 2140 CG2 VAL A 130 -7.536 2.744 -1.316 1.00 0.00 C ATOM 0 H VAL A 130 -10.013 1.877 0.552 1.00 0.00 H new ATOM 0 HA VAL A 130 -7.799 3.530 1.015 1.00 0.00 H new ATOM 0 HB VAL A 130 -9.659 2.893 -1.164 1.00 0.00 H new ATOM 0 HG11 VAL A 130 -8.871 4.742 -2.600 1.00 0.00 H new ATOM 0 HG12 VAL A 130 -9.837 5.331 -1.225 1.00 0.00 H new ATOM 0 HG13 VAL A 130 -8.063 5.479 -1.195 1.00 0.00 H new ATOM 0 HG21 VAL A 130 -7.536 2.671 -2.404 1.00 0.00 H new ATOM 0 HG22 VAL A 130 -6.653 3.292 -0.989 1.00 0.00 H new ATOM 0 HG23 VAL A 130 -7.522 1.743 -0.885 1.00 0.00 H new ATOM 2150 N GLU A 131 -10.654 5.166 0.876 1.00 0.00 N ATOM 2151 CA GLU A 131 -11.306 6.403 1.272 1.00 0.00 C ATOM 2152 C GLU A 131 -11.296 6.544 2.796 1.00 0.00 C ATOM 2153 O GLU A 131 -10.897 7.580 3.325 1.00 0.00 O ATOM 2154 CB GLU A 131 -12.732 6.472 0.724 1.00 0.00 C ATOM 2155 CG GLU A 131 -12.978 7.797 0.000 1.00 0.00 C ATOM 2156 CD GLU A 131 -14.422 7.889 -0.499 1.00 0.00 C ATOM 2157 OE1 GLU A 131 -15.179 8.761 -0.047 1.00 0.00 O ATOM 2158 OE2 GLU A 131 -14.749 7.014 -1.388 1.00 0.00 O ATOM 0 H GLU A 131 -11.256 4.505 0.384 1.00 0.00 H new ATOM 0 HA GLU A 131 -10.748 7.237 0.846 1.00 0.00 H new ATOM 0 HB2 GLU A 131 -12.902 5.642 0.038 1.00 0.00 H new ATOM 0 HB3 GLU A 131 -13.445 6.362 1.541 1.00 0.00 H new ATOM 0 HG2 GLU A 131 -12.769 8.628 0.674 1.00 0.00 H new ATOM 0 HG3 GLU A 131 -12.292 7.888 -0.842 1.00 0.00 H new ATOM 2166 N GLU A 132 -11.740 5.486 3.458 1.00 0.00 N ATOM 2167 CA GLU A 132 -11.788 5.478 4.911 1.00 0.00 C ATOM 2168 C GLU A 132 -10.412 5.816 5.489 1.00 0.00 C ATOM 2169 O GLU A 132 -10.296 6.668 6.368 1.00 0.00 O ATOM 2170 CB GLU A 132 -12.288 4.131 5.436 1.00 0.00 C ATOM 2171 CG GLU A 132 -13.609 4.292 6.190 1.00 0.00 C ATOM 2172 CD GLU A 132 -14.703 3.416 5.574 1.00 0.00 C ATOM 2173 OE1 GLU A 132 -14.394 2.430 4.889 1.00 0.00 O ATOM 2174 OE2 GLU A 132 -15.910 3.791 5.831 1.00 0.00 O ATOM 0 H GLU A 132 -12.070 4.628 3.016 1.00 0.00 H new ATOM 0 HA GLU A 132 -12.495 6.242 5.236 1.00 0.00 H new ATOM 0 HB2 GLU A 132 -12.422 3.440 4.604 1.00 0.00 H new ATOM 0 HB3 GLU A 132 -11.539 3.694 6.096 1.00 0.00 H new ATOM 0 HG2 GLU A 132 -13.469 4.023 7.237 1.00 0.00 H new ATOM 0 HG3 GLU A 132 -13.919 5.337 6.168 1.00 0.00 H new ATOM 2182 N VAL A 133 -9.404 5.129 4.972 1.00 0.00 N ATOM 2183 CA VAL A 133 -8.041 5.345 5.426 1.00 0.00 C ATOM 2184 C VAL A 133 -7.552 6.708 4.929 1.00 0.00 C ATOM 2185 O VAL A 133 -6.801 7.392 5.622 1.00 0.00 O ATOM 2186 CB VAL A 133 -7.148 4.188 4.972 1.00 0.00 C ATOM 2187 CG1 VAL A 133 -5.691 4.430 5.373 1.00 0.00 C ATOM 2188 CG2 VAL A 133 -7.656 2.855 5.524 1.00 0.00 C ATOM 0 H VAL A 133 -9.504 4.422 4.243 1.00 0.00 H new ATOM 0 HA VAL A 133 -8.000 5.362 6.515 1.00 0.00 H new ATOM 0 HB VAL A 133 -7.191 4.138 3.884 1.00 0.00 H new ATOM 0 HG11 VAL A 133 -5.078 3.593 5.039 1.00 0.00 H new ATOM 0 HG12 VAL A 133 -5.334 5.350 4.909 1.00 0.00 H new ATOM 0 HG13 VAL A 133 -5.622 4.520 6.457 1.00 0.00 H new ATOM 0 HG21 VAL A 133 -7.004 2.049 5.187 1.00 0.00 H new ATOM 0 HG22 VAL A 133 -7.657 2.889 6.613 1.00 0.00 H new ATOM 0 HG23 VAL A 133 -8.670 2.675 5.166 1.00 0.00 H new ATOM 2198 N TRP A 134 -7.999 7.060 3.732 1.00 0.00 N ATOM 2199 CA TRP A 134 -7.617 8.328 3.135 1.00 0.00 C ATOM 2200 C TRP A 134 -8.327 9.446 3.902 1.00 0.00 C ATOM 2201 O TRP A 134 -7.982 10.618 3.759 1.00 0.00 O ATOM 2202 CB TRP A 134 -7.925 8.343 1.636 1.00 0.00 C ATOM 2203 CG TRP A 134 -7.439 9.601 0.913 1.00 0.00 C ATOM 2204 CD1 TRP A 134 -6.670 10.586 1.398 1.00 0.00 C ATOM 2205 CD2 TRP A 134 -7.723 9.972 -0.452 1.00 0.00 C ATOM 2206 NE1 TRP A 134 -6.438 11.560 0.448 1.00 0.00 N ATOM 2207 CE2 TRP A 134 -7.099 11.175 -0.713 1.00 0.00 C ATOM 2208 CE3 TRP A 134 -8.482 9.313 -1.435 1.00 0.00 C ATOM 2209 CZ2 TRP A 134 -7.170 11.823 -1.952 1.00 0.00 C ATOM 2210 CZ3 TRP A 134 -8.543 9.973 -2.668 1.00 0.00 C ATOM 2211 CH2 TRP A 134 -7.921 11.184 -2.946 1.00 0.00 C ATOM 0 H TRP A 134 -8.622 6.489 3.160 1.00 0.00 H new ATOM 0 HA TRP A 134 -6.541 8.482 3.213 1.00 0.00 H new ATOM 0 HB2 TRP A 134 -7.466 7.470 1.172 1.00 0.00 H new ATOM 0 HB3 TRP A 134 -9.002 8.249 1.496 1.00 0.00 H new ATOM 0 HD1 TRP A 134 -6.281 10.614 2.405 1.00 0.00 H new ATOM 0 HE1 TRP A 134 -5.883 12.407 0.574 1.00 0.00 H new ATOM 0 HE3 TRP A 134 -8.979 8.372 -1.253 1.00 0.00 H new ATOM 0 HZ2 TRP A 134 -6.672 12.765 -2.131 1.00 0.00 H new ATOM 0 HZ3 TRP A 134 -9.114 9.508 -3.459 1.00 0.00 H new ATOM 0 HH2 TRP A 134 -8.016 11.631 -3.925 1.00 0.00 H new ATOM 2222 N GLY A 135 -9.306 9.043 4.699 1.00 0.00 N ATOM 2223 CA GLY A 135 -10.067 9.995 5.490 1.00 0.00 C ATOM 2224 C GLY A 135 -9.138 10.919 6.279 1.00 0.00 C ATOM 2225 O GLY A 135 -9.526 12.025 6.652 1.00 0.00 O ATOM 0 H GLY A 135 -9.590 8.070 4.814 1.00 0.00 H new ATOM 0 HA2 GLY A 135 -10.706 10.588 4.836 1.00 0.00 H new ATOM 0 HA3 GLY A 135 -10.723 9.460 6.177 1.00 0.00 H new ATOM 2229 N GLU A 136 -7.928 10.432 6.511 1.00 0.00 N ATOM 2230 CA GLU A 136 -6.940 11.200 7.250 1.00 0.00 C ATOM 2231 C GLU A 136 -6.155 12.107 6.301 1.00 0.00 C ATOM 2232 O GLU A 136 -6.197 13.330 6.429 1.00 0.00 O ATOM 2233 CB GLU A 136 -6.000 10.278 8.030 1.00 0.00 C ATOM 2234 CG GLU A 136 -5.395 11.004 9.234 1.00 0.00 C ATOM 2235 CD GLU A 136 -4.693 10.019 10.171 1.00 0.00 C ATOM 2236 OE1 GLU A 136 -4.643 8.815 9.881 1.00 0.00 O ATOM 2237 OE2 GLU A 136 -4.185 10.546 11.234 1.00 0.00 O ATOM 0 H GLU A 136 -7.609 9.514 6.200 1.00 0.00 H new ATOM 0 HA GLU A 136 -7.462 11.827 7.972 1.00 0.00 H new ATOM 0 HB2 GLU A 136 -6.546 9.398 8.368 1.00 0.00 H new ATOM 0 HB3 GLU A 136 -5.203 9.926 7.375 1.00 0.00 H new ATOM 0 HG2 GLU A 136 -4.684 11.755 8.891 1.00 0.00 H new ATOM 0 HG3 GLU A 136 -6.179 11.532 9.777 1.00 0.00 H new ATOM 2245 N TRP A 137 -5.457 11.474 5.370 1.00 0.00 N ATOM 2246 CA TRP A 137 -4.664 12.209 4.399 1.00 0.00 C ATOM 2247 C TRP A 137 -5.591 13.187 3.675 1.00 0.00 C ATOM 2248 O TRP A 137 -5.132 14.176 3.104 1.00 0.00 O ATOM 2249 CB TRP A 137 -3.940 11.255 3.447 1.00 0.00 C ATOM 2250 CG TRP A 137 -2.508 10.922 3.869 1.00 0.00 C ATOM 2251 CD1 TRP A 137 -2.082 10.461 5.053 1.00 0.00 C ATOM 2252 CD2 TRP A 137 -1.322 11.045 3.056 1.00 0.00 C ATOM 2253 NE1 TRP A 137 -0.715 10.278 5.063 1.00 0.00 N ATOM 2254 CE2 TRP A 137 -0.237 10.644 3.810 1.00 0.00 C ATOM 2255 CE3 TRP A 137 -1.170 11.480 1.728 1.00 0.00 C ATOM 2256 CZ2 TRP A 137 1.075 10.639 3.323 1.00 0.00 C ATOM 2257 CZ3 TRP A 137 0.148 11.469 1.256 1.00 0.00 C ATOM 2258 CH2 TRP A 137 1.250 11.069 2.002 1.00 0.00 C ATOM 0 H TRP A 137 -5.424 10.460 5.267 1.00 0.00 H new ATOM 0 HA TRP A 137 -3.877 12.777 4.895 1.00 0.00 H new ATOM 0 HB2 TRP A 137 -4.511 10.329 3.373 1.00 0.00 H new ATOM 0 HB3 TRP A 137 -3.921 11.697 2.451 1.00 0.00 H new ATOM 0 HD1 TRP A 137 -2.728 10.258 5.894 1.00 0.00 H new ATOM 0 HE1 TRP A 137 -0.157 9.937 5.846 1.00 0.00 H new ATOM 0 HE3 TRP A 137 -2.004 11.798 1.120 1.00 0.00 H new ATOM 0 HZ2 TRP A 137 1.907 10.321 3.933 1.00 0.00 H new ATOM 0 HZ3 TRP A 137 0.320 11.794 0.241 1.00 0.00 H new ATOM 0 HH2 TRP A 137 2.237 11.090 1.565 1.00 0.00 H new ATOM 2269 N ARG A 138 -6.878 12.879 3.722 1.00 0.00 N ATOM 2270 CA ARG A 138 -7.873 13.718 3.078 1.00 0.00 C ATOM 2271 C ARG A 138 -7.715 15.171 3.530 1.00 0.00 C ATOM 2272 O ARG A 138 -8.129 16.092 2.828 1.00 0.00 O ATOM 2273 CB ARG A 138 -9.290 13.242 3.403 1.00 0.00 C ATOM 2274 CG ARG A 138 -9.902 12.491 2.218 1.00 0.00 C ATOM 2275 CD ARG A 138 -10.496 13.466 1.199 1.00 0.00 C ATOM 2276 NE ARG A 138 -11.761 14.032 1.717 1.00 0.00 N ATOM 2277 CZ ARG A 138 -12.950 13.394 1.672 1.00 0.00 C ATOM 2278 NH1 ARG A 138 -13.046 12.161 1.131 1.00 0.00 N ATOM 2279 NH2 ARG A 138 -14.018 13.994 2.165 1.00 0.00 N ATOM 0 H ARG A 138 -7.255 12.059 4.197 1.00 0.00 H new ATOM 0 HA ARG A 138 -7.717 13.649 2.001 1.00 0.00 H new ATOM 0 HB2 ARG A 138 -9.267 12.592 4.278 1.00 0.00 H new ATOM 0 HB3 ARG A 138 -9.915 14.098 3.658 1.00 0.00 H new ATOM 0 HG2 ARG A 138 -9.139 11.878 1.738 1.00 0.00 H new ATOM 0 HG3 ARG A 138 -10.678 11.813 2.574 1.00 0.00 H new ATOM 0 HD2 ARG A 138 -9.786 14.268 0.994 1.00 0.00 H new ATOM 0 HD3 ARG A 138 -10.678 12.952 0.255 1.00 0.00 H new ATOM 0 HE ARG A 138 -11.733 14.962 2.134 1.00 0.00 H new ATOM 0 HH11 ARG A 138 -12.216 11.704 0.752 1.00 0.00 H new ATOM 0 HH12 ARG A 138 -13.948 11.686 1.101 1.00 0.00 H new ATOM 0 HH21 ARG A 138 -13.937 14.926 2.572 1.00 0.00 H new ATOM 0 HH22 ARG A 138 -14.924 13.526 2.139 1.00 0.00 H new ATOM 2292 N SER A 139 -7.115 15.331 4.700 1.00 0.00 N ATOM 2293 CA SER A 139 -6.897 16.657 5.255 1.00 0.00 C ATOM 2294 C SER A 139 -5.741 17.345 4.526 1.00 0.00 C ATOM 2295 O SER A 139 -5.409 18.491 4.824 1.00 0.00 O ATOM 2296 CB SER A 139 -6.610 16.586 6.756 1.00 0.00 C ATOM 2297 OG SER A 139 -7.804 16.437 7.520 1.00 0.00 O ATOM 0 H SER A 139 -6.773 14.565 5.280 1.00 0.00 H new ATOM 0 HA SER A 139 -7.807 17.241 5.114 1.00 0.00 H new ATOM 0 HB2 SER A 139 -5.943 15.748 6.959 1.00 0.00 H new ATOM 0 HB3 SER A 139 -6.089 17.491 7.069 1.00 0.00 H new ATOM 0 HG SER A 139 -7.579 16.394 8.473 1.00 0.00 H new ATOM 2303 N ASN A 140 -5.160 16.616 3.584 1.00 0.00 N ATOM 2304 CA ASN A 140 -4.048 17.142 2.810 1.00 0.00 C ATOM 2305 C ASN A 140 -4.147 16.632 1.371 1.00 0.00 C ATOM 2306 O ASN A 140 -3.475 15.669 1.003 1.00 0.00 O ATOM 2307 CB ASN A 140 -2.708 16.679 3.386 1.00 0.00 C ATOM 2308 CG ASN A 140 -2.786 16.532 4.907 1.00 0.00 C ATOM 2309 OD1 ASN A 140 -3.324 15.386 5.313 1.00 0.00 O flip ATOM 2310 ND2 ASN A 140 -2.384 17.402 5.661 1.00 0.00 N flip ATOM 0 H ASN A 140 -5.438 15.666 3.339 1.00 0.00 H new ATOM 0 HA ASN A 140 -4.098 18.230 2.844 1.00 0.00 H new ATOM 0 HB2 ASN A 140 -2.426 15.726 2.939 1.00 0.00 H new ATOM 0 HB3 ASN A 140 -1.929 17.396 3.126 1.00 0.00 H new ATOM 0 HD21 ASN A 140 -1.981 18.259 5.282 1.00 0.00 H new ATOM 0 HD22 ASN A 140 -2.451 17.273 6.671 1.00 0.00 H new ATOM 2317 N PRO A 141 -5.012 17.317 0.576 1.00 0.00 N ATOM 2318 CA PRO A 141 -5.207 16.942 -0.814 1.00 0.00 C ATOM 2319 C PRO A 141 -4.018 17.380 -1.672 1.00 0.00 C ATOM 2320 O PRO A 141 -2.997 17.820 -1.146 1.00 0.00 O ATOM 2321 CB PRO A 141 -6.510 17.609 -1.222 1.00 0.00 C ATOM 2322 CG PRO A 141 -6.757 18.704 -0.197 1.00 0.00 C ATOM 2323 CD PRO A 141 -5.824 18.461 0.978 1.00 0.00 C ATOM 0 HA PRO A 141 -5.266 15.863 -0.954 1.00 0.00 H new ATOM 0 HB2 PRO A 141 -6.438 18.024 -2.227 1.00 0.00 H new ATOM 0 HB3 PRO A 141 -7.330 16.891 -1.232 1.00 0.00 H new ATOM 0 HG2 PRO A 141 -6.572 19.685 -0.634 1.00 0.00 H new ATOM 0 HG3 PRO A 141 -7.796 18.692 0.132 1.00 0.00 H new ATOM 0 HD2 PRO A 141 -5.205 19.335 1.179 1.00 0.00 H new ATOM 0 HD3 PRO A 141 -6.382 18.249 1.890 1.00 0.00 H new ATOM 2331 N SER A 142 -4.189 17.242 -2.978 1.00 0.00 N ATOM 2332 CA SER A 142 -3.143 17.618 -3.914 1.00 0.00 C ATOM 2333 C SER A 142 -1.775 17.216 -3.358 1.00 0.00 C ATOM 2334 O SER A 142 -1.072 18.040 -2.775 1.00 0.00 O ATOM 2335 CB SER A 142 -3.178 19.119 -4.205 1.00 0.00 C ATOM 2336 OG SER A 142 -4.476 19.558 -4.596 1.00 0.00 O ATOM 0 H SER A 142 -5.037 16.875 -3.411 1.00 0.00 H new ATOM 0 HA SER A 142 -3.316 17.090 -4.852 1.00 0.00 H new ATOM 0 HB2 SER A 142 -2.862 19.668 -3.318 1.00 0.00 H new ATOM 0 HB3 SER A 142 -2.464 19.352 -4.995 1.00 0.00 H new ATOM 0 HG SER A 142 -4.456 20.522 -4.771 1.00 0.00 H new ATOM 2342 N GLU A 143 -1.439 15.950 -3.559 1.00 0.00 N ATOM 2343 CA GLU A 143 -0.168 15.430 -3.085 1.00 0.00 C ATOM 2344 C GLU A 143 0.967 15.884 -4.004 1.00 0.00 C ATOM 2345 O GLU A 143 0.723 16.335 -5.122 1.00 0.00 O ATOM 2346 CB GLU A 143 -0.208 13.904 -2.975 1.00 0.00 C ATOM 2347 CG GLU A 143 0.599 13.421 -1.768 1.00 0.00 C ATOM 2348 CD GLU A 143 0.103 14.076 -0.478 1.00 0.00 C ATOM 2349 OE1 GLU A 143 -1.058 13.880 -0.090 1.00 0.00 O ATOM 2350 OE2 GLU A 143 0.971 14.812 0.129 1.00 0.00 O ATOM 0 H GLU A 143 -2.025 15.270 -4.043 1.00 0.00 H new ATOM 0 HA GLU A 143 0.017 15.829 -2.088 1.00 0.00 H new ATOM 0 HB2 GLU A 143 -1.241 13.569 -2.884 1.00 0.00 H new ATOM 0 HB3 GLU A 143 0.192 13.459 -3.886 1.00 0.00 H new ATOM 0 HG2 GLU A 143 0.520 12.337 -1.683 1.00 0.00 H new ATOM 0 HG3 GLU A 143 1.654 13.653 -1.915 1.00 0.00 H new ATOM 2358 N ASP A 144 2.185 15.748 -3.500 1.00 0.00 N ATOM 2359 CA ASP A 144 3.359 16.139 -4.261 1.00 0.00 C ATOM 2360 C ASP A 144 3.171 15.731 -5.724 1.00 0.00 C ATOM 2361 O ASP A 144 3.290 14.555 -6.064 1.00 0.00 O ATOM 2362 CB ASP A 144 4.615 15.443 -3.734 1.00 0.00 C ATOM 2363 CG ASP A 144 5.927 16.178 -4.013 1.00 0.00 C ATOM 2364 OD1 ASP A 144 6.768 15.709 -4.794 1.00 0.00 O ATOM 2365 OD2 ASP A 144 6.072 17.293 -3.380 1.00 0.00 O ATOM 0 H ASP A 144 2.384 15.372 -2.573 1.00 0.00 H new ATOM 0 HA ASP A 144 3.479 17.218 -4.166 1.00 0.00 H new ATOM 0 HB2 ASP A 144 4.513 15.309 -2.657 1.00 0.00 H new ATOM 0 HB3 ASP A 144 4.673 14.448 -4.175 1.00 0.00 H new ATOM 2371 N SER A 145 2.881 16.725 -6.550 1.00 0.00 N ATOM 2372 CA SER A 145 2.676 16.485 -7.968 1.00 0.00 C ATOM 2373 C SER A 145 2.210 17.770 -8.655 1.00 0.00 C ATOM 2374 O SER A 145 1.021 17.941 -8.920 1.00 0.00 O ATOM 2375 CB SER A 145 1.660 15.363 -8.195 1.00 0.00 C ATOM 2376 OG SER A 145 1.209 15.317 -9.546 1.00 0.00 O ATOM 0 H SER A 145 2.783 17.699 -6.264 1.00 0.00 H new ATOM 0 HA SER A 145 3.626 16.173 -8.403 1.00 0.00 H new ATOM 0 HB2 SER A 145 2.111 14.407 -7.930 1.00 0.00 H new ATOM 0 HB3 SER A 145 0.807 15.507 -7.532 1.00 0.00 H new ATOM 0 HG SER A 145 0.980 14.394 -9.783 1.00 0.00 H new ATOM 2382 N ASP A 146 3.171 18.641 -8.924 1.00 0.00 N ATOM 2383 CA ASP A 146 2.875 19.906 -9.575 1.00 0.00 C ATOM 2384 C ASP A 146 4.185 20.612 -9.928 1.00 0.00 C ATOM 2385 O ASP A 146 5.087 20.707 -9.097 1.00 0.00 O ATOM 2386 CB ASP A 146 2.075 20.826 -8.651 1.00 0.00 C ATOM 2387 CG ASP A 146 2.448 20.740 -7.170 1.00 0.00 C ATOM 2388 OD1 ASP A 146 3.511 21.223 -6.750 1.00 0.00 O ATOM 2389 OD2 ASP A 146 1.585 20.137 -6.425 1.00 0.00 O ATOM 0 H ASP A 146 4.156 18.496 -8.703 1.00 0.00 H new ATOM 0 HA ASP A 146 2.289 19.696 -10.470 1.00 0.00 H new ATOM 0 HB2 ASP A 146 2.208 21.855 -8.984 1.00 0.00 H new ATOM 0 HB3 ASP A 146 1.016 20.591 -8.757 1.00 0.00 H new ATOM 2395 N PRO A 147 4.251 21.103 -11.195 1.00 0.00 N ATOM 2396 CA PRO A 147 5.436 21.798 -11.668 1.00 0.00 C ATOM 2397 C PRO A 147 5.515 23.209 -11.081 1.00 0.00 C ATOM 2398 O PRO A 147 6.531 23.587 -10.501 1.00 0.00 O ATOM 2399 CB PRO A 147 5.317 21.791 -13.183 1.00 0.00 C ATOM 2400 CG PRO A 147 3.855 21.508 -13.485 1.00 0.00 C ATOM 2401 CD PRO A 147 3.202 21.009 -12.206 1.00 0.00 C ATOM 0 HA PRO A 147 6.361 21.316 -11.352 1.00 0.00 H new ATOM 0 HB2 PRO A 147 5.624 22.749 -13.603 1.00 0.00 H new ATOM 0 HB3 PRO A 147 5.961 21.029 -13.622 1.00 0.00 H new ATOM 0 HG2 PRO A 147 3.357 22.410 -13.841 1.00 0.00 H new ATOM 0 HG3 PRO A 147 3.766 20.762 -14.275 1.00 0.00 H new ATOM 0 HD2 PRO A 147 2.338 21.618 -11.939 1.00 0.00 H new ATOM 0 HD3 PRO A 147 2.848 19.984 -12.316 1.00 0.00 H new ATOM 2409 N GLY A 148 4.429 23.948 -11.252 1.00 0.00 N ATOM 2410 CA GLY A 148 4.362 25.308 -10.746 1.00 0.00 C ATOM 2411 C GLY A 148 3.240 26.093 -11.429 1.00 0.00 C ATOM 2412 O GLY A 148 3.390 26.535 -12.567 1.00 0.00 O ATOM 0 H GLY A 148 3.588 23.630 -11.734 1.00 0.00 H new ATOM 0 HA2 GLY A 148 4.195 25.291 -9.669 1.00 0.00 H new ATOM 0 HA3 GLY A 148 5.315 25.809 -10.913 1.00 0.00 H new ATOM 2416 N LYS A 149 2.141 26.242 -10.705 1.00 0.00 N ATOM 2417 CA LYS A 149 0.994 26.966 -11.227 1.00 0.00 C ATOM 2418 C LYS A 149 0.344 26.146 -12.343 1.00 0.00 C ATOM 2419 O LYS A 149 0.943 25.201 -12.854 1.00 0.00 O ATOM 2420 CB LYS A 149 1.401 28.377 -11.657 1.00 0.00 C ATOM 2421 CG LYS A 149 0.206 29.332 -11.604 1.00 0.00 C ATOM 2422 CD LYS A 149 0.662 30.764 -11.319 1.00 0.00 C ATOM 2423 CE LYS A 149 0.206 31.715 -12.428 1.00 0.00 C ATOM 2424 NZ LYS A 149 0.268 33.120 -11.964 1.00 0.00 N ATOM 0 H LYS A 149 2.020 25.874 -9.761 1.00 0.00 H new ATOM 0 HA LYS A 149 0.242 27.100 -10.450 1.00 0.00 H new ATOM 0 HB2 LYS A 149 2.194 28.745 -11.006 1.00 0.00 H new ATOM 0 HB3 LYS A 149 1.805 28.350 -12.669 1.00 0.00 H new ATOM 0 HG2 LYS A 149 -0.332 29.300 -12.551 1.00 0.00 H new ATOM 0 HG3 LYS A 149 -0.490 29.007 -10.830 1.00 0.00 H new ATOM 0 HD2 LYS A 149 0.258 31.095 -10.362 1.00 0.00 H new ATOM 0 HD3 LYS A 149 1.748 30.793 -11.233 1.00 0.00 H new ATOM 0 HE2 LYS A 149 0.838 31.588 -13.307 1.00 0.00 H new ATOM 0 HE3 LYS A 149 -0.812 31.470 -12.729 1.00 0.00 H new ATOM 0 HZ1 LYS A 149 -0.045 33.752 -12.728 1.00 0.00 H new ATOM 0 HZ2 LYS A 149 -0.353 33.241 -11.139 1.00 0.00 H new ATOM 0 HZ3 LYS A 149 1.246 33.355 -11.698 1.00 0.00 H new ATOM 2437 N ARG A 150 -0.874 26.538 -12.690 1.00 0.00 N ATOM 2438 CA ARG A 150 -1.611 25.852 -13.737 1.00 0.00 C ATOM 2439 C ARG A 150 -1.792 24.375 -13.378 1.00 0.00 C ATOM 2440 O ARG A 150 -1.816 24.017 -12.201 1.00 0.00 O ATOM 2441 CB ARG A 150 -0.888 25.958 -15.080 1.00 0.00 C ATOM 2442 CG ARG A 150 -0.421 27.391 -15.340 1.00 0.00 C ATOM 2443 CD ARG A 150 -1.191 28.017 -16.504 1.00 0.00 C ATOM 2444 NE ARG A 150 -0.695 27.475 -17.789 1.00 0.00 N ATOM 2445 CZ ARG A 150 0.344 27.993 -18.478 1.00 0.00 C ATOM 2446 NH1 ARG A 150 1.006 29.072 -18.010 1.00 0.00 N ATOM 2447 NH2 ARG A 150 0.702 27.429 -19.616 1.00 0.00 N ATOM 0 H ARG A 150 -1.368 27.322 -12.264 1.00 0.00 H new ATOM 0 HA ARG A 150 -2.586 26.331 -13.824 1.00 0.00 H new ATOM 0 HB2 ARG A 150 -0.031 25.285 -15.089 1.00 0.00 H new ATOM 0 HB3 ARG A 150 -1.554 25.638 -15.882 1.00 0.00 H new ATOM 0 HG2 ARG A 150 -0.562 27.992 -14.441 1.00 0.00 H new ATOM 0 HG3 ARG A 150 0.646 27.395 -15.562 1.00 0.00 H new ATOM 0 HD2 ARG A 150 -2.256 27.810 -16.399 1.00 0.00 H new ATOM 0 HD3 ARG A 150 -1.074 29.101 -16.487 1.00 0.00 H new ATOM 0 HE ARG A 150 -1.168 26.659 -18.178 1.00 0.00 H new ATOM 0 HH11 ARG A 150 0.722 29.502 -17.130 1.00 0.00 H new ATOM 0 HH12 ARG A 150 1.790 29.457 -18.537 1.00 0.00 H new ATOM 0 HH21 ARG A 150 0.196 26.614 -19.963 1.00 0.00 H new ATOM 0 HH22 ARG A 150 1.485 27.808 -20.149 1.00 0.00 H new TER 2460 ARG A 150