USER MOD reduce.3.24.130724 H: found=0, std=0, add=786, rem=0, adj=31 USER MOD reduce.3.24.130724 removed 786 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 49 TYR OH : rot 180:sc= 0.934 USER MOD Set 1.2: B 48 GLN : amide:sc= 0.745 K(o=1.7,f=1) USER MOD Set 2.1: B 34 GLN : amide:sc= 0.103 X(o=0.47,f=0.71) USER MOD Set 2.2: B 38 TYR OH : rot 180:sc= 0.37 USER MOD Set 3.1: B 35 THR OG1 : rot -73:sc= 0.953 USER MOD Set 3.2: B 36 LYS NZ :NH3+ -122:sc= 1.15 (180deg=-2.25!) USER MOD Set 4.1: A 48 GLN : amide:sc= -0.0332 X(o=-0.12,f=-0.41) USER MOD Set 4.2: B 49 TYR OH : rot 180:sc= -0.0904 USER MOD Set 5.1: A 34 GLN :FLIP amide:sc= 0.336 F(o=-0.51,f=0.87) USER MOD Set 5.2: A 38 TYR OH : rot 117:sc= 0.536 USER MOD Single : A 1 GLY N :NH3+ -123:sc= 0.094 (180deg=0) USER MOD Single : A 2 SER OG : rot 180:sc= 0 USER MOD Single : A 13 SER OG : rot 85:sc= 1.23 USER MOD Single : A 15 SER OG : rot 172:sc= 1.35 USER MOD Single : A 16 GLN : amide:sc= -0.0058 K(o=-0.0058,f=-0.81) USER MOD Single : A 17 MET CE :methyl -171:sc= 0 (180deg=-0.0976) USER MOD Single : A 19 SER OG : rot 180:sc= 0 USER MOD Single : A 20 MET CE :methyl -162:sc= -0.0391 (180deg=-0.382) USER MOD Single : A 23 SER OG : rot 180:sc= -0.0604 USER MOD Single : A 30 THR OG1 : rot 180:sc= 0 USER MOD Single : A 35 THR OG1 : rot -68:sc= 0.625 USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 37 ASN : amide:sc= -0.207 K(o=-0.21,f=-2.3) USER MOD Single : A 46 THR OG1 : rot 50:sc= -0.245 USER MOD Single : A 50 SER OG : rot 180:sc= -0.0308 USER MOD Single : A 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 52 HIS : no HE2:sc= 0.985 K(o=0.98,f=-4!) USER MOD Single : B 1 GLY N :NH3+ -138:sc= 0.0382 (180deg=0) USER MOD Single : B 2 SER OG : rot 180:sc= 0 USER MOD Single : B 13 SER OG : rot 86:sc= 1.33 USER MOD Single : B 15 SER OG : rot 146:sc= 1.32 USER MOD Single : B 16 GLN : amide:sc= -0.0405 K(o=-0.04,f=-0.66) USER MOD Single : B 17 MET CE :methyl -168:sc=-0.00935 (180deg=-0.201) USER MOD Single : B 19 SER OG : rot 180:sc= 0 USER MOD Single : B 20 MET CE :methyl -147:sc= -0.116 (180deg=-1.21) USER MOD Single : B 23 SER OG : rot 180:sc= -0.0101 USER MOD Single : B 30 THR OG1 : rot 180:sc= 0 USER MOD Single : B 37 ASN : amide:sc= -0.921! C(o=-0.92!,f=-2.1!) USER MOD Single : B 46 THR OG1 : rot 70:sc= 1.2 USER MOD Single : B 50 SER OG : rot -60:sc= 0.741 USER MOD Single : B 51 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 52 HIS : no HD1:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 18.211 19.403 -2.931 1.00 10.00 N ATOM 2 CA GLY A 1 19.024 18.357 -3.596 1.00 10.00 C ATOM 3 C GLY A 1 19.635 17.405 -2.595 1.00 10.00 C ATOM 4 O GLY A 1 19.359 17.500 -1.399 1.00 10.00 O ATOM 0 H1 GLY A 1 17.241 19.378 -3.304 1.00 10.00 H new ATOM 0 H2 GLY A 1 18.192 19.229 -1.906 1.00 10.00 H new ATOM 0 H3 GLY A 1 18.629 20.337 -3.115 1.00 10.00 H new ATOM 0 HA2 GLY A 1 18.400 17.800 -4.294 1.00 10.00 H new ATOM 0 HA3 GLY A 1 19.815 18.827 -4.181 1.00 10.00 H new ATOM 10 N SER A 2 20.463 16.489 -3.076 1.00 10.00 N ATOM 11 CA SER A 2 21.108 15.515 -2.210 1.00 10.00 C ATOM 12 C SER A 2 22.471 16.032 -1.736 1.00 10.00 C ATOM 13 O SER A 2 23.410 16.139 -2.529 1.00 10.00 O ATOM 14 CB SER A 2 21.270 14.186 -2.948 1.00 10.00 C ATOM 15 OG SER A 2 20.081 13.850 -3.654 1.00 10.00 O ATOM 0 H SER A 2 20.704 16.401 -4.063 1.00 10.00 H new ATOM 0 HA SER A 2 20.479 15.358 -1.334 1.00 10.00 H new ATOM 0 HB2 SER A 2 22.105 14.252 -3.645 1.00 10.00 H new ATOM 0 HB3 SER A 2 21.510 13.397 -2.236 1.00 10.00 H new ATOM 0 HG SER A 2 20.207 12.997 -4.120 1.00 10.00 H new ATOM 21 N PRO A 3 22.590 16.386 -0.443 1.00 10.00 N ATOM 22 CA PRO A 3 23.836 16.894 0.133 1.00 10.00 C ATOM 23 C PRO A 3 24.838 15.772 0.409 1.00 10.00 C ATOM 24 O PRO A 3 24.463 14.602 0.461 1.00 10.00 O ATOM 25 CB PRO A 3 23.393 17.543 1.457 1.00 10.00 C ATOM 26 CG PRO A 3 21.903 17.424 1.509 1.00 10.00 C ATOM 27 CD PRO A 3 21.525 16.321 0.565 1.00 10.00 C ATOM 0 HA PRO A 3 24.342 17.583 -0.543 1.00 10.00 H new ATOM 0 HB2 PRO A 3 23.852 17.041 2.308 1.00 10.00 H new ATOM 0 HB3 PRO A 3 23.701 18.588 1.499 1.00 10.00 H new ATOM 0 HG2 PRO A 3 21.568 17.199 2.521 1.00 10.00 H new ATOM 0 HG3 PRO A 3 21.430 18.362 1.218 1.00 10.00 H new ATOM 0 HD2 PRO A 3 21.497 15.352 1.064 1.00 10.00 H new ATOM 0 HD3 PRO A 3 20.540 16.482 0.126 1.00 10.00 H new ATOM 35 N PRO A 4 26.127 16.113 0.609 1.00 10.00 N ATOM 36 CA PRO A 4 27.176 15.123 0.891 1.00 10.00 C ATOM 37 C PRO A 4 26.934 14.393 2.211 1.00 10.00 C ATOM 38 O PRO A 4 27.497 13.327 2.462 1.00 10.00 O ATOM 39 CB PRO A 4 28.463 15.957 0.971 1.00 10.00 C ATOM 40 CG PRO A 4 28.130 17.256 0.321 1.00 10.00 C ATOM 41 CD PRO A 4 26.669 17.479 0.567 1.00 10.00 C ATOM 0 HA PRO A 4 27.212 14.345 0.128 1.00 10.00 H new ATOM 0 HB2 PRO A 4 28.774 16.103 2.006 1.00 10.00 H new ATOM 0 HB3 PRO A 4 29.286 15.460 0.458 1.00 10.00 H new ATOM 0 HG2 PRO A 4 28.725 18.067 0.742 1.00 10.00 H new ATOM 0 HG3 PRO A 4 28.345 17.224 -0.747 1.00 10.00 H new ATOM 0 HD2 PRO A 4 26.494 18.011 1.502 1.00 10.00 H new ATOM 0 HD3 PRO A 4 26.212 18.070 -0.227 1.00 10.00 H new ATOM 49 N GLU A 5 26.081 14.978 3.046 1.00 10.00 N ATOM 50 CA GLU A 5 25.745 14.404 4.342 1.00 10.00 C ATOM 51 C GLU A 5 24.816 13.206 4.184 1.00 10.00 C ATOM 52 O GLU A 5 24.665 12.397 5.103 1.00 10.00 O ATOM 53 CB GLU A 5 25.078 15.463 5.218 1.00 10.00 C ATOM 54 CG GLU A 5 25.953 16.678 5.470 1.00 10.00 C ATOM 55 CD GLU A 5 26.929 16.465 6.606 1.00 10.00 C ATOM 56 OE1 GLU A 5 27.981 15.833 6.381 1.00 10.00 O ATOM 57 OE2 GLU A 5 26.650 16.936 7.726 1.00 10.00 O ATOM 0 H GLU A 5 25.606 15.858 2.844 1.00 10.00 H new ATOM 0 HA GLU A 5 26.666 14.064 4.816 1.00 10.00 H new ATOM 0 HB2 GLU A 5 24.151 15.785 4.743 1.00 10.00 H new ATOM 0 HB3 GLU A 5 24.808 15.015 6.174 1.00 10.00 H new ATOM 0 HG2 GLU A 5 26.505 16.918 4.561 1.00 10.00 H new ATOM 0 HG3 GLU A 5 25.320 17.537 5.695 1.00 10.00 H new ATOM 64 N ALA A 6 24.197 13.097 3.018 1.00 10.00 N ATOM 65 CA ALA A 6 23.281 12.007 2.746 1.00 10.00 C ATOM 66 C ALA A 6 24.052 10.713 2.527 1.00 10.00 C ATOM 67 O ALA A 6 24.986 10.664 1.724 1.00 10.00 O ATOM 68 CB ALA A 6 22.411 12.324 1.542 1.00 10.00 C ATOM 0 H ALA A 6 24.315 13.753 2.246 1.00 10.00 H new ATOM 0 HA ALA A 6 22.629 11.880 3.610 1.00 10.00 H new ATOM 0 HB1 ALA A 6 21.731 11.493 1.355 1.00 10.00 H new ATOM 0 HB2 ALA A 6 21.834 13.228 1.738 1.00 10.00 H new ATOM 0 HB3 ALA A 6 23.043 12.479 0.667 1.00 10.00 H new ATOM 74 N ASP A 7 23.663 9.677 3.258 1.00 10.00 N ATOM 75 CA ASP A 7 24.306 8.371 3.158 1.00 10.00 C ATOM 76 C ASP A 7 24.116 7.793 1.757 1.00 10.00 C ATOM 77 O ASP A 7 22.983 7.585 1.317 1.00 10.00 O ATOM 78 CB ASP A 7 23.718 7.424 4.204 1.00 10.00 C ATOM 79 CG ASP A 7 24.556 6.180 4.405 1.00 10.00 C ATOM 80 OD1 ASP A 7 24.469 5.251 3.573 1.00 10.00 O ATOM 81 OD2 ASP A 7 25.303 6.122 5.401 1.00 10.00 O ATOM 0 H ASP A 7 22.899 9.716 3.933 1.00 10.00 H new ATOM 0 HA ASP A 7 25.374 8.487 3.343 1.00 10.00 H new ATOM 0 HB2 ASP A 7 23.625 7.951 5.153 1.00 10.00 H new ATOM 0 HB3 ASP A 7 22.712 7.134 3.900 1.00 10.00 H new ATOM 86 N PRO A 8 25.222 7.512 1.048 1.00 10.00 N ATOM 87 CA PRO A 8 25.179 6.976 -0.320 1.00 10.00 C ATOM 88 C PRO A 8 24.558 5.584 -0.399 1.00 10.00 C ATOM 89 O PRO A 8 24.152 5.134 -1.469 1.00 10.00 O ATOM 90 CB PRO A 8 26.652 6.929 -0.737 1.00 10.00 C ATOM 91 CG PRO A 8 27.415 6.893 0.542 1.00 10.00 C ATOM 92 CD PRO A 8 26.606 7.688 1.525 1.00 10.00 C ATOM 0 HA PRO A 8 24.556 7.593 -0.967 1.00 10.00 H new ATOM 0 HB2 PRO A 8 26.862 6.050 -1.346 1.00 10.00 H new ATOM 0 HB3 PRO A 8 26.921 7.801 -1.333 1.00 10.00 H new ATOM 0 HG2 PRO A 8 27.552 5.868 0.887 1.00 10.00 H new ATOM 0 HG3 PRO A 8 28.409 7.322 0.416 1.00 10.00 H new ATOM 0 HD2 PRO A 8 26.731 7.317 2.542 1.00 10.00 H new ATOM 0 HD3 PRO A 8 26.899 8.738 1.531 1.00 10.00 H new ATOM 100 N ARG A 9 24.488 4.906 0.737 1.00 10.00 N ATOM 101 CA ARG A 9 23.917 3.572 0.785 1.00 10.00 C ATOM 102 C ARG A 9 22.438 3.650 1.138 1.00 10.00 C ATOM 103 O ARG A 9 21.615 2.940 0.566 1.00 10.00 O ATOM 104 CB ARG A 9 24.666 2.712 1.806 1.00 10.00 C ATOM 105 CG ARG A 9 26.154 2.595 1.524 1.00 10.00 C ATOM 106 CD ARG A 9 26.953 2.413 2.804 1.00 10.00 C ATOM 107 NE ARG A 9 26.866 3.583 3.680 1.00 10.00 N ATOM 108 CZ ARG A 9 27.887 4.063 4.388 1.00 10.00 C ATOM 109 NH1 ARG A 9 29.085 3.501 4.312 1.00 10.00 N ATOM 110 NH2 ARG A 9 27.711 5.116 5.172 1.00 10.00 N ATOM 0 H ARG A 9 24.819 5.258 1.635 1.00 10.00 H new ATOM 0 HA ARG A 9 24.018 3.109 -0.197 1.00 10.00 H new ATOM 0 HB2 ARG A 9 24.525 3.137 2.800 1.00 10.00 H new ATOM 0 HB3 ARG A 9 24.227 1.714 1.820 1.00 10.00 H new ATOM 0 HG2 ARG A 9 26.334 1.750 0.859 1.00 10.00 H new ATOM 0 HG3 ARG A 9 26.498 3.489 1.004 1.00 10.00 H new ATOM 0 HD2 ARG A 9 26.588 1.534 3.336 1.00 10.00 H new ATOM 0 HD3 ARG A 9 27.997 2.224 2.555 1.00 10.00 H new ATOM 0 HE ARG A 9 25.967 4.060 3.753 1.00 10.00 H new ATOM 0 HH11 ARG A 9 29.232 2.693 3.707 1.00 10.00 H new ATOM 0 HH12 ARG A 9 29.860 3.877 4.858 1.00 10.00 H new ATOM 0 HH21 ARG A 9 26.794 5.559 5.233 1.00 10.00 H new ATOM 0 HH22 ARG A 9 28.492 5.484 5.715 1.00 10.00 H new ATOM 124 N LEU A 10 22.108 4.541 2.066 1.00 10.00 N ATOM 125 CA LEU A 10 20.727 4.716 2.504 1.00 10.00 C ATOM 126 C LEU A 10 19.872 5.330 1.402 1.00 10.00 C ATOM 127 O LEU A 10 18.711 4.963 1.230 1.00 10.00 O ATOM 128 CB LEU A 10 20.664 5.596 3.753 1.00 10.00 C ATOM 129 CG LEU A 10 19.293 5.672 4.430 1.00 10.00 C ATOM 130 CD1 LEU A 10 18.890 4.314 4.990 1.00 10.00 C ATOM 131 CD2 LEU A 10 19.305 6.723 5.532 1.00 10.00 C ATOM 0 H LEU A 10 22.778 5.154 2.530 1.00 10.00 H new ATOM 0 HA LEU A 10 20.331 3.729 2.742 1.00 10.00 H new ATOM 0 HB2 LEU A 10 21.389 5.223 4.477 1.00 10.00 H new ATOM 0 HB3 LEU A 10 20.974 6.605 3.482 1.00 10.00 H new ATOM 0 HG LEU A 10 18.556 5.962 3.681 1.00 10.00 H new ATOM 0 HD11 LEU A 10 17.913 4.392 5.466 1.00 10.00 H new ATOM 0 HD12 LEU A 10 18.842 3.586 4.180 1.00 10.00 H new ATOM 0 HD13 LEU A 10 19.627 3.990 5.725 1.00 10.00 H new ATOM 0 HD21 LEU A 10 18.324 6.766 6.005 1.00 10.00 H new ATOM 0 HD22 LEU A 10 20.055 6.460 6.277 1.00 10.00 H new ATOM 0 HD23 LEU A 10 19.544 7.696 5.104 1.00 10.00 H new ATOM 143 N ILE A 11 20.452 6.255 0.644 1.00 10.00 N ATOM 144 CA ILE A 11 19.730 6.918 -0.438 1.00 10.00 C ATOM 145 C ILE A 11 19.410 5.935 -1.567 1.00 10.00 C ATOM 146 O ILE A 11 18.467 6.131 -2.331 1.00 10.00 O ATOM 147 CB ILE A 11 20.526 8.122 -0.999 1.00 10.00 C ATOM 148 CG1 ILE A 11 19.626 9.002 -1.874 1.00 10.00 C ATOM 149 CG2 ILE A 11 21.743 7.652 -1.786 1.00 10.00 C ATOM 150 CD1 ILE A 11 20.296 10.274 -2.352 1.00 10.00 C ATOM 0 H ILE A 11 21.418 6.563 0.758 1.00 10.00 H new ATOM 0 HA ILE A 11 18.795 7.291 -0.019 1.00 10.00 H new ATOM 0 HB ILE A 11 20.877 8.717 -0.156 1.00 10.00 H new ATOM 0 HG12 ILE A 11 19.301 8.426 -2.740 1.00 10.00 H new ATOM 0 HG13 ILE A 11 18.730 9.263 -1.311 1.00 10.00 H new ATOM 0 HG21 ILE A 11 22.285 8.517 -2.169 1.00 10.00 H new ATOM 0 HG22 ILE A 11 22.397 7.074 -1.133 1.00 10.00 H new ATOM 0 HG23 ILE A 11 21.419 7.029 -2.619 1.00 10.00 H new ATOM 0 HD11 ILE A 11 19.598 10.845 -2.965 1.00 10.00 H new ATOM 0 HD12 ILE A 11 20.597 10.872 -1.492 1.00 10.00 H new ATOM 0 HD13 ILE A 11 21.176 10.022 -2.944 1.00 10.00 H new ATOM 162 N GLU A 12 20.177 4.851 -1.631 1.00 10.00 N ATOM 163 CA GLU A 12 19.997 3.839 -2.662 1.00 10.00 C ATOM 164 C GLU A 12 18.761 2.986 -2.405 1.00 10.00 C ATOM 165 O GLU A 12 18.319 2.250 -3.287 1.00 10.00 O ATOM 166 CB GLU A 12 21.238 2.953 -2.758 1.00 10.00 C ATOM 167 CG GLU A 12 22.219 3.407 -3.827 1.00 10.00 C ATOM 168 CD GLU A 12 21.711 3.145 -5.229 1.00 10.00 C ATOM 169 OE1 GLU A 12 20.922 3.957 -5.748 1.00 10.00 O ATOM 170 OE2 GLU A 12 22.097 2.113 -5.819 1.00 10.00 O ATOM 0 H GLU A 12 20.933 4.652 -0.976 1.00 10.00 H new ATOM 0 HA GLU A 12 19.852 4.357 -3.610 1.00 10.00 H new ATOM 0 HB2 GLU A 12 21.743 2.941 -1.792 1.00 10.00 H new ATOM 0 HB3 GLU A 12 20.930 1.929 -2.969 1.00 10.00 H new ATOM 0 HG2 GLU A 12 22.414 4.473 -3.708 1.00 10.00 H new ATOM 0 HG3 GLU A 12 23.169 2.892 -3.686 1.00 10.00 H new ATOM 177 N SER A 13 18.204 3.085 -1.202 1.00 10.00 N ATOM 178 CA SER A 13 17.017 2.315 -0.844 1.00 10.00 C ATOM 179 C SER A 13 15.843 2.650 -1.765 1.00 10.00 C ATOM 180 O SER A 13 15.048 1.777 -2.115 1.00 10.00 O ATOM 181 CB SER A 13 16.632 2.581 0.611 1.00 10.00 C ATOM 182 OG SER A 13 17.754 2.436 1.467 1.00 10.00 O ATOM 0 H SER A 13 18.555 3.690 -0.459 1.00 10.00 H new ATOM 0 HA SER A 13 17.254 1.258 -0.964 1.00 10.00 H new ATOM 0 HB2 SER A 13 16.225 3.588 0.705 1.00 10.00 H new ATOM 0 HB3 SER A 13 15.846 1.890 0.915 1.00 10.00 H new ATOM 0 HG SER A 13 18.255 3.278 1.495 1.00 10.00 H new ATOM 188 N LEU A 14 15.746 3.915 -2.170 1.00 10.00 N ATOM 189 CA LEU A 14 14.668 4.352 -3.055 1.00 10.00 C ATOM 190 C LEU A 14 14.846 3.747 -4.441 1.00 10.00 C ATOM 191 O LEU A 14 13.914 3.177 -5.009 1.00 10.00 O ATOM 192 CB LEU A 14 14.632 5.880 -3.155 1.00 10.00 C ATOM 193 CG LEU A 14 14.103 6.609 -1.916 1.00 10.00 C ATOM 194 CD1 LEU A 14 15.245 6.964 -0.972 1.00 10.00 C ATOM 195 CD2 LEU A 14 13.337 7.859 -2.322 1.00 10.00 C ATOM 0 H LEU A 14 16.397 4.652 -1.901 1.00 10.00 H new ATOM 0 HA LEU A 14 13.723 4.009 -2.634 1.00 10.00 H new ATOM 0 HB2 LEU A 14 15.641 6.237 -3.362 1.00 10.00 H new ATOM 0 HB3 LEU A 14 14.014 6.156 -4.009 1.00 10.00 H new ATOM 0 HG LEU A 14 13.421 5.941 -1.390 1.00 10.00 H new ATOM 0 HD11 LEU A 14 14.848 7.481 -0.099 1.00 10.00 H new ATOM 0 HD12 LEU A 14 15.752 6.052 -0.655 1.00 10.00 H new ATOM 0 HD13 LEU A 14 15.954 7.613 -1.486 1.00 10.00 H new ATOM 0 HD21 LEU A 14 12.968 8.365 -1.430 1.00 10.00 H new ATOM 0 HD22 LEU A 14 13.998 8.529 -2.872 1.00 10.00 H new ATOM 0 HD23 LEU A 14 12.495 7.580 -2.956 1.00 10.00 H new ATOM 207 N SER A 15 16.055 3.864 -4.971 1.00 10.00 N ATOM 208 CA SER A 15 16.371 3.328 -6.284 1.00 10.00 C ATOM 209 C SER A 15 16.267 1.806 -6.282 1.00 10.00 C ATOM 210 O SER A 15 15.884 1.198 -7.281 1.00 10.00 O ATOM 211 CB SER A 15 17.777 3.768 -6.680 1.00 10.00 C ATOM 212 OG SER A 15 18.375 4.513 -5.631 1.00 10.00 O ATOM 0 H SER A 15 16.836 4.328 -4.508 1.00 10.00 H new ATOM 0 HA SER A 15 15.655 3.711 -7.011 1.00 10.00 H new ATOM 0 HB2 SER A 15 18.388 2.894 -6.908 1.00 10.00 H new ATOM 0 HB3 SER A 15 17.734 4.373 -7.586 1.00 10.00 H new ATOM 0 HG SER A 15 19.318 4.677 -5.842 1.00 10.00 H new ATOM 218 N GLN A 16 16.605 1.201 -5.146 1.00 10.00 N ATOM 219 CA GLN A 16 16.539 -0.247 -4.990 1.00 10.00 C ATOM 220 C GLN A 16 15.117 -0.737 -5.233 1.00 10.00 C ATOM 221 O GLN A 16 14.896 -1.703 -5.965 1.00 10.00 O ATOM 222 CB GLN A 16 17.000 -0.653 -3.588 1.00 10.00 C ATOM 223 CG GLN A 16 16.962 -2.153 -3.343 1.00 10.00 C ATOM 224 CD GLN A 16 18.032 -2.903 -4.111 1.00 10.00 C ATOM 225 OE1 GLN A 16 19.120 -2.379 -4.360 1.00 10.00 O ATOM 226 NE2 GLN A 16 17.734 -4.133 -4.496 1.00 10.00 N ATOM 0 H GLN A 16 16.929 1.696 -4.316 1.00 10.00 H new ATOM 0 HA GLN A 16 17.202 -0.706 -5.724 1.00 10.00 H new ATOM 0 HB2 GLN A 16 18.017 -0.294 -3.431 1.00 10.00 H new ATOM 0 HB3 GLN A 16 16.370 -0.157 -2.850 1.00 10.00 H new ATOM 0 HG2 GLN A 16 17.085 -2.345 -2.277 1.00 10.00 H new ATOM 0 HG3 GLN A 16 15.982 -2.538 -3.626 1.00 10.00 H new ATOM 0 HE21 GLN A 16 16.822 -4.531 -4.270 1.00 10.00 H new ATOM 0 HE22 GLN A 16 18.416 -4.683 -5.018 1.00 10.00 H new ATOM 235 N MET A 17 14.154 -0.049 -4.625 1.00 10.00 N ATOM 236 CA MET A 17 12.749 -0.403 -4.782 1.00 10.00 C ATOM 237 C MET A 17 12.336 -0.240 -6.239 1.00 10.00 C ATOM 238 O MET A 17 11.647 -1.093 -6.800 1.00 10.00 O ATOM 239 CB MET A 17 11.863 0.461 -3.878 1.00 10.00 C ATOM 240 CG MET A 17 12.132 0.266 -2.393 1.00 10.00 C ATOM 241 SD MET A 17 11.778 -1.413 -1.832 1.00 10.00 S ATOM 242 CE MET A 17 9.986 -1.411 -1.846 1.00 10.00 C ATOM 0 H MET A 17 14.322 0.755 -4.020 1.00 10.00 H new ATOM 0 HA MET A 17 12.618 -1.444 -4.487 1.00 10.00 H new ATOM 0 HB2 MET A 17 12.014 1.510 -4.131 1.00 10.00 H new ATOM 0 HB3 MET A 17 10.817 0.232 -4.082 1.00 10.00 H new ATOM 0 HG2 MET A 17 13.175 0.502 -2.183 1.00 10.00 H new ATOM 0 HG3 MET A 17 11.526 0.970 -1.823 1.00 10.00 H new ATOM 0 HE1 MET A 17 9.617 -2.321 -1.373 1.00 10.00 H new ATOM 0 HE2 MET A 17 9.619 -0.543 -1.298 1.00 10.00 H new ATOM 0 HE3 MET A 17 9.630 -1.367 -2.875 1.00 10.00 H new ATOM 252 N LEU A 18 12.795 0.847 -6.851 1.00 10.00 N ATOM 253 CA LEU A 18 12.495 1.132 -8.250 1.00 10.00 C ATOM 254 C LEU A 18 13.041 0.023 -9.149 1.00 10.00 C ATOM 255 O LEU A 18 12.366 -0.438 -10.072 1.00 10.00 O ATOM 256 CB LEU A 18 13.097 2.479 -8.653 1.00 10.00 C ATOM 257 CG LEU A 18 12.580 3.064 -9.971 1.00 10.00 C ATOM 258 CD1 LEU A 18 11.264 3.793 -9.757 1.00 10.00 C ATOM 259 CD2 LEU A 18 13.619 3.994 -10.578 1.00 10.00 C ATOM 0 H LEU A 18 13.380 1.549 -6.397 1.00 10.00 H new ATOM 0 HA LEU A 18 11.413 1.177 -8.371 1.00 10.00 H new ATOM 0 HB2 LEU A 18 12.903 3.197 -7.856 1.00 10.00 H new ATOM 0 HB3 LEU A 18 14.179 2.367 -8.725 1.00 10.00 H new ATOM 0 HG LEU A 18 12.401 2.244 -10.667 1.00 10.00 H new ATOM 0 HD11 LEU A 18 10.915 4.200 -10.706 1.00 10.00 H new ATOM 0 HD12 LEU A 18 10.522 3.097 -9.366 1.00 10.00 H new ATOM 0 HD13 LEU A 18 11.410 4.605 -9.045 1.00 10.00 H new ATOM 0 HD21 LEU A 18 13.239 4.403 -11.514 1.00 10.00 H new ATOM 0 HD22 LEU A 18 13.828 4.809 -9.884 1.00 10.00 H new ATOM 0 HD23 LEU A 18 14.536 3.438 -10.771 1.00 10.00 H new ATOM 271 N SER A 19 14.260 -0.417 -8.854 1.00 10.00 N ATOM 272 CA SER A 19 14.910 -1.470 -9.622 1.00 10.00 C ATOM 273 C SER A 19 14.202 -2.808 -9.407 1.00 10.00 C ATOM 274 O SER A 19 14.223 -3.679 -10.275 1.00 10.00 O ATOM 275 CB SER A 19 16.385 -1.580 -9.215 1.00 10.00 C ATOM 276 OG SER A 19 17.167 -2.156 -10.246 1.00 10.00 O ATOM 0 H SER A 19 14.820 -0.056 -8.082 1.00 10.00 H new ATOM 0 HA SER A 19 14.851 -1.216 -10.680 1.00 10.00 H new ATOM 0 HB2 SER A 19 16.772 -0.590 -8.974 1.00 10.00 H new ATOM 0 HB3 SER A 19 16.470 -2.184 -8.312 1.00 10.00 H new ATOM 0 HG SER A 19 18.102 -2.211 -9.956 1.00 10.00 H new ATOM 282 N MET A 20 13.554 -2.957 -8.255 1.00 10.00 N ATOM 283 CA MET A 20 12.833 -4.183 -7.923 1.00 10.00 C ATOM 284 C MET A 20 11.477 -4.230 -8.624 1.00 10.00 C ATOM 285 O MET A 20 10.734 -5.208 -8.499 1.00 10.00 O ATOM 286 CB MET A 20 12.633 -4.290 -6.410 1.00 10.00 C ATOM 287 CG MET A 20 13.850 -4.818 -5.668 1.00 10.00 C ATOM 288 SD MET A 20 14.059 -6.599 -5.854 1.00 10.00 S ATOM 289 CE MET A 20 12.712 -7.211 -4.839 1.00 10.00 C ATOM 0 H MET A 20 13.513 -2.239 -7.531 1.00 10.00 H new ATOM 0 HA MET A 20 13.432 -5.026 -8.268 1.00 10.00 H new ATOM 0 HB2 MET A 20 12.377 -3.307 -6.016 1.00 10.00 H new ATOM 0 HB3 MET A 20 11.785 -4.944 -6.210 1.00 10.00 H new ATOM 0 HG2 MET A 20 14.742 -4.311 -6.035 1.00 10.00 H new ATOM 0 HG3 MET A 20 13.758 -4.576 -4.609 1.00 10.00 H new ATOM 0 HE1 MET A 20 12.890 -8.257 -4.591 1.00 10.00 H new ATOM 0 HE2 MET A 20 12.653 -6.626 -3.921 1.00 10.00 H new ATOM 0 HE3 MET A 20 11.774 -7.122 -5.387 1.00 10.00 H new ATOM 299 N GLY A 21 11.157 -3.163 -9.344 1.00 10.00 N ATOM 300 CA GLY A 21 9.898 -3.096 -10.054 1.00 10.00 C ATOM 301 C GLY A 21 8.810 -2.460 -9.222 1.00 10.00 C ATOM 302 O GLY A 21 7.627 -2.551 -9.551 1.00 10.00 O ATOM 0 H GLY A 21 11.751 -2.340 -9.448 1.00 10.00 H new ATOM 0 HA2 GLY A 21 10.031 -2.526 -10.973 1.00 10.00 H new ATOM 0 HA3 GLY A 21 9.592 -4.101 -10.344 1.00 10.00 H new ATOM 306 N PHE A 22 9.208 -1.817 -8.135 1.00 10.00 N ATOM 307 CA PHE A 22 8.262 -1.160 -7.252 1.00 10.00 C ATOM 308 C PHE A 22 8.229 0.329 -7.539 1.00 10.00 C ATOM 309 O PHE A 22 9.264 1.000 -7.537 1.00 10.00 O ATOM 310 CB PHE A 22 8.641 -1.402 -5.790 1.00 10.00 C ATOM 311 CG PHE A 22 7.480 -1.772 -4.914 1.00 10.00 C ATOM 312 CD1 PHE A 22 6.531 -0.828 -4.557 1.00 10.00 C ATOM 313 CD2 PHE A 22 7.342 -3.067 -4.441 1.00 10.00 C ATOM 314 CE1 PHE A 22 5.464 -1.171 -3.750 1.00 10.00 C ATOM 315 CE2 PHE A 22 6.280 -3.416 -3.633 1.00 10.00 C ATOM 316 CZ PHE A 22 5.338 -2.465 -3.288 1.00 10.00 C ATOM 0 H PHE A 22 10.182 -1.737 -7.844 1.00 10.00 H new ATOM 0 HA PHE A 22 7.271 -1.578 -7.430 1.00 10.00 H new ATOM 0 HB2 PHE A 22 9.385 -2.197 -5.745 1.00 10.00 H new ATOM 0 HB3 PHE A 22 9.111 -0.502 -5.393 1.00 10.00 H new ATOM 0 HD1 PHE A 22 6.627 0.187 -4.914 1.00 10.00 H new ATOM 0 HD2 PHE A 22 8.076 -3.813 -4.709 1.00 10.00 H new ATOM 0 HE1 PHE A 22 4.729 -0.427 -3.481 1.00 10.00 H new ATOM 0 HE2 PHE A 22 6.185 -4.429 -3.271 1.00 10.00 H new ATOM 0 HZ PHE A 22 4.504 -2.735 -2.657 1.00 10.00 H new ATOM 326 N SER A 23 7.044 0.831 -7.817 1.00 10.00 N ATOM 327 CA SER A 23 6.853 2.238 -8.106 1.00 10.00 C ATOM 328 C SER A 23 5.485 2.676 -7.606 1.00 10.00 C ATOM 329 O SER A 23 4.616 1.834 -7.369 1.00 10.00 O ATOM 330 CB SER A 23 6.976 2.478 -9.613 1.00 10.00 C ATOM 331 OG SER A 23 8.147 1.862 -10.129 1.00 10.00 O ATOM 0 H SER A 23 6.188 0.277 -7.849 1.00 10.00 H new ATOM 0 HA SER A 23 7.619 2.824 -7.598 1.00 10.00 H new ATOM 0 HB2 SER A 23 6.097 2.082 -10.122 1.00 10.00 H new ATOM 0 HB3 SER A 23 7.005 3.549 -9.814 1.00 10.00 H new ATOM 0 HG SER A 23 8.205 2.026 -11.093 1.00 10.00 H new ATOM 337 N ASP A 24 5.303 3.969 -7.420 1.00 10.00 N ATOM 338 CA ASP A 24 4.027 4.488 -6.950 1.00 10.00 C ATOM 339 C ASP A 24 3.396 5.413 -7.983 1.00 10.00 C ATOM 340 O ASP A 24 4.085 6.090 -8.745 1.00 10.00 O ATOM 341 CB ASP A 24 4.167 5.212 -5.597 1.00 10.00 C ATOM 342 CG ASP A 24 5.281 6.252 -5.538 1.00 10.00 C ATOM 343 OD1 ASP A 24 5.990 6.455 -6.542 1.00 10.00 O ATOM 344 OD2 ASP A 24 5.460 6.861 -4.461 1.00 10.00 O ATOM 0 H ASP A 24 6.017 4.679 -7.585 1.00 10.00 H new ATOM 0 HA ASP A 24 3.369 3.631 -6.804 1.00 10.00 H new ATOM 0 HB2 ASP A 24 3.221 5.700 -5.363 1.00 10.00 H new ATOM 0 HB3 ASP A 24 4.343 4.468 -4.820 1.00 10.00 H new ATOM 349 N GLU A 25 2.079 5.408 -8.008 1.00 10.00 N ATOM 350 CA GLU A 25 1.312 6.231 -8.928 1.00 10.00 C ATOM 351 C GLU A 25 0.788 7.453 -8.190 1.00 10.00 C ATOM 352 O GLU A 25 0.865 8.579 -8.685 1.00 10.00 O ATOM 353 CB GLU A 25 0.140 5.432 -9.522 1.00 10.00 C ATOM 354 CG GLU A 25 0.105 3.966 -9.094 1.00 10.00 C ATOM 355 CD GLU A 25 -0.481 3.761 -7.705 1.00 10.00 C ATOM 356 OE1 GLU A 25 0.020 4.384 -6.741 1.00 10.00 O ATOM 357 OE2 GLU A 25 -1.434 2.970 -7.574 1.00 10.00 O ATOM 0 H GLU A 25 1.506 4.833 -7.390 1.00 10.00 H new ATOM 0 HA GLU A 25 1.959 6.547 -9.746 1.00 10.00 H new ATOM 0 HB2 GLU A 25 -0.796 5.908 -9.229 1.00 10.00 H new ATOM 0 HB3 GLU A 25 0.195 5.481 -10.610 1.00 10.00 H new ATOM 0 HG2 GLU A 25 -0.481 3.397 -9.816 1.00 10.00 H new ATOM 0 HG3 GLU A 25 1.118 3.563 -9.117 1.00 10.00 H new ATOM 364 N GLY A 26 0.266 7.216 -6.996 1.00 10.00 N ATOM 365 CA GLY A 26 -0.260 8.295 -6.185 1.00 10.00 C ATOM 366 C GLY A 26 0.789 8.877 -5.260 1.00 10.00 C ATOM 367 O GLY A 26 0.537 9.859 -4.566 1.00 10.00 O ATOM 0 H GLY A 26 0.197 6.291 -6.572 1.00 10.00 H new ATOM 0 HA2 GLY A 26 -0.646 9.081 -6.834 1.00 10.00 H new ATOM 0 HA3 GLY A 26 -1.100 7.928 -5.595 1.00 10.00 H new ATOM 371 N GLY A 27 1.967 8.269 -5.251 1.00 10.00 N ATOM 372 CA GLY A 27 3.047 8.748 -4.405 1.00 10.00 C ATOM 373 C GLY A 27 2.958 8.221 -2.988 1.00 10.00 C ATOM 374 O GLY A 27 3.218 8.947 -2.028 1.00 10.00 O ATOM 0 H GLY A 27 2.197 7.451 -5.815 1.00 10.00 H new ATOM 0 HA2 GLY A 27 4.002 8.451 -4.839 1.00 10.00 H new ATOM 0 HA3 GLY A 27 3.031 9.838 -4.385 1.00 10.00 H new ATOM 378 N TRP A 28 2.585 6.956 -2.849 1.00 10.00 N ATOM 379 CA TRP A 28 2.459 6.355 -1.533 1.00 10.00 C ATOM 380 C TRP A 28 3.717 5.582 -1.140 1.00 10.00 C ATOM 381 O TRP A 28 3.915 5.272 0.032 1.00 10.00 O ATOM 382 CB TRP A 28 1.220 5.455 -1.455 1.00 10.00 C ATOM 383 CG TRP A 28 1.268 4.225 -2.314 1.00 10.00 C ATOM 384 CD1 TRP A 28 1.097 4.156 -3.667 1.00 10.00 C ATOM 385 CD2 TRP A 28 1.469 2.881 -1.865 1.00 10.00 C ATOM 386 NE1 TRP A 28 1.195 2.852 -4.087 1.00 10.00 N ATOM 387 CE2 TRP A 28 1.428 2.049 -2.998 1.00 10.00 C ATOM 388 CE3 TRP A 28 1.700 2.302 -0.611 1.00 10.00 C ATOM 389 CZ2 TRP A 28 1.591 0.665 -2.912 1.00 10.00 C ATOM 390 CZ3 TRP A 28 1.860 0.933 -0.530 1.00 10.00 C ATOM 391 CH2 TRP A 28 1.811 0.129 -1.673 1.00 10.00 C ATOM 0 H TRP A 28 2.366 6.332 -3.626 1.00 10.00 H new ATOM 0 HA TRP A 28 2.337 7.168 -0.817 1.00 10.00 H new ATOM 0 HB2 TRP A 28 1.077 5.149 -0.418 1.00 10.00 H new ATOM 0 HB3 TRP A 28 0.346 6.042 -1.737 1.00 10.00 H new ATOM 0 HD1 TRP A 28 0.912 5.002 -4.312 1.00 10.00 H new ATOM 0 HE1 TRP A 28 1.109 2.532 -5.052 1.00 10.00 H new ATOM 0 HE3 TRP A 28 1.752 2.915 0.277 1.00 10.00 H new ATOM 0 HZ2 TRP A 28 1.545 0.040 -3.792 1.00 10.00 H new ATOM 0 HZ3 TRP A 28 2.026 0.475 0.434 1.00 10.00 H new ATOM 0 HH2 TRP A 28 1.950 -0.938 -1.575 1.00 10.00 H new ATOM 402 N LEU A 29 4.584 5.299 -2.109 1.00 10.00 N ATOM 403 CA LEU A 29 5.812 4.561 -1.827 1.00 10.00 C ATOM 404 C LEU A 29 6.757 5.421 -1.002 1.00 10.00 C ATOM 405 O LEU A 29 7.349 4.955 -0.028 1.00 10.00 O ATOM 406 CB LEU A 29 6.496 4.110 -3.122 1.00 10.00 C ATOM 407 CG LEU A 29 7.824 3.370 -2.939 1.00 10.00 C ATOM 408 CD1 LEU A 29 7.605 2.018 -2.279 1.00 10.00 C ATOM 409 CD2 LEU A 29 8.529 3.201 -4.278 1.00 10.00 C ATOM 0 H LEU A 29 4.461 5.566 -3.086 1.00 10.00 H new ATOM 0 HA LEU A 29 5.552 3.669 -1.257 1.00 10.00 H new ATOM 0 HB2 LEU A 29 5.811 3.462 -3.669 1.00 10.00 H new ATOM 0 HB3 LEU A 29 6.671 4.987 -3.745 1.00 10.00 H new ATOM 0 HG LEU A 29 8.459 3.968 -2.285 1.00 10.00 H new ATOM 0 HD11 LEU A 29 8.563 1.512 -2.160 1.00 10.00 H new ATOM 0 HD12 LEU A 29 7.146 2.161 -1.301 1.00 10.00 H new ATOM 0 HD13 LEU A 29 6.949 1.411 -2.903 1.00 10.00 H new ATOM 0 HD21 LEU A 29 9.471 2.673 -4.129 1.00 10.00 H new ATOM 0 HD22 LEU A 29 7.894 2.627 -4.953 1.00 10.00 H new ATOM 0 HD23 LEU A 29 8.727 4.181 -4.711 1.00 10.00 H new ATOM 421 N THR A 30 6.874 6.688 -1.380 1.00 10.00 N ATOM 422 CA THR A 30 7.736 7.617 -0.666 1.00 10.00 C ATOM 423 C THR A 30 7.210 7.855 0.751 1.00 10.00 C ATOM 424 O THR A 30 7.972 8.181 1.660 1.00 10.00 O ATOM 425 CB THR A 30 7.872 8.966 -1.416 1.00 10.00 C ATOM 426 OG1 THR A 30 8.771 9.836 -0.714 1.00 10.00 O ATOM 427 CG2 THR A 30 6.523 9.651 -1.578 1.00 10.00 C ATOM 0 H THR A 30 6.383 7.094 -2.176 1.00 10.00 H new ATOM 0 HA THR A 30 8.726 7.165 -0.609 1.00 10.00 H new ATOM 0 HB THR A 30 8.270 8.753 -2.408 1.00 10.00 H new ATOM 0 HG1 THR A 30 8.850 10.684 -1.198 1.00 10.00 H new ATOM 0 HG21 THR A 30 6.655 10.594 -2.108 1.00 10.00 H new ATOM 0 HG22 THR A 30 5.853 9.006 -2.147 1.00 10.00 H new ATOM 0 HG23 THR A 30 6.093 9.844 -0.595 1.00 10.00 H new ATOM 435 N ARG A 31 5.905 7.667 0.936 1.00 10.00 N ATOM 436 CA ARG A 31 5.284 7.844 2.241 1.00 10.00 C ATOM 437 C ARG A 31 5.465 6.584 3.077 1.00 10.00 C ATOM 438 O ARG A 31 5.614 6.650 4.299 1.00 10.00 O ATOM 439 CB ARG A 31 3.795 8.172 2.090 1.00 10.00 C ATOM 440 CG ARG A 31 3.525 9.554 1.513 1.00 10.00 C ATOM 441 CD ARG A 31 3.771 10.654 2.535 1.00 10.00 C ATOM 442 NE ARG A 31 2.661 10.789 3.482 1.00 10.00 N ATOM 443 CZ ARG A 31 2.646 11.653 4.500 1.00 10.00 C ATOM 444 NH1 ARG A 31 3.673 12.467 4.699 1.00 10.00 N ATOM 445 NH2 ARG A 31 1.598 11.711 5.312 1.00 10.00 N ATOM 0 H ARG A 31 5.259 7.392 0.196 1.00 10.00 H new ATOM 0 HA ARG A 31 5.768 8.679 2.748 1.00 10.00 H new ATOM 0 HB2 ARG A 31 3.331 7.424 1.448 1.00 10.00 H new ATOM 0 HB3 ARG A 31 3.315 8.096 3.066 1.00 10.00 H new ATOM 0 HG2 ARG A 31 4.164 9.716 0.645 1.00 10.00 H new ATOM 0 HG3 ARG A 31 2.494 9.607 1.164 1.00 10.00 H new ATOM 0 HD2 ARG A 31 4.689 10.440 3.082 1.00 10.00 H new ATOM 0 HD3 ARG A 31 3.922 11.601 2.017 1.00 10.00 H new ATOM 0 HE ARG A 31 1.849 10.185 3.356 1.00 10.00 H new ATOM 0 HH11 ARG A 31 4.478 12.435 4.074 1.00 10.00 H new ATOM 0 HH12 ARG A 31 3.658 13.126 5.478 1.00 10.00 H new ATOM 0 HH21 ARG A 31 0.800 11.094 5.160 1.00 10.00 H new ATOM 0 HH22 ARG A 31 1.590 12.372 6.088 1.00 10.00 H new ATOM 459 N LEU A 32 5.467 5.437 2.406 1.00 10.00 N ATOM 460 CA LEU A 32 5.640 4.154 3.073 1.00 10.00 C ATOM 461 C LEU A 32 7.061 4.022 3.611 1.00 10.00 C ATOM 462 O LEU A 32 7.275 3.550 4.726 1.00 10.00 O ATOM 463 CB LEU A 32 5.332 3.009 2.104 1.00 10.00 C ATOM 464 CG LEU A 32 5.336 1.609 2.723 1.00 10.00 C ATOM 465 CD1 LEU A 32 4.143 1.435 3.652 1.00 10.00 C ATOM 466 CD2 LEU A 32 5.325 0.546 1.638 1.00 10.00 C ATOM 0 H LEU A 32 5.350 5.371 1.395 1.00 10.00 H new ATOM 0 HA LEU A 32 4.945 4.101 3.911 1.00 10.00 H new ATOM 0 HB2 LEU A 32 4.355 3.187 1.656 1.00 10.00 H new ATOM 0 HB3 LEU A 32 6.063 3.033 1.295 1.00 10.00 H new ATOM 0 HG LEU A 32 6.249 1.493 3.308 1.00 10.00 H new ATOM 0 HD11 LEU A 32 4.161 0.434 4.084 1.00 10.00 H new ATOM 0 HD12 LEU A 32 4.192 2.176 4.450 1.00 10.00 H new ATOM 0 HD13 LEU A 32 3.220 1.570 3.088 1.00 10.00 H new ATOM 0 HD21 LEU A 32 5.328 -0.443 2.097 1.00 10.00 H new ATOM 0 HD22 LEU A 32 4.430 0.659 1.027 1.00 10.00 H new ATOM 0 HD23 LEU A 32 6.209 0.657 1.011 1.00 10.00 H new ATOM 478 N LEU A 33 8.029 4.481 2.818 1.00 10.00 N ATOM 479 CA LEU A 33 9.434 4.429 3.207 1.00 10.00 C ATOM 480 C LEU A 33 9.704 5.381 4.367 1.00 10.00 C ATOM 481 O LEU A 33 10.764 5.341 4.994 1.00 10.00 O ATOM 482 CB LEU A 33 10.323 4.794 2.020 1.00 10.00 C ATOM 483 CG LEU A 33 10.305 3.801 0.856 1.00 10.00 C ATOM 484 CD1 LEU A 33 11.029 4.393 -0.343 1.00 10.00 C ATOM 485 CD2 LEU A 33 10.940 2.481 1.263 1.00 10.00 C ATOM 0 H LEU A 33 7.863 4.894 1.900 1.00 10.00 H new ATOM 0 HA LEU A 33 9.665 3.413 3.527 1.00 10.00 H new ATOM 0 HB2 LEU A 33 10.018 5.771 1.646 1.00 10.00 H new ATOM 0 HB3 LEU A 33 11.349 4.894 2.374 1.00 10.00 H new ATOM 0 HG LEU A 33 9.268 3.606 0.581 1.00 10.00 H new ATOM 0 HD11 LEU A 33 11.012 3.680 -1.167 1.00 10.00 H new ATOM 0 HD12 LEU A 33 10.533 5.314 -0.649 1.00 10.00 H new ATOM 0 HD13 LEU A 33 12.062 4.610 -0.073 1.00 10.00 H new ATOM 0 HD21 LEU A 33 10.916 1.791 0.420 1.00 10.00 H new ATOM 0 HD22 LEU A 33 11.974 2.652 1.563 1.00 10.00 H new ATOM 0 HD23 LEU A 33 10.386 2.053 2.098 1.00 10.00 H new ATOM 497 N GLN A 34 8.749 6.260 4.635 1.00 10.00 N ATOM 498 CA GLN A 34 8.873 7.209 5.726 1.00 10.00 C ATOM 499 C GLN A 34 8.214 6.670 6.994 1.00 10.00 C ATOM 500 O GLN A 34 8.656 6.969 8.100 1.00 10.00 O ATOM 501 CB GLN A 34 8.259 8.556 5.338 1.00 10.00 C ATOM 502 CG GLN A 34 9.184 9.445 4.522 1.00 10.00 C ATOM 503 CD GLN A 34 10.374 9.933 5.321 1.00 10.00 C ATOM 504 OE1 GLN A 34 11.477 9.205 5.255 1.00 10.00 O flip ATOM 505 NE2 GLN A 34 10.307 10.965 5.984 1.00 10.00 N flip ATOM 0 H GLN A 34 7.878 6.334 4.109 1.00 10.00 H new ATOM 0 HA GLN A 34 9.934 7.355 5.928 1.00 10.00 H new ATOM 0 HB2 GLN A 34 7.347 8.377 4.768 1.00 10.00 H new ATOM 0 HB3 GLN A 34 7.969 9.086 6.245 1.00 10.00 H new ATOM 0 HG2 GLN A 34 9.537 8.893 3.651 1.00 10.00 H new ATOM 0 HG3 GLN A 34 8.624 10.303 4.151 1.00 10.00 H new ATOM 0 HE21 GLN A 34 9.438 11.499 6.010 1.00 10.00 H new ATOM 0 HE22 GLN A 34 11.120 11.288 6.509 1.00 10.00 H new ATOM 514 N THR A 35 7.170 5.863 6.832 1.00 10.00 N ATOM 515 CA THR A 35 6.455 5.307 7.979 1.00 10.00 C ATOM 516 C THR A 35 7.051 3.978 8.434 1.00 10.00 C ATOM 517 O THR A 35 7.248 3.752 9.625 1.00 10.00 O ATOM 518 CB THR A 35 4.955 5.115 7.673 1.00 10.00 C ATOM 519 OG1 THR A 35 4.763 4.825 6.278 1.00 10.00 O ATOM 520 CG2 THR A 35 4.162 6.355 8.061 1.00 10.00 C ATOM 0 H THR A 35 6.801 5.580 5.924 1.00 10.00 H new ATOM 0 HA THR A 35 6.564 6.032 8.786 1.00 10.00 H new ATOM 0 HB THR A 35 4.592 4.273 8.263 1.00 10.00 H new ATOM 0 HG1 THR A 35 4.981 5.619 5.746 1.00 10.00 H new ATOM 0 HG21 THR A 35 3.107 6.197 7.836 1.00 10.00 H new ATOM 0 HG22 THR A 35 4.282 6.544 9.128 1.00 10.00 H new ATOM 0 HG23 THR A 35 4.529 7.213 7.497 1.00 10.00 H new ATOM 528 N LYS A 36 7.350 3.107 7.477 1.00 10.00 N ATOM 529 CA LYS A 36 7.911 1.796 7.783 1.00 10.00 C ATOM 530 C LYS A 36 9.425 1.792 7.591 1.00 10.00 C ATOM 531 O LYS A 36 10.054 0.731 7.567 1.00 10.00 O ATOM 532 CB LYS A 36 7.255 0.734 6.895 1.00 10.00 C ATOM 533 CG LYS A 36 7.208 -0.653 7.518 1.00 10.00 C ATOM 534 CD LYS A 36 6.219 -1.548 6.788 1.00 10.00 C ATOM 535 CE LYS A 36 6.255 -2.977 7.310 1.00 10.00 C ATOM 536 NZ LYS A 36 5.712 -3.090 8.689 1.00 10.00 N ATOM 0 H LYS A 36 7.213 3.285 6.482 1.00 10.00 H new ATOM 0 HA LYS A 36 7.706 1.564 8.828 1.00 10.00 H new ATOM 0 HB2 LYS A 36 6.239 1.050 6.660 1.00 10.00 H new ATOM 0 HB3 LYS A 36 7.798 0.679 5.951 1.00 10.00 H new ATOM 0 HG2 LYS A 36 8.201 -1.102 7.488 1.00 10.00 H new ATOM 0 HG3 LYS A 36 6.926 -0.574 8.568 1.00 10.00 H new ATOM 0 HD2 LYS A 36 5.213 -1.145 6.901 1.00 10.00 H new ATOM 0 HD3 LYS A 36 6.445 -1.545 5.722 1.00 10.00 H new ATOM 0 HE2 LYS A 36 5.681 -3.619 6.642 1.00 10.00 H new ATOM 0 HE3 LYS A 36 7.283 -3.340 7.296 1.00 10.00 H new ATOM 0 HZ1 LYS A 36 5.758 -4.081 9.000 1.00 10.00 H new ATOM 0 HZ2 LYS A 36 6.275 -2.499 9.333 1.00 10.00 H new ATOM 0 HZ3 LYS A 36 4.723 -2.769 8.700 1.00 10.00 H new ATOM 550 N ASN A 37 9.996 2.993 7.464 1.00 10.00 N ATOM 551 CA ASN A 37 11.442 3.176 7.275 1.00 10.00 C ATOM 552 C ASN A 37 11.876 2.697 5.888 1.00 10.00 C ATOM 553 O ASN A 37 11.088 2.120 5.140 1.00 10.00 O ATOM 554 CB ASN A 37 12.241 2.440 8.364 1.00 10.00 C ATOM 555 CG ASN A 37 13.688 2.894 8.446 1.00 10.00 C ATOM 556 OD1 ASN A 37 13.995 4.076 8.279 1.00 10.00 O ATOM 557 ND2 ASN A 37 14.591 1.955 8.675 1.00 10.00 N ATOM 0 H ASN A 37 9.471 3.867 7.489 1.00 10.00 H new ATOM 0 HA ASN A 37 11.652 4.242 7.356 1.00 10.00 H new ATOM 0 HB2 ASN A 37 11.761 2.599 9.329 1.00 10.00 H new ATOM 0 HB3 ASN A 37 12.213 1.368 8.166 1.00 10.00 H new ATOM 0 HD21 ASN A 37 15.580 2.199 8.718 1.00 10.00 H new ATOM 0 HD22 ASN A 37 14.298 0.987 8.808 1.00 10.00 H new ATOM 564 N TYR A 38 13.136 2.941 5.547 1.00 10.00 N ATOM 565 CA TYR A 38 13.681 2.537 4.257 1.00 10.00 C ATOM 566 C TYR A 38 14.114 1.073 4.287 1.00 10.00 C ATOM 567 O TYR A 38 15.089 0.686 3.641 1.00 10.00 O ATOM 568 CB TYR A 38 14.872 3.424 3.883 1.00 10.00 C ATOM 569 CG TYR A 38 14.513 4.881 3.693 1.00 10.00 C ATOM 570 CD1 TYR A 38 13.949 5.325 2.504 1.00 10.00 C ATOM 571 CD2 TYR A 38 14.739 5.814 4.699 1.00 10.00 C ATOM 572 CE1 TYR A 38 13.623 6.653 2.321 1.00 10.00 C ATOM 573 CE2 TYR A 38 14.415 7.144 4.523 1.00 10.00 C ATOM 574 CZ TYR A 38 13.856 7.558 3.333 1.00 10.00 C ATOM 575 OH TYR A 38 13.531 8.883 3.154 1.00 10.00 O ATOM 0 H TYR A 38 13.803 3.420 6.151 1.00 10.00 H new ATOM 0 HA TYR A 38 12.900 2.653 3.506 1.00 10.00 H new ATOM 0 HB2 TYR A 38 15.630 3.345 4.662 1.00 10.00 H new ATOM 0 HB3 TYR A 38 15.319 3.047 2.963 1.00 10.00 H new ATOM 0 HD1 TYR A 38 13.762 4.618 1.709 1.00 10.00 H new ATOM 0 HD2 TYR A 38 15.175 5.493 5.633 1.00 10.00 H new ATOM 0 HE1 TYR A 38 13.187 6.981 1.389 1.00 10.00 H new ATOM 0 HE2 TYR A 38 14.598 7.857 5.314 1.00 10.00 H new ATOM 0 HH TYR A 38 12.840 9.140 3.799 1.00 10.00 H new ATOM 585 N ASP A 39 13.379 0.268 5.037 1.00 10.00 N ATOM 586 CA ASP A 39 13.677 -1.150 5.164 1.00 10.00 C ATOM 587 C ASP A 39 13.031 -1.937 4.036 1.00 10.00 C ATOM 588 O ASP A 39 11.821 -2.177 4.036 1.00 10.00 O ATOM 589 CB ASP A 39 13.204 -1.674 6.516 1.00 10.00 C ATOM 590 CG ASP A 39 14.321 -1.729 7.533 1.00 10.00 C ATOM 591 OD1 ASP A 39 15.065 -2.735 7.550 1.00 10.00 O ATOM 592 OD2 ASP A 39 14.459 -0.777 8.326 1.00 10.00 O ATOM 0 H ASP A 39 12.566 0.575 5.571 1.00 10.00 H new ATOM 0 HA ASP A 39 14.757 -1.280 5.099 1.00 10.00 H new ATOM 0 HB2 ASP A 39 12.405 -1.035 6.892 1.00 10.00 H new ATOM 0 HB3 ASP A 39 12.782 -2.671 6.389 1.00 10.00 H new ATOM 597 N ILE A 40 13.855 -2.338 3.080 1.00 10.00 N ATOM 598 CA ILE A 40 13.402 -3.096 1.919 1.00 10.00 C ATOM 599 C ILE A 40 12.708 -4.394 2.336 1.00 10.00 C ATOM 600 O ILE A 40 11.631 -4.719 1.837 1.00 10.00 O ATOM 601 CB ILE A 40 14.587 -3.430 0.987 1.00 10.00 C ATOM 602 CG1 ILE A 40 15.360 -2.154 0.635 1.00 10.00 C ATOM 603 CG2 ILE A 40 14.099 -4.123 -0.280 1.00 10.00 C ATOM 604 CD1 ILE A 40 16.826 -2.392 0.348 1.00 10.00 C ATOM 0 H ILE A 40 14.857 -2.148 3.085 1.00 10.00 H new ATOM 0 HA ILE A 40 12.686 -2.471 1.386 1.00 10.00 H new ATOM 0 HB ILE A 40 15.256 -4.112 1.512 1.00 10.00 H new ATOM 0 HG12 ILE A 40 14.899 -1.689 -0.236 1.00 10.00 H new ATOM 0 HG13 ILE A 40 15.270 -1.446 1.459 1.00 10.00 H new ATOM 0 HG21 ILE A 40 14.950 -4.349 -0.922 1.00 10.00 H new ATOM 0 HG22 ILE A 40 13.589 -5.049 -0.015 1.00 10.00 H new ATOM 0 HG23 ILE A 40 13.409 -3.467 -0.810 1.00 10.00 H new ATOM 0 HD11 ILE A 40 17.308 -1.445 0.107 1.00 10.00 H new ATOM 0 HD12 ILE A 40 17.302 -2.828 1.226 1.00 10.00 H new ATOM 0 HD13 ILE A 40 16.925 -3.075 -0.496 1.00 10.00 H new ATOM 616 N GLY A 41 13.324 -5.117 3.267 1.00 10.00 N ATOM 617 CA GLY A 41 12.764 -6.373 3.734 1.00 10.00 C ATOM 618 C GLY A 41 11.401 -6.209 4.381 1.00 10.00 C ATOM 619 O GLY A 41 10.517 -7.057 4.209 1.00 10.00 O ATOM 0 H GLY A 41 14.205 -4.854 3.708 1.00 10.00 H new ATOM 0 HA2 GLY A 41 12.681 -7.062 2.894 1.00 10.00 H new ATOM 0 HA3 GLY A 41 13.449 -6.826 4.451 1.00 10.00 H new ATOM 623 N ALA A 42 11.224 -5.119 5.114 1.00 10.00 N ATOM 624 CA ALA A 42 9.964 -4.856 5.794 1.00 10.00 C ATOM 625 C ALA A 42 8.875 -4.468 4.797 1.00 10.00 C ATOM 626 O ALA A 42 7.746 -4.958 4.870 1.00 10.00 O ATOM 627 CB ALA A 42 10.153 -3.765 6.839 1.00 10.00 C ATOM 0 H ALA A 42 11.937 -4.403 5.253 1.00 10.00 H new ATOM 0 HA ALA A 42 9.645 -5.769 6.296 1.00 10.00 H new ATOM 0 HB1 ALA A 42 9.205 -3.575 7.342 1.00 10.00 H new ATOM 0 HB2 ALA A 42 10.894 -4.086 7.571 1.00 10.00 H new ATOM 0 HB3 ALA A 42 10.495 -2.851 6.353 1.00 10.00 H new ATOM 633 N ALA A 43 9.225 -3.602 3.854 1.00 10.00 N ATOM 634 CA ALA A 43 8.288 -3.140 2.836 1.00 10.00 C ATOM 635 C ALA A 43 7.835 -4.275 1.925 1.00 10.00 C ATOM 636 O ALA A 43 6.665 -4.362 1.556 1.00 10.00 O ATOM 637 CB ALA A 43 8.921 -2.028 2.012 1.00 10.00 C ATOM 0 H ALA A 43 10.160 -3.202 3.773 1.00 10.00 H new ATOM 0 HA ALA A 43 7.405 -2.756 3.348 1.00 10.00 H new ATOM 0 HB1 ALA A 43 8.214 -1.689 1.254 1.00 10.00 H new ATOM 0 HB2 ALA A 43 9.181 -1.194 2.665 1.00 10.00 H new ATOM 0 HB3 ALA A 43 9.822 -2.403 1.526 1.00 10.00 H new ATOM 643 N LEU A 44 8.758 -5.156 1.588 1.00 10.00 N ATOM 644 CA LEU A 44 8.469 -6.279 0.707 1.00 10.00 C ATOM 645 C LEU A 44 7.453 -7.242 1.323 1.00 10.00 C ATOM 646 O LEU A 44 6.577 -7.768 0.635 1.00 10.00 O ATOM 647 CB LEU A 44 9.764 -7.018 0.389 1.00 10.00 C ATOM 648 CG LEU A 44 9.662 -8.056 -0.729 1.00 10.00 C ATOM 649 CD1 LEU A 44 9.433 -7.372 -2.070 1.00 10.00 C ATOM 650 CD2 LEU A 44 10.910 -8.936 -0.781 1.00 10.00 C ATOM 0 H LEU A 44 9.724 -5.117 1.913 1.00 10.00 H new ATOM 0 HA LEU A 44 8.029 -5.885 -0.209 1.00 10.00 H new ATOM 0 HB2 LEU A 44 10.524 -6.286 0.115 1.00 10.00 H new ATOM 0 HB3 LEU A 44 10.112 -7.515 1.294 1.00 10.00 H new ATOM 0 HG LEU A 44 8.808 -8.699 -0.515 1.00 10.00 H new ATOM 0 HD11 LEU A 44 9.363 -8.125 -2.855 1.00 10.00 H new ATOM 0 HD12 LEU A 44 8.506 -6.799 -2.033 1.00 10.00 H new ATOM 0 HD13 LEU A 44 10.266 -6.702 -2.283 1.00 10.00 H new ATOM 0 HD21 LEU A 44 10.808 -9.664 -1.586 1.00 10.00 H new ATOM 0 HD22 LEU A 44 11.786 -8.314 -0.963 1.00 10.00 H new ATOM 0 HD23 LEU A 44 11.027 -9.458 0.169 1.00 10.00 H new ATOM 662 N ASP A 45 7.563 -7.452 2.621 1.00 10.00 N ATOM 663 CA ASP A 45 6.669 -8.367 3.325 1.00 10.00 C ATOM 664 C ASP A 45 5.331 -7.700 3.647 1.00 10.00 C ATOM 665 O ASP A 45 4.379 -8.363 4.051 1.00 10.00 O ATOM 666 CB ASP A 45 7.341 -8.866 4.614 1.00 10.00 C ATOM 667 CG ASP A 45 6.874 -10.254 5.037 1.00 10.00 C ATOM 668 OD1 ASP A 45 5.955 -10.812 4.397 1.00 10.00 O ATOM 669 OD2 ASP A 45 7.443 -10.801 6.004 1.00 10.00 O ATOM 0 H ASP A 45 8.261 -7.004 3.214 1.00 10.00 H new ATOM 0 HA ASP A 45 6.468 -9.217 2.672 1.00 10.00 H new ATOM 0 HB2 ASP A 45 8.421 -8.882 4.470 1.00 10.00 H new ATOM 0 HB3 ASP A 45 7.137 -8.160 5.419 1.00 10.00 H new ATOM 674 N THR A 46 5.256 -6.391 3.437 1.00 10.00 N ATOM 675 CA THR A 46 4.046 -5.641 3.742 1.00 10.00 C ATOM 676 C THR A 46 2.865 -6.051 2.856 1.00 10.00 C ATOM 677 O THR A 46 1.717 -6.065 3.312 1.00 10.00 O ATOM 678 CB THR A 46 4.294 -4.121 3.593 1.00 10.00 C ATOM 679 OG1 THR A 46 5.342 -3.711 4.479 1.00 10.00 O ATOM 680 CG2 THR A 46 3.039 -3.325 3.905 1.00 10.00 C ATOM 0 H THR A 46 6.018 -5.829 3.057 1.00 10.00 H new ATOM 0 HA THR A 46 3.788 -5.874 4.775 1.00 10.00 H new ATOM 0 HB THR A 46 4.580 -3.928 2.559 1.00 10.00 H new ATOM 0 HG1 THR A 46 6.113 -4.307 4.372 1.00 10.00 H new ATOM 0 HG21 THR A 46 3.246 -2.261 3.791 1.00 10.00 H new ATOM 0 HG22 THR A 46 2.244 -3.616 3.219 1.00 10.00 H new ATOM 0 HG23 THR A 46 2.726 -3.526 4.929 1.00 10.00 H new ATOM 688 N ILE A 47 3.139 -6.408 1.610 1.00 10.00 N ATOM 689 CA ILE A 47 2.071 -6.765 0.688 1.00 10.00 C ATOM 690 C ILE A 47 2.071 -8.254 0.330 1.00 10.00 C ATOM 691 O ILE A 47 1.463 -8.650 -0.666 1.00 10.00 O ATOM 692 CB ILE A 47 2.152 -5.931 -0.608 1.00 10.00 C ATOM 693 CG1 ILE A 47 3.444 -6.238 -1.372 1.00 10.00 C ATOM 694 CG2 ILE A 47 2.058 -4.438 -0.298 1.00 10.00 C ATOM 695 CD1 ILE A 47 3.406 -5.769 -2.811 1.00 10.00 C ATOM 0 H ILE A 47 4.079 -6.458 1.218 1.00 10.00 H new ATOM 0 HA ILE A 47 1.140 -6.544 1.209 1.00 10.00 H new ATOM 0 HB ILE A 47 1.306 -6.205 -1.239 1.00 10.00 H new ATOM 0 HG12 ILE A 47 4.282 -5.763 -0.863 1.00 10.00 H new ATOM 0 HG13 ILE A 47 3.626 -7.313 -1.351 1.00 10.00 H new ATOM 0 HG21 ILE A 47 2.117 -3.869 -1.226 1.00 10.00 H new ATOM 0 HG22 ILE A 47 1.109 -4.228 0.196 1.00 10.00 H new ATOM 0 HG23 ILE A 47 2.880 -4.150 0.357 1.00 10.00 H new ATOM 0 HD11 ILE A 47 4.349 -6.015 -3.299 1.00 10.00 H new ATOM 0 HD12 ILE A 47 2.587 -6.264 -3.333 1.00 10.00 H new ATOM 0 HD13 ILE A 47 3.254 -4.690 -2.838 1.00 10.00 H new ATOM 707 N GLN A 48 2.759 -9.059 1.144 1.00 10.00 N ATOM 708 CA GLN A 48 2.844 -10.521 0.957 1.00 10.00 C ATOM 709 C GLN A 48 3.647 -10.935 -0.284 1.00 10.00 C ATOM 710 O GLN A 48 4.420 -11.891 -0.228 1.00 10.00 O ATOM 711 CB GLN A 48 1.445 -11.147 0.883 1.00 10.00 C ATOM 712 CG GLN A 48 1.156 -12.122 2.011 1.00 10.00 C ATOM 713 CD GLN A 48 2.079 -13.319 2.007 1.00 10.00 C ATOM 714 OE1 GLN A 48 2.435 -13.848 0.952 1.00 10.00 O ATOM 715 NE2 GLN A 48 2.487 -13.747 3.188 1.00 10.00 N ATOM 0 H GLN A 48 3.276 -8.720 1.955 1.00 10.00 H new ATOM 0 HA GLN A 48 3.378 -10.895 1.831 1.00 10.00 H new ATOM 0 HB2 GLN A 48 0.699 -10.352 0.900 1.00 10.00 H new ATOM 0 HB3 GLN A 48 1.337 -11.665 -0.070 1.00 10.00 H new ATOM 0 HG2 GLN A 48 1.247 -11.603 2.965 1.00 10.00 H new ATOM 0 HG3 GLN A 48 0.124 -12.465 1.932 1.00 10.00 H new ATOM 0 HE21 GLN A 48 2.168 -13.281 4.037 1.00 10.00 H new ATOM 0 HE22 GLN A 48 3.121 -14.544 3.251 1.00 10.00 H new ATOM 724 N TYR A 49 3.459 -10.235 -1.397 1.00 10.00 N ATOM 725 CA TYR A 49 4.155 -10.558 -2.642 1.00 10.00 C ATOM 726 C TYR A 49 5.666 -10.356 -2.523 1.00 10.00 C ATOM 727 O TYR A 49 6.195 -9.302 -2.872 1.00 10.00 O ATOM 728 CB TYR A 49 3.605 -9.716 -3.799 1.00 10.00 C ATOM 729 CG TYR A 49 2.175 -10.041 -4.179 1.00 10.00 C ATOM 730 CD1 TYR A 49 1.866 -11.227 -4.828 1.00 10.00 C ATOM 731 CD2 TYR A 49 1.137 -9.161 -3.891 1.00 10.00 C ATOM 732 CE1 TYR A 49 0.566 -11.531 -5.180 1.00 10.00 C ATOM 733 CE2 TYR A 49 -0.168 -9.460 -4.237 1.00 10.00 C ATOM 734 CZ TYR A 49 -0.447 -10.646 -4.879 1.00 10.00 C ATOM 735 OH TYR A 49 -1.746 -10.950 -5.223 1.00 10.00 O ATOM 0 H TYR A 49 2.828 -9.436 -1.465 1.00 10.00 H new ATOM 0 HA TYR A 49 3.975 -11.614 -2.846 1.00 10.00 H new ATOM 0 HB2 TYR A 49 3.666 -8.662 -3.528 1.00 10.00 H new ATOM 0 HB3 TYR A 49 4.242 -9.858 -4.672 1.00 10.00 H new ATOM 0 HD1 TYR A 49 2.656 -11.925 -5.062 1.00 10.00 H new ATOM 0 HD2 TYR A 49 1.354 -8.230 -3.389 1.00 10.00 H new ATOM 0 HE1 TYR A 49 0.344 -12.458 -5.689 1.00 10.00 H new ATOM 0 HE2 TYR A 49 -0.964 -8.768 -4.005 1.00 10.00 H new ATOM 0 HH TYR A 49 -2.338 -10.223 -4.939 1.00 10.00 H new ATOM 745 N SER A 50 6.355 -11.370 -2.014 1.00 10.00 N ATOM 746 CA SER A 50 7.804 -11.311 -1.864 1.00 10.00 C ATOM 747 C SER A 50 8.479 -12.288 -2.823 1.00 10.00 C ATOM 748 O SER A 50 9.683 -12.207 -3.068 1.00 10.00 O ATOM 749 CB SER A 50 8.212 -11.636 -0.425 1.00 10.00 C ATOM 750 OG SER A 50 7.079 -11.702 0.423 1.00 10.00 O ATOM 0 H SER A 50 5.934 -12.243 -1.698 1.00 10.00 H new ATOM 0 HA SER A 50 8.128 -10.298 -2.101 1.00 10.00 H new ATOM 0 HB2 SER A 50 8.745 -12.587 -0.400 1.00 10.00 H new ATOM 0 HB3 SER A 50 8.901 -10.875 -0.058 1.00 10.00 H new ATOM 0 HG SER A 50 7.366 -11.913 1.336 1.00 10.00 H new ATOM 756 N LYS A 51 7.693 -13.210 -3.369 1.00 10.00 N ATOM 757 CA LYS A 51 8.212 -14.204 -4.299 1.00 10.00 C ATOM 758 C LYS A 51 7.681 -13.946 -5.705 1.00 10.00 C ATOM 759 O LYS A 51 8.411 -13.472 -6.575 1.00 10.00 O ATOM 760 CB LYS A 51 7.826 -15.613 -3.848 1.00 10.00 C ATOM 761 CG LYS A 51 8.222 -15.929 -2.416 1.00 10.00 C ATOM 762 CD LYS A 51 7.509 -17.165 -1.899 1.00 10.00 C ATOM 763 CE LYS A 51 8.108 -18.444 -2.458 1.00 10.00 C ATOM 764 NZ LYS A 51 7.364 -19.649 -1.997 1.00 10.00 N ATOM 0 H LYS A 51 6.693 -13.289 -3.183 1.00 10.00 H new ATOM 0 HA LYS A 51 9.299 -14.124 -4.312 1.00 10.00 H new ATOM 0 HB2 LYS A 51 6.748 -15.735 -3.952 1.00 10.00 H new ATOM 0 HB3 LYS A 51 8.295 -16.338 -4.513 1.00 10.00 H new ATOM 0 HG2 LYS A 51 9.300 -16.080 -2.361 1.00 10.00 H new ATOM 0 HG3 LYS A 51 7.987 -15.078 -1.777 1.00 10.00 H new ATOM 0 HD2 LYS A 51 7.562 -17.185 -0.810 1.00 10.00 H new ATOM 0 HD3 LYS A 51 6.453 -17.113 -2.166 1.00 10.00 H new ATOM 0 HE2 LYS A 51 8.098 -18.405 -3.547 1.00 10.00 H new ATOM 0 HE3 LYS A 51 9.151 -18.521 -2.152 1.00 10.00 H new ATOM 0 HZ1 LYS A 51 7.802 -20.502 -2.399 1.00 10.00 H new ATOM 0 HZ2 LYS A 51 7.395 -19.700 -0.959 1.00 10.00 H new ATOM 0 HZ3 LYS A 51 6.374 -19.587 -2.311 1.00 10.00 H new ATOM 778 N HIS A 52 6.405 -14.242 -5.911 1.00 10.00 N ATOM 779 CA HIS A 52 5.762 -14.047 -7.201 1.00 10.00 C ATOM 780 C HIS A 52 4.253 -14.127 -7.021 1.00 10.00 C ATOM 781 O HIS A 52 3.513 -13.733 -7.948 1.00 10.00 O ATOM 782 CB HIS A 52 6.228 -15.109 -8.205 1.00 10.00 C ATOM 783 CG HIS A 52 6.101 -14.683 -9.636 1.00 10.00 C ATOM 784 ND1 HIS A 52 5.010 -14.003 -10.123 1.00 10.00 N ATOM 785 CD2 HIS A 52 6.938 -14.844 -10.687 1.00 10.00 C ATOM 786 CE1 HIS A 52 5.176 -13.765 -11.407 1.00 10.00 C ATOM 787 NE2 HIS A 52 6.338 -14.266 -11.777 1.00 10.00 N ATOM 788 OXT HIS A 52 3.820 -14.595 -5.948 1.00 10.00 O ATOM 0 H HIS A 52 5.790 -14.622 -5.192 1.00 10.00 H new ATOM 0 HA HIS A 52 6.036 -13.067 -7.592 1.00 10.00 H new ATOM 0 HB2 HIS A 52 7.269 -15.357 -8.000 1.00 10.00 H new ATOM 0 HB3 HIS A 52 5.647 -16.019 -8.053 1.00 10.00 H new ATOM 0 HD1 HIS A 52 4.197 -13.725 -9.574 1.00 10.00 H new ATOM 0 HD2 HIS A 52 7.899 -15.336 -10.671 1.00 10.00 H new ATOM 0 HE1 HIS A 52 4.478 -13.247 -12.049 1.00 10.00 H new TER 797 HIS A 52 ATOM 798 N GLY B 1 -17.866 19.417 1.735 1.00 10.00 N ATOM 799 CA GLY B 1 -18.437 18.402 2.653 1.00 10.00 C ATOM 800 C GLY B 1 -19.154 17.303 1.905 1.00 10.00 C ATOM 801 O GLY B 1 -18.812 16.999 0.763 1.00 10.00 O ATOM 0 H1 GLY B 1 -16.914 19.682 2.059 1.00 10.00 H new ATOM 0 H2 GLY B 1 -17.807 19.022 0.775 1.00 10.00 H new ATOM 0 H3 GLY B 1 -18.476 20.259 1.726 1.00 10.00 H new ATOM 0 HA2 GLY B 1 -17.639 17.969 3.256 1.00 10.00 H new ATOM 0 HA3 GLY B 1 -19.131 18.885 3.341 1.00 10.00 H new ATOM 807 N SER B 2 -20.146 16.708 2.548 1.00 10.00 N ATOM 808 CA SER B 2 -20.918 15.639 1.939 1.00 10.00 C ATOM 809 C SER B 2 -22.256 16.168 1.435 1.00 10.00 C ATOM 810 O SER B 2 -23.162 16.442 2.219 1.00 10.00 O ATOM 811 CB SER B 2 -21.137 14.517 2.951 1.00 10.00 C ATOM 812 OG SER B 2 -19.932 14.208 3.632 1.00 10.00 O ATOM 0 H SER B 2 -20.436 16.949 3.496 1.00 10.00 H new ATOM 0 HA SER B 2 -20.363 15.245 1.088 1.00 10.00 H new ATOM 0 HB2 SER B 2 -21.900 14.814 3.670 1.00 10.00 H new ATOM 0 HB3 SER B 2 -21.509 13.629 2.440 1.00 10.00 H new ATOM 0 HG SER B 2 -20.096 13.488 4.276 1.00 10.00 H new ATOM 818 N PRO B 3 -22.385 16.345 0.113 1.00 10.00 N ATOM 819 CA PRO B 3 -23.609 16.846 -0.494 1.00 10.00 C ATOM 820 C PRO B 3 -24.617 15.734 -0.783 1.00 10.00 C ATOM 821 O PRO B 3 -24.241 14.568 -0.918 1.00 10.00 O ATOM 822 CB PRO B 3 -23.099 17.462 -1.794 1.00 10.00 C ATOM 823 CG PRO B 3 -21.931 16.615 -2.180 1.00 10.00 C ATOM 824 CD PRO B 3 -21.341 16.077 -0.898 1.00 10.00 C ATOM 0 HA PRO B 3 -24.145 17.540 0.154 1.00 10.00 H new ATOM 0 HB2 PRO B 3 -23.868 17.452 -2.566 1.00 10.00 H new ATOM 0 HB3 PRO B 3 -22.805 18.502 -1.651 1.00 10.00 H new ATOM 0 HG2 PRO B 3 -22.243 15.801 -2.834 1.00 10.00 H new ATOM 0 HG3 PRO B 3 -21.194 17.200 -2.729 1.00 10.00 H new ATOM 0 HD2 PRO B 3 -21.123 15.012 -0.975 1.00 10.00 H new ATOM 0 HD3 PRO B 3 -20.405 16.577 -0.648 1.00 10.00 H new ATOM 832 N PRO B 4 -25.914 16.078 -0.892 1.00 10.00 N ATOM 833 CA PRO B 4 -26.977 15.100 -1.180 1.00 10.00 C ATOM 834 C PRO B 4 -26.825 14.485 -2.571 1.00 10.00 C ATOM 835 O PRO B 4 -27.481 13.501 -2.908 1.00 10.00 O ATOM 836 CB PRO B 4 -28.270 15.925 -1.110 1.00 10.00 C ATOM 837 CG PRO B 4 -27.900 17.185 -0.402 1.00 10.00 C ATOM 838 CD PRO B 4 -26.456 17.437 -0.729 1.00 10.00 C ATOM 0 HA PRO B 4 -26.955 14.264 -0.480 1.00 10.00 H new ATOM 0 HB2 PRO B 4 -28.657 16.134 -2.107 1.00 10.00 H new ATOM 0 HB3 PRO B 4 -29.050 15.387 -0.572 1.00 10.00 H new ATOM 0 HG2 PRO B 4 -28.525 18.015 -0.731 1.00 10.00 H new ATOM 0 HG3 PRO B 4 -28.044 17.085 0.674 1.00 10.00 H new ATOM 0 HD2 PRO B 4 -26.345 18.028 -1.638 1.00 10.00 H new ATOM 0 HD3 PRO B 4 -25.950 17.981 0.069 1.00 10.00 H new ATOM 846 N GLU B 5 -25.955 15.089 -3.372 1.00 10.00 N ATOM 847 CA GLU B 5 -25.691 14.623 -4.727 1.00 10.00 C ATOM 848 C GLU B 5 -24.733 13.433 -4.716 1.00 10.00 C ATOM 849 O GLU B 5 -24.596 12.722 -5.713 1.00 10.00 O ATOM 850 CB GLU B 5 -25.093 15.757 -5.557 1.00 10.00 C ATOM 851 CG GLU B 5 -25.931 17.023 -5.556 1.00 10.00 C ATOM 852 CD GLU B 5 -27.108 16.944 -6.506 1.00 10.00 C ATOM 853 OE1 GLU B 5 -26.896 17.059 -7.733 1.00 10.00 O ATOM 854 OE2 GLU B 5 -28.251 16.779 -6.032 1.00 10.00 O ATOM 0 H GLU B 5 -25.415 15.911 -3.102 1.00 10.00 H new ATOM 0 HA GLU B 5 -26.634 14.304 -5.170 1.00 10.00 H new ATOM 0 HB2 GLU B 5 -24.099 15.990 -5.175 1.00 10.00 H new ATOM 0 HB3 GLU B 5 -24.968 15.416 -6.585 1.00 10.00 H new ATOM 0 HG2 GLU B 5 -26.296 17.212 -4.546 1.00 10.00 H new ATOM 0 HG3 GLU B 5 -25.303 17.870 -5.831 1.00 10.00 H new ATOM 861 N ALA B 6 -24.069 13.219 -3.587 1.00 10.00 N ATOM 862 CA ALA B 6 -23.123 12.121 -3.454 1.00 10.00 C ATOM 863 C ALA B 6 -23.843 10.833 -3.074 1.00 10.00 C ATOM 864 O ALA B 6 -24.782 10.851 -2.278 1.00 10.00 O ATOM 865 CB ALA B 6 -22.055 12.460 -2.426 1.00 10.00 C ATOM 0 H ALA B 6 -24.169 13.793 -2.750 1.00 10.00 H new ATOM 0 HA ALA B 6 -22.637 11.968 -4.418 1.00 10.00 H new ATOM 0 HB1 ALA B 6 -21.356 11.628 -2.339 1.00 10.00 H new ATOM 0 HB2 ALA B 6 -21.517 13.354 -2.741 1.00 10.00 H new ATOM 0 HB3 ALA B 6 -22.525 12.641 -1.459 1.00 10.00 H new ATOM 871 N ASP B 7 -23.402 9.725 -3.658 1.00 10.00 N ATOM 872 CA ASP B 7 -23.994 8.417 -3.385 1.00 10.00 C ATOM 873 C ASP B 7 -23.744 8.009 -1.933 1.00 10.00 C ATOM 874 O ASP B 7 -22.595 7.908 -1.496 1.00 10.00 O ATOM 875 CB ASP B 7 -23.416 7.366 -4.337 1.00 10.00 C ATOM 876 CG ASP B 7 -24.133 6.029 -4.267 1.00 10.00 C ATOM 877 OD1 ASP B 7 -24.220 5.437 -3.171 1.00 10.00 O ATOM 878 OD2 ASP B 7 -24.596 5.550 -5.318 1.00 10.00 O ATOM 0 H ASP B 7 -22.633 9.705 -4.327 1.00 10.00 H new ATOM 0 HA ASP B 7 -25.070 8.483 -3.546 1.00 10.00 H new ATOM 0 HB2 ASP B 7 -23.467 7.744 -5.358 1.00 10.00 H new ATOM 0 HB3 ASP B 7 -22.362 7.217 -4.105 1.00 10.00 H new ATOM 883 N PRO B 8 -24.822 7.753 -1.175 1.00 10.00 N ATOM 884 CA PRO B 8 -24.734 7.372 0.242 1.00 10.00 C ATOM 885 C PRO B 8 -24.052 6.023 0.472 1.00 10.00 C ATOM 886 O PRO B 8 -23.565 5.753 1.567 1.00 10.00 O ATOM 887 CB PRO B 8 -26.200 7.308 0.684 1.00 10.00 C ATOM 888 CG PRO B 8 -26.970 7.084 -0.570 1.00 10.00 C ATOM 889 CD PRO B 8 -26.218 7.812 -1.643 1.00 10.00 C ATOM 0 HA PRO B 8 -24.125 8.082 0.802 1.00 10.00 H new ATOM 0 HB2 PRO B 8 -26.363 6.500 1.397 1.00 10.00 H new ATOM 0 HB3 PRO B 8 -26.505 8.232 1.175 1.00 10.00 H new ATOM 0 HG2 PRO B 8 -27.046 6.021 -0.798 1.00 10.00 H new ATOM 0 HG3 PRO B 8 -27.987 7.464 -0.478 1.00 10.00 H new ATOM 0 HD2 PRO B 8 -26.338 7.333 -2.615 1.00 10.00 H new ATOM 0 HD3 PRO B 8 -26.564 8.840 -1.750 1.00 10.00 H new ATOM 897 N ARG B 9 -24.027 5.181 -0.549 1.00 10.00 N ATOM 898 CA ARG B 9 -23.410 3.865 -0.446 1.00 10.00 C ATOM 899 C ARG B 9 -21.966 3.912 -0.925 1.00 10.00 C ATOM 900 O ARG B 9 -21.082 3.299 -0.324 1.00 10.00 O ATOM 901 CB ARG B 9 -24.196 2.841 -1.262 1.00 10.00 C ATOM 902 CG ARG B 9 -25.687 2.855 -0.980 1.00 10.00 C ATOM 903 CD ARG B 9 -26.480 2.402 -2.192 1.00 10.00 C ATOM 904 NE ARG B 9 -26.242 3.262 -3.353 1.00 10.00 N ATOM 905 CZ ARG B 9 -26.915 3.158 -4.498 1.00 10.00 C ATOM 906 NH1 ARG B 9 -27.860 2.240 -4.633 1.00 10.00 N ATOM 907 NH2 ARG B 9 -26.643 3.970 -5.507 1.00 10.00 N ATOM 0 H ARG B 9 -24.429 5.386 -1.464 1.00 10.00 H new ATOM 0 HA ARG B 9 -23.422 3.565 0.602 1.00 10.00 H new ATOM 0 HB2 ARG B 9 -24.033 3.032 -2.323 1.00 10.00 H new ATOM 0 HB3 ARG B 9 -23.805 1.845 -1.054 1.00 10.00 H new ATOM 0 HG2 ARG B 9 -25.906 2.203 -0.135 1.00 10.00 H new ATOM 0 HG3 ARG B 9 -25.996 3.861 -0.695 1.00 10.00 H new ATOM 0 HD2 ARG B 9 -26.210 1.375 -2.439 1.00 10.00 H new ATOM 0 HD3 ARG B 9 -27.543 2.403 -1.951 1.00 10.00 H new ATOM 0 HE ARG B 9 -25.521 3.980 -3.281 1.00 10.00 H new ATOM 0 HH11 ARG B 9 -28.074 1.611 -3.859 1.00 10.00 H new ATOM 0 HH12 ARG B 9 -28.374 2.162 -5.511 1.00 10.00 H new ATOM 0 HH21 ARG B 9 -25.916 4.679 -5.410 1.00 10.00 H new ATOM 0 HH22 ARG B 9 -27.161 3.887 -6.382 1.00 10.00 H new ATOM 921 N LEU B 10 -21.735 4.643 -2.008 1.00 10.00 N ATOM 922 CA LEU B 10 -20.394 4.773 -2.574 1.00 10.00 C ATOM 923 C LEU B 10 -19.462 5.458 -1.584 1.00 10.00 C ATOM 924 O LEU B 10 -18.293 5.088 -1.455 1.00 10.00 O ATOM 925 CB LEU B 10 -20.439 5.569 -3.878 1.00 10.00 C ATOM 926 CG LEU B 10 -19.156 5.536 -4.713 1.00 10.00 C ATOM 927 CD1 LEU B 10 -18.951 4.160 -5.329 1.00 10.00 C ATOM 928 CD2 LEU B 10 -19.197 6.608 -5.792 1.00 10.00 C ATOM 0 H LEU B 10 -22.457 5.156 -2.514 1.00 10.00 H new ATOM 0 HA LEU B 10 -20.014 3.773 -2.783 1.00 10.00 H new ATOM 0 HB2 LEU B 10 -21.259 5.189 -4.488 1.00 10.00 H new ATOM 0 HB3 LEU B 10 -20.672 6.607 -3.642 1.00 10.00 H new ATOM 0 HG LEU B 10 -18.312 5.742 -4.055 1.00 10.00 H new ATOM 0 HD11 LEU B 10 -18.034 4.158 -5.918 1.00 10.00 H new ATOM 0 HD12 LEU B 10 -18.875 3.415 -4.537 1.00 10.00 H new ATOM 0 HD13 LEU B 10 -19.797 3.920 -5.973 1.00 10.00 H new ATOM 0 HD21 LEU B 10 -18.278 6.571 -6.377 1.00 10.00 H new ATOM 0 HD22 LEU B 10 -20.051 6.433 -6.447 1.00 10.00 H new ATOM 0 HD23 LEU B 10 -19.292 7.589 -5.327 1.00 10.00 H new ATOM 940 N ILE B 11 -19.988 6.446 -0.871 1.00 10.00 N ATOM 941 CA ILE B 11 -19.203 7.178 0.113 1.00 10.00 C ATOM 942 C ILE B 11 -18.891 6.301 1.332 1.00 10.00 C ATOM 943 O ILE B 11 -17.986 6.596 2.107 1.00 10.00 O ATOM 944 CB ILE B 11 -19.934 8.466 0.563 1.00 10.00 C ATOM 945 CG1 ILE B 11 -18.949 9.440 1.220 1.00 10.00 C ATOM 946 CG2 ILE B 11 -21.084 8.139 1.510 1.00 10.00 C ATOM 947 CD1 ILE B 11 -19.544 10.802 1.508 1.00 10.00 C ATOM 0 H ILE B 11 -20.955 6.758 -0.956 1.00 10.00 H new ATOM 0 HA ILE B 11 -18.264 7.460 -0.363 1.00 10.00 H new ATOM 0 HB ILE B 11 -20.354 8.945 -0.321 1.00 10.00 H new ATOM 0 HG12 ILE B 11 -18.589 9.006 2.153 1.00 10.00 H new ATOM 0 HG13 ILE B 11 -18.083 9.561 0.570 1.00 10.00 H new ATOM 0 HG21 ILE B 11 -21.581 9.061 1.811 1.00 10.00 H new ATOM 0 HG22 ILE B 11 -21.799 7.490 1.004 1.00 10.00 H new ATOM 0 HG23 ILE B 11 -20.695 7.631 2.393 1.00 10.00 H new ATOM 0 HD11 ILE B 11 -18.790 11.438 1.972 1.00 10.00 H new ATOM 0 HD12 ILE B 11 -19.878 11.257 0.576 1.00 10.00 H new ATOM 0 HD13 ILE B 11 -20.393 10.693 2.183 1.00 10.00 H new ATOM 959 N GLU B 12 -19.624 5.204 1.473 1.00 10.00 N ATOM 960 CA GLU B 12 -19.429 4.296 2.595 1.00 10.00 C ATOM 961 C GLU B 12 -18.202 3.414 2.404 1.00 10.00 C ATOM 962 O GLU B 12 -17.764 2.747 3.340 1.00 10.00 O ATOM 963 CB GLU B 12 -20.667 3.424 2.809 1.00 10.00 C ATOM 964 CG GLU B 12 -21.826 4.154 3.464 1.00 10.00 C ATOM 965 CD GLU B 12 -21.434 4.858 4.749 1.00 10.00 C ATOM 966 OE1 GLU B 12 -20.397 4.502 5.342 1.00 10.00 O ATOM 967 OE2 GLU B 12 -22.173 5.773 5.177 1.00 10.00 O ATOM 0 H GLU B 12 -20.359 4.922 0.824 1.00 10.00 H new ATOM 0 HA GLU B 12 -19.268 4.912 3.480 1.00 10.00 H new ATOM 0 HB2 GLU B 12 -20.995 3.032 1.846 1.00 10.00 H new ATOM 0 HB3 GLU B 12 -20.394 2.568 3.426 1.00 10.00 H new ATOM 0 HG2 GLU B 12 -22.229 4.886 2.764 1.00 10.00 H new ATOM 0 HG3 GLU B 12 -22.624 3.442 3.675 1.00 10.00 H new ATOM 974 N SER B 13 -17.658 3.400 1.189 1.00 10.00 N ATOM 975 CA SER B 13 -16.480 2.593 0.884 1.00 10.00 C ATOM 976 C SER B 13 -15.333 2.892 1.855 1.00 10.00 C ATOM 977 O SER B 13 -14.569 1.998 2.219 1.00 10.00 O ATOM 978 CB SER B 13 -16.033 2.843 -0.556 1.00 10.00 C ATOM 979 OG SER B 13 -17.116 2.679 -1.460 1.00 10.00 O ATOM 0 H SER B 13 -18.015 3.939 0.400 1.00 10.00 H new ATOM 0 HA SER B 13 -16.750 1.543 0.999 1.00 10.00 H new ATOM 0 HB2 SER B 13 -15.629 3.852 -0.645 1.00 10.00 H new ATOM 0 HB3 SER B 13 -15.230 2.154 -0.816 1.00 10.00 H new ATOM 0 HG SER B 13 -17.617 3.519 -1.526 1.00 10.00 H new ATOM 985 N LEU B 14 -15.233 4.145 2.289 1.00 10.00 N ATOM 986 CA LEU B 14 -14.185 4.546 3.219 1.00 10.00 C ATOM 987 C LEU B 14 -14.444 3.962 4.610 1.00 10.00 C ATOM 988 O LEU B 14 -13.536 3.422 5.246 1.00 10.00 O ATOM 989 CB LEU B 14 -14.081 6.071 3.289 1.00 10.00 C ATOM 990 CG LEU B 14 -13.600 6.753 2.001 1.00 10.00 C ATOM 991 CD1 LEU B 14 -14.779 7.286 1.198 1.00 10.00 C ATOM 992 CD2 LEU B 14 -12.621 7.873 2.324 1.00 10.00 C ATOM 0 H LEU B 14 -15.863 4.897 2.012 1.00 10.00 H new ATOM 0 HA LEU B 14 -13.236 4.153 2.853 1.00 10.00 H new ATOM 0 HB2 LEU B 14 -15.059 6.474 3.551 1.00 10.00 H new ATOM 0 HB3 LEU B 14 -13.400 6.336 4.098 1.00 10.00 H new ATOM 0 HG LEU B 14 -13.085 6.009 1.393 1.00 10.00 H new ATOM 0 HD11 LEU B 14 -14.414 7.765 0.290 1.00 10.00 H new ATOM 0 HD12 LEU B 14 -15.441 6.462 0.932 1.00 10.00 H new ATOM 0 HD13 LEU B 14 -15.328 8.013 1.796 1.00 10.00 H new ATOM 0 HD21 LEU B 14 -12.290 8.345 1.399 1.00 10.00 H new ATOM 0 HD22 LEU B 14 -13.112 8.614 2.955 1.00 10.00 H new ATOM 0 HD23 LEU B 14 -11.759 7.462 2.850 1.00 10.00 H new ATOM 1004 N SER B 15 -15.688 4.057 5.071 1.00 10.00 N ATOM 1005 CA SER B 15 -16.064 3.529 6.377 1.00 10.00 C ATOM 1006 C SER B 15 -15.943 2.006 6.395 1.00 10.00 C ATOM 1007 O SER B 15 -15.534 1.419 7.398 1.00 10.00 O ATOM 1008 CB SER B 15 -17.496 3.941 6.719 1.00 10.00 C ATOM 1009 OG SER B 15 -17.885 5.096 5.994 1.00 10.00 O ATOM 0 H SER B 15 -16.453 4.495 4.558 1.00 10.00 H new ATOM 0 HA SER B 15 -15.386 3.942 7.124 1.00 10.00 H new ATOM 0 HB2 SER B 15 -18.177 3.120 6.493 1.00 10.00 H new ATOM 0 HB3 SER B 15 -17.575 4.136 7.788 1.00 10.00 H new ATOM 0 HG SER B 15 -18.838 5.039 5.774 1.00 10.00 H new ATOM 1015 N GLN B 16 -16.292 1.378 5.274 1.00 10.00 N ATOM 1016 CA GLN B 16 -16.226 -0.076 5.146 1.00 10.00 C ATOM 1017 C GLN B 16 -14.806 -0.579 5.385 1.00 10.00 C ATOM 1018 O GLN B 16 -14.603 -1.562 6.097 1.00 10.00 O ATOM 1019 CB GLN B 16 -16.707 -0.510 3.760 1.00 10.00 C ATOM 1020 CG GLN B 16 -17.826 -1.539 3.798 1.00 10.00 C ATOM 1021 CD GLN B 16 -19.123 -0.974 4.347 1.00 10.00 C ATOM 1022 OE1 GLN B 16 -19.414 0.213 4.195 1.00 10.00 O ATOM 1023 NE2 GLN B 16 -19.909 -1.819 4.986 1.00 10.00 N ATOM 0 H GLN B 16 -16.625 1.857 4.437 1.00 10.00 H new ATOM 0 HA GLN B 16 -16.879 -0.512 5.902 1.00 10.00 H new ATOM 0 HB2 GLN B 16 -17.050 0.368 3.213 1.00 10.00 H new ATOM 0 HB3 GLN B 16 -15.864 -0.922 3.205 1.00 10.00 H new ATOM 0 HG2 GLN B 16 -17.998 -1.920 2.791 1.00 10.00 H new ATOM 0 HG3 GLN B 16 -17.515 -2.385 4.411 1.00 10.00 H new ATOM 0 HE21 GLN B 16 -19.631 -2.795 5.090 1.00 10.00 H new ATOM 0 HE22 GLN B 16 -20.795 -1.497 5.376 1.00 10.00 H new ATOM 1032 N MET B 17 -13.833 0.111 4.801 1.00 10.00 N ATOM 1033 CA MET B 17 -12.431 -0.263 4.950 1.00 10.00 C ATOM 1034 C MET B 17 -11.968 -0.022 6.379 1.00 10.00 C ATOM 1035 O MET B 17 -11.238 -0.831 6.953 1.00 10.00 O ATOM 1036 CB MET B 17 -11.550 0.527 3.979 1.00 10.00 C ATOM 1037 CG MET B 17 -11.834 0.229 2.516 1.00 10.00 C ATOM 1038 SD MET B 17 -11.667 -1.520 2.111 1.00 10.00 S ATOM 1039 CE MET B 17 -9.906 -1.763 2.347 1.00 10.00 C ATOM 0 H MET B 17 -13.989 0.934 4.219 1.00 10.00 H new ATOM 0 HA MET B 17 -12.338 -1.324 4.719 1.00 10.00 H new ATOM 0 HB2 MET B 17 -11.693 1.593 4.158 1.00 10.00 H new ATOM 0 HB3 MET B 17 -10.504 0.306 4.189 1.00 10.00 H new ATOM 0 HG2 MET B 17 -12.844 0.558 2.273 1.00 10.00 H new ATOM 0 HG3 MET B 17 -11.152 0.808 1.893 1.00 10.00 H new ATOM 0 HE1 MET B 17 -9.613 -2.728 1.934 1.00 10.00 H new ATOM 0 HE2 MET B 17 -9.358 -0.970 1.839 1.00 10.00 H new ATOM 0 HE3 MET B 17 -9.675 -1.739 3.412 1.00 10.00 H new ATOM 1049 N LEU B 18 -12.408 1.093 6.954 1.00 10.00 N ATOM 1050 CA LEU B 18 -12.043 1.445 8.321 1.00 10.00 C ATOM 1051 C LEU B 18 -12.589 0.401 9.298 1.00 10.00 C ATOM 1052 O LEU B 18 -11.897 -0.028 10.222 1.00 10.00 O ATOM 1053 CB LEU B 18 -12.582 2.838 8.663 1.00 10.00 C ATOM 1054 CG LEU B 18 -11.963 3.506 9.892 1.00 10.00 C ATOM 1055 CD1 LEU B 18 -10.458 3.675 9.716 1.00 10.00 C ATOM 1056 CD2 LEU B 18 -12.627 4.851 10.145 1.00 10.00 C ATOM 0 H LEU B 18 -13.018 1.768 6.494 1.00 10.00 H new ATOM 0 HA LEU B 18 -10.957 1.461 8.407 1.00 10.00 H new ATOM 0 HB2 LEU B 18 -12.427 3.489 7.802 1.00 10.00 H new ATOM 0 HB3 LEU B 18 -13.659 2.763 8.817 1.00 10.00 H new ATOM 0 HG LEU B 18 -12.131 2.864 10.757 1.00 10.00 H new ATOM 0 HD11 LEU B 18 -10.039 4.152 10.602 1.00 10.00 H new ATOM 0 HD12 LEU B 18 -9.996 2.698 9.578 1.00 10.00 H new ATOM 0 HD13 LEU B 18 -10.261 4.296 8.842 1.00 10.00 H new ATOM 0 HD21 LEU B 18 -12.179 5.319 11.022 1.00 10.00 H new ATOM 0 HD22 LEU B 18 -12.485 5.496 9.278 1.00 10.00 H new ATOM 0 HD23 LEU B 18 -13.693 4.704 10.317 1.00 10.00 H new ATOM 1068 N SER B 19 -13.830 -0.020 9.066 1.00 10.00 N ATOM 1069 CA SER B 19 -14.482 -1.021 9.904 1.00 10.00 C ATOM 1070 C SER B 19 -13.867 -2.402 9.691 1.00 10.00 C ATOM 1071 O SER B 19 -13.967 -3.279 10.548 1.00 10.00 O ATOM 1072 CB SER B 19 -15.983 -1.065 9.604 1.00 10.00 C ATOM 1073 OG SER B 19 -16.729 -0.396 10.605 1.00 10.00 O ATOM 0 H SER B 19 -14.408 0.321 8.297 1.00 10.00 H new ATOM 0 HA SER B 19 -14.332 -0.738 10.946 1.00 10.00 H new ATOM 0 HB2 SER B 19 -16.176 -0.604 8.635 1.00 10.00 H new ATOM 0 HB3 SER B 19 -16.312 -2.102 9.535 1.00 10.00 H new ATOM 0 HG SER B 19 -17.683 -0.439 10.386 1.00 10.00 H new ATOM 1079 N MET B 20 -13.230 -2.585 8.542 1.00 10.00 N ATOM 1080 CA MET B 20 -12.594 -3.857 8.214 1.00 10.00 C ATOM 1081 C MET B 20 -11.289 -4.013 8.988 1.00 10.00 C ATOM 1082 O MET B 20 -10.711 -5.100 9.055 1.00 10.00 O ATOM 1083 CB MET B 20 -12.331 -3.941 6.709 1.00 10.00 C ATOM 1084 CG MET B 20 -12.070 -5.355 6.211 1.00 10.00 C ATOM 1085 SD MET B 20 -11.783 -5.425 4.431 1.00 10.00 S ATOM 1086 CE MET B 20 -13.353 -4.834 3.805 1.00 10.00 C ATOM 0 H MET B 20 -13.139 -1.870 7.821 1.00 10.00 H new ATOM 0 HA MET B 20 -13.265 -4.667 8.499 1.00 10.00 H new ATOM 0 HB2 MET B 20 -13.188 -3.530 6.176 1.00 10.00 H new ATOM 0 HB3 MET B 20 -11.473 -3.315 6.464 1.00 10.00 H new ATOM 0 HG2 MET B 20 -11.204 -5.765 6.731 1.00 10.00 H new ATOM 0 HG3 MET B 20 -12.921 -5.987 6.463 1.00 10.00 H new ATOM 0 HE1 MET B 20 -13.578 -5.329 2.860 1.00 10.00 H new ATOM 0 HE2 MET B 20 -14.139 -5.056 4.527 1.00 10.00 H new ATOM 0 HE3 MET B 20 -13.299 -3.757 3.647 1.00 10.00 H new ATOM 1096 N GLY B 21 -10.832 -2.918 9.578 1.00 10.00 N ATOM 1097 CA GLY B 21 -9.607 -2.946 10.347 1.00 10.00 C ATOM 1098 C GLY B 21 -8.435 -2.396 9.569 1.00 10.00 C ATOM 1099 O GLY B 21 -7.280 -2.683 9.886 1.00 10.00 O ATOM 0 H GLY B 21 -11.290 -2.008 9.537 1.00 10.00 H new ATOM 0 HA2 GLY B 21 -9.740 -2.366 11.260 1.00 10.00 H new ATOM 0 HA3 GLY B 21 -9.392 -3.971 10.649 1.00 10.00 H new ATOM 1103 N PHE B 22 -8.725 -1.616 8.540 1.00 10.00 N ATOM 1104 CA PHE B 22 -7.678 -1.026 7.731 1.00 10.00 C ATOM 1105 C PHE B 22 -7.566 0.460 8.038 1.00 10.00 C ATOM 1106 O PHE B 22 -8.553 1.196 7.985 1.00 10.00 O ATOM 1107 CB PHE B 22 -7.954 -1.241 6.242 1.00 10.00 C ATOM 1108 CG PHE B 22 -6.715 -1.201 5.396 1.00 10.00 C ATOM 1109 CD1 PHE B 22 -5.706 -2.132 5.580 1.00 10.00 C ATOM 1110 CD2 PHE B 22 -6.557 -0.234 4.419 1.00 10.00 C ATOM 1111 CE1 PHE B 22 -4.563 -2.095 4.809 1.00 10.00 C ATOM 1112 CE2 PHE B 22 -5.417 -0.192 3.642 1.00 10.00 C ATOM 1113 CZ PHE B 22 -4.417 -1.124 3.837 1.00 10.00 C ATOM 0 H PHE B 22 -9.673 -1.379 8.248 1.00 10.00 H new ATOM 0 HA PHE B 22 -6.734 -1.514 7.974 1.00 10.00 H new ATOM 0 HB2 PHE B 22 -8.447 -2.204 6.106 1.00 10.00 H new ATOM 0 HB3 PHE B 22 -8.648 -0.476 5.894 1.00 10.00 H new ATOM 0 HD1 PHE B 22 -5.816 -2.896 6.336 1.00 10.00 H new ATOM 0 HD2 PHE B 22 -7.336 0.498 4.262 1.00 10.00 H new ATOM 0 HE1 PHE B 22 -3.782 -2.825 4.965 1.00 10.00 H new ATOM 0 HE2 PHE B 22 -5.307 0.568 2.883 1.00 10.00 H new ATOM 0 HZ PHE B 22 -3.523 -1.094 3.231 1.00 10.00 H new ATOM 1123 N SER B 23 -6.364 0.889 8.384 1.00 10.00 N ATOM 1124 CA SER B 23 -6.108 2.281 8.707 1.00 10.00 C ATOM 1125 C SER B 23 -4.736 2.689 8.186 1.00 10.00 C ATOM 1126 O SER B 23 -3.765 1.941 8.312 1.00 10.00 O ATOM 1127 CB SER B 23 -6.196 2.477 10.222 1.00 10.00 C ATOM 1128 OG SER B 23 -7.393 1.907 10.736 1.00 10.00 O ATOM 0 H SER B 23 -5.544 0.286 8.448 1.00 10.00 H new ATOM 0 HA SER B 23 -6.857 2.913 8.229 1.00 10.00 H new ATOM 0 HB2 SER B 23 -5.333 2.017 10.703 1.00 10.00 H new ATOM 0 HB3 SER B 23 -6.164 3.541 10.458 1.00 10.00 H new ATOM 0 HG SER B 23 -7.429 2.042 11.706 1.00 10.00 H new ATOM 1134 N ASP B 24 -4.657 3.873 7.607 1.00 10.00 N ATOM 1135 CA ASP B 24 -3.405 4.360 7.044 1.00 10.00 C ATOM 1136 C ASP B 24 -2.968 5.658 7.721 1.00 10.00 C ATOM 1137 O ASP B 24 -3.805 6.462 8.145 1.00 10.00 O ATOM 1138 CB ASP B 24 -3.569 4.530 5.526 1.00 10.00 C ATOM 1139 CG ASP B 24 -3.288 5.928 5.027 1.00 10.00 C ATOM 1140 OD1 ASP B 24 -2.108 6.291 4.922 1.00 10.00 O ATOM 1141 OD2 ASP B 24 -4.246 6.658 4.700 1.00 10.00 O ATOM 0 H ASP B 24 -5.443 4.517 7.513 1.00 10.00 H new ATOM 0 HA ASP B 24 -2.614 3.633 7.228 1.00 10.00 H new ATOM 0 HB2 ASP B 24 -2.901 3.834 5.019 1.00 10.00 H new ATOM 0 HB3 ASP B 24 -4.586 4.255 5.248 1.00 10.00 H new ATOM 1146 N GLU B 25 -1.654 5.845 7.840 1.00 10.00 N ATOM 1147 CA GLU B 25 -1.098 7.033 8.483 1.00 10.00 C ATOM 1148 C GLU B 25 -0.153 7.792 7.556 1.00 10.00 C ATOM 1149 O GLU B 25 0.626 8.635 8.002 1.00 10.00 O ATOM 1150 CB GLU B 25 -0.364 6.658 9.782 1.00 10.00 C ATOM 1151 CG GLU B 25 -0.232 5.160 10.024 1.00 10.00 C ATOM 1152 CD GLU B 25 0.884 4.528 9.219 1.00 10.00 C ATOM 1153 OE1 GLU B 25 0.646 4.174 8.044 1.00 10.00 O ATOM 1154 OE2 GLU B 25 1.994 4.370 9.762 1.00 10.00 O ATOM 0 H GLU B 25 -0.954 5.187 7.498 1.00 10.00 H new ATOM 0 HA GLU B 25 -1.936 7.688 8.721 1.00 10.00 H new ATOM 0 HB2 GLU B 25 0.633 7.099 9.761 1.00 10.00 H new ATOM 0 HB3 GLU B 25 -0.892 7.104 10.625 1.00 10.00 H new ATOM 0 HG2 GLU B 25 -0.053 4.983 11.085 1.00 10.00 H new ATOM 0 HG3 GLU B 25 -1.174 4.672 9.774 1.00 10.00 H new ATOM 1161 N GLY B 26 -0.226 7.499 6.271 1.00 10.00 N ATOM 1162 CA GLY B 26 0.616 8.175 5.309 1.00 10.00 C ATOM 1163 C GLY B 26 -0.211 8.846 4.238 1.00 10.00 C ATOM 1164 O GLY B 26 0.325 9.408 3.280 1.00 10.00 O ATOM 0 H GLY B 26 -0.856 6.802 5.874 1.00 10.00 H new ATOM 0 HA2 GLY B 26 1.230 8.918 5.818 1.00 10.00 H new ATOM 0 HA3 GLY B 26 1.297 7.458 4.851 1.00 10.00 H new ATOM 1168 N GLY B 27 -1.523 8.785 4.409 1.00 10.00 N ATOM 1169 CA GLY B 27 -2.434 9.365 3.455 1.00 10.00 C ATOM 1170 C GLY B 27 -2.445 8.589 2.160 1.00 10.00 C ATOM 1171 O GLY B 27 -2.705 9.147 1.092 1.00 10.00 O ATOM 0 H GLY B 27 -1.975 8.336 5.206 1.00 10.00 H new ATOM 0 HA2 GLY B 27 -3.439 9.387 3.876 1.00 10.00 H new ATOM 0 HA3 GLY B 27 -2.148 10.398 3.259 1.00 10.00 H new ATOM 1175 N TRP B 28 -2.144 7.297 2.243 1.00 10.00 N ATOM 1176 CA TRP B 28 -2.102 6.469 1.052 1.00 10.00 C ATOM 1177 C TRP B 28 -3.401 5.697 0.833 1.00 10.00 C ATOM 1178 O TRP B 28 -3.682 5.268 -0.283 1.00 10.00 O ATOM 1179 CB TRP B 28 -0.879 5.537 1.055 1.00 10.00 C ATOM 1180 CG TRP B 28 -0.948 4.354 1.978 1.00 10.00 C ATOM 1181 CD1 TRP B 28 -0.691 4.336 3.317 1.00 10.00 C ATOM 1182 CD2 TRP B 28 -1.237 3.003 1.605 1.00 10.00 C ATOM 1183 NE1 TRP B 28 -0.842 3.061 3.807 1.00 10.00 N ATOM 1184 CE2 TRP B 28 -1.170 2.223 2.775 1.00 10.00 C ATOM 1185 CE3 TRP B 28 -1.560 2.377 0.397 1.00 10.00 C ATOM 1186 CZ2 TRP B 28 -1.412 0.852 2.771 1.00 10.00 C ATOM 1187 CZ3 TRP B 28 -1.795 1.014 0.396 1.00 10.00 C ATOM 1188 CH2 TRP B 28 -1.719 0.266 1.573 1.00 10.00 C ATOM 0 H TRP B 28 -1.929 6.809 3.113 1.00 10.00 H new ATOM 0 HA TRP B 28 -1.997 7.145 0.203 1.00 10.00 H new ATOM 0 HB2 TRP B 28 -0.725 5.171 0.040 1.00 10.00 H new ATOM 0 HB3 TRP B 28 -0.000 6.126 1.318 1.00 10.00 H new ATOM 0 HD1 TRP B 28 -0.410 5.197 3.906 1.00 10.00 H new ATOM 0 HE1 TRP B 28 -0.728 2.784 4.782 1.00 10.00 H new ATOM 0 HE3 TRP B 28 -1.625 2.947 -0.518 1.00 10.00 H new ATOM 0 HZ2 TRP B 28 -1.359 0.272 3.680 1.00 10.00 H new ATOM 0 HZ3 TRP B 28 -2.042 0.519 -0.532 1.00 10.00 H new ATOM 0 HH2 TRP B 28 -1.906 -0.797 1.537 1.00 10.00 H new ATOM 1199 N LEU B 29 -4.210 5.545 1.876 1.00 10.00 N ATOM 1200 CA LEU B 29 -5.475 4.833 1.735 1.00 10.00 C ATOM 1201 C LEU B 29 -6.438 5.660 0.892 1.00 10.00 C ATOM 1202 O LEU B 29 -7.102 5.142 -0.009 1.00 10.00 O ATOM 1203 CB LEU B 29 -6.092 4.535 3.106 1.00 10.00 C ATOM 1204 CG LEU B 29 -7.535 4.022 3.082 1.00 10.00 C ATOM 1205 CD1 LEU B 29 -7.627 2.694 2.343 1.00 10.00 C ATOM 1206 CD2 LEU B 29 -8.074 3.885 4.498 1.00 10.00 C ATOM 0 H LEU B 29 -4.018 5.898 2.813 1.00 10.00 H new ATOM 0 HA LEU B 29 -5.285 3.882 1.237 1.00 10.00 H new ATOM 0 HB2 LEU B 29 -5.470 3.796 3.612 1.00 10.00 H new ATOM 0 HB3 LEU B 29 -6.058 5.445 3.706 1.00 10.00 H new ATOM 0 HG LEU B 29 -8.146 4.749 2.548 1.00 10.00 H new ATOM 0 HD11 LEU B 29 -8.661 2.350 2.340 1.00 10.00 H new ATOM 0 HD12 LEU B 29 -7.285 2.824 1.316 1.00 10.00 H new ATOM 0 HD13 LEU B 29 -7.001 1.955 2.843 1.00 10.00 H new ATOM 0 HD21 LEU B 29 -9.100 3.519 4.463 1.00 10.00 H new ATOM 0 HD22 LEU B 29 -7.457 3.181 5.056 1.00 10.00 H new ATOM 0 HD23 LEU B 29 -8.052 4.857 4.991 1.00 10.00 H new ATOM 1218 N THR B 30 -6.477 6.958 1.165 1.00 10.00 N ATOM 1219 CA THR B 30 -7.339 7.873 0.430 1.00 10.00 C ATOM 1220 C THR B 30 -6.927 7.937 -1.040 1.00 10.00 C ATOM 1221 O THR B 30 -7.725 8.292 -1.904 1.00 10.00 O ATOM 1222 CB THR B 30 -7.317 9.293 1.047 1.00 10.00 C ATOM 1223 OG1 THR B 30 -8.153 10.184 0.295 1.00 10.00 O ATOM 1224 CG2 THR B 30 -5.899 9.848 1.097 1.00 10.00 C ATOM 0 H THR B 30 -5.918 7.402 1.894 1.00 10.00 H new ATOM 0 HA THR B 30 -8.357 7.489 0.498 1.00 10.00 H new ATOM 0 HB THR B 30 -7.699 9.215 2.065 1.00 10.00 H new ATOM 0 HG1 THR B 30 -8.128 11.076 0.700 1.00 10.00 H new ATOM 0 HG21 THR B 30 -5.914 10.846 1.535 1.00 10.00 H new ATOM 0 HG22 THR B 30 -5.274 9.194 1.705 1.00 10.00 H new ATOM 0 HG23 THR B 30 -5.493 9.901 0.087 1.00 10.00 H new ATOM 1232 N ARG B 31 -5.680 7.568 -1.316 1.00 10.00 N ATOM 1233 CA ARG B 31 -5.156 7.572 -2.673 1.00 10.00 C ATOM 1234 C ARG B 31 -5.330 6.201 -3.309 1.00 10.00 C ATOM 1235 O ARG B 31 -5.437 6.078 -4.528 1.00 10.00 O ATOM 1236 CB ARG B 31 -3.684 7.969 -2.670 1.00 10.00 C ATOM 1237 CG ARG B 31 -3.462 9.448 -2.906 1.00 10.00 C ATOM 1238 CD ARG B 31 -1.998 9.815 -2.767 1.00 10.00 C ATOM 1239 NE ARG B 31 -1.589 9.950 -1.372 1.00 10.00 N ATOM 1240 CZ ARG B 31 -0.422 10.465 -0.993 1.00 10.00 C ATOM 1241 NH1 ARG B 31 0.468 10.834 -1.906 1.00 10.00 N ATOM 1242 NH2 ARG B 31 -0.143 10.598 0.298 1.00 10.00 N ATOM 0 H ARG B 31 -5.011 7.261 -0.610 1.00 10.00 H new ATOM 0 HA ARG B 31 -5.713 8.302 -3.260 1.00 10.00 H new ATOM 0 HB2 ARG B 31 -3.242 7.690 -1.714 1.00 10.00 H new ATOM 0 HB3 ARG B 31 -3.161 7.403 -3.440 1.00 10.00 H new ATOM 0 HG2 ARG B 31 -3.813 9.716 -3.902 1.00 10.00 H new ATOM 0 HG3 ARG B 31 -4.053 10.025 -2.194 1.00 10.00 H new ATOM 0 HD2 ARG B 31 -1.387 9.052 -3.250 1.00 10.00 H new ATOM 0 HD3 ARG B 31 -1.810 10.752 -3.291 1.00 10.00 H new ATOM 0 HE ARG B 31 -2.233 9.632 -0.648 1.00 10.00 H new ATOM 0 HH11 ARG B 31 0.257 10.723 -2.898 1.00 10.00 H new ATOM 0 HH12 ARG B 31 1.363 11.229 -1.616 1.00 10.00 H new ATOM 0 HH21 ARG B 31 -0.823 10.305 1.000 1.00 10.00 H new ATOM 0 HH22 ARG B 31 0.752 10.993 0.588 1.00 10.00 H new ATOM 1256 N LEU B 32 -5.353 5.173 -2.475 1.00 10.00 N ATOM 1257 CA LEU B 32 -5.528 3.805 -2.939 1.00 10.00 C ATOM 1258 C LEU B 32 -6.902 3.651 -3.580 1.00 10.00 C ATOM 1259 O LEU B 32 -7.049 3.021 -4.630 1.00 10.00 O ATOM 1260 CB LEU B 32 -5.376 2.828 -1.767 1.00 10.00 C ATOM 1261 CG LEU B 32 -5.198 1.364 -2.156 1.00 10.00 C ATOM 1262 CD1 LEU B 32 -3.826 1.135 -2.762 1.00 10.00 C ATOM 1263 CD2 LEU B 32 -5.403 0.463 -0.948 1.00 10.00 C ATOM 0 H LEU B 32 -5.252 5.262 -1.464 1.00 10.00 H new ATOM 0 HA LEU B 32 -4.763 3.579 -3.682 1.00 10.00 H new ATOM 0 HB2 LEU B 32 -4.518 3.135 -1.169 1.00 10.00 H new ATOM 0 HB3 LEU B 32 -6.256 2.913 -1.129 1.00 10.00 H new ATOM 0 HG LEU B 32 -5.950 1.115 -2.905 1.00 10.00 H new ATOM 0 HD11 LEU B 32 -3.719 0.085 -3.033 1.00 10.00 H new ATOM 0 HD12 LEU B 32 -3.714 1.753 -3.653 1.00 10.00 H new ATOM 0 HD13 LEU B 32 -3.058 1.403 -2.036 1.00 10.00 H new ATOM 0 HD21 LEU B 32 -5.272 -0.578 -1.244 1.00 10.00 H new ATOM 0 HD22 LEU B 32 -4.674 0.716 -0.178 1.00 10.00 H new ATOM 0 HD23 LEU B 32 -6.410 0.605 -0.555 1.00 10.00 H new ATOM 1275 N LEU B 33 -7.898 4.275 -2.953 1.00 10.00 N ATOM 1276 CA LEU B 33 -9.270 4.229 -3.444 1.00 10.00 C ATOM 1277 C LEU B 33 -9.447 5.141 -4.653 1.00 10.00 C ATOM 1278 O LEU B 33 -10.498 5.147 -5.290 1.00 10.00 O ATOM 1279 CB LEU B 33 -10.238 4.639 -2.334 1.00 10.00 C ATOM 1280 CG LEU B 33 -10.242 3.733 -1.100 1.00 10.00 C ATOM 1281 CD1 LEU B 33 -11.202 4.278 -0.054 1.00 10.00 C ATOM 1282 CD2 LEU B 33 -10.620 2.309 -1.479 1.00 10.00 C ATOM 0 H LEU B 33 -7.777 4.821 -2.100 1.00 10.00 H new ATOM 0 HA LEU B 33 -9.488 3.206 -3.751 1.00 10.00 H new ATOM 0 HB2 LEU B 33 -9.994 5.653 -2.018 1.00 10.00 H new ATOM 0 HB3 LEU B 33 -11.247 4.667 -2.747 1.00 10.00 H new ATOM 0 HG LEU B 33 -9.237 3.717 -0.679 1.00 10.00 H new ATOM 0 HD11 LEU B 33 -11.197 3.626 0.819 1.00 10.00 H new ATOM 0 HD12 LEU B 33 -10.890 5.280 0.240 1.00 10.00 H new ATOM 0 HD13 LEU B 33 -12.209 4.319 -0.470 1.00 10.00 H new ATOM 0 HD21 LEU B 33 -10.617 1.682 -0.587 1.00 10.00 H new ATOM 0 HD22 LEU B 33 -11.615 2.303 -1.923 1.00 10.00 H new ATOM 0 HD23 LEU B 33 -9.899 1.920 -2.198 1.00 10.00 H new ATOM 1294 N GLN B 34 -8.437 5.950 -4.944 1.00 10.00 N ATOM 1295 CA GLN B 34 -8.493 6.843 -6.092 1.00 10.00 C ATOM 1296 C GLN B 34 -7.816 6.202 -7.297 1.00 10.00 C ATOM 1297 O GLN B 34 -8.285 6.326 -8.425 1.00 10.00 O ATOM 1298 CB GLN B 34 -7.827 8.186 -5.782 1.00 10.00 C ATOM 1299 CG GLN B 34 -8.583 9.043 -4.780 1.00 10.00 C ATOM 1300 CD GLN B 34 -10.028 9.281 -5.171 1.00 10.00 C ATOM 1301 OE1 GLN B 34 -10.335 10.195 -5.937 1.00 10.00 O ATOM 1302 NE2 GLN B 34 -10.925 8.467 -4.640 1.00 10.00 N ATOM 0 H GLN B 34 -7.574 6.006 -4.404 1.00 10.00 H new ATOM 0 HA GLN B 34 -9.543 7.023 -6.321 1.00 10.00 H new ATOM 0 HB2 GLN B 34 -6.823 8.001 -5.400 1.00 10.00 H new ATOM 0 HB3 GLN B 34 -7.716 8.746 -6.711 1.00 10.00 H new ATOM 0 HG2 GLN B 34 -8.552 8.561 -3.803 1.00 10.00 H new ATOM 0 HG3 GLN B 34 -8.078 10.003 -4.678 1.00 10.00 H new ATOM 0 HE21 GLN B 34 -10.628 7.722 -4.010 1.00 10.00 H new ATOM 0 HE22 GLN B 34 -11.914 8.584 -4.861 1.00 10.00 H new ATOM 1311 N THR B 35 -6.714 5.511 -7.042 1.00 10.00 N ATOM 1312 CA THR B 35 -5.950 4.870 -8.102 1.00 10.00 C ATOM 1313 C THR B 35 -6.591 3.565 -8.553 1.00 10.00 C ATOM 1314 O THR B 35 -6.704 3.299 -9.748 1.00 10.00 O ATOM 1315 CB THR B 35 -4.504 4.590 -7.651 1.00 10.00 C ATOM 1316 OG1 THR B 35 -4.495 4.117 -6.293 1.00 10.00 O ATOM 1317 CG2 THR B 35 -3.647 5.842 -7.769 1.00 10.00 C ATOM 0 H THR B 35 -6.328 5.380 -6.107 1.00 10.00 H new ATOM 0 HA THR B 35 -5.942 5.564 -8.942 1.00 10.00 H new ATOM 0 HB THR B 35 -4.085 3.823 -8.302 1.00 10.00 H new ATOM 0 HG1 THR B 35 -4.688 4.862 -5.686 1.00 10.00 H new ATOM 0 HG21 THR B 35 -2.630 5.619 -7.445 1.00 10.00 H new ATOM 0 HG22 THR B 35 -3.632 6.176 -8.806 1.00 10.00 H new ATOM 0 HG23 THR B 35 -4.064 6.629 -7.140 1.00 10.00 H new ATOM 1325 N LYS B 36 -7.021 2.757 -7.594 1.00 10.00 N ATOM 1326 CA LYS B 36 -7.637 1.473 -7.900 1.00 10.00 C ATOM 1327 C LYS B 36 -9.147 1.531 -7.694 1.00 10.00 C ATOM 1328 O LYS B 36 -9.815 0.499 -7.633 1.00 10.00 O ATOM 1329 CB LYS B 36 -7.007 0.378 -7.039 1.00 10.00 C ATOM 1330 CG LYS B 36 -5.548 0.129 -7.385 1.00 10.00 C ATOM 1331 CD LYS B 36 -4.730 -0.265 -6.166 1.00 10.00 C ATOM 1332 CE LYS B 36 -3.270 0.140 -6.328 1.00 10.00 C ATOM 1333 NZ LYS B 36 -3.079 1.608 -6.164 1.00 10.00 N ATOM 0 H LYS B 36 -6.955 2.967 -6.598 1.00 10.00 H new ATOM 0 HA LYS B 36 -7.458 1.238 -8.949 1.00 10.00 H new ATOM 0 HB2 LYS B 36 -7.085 0.657 -5.988 1.00 10.00 H new ATOM 0 HB3 LYS B 36 -7.569 -0.547 -7.165 1.00 10.00 H new ATOM 0 HG2 LYS B 36 -5.483 -0.660 -8.135 1.00 10.00 H new ATOM 0 HG3 LYS B 36 -5.123 1.028 -7.831 1.00 10.00 H new ATOM 0 HD2 LYS B 36 -5.145 0.210 -5.277 1.00 10.00 H new ATOM 0 HD3 LYS B 36 -4.797 -1.342 -6.013 1.00 10.00 H new ATOM 0 HE2 LYS B 36 -2.663 -0.389 -5.594 1.00 10.00 H new ATOM 0 HE3 LYS B 36 -2.916 -0.164 -7.313 1.00 10.00 H new ATOM 0 HZ1 LYS B 36 -2.645 2.000 -7.024 1.00 10.00 H new ATOM 0 HZ2 LYS B 36 -4.001 2.062 -6.004 1.00 10.00 H new ATOM 0 HZ3 LYS B 36 -2.458 1.788 -5.350 1.00 10.00 H new ATOM 1347 N ASN B 37 -9.663 2.757 -7.602 1.00 10.00 N ATOM 1348 CA ASN B 37 -11.094 3.003 -7.416 1.00 10.00 C ATOM 1349 C ASN B 37 -11.583 2.464 -6.066 1.00 10.00 C ATOM 1350 O ASN B 37 -10.793 1.983 -5.254 1.00 10.00 O ATOM 1351 CB ASN B 37 -11.897 2.392 -8.576 1.00 10.00 C ATOM 1352 CG ASN B 37 -13.299 2.961 -8.687 1.00 10.00 C ATOM 1353 OD1 ASN B 37 -13.488 4.171 -8.824 1.00 10.00 O ATOM 1354 ND2 ASN B 37 -14.293 2.096 -8.612 1.00 10.00 N ATOM 0 H ASN B 37 -9.102 3.607 -7.654 1.00 10.00 H new ATOM 0 HA ASN B 37 -11.254 4.081 -7.414 1.00 10.00 H new ATOM 0 HB2 ASN B 37 -11.365 2.566 -9.511 1.00 10.00 H new ATOM 0 HB3 ASN B 37 -11.958 1.312 -8.440 1.00 10.00 H new ATOM 0 HD21 ASN B 37 -15.258 2.422 -8.667 1.00 10.00 H new ATOM 0 HD22 ASN B 37 -14.096 1.102 -8.499 1.00 10.00 H new ATOM 1361 N TYR B 38 -12.885 2.553 -5.824 1.00 10.00 N ATOM 1362 CA TYR B 38 -13.474 2.086 -4.575 1.00 10.00 C ATOM 1363 C TYR B 38 -13.815 0.602 -4.657 1.00 10.00 C ATOM 1364 O TYR B 38 -14.809 0.143 -4.083 1.00 10.00 O ATOM 1365 CB TYR B 38 -14.734 2.897 -4.251 1.00 10.00 C ATOM 1366 CG TYR B 38 -14.505 4.394 -4.241 1.00 10.00 C ATOM 1367 CD1 TYR B 38 -13.863 5.010 -3.173 1.00 10.00 C ATOM 1368 CD2 TYR B 38 -14.928 5.189 -5.297 1.00 10.00 C ATOM 1369 CE1 TYR B 38 -13.649 6.375 -3.160 1.00 10.00 C ATOM 1370 CE2 TYR B 38 -14.718 6.556 -5.291 1.00 10.00 C ATOM 1371 CZ TYR B 38 -14.078 7.143 -4.220 1.00 10.00 C ATOM 1372 OH TYR B 38 -13.863 8.502 -4.212 1.00 10.00 O ATOM 0 H TYR B 38 -13.558 2.947 -6.482 1.00 10.00 H new ATOM 0 HA TYR B 38 -12.743 2.227 -3.779 1.00 10.00 H new ATOM 0 HB2 TYR B 38 -15.506 2.661 -4.983 1.00 10.00 H new ATOM 0 HB3 TYR B 38 -15.114 2.589 -3.277 1.00 10.00 H new ATOM 0 HD1 TYR B 38 -13.526 4.412 -2.339 1.00 10.00 H new ATOM 0 HD2 TYR B 38 -15.430 4.733 -6.138 1.00 10.00 H new ATOM 0 HE1 TYR B 38 -13.148 6.838 -2.323 1.00 10.00 H new ATOM 0 HE2 TYR B 38 -15.054 7.160 -6.121 1.00 10.00 H new ATOM 0 HH TYR B 38 -14.225 8.895 -5.033 1.00 10.00 H new ATOM 1382 N ASP B 39 -12.984 -0.147 -5.366 1.00 10.00 N ATOM 1383 CA ASP B 39 -13.187 -1.577 -5.526 1.00 10.00 C ATOM 1384 C ASP B 39 -12.518 -2.326 -4.382 1.00 10.00 C ATOM 1385 O ASP B 39 -11.318 -2.606 -4.425 1.00 10.00 O ATOM 1386 CB ASP B 39 -12.636 -2.057 -6.871 1.00 10.00 C ATOM 1387 CG ASP B 39 -13.583 -1.773 -8.021 1.00 10.00 C ATOM 1388 OD1 ASP B 39 -13.705 -0.597 -8.431 1.00 10.00 O ATOM 1389 OD2 ASP B 39 -14.207 -2.728 -8.531 1.00 10.00 O ATOM 0 H ASP B 39 -12.158 0.216 -5.842 1.00 10.00 H new ATOM 0 HA ASP B 39 -14.258 -1.780 -5.507 1.00 10.00 H new ATOM 0 HB2 ASP B 39 -11.680 -1.570 -7.063 1.00 10.00 H new ATOM 0 HB3 ASP B 39 -12.443 -3.129 -6.819 1.00 10.00 H new ATOM 1394 N ILE B 40 -13.305 -2.639 -3.361 1.00 10.00 N ATOM 1395 CA ILE B 40 -12.811 -3.339 -2.180 1.00 10.00 C ATOM 1396 C ILE B 40 -12.153 -4.668 -2.549 1.00 10.00 C ATOM 1397 O ILE B 40 -11.104 -5.024 -2.008 1.00 10.00 O ATOM 1398 CB ILE B 40 -13.948 -3.594 -1.168 1.00 10.00 C ATOM 1399 CG1 ILE B 40 -14.653 -2.278 -0.820 1.00 10.00 C ATOM 1400 CG2 ILE B 40 -13.403 -4.260 0.090 1.00 10.00 C ATOM 1401 CD1 ILE B 40 -15.810 -2.443 0.142 1.00 10.00 C ATOM 0 H ILE B 40 -14.300 -2.416 -3.327 1.00 10.00 H new ATOM 0 HA ILE B 40 -12.062 -2.694 -1.721 1.00 10.00 H new ATOM 0 HB ILE B 40 -14.675 -4.267 -1.623 1.00 10.00 H new ATOM 0 HG12 ILE B 40 -13.927 -1.591 -0.386 1.00 10.00 H new ATOM 0 HG13 ILE B 40 -15.018 -1.818 -1.738 1.00 10.00 H new ATOM 0 HG21 ILE B 40 -14.218 -4.432 0.793 1.00 10.00 H new ATOM 0 HG22 ILE B 40 -12.943 -5.213 -0.173 1.00 10.00 H new ATOM 0 HG23 ILE B 40 -12.658 -3.612 0.551 1.00 10.00 H new ATOM 0 HD11 ILE B 40 -16.259 -1.470 0.341 1.00 10.00 H new ATOM 0 HD12 ILE B 40 -16.557 -3.104 -0.297 1.00 10.00 H new ATOM 0 HD13 ILE B 40 -15.448 -2.874 1.076 1.00 10.00 H new ATOM 1413 N GLY B 41 -12.768 -5.384 -3.483 1.00 10.00 N ATOM 1414 CA GLY B 41 -12.234 -6.663 -3.916 1.00 10.00 C ATOM 1415 C GLY B 41 -10.833 -6.536 -4.477 1.00 10.00 C ATOM 1416 O GLY B 41 -9.933 -7.290 -4.101 1.00 10.00 O ATOM 0 H GLY B 41 -13.630 -5.101 -3.950 1.00 10.00 H new ATOM 0 HA2 GLY B 41 -12.225 -7.355 -3.074 1.00 10.00 H new ATOM 0 HA3 GLY B 41 -12.890 -7.091 -4.674 1.00 10.00 H new ATOM 1420 N ALA B 42 -10.645 -5.564 -5.359 1.00 10.00 N ATOM 1421 CA ALA B 42 -9.345 -5.330 -5.977 1.00 10.00 C ATOM 1422 C ALA B 42 -8.316 -4.884 -4.945 1.00 10.00 C ATOM 1423 O ALA B 42 -7.170 -5.335 -4.964 1.00 10.00 O ATOM 1424 CB ALA B 42 -9.467 -4.294 -7.086 1.00 10.00 C ATOM 0 H ALA B 42 -11.377 -4.923 -5.664 1.00 10.00 H new ATOM 0 HA ALA B 42 -9.002 -6.271 -6.408 1.00 10.00 H new ATOM 0 HB1 ALA B 42 -8.489 -4.129 -7.539 1.00 10.00 H new ATOM 0 HB2 ALA B 42 -10.162 -4.653 -7.845 1.00 10.00 H new ATOM 0 HB3 ALA B 42 -9.837 -3.357 -6.670 1.00 10.00 H new ATOM 1430 N ALA B 43 -8.734 -4.003 -4.041 1.00 10.00 N ATOM 1431 CA ALA B 43 -7.856 -3.486 -2.995 1.00 10.00 C ATOM 1432 C ALA B 43 -7.349 -4.606 -2.089 1.00 10.00 C ATOM 1433 O ALA B 43 -6.158 -4.676 -1.786 1.00 10.00 O ATOM 1434 CB ALA B 43 -8.576 -2.421 -2.179 1.00 10.00 C ATOM 0 H ALA B 43 -9.683 -3.630 -4.012 1.00 10.00 H new ATOM 0 HA ALA B 43 -6.990 -3.033 -3.477 1.00 10.00 H new ATOM 0 HB1 ALA B 43 -7.909 -2.045 -1.403 1.00 10.00 H new ATOM 0 HB2 ALA B 43 -8.872 -1.600 -2.832 1.00 10.00 H new ATOM 0 HB3 ALA B 43 -9.463 -2.855 -1.717 1.00 10.00 H new ATOM 1440 N LEU B 44 -8.255 -5.485 -1.674 1.00 10.00 N ATOM 1441 CA LEU B 44 -7.903 -6.605 -0.807 1.00 10.00 C ATOM 1442 C LEU B 44 -6.930 -7.549 -1.507 1.00 10.00 C ATOM 1443 O LEU B 44 -6.000 -8.075 -0.892 1.00 10.00 O ATOM 1444 CB LEU B 44 -9.163 -7.367 -0.392 1.00 10.00 C ATOM 1445 CG LEU B 44 -9.607 -7.155 1.056 1.00 10.00 C ATOM 1446 CD1 LEU B 44 -9.882 -5.685 1.330 1.00 10.00 C ATOM 1447 CD2 LEU B 44 -10.841 -7.990 1.357 1.00 10.00 C ATOM 0 H LEU B 44 -9.243 -5.443 -1.925 1.00 10.00 H new ATOM 0 HA LEU B 44 -7.416 -6.207 0.083 1.00 10.00 H new ATOM 0 HB2 LEU B 44 -9.979 -7.073 -1.052 1.00 10.00 H new ATOM 0 HB3 LEU B 44 -8.993 -8.432 -0.550 1.00 10.00 H new ATOM 0 HG LEU B 44 -8.797 -7.476 1.711 1.00 10.00 H new ATOM 0 HD11 LEU B 44 -10.196 -5.561 2.366 1.00 10.00 H new ATOM 0 HD12 LEU B 44 -8.975 -5.106 1.154 1.00 10.00 H new ATOM 0 HD13 LEU B 44 -10.672 -5.333 0.667 1.00 10.00 H new ATOM 0 HD21 LEU B 44 -11.146 -7.829 2.391 1.00 10.00 H new ATOM 0 HD22 LEU B 44 -11.651 -7.696 0.690 1.00 10.00 H new ATOM 0 HD23 LEU B 44 -10.612 -9.045 1.206 1.00 10.00 H new ATOM 1459 N ASP B 45 -7.147 -7.745 -2.801 1.00 10.00 N ATOM 1460 CA ASP B 45 -6.298 -8.617 -3.607 1.00 10.00 C ATOM 1461 C ASP B 45 -4.913 -8.000 -3.804 1.00 10.00 C ATOM 1462 O ASP B 45 -3.916 -8.713 -3.916 1.00 10.00 O ATOM 1463 CB ASP B 45 -6.964 -8.879 -4.963 1.00 10.00 C ATOM 1464 CG ASP B 45 -6.034 -9.525 -5.973 1.00 10.00 C ATOM 1465 OD1 ASP B 45 -5.922 -10.769 -5.979 1.00 10.00 O ATOM 1466 OD2 ASP B 45 -5.433 -8.792 -6.784 1.00 10.00 O ATOM 0 H ASP B 45 -7.909 -7.309 -3.319 1.00 10.00 H new ATOM 0 HA ASP B 45 -6.172 -9.564 -3.081 1.00 10.00 H new ATOM 0 HB2 ASP B 45 -7.832 -9.522 -4.816 1.00 10.00 H new ATOM 0 HB3 ASP B 45 -7.331 -7.936 -5.368 1.00 10.00 H new ATOM 1471 N THR B 46 -4.865 -6.670 -3.809 1.00 10.00 N ATOM 1472 CA THR B 46 -3.617 -5.936 -4.000 1.00 10.00 C ATOM 1473 C THR B 46 -2.554 -6.324 -2.967 1.00 10.00 C ATOM 1474 O THR B 46 -1.381 -6.495 -3.307 1.00 10.00 O ATOM 1475 CB THR B 46 -3.855 -4.409 -3.920 1.00 10.00 C ATOM 1476 OG1 THR B 46 -4.849 -4.007 -4.872 1.00 10.00 O ATOM 1477 CG2 THR B 46 -2.570 -3.633 -4.178 1.00 10.00 C ATOM 0 H THR B 46 -5.683 -6.075 -3.682 1.00 10.00 H new ATOM 0 HA THR B 46 -3.253 -6.203 -4.992 1.00 10.00 H new ATOM 0 HB THR B 46 -4.202 -4.185 -2.911 1.00 10.00 H new ATOM 0 HG1 THR B 46 -5.725 -4.345 -4.592 1.00 10.00 H new ATOM 0 HG21 THR B 46 -2.772 -2.564 -4.115 1.00 10.00 H new ATOM 0 HG22 THR B 46 -1.824 -3.906 -3.432 1.00 10.00 H new ATOM 0 HG23 THR B 46 -2.194 -3.873 -5.172 1.00 10.00 H new ATOM 1485 N ILE B 47 -2.966 -6.477 -1.711 1.00 10.00 N ATOM 1486 CA ILE B 47 -2.029 -6.822 -0.645 1.00 10.00 C ATOM 1487 C ILE B 47 -2.135 -8.291 -0.242 1.00 10.00 C ATOM 1488 O ILE B 47 -1.448 -8.737 0.680 1.00 10.00 O ATOM 1489 CB ILE B 47 -2.243 -5.931 0.599 1.00 10.00 C ATOM 1490 CG1 ILE B 47 -3.654 -6.127 1.161 1.00 10.00 C ATOM 1491 CG2 ILE B 47 -1.999 -4.471 0.246 1.00 10.00 C ATOM 1492 CD1 ILE B 47 -3.879 -5.448 2.494 1.00 10.00 C ATOM 0 H ILE B 47 -3.934 -6.369 -1.408 1.00 10.00 H new ATOM 0 HA ILE B 47 -1.030 -6.647 -1.044 1.00 10.00 H new ATOM 0 HB ILE B 47 -1.528 -6.223 1.368 1.00 10.00 H new ATOM 0 HG12 ILE B 47 -4.378 -5.744 0.442 1.00 10.00 H new ATOM 0 HG13 ILE B 47 -3.847 -7.194 1.270 1.00 10.00 H new ATOM 0 HG21 ILE B 47 -2.153 -3.852 1.130 1.00 10.00 H new ATOM 0 HG22 ILE B 47 -0.976 -4.349 -0.109 1.00 10.00 H new ATOM 0 HG23 ILE B 47 -2.694 -4.165 -0.536 1.00 10.00 H new ATOM 0 HD11 ILE B 47 -4.900 -5.631 2.828 1.00 10.00 H new ATOM 0 HD12 ILE B 47 -3.180 -5.848 3.228 1.00 10.00 H new ATOM 0 HD13 ILE B 47 -3.719 -4.375 2.387 1.00 10.00 H new ATOM 1504 N GLN B 48 -3.010 -9.031 -0.927 1.00 10.00 N ATOM 1505 CA GLN B 48 -3.237 -10.466 -0.676 1.00 10.00 C ATOM 1506 C GLN B 48 -3.960 -10.729 0.644 1.00 10.00 C ATOM 1507 O GLN B 48 -4.855 -11.574 0.698 1.00 10.00 O ATOM 1508 CB GLN B 48 -1.930 -11.263 -0.717 1.00 10.00 C ATOM 1509 CG GLN B 48 -1.688 -11.950 -2.046 1.00 10.00 C ATOM 1510 CD GLN B 48 -2.838 -12.854 -2.455 1.00 10.00 C ATOM 1511 OE1 GLN B 48 -3.468 -13.509 -1.619 1.00 10.00 O ATOM 1512 NE2 GLN B 48 -3.134 -12.879 -3.744 1.00 10.00 N ATOM 0 H GLN B 48 -3.588 -8.653 -1.678 1.00 10.00 H new ATOM 0 HA GLN B 48 -3.884 -10.806 -1.484 1.00 10.00 H new ATOM 0 HB2 GLN B 48 -1.097 -10.593 -0.506 1.00 10.00 H new ATOM 0 HB3 GLN B 48 -1.945 -12.013 0.074 1.00 10.00 H new ATOM 0 HG2 GLN B 48 -1.532 -11.196 -2.817 1.00 10.00 H new ATOM 0 HG3 GLN B 48 -0.772 -12.538 -1.985 1.00 10.00 H new ATOM 0 HE21 GLN B 48 -2.589 -12.323 -4.403 1.00 10.00 H new ATOM 0 HE22 GLN B 48 -3.907 -13.454 -4.079 1.00 10.00 H new ATOM 1521 N TYR B 49 -3.569 -10.028 1.701 1.00 10.00 N ATOM 1522 CA TYR B 49 -4.182 -10.195 3.017 1.00 10.00 C ATOM 1523 C TYR B 49 -5.667 -9.851 2.983 1.00 10.00 C ATOM 1524 O TYR B 49 -6.049 -8.689 3.117 1.00 10.00 O ATOM 1525 CB TYR B 49 -3.470 -9.320 4.052 1.00 10.00 C ATOM 1526 CG TYR B 49 -2.049 -9.749 4.335 1.00 10.00 C ATOM 1527 CD1 TYR B 49 -1.780 -10.987 4.906 1.00 10.00 C ATOM 1528 CD2 TYR B 49 -0.976 -8.919 4.035 1.00 10.00 C ATOM 1529 CE1 TYR B 49 -0.487 -11.386 5.169 1.00 10.00 C ATOM 1530 CE2 TYR B 49 0.324 -9.312 4.295 1.00 10.00 C ATOM 1531 CZ TYR B 49 0.562 -10.548 4.862 1.00 10.00 C ATOM 1532 OH TYR B 49 1.851 -10.951 5.115 1.00 10.00 O ATOM 0 H TYR B 49 -2.824 -9.332 1.673 1.00 10.00 H new ATOM 0 HA TYR B 49 -4.079 -11.242 3.301 1.00 10.00 H new ATOM 0 HB2 TYR B 49 -3.466 -8.288 3.701 1.00 10.00 H new ATOM 0 HB3 TYR B 49 -4.038 -9.338 4.982 1.00 10.00 H new ATOM 0 HD1 TYR B 49 -2.599 -11.648 5.148 1.00 10.00 H new ATOM 0 HD2 TYR B 49 -1.160 -7.952 3.592 1.00 10.00 H new ATOM 0 HE1 TYR B 49 -0.297 -12.352 5.614 1.00 10.00 H new ATOM 0 HE2 TYR B 49 1.148 -8.656 4.056 1.00 10.00 H new ATOM 0 HH TYR B 49 2.474 -10.246 4.840 1.00 10.00 H new ATOM 1542 N SER B 50 -6.496 -10.865 2.780 1.00 10.00 N ATOM 1543 CA SER B 50 -7.940 -10.676 2.729 1.00 10.00 C ATOM 1544 C SER B 50 -8.663 -11.651 3.655 1.00 10.00 C ATOM 1545 O SER B 50 -9.843 -11.474 3.961 1.00 10.00 O ATOM 1546 CB SER B 50 -8.433 -10.848 1.289 1.00 10.00 C ATOM 1547 OG SER B 50 -7.547 -11.667 0.538 1.00 10.00 O ATOM 0 H SER B 50 -6.193 -11.830 2.648 1.00 10.00 H new ATOM 0 HA SER B 50 -8.164 -9.666 3.072 1.00 10.00 H new ATOM 0 HB2 SER B 50 -9.428 -11.292 1.293 1.00 10.00 H new ATOM 0 HB3 SER B 50 -8.522 -9.872 0.813 1.00 10.00 H new ATOM 0 HG SER B 50 -6.659 -11.254 0.516 1.00 10.00 H new ATOM 1553 N LYS B 51 -7.956 -12.686 4.105 1.00 10.00 N ATOM 1554 CA LYS B 51 -8.550 -13.679 4.995 1.00 10.00 C ATOM 1555 C LYS B 51 -7.645 -13.948 6.190 1.00 10.00 C ATOM 1556 O LYS B 51 -7.861 -14.905 6.938 1.00 10.00 O ATOM 1557 CB LYS B 51 -8.835 -14.985 4.243 1.00 10.00 C ATOM 1558 CG LYS B 51 -9.839 -14.835 3.108 1.00 10.00 C ATOM 1559 CD LYS B 51 -10.461 -16.169 2.725 1.00 10.00 C ATOM 1560 CE LYS B 51 -11.627 -16.527 3.634 1.00 10.00 C ATOM 1561 NZ LYS B 51 -12.203 -17.860 3.303 1.00 10.00 N ATOM 0 H LYS B 51 -6.978 -12.857 3.870 1.00 10.00 H new ATOM 0 HA LYS B 51 -9.495 -13.276 5.360 1.00 10.00 H new ATOM 0 HB2 LYS B 51 -7.900 -15.372 3.839 1.00 10.00 H new ATOM 0 HB3 LYS B 51 -9.208 -15.726 4.950 1.00 10.00 H new ATOM 0 HG2 LYS B 51 -10.624 -14.140 3.406 1.00 10.00 H new ATOM 0 HG3 LYS B 51 -9.343 -14.402 2.239 1.00 10.00 H new ATOM 0 HD2 LYS B 51 -10.805 -16.127 1.691 1.00 10.00 H new ATOM 0 HD3 LYS B 51 -9.704 -16.952 2.778 1.00 10.00 H new ATOM 0 HE2 LYS B 51 -11.292 -16.524 4.671 1.00 10.00 H new ATOM 0 HE3 LYS B 51 -12.402 -15.765 3.547 1.00 10.00 H new ATOM 0 HZ1 LYS B 51 -12.995 -18.065 3.946 1.00 10.00 H new ATOM 0 HZ2 LYS B 51 -12.546 -17.856 2.321 1.00 10.00 H new ATOM 0 HZ3 LYS B 51 -11.471 -18.591 3.411 1.00 10.00 H new ATOM 1575 N HIS B 52 -6.633 -13.105 6.362 1.00 10.00 N ATOM 1576 CA HIS B 52 -5.694 -13.237 7.465 1.00 10.00 C ATOM 1577 C HIS B 52 -4.758 -12.041 7.476 1.00 10.00 C ATOM 1578 O HIS B 52 -4.236 -11.697 8.559 1.00 10.00 O ATOM 1579 CB HIS B 52 -4.882 -14.536 7.352 1.00 10.00 C ATOM 1580 CG HIS B 52 -4.044 -14.816 8.563 1.00 10.00 C ATOM 1581 ND1 HIS B 52 -2.697 -15.103 8.498 1.00 10.00 N ATOM 1582 CD2 HIS B 52 -4.368 -14.836 9.878 1.00 10.00 C ATOM 1583 CE1 HIS B 52 -2.232 -15.287 9.719 1.00 10.00 C ATOM 1584 NE2 HIS B 52 -3.224 -15.130 10.576 1.00 10.00 N ATOM 1585 OXT HIS B 52 -4.559 -11.446 6.399 1.00 10.00 O ATOM 0 H HIS B 52 -6.443 -12.316 5.744 1.00 10.00 H new ATOM 0 HA HIS B 52 -6.258 -13.274 8.397 1.00 10.00 H new ATOM 0 HB2 HIS B 52 -5.564 -15.370 7.190 1.00 10.00 H new ATOM 0 HB3 HIS B 52 -4.236 -14.478 6.476 1.00 10.00 H new ATOM 0 HD2 HIS B 52 -5.346 -14.654 10.299 1.00 10.00 H new ATOM 0 HE1 HIS B 52 -1.210 -15.526 9.975 1.00 10.00 H new ATOM 0 HE2 HIS B 52 -3.152 -15.214 11.590 1.00 10.00 H new TER 1594 HIS B 52