USER MOD reduce.3.24.130724 H: found=0, std=0, add=1944, rem=0, adj=71 USER MOD reduce.3.24.130724 removed 1943 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: B 86 CYS SG : rot -155:sc= -2.96! USER MOD Set 1.2: C1934 MET CE :methyl 158:sc= -2.93! (180deg=-3.79!) USER MOD Set 2.1: B 81 CYS SG : rot -97:sc= -10.5! USER MOD Set 2.2: B 85 MET CE :methyl -170:sc= -0.0166 (180deg=-0.221) USER MOD Set 3.1: B 31 LYS NZ :NH3+ -152:sc= 1.23 (180deg=-0.128) USER MOD Set 3.2: B 68 ASN : amide:sc= -0.121 K(o=1.1,f=-6.5!) USER MOD Set 4.1: A 12 MET CE :methyl 155:sc= 0 (180deg=-0.649) USER MOD Set 4.2: A 80 SER OG : rot -124:sc= 0.0886 USER MOD Set 4.3: B 12 MET CE :methyl -179:sc= -1.68 (180deg=-1.77) USER MOD Set 4.4: B 80 SER OG : rot -150:sc= -1.23! USER MOD Set 5.1: A 81 CYS SG : rot 97:sc= -5.52! USER MOD Set 5.2: A 84 MET CE :methyl -159:sc= -3.94! (180deg=-5.55!) USER MOD Set 5.3: C1910 MET CE :methyl 180:sc= -5.52! (180deg=-5.34!) USER MOD Set 6.1: A 73 GLN : amide:sc= -2.27! C(o=-0.63!,f=-6.7!) USER MOD Set 6.2: B 97 GLN : amide:sc= 1.3 K(o=-0.63,f=-11!) USER MOD Set 6.3: C1918 LYS NZ :NH3+ 178:sc= 0.343 (180deg=-0.881) USER MOD Set 7.1: A 64 SER OG : rot -91:sc= 1.18 USER MOD Set 7.2: C1911 ASN : amide:sc= 0.0204 X(o=1.2,f=0.89) USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 170:sc= 1.14 (180deg=0.848) USER MOD Single : A 3 CYS SG : rot 155:sc= 0.505 USER MOD Single : A 7 LYS NZ :NH3+ 167:sc= 1.28 (180deg=0.819) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 15 THR OG1 : rot -131:sc= 0.952 USER MOD Single : A 17 HIS : no HD1:sc= -1.29 K(o=-1.3,f=-5.2!) USER MOD Single : A 18 LYS NZ :NH3+ 162:sc= 1.32 (180deg=1.12) USER MOD Single : A 19 TYR OH : rot 180:sc=-0.00323 USER MOD Single : A 20 SER OG : rot -82:sc= 0.84 USER MOD Single : A 22 LYS NZ :NH3+ -142:sc= 1.16 (180deg=1.03) USER MOD Single : A 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 28 LYS NZ :NH3+ -178:sc= 1.18 (180deg=1.12) USER MOD Single : A 30 ASN : amide:sc= -0.965! C(o=-0.97!,f=-5.9!) USER MOD Single : A 31 LYS NZ :NH3+ -172:sc= 0 (180deg=-0.0965) USER MOD Single : A 32 SER OG : rot 180:sc= 0 USER MOD Single : A 35 LYS NZ :NH3+ 174:sc= 1.13 (180deg=1.03) USER MOD Single : A 39 THR OG1 : rot -68:sc= -1.4! USER MOD Single : A 44 SER OG : rot 125:sc= 1.28 USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot 90:sc= -2.48! USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 57 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 59 MET CE :methyl 161:sc= -3.3 (180deg=-4.63!) USER MOD Single : A 60 SER OG : rot 180:sc= 0 USER MOD Single : A 61 ASN : amide:sc= -0.739 K(o=-0.74,f=-1.5!) USER MOD Single : A 65 ASN :FLIP amide:sc= -0.154 F(o=-1.5,f=-0.15) USER MOD Single : A 68 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 75 TYR OH : rot 0:sc= -2.85! USER MOD Single : A 76 CYS SG : rot 58:sc= -4.16! USER MOD Single : A 85 MET CE :methyl -174:sc= -6.47! (180deg=-7.14!) USER MOD Single : A 86 CYS SG : rot -30:sc= 0.0621 USER MOD Single : A 87 ASN : amide:sc= -0.0419 X(o=-0.042,f=0) USER MOD Single : A 96 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 97 GLN : amide:sc= -0.0486 K(o=-0.049,f=-0.7) USER MOD Single : A 100 LYS NZ :NH3+ -133:sc= -0.101 (180deg=-0.529) USER MOD Single : A 101 LYS NZ :NH3+ -168:sc=-0.00836 (180deg=-0.191) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ -118:sc= 0.0993 (180deg=-0.0229) USER MOD Single : B 3 CYS SG : rot 156:sc= 0.541 USER MOD Single : B 7 LYS NZ :NH3+ 138:sc= 1.23 (180deg=0.771) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 15 THR OG1 : rot -132:sc= 1.07 USER MOD Single : B 17 HIS :FLIP no HD1:sc= -0.54 F(o=-1.6,f=-0.54) USER MOD Single : B 18 LYS NZ :NH3+ 156:sc= 1.24 (180deg=1.13) USER MOD Single : B 19 TYR OH : rot 180:sc=-0.00251 USER MOD Single : B 20 SER OG : rot -80:sc= 0.951 USER MOD Single : B 22 LYS NZ :NH3+ -165:sc= 1.23 (180deg=1.14) USER MOD Single : B 26 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 28 LYS NZ :NH3+ -172:sc= 1.3 (180deg=1.12) USER MOD Single : B 30 ASN : amide:sc= -1.17! C(o=-1.2!,f=-6.3!) USER MOD Single : B 32 SER OG : rot 180:sc= 0 USER MOD Single : B 35 LYS NZ :NH3+ -167:sc= 1.21 (180deg=1.12) USER MOD Single : B 39 THR OG1 : rot -2:sc= -1.4! USER MOD Single : B 44 SER OG : rot 118:sc= 1.24 USER MOD Single : B 48 LYS NZ :NH3+ 167:sc= -0.0278 (180deg=-0.22) USER MOD Single : B 50 THR OG1 : rot 49:sc= 0.037 USER MOD Single : B 56 GLN : amide:sc= 0 K(o=0,f=-0.68) USER MOD Single : B 57 LYS NZ :NH3+ -173:sc= 0 (180deg=-0.0777) USER MOD Single : B 59 MET CE :methyl 175:sc= -4.97! (180deg=-5.06!) USER MOD Single : B 60 SER OG : rot 5:sc= 0.944 USER MOD Single : B 61 ASN :FLIP amide:sc= -2.44! C(o=-3.9!,f=-2.4!) USER MOD Single : B 64 SER OG : rot 101:sc= 0.806 USER MOD Single : B 65 ASN :FLIP amide:sc= -0.221 F(o=-3.5!,f=-0.22) USER MOD Single : B 73 GLN : amide:sc= 0.876 K(o=0.88,f=-1.1) USER MOD Single : B 75 TYR OH : rot -15:sc= -0.908 USER MOD Single : B 76 CYS SG : rot 77:sc= 0.468 USER MOD Single : B 84 MET CE :methyl 149:sc= -7.64! (180deg=-11.7!) USER MOD Single : B 87 ASN :FLIP amide:sc= -1.84! C(o=-2.7!,f=-1.8!) USER MOD Single : B 96 LYS NZ :NH3+ -147:sc= 0.22! (180deg=-0.0212) USER MOD Single : B 100 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 101 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : C1897 GLN :FLIP amide:sc= -3.49! C(o=-4.6!,f=-3.5!) USER MOD Single : C1904 THR OG1 : rot -17:sc= 0.852 USER MOD Single : C1906 THR OG1 : rot 81:sc= 0.844 USER MOD Single : C1915 SER OG : rot -89:sc= 0.435 USER MOD Single : C1916 SER OG : rot 180:sc= 0 USER MOD Single : C1919 ASN : amide:sc= -0.205 K(o=-0.2,f=-5.3!) USER MOD Single : C1920 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLN C1897 -19.359 -11.752 0.971 1.00 1.90 N ATOM 2 CA GLN C1897 -18.889 -10.412 0.559 1.00 1.28 C ATOM 3 C GLN C1897 -18.191 -9.713 1.722 1.00 1.03 C ATOM 4 O GLN C1897 -18.232 -10.198 2.855 1.00 1.73 O ATOM 5 CB GLN C1897 -20.079 -9.567 0.080 1.00 1.38 C ATOM 6 CG GLN C1897 -19.700 -8.157 -0.341 1.00 1.18 C ATOM 7 CD GLN C1897 -20.883 -7.286 -0.648 1.00 1.58 C ATOM 8 OE1 GLN C1897 -20.687 -6.370 -1.566 1.00 2.33 O flip ATOM 9 NE2 GLN C1897 -21.956 -7.430 -0.068 1.00 1.78 N flip ATOM 0 HA GLN C1897 -18.177 -10.526 -0.258 1.00 1.28 H new ATOM 0 HB2 GLN C1897 -20.556 -10.071 -0.761 1.00 1.38 H new ATOM 0 HB3 GLN C1897 -20.818 -9.511 0.879 1.00 1.38 H new ATOM 0 HG2 GLN C1897 -19.114 -7.694 0.453 1.00 1.18 H new ATOM 0 HG3 GLN C1897 -19.059 -8.209 -1.221 1.00 1.18 H new ATOM 0 HE21 GLN C1897 -22.060 -8.158 0.639 1.00 1.78 H new ATOM 0 HE22 GLN C1897 -22.743 -6.822 -0.294 1.00 1.78 H new ATOM 20 N ARG C1898 -17.512 -8.607 1.406 1.00 0.67 N ATOM 21 CA ARG C1898 -16.945 -7.700 2.372 1.00 0.76 C ATOM 22 C ARG C1898 -15.608 -8.238 2.825 1.00 0.64 C ATOM 23 O ARG C1898 -15.343 -8.434 4.005 1.00 0.95 O ATOM 24 CB ARG C1898 -17.905 -7.462 3.524 1.00 1.15 C ATOM 25 CG ARG C1898 -17.444 -6.403 4.517 1.00 1.54 C ATOM 26 CD ARG C1898 -18.423 -6.243 5.667 1.00 2.04 C ATOM 27 NE ARG C1898 -18.461 -7.428 6.517 1.00 2.71 N ATOM 28 CZ ARG C1898 -19.131 -7.511 7.662 1.00 3.58 C ATOM 29 NH1 ARG C1898 -19.835 -6.479 8.108 1.00 3.84 N ATOM 30 NH2 ARG C1898 -19.087 -8.636 8.364 1.00 4.54 N ATOM 0 H ARG C1898 -17.344 -8.322 0.441 1.00 0.67 H new ATOM 0 HA ARG C1898 -16.779 -6.724 1.915 1.00 0.76 H new ATOM 0 HB2 ARG C1898 -18.873 -7.167 3.119 1.00 1.15 H new ATOM 0 HB3 ARG C1898 -18.055 -8.401 4.056 1.00 1.15 H new ATOM 0 HG2 ARG C1898 -16.464 -6.675 4.909 1.00 1.54 H new ATOM 0 HG3 ARG C1898 -17.328 -5.449 4.003 1.00 1.54 H new ATOM 0 HD2 ARG C1898 -18.142 -5.376 6.265 1.00 2.04 H new ATOM 0 HD3 ARG C1898 -19.420 -6.048 5.271 1.00 2.04 H new ATOM 0 HE ARG C1898 -17.938 -8.249 6.212 1.00 2.71 H new ATOM 0 HH11 ARG C1898 -19.865 -5.612 7.571 1.00 3.84 H new ATOM 0 HH12 ARG C1898 -20.346 -6.552 8.988 1.00 3.84 H new ATOM 0 HH21 ARG C1898 -18.542 -9.428 8.024 1.00 4.54 H new ATOM 0 HH22 ARG C1898 -19.598 -8.708 9.244 1.00 4.54 H new ATOM 44 N GLU C1899 -14.779 -8.483 1.833 1.00 0.40 N ATOM 45 CA GLU C1899 -13.392 -8.847 2.015 1.00 0.29 C ATOM 46 C GLU C1899 -12.708 -7.830 2.899 1.00 0.24 C ATOM 47 O GLU C1899 -11.791 -8.149 3.653 1.00 0.27 O ATOM 48 CB GLU C1899 -12.720 -8.845 0.651 1.00 0.30 C ATOM 49 CG GLU C1899 -13.264 -7.735 -0.239 1.00 0.35 C ATOM 50 CD GLU C1899 -14.407 -8.209 -1.124 1.00 0.62 C ATOM 51 OE1 GLU C1899 -14.150 -8.695 -2.239 1.00 0.76 O ATOM 52 OE2 GLU C1899 -15.578 -8.122 -0.679 1.00 0.97 O ATOM 0 H GLU C1899 -15.059 -8.433 0.853 1.00 0.40 H new ATOM 0 HA GLU C1899 -13.323 -9.830 2.480 1.00 0.29 H new ATOM 0 HB2 GLU C1899 -11.644 -8.719 0.775 1.00 0.30 H new ATOM 0 HB3 GLU C1899 -12.875 -9.809 0.167 1.00 0.30 H new ATOM 0 HG2 GLU C1899 -13.609 -6.910 0.384 1.00 0.35 H new ATOM 0 HG3 GLU C1899 -12.460 -7.348 -0.865 1.00 0.35 H new ATOM 59 N LEU C1900 -13.198 -6.598 2.807 1.00 0.24 N ATOM 60 CA LEU C1900 -12.617 -5.476 3.504 1.00 0.25 C ATOM 61 C LEU C1900 -12.654 -5.685 5.025 1.00 0.28 C ATOM 62 O LEU C1900 -11.889 -5.063 5.755 1.00 0.44 O ATOM 63 CB LEU C1900 -13.334 -4.163 3.131 1.00 0.33 C ATOM 64 CG LEU C1900 -13.123 -3.607 1.717 1.00 0.20 C ATOM 65 CD1 LEU C1900 -11.657 -3.594 1.342 1.00 0.22 C ATOM 66 CD2 LEU C1900 -13.953 -4.328 0.681 1.00 0.31 C ATOM 0 H LEU C1900 -14.013 -6.358 2.242 1.00 0.24 H new ATOM 0 HA LEU C1900 -11.575 -5.403 3.194 1.00 0.25 H new ATOM 0 HB2 LEU C1900 -14.404 -4.314 3.275 1.00 0.33 H new ATOM 0 HB3 LEU C1900 -13.021 -3.398 3.841 1.00 0.33 H new ATOM 0 HG LEU C1900 -13.473 -2.575 1.732 1.00 0.20 H new ATOM 0 HD11 LEU C1900 -11.543 -3.194 0.334 1.00 0.22 H new ATOM 0 HD12 LEU C1900 -11.107 -2.968 2.045 1.00 0.22 H new ATOM 0 HD13 LEU C1900 -11.264 -4.610 1.376 1.00 0.22 H new ATOM 0 HD21 LEU C1900 -13.765 -3.895 -0.301 1.00 0.31 H new ATOM 0 HD22 LEU C1900 -13.683 -5.384 0.669 1.00 0.31 H new ATOM 0 HD23 LEU C1900 -15.010 -4.226 0.927 1.00 0.31 H new ATOM 78 N GLU C1901 -13.526 -6.574 5.505 1.00 0.27 N ATOM 79 CA GLU C1901 -13.618 -6.839 6.941 1.00 0.34 C ATOM 80 C GLU C1901 -12.360 -7.552 7.433 1.00 0.37 C ATOM 81 O GLU C1901 -11.858 -7.269 8.516 1.00 0.52 O ATOM 82 CB GLU C1901 -14.868 -7.668 7.282 1.00 0.48 C ATOM 83 CG GLU C1901 -14.821 -9.111 6.796 1.00 1.00 C ATOM 84 CD GLU C1901 -16.113 -9.860 7.047 1.00 1.11 C ATOM 85 OE1 GLU C1901 -17.075 -9.682 6.272 1.00 1.44 O ATOM 86 OE2 GLU C1901 -16.175 -10.630 8.027 1.00 1.48 O ATOM 0 H GLU C1901 -14.170 -7.116 4.929 1.00 0.27 H new ATOM 0 HA GLU C1901 -13.704 -5.879 7.450 1.00 0.34 H new ATOM 0 HB2 GLU C1901 -15.006 -7.666 8.363 1.00 0.48 H new ATOM 0 HB3 GLU C1901 -15.741 -7.180 6.849 1.00 0.48 H new ATOM 0 HG2 GLU C1901 -14.602 -9.122 5.728 1.00 1.00 H new ATOM 0 HG3 GLU C1901 -14.003 -9.631 7.295 1.00 1.00 H new ATOM 93 N ASP C1902 -11.861 -8.481 6.630 1.00 0.37 N ATOM 94 CA ASP C1902 -10.651 -9.210 6.973 1.00 0.46 C ATOM 95 C ASP C1902 -9.431 -8.502 6.399 1.00 0.44 C ATOM 96 O ASP C1902 -8.323 -8.601 6.930 1.00 0.58 O ATOM 97 CB ASP C1902 -10.731 -10.642 6.446 1.00 0.60 C ATOM 98 CG ASP C1902 -9.600 -11.507 6.958 1.00 1.18 C ATOM 99 OD1 ASP C1902 -9.680 -11.989 8.107 1.00 1.42 O ATOM 100 OD2 ASP C1902 -8.621 -11.712 6.209 1.00 2.01 O ATOM 0 H ASP C1902 -12.276 -8.747 5.737 1.00 0.37 H new ATOM 0 HA ASP C1902 -10.556 -9.243 8.058 1.00 0.46 H new ATOM 0 HB2 ASP C1902 -11.684 -11.082 6.740 1.00 0.60 H new ATOM 0 HB3 ASP C1902 -10.710 -10.627 5.356 1.00 0.60 H new ATOM 105 N ALA C1903 -9.655 -7.780 5.314 1.00 0.36 N ATOM 106 CA ALA C1903 -8.588 -7.084 4.612 1.00 0.46 C ATOM 107 C ALA C1903 -8.131 -5.843 5.365 1.00 0.37 C ATOM 108 O ALA C1903 -7.026 -5.804 5.904 1.00 0.37 O ATOM 109 CB ALA C1903 -9.050 -6.698 3.217 1.00 0.66 C ATOM 0 H ALA C1903 -10.577 -7.660 4.896 1.00 0.36 H new ATOM 0 HA ALA C1903 -7.739 -7.764 4.544 1.00 0.46 H new ATOM 0 HB1 ALA C1903 -8.245 -6.177 2.698 1.00 0.66 H new ATOM 0 HB2 ALA C1903 -9.319 -7.596 2.661 1.00 0.66 H new ATOM 0 HB3 ALA C1903 -9.918 -6.043 3.290 1.00 0.66 H new ATOM 115 N THR C1904 -8.997 -4.837 5.425 1.00 0.37 N ATOM 116 CA THR C1904 -8.607 -3.540 5.946 1.00 0.36 C ATOM 117 C THR C1904 -8.779 -3.457 7.458 1.00 0.34 C ATOM 118 O THR C1904 -8.596 -2.402 8.050 1.00 0.36 O ATOM 119 CB THR C1904 -9.383 -2.405 5.254 1.00 0.40 C ATOM 120 OG1 THR C1904 -10.793 -2.593 5.414 1.00 0.42 O ATOM 121 CG2 THR C1904 -9.041 -2.357 3.774 1.00 0.40 C ATOM 0 H THR C1904 -9.968 -4.898 5.120 1.00 0.37 H new ATOM 0 HA THR C1904 -7.546 -3.418 5.726 1.00 0.36 H new ATOM 0 HB THR C1904 -9.095 -1.462 5.719 1.00 0.40 H new ATOM 0 HG1 THR C1904 -10.972 -3.519 5.679 1.00 0.42 H new ATOM 0 HG21 THR C1904 -9.597 -1.550 3.298 1.00 0.40 H new ATOM 0 HG22 THR C1904 -7.972 -2.182 3.653 1.00 0.40 H new ATOM 0 HG23 THR C1904 -9.308 -3.305 3.308 1.00 0.40 H new ATOM 129 N GLU C1905 -9.129 -4.572 8.080 1.00 0.32 N ATOM 130 CA GLU C1905 -9.048 -4.681 9.532 1.00 0.32 C ATOM 131 C GLU C1905 -7.618 -4.396 9.942 1.00 0.28 C ATOM 132 O GLU C1905 -7.343 -3.597 10.837 1.00 0.32 O ATOM 133 CB GLU C1905 -9.411 -6.090 9.969 1.00 0.36 C ATOM 134 CG GLU C1905 -9.305 -6.335 11.472 1.00 0.62 C ATOM 135 CD GLU C1905 -10.186 -5.417 12.299 1.00 1.25 C ATOM 136 OE1 GLU C1905 -11.385 -5.725 12.467 1.00 1.76 O ATOM 137 OE2 GLU C1905 -9.677 -4.399 12.806 1.00 2.06 O ATOM 0 H GLU C1905 -9.470 -5.410 7.608 1.00 0.32 H new ATOM 0 HA GLU C1905 -9.737 -3.976 9.996 1.00 0.32 H new ATOM 0 HB2 GLU C1905 -10.431 -6.304 9.650 1.00 0.36 H new ATOM 0 HB3 GLU C1905 -8.761 -6.796 9.452 1.00 0.36 H new ATOM 0 HG2 GLU C1905 -9.573 -7.370 11.683 1.00 0.62 H new ATOM 0 HG3 GLU C1905 -8.268 -6.205 11.781 1.00 0.62 H new ATOM 144 N THR C1906 -6.715 -5.054 9.226 1.00 0.25 N ATOM 145 CA THR C1906 -5.290 -4.938 9.446 1.00 0.24 C ATOM 146 C THR C1906 -4.774 -3.566 9.025 1.00 0.21 C ATOM 147 O THR C1906 -3.619 -3.226 9.287 1.00 0.19 O ATOM 148 CB THR C1906 -4.551 -6.028 8.654 1.00 0.29 C ATOM 149 OG1 THR C1906 -5.509 -6.923 8.063 1.00 0.48 O ATOM 150 CG2 THR C1906 -3.611 -6.811 9.557 1.00 0.47 C ATOM 0 H THR C1906 -6.961 -5.690 8.468 1.00 0.25 H new ATOM 0 HA THR C1906 -5.103 -5.062 10.513 1.00 0.24 H new ATOM 0 HB THR C1906 -3.960 -5.549 7.873 1.00 0.29 H new ATOM 0 HG1 THR C1906 -5.868 -6.523 7.243 1.00 0.48 H new ATOM 0 HG21 THR C1906 -3.100 -7.577 8.973 1.00 0.47 H new ATOM 0 HG22 THR C1906 -2.875 -6.134 9.991 1.00 0.47 H new ATOM 0 HG23 THR C1906 -4.183 -7.285 10.355 1.00 0.47 H new ATOM 158 N ALA C1907 -5.630 -2.780 8.363 1.00 0.23 N ATOM 159 CA ALA C1907 -5.250 -1.439 7.946 1.00 0.21 C ATOM 160 C ALA C1907 -4.911 -0.595 9.157 1.00 0.21 C ATOM 161 O ALA C1907 -3.886 0.079 9.188 1.00 0.21 O ATOM 162 CB ALA C1907 -6.342 -0.769 7.123 1.00 0.22 C ATOM 0 H ALA C1907 -6.580 -3.052 8.110 1.00 0.23 H new ATOM 0 HA ALA C1907 -4.370 -1.527 7.309 1.00 0.21 H new ATOM 0 HB1 ALA C1907 -6.017 0.230 6.832 1.00 0.22 H new ATOM 0 HB2 ALA C1907 -6.539 -1.361 6.229 1.00 0.22 H new ATOM 0 HB3 ALA C1907 -7.253 -0.696 7.718 1.00 0.22 H new ATOM 168 N ASP C1908 -5.781 -0.656 10.155 1.00 0.24 N ATOM 169 CA ASP C1908 -5.547 0.004 11.432 1.00 0.26 C ATOM 170 C ASP C1908 -4.181 -0.380 12.001 1.00 0.27 C ATOM 171 O ASP C1908 -3.447 0.475 12.505 1.00 0.34 O ATOM 172 CB ASP C1908 -6.656 -0.373 12.418 1.00 0.33 C ATOM 173 CG ASP C1908 -6.463 0.230 13.793 1.00 0.44 C ATOM 174 OD1 ASP C1908 -6.817 1.409 13.988 1.00 0.58 O ATOM 175 OD2 ASP C1908 -5.973 -0.478 14.696 1.00 0.68 O ATOM 0 H ASP C1908 -6.665 -1.162 10.103 1.00 0.24 H new ATOM 0 HA ASP C1908 -5.557 1.082 11.274 1.00 0.26 H new ATOM 0 HB2 ASP C1908 -7.616 -0.047 12.017 1.00 0.33 H new ATOM 0 HB3 ASP C1908 -6.700 -1.458 12.507 1.00 0.33 H new ATOM 180 N ALA C1909 -3.833 -1.662 11.900 1.00 0.23 N ATOM 181 CA ALA C1909 -2.537 -2.137 12.370 1.00 0.24 C ATOM 182 C ALA C1909 -1.399 -1.543 11.547 1.00 0.22 C ATOM 183 O ALA C1909 -0.593 -0.786 12.068 1.00 0.24 O ATOM 184 CB ALA C1909 -2.471 -3.651 12.351 1.00 0.27 C ATOM 0 H ALA C1909 -4.429 -2.386 11.498 1.00 0.23 H new ATOM 0 HA ALA C1909 -2.420 -1.803 13.401 1.00 0.24 H new ATOM 0 HB1 ALA C1909 -1.494 -3.977 12.706 1.00 0.27 H new ATOM 0 HB2 ALA C1909 -3.247 -4.057 13.000 1.00 0.27 H new ATOM 0 HB3 ALA C1909 -2.625 -4.009 11.333 1.00 0.27 H new ATOM 190 N MET C1910 -1.331 -1.883 10.262 1.00 0.19 N ATOM 191 CA MET C1910 -0.337 -1.297 9.364 1.00 0.19 C ATOM 192 C MET C1910 -0.228 0.225 9.510 1.00 0.19 C ATOM 193 O MET C1910 0.861 0.758 9.498 1.00 0.22 O ATOM 194 CB MET C1910 -0.676 -1.650 7.917 1.00 0.18 C ATOM 195 CG MET C1910 0.090 -0.832 6.887 1.00 0.20 C ATOM 196 SD MET C1910 -0.320 -1.303 5.208 1.00 0.20 S ATOM 197 CE MET C1910 0.113 -3.037 5.249 1.00 0.14 C ATOM 0 H MET C1910 -1.951 -2.561 9.819 1.00 0.19 H new ATOM 0 HA MET C1910 0.630 -1.717 9.641 1.00 0.19 H new ATOM 0 HB2 MET C1910 -0.469 -2.708 7.753 1.00 0.18 H new ATOM 0 HB3 MET C1910 -1.745 -1.506 7.759 1.00 0.18 H new ATOM 0 HG2 MET C1910 -0.130 0.226 7.030 1.00 0.20 H new ATOM 0 HG3 MET C1910 1.161 -0.960 7.047 1.00 0.20 H new ATOM 0 HE1 MET C1910 -0.083 -3.484 4.274 1.00 0.14 H new ATOM 0 HE2 MET C1910 1.171 -3.142 5.491 1.00 0.14 H new ATOM 0 HE3 MET C1910 -0.484 -3.543 6.007 1.00 0.14 H new ATOM 207 N ASN C1911 -1.342 0.912 9.675 1.00 0.21 N ATOM 208 CA ASN C1911 -1.349 2.379 9.729 1.00 0.22 C ATOM 209 C ASN C1911 -0.555 2.929 10.911 1.00 0.23 C ATOM 210 O ASN C1911 0.073 3.981 10.805 1.00 0.27 O ATOM 211 CB ASN C1911 -2.787 2.873 9.813 1.00 0.24 C ATOM 212 CG ASN C1911 -2.901 4.379 9.797 1.00 0.25 C ATOM 213 OD1 ASN C1911 -2.840 5.035 10.838 1.00 0.42 O ATOM 214 ND2 ASN C1911 -3.088 4.935 8.614 1.00 0.25 N ATOM 0 H ASN C1911 -2.263 0.484 9.775 1.00 0.21 H new ATOM 0 HA ASN C1911 -0.868 2.740 8.820 1.00 0.22 H new ATOM 0 HB2 ASN C1911 -3.354 2.463 8.977 1.00 0.24 H new ATOM 0 HB3 ASN C1911 -3.243 2.490 10.726 1.00 0.24 H new ATOM 0 HD21 ASN C1911 -3.188 5.947 8.536 1.00 0.25 H new ATOM 0 HD22 ASN C1911 -3.132 4.352 7.778 1.00 0.25 H new ATOM 221 N ARG C1912 -0.566 2.223 12.028 1.00 0.23 N ATOM 222 CA ARG C1912 0.095 2.704 13.222 1.00 0.26 C ATOM 223 C ARG C1912 1.605 2.595 13.061 1.00 0.28 C ATOM 224 O ARG C1912 2.364 3.400 13.600 1.00 0.38 O ATOM 225 CB ARG C1912 -0.405 1.904 14.429 1.00 0.30 C ATOM 226 CG ARG C1912 0.649 1.051 15.103 1.00 0.75 C ATOM 227 CD ARG C1912 0.835 -0.265 14.378 1.00 1.46 C ATOM 228 NE ARG C1912 2.011 -0.993 14.843 1.00 2.17 N ATOM 229 CZ ARG C1912 2.437 -2.135 14.309 1.00 2.91 C ATOM 230 NH1 ARG C1912 1.738 -2.715 13.342 1.00 3.13 N ATOM 231 NH2 ARG C1912 3.550 -2.701 14.750 1.00 3.76 N ATOM 0 H ARG C1912 -1.025 1.318 12.130 1.00 0.23 H new ATOM 0 HA ARG C1912 -0.142 3.755 13.384 1.00 0.26 H new ATOM 0 HB2 ARG C1912 -0.815 2.598 15.163 1.00 0.30 H new ATOM 0 HB3 ARG C1912 -1.223 1.260 14.107 1.00 0.30 H new ATOM 0 HG2 ARG C1912 1.595 1.591 15.130 1.00 0.75 H new ATOM 0 HG3 ARG C1912 0.361 0.862 16.137 1.00 0.75 H new ATOM 0 HD2 ARG C1912 -0.051 -0.883 14.519 1.00 1.46 H new ATOM 0 HD3 ARG C1912 0.926 -0.078 13.308 1.00 1.46 H new ATOM 0 HE ARG C1912 2.538 -0.603 15.624 1.00 2.17 H new ATOM 0 HH11 ARG C1912 0.875 -2.286 13.009 1.00 3.13 H new ATOM 0 HH12 ARG C1912 2.064 -3.590 12.932 1.00 3.13 H new ATOM 0 HH21 ARG C1912 4.083 -2.262 15.501 1.00 3.76 H new ATOM 0 HH22 ARG C1912 3.874 -3.576 14.339 1.00 3.76 H new ATOM 245 N GLU C1913 2.029 1.591 12.311 1.00 0.23 N ATOM 246 CA GLU C1913 3.438 1.388 12.057 1.00 0.25 C ATOM 247 C GLU C1913 3.849 2.136 10.807 1.00 0.22 C ATOM 248 O GLU C1913 4.934 2.671 10.748 1.00 0.27 O ATOM 249 CB GLU C1913 3.763 -0.100 11.906 1.00 0.29 C ATOM 250 CG GLU C1913 3.078 -0.758 10.721 1.00 0.29 C ATOM 251 CD GLU C1913 3.401 -2.226 10.595 1.00 0.39 C ATOM 252 OE1 GLU C1913 4.279 -2.714 11.336 1.00 0.79 O ATOM 253 OE2 GLU C1913 2.767 -2.904 9.763 1.00 0.57 O ATOM 0 H GLU C1913 1.415 0.907 11.870 1.00 0.23 H new ATOM 0 HA GLU C1913 3.997 1.773 12.910 1.00 0.25 H new ATOM 0 HB2 GLU C1913 4.842 -0.218 11.802 1.00 0.29 H new ATOM 0 HB3 GLU C1913 3.471 -0.621 12.818 1.00 0.29 H new ATOM 0 HG2 GLU C1913 1.999 -0.636 10.818 1.00 0.29 H new ATOM 0 HG3 GLU C1913 3.376 -0.246 9.806 1.00 0.29 H new ATOM 260 N VAL C1914 2.948 2.194 9.833 1.00 0.19 N ATOM 261 CA VAL C1914 3.232 2.764 8.521 1.00 0.20 C ATOM 262 C VAL C1914 3.544 4.247 8.619 1.00 0.18 C ATOM 263 O VAL C1914 4.358 4.774 7.864 1.00 0.20 O ATOM 264 CB VAL C1914 2.035 2.573 7.558 1.00 0.24 C ATOM 265 CG1 VAL C1914 0.922 3.532 7.888 1.00 0.26 C ATOM 266 CG2 VAL C1914 2.438 2.743 6.116 1.00 0.29 C ATOM 0 H VAL C1914 1.995 1.845 9.932 1.00 0.19 H new ATOM 0 HA VAL C1914 4.102 2.236 8.131 1.00 0.20 H new ATOM 0 HB VAL C1914 1.682 1.551 7.694 1.00 0.24 H new ATOM 0 HG11 VAL C1914 0.093 3.378 7.198 1.00 0.26 H new ATOM 0 HG12 VAL C1914 0.582 3.357 8.909 1.00 0.26 H new ATOM 0 HG13 VAL C1914 1.285 4.556 7.797 1.00 0.26 H new ATOM 0 HG21 VAL C1914 1.567 2.600 5.476 1.00 0.29 H new ATOM 0 HG22 VAL C1914 2.839 3.746 5.966 1.00 0.29 H new ATOM 0 HG23 VAL C1914 3.200 2.006 5.862 1.00 0.29 H new ATOM 276 N SER C1915 2.894 4.914 9.551 1.00 0.21 N ATOM 277 CA SER C1915 3.078 6.330 9.725 1.00 0.28 C ATOM 278 C SER C1915 4.445 6.590 10.325 1.00 0.28 C ATOM 279 O SER C1915 5.081 7.601 10.055 1.00 0.36 O ATOM 280 CB SER C1915 1.959 6.869 10.588 1.00 0.36 C ATOM 281 OG SER C1915 1.853 6.152 11.807 1.00 1.31 O ATOM 0 H SER C1915 2.231 4.490 10.200 1.00 0.21 H new ATOM 0 HA SER C1915 3.039 6.847 8.766 1.00 0.28 H new ATOM 0 HB2 SER C1915 2.136 7.924 10.799 1.00 0.36 H new ATOM 0 HB3 SER C1915 1.016 6.807 10.044 1.00 0.36 H new ATOM 0 HG SER C1915 1.255 5.386 11.685 1.00 1.31 H new ATOM 287 N SER C1916 4.899 5.645 11.130 1.00 0.25 N ATOM 288 CA SER C1916 6.276 5.649 11.576 1.00 0.27 C ATOM 289 C SER C1916 7.175 5.098 10.466 1.00 0.27 C ATOM 290 O SER C1916 8.299 5.545 10.285 1.00 0.29 O ATOM 291 CB SER C1916 6.421 4.813 12.850 1.00 0.31 C ATOM 292 OG SER C1916 7.757 4.813 13.318 1.00 1.04 O ATOM 0 H SER C1916 4.337 4.871 11.485 1.00 0.25 H new ATOM 0 HA SER C1916 6.579 6.671 11.802 1.00 0.27 H new ATOM 0 HB2 SER C1916 5.763 5.209 13.624 1.00 0.31 H new ATOM 0 HB3 SER C1916 6.103 3.789 12.654 1.00 0.31 H new ATOM 0 HG SER C1916 7.818 4.272 14.133 1.00 1.04 H new ATOM 298 N LEU C1917 6.638 4.151 9.703 1.00 0.30 N ATOM 299 CA LEU C1917 7.375 3.418 8.681 1.00 0.30 C ATOM 300 C LEU C1917 7.805 4.329 7.549 1.00 0.26 C ATOM 301 O LEU C1917 8.985 4.402 7.222 1.00 0.26 O ATOM 302 CB LEU C1917 6.508 2.276 8.131 1.00 0.42 C ATOM 303 CG LEU C1917 7.234 1.161 7.365 1.00 0.57 C ATOM 304 CD1 LEU C1917 7.302 1.459 5.884 1.00 1.25 C ATOM 305 CD2 LEU C1917 8.622 0.974 7.903 1.00 1.16 C ATOM 0 H LEU C1917 5.661 3.867 9.779 1.00 0.30 H new ATOM 0 HA LEU C1917 8.273 3.007 9.142 1.00 0.30 H new ATOM 0 HB2 LEU C1917 5.975 1.822 8.966 1.00 0.42 H new ATOM 0 HB3 LEU C1917 5.757 2.708 7.470 1.00 0.42 H new ATOM 0 HG LEU C1917 6.663 0.243 7.505 1.00 0.57 H new ATOM 0 HD11 LEU C1917 7.822 0.649 5.373 1.00 1.25 H new ATOM 0 HD12 LEU C1917 6.292 1.550 5.484 1.00 1.25 H new ATOM 0 HD13 LEU C1917 7.841 2.393 5.725 1.00 1.25 H new ATOM 0 HD21 LEU C1917 9.123 0.180 7.349 1.00 1.16 H new ATOM 0 HD22 LEU C1917 9.183 1.902 7.794 1.00 1.16 H new ATOM 0 HD23 LEU C1917 8.570 0.704 8.958 1.00 1.16 H new ATOM 317 N LYS C1918 6.852 5.033 6.954 1.00 0.28 N ATOM 318 CA LYS C1918 7.168 5.877 5.822 1.00 0.29 C ATOM 319 C LYS C1918 8.092 7.019 6.264 1.00 0.32 C ATOM 320 O LYS C1918 8.729 7.677 5.445 1.00 0.38 O ATOM 321 CB LYS C1918 5.893 6.385 5.119 1.00 0.39 C ATOM 322 CG LYS C1918 5.530 7.827 5.389 1.00 0.29 C ATOM 323 CD LYS C1918 4.932 7.997 6.775 1.00 0.40 C ATOM 324 CE LYS C1918 5.613 9.110 7.530 1.00 0.69 C ATOM 325 NZ LYS C1918 5.578 10.408 6.799 1.00 1.36 N ATOM 0 H LYS C1918 5.871 5.034 7.234 1.00 0.28 H new ATOM 0 HA LYS C1918 7.703 5.285 5.080 1.00 0.29 H new ATOM 0 HB2 LYS C1918 6.016 6.255 4.044 1.00 0.39 H new ATOM 0 HB3 LYS C1918 5.057 5.755 5.423 1.00 0.39 H new ATOM 0 HG2 LYS C1918 6.419 8.451 5.295 1.00 0.29 H new ATOM 0 HG3 LYS C1918 4.818 8.171 4.639 1.00 0.29 H new ATOM 0 HD2 LYS C1918 3.866 8.210 6.690 1.00 0.40 H new ATOM 0 HD3 LYS C1918 5.027 7.065 7.332 1.00 0.40 H new ATOM 0 HE2 LYS C1918 5.133 9.232 8.501 1.00 0.69 H new ATOM 0 HE3 LYS C1918 6.650 8.833 7.720 1.00 0.69 H new ATOM 0 HZ1 LYS C1918 6.030 11.145 7.378 1.00 1.36 H new ATOM 0 HZ2 LYS C1918 6.089 10.313 5.898 1.00 1.36 H new ATOM 0 HZ3 LYS C1918 4.590 10.674 6.610 1.00 1.36 H new ATOM 339 N ASN C1919 8.170 7.219 7.581 1.00 0.31 N ATOM 340 CA ASN C1919 9.055 8.217 8.164 1.00 0.33 C ATOM 341 C ASN C1919 10.420 7.624 8.466 1.00 0.32 C ATOM 342 O ASN C1919 11.434 8.252 8.203 1.00 0.41 O ATOM 343 CB ASN C1919 8.457 8.802 9.447 1.00 0.37 C ATOM 344 CG ASN C1919 9.433 9.705 10.186 1.00 0.43 C ATOM 345 OD1 ASN C1919 9.548 10.892 9.882 1.00 1.05 O ATOM 346 ND2 ASN C1919 10.129 9.154 11.170 1.00 1.15 N ATOM 0 H ASN C1919 7.624 6.696 8.265 1.00 0.31 H new ATOM 0 HA ASN C1919 9.170 9.016 7.432 1.00 0.33 H new ATOM 0 HB2 ASN C1919 7.559 9.368 9.200 1.00 0.37 H new ATOM 0 HB3 ASN C1919 8.150 7.989 10.105 1.00 0.37 H new ATOM 0 HD21 ASN C1919 10.789 9.718 11.706 1.00 1.15 H new ATOM 0 HD22 ASN C1919 10.005 8.166 11.391 1.00 1.15 H new ATOM 353 N LYS C1920 10.450 6.407 9.006 1.00 0.28 N ATOM 354 CA LYS C1920 11.710 5.772 9.366 1.00 0.37 C ATOM 355 C LYS C1920 12.503 5.452 8.120 1.00 0.41 C ATOM 356 O LYS C1920 13.721 5.347 8.161 1.00 0.53 O ATOM 357 CB LYS C1920 11.508 4.512 10.230 1.00 0.48 C ATOM 358 CG LYS C1920 10.487 3.504 9.705 1.00 0.33 C ATOM 359 CD LYS C1920 10.422 2.272 10.596 1.00 0.44 C ATOM 360 CE LYS C1920 9.775 2.574 11.938 1.00 1.36 C ATOM 361 NZ LYS C1920 9.761 1.382 12.827 1.00 1.64 N ATOM 0 H LYS C1920 9.621 5.846 9.202 1.00 0.28 H new ATOM 0 HA LYS C1920 12.272 6.479 9.975 1.00 0.37 H new ATOM 0 HB2 LYS C1920 12.469 4.007 10.334 1.00 0.48 H new ATOM 0 HB3 LYS C1920 11.202 4.824 11.229 1.00 0.48 H new ATOM 0 HG2 LYS C1920 9.504 3.971 9.654 1.00 0.33 H new ATOM 0 HG3 LYS C1920 10.753 3.208 8.690 1.00 0.33 H new ATOM 0 HD2 LYS C1920 9.859 1.488 10.090 1.00 0.44 H new ATOM 0 HD3 LYS C1920 11.429 1.888 10.757 1.00 0.44 H new ATOM 0 HE2 LYS C1920 10.314 3.385 12.427 1.00 1.36 H new ATOM 0 HE3 LYS C1920 8.754 2.921 11.779 1.00 1.36 H new ATOM 0 HZ1 LYS C1920 9.312 1.629 13.732 1.00 1.64 H new ATOM 0 HZ2 LYS C1920 9.225 0.616 12.372 1.00 1.64 H new ATOM 0 HZ3 LYS C1920 10.737 1.066 13.000 1.00 1.64 H new ATOM 375 N LEU C1921 11.809 5.318 7.004 1.00 0.38 N ATOM 376 CA LEU C1921 12.477 5.133 5.735 1.00 0.46 C ATOM 377 C LEU C1921 13.041 6.458 5.259 1.00 0.59 C ATOM 378 O LEU C1921 14.185 6.542 4.822 1.00 0.92 O ATOM 379 CB LEU C1921 11.529 4.545 4.682 1.00 0.44 C ATOM 380 CG LEU C1921 10.793 3.261 5.083 1.00 0.38 C ATOM 381 CD1 LEU C1921 10.238 2.554 3.863 1.00 0.40 C ATOM 382 CD2 LEU C1921 11.697 2.329 5.862 1.00 0.48 C ATOM 0 H LEU C1921 10.790 5.334 6.953 1.00 0.38 H new ATOM 0 HA LEU C1921 13.291 4.422 5.876 1.00 0.46 H new ATOM 0 HB2 LEU C1921 10.787 5.301 4.427 1.00 0.44 H new ATOM 0 HB3 LEU C1921 12.103 4.344 3.777 1.00 0.44 H new ATOM 0 HG LEU C1921 9.962 3.547 5.728 1.00 0.38 H new ATOM 0 HD11 LEU C1921 9.720 1.646 4.173 1.00 0.40 H new ATOM 0 HD12 LEU C1921 9.539 3.212 3.348 1.00 0.40 H new ATOM 0 HD13 LEU C1921 11.055 2.294 3.190 1.00 0.40 H new ATOM 0 HD21 LEU C1921 11.146 1.428 6.131 1.00 0.48 H new ATOM 0 HD22 LEU C1921 12.556 2.059 5.248 1.00 0.48 H new ATOM 0 HD23 LEU C1921 12.041 2.828 6.768 1.00 0.48 H new ATOM 394 N ARG C1922 12.256 7.506 5.390 1.00 0.49 N ATOM 395 CA ARG C1922 12.689 8.818 4.959 1.00 0.66 C ATOM 396 C ARG C1922 13.588 9.452 6.021 1.00 0.65 C ATOM 397 O ARG C1922 14.070 10.573 5.866 1.00 0.78 O ATOM 398 CB ARG C1922 11.476 9.691 4.661 1.00 0.87 C ATOM 399 CG ARG C1922 11.745 10.724 3.587 1.00 1.15 C ATOM 400 CD ARG C1922 10.456 11.249 2.983 1.00 1.07 C ATOM 401 NE ARG C1922 9.653 12.030 3.930 1.00 1.64 N ATOM 402 CZ ARG C1922 9.968 13.261 4.342 1.00 2.45 C ATOM 403 NH1 ARG C1922 11.112 13.818 3.963 1.00 2.92 N ATOM 404 NH2 ARG C1922 9.137 13.931 5.133 1.00 3.23 N ATOM 0 H ARG C1922 11.318 7.476 5.790 1.00 0.49 H new ATOM 0 HA ARG C1922 13.272 8.725 4.043 1.00 0.66 H new ATOM 0 HB2 ARG C1922 10.646 9.057 4.349 1.00 0.87 H new ATOM 0 HB3 ARG C1922 11.165 10.197 5.575 1.00 0.87 H new ATOM 0 HG2 ARG C1922 12.312 11.552 4.012 1.00 1.15 H new ATOM 0 HG3 ARG C1922 12.362 10.283 2.804 1.00 1.15 H new ATOM 0 HD2 ARG C1922 10.693 11.869 2.119 1.00 1.07 H new ATOM 0 HD3 ARG C1922 9.864 10.409 2.620 1.00 1.07 H new ATOM 0 HE ARG C1922 8.801 11.607 4.297 1.00 1.64 H new ATOM 0 HH11 ARG C1922 11.752 13.306 3.356 1.00 2.92 H new ATOM 0 HH12 ARG C1922 11.351 14.758 4.279 1.00 2.92 H new ATOM 0 HH21 ARG C1922 8.258 13.505 5.426 1.00 3.23 H new ATOM 0 HH22 ARG C1922 9.378 14.871 5.447 1.00 3.23 H new ATOM 418 N ARG C1923 13.814 8.714 7.099 1.00 0.58 N ATOM 419 CA ARG C1923 14.730 9.129 8.140 1.00 0.73 C ATOM 420 C ARG C1923 15.899 8.154 8.194 1.00 1.24 C ATOM 421 O ARG C1923 15.832 7.097 8.819 1.00 2.11 O ATOM 422 CB ARG C1923 14.021 9.219 9.498 1.00 0.81 C ATOM 423 CG ARG C1923 14.762 10.059 10.535 1.00 1.13 C ATOM 424 CD ARG C1923 15.956 9.325 11.122 1.00 1.55 C ATOM 425 NE ARG C1923 16.775 10.191 11.965 1.00 2.40 N ATOM 426 CZ ARG C1923 17.178 9.873 13.192 1.00 3.28 C ATOM 427 NH1 ARG C1923 16.784 8.736 13.756 1.00 3.55 N ATOM 428 NH2 ARG C1923 17.969 10.702 13.860 1.00 4.28 N ATOM 0 H ARG C1923 13.366 7.814 7.272 1.00 0.58 H new ATOM 0 HA ARG C1923 15.106 10.126 7.909 1.00 0.73 H new ATOM 0 HB2 ARG C1923 13.027 9.640 9.349 1.00 0.81 H new ATOM 0 HB3 ARG C1923 13.885 8.212 9.892 1.00 0.81 H new ATOM 0 HG2 ARG C1923 15.099 10.987 10.074 1.00 1.13 H new ATOM 0 HG3 ARG C1923 14.076 10.332 11.337 1.00 1.13 H new ATOM 0 HD2 ARG C1923 15.606 8.476 11.708 1.00 1.55 H new ATOM 0 HD3 ARG C1923 16.567 8.924 10.314 1.00 1.55 H new ATOM 0 HE ARG C1923 17.056 11.097 11.589 1.00 2.40 H new ATOM 0 HH11 ARG C1923 16.169 8.101 13.248 1.00 3.55 H new ATOM 0 HH12 ARG C1923 17.097 8.498 14.697 1.00 3.55 H new ATOM 0 HH21 ARG C1923 18.266 11.579 13.433 1.00 4.28 H new ATOM 0 HH22 ARG C1923 18.281 10.462 14.801 1.00 4.28 H new ATOM 442 N GLY C1924 16.954 8.528 7.513 1.00 1.22 N ATOM 443 CA GLY C1924 18.153 7.731 7.455 1.00 1.93 C ATOM 444 C GLY C1924 18.671 7.693 6.044 1.00 1.43 C ATOM 445 O GLY C1924 19.737 7.138 5.776 1.00 1.98 O ATOM 0 H GLY C1924 17.005 9.397 6.982 1.00 1.22 H new ATOM 0 HA2 GLY C1924 18.910 8.148 8.119 1.00 1.93 H new ATOM 0 HA3 GLY C1924 17.945 6.719 7.803 1.00 1.93 H new ATOM 449 N ASP C1925 17.894 8.309 5.148 1.00 0.81 N ATOM 450 CA ASP C1925 18.285 8.506 3.755 1.00 1.16 C ATOM 451 C ASP C1925 18.680 7.190 3.116 1.00 0.95 C ATOM 452 O ASP C1925 19.687 7.100 2.413 1.00 1.23 O ATOM 453 CB ASP C1925 19.424 9.528 3.649 1.00 1.89 C ATOM 454 CG ASP C1925 18.973 10.933 3.999 1.00 2.48 C ATOM 455 OD1 ASP C1925 18.478 11.646 3.101 1.00 2.98 O ATOM 456 OD2 ASP C1925 19.115 11.337 5.175 1.00 2.71 O ATOM 0 H ASP C1925 16.973 8.685 5.373 1.00 0.81 H new ATOM 0 HA ASP C1925 17.425 8.900 3.213 1.00 1.16 H new ATOM 0 HB2 ASP C1925 20.236 9.234 4.314 1.00 1.89 H new ATOM 0 HB3 ASP C1925 19.823 9.519 2.635 1.00 1.89 H new ATOM 461 N LEU C1926 17.872 6.172 3.369 1.00 0.64 N ATOM 462 CA LEU C1926 18.087 4.863 2.790 1.00 0.60 C ATOM 463 C LEU C1926 17.970 4.926 1.253 1.00 0.54 C ATOM 464 O LEU C1926 17.575 5.958 0.704 1.00 0.72 O ATOM 465 CB LEU C1926 17.139 3.837 3.436 1.00 0.93 C ATOM 466 CG LEU C1926 15.721 4.309 3.783 1.00 0.48 C ATOM 467 CD1 LEU C1926 14.910 4.622 2.535 1.00 0.56 C ATOM 468 CD2 LEU C1926 15.028 3.242 4.594 1.00 0.57 C ATOM 0 H LEU C1926 17.056 6.233 3.977 1.00 0.64 H new ATOM 0 HA LEU C1926 19.102 4.527 3.003 1.00 0.60 H new ATOM 0 HB2 LEU C1926 17.055 2.984 2.762 1.00 0.93 H new ATOM 0 HB3 LEU C1926 17.607 3.475 4.351 1.00 0.93 H new ATOM 0 HG LEU C1926 15.799 5.229 4.362 1.00 0.48 H new ATOM 0 HD11 LEU C1926 13.912 4.953 2.823 1.00 0.56 H new ATOM 0 HD12 LEU C1926 15.404 5.411 1.968 1.00 0.56 H new ATOM 0 HD13 LEU C1926 14.831 3.727 1.918 1.00 0.56 H new ATOM 0 HD21 LEU C1926 14.020 3.572 4.844 1.00 0.57 H new ATOM 0 HD22 LEU C1926 14.975 2.321 4.014 1.00 0.57 H new ATOM 0 HD23 LEU C1926 15.588 3.061 5.511 1.00 0.57 H new ATOM 480 N PRO C1927 18.289 3.835 0.531 1.00 0.46 N ATOM 481 CA PRO C1927 18.563 3.901 -0.911 1.00 0.55 C ATOM 482 C PRO C1927 17.317 4.005 -1.775 1.00 0.63 C ATOM 483 O PRO C1927 17.369 3.756 -2.980 1.00 1.12 O ATOM 484 CB PRO C1927 19.269 2.579 -1.164 1.00 0.54 C ATOM 485 CG PRO C1927 18.630 1.639 -0.213 1.00 0.44 C ATOM 486 CD PRO C1927 18.365 2.445 1.027 1.00 0.41 C ATOM 0 HA PRO C1927 19.134 4.793 -1.171 1.00 0.55 H new ATOM 0 HB2 PRO C1927 19.142 2.250 -2.195 1.00 0.54 H new ATOM 0 HB3 PRO C1927 20.341 2.659 -0.985 1.00 0.54 H new ATOM 0 HG2 PRO C1927 17.705 1.233 -0.623 1.00 0.44 H new ATOM 0 HG3 PRO C1927 19.282 0.792 0.001 1.00 0.44 H new ATOM 0 HD2 PRO C1927 17.437 2.141 1.511 1.00 0.41 H new ATOM 0 HD3 PRO C1927 19.162 2.325 1.761 1.00 0.41 H new ATOM 494 N PHE C1928 16.210 4.383 -1.172 1.00 0.30 N ATOM 495 CA PHE C1928 14.968 4.501 -1.899 1.00 0.27 C ATOM 496 C PHE C1928 14.053 5.508 -1.231 1.00 0.27 C ATOM 497 O PHE C1928 13.886 5.500 -0.018 1.00 0.31 O ATOM 498 CB PHE C1928 14.318 3.117 -2.040 1.00 0.24 C ATOM 499 CG PHE C1928 13.100 2.854 -1.223 1.00 0.23 C ATOM 500 CD1 PHE C1928 11.945 3.597 -1.375 1.00 0.30 C ATOM 501 CD2 PHE C1928 13.116 1.829 -0.319 1.00 0.26 C ATOM 502 CE1 PHE C1928 10.840 3.324 -0.626 1.00 0.33 C ATOM 503 CE2 PHE C1928 12.004 1.541 0.431 1.00 0.29 C ATOM 504 CZ PHE C1928 10.869 2.293 0.277 1.00 0.27 C ATOM 0 H PHE C1928 16.147 4.613 -0.180 1.00 0.30 H new ATOM 0 HA PHE C1928 15.165 4.876 -2.903 1.00 0.27 H new ATOM 0 HB2 PHE C1928 14.061 2.969 -3.089 1.00 0.24 H new ATOM 0 HB3 PHE C1928 15.065 2.365 -1.786 1.00 0.24 H new ATOM 0 HD1 PHE C1928 11.918 4.402 -2.094 1.00 0.30 H new ATOM 0 HD2 PHE C1928 14.013 1.240 -0.194 1.00 0.26 H new ATOM 0 HE1 PHE C1928 9.945 3.917 -0.743 1.00 0.33 H new ATOM 0 HE2 PHE C1928 12.023 0.726 1.139 1.00 0.29 H new ATOM 0 HZ PHE C1928 9.993 2.073 0.870 1.00 0.27 H new ATOM 514 N VAL C1929 13.449 6.355 -2.046 1.00 0.25 N ATOM 515 CA VAL C1929 12.589 7.426 -1.576 1.00 0.25 C ATOM 516 C VAL C1929 11.685 7.887 -2.693 1.00 0.25 C ATOM 517 O VAL C1929 12.008 7.725 -3.868 1.00 0.27 O ATOM 518 CB VAL C1929 13.403 8.640 -1.124 1.00 0.29 C ATOM 519 CG1 VAL C1929 14.096 8.361 0.184 1.00 0.62 C ATOM 520 CG2 VAL C1929 14.405 8.984 -2.202 1.00 0.62 C ATOM 0 H VAL C1929 13.543 6.318 -3.061 1.00 0.25 H new ATOM 0 HA VAL C1929 12.015 7.032 -0.737 1.00 0.25 H new ATOM 0 HB VAL C1929 12.736 9.488 -0.966 1.00 0.29 H new ATOM 0 HG11 VAL C1929 14.669 9.238 0.486 1.00 0.62 H new ATOM 0 HG12 VAL C1929 13.353 8.132 0.948 1.00 0.62 H new ATOM 0 HG13 VAL C1929 14.768 7.511 0.066 1.00 0.62 H new ATOM 0 HG21 VAL C1929 14.992 9.848 -1.891 1.00 0.62 H new ATOM 0 HG22 VAL C1929 15.069 8.135 -2.366 1.00 0.62 H new ATOM 0 HG23 VAL C1929 13.878 9.217 -3.127 1.00 0.62 H new ATOM 530 N VAL C1930 10.573 8.481 -2.334 1.00 0.26 N ATOM 531 CA VAL C1930 9.695 9.048 -3.328 1.00 0.26 C ATOM 532 C VAL C1930 10.257 10.382 -3.822 1.00 0.29 C ATOM 533 O VAL C1930 10.583 11.261 -3.023 1.00 0.32 O ATOM 534 CB VAL C1930 8.279 9.282 -2.781 1.00 0.28 C ATOM 535 CG1 VAL C1930 7.332 9.671 -3.905 1.00 0.34 C ATOM 536 CG2 VAL C1930 7.777 8.053 -2.047 1.00 0.32 C ATOM 0 H VAL C1930 10.256 8.584 -1.370 1.00 0.26 H new ATOM 0 HA VAL C1930 9.633 8.332 -4.147 1.00 0.26 H new ATOM 0 HB VAL C1930 8.316 10.106 -2.068 1.00 0.28 H new ATOM 0 HG11 VAL C1930 6.333 9.833 -3.500 1.00 0.34 H new ATOM 0 HG12 VAL C1930 7.685 10.588 -4.377 1.00 0.34 H new ATOM 0 HG13 VAL C1930 7.298 8.872 -4.645 1.00 0.34 H new ATOM 0 HG21 VAL C1930 6.772 8.241 -1.668 1.00 0.32 H new ATOM 0 HG22 VAL C1930 7.754 7.205 -2.731 1.00 0.32 H new ATOM 0 HG23 VAL C1930 8.443 7.829 -1.214 1.00 0.32 H new ATOM 546 N PRO C1931 10.421 10.527 -5.138 1.00 0.34 N ATOM 547 CA PRO C1931 10.797 11.800 -5.764 1.00 0.42 C ATOM 548 C PRO C1931 9.721 12.869 -5.557 1.00 0.45 C ATOM 549 O PRO C1931 8.629 12.575 -5.071 1.00 0.45 O ATOM 550 CB PRO C1931 10.936 11.452 -7.252 1.00 0.56 C ATOM 551 CG PRO C1931 10.187 10.176 -7.429 1.00 0.48 C ATOM 552 CD PRO C1931 10.284 9.446 -6.119 1.00 0.36 C ATOM 0 HA PRO C1931 11.709 12.216 -5.336 1.00 0.42 H new ATOM 0 HB2 PRO C1931 10.523 12.241 -7.881 1.00 0.56 H new ATOM 0 HB3 PRO C1931 11.983 11.336 -7.533 1.00 0.56 H new ATOM 0 HG2 PRO C1931 9.147 10.369 -7.691 1.00 0.48 H new ATOM 0 HG3 PRO C1931 10.615 9.583 -8.237 1.00 0.48 H new ATOM 0 HD2 PRO C1931 9.397 8.841 -5.929 1.00 0.36 H new ATOM 0 HD3 PRO C1931 11.140 8.772 -6.097 1.00 0.36 H new ATOM 560 N ARG C1932 10.022 14.112 -5.933 1.00 0.54 N ATOM 561 CA ARG C1932 9.081 15.221 -5.742 1.00 0.70 C ATOM 562 C ARG C1932 7.987 15.205 -6.805 1.00 0.89 C ATOM 563 O ARG C1932 7.546 16.250 -7.289 1.00 1.79 O ATOM 564 CB ARG C1932 9.806 16.575 -5.752 1.00 0.83 C ATOM 565 CG ARG C1932 10.516 16.912 -4.448 1.00 1.53 C ATOM 566 CD ARG C1932 11.732 16.035 -4.214 1.00 2.00 C ATOM 567 NE ARG C1932 12.311 16.243 -2.887 1.00 2.79 N ATOM 568 CZ ARG C1932 13.568 15.946 -2.570 1.00 3.62 C ATOM 569 NH1 ARG C1932 14.393 15.477 -3.497 1.00 3.88 N ATOM 570 NH2 ARG C1932 13.994 16.114 -1.325 1.00 4.56 N ATOM 0 H ARG C1932 10.905 14.378 -6.370 1.00 0.54 H new ATOM 0 HA ARG C1932 8.617 15.086 -4.765 1.00 0.70 H new ATOM 0 HB2 ARG C1932 10.536 16.578 -6.561 1.00 0.83 H new ATOM 0 HB3 ARG C1932 9.083 17.360 -5.972 1.00 0.83 H new ATOM 0 HG2 ARG C1932 10.822 17.958 -4.463 1.00 1.53 H new ATOM 0 HG3 ARG C1932 9.821 16.795 -3.617 1.00 1.53 H new ATOM 0 HD2 ARG C1932 11.451 14.988 -4.327 1.00 2.00 H new ATOM 0 HD3 ARG C1932 12.483 16.247 -4.975 1.00 2.00 H new ATOM 0 HE ARG C1932 11.715 16.640 -2.161 1.00 2.79 H new ATOM 0 HH11 ARG C1932 14.063 15.344 -4.453 1.00 3.88 H new ATOM 0 HH12 ARG C1932 15.357 15.249 -3.254 1.00 3.88 H new ATOM 0 HH21 ARG C1932 13.358 16.471 -0.612 1.00 4.56 H new ATOM 0 HH22 ARG C1932 14.958 15.887 -1.081 1.00 4.56 H new ATOM 584 N ARG C1933 7.540 14.002 -7.118 1.00 0.74 N ATOM 585 CA ARG C1933 6.547 13.743 -8.141 1.00 0.76 C ATOM 586 C ARG C1933 6.416 12.234 -8.269 1.00 0.65 C ATOM 587 O ARG C1933 7.065 11.500 -7.529 1.00 0.69 O ATOM 588 CB ARG C1933 6.965 14.360 -9.485 1.00 0.95 C ATOM 589 CG ARG C1933 8.298 13.844 -10.005 1.00 1.66 C ATOM 590 CD ARG C1933 8.635 14.418 -11.372 1.00 1.80 C ATOM 591 NE ARG C1933 9.011 15.828 -11.314 1.00 2.56 N ATOM 592 CZ ARG C1933 9.303 16.564 -12.388 1.00 2.86 C ATOM 593 NH1 ARG C1933 9.255 16.035 -13.604 1.00 2.53 N ATOM 594 NH2 ARG C1933 9.659 17.828 -12.238 1.00 3.92 N ATOM 0 H ARG C1933 7.868 13.155 -6.653 1.00 0.74 H new ATOM 0 HA ARG C1933 5.594 14.194 -7.865 1.00 0.76 H new ATOM 0 HB2 ARG C1933 6.192 14.155 -10.225 1.00 0.95 H new ATOM 0 HB3 ARG C1933 7.022 15.443 -9.376 1.00 0.95 H new ATOM 0 HG2 ARG C1933 9.087 14.102 -9.299 1.00 1.66 H new ATOM 0 HG3 ARG C1933 8.267 12.756 -10.066 1.00 1.66 H new ATOM 0 HD2 ARG C1933 9.453 13.846 -11.810 1.00 1.80 H new ATOM 0 HD3 ARG C1933 7.775 14.302 -12.032 1.00 1.80 H new ATOM 0 HE ARG C1933 9.053 16.276 -10.399 1.00 2.56 H new ATOM 0 HH11 ARG C1933 8.993 15.057 -13.725 1.00 2.53 H new ATOM 0 HH12 ARG C1933 9.480 16.607 -14.418 1.00 2.53 H new ATOM 0 HH21 ARG C1933 9.709 18.236 -11.305 1.00 3.92 H new ATOM 0 HH22 ARG C1933 9.883 18.395 -13.056 1.00 3.92 H new ATOM 608 N MET C1934 5.594 11.764 -9.189 1.00 0.70 N ATOM 609 CA MET C1934 5.515 10.334 -9.446 1.00 0.73 C ATOM 610 C MET C1934 6.636 9.941 -10.392 1.00 0.84 C ATOM 611 O MET C1934 7.049 8.783 -10.442 1.00 1.02 O ATOM 612 CB MET C1934 4.145 9.957 -10.011 1.00 0.81 C ATOM 613 CG MET C1934 3.003 10.189 -9.032 1.00 0.89 C ATOM 614 SD MET C1934 2.694 8.798 -7.913 1.00 1.18 S ATOM 615 CE MET C1934 4.214 8.675 -6.967 1.00 0.55 C ATOM 0 H MET C1934 4.979 12.340 -9.764 1.00 0.70 H new ATOM 0 HA MET C1934 5.634 9.787 -8.511 1.00 0.73 H new ATOM 0 HB2 MET C1934 3.961 10.536 -10.916 1.00 0.81 H new ATOM 0 HB3 MET C1934 4.157 8.907 -10.302 1.00 0.81 H new ATOM 0 HG2 MET C1934 3.222 11.077 -8.439 1.00 0.89 H new ATOM 0 HG3 MET C1934 2.093 10.398 -9.595 1.00 0.89 H new ATOM 0 HE1 MET C1934 4.018 8.156 -6.029 1.00 0.55 H new ATOM 0 HE2 MET C1934 4.956 8.119 -7.541 1.00 0.55 H new ATOM 0 HE3 MET C1934 4.593 9.675 -6.756 1.00 0.55 H new ATOM 625 N ALA C1935 7.121 10.945 -11.122 1.00 0.93 N ATOM 626 CA ALA C1935 8.316 10.829 -11.947 1.00 1.04 C ATOM 627 C ALA C1935 8.163 9.751 -13.013 1.00 1.66 C ATOM 628 O ALA C1935 8.841 8.708 -12.923 1.00 2.07 O ATOM 629 CB ALA C1935 9.536 10.581 -11.063 1.00 1.04 C ATOM 630 OXT ALA C1935 7.359 9.959 -13.949 1.00 2.38 O ATOM 0 H ALA C1935 6.689 11.869 -11.155 1.00 0.93 H new ATOM 0 HA ALA C1935 8.461 11.770 -12.478 1.00 1.04 H new ATOM 0 HB1 ALA C1935 10.426 10.495 -11.687 1.00 1.04 H new ATOM 0 HB2 ALA C1935 9.658 11.413 -10.369 1.00 1.04 H new ATOM 0 HB3 ALA C1935 9.396 9.657 -10.501 1.00 1.04 H new TER 636 ALA C1935 ATOM 637 N MET A 1 2.471 -3.676 -20.001 1.00 1.37 N ATOM 638 CA MET A 1 1.519 -2.554 -20.155 1.00 0.72 C ATOM 639 C MET A 1 1.915 -1.418 -19.227 1.00 0.58 C ATOM 640 O MET A 1 2.404 -0.381 -19.672 1.00 0.77 O ATOM 641 CB MET A 1 0.083 -3.011 -19.863 1.00 1.65 C ATOM 642 CG MET A 1 -0.483 -3.969 -20.904 1.00 2.36 C ATOM 643 SD MET A 1 0.457 -5.506 -21.037 1.00 3.50 S ATOM 644 CE MET A 1 -0.411 -6.316 -22.376 1.00 4.47 C ATOM 0 H1 MET A 1 2.108 -4.511 -20.504 1.00 1.37 H new ATOM 0 H2 MET A 1 3.393 -3.406 -20.399 1.00 1.37 H new ATOM 0 H3 MET A 1 2.582 -3.901 -18.992 1.00 1.37 H new ATOM 0 HA MET A 1 1.555 -2.203 -21.186 1.00 0.72 H new ATOM 0 HB2 MET A 1 0.057 -3.494 -18.886 1.00 1.65 H new ATOM 0 HB3 MET A 1 -0.562 -2.134 -19.802 1.00 1.65 H new ATOM 0 HG2 MET A 1 -1.517 -4.203 -20.650 1.00 2.36 H new ATOM 0 HG3 MET A 1 -0.498 -3.474 -21.875 1.00 2.36 H new ATOM 0 HE1 MET A 1 0.052 -7.282 -22.578 1.00 4.47 H new ATOM 0 HE2 MET A 1 -1.454 -6.465 -22.096 1.00 4.47 H new ATOM 0 HE3 MET A 1 -0.361 -5.695 -23.270 1.00 4.47 H new ATOM 654 N ALA A 2 1.708 -1.615 -17.936 1.00 0.37 N ATOM 655 CA ALA A 2 2.177 -0.671 -16.942 1.00 0.33 C ATOM 656 C ALA A 2 3.199 -1.338 -16.034 1.00 0.30 C ATOM 657 O ALA A 2 3.209 -2.564 -15.921 1.00 0.39 O ATOM 658 CB ALA A 2 1.008 -0.140 -16.130 1.00 0.33 C ATOM 0 H ALA A 2 1.217 -2.423 -17.553 1.00 0.37 H new ATOM 0 HA ALA A 2 2.655 0.169 -17.447 1.00 0.33 H new ATOM 0 HB1 ALA A 2 1.373 0.568 -15.386 1.00 0.33 H new ATOM 0 HB2 ALA A 2 0.302 0.361 -16.793 1.00 0.33 H new ATOM 0 HB3 ALA A 2 0.508 -0.968 -15.627 1.00 0.33 H new ATOM 664 N CYS A 3 4.071 -0.546 -15.417 1.00 0.29 N ATOM 665 CA CYS A 3 4.999 -1.059 -14.427 1.00 0.27 C ATOM 666 C CYS A 3 4.209 -1.513 -13.214 1.00 0.22 C ATOM 667 O CYS A 3 3.717 -0.687 -12.451 1.00 0.21 O ATOM 668 CB CYS A 3 6.005 0.018 -14.027 1.00 0.32 C ATOM 669 SG CYS A 3 6.829 0.822 -15.420 1.00 0.43 S ATOM 0 H CYS A 3 4.151 0.456 -15.589 1.00 0.29 H new ATOM 0 HA CYS A 3 5.554 -1.899 -14.846 1.00 0.27 H new ATOM 0 HB2 CYS A 3 5.491 0.777 -13.437 1.00 0.32 H new ATOM 0 HB3 CYS A 3 6.761 -0.430 -13.382 1.00 0.32 H new ATOM 0 HG CYS A 3 7.220 2.010 -15.066 1.00 0.43 H new ATOM 675 N PRO A 4 4.074 -2.831 -13.037 1.00 0.20 N ATOM 676 CA PRO A 4 3.146 -3.417 -12.061 1.00 0.18 C ATOM 677 C PRO A 4 3.266 -2.807 -10.668 1.00 0.16 C ATOM 678 O PRO A 4 2.330 -2.172 -10.182 1.00 0.16 O ATOM 679 CB PRO A 4 3.582 -4.880 -12.041 1.00 0.21 C ATOM 680 CG PRO A 4 4.101 -5.122 -13.410 1.00 0.24 C ATOM 681 CD PRO A 4 4.835 -3.867 -13.765 1.00 0.24 C ATOM 0 HA PRO A 4 2.104 -3.250 -12.335 1.00 0.18 H new ATOM 0 HB2 PRO A 4 4.349 -5.057 -11.287 1.00 0.21 H new ATOM 0 HB3 PRO A 4 2.747 -5.541 -11.808 1.00 0.21 H new ATOM 0 HG2 PRO A 4 4.762 -5.988 -13.436 1.00 0.24 H new ATOM 0 HG3 PRO A 4 3.291 -5.319 -14.112 1.00 0.24 H new ATOM 0 HD2 PRO A 4 5.877 -3.903 -13.447 1.00 0.24 H new ATOM 0 HD3 PRO A 4 4.836 -3.689 -14.840 1.00 0.24 H new ATOM 689 N LEU A 5 4.428 -2.962 -10.050 1.00 0.16 N ATOM 690 CA LEU A 5 4.634 -2.457 -8.701 1.00 0.17 C ATOM 691 C LEU A 5 4.704 -0.932 -8.704 1.00 0.19 C ATOM 692 O LEU A 5 4.203 -0.284 -7.791 1.00 0.24 O ATOM 693 CB LEU A 5 5.914 -3.054 -8.102 1.00 0.17 C ATOM 694 CG LEU A 5 5.853 -3.410 -6.608 1.00 0.18 C ATOM 695 CD1 LEU A 5 5.648 -2.175 -5.752 1.00 0.20 C ATOM 696 CD2 LEU A 5 4.753 -4.423 -6.344 1.00 0.20 C ATOM 0 H LEU A 5 5.237 -3.430 -10.458 1.00 0.16 H new ATOM 0 HA LEU A 5 3.788 -2.758 -8.084 1.00 0.17 H new ATOM 0 HB2 LEU A 5 6.167 -3.955 -8.660 1.00 0.17 H new ATOM 0 HB3 LEU A 5 6.728 -2.345 -8.254 1.00 0.17 H new ATOM 0 HG LEU A 5 6.811 -3.853 -6.335 1.00 0.18 H new ATOM 0 HD11 LEU A 5 5.610 -2.463 -4.701 1.00 0.20 H new ATOM 0 HD12 LEU A 5 6.475 -1.482 -5.908 1.00 0.20 H new ATOM 0 HD13 LEU A 5 4.712 -1.691 -6.030 1.00 0.20 H new ATOM 0 HD21 LEU A 5 4.726 -4.662 -5.281 1.00 0.20 H new ATOM 0 HD22 LEU A 5 3.793 -4.005 -6.646 1.00 0.20 H new ATOM 0 HD23 LEU A 5 4.949 -5.330 -6.915 1.00 0.20 H new ATOM 708 N GLU A 6 5.301 -0.358 -9.745 1.00 0.19 N ATOM 709 CA GLU A 6 5.479 1.088 -9.806 1.00 0.23 C ATOM 710 C GLU A 6 4.138 1.810 -9.845 1.00 0.21 C ATOM 711 O GLU A 6 3.936 2.807 -9.149 1.00 0.25 O ATOM 712 CB GLU A 6 6.318 1.495 -11.021 1.00 0.32 C ATOM 713 CG GLU A 6 6.563 2.992 -11.118 1.00 0.47 C ATOM 714 CD GLU A 6 7.501 3.364 -12.245 1.00 0.90 C ATOM 715 OE1 GLU A 6 7.145 3.130 -13.419 1.00 1.39 O ATOM 716 OE2 GLU A 6 8.586 3.913 -11.966 1.00 1.78 O ATOM 0 H GLU A 6 5.666 -0.867 -10.550 1.00 0.19 H new ATOM 0 HA GLU A 6 6.009 1.382 -8.900 1.00 0.23 H new ATOM 0 HB2 GLU A 6 7.278 0.980 -10.978 1.00 0.32 H new ATOM 0 HB3 GLU A 6 5.816 1.158 -11.928 1.00 0.32 H new ATOM 0 HG2 GLU A 6 5.611 3.502 -11.262 1.00 0.47 H new ATOM 0 HG3 GLU A 6 6.977 3.349 -10.175 1.00 0.47 H new ATOM 723 N LYS A 7 3.219 1.299 -10.652 1.00 0.18 N ATOM 724 CA LYS A 7 1.916 1.918 -10.796 1.00 0.20 C ATOM 725 C LYS A 7 1.118 1.799 -9.509 1.00 0.17 C ATOM 726 O LYS A 7 0.272 2.636 -9.236 1.00 0.19 O ATOM 727 CB LYS A 7 1.143 1.310 -11.973 1.00 0.26 C ATOM 728 CG LYS A 7 1.777 1.605 -13.325 1.00 0.41 C ATOM 729 CD LYS A 7 1.843 3.096 -13.613 1.00 0.90 C ATOM 730 CE LYS A 7 0.467 3.686 -13.871 1.00 0.83 C ATOM 731 NZ LYS A 7 0.528 5.157 -14.069 1.00 1.16 N ATOM 0 H LYS A 7 3.354 0.459 -11.215 1.00 0.18 H new ATOM 0 HA LYS A 7 2.069 2.976 -11.006 1.00 0.20 H new ATOM 0 HB2 LYS A 7 1.078 0.230 -11.837 1.00 0.26 H new ATOM 0 HB3 LYS A 7 0.123 1.694 -11.966 1.00 0.26 H new ATOM 0 HG2 LYS A 7 2.783 1.186 -13.352 1.00 0.41 H new ATOM 0 HG3 LYS A 7 1.204 1.110 -14.109 1.00 0.41 H new ATOM 0 HD2 LYS A 7 2.305 3.608 -12.769 1.00 0.90 H new ATOM 0 HD3 LYS A 7 2.481 3.270 -14.480 1.00 0.90 H new ATOM 0 HE2 LYS A 7 0.030 3.218 -14.753 1.00 0.83 H new ATOM 0 HE3 LYS A 7 -0.190 3.459 -13.031 1.00 0.83 H new ATOM 0 HZ1 LYS A 7 -0.377 5.493 -14.456 1.00 1.16 H new ATOM 0 HZ2 LYS A 7 0.709 5.623 -13.157 1.00 1.16 H new ATOM 0 HZ3 LYS A 7 1.295 5.386 -14.733 1.00 1.16 H new ATOM 745 N ALA A 8 1.414 0.778 -8.709 1.00 0.18 N ATOM 746 CA ALA A 8 0.743 0.590 -7.427 1.00 0.19 C ATOM 747 C ALA A 8 0.832 1.850 -6.572 1.00 0.17 C ATOM 748 O ALA A 8 -0.180 2.337 -6.073 1.00 0.21 O ATOM 749 CB ALA A 8 1.328 -0.601 -6.685 1.00 0.20 C ATOM 0 H ALA A 8 2.114 0.069 -8.926 1.00 0.18 H new ATOM 0 HA ALA A 8 -0.310 0.390 -7.625 1.00 0.19 H new ATOM 0 HB1 ALA A 8 0.814 -0.724 -5.732 1.00 0.20 H new ATOM 0 HB2 ALA A 8 1.200 -1.502 -7.285 1.00 0.20 H new ATOM 0 HB3 ALA A 8 2.390 -0.432 -6.506 1.00 0.20 H new ATOM 755 N LEU A 9 2.037 2.390 -6.425 1.00 0.14 N ATOM 756 CA LEU A 9 2.231 3.596 -5.621 1.00 0.14 C ATOM 757 C LEU A 9 1.683 4.824 -6.342 1.00 0.13 C ATOM 758 O LEU A 9 1.089 5.710 -5.727 1.00 0.16 O ATOM 759 CB LEU A 9 3.713 3.817 -5.287 1.00 0.15 C ATOM 760 CG LEU A 9 4.404 2.685 -4.520 1.00 0.16 C ATOM 761 CD1 LEU A 9 3.509 2.168 -3.411 1.00 0.19 C ATOM 762 CD2 LEU A 9 4.812 1.554 -5.447 1.00 0.15 C ATOM 0 H LEU A 9 2.888 2.018 -6.847 1.00 0.14 H new ATOM 0 HA LEU A 9 1.683 3.452 -4.690 1.00 0.14 H new ATOM 0 HB2 LEU A 9 4.254 3.981 -6.219 1.00 0.15 H new ATOM 0 HB3 LEU A 9 3.801 4.732 -4.702 1.00 0.15 H new ATOM 0 HG LEU A 9 5.311 3.093 -4.074 1.00 0.16 H new ATOM 0 HD11 LEU A 9 4.017 1.365 -2.878 1.00 0.19 H new ATOM 0 HD12 LEU A 9 3.284 2.978 -2.717 1.00 0.19 H new ATOM 0 HD13 LEU A 9 2.581 1.789 -3.839 1.00 0.19 H new ATOM 0 HD21 LEU A 9 5.299 0.768 -4.870 1.00 0.15 H new ATOM 0 HD22 LEU A 9 3.927 1.148 -5.938 1.00 0.15 H new ATOM 0 HD23 LEU A 9 5.503 1.932 -6.200 1.00 0.15 H new ATOM 774 N ASP A 10 1.885 4.860 -7.652 1.00 0.14 N ATOM 775 CA ASP A 10 1.425 5.972 -8.482 1.00 0.15 C ATOM 776 C ASP A 10 -0.090 6.137 -8.412 1.00 0.15 C ATOM 777 O ASP A 10 -0.597 7.235 -8.181 1.00 0.18 O ATOM 778 CB ASP A 10 1.874 5.753 -9.932 1.00 0.19 C ATOM 779 CG ASP A 10 1.143 6.632 -10.930 1.00 0.48 C ATOM 780 OD1 ASP A 10 1.493 7.821 -11.066 1.00 1.19 O ATOM 781 OD2 ASP A 10 0.232 6.122 -11.616 1.00 1.18 O ATOM 0 H ASP A 10 2.369 4.126 -8.169 1.00 0.14 H new ATOM 0 HA ASP A 10 1.870 6.890 -8.099 1.00 0.15 H new ATOM 0 HB2 ASP A 10 2.944 5.945 -10.006 1.00 0.19 H new ATOM 0 HB3 ASP A 10 1.719 4.707 -10.198 1.00 0.19 H new ATOM 786 N VAL A 11 -0.807 5.040 -8.585 1.00 0.16 N ATOM 787 CA VAL A 11 -2.260 5.083 -8.609 1.00 0.18 C ATOM 788 C VAL A 11 -2.828 5.341 -7.221 1.00 0.18 C ATOM 789 O VAL A 11 -3.947 5.826 -7.088 1.00 0.23 O ATOM 790 CB VAL A 11 -2.856 3.786 -9.181 1.00 0.20 C ATOM 791 CG1 VAL A 11 -2.262 3.509 -10.551 1.00 0.23 C ATOM 792 CG2 VAL A 11 -2.630 2.612 -8.239 1.00 0.18 C ATOM 0 H VAL A 11 -0.408 4.110 -8.711 1.00 0.16 H new ATOM 0 HA VAL A 11 -2.540 5.909 -9.263 1.00 0.18 H new ATOM 0 HB VAL A 11 -3.934 3.914 -9.284 1.00 0.20 H new ATOM 0 HG11 VAL A 11 -2.687 2.589 -10.953 1.00 0.23 H new ATOM 0 HG12 VAL A 11 -2.491 4.337 -11.221 1.00 0.23 H new ATOM 0 HG13 VAL A 11 -1.181 3.401 -10.464 1.00 0.23 H new ATOM 0 HG21 VAL A 11 -3.063 1.710 -8.672 1.00 0.18 H new ATOM 0 HG22 VAL A 11 -1.560 2.466 -8.090 1.00 0.18 H new ATOM 0 HG23 VAL A 11 -3.105 2.818 -7.280 1.00 0.18 H new ATOM 802 N MET A 12 -2.048 5.033 -6.194 1.00 0.16 N ATOM 803 CA MET A 12 -2.464 5.277 -4.821 1.00 0.20 C ATOM 804 C MET A 12 -2.803 6.741 -4.606 1.00 0.24 C ATOM 805 O MET A 12 -3.815 7.057 -3.998 1.00 0.40 O ATOM 806 CB MET A 12 -1.377 4.842 -3.846 1.00 0.25 C ATOM 807 CG MET A 12 -1.402 3.363 -3.543 1.00 0.17 C ATOM 808 SD MET A 12 0.095 2.808 -2.717 1.00 0.72 S ATOM 809 CE MET A 12 -0.395 1.172 -2.211 1.00 0.19 C ATOM 0 H MET A 12 -1.123 4.613 -6.286 1.00 0.16 H new ATOM 0 HA MET A 12 -3.361 4.686 -4.634 1.00 0.20 H new ATOM 0 HB2 MET A 12 -0.403 5.105 -4.258 1.00 0.25 H new ATOM 0 HB3 MET A 12 -1.490 5.398 -2.915 1.00 0.25 H new ATOM 0 HG2 MET A 12 -2.265 3.138 -2.916 1.00 0.17 H new ATOM 0 HG3 MET A 12 -1.529 2.807 -4.472 1.00 0.17 H new ATOM 0 HE1 MET A 12 0.490 0.546 -2.098 1.00 0.19 H new ATOM 0 HE2 MET A 12 -0.924 1.229 -1.260 1.00 0.19 H new ATOM 0 HE3 MET A 12 -1.051 0.739 -2.966 1.00 0.19 H new ATOM 819 N VAL A 13 -1.950 7.629 -5.103 1.00 0.17 N ATOM 820 CA VAL A 13 -2.210 9.060 -5.000 1.00 0.19 C ATOM 821 C VAL A 13 -2.954 9.591 -6.234 1.00 0.20 C ATOM 822 O VAL A 13 -3.592 10.646 -6.174 1.00 0.28 O ATOM 823 CB VAL A 13 -0.914 9.868 -4.772 1.00 0.18 C ATOM 824 CG1 VAL A 13 -0.269 9.493 -3.446 1.00 0.21 C ATOM 825 CG2 VAL A 13 0.064 9.670 -5.908 1.00 0.19 C ATOM 0 H VAL A 13 -1.080 7.387 -5.577 1.00 0.17 H new ATOM 0 HA VAL A 13 -2.850 9.195 -4.128 1.00 0.19 H new ATOM 0 HB VAL A 13 -1.185 10.923 -4.740 1.00 0.18 H new ATOM 0 HG11 VAL A 13 0.642 10.075 -3.307 1.00 0.21 H new ATOM 0 HG12 VAL A 13 -0.962 9.704 -2.632 1.00 0.21 H new ATOM 0 HG13 VAL A 13 -0.024 8.431 -3.448 1.00 0.21 H new ATOM 0 HG21 VAL A 13 0.966 10.252 -5.717 1.00 0.19 H new ATOM 0 HG22 VAL A 13 0.323 8.614 -5.985 1.00 0.19 H new ATOM 0 HG23 VAL A 13 -0.391 10.001 -6.842 1.00 0.19 H new ATOM 835 N SER A 14 -2.878 8.858 -7.343 1.00 0.19 N ATOM 836 CA SER A 14 -3.536 9.274 -8.581 1.00 0.22 C ATOM 837 C SER A 14 -5.040 9.002 -8.513 1.00 0.24 C ATOM 838 O SER A 14 -5.848 9.923 -8.631 1.00 0.28 O ATOM 839 CB SER A 14 -2.918 8.554 -9.785 1.00 0.24 C ATOM 840 OG SER A 14 -3.405 9.079 -11.009 1.00 1.12 O ATOM 0 H SER A 14 -2.370 7.976 -7.410 1.00 0.19 H new ATOM 0 HA SER A 14 -3.386 10.347 -8.703 1.00 0.22 H new ATOM 0 HB2 SER A 14 -1.833 8.652 -9.752 1.00 0.24 H new ATOM 0 HB3 SER A 14 -3.144 7.489 -9.729 1.00 0.24 H new ATOM 0 HG SER A 14 -2.991 8.601 -11.758 1.00 1.12 H new ATOM 846 N THR A 15 -5.405 7.738 -8.308 1.00 0.25 N ATOM 847 CA THR A 15 -6.799 7.342 -8.151 1.00 0.28 C ATOM 848 C THR A 15 -7.395 8.033 -6.923 1.00 0.30 C ATOM 849 O THR A 15 -8.591 8.323 -6.866 1.00 0.33 O ATOM 850 CB THR A 15 -6.906 5.806 -8.012 1.00 0.28 C ATOM 851 OG1 THR A 15 -6.212 5.174 -9.101 1.00 0.34 O ATOM 852 CG2 THR A 15 -8.351 5.336 -8.000 1.00 0.26 C ATOM 0 H THR A 15 -4.744 6.964 -8.247 1.00 0.25 H new ATOM 0 HA THR A 15 -7.359 7.646 -9.035 1.00 0.28 H new ATOM 0 HB THR A 15 -6.453 5.529 -7.060 1.00 0.28 H new ATOM 0 HG1 THR A 15 -6.787 4.489 -9.502 1.00 0.34 H new ATOM 0 HG21 THR A 15 -8.380 4.251 -7.901 1.00 0.26 H new ATOM 0 HG22 THR A 15 -8.875 5.791 -7.159 1.00 0.26 H new ATOM 0 HG23 THR A 15 -8.836 5.628 -8.931 1.00 0.26 H new ATOM 860 N PHE A 16 -6.521 8.303 -5.960 1.00 0.31 N ATOM 861 CA PHE A 16 -6.852 9.079 -4.771 1.00 0.37 C ATOM 862 C PHE A 16 -7.516 10.400 -5.158 1.00 0.42 C ATOM 863 O PHE A 16 -8.718 10.579 -4.963 1.00 0.54 O ATOM 864 CB PHE A 16 -5.556 9.340 -4.003 1.00 0.45 C ATOM 865 CG PHE A 16 -5.710 9.991 -2.666 1.00 0.36 C ATOM 866 CD1 PHE A 16 -6.361 9.342 -1.638 1.00 1.26 C ATOM 867 CD2 PHE A 16 -5.172 11.241 -2.431 1.00 1.24 C ATOM 868 CE1 PHE A 16 -6.480 9.929 -0.396 1.00 1.43 C ATOM 869 CE2 PHE A 16 -5.281 11.831 -1.192 1.00 1.39 C ATOM 870 CZ PHE A 16 -5.939 11.174 -0.173 1.00 0.99 C ATOM 0 H PHE A 16 -5.552 7.986 -5.983 1.00 0.31 H new ATOM 0 HA PHE A 16 -7.556 8.526 -4.148 1.00 0.37 H new ATOM 0 HB2 PHE A 16 -5.040 8.390 -3.866 1.00 0.45 H new ATOM 0 HB3 PHE A 16 -4.911 9.967 -4.619 1.00 0.45 H new ATOM 0 HD1 PHE A 16 -6.783 8.362 -1.808 1.00 1.26 H new ATOM 0 HD2 PHE A 16 -4.660 11.761 -3.227 1.00 1.24 H new ATOM 0 HE1 PHE A 16 -6.997 9.413 0.400 1.00 1.43 H new ATOM 0 HE2 PHE A 16 -4.852 12.807 -1.018 1.00 1.39 H new ATOM 0 HZ PHE A 16 -6.029 11.637 0.799 1.00 0.99 H new ATOM 880 N HIS A 17 -6.730 11.296 -5.760 1.00 0.44 N ATOM 881 CA HIS A 17 -7.212 12.621 -6.162 1.00 0.54 C ATOM 882 C HIS A 17 -8.309 12.519 -7.219 1.00 0.47 C ATOM 883 O HIS A 17 -9.055 13.471 -7.450 1.00 0.52 O ATOM 884 CB HIS A 17 -6.053 13.468 -6.709 1.00 0.72 C ATOM 885 CG HIS A 17 -5.157 14.037 -5.652 1.00 1.09 C ATOM 886 ND1 HIS A 17 -5.064 15.385 -5.396 1.00 2.16 N ATOM 887 CD2 HIS A 17 -4.312 13.436 -4.780 1.00 1.23 C ATOM 888 CE1 HIS A 17 -4.218 15.587 -4.408 1.00 2.80 C ATOM 889 NE2 HIS A 17 -3.747 14.422 -4.011 1.00 2.27 N ATOM 0 H HIS A 17 -5.749 11.126 -5.981 1.00 0.44 H new ATOM 0 HA HIS A 17 -7.629 13.100 -5.276 1.00 0.54 H new ATOM 0 HB2 HIS A 17 -5.456 12.854 -7.384 1.00 0.72 H new ATOM 0 HB3 HIS A 17 -6.463 14.286 -7.301 1.00 0.72 H new ATOM 0 HD2 HIS A 17 -4.119 12.376 -4.704 1.00 1.23 H new ATOM 0 HE1 HIS A 17 -3.954 16.548 -3.992 1.00 2.80 H new ATOM 0 HE2 HIS A 17 -3.075 14.277 -3.258 1.00 2.27 H new ATOM 898 N LYS A 18 -8.398 11.359 -7.846 1.00 0.43 N ATOM 899 CA LYS A 18 -9.351 11.121 -8.917 1.00 0.46 C ATOM 900 C LYS A 18 -10.783 11.019 -8.385 1.00 0.44 C ATOM 901 O LYS A 18 -11.739 11.329 -9.097 1.00 0.62 O ATOM 902 CB LYS A 18 -8.949 9.839 -9.653 1.00 0.55 C ATOM 903 CG LYS A 18 -9.882 9.412 -10.771 1.00 0.77 C ATOM 904 CD LYS A 18 -9.363 8.149 -11.437 1.00 0.73 C ATOM 905 CE LYS A 18 -10.337 7.595 -12.458 1.00 1.41 C ATOM 906 NZ LYS A 18 -9.802 6.375 -13.111 1.00 1.69 N ATOM 0 H LYS A 18 -7.811 10.554 -7.627 1.00 0.43 H new ATOM 0 HA LYS A 18 -9.331 11.965 -9.606 1.00 0.46 H new ATOM 0 HB2 LYS A 18 -7.951 9.976 -10.068 1.00 0.55 H new ATOM 0 HB3 LYS A 18 -8.884 9.028 -8.927 1.00 0.55 H new ATOM 0 HG2 LYS A 18 -10.882 9.237 -10.373 1.00 0.77 H new ATOM 0 HG3 LYS A 18 -9.968 10.211 -11.508 1.00 0.77 H new ATOM 0 HD2 LYS A 18 -8.412 8.363 -11.924 1.00 0.73 H new ATOM 0 HD3 LYS A 18 -9.169 7.393 -10.676 1.00 0.73 H new ATOM 0 HE2 LYS A 18 -11.284 7.363 -11.971 1.00 1.41 H new ATOM 0 HE3 LYS A 18 -10.544 8.353 -13.214 1.00 1.41 H new ATOM 0 HZ1 LYS A 18 -10.580 5.853 -13.563 1.00 1.69 H new ATOM 0 HZ2 LYS A 18 -9.102 6.645 -13.831 1.00 1.69 H new ATOM 0 HZ3 LYS A 18 -9.348 5.770 -12.397 1.00 1.69 H new ATOM 920 N TYR A 19 -10.934 10.599 -7.133 1.00 0.37 N ATOM 921 CA TYR A 19 -12.263 10.402 -6.563 1.00 0.41 C ATOM 922 C TYR A 19 -12.505 11.261 -5.327 1.00 0.48 C ATOM 923 O TYR A 19 -13.613 11.746 -5.129 1.00 0.73 O ATOM 924 CB TYR A 19 -12.496 8.925 -6.236 1.00 0.43 C ATOM 925 CG TYR A 19 -12.616 8.054 -7.466 1.00 0.38 C ATOM 926 CD1 TYR A 19 -13.833 7.918 -8.121 1.00 1.18 C ATOM 927 CD2 TYR A 19 -11.518 7.375 -7.973 1.00 1.14 C ATOM 928 CE1 TYR A 19 -13.950 7.132 -9.251 1.00 1.21 C ATOM 929 CE2 TYR A 19 -11.627 6.586 -9.101 1.00 1.14 C ATOM 930 CZ TYR A 19 -12.843 6.468 -9.735 1.00 0.48 C ATOM 931 OH TYR A 19 -12.949 5.693 -10.865 1.00 0.59 O ATOM 0 H TYR A 19 -10.162 10.390 -6.499 1.00 0.37 H new ATOM 0 HA TYR A 19 -12.979 10.720 -7.320 1.00 0.41 H new ATOM 0 HB2 TYR A 19 -11.673 8.562 -5.620 1.00 0.43 H new ATOM 0 HB3 TYR A 19 -13.405 8.830 -5.642 1.00 0.43 H new ATOM 0 HD1 TYR A 19 -14.702 8.435 -7.741 1.00 1.18 H new ATOM 0 HD2 TYR A 19 -10.563 7.465 -7.478 1.00 1.14 H new ATOM 0 HE1 TYR A 19 -14.902 7.038 -9.752 1.00 1.21 H new ATOM 0 HE2 TYR A 19 -10.762 6.064 -9.484 1.00 1.14 H new ATOM 0 HH TYR A 19 -12.077 5.296 -11.072 1.00 0.59 H new ATOM 941 N SER A 20 -11.476 11.464 -4.510 1.00 0.38 N ATOM 942 CA SER A 20 -11.629 12.215 -3.265 1.00 0.45 C ATOM 943 C SER A 20 -12.078 13.650 -3.536 1.00 0.54 C ATOM 944 O SER A 20 -12.901 14.206 -2.809 1.00 0.68 O ATOM 945 CB SER A 20 -10.307 12.215 -2.498 1.00 0.47 C ATOM 946 OG SER A 20 -9.250 12.676 -3.325 1.00 0.52 O ATOM 0 H SER A 20 -10.531 11.122 -4.685 1.00 0.38 H new ATOM 0 HA SER A 20 -12.399 11.730 -2.665 1.00 0.45 H new ATOM 0 HB2 SER A 20 -10.391 12.852 -1.617 1.00 0.47 H new ATOM 0 HB3 SER A 20 -10.086 11.208 -2.143 1.00 0.47 H new ATOM 0 HG SER A 20 -8.929 11.940 -3.887 1.00 0.52 H new ATOM 952 N GLY A 21 -11.550 14.235 -4.603 1.00 0.54 N ATOM 953 CA GLY A 21 -11.845 15.618 -4.913 1.00 0.65 C ATOM 954 C GLY A 21 -13.156 15.792 -5.654 1.00 0.68 C ATOM 955 O GLY A 21 -13.371 16.815 -6.307 1.00 0.82 O ATOM 0 H GLY A 21 -10.921 13.774 -5.260 1.00 0.54 H new ATOM 0 HA2 GLY A 21 -11.878 16.193 -3.988 1.00 0.65 H new ATOM 0 HA3 GLY A 21 -11.036 16.030 -5.516 1.00 0.65 H new ATOM 959 N LYS A 22 -14.029 14.802 -5.572 1.00 0.70 N ATOM 960 CA LYS A 22 -15.334 14.892 -6.205 1.00 0.76 C ATOM 961 C LYS A 22 -16.349 15.504 -5.250 1.00 0.85 C ATOM 962 O LYS A 22 -16.883 16.587 -5.501 1.00 0.93 O ATOM 963 CB LYS A 22 -15.822 13.519 -6.671 1.00 0.78 C ATOM 964 CG LYS A 22 -15.161 13.021 -7.944 1.00 1.19 C ATOM 965 CD LYS A 22 -15.928 11.845 -8.523 1.00 1.26 C ATOM 966 CE LYS A 22 -15.310 11.345 -9.816 1.00 1.71 C ATOM 967 NZ LYS A 22 -16.210 10.391 -10.514 1.00 2.08 N ATOM 0 H LYS A 22 -13.858 13.928 -5.074 1.00 0.70 H new ATOM 0 HA LYS A 22 -15.233 15.535 -7.080 1.00 0.76 H new ATOM 0 HB2 LYS A 22 -15.645 12.794 -5.876 1.00 0.78 H new ATOM 0 HB3 LYS A 22 -16.900 13.563 -6.828 1.00 0.78 H new ATOM 0 HG2 LYS A 22 -15.116 13.828 -8.676 1.00 1.19 H new ATOM 0 HG3 LYS A 22 -14.134 12.723 -7.734 1.00 1.19 H new ATOM 0 HD2 LYS A 22 -15.952 11.034 -7.795 1.00 1.26 H new ATOM 0 HD3 LYS A 22 -16.961 12.140 -8.705 1.00 1.26 H new ATOM 0 HE2 LYS A 22 -15.096 12.191 -10.470 1.00 1.71 H new ATOM 0 HE3 LYS A 22 -14.358 10.859 -9.602 1.00 1.71 H new ATOM 0 HZ1 LYS A 22 -15.645 9.631 -10.943 1.00 2.08 H new ATOM 0 HZ2 LYS A 22 -16.879 9.982 -9.831 1.00 2.08 H new ATOM 0 HZ3 LYS A 22 -16.737 10.892 -11.258 1.00 2.08 H new ATOM 981 N GLU A 23 -16.592 14.815 -4.149 1.00 0.96 N ATOM 982 CA GLU A 23 -17.579 15.245 -3.166 1.00 1.13 C ATOM 983 C GLU A 23 -16.888 15.782 -1.921 1.00 1.24 C ATOM 984 O GLU A 23 -17.289 16.810 -1.367 1.00 1.56 O ATOM 985 CB GLU A 23 -18.492 14.078 -2.777 1.00 1.44 C ATOM 986 CG GLU A 23 -19.292 13.500 -3.933 1.00 1.91 C ATOM 987 CD GLU A 23 -20.360 14.444 -4.440 1.00 2.47 C ATOM 988 OE1 GLU A 23 -21.397 14.589 -3.761 1.00 2.94 O ATOM 989 OE2 GLU A 23 -20.183 15.029 -5.527 1.00 3.12 O ATOM 0 H GLU A 23 -16.115 13.946 -3.909 1.00 0.96 H new ATOM 0 HA GLU A 23 -18.181 16.036 -3.613 1.00 1.13 H new ATOM 0 HB2 GLU A 23 -17.884 13.286 -2.339 1.00 1.44 H new ATOM 0 HB3 GLU A 23 -19.183 14.414 -2.004 1.00 1.44 H new ATOM 0 HG2 GLU A 23 -18.614 13.254 -4.750 1.00 1.91 H new ATOM 0 HG3 GLU A 23 -19.759 12.568 -3.615 1.00 1.91 H new ATOM 996 N GLY A 24 -15.851 15.082 -1.483 1.00 1.31 N ATOM 997 CA GLY A 24 -15.136 15.484 -0.292 1.00 1.56 C ATOM 998 C GLY A 24 -13.991 16.424 -0.597 1.00 1.32 C ATOM 999 O GLY A 24 -14.106 17.307 -1.451 1.00 1.41 O ATOM 0 H GLY A 24 -15.492 14.240 -1.934 1.00 1.31 H new ATOM 0 HA2 GLY A 24 -15.827 15.969 0.397 1.00 1.56 H new ATOM 0 HA3 GLY A 24 -14.751 14.599 0.214 1.00 1.56 H new ATOM 1003 N ASP A 25 -12.886 16.242 0.104 1.00 1.15 N ATOM 1004 CA ASP A 25 -11.702 17.054 -0.122 1.00 1.05 C ATOM 1005 C ASP A 25 -10.715 16.272 -0.979 1.00 0.89 C ATOM 1006 O ASP A 25 -10.838 15.060 -1.109 1.00 0.91 O ATOM 1007 CB ASP A 25 -11.061 17.457 1.209 1.00 1.15 C ATOM 1008 CG ASP A 25 -10.087 18.611 1.060 1.00 1.30 C ATOM 1009 OD1 ASP A 25 -8.960 18.391 0.581 1.00 1.94 O ATOM 1010 OD2 ASP A 25 -10.447 19.751 1.419 1.00 1.80 O ATOM 0 H ASP A 25 -12.783 15.539 0.835 1.00 1.15 H new ATOM 0 HA ASP A 25 -11.987 17.968 -0.644 1.00 1.05 H new ATOM 0 HB2 ASP A 25 -11.843 17.735 1.916 1.00 1.15 H new ATOM 0 HB3 ASP A 25 -10.540 16.598 1.632 1.00 1.15 H new ATOM 1015 N LYS A 26 -9.712 16.954 -1.516 1.00 0.93 N ATOM 1016 CA LYS A 26 -8.794 16.359 -2.487 1.00 0.87 C ATOM 1017 C LYS A 26 -8.017 15.187 -1.887 1.00 0.82 C ATOM 1018 O LYS A 26 -7.396 14.409 -2.610 1.00 0.88 O ATOM 1019 CB LYS A 26 -7.801 17.411 -2.987 1.00 1.07 C ATOM 1020 CG LYS A 26 -8.450 18.698 -3.478 1.00 1.37 C ATOM 1021 CD LYS A 26 -9.297 18.481 -4.719 1.00 1.56 C ATOM 1022 CE LYS A 26 -8.442 18.221 -5.950 1.00 1.77 C ATOM 1023 NZ LYS A 26 -9.249 18.234 -7.200 1.00 2.57 N ATOM 0 H LYS A 26 -9.510 17.929 -1.295 1.00 0.93 H new ATOM 0 HA LYS A 26 -9.396 15.987 -3.316 1.00 0.87 H new ATOM 0 HB2 LYS A 26 -7.107 17.651 -2.181 1.00 1.07 H new ATOM 0 HB3 LYS A 26 -7.212 16.982 -3.798 1.00 1.07 H new ATOM 0 HG2 LYS A 26 -9.072 19.114 -2.685 1.00 1.37 H new ATOM 0 HG3 LYS A 26 -7.675 19.433 -3.694 1.00 1.37 H new ATOM 0 HD2 LYS A 26 -9.968 17.637 -4.558 1.00 1.56 H new ATOM 0 HD3 LYS A 26 -9.922 19.357 -4.890 1.00 1.56 H new ATOM 0 HE2 LYS A 26 -7.660 18.978 -6.015 1.00 1.77 H new ATOM 0 HE3 LYS A 26 -7.945 17.256 -5.849 1.00 1.77 H new ATOM 0 HZ1 LYS A 26 -8.629 18.053 -8.015 1.00 2.57 H new ATOM 0 HZ2 LYS A 26 -9.979 17.495 -7.149 1.00 2.57 H new ATOM 0 HZ3 LYS A 26 -9.703 19.163 -7.310 1.00 2.57 H new ATOM 1037 N PHE A 27 -8.046 15.079 -0.570 1.00 0.78 N ATOM 1038 CA PHE A 27 -7.350 14.009 0.124 1.00 0.78 C ATOM 1039 C PHE A 27 -8.260 13.309 1.130 1.00 0.69 C ATOM 1040 O PHE A 27 -7.794 12.538 1.969 1.00 0.68 O ATOM 1041 CB PHE A 27 -6.091 14.546 0.806 1.00 0.98 C ATOM 1042 CG PHE A 27 -6.291 15.850 1.508 1.00 0.66 C ATOM 1043 CD1 PHE A 27 -6.900 15.896 2.749 1.00 1.57 C ATOM 1044 CD2 PHE A 27 -5.862 17.030 0.924 1.00 1.53 C ATOM 1045 CE1 PHE A 27 -7.079 17.102 3.399 1.00 2.34 C ATOM 1046 CE2 PHE A 27 -6.036 18.238 1.568 1.00 2.32 C ATOM 1047 CZ PHE A 27 -6.643 18.274 2.809 1.00 2.54 C ATOM 0 H PHE A 27 -8.547 15.723 0.043 1.00 0.78 H new ATOM 0 HA PHE A 27 -7.053 13.266 -0.617 1.00 0.78 H new ATOM 0 HB2 PHE A 27 -5.737 13.808 1.526 1.00 0.98 H new ATOM 0 HB3 PHE A 27 -5.307 14.664 0.058 1.00 0.98 H new ATOM 0 HD1 PHE A 27 -7.238 14.982 3.214 1.00 1.57 H new ATOM 0 HD2 PHE A 27 -5.386 17.005 -0.045 1.00 1.53 H new ATOM 0 HE1 PHE A 27 -7.559 17.129 4.366 1.00 2.34 H new ATOM 0 HE2 PHE A 27 -5.699 19.153 1.103 1.00 2.32 H new ATOM 0 HZ PHE A 27 -6.777 19.217 3.318 1.00 2.54 H new ATOM 1057 N LYS A 28 -9.552 13.587 1.057 1.00 0.67 N ATOM 1058 CA LYS A 28 -10.505 12.955 1.955 1.00 0.64 C ATOM 1059 C LYS A 28 -11.550 12.193 1.164 1.00 0.48 C ATOM 1060 O LYS A 28 -12.293 12.770 0.375 1.00 0.54 O ATOM 1061 CB LYS A 28 -11.216 13.997 2.830 1.00 0.87 C ATOM 1062 CG LYS A 28 -10.295 14.875 3.663 1.00 1.00 C ATOM 1063 CD LYS A 28 -9.591 14.087 4.749 1.00 1.04 C ATOM 1064 CE LYS A 28 -8.863 15.018 5.711 1.00 1.55 C ATOM 1065 NZ LYS A 28 -8.272 14.294 6.865 1.00 2.03 N ATOM 0 H LYS A 28 -9.963 14.241 0.391 1.00 0.67 H new ATOM 0 HA LYS A 28 -9.948 12.270 2.594 1.00 0.64 H new ATOM 0 HB2 LYS A 28 -11.820 14.637 2.187 1.00 0.87 H new ATOM 0 HB3 LYS A 28 -11.903 13.479 3.500 1.00 0.87 H new ATOM 0 HG2 LYS A 28 -9.553 15.341 3.014 1.00 1.00 H new ATOM 0 HG3 LYS A 28 -10.873 15.680 4.116 1.00 1.00 H new ATOM 0 HD2 LYS A 28 -10.317 13.487 5.297 1.00 1.04 H new ATOM 0 HD3 LYS A 28 -8.880 13.394 4.299 1.00 1.04 H new ATOM 0 HE2 LYS A 28 -8.074 15.545 5.174 1.00 1.55 H new ATOM 0 HE3 LYS A 28 -9.559 15.773 6.077 1.00 1.55 H new ATOM 0 HZ1 LYS A 28 -7.818 14.975 7.506 1.00 2.03 H new ATOM 0 HZ2 LYS A 28 -9.021 13.784 7.375 1.00 2.03 H new ATOM 0 HZ3 LYS A 28 -7.563 13.615 6.522 1.00 2.03 H new ATOM 1079 N LEU A 29 -11.606 10.899 1.389 1.00 0.36 N ATOM 1080 CA LEU A 29 -12.631 10.073 0.764 1.00 0.32 C ATOM 1081 C LEU A 29 -13.684 9.663 1.777 1.00 0.34 C ATOM 1082 O LEU A 29 -13.390 8.956 2.738 1.00 0.40 O ATOM 1083 CB LEU A 29 -12.046 8.811 0.120 1.00 0.30 C ATOM 1084 CG LEU A 29 -11.183 9.032 -1.123 1.00 0.30 C ATOM 1085 CD1 LEU A 29 -9.735 9.254 -0.731 1.00 0.32 C ATOM 1086 CD2 LEU A 29 -11.311 7.857 -2.078 1.00 0.33 C ATOM 0 H LEU A 29 -10.961 10.393 1.995 1.00 0.36 H new ATOM 0 HA LEU A 29 -13.084 10.682 -0.018 1.00 0.32 H new ATOM 0 HB2 LEU A 29 -11.446 8.291 0.867 1.00 0.30 H new ATOM 0 HB3 LEU A 29 -12.869 8.148 -0.146 1.00 0.30 H new ATOM 0 HG LEU A 29 -11.538 9.926 -1.636 1.00 0.30 H new ATOM 0 HD11 LEU A 29 -9.135 9.410 -1.628 1.00 0.32 H new ATOM 0 HD12 LEU A 29 -9.662 10.132 -0.089 1.00 0.32 H new ATOM 0 HD13 LEU A 29 -9.365 8.380 -0.194 1.00 0.32 H new ATOM 0 HD21 LEU A 29 -10.690 8.033 -2.956 1.00 0.33 H new ATOM 0 HD22 LEU A 29 -10.984 6.945 -1.579 1.00 0.33 H new ATOM 0 HD23 LEU A 29 -12.351 7.749 -2.385 1.00 0.33 H new ATOM 1098 N ASN A 30 -14.909 10.121 1.569 1.00 0.35 N ATOM 1099 CA ASN A 30 -16.034 9.639 2.355 1.00 0.35 C ATOM 1100 C ASN A 30 -16.563 8.357 1.716 1.00 0.31 C ATOM 1101 O ASN A 30 -15.951 7.840 0.777 1.00 0.29 O ATOM 1102 CB ASN A 30 -17.146 10.696 2.461 1.00 0.41 C ATOM 1103 CG ASN A 30 -17.859 10.957 1.147 1.00 0.62 C ATOM 1104 OD1 ASN A 30 -18.809 10.260 0.792 1.00 1.20 O ATOM 1105 ND2 ASN A 30 -17.429 11.982 0.432 1.00 0.63 N ATOM 0 H ASN A 30 -15.149 10.821 0.867 1.00 0.35 H new ATOM 0 HA ASN A 30 -15.696 9.435 3.371 1.00 0.35 H new ATOM 0 HB2 ASN A 30 -17.875 10.372 3.203 1.00 0.41 H new ATOM 0 HB3 ASN A 30 -16.716 11.630 2.824 1.00 0.41 H new ATOM 0 HD21 ASN A 30 -17.888 12.219 -0.447 1.00 0.63 H new ATOM 0 HD22 ASN A 30 -16.638 12.536 0.760 1.00 0.63 H new ATOM 1112 N LYS A 31 -17.681 7.846 2.222 1.00 0.32 N ATOM 1113 CA LYS A 31 -18.251 6.592 1.721 1.00 0.31 C ATOM 1114 C LYS A 31 -18.428 6.615 0.202 1.00 0.30 C ATOM 1115 O LYS A 31 -18.033 5.679 -0.489 1.00 0.31 O ATOM 1116 CB LYS A 31 -19.601 6.305 2.384 1.00 0.35 C ATOM 1117 CG LYS A 31 -19.536 6.212 3.902 1.00 0.45 C ATOM 1118 CD LYS A 31 -20.852 5.728 4.495 1.00 0.56 C ATOM 1119 CE LYS A 31 -22.008 6.664 4.170 1.00 1.22 C ATOM 1120 NZ LYS A 31 -21.800 8.029 4.723 1.00 1.70 N ATOM 0 H LYS A 31 -18.213 8.278 2.978 1.00 0.32 H new ATOM 0 HA LYS A 31 -17.546 5.800 1.974 1.00 0.31 H new ATOM 0 HB2 LYS A 31 -20.304 7.090 2.108 1.00 0.35 H new ATOM 0 HB3 LYS A 31 -19.997 5.369 1.989 1.00 0.35 H new ATOM 0 HG2 LYS A 31 -18.735 5.531 4.191 1.00 0.45 H new ATOM 0 HG3 LYS A 31 -19.288 7.189 4.316 1.00 0.45 H new ATOM 0 HD2 LYS A 31 -21.075 4.731 4.114 1.00 0.56 H new ATOM 0 HD3 LYS A 31 -20.751 5.640 5.577 1.00 0.56 H new ATOM 0 HE2 LYS A 31 -22.129 6.727 3.089 1.00 1.22 H new ATOM 0 HE3 LYS A 31 -22.933 6.249 4.571 1.00 1.22 H new ATOM 0 HZ1 LYS A 31 -22.666 8.591 4.596 1.00 1.70 H new ATOM 0 HZ2 LYS A 31 -21.576 7.963 5.736 1.00 1.70 H new ATOM 0 HZ3 LYS A 31 -21.012 8.490 4.224 1.00 1.70 H new ATOM 1134 N SER A 32 -18.998 7.699 -0.310 1.00 0.32 N ATOM 1135 CA SER A 32 -19.297 7.815 -1.732 1.00 0.34 C ATOM 1136 C SER A 32 -18.015 7.811 -2.570 1.00 0.31 C ATOM 1137 O SER A 32 -17.983 7.245 -3.666 1.00 0.34 O ATOM 1138 CB SER A 32 -20.103 9.094 -1.994 1.00 0.43 C ATOM 1139 OG SER A 32 -20.582 9.142 -3.328 1.00 1.29 O ATOM 0 H SER A 32 -19.264 8.515 0.242 1.00 0.32 H new ATOM 0 HA SER A 32 -19.891 6.951 -2.028 1.00 0.34 H new ATOM 0 HB2 SER A 32 -20.944 9.144 -1.302 1.00 0.43 H new ATOM 0 HB3 SER A 32 -19.478 9.966 -1.799 1.00 0.43 H new ATOM 0 HG SER A 32 -21.092 9.968 -3.463 1.00 1.29 H new ATOM 1145 N GLU A 33 -16.951 8.401 -2.034 1.00 0.30 N ATOM 1146 CA GLU A 33 -15.703 8.545 -2.773 1.00 0.31 C ATOM 1147 C GLU A 33 -15.025 7.195 -2.889 1.00 0.26 C ATOM 1148 O GLU A 33 -14.604 6.780 -3.970 1.00 0.27 O ATOM 1149 CB GLU A 33 -14.769 9.524 -2.066 1.00 0.37 C ATOM 1150 CG GLU A 33 -15.434 10.827 -1.654 1.00 0.51 C ATOM 1151 CD GLU A 33 -15.973 11.622 -2.823 1.00 0.88 C ATOM 1152 OE1 GLU A 33 -16.918 11.151 -3.485 1.00 1.46 O ATOM 1153 OE2 GLU A 33 -15.476 12.739 -3.054 1.00 1.68 O ATOM 0 H GLU A 33 -16.929 8.787 -1.090 1.00 0.30 H new ATOM 0 HA GLU A 33 -15.929 8.932 -3.766 1.00 0.31 H new ATOM 0 HB2 GLU A 33 -14.358 9.042 -1.179 1.00 0.37 H new ATOM 0 HB3 GLU A 33 -13.930 9.749 -2.724 1.00 0.37 H new ATOM 0 HG2 GLU A 33 -16.250 10.608 -0.966 1.00 0.51 H new ATOM 0 HG3 GLU A 33 -14.714 11.438 -1.110 1.00 0.51 H new ATOM 1160 N LEU A 34 -14.937 6.510 -1.759 1.00 0.23 N ATOM 1161 CA LEU A 34 -14.353 5.184 -1.718 1.00 0.20 C ATOM 1162 C LEU A 34 -15.188 4.204 -2.517 1.00 0.20 C ATOM 1163 O LEU A 34 -14.654 3.295 -3.148 1.00 0.23 O ATOM 1164 CB LEU A 34 -14.214 4.702 -0.278 1.00 0.18 C ATOM 1165 CG LEU A 34 -12.950 5.164 0.432 1.00 0.18 C ATOM 1166 CD1 LEU A 34 -13.010 4.800 1.898 1.00 0.21 C ATOM 1167 CD2 LEU A 34 -11.733 4.538 -0.222 1.00 0.18 C ATOM 0 H LEU A 34 -15.265 6.855 -0.857 1.00 0.23 H new ATOM 0 HA LEU A 34 -13.360 5.239 -2.165 1.00 0.20 H new ATOM 0 HB2 LEU A 34 -15.079 5.045 0.290 1.00 0.18 H new ATOM 0 HB3 LEU A 34 -14.240 3.612 -0.271 1.00 0.18 H new ATOM 0 HG LEU A 34 -12.873 6.248 0.350 1.00 0.18 H new ATOM 0 HD11 LEU A 34 -12.099 5.136 2.394 1.00 0.21 H new ATOM 0 HD12 LEU A 34 -13.873 5.282 2.358 1.00 0.21 H new ATOM 0 HD13 LEU A 34 -13.101 3.719 2.001 1.00 0.21 H new ATOM 0 HD21 LEU A 34 -10.832 4.873 0.291 1.00 0.18 H new ATOM 0 HD22 LEU A 34 -11.804 3.452 -0.159 1.00 0.18 H new ATOM 0 HD23 LEU A 34 -11.687 4.838 -1.269 1.00 0.18 H new ATOM 1179 N LYS A 35 -16.499 4.390 -2.506 1.00 0.23 N ATOM 1180 CA LYS A 35 -17.370 3.516 -3.261 1.00 0.29 C ATOM 1181 C LYS A 35 -17.058 3.625 -4.742 1.00 0.25 C ATOM 1182 O LYS A 35 -16.809 2.619 -5.392 1.00 0.27 O ATOM 1183 CB LYS A 35 -18.843 3.815 -2.987 1.00 0.42 C ATOM 1184 CG LYS A 35 -19.760 2.680 -3.409 1.00 0.60 C ATOM 1185 CD LYS A 35 -21.139 2.813 -2.792 1.00 0.71 C ATOM 1186 CE LYS A 35 -21.912 3.957 -3.408 1.00 0.53 C ATOM 1187 NZ LYS A 35 -23.218 4.168 -2.734 1.00 0.89 N ATOM 0 H LYS A 35 -16.974 5.129 -1.988 1.00 0.23 H new ATOM 0 HA LYS A 35 -17.186 2.491 -2.938 1.00 0.29 H new ATOM 0 HB2 LYS A 35 -18.978 4.009 -1.923 1.00 0.42 H new ATOM 0 HB3 LYS A 35 -19.130 4.724 -3.516 1.00 0.42 H new ATOM 0 HG2 LYS A 35 -19.847 2.668 -4.495 1.00 0.60 H new ATOM 0 HG3 LYS A 35 -19.320 1.728 -3.114 1.00 0.60 H new ATOM 0 HD2 LYS A 35 -21.691 1.883 -2.929 1.00 0.71 H new ATOM 0 HD3 LYS A 35 -21.045 2.973 -1.718 1.00 0.71 H new ATOM 0 HE2 LYS A 35 -21.320 4.870 -3.347 1.00 0.53 H new ATOM 0 HE3 LYS A 35 -22.078 3.755 -4.466 1.00 0.53 H new ATOM 0 HZ1 LYS A 35 -23.672 5.022 -3.117 1.00 0.89 H new ATOM 0 HZ2 LYS A 35 -23.832 3.345 -2.901 1.00 0.89 H new ATOM 0 HZ3 LYS A 35 -23.066 4.285 -1.712 1.00 0.89 H new ATOM 1201 N GLU A 36 -17.032 4.841 -5.272 1.00 0.25 N ATOM 1202 CA GLU A 36 -16.651 5.042 -6.667 1.00 0.28 C ATOM 1203 C GLU A 36 -15.246 4.514 -6.930 1.00 0.28 C ATOM 1204 O GLU A 36 -14.983 3.927 -7.977 1.00 0.34 O ATOM 1205 CB GLU A 36 -16.737 6.511 -7.060 1.00 0.32 C ATOM 1206 CG GLU A 36 -18.076 6.898 -7.652 1.00 0.66 C ATOM 1207 CD GLU A 36 -18.089 8.318 -8.166 1.00 0.77 C ATOM 1208 OE1 GLU A 36 -17.524 8.562 -9.252 1.00 1.49 O ATOM 1209 OE2 GLU A 36 -18.657 9.196 -7.488 1.00 1.28 O ATOM 0 H GLU A 36 -17.267 5.695 -4.766 1.00 0.25 H new ATOM 0 HA GLU A 36 -17.357 4.481 -7.280 1.00 0.28 H new ATOM 0 HB2 GLU A 36 -16.545 7.126 -6.181 1.00 0.32 H new ATOM 0 HB3 GLU A 36 -15.951 6.733 -7.782 1.00 0.32 H new ATOM 0 HG2 GLU A 36 -18.320 6.217 -8.467 1.00 0.66 H new ATOM 0 HG3 GLU A 36 -18.852 6.781 -6.896 1.00 0.66 H new ATOM 1216 N LEU A 37 -14.357 4.717 -5.969 1.00 0.25 N ATOM 1217 CA LEU A 37 -12.999 4.194 -6.041 1.00 0.27 C ATOM 1218 C LEU A 37 -13.016 2.698 -6.323 1.00 0.23 C ATOM 1219 O LEU A 37 -12.509 2.233 -7.347 1.00 0.24 O ATOM 1220 CB LEU A 37 -12.285 4.451 -4.716 1.00 0.32 C ATOM 1221 CG LEU A 37 -10.766 4.400 -4.775 1.00 0.40 C ATOM 1222 CD1 LEU A 37 -10.215 5.774 -5.112 1.00 0.33 C ATOM 1223 CD2 LEU A 37 -10.202 3.890 -3.460 1.00 0.74 C ATOM 0 H LEU A 37 -14.555 5.247 -5.120 1.00 0.25 H new ATOM 0 HA LEU A 37 -12.472 4.698 -6.851 1.00 0.27 H new ATOM 0 HB2 LEU A 37 -12.585 5.431 -4.345 1.00 0.32 H new ATOM 0 HB3 LEU A 37 -12.629 3.716 -3.988 1.00 0.32 H new ATOM 0 HG LEU A 37 -10.462 3.707 -5.560 1.00 0.40 H new ATOM 0 HD11 LEU A 37 -9.127 5.730 -5.152 1.00 0.33 H new ATOM 0 HD12 LEU A 37 -10.601 6.094 -6.080 1.00 0.33 H new ATOM 0 HD13 LEU A 37 -10.521 6.487 -4.346 1.00 0.33 H new ATOM 0 HD21 LEU A 37 -9.114 3.859 -3.518 1.00 0.74 H new ATOM 0 HD22 LEU A 37 -10.503 4.556 -2.652 1.00 0.74 H new ATOM 0 HD23 LEU A 37 -10.583 2.888 -3.265 1.00 0.74 H new ATOM 1235 N LEU A 38 -13.634 1.955 -5.418 1.00 0.20 N ATOM 1236 CA LEU A 38 -13.642 0.506 -5.493 1.00 0.20 C ATOM 1237 C LEU A 38 -14.570 -0.012 -6.594 1.00 0.22 C ATOM 1238 O LEU A 38 -14.286 -1.028 -7.210 1.00 0.24 O ATOM 1239 CB LEU A 38 -14.026 -0.094 -4.140 1.00 0.19 C ATOM 1240 CG LEU A 38 -12.928 -0.051 -3.072 1.00 0.18 C ATOM 1241 CD1 LEU A 38 -13.304 0.893 -1.944 1.00 0.19 C ATOM 1242 CD2 LEU A 38 -12.663 -1.445 -2.527 1.00 0.21 C ATOM 0 H LEU A 38 -14.139 2.337 -4.618 1.00 0.20 H new ATOM 0 HA LEU A 38 -12.632 0.188 -5.750 1.00 0.20 H new ATOM 0 HB2 LEU A 38 -14.900 0.435 -3.761 1.00 0.19 H new ATOM 0 HB3 LEU A 38 -14.323 -1.132 -4.292 1.00 0.19 H new ATOM 0 HG LEU A 38 -12.016 0.322 -3.539 1.00 0.18 H new ATOM 0 HD11 LEU A 38 -12.508 0.905 -1.199 1.00 0.19 H new ATOM 0 HD12 LEU A 38 -13.444 1.898 -2.342 1.00 0.19 H new ATOM 0 HD13 LEU A 38 -14.230 0.554 -1.480 1.00 0.19 H new ATOM 0 HD21 LEU A 38 -11.881 -1.397 -1.770 1.00 0.21 H new ATOM 0 HD22 LEU A 38 -13.576 -1.841 -2.081 1.00 0.21 H new ATOM 0 HD23 LEU A 38 -12.343 -2.098 -3.339 1.00 0.21 H new ATOM 1254 N THR A 39 -15.661 0.684 -6.859 1.00 0.23 N ATOM 1255 CA THR A 39 -16.625 0.220 -7.865 1.00 0.26 C ATOM 1256 C THR A 39 -16.004 0.218 -9.253 1.00 0.27 C ATOM 1257 O THR A 39 -16.290 -0.652 -10.079 1.00 0.30 O ATOM 1258 CB THR A 39 -17.909 1.079 -7.908 1.00 0.29 C ATOM 1259 OG1 THR A 39 -17.578 2.470 -7.989 1.00 0.33 O ATOM 1260 CG2 THR A 39 -18.782 0.835 -6.689 1.00 0.30 C ATOM 0 H THR A 39 -15.908 1.562 -6.403 1.00 0.23 H new ATOM 0 HA THR A 39 -16.897 -0.793 -7.568 1.00 0.26 H new ATOM 0 HB THR A 39 -18.469 0.786 -8.796 1.00 0.29 H new ATOM 0 HG1 THR A 39 -17.166 2.758 -7.148 1.00 0.33 H new ATOM 0 HG21 THR A 39 -19.676 1.455 -6.752 1.00 0.30 H new ATOM 0 HG22 THR A 39 -19.071 -0.215 -6.653 1.00 0.30 H new ATOM 0 HG23 THR A 39 -18.226 1.090 -5.787 1.00 0.30 H new ATOM 1268 N ARG A 40 -15.149 1.193 -9.495 1.00 0.27 N ATOM 1269 CA ARG A 40 -14.558 1.386 -10.804 1.00 0.30 C ATOM 1270 C ARG A 40 -13.251 0.612 -10.950 1.00 0.29 C ATOM 1271 O ARG A 40 -13.109 -0.213 -11.853 1.00 0.33 O ATOM 1272 CB ARG A 40 -14.320 2.876 -11.036 1.00 0.34 C ATOM 1273 CG ARG A 40 -15.590 3.712 -10.958 1.00 0.36 C ATOM 1274 CD ARG A 40 -16.491 3.481 -12.156 1.00 0.47 C ATOM 1275 NE ARG A 40 -15.884 3.981 -13.388 1.00 0.67 N ATOM 1276 CZ ARG A 40 -16.153 3.513 -14.603 1.00 0.90 C ATOM 1277 NH1 ARG A 40 -17.034 2.533 -14.769 1.00 1.24 N ATOM 1278 NH2 ARG A 40 -15.540 4.031 -15.655 1.00 1.09 N ATOM 0 H ARG A 40 -14.846 1.869 -8.794 1.00 0.27 H new ATOM 0 HA ARG A 40 -15.250 1.002 -11.554 1.00 0.30 H new ATOM 0 HB2 ARG A 40 -13.608 3.242 -10.297 1.00 0.34 H new ATOM 0 HB3 ARG A 40 -13.862 3.015 -12.016 1.00 0.34 H new ATOM 0 HG2 ARG A 40 -16.131 3.467 -10.044 1.00 0.36 H new ATOM 0 HG3 ARG A 40 -15.327 4.768 -10.899 1.00 0.36 H new ATOM 0 HD2 ARG A 40 -16.697 2.415 -12.257 1.00 0.47 H new ATOM 0 HD3 ARG A 40 -17.448 3.977 -11.994 1.00 0.47 H new ATOM 0 HE ARG A 40 -15.208 4.741 -13.310 1.00 0.67 H new ATOM 0 HH11 ARG A 40 -17.510 2.133 -13.961 1.00 1.24 H new ATOM 0 HH12 ARG A 40 -17.234 2.180 -15.705 1.00 1.24 H new ATOM 0 HH21 ARG A 40 -14.865 4.786 -15.532 1.00 1.09 H new ATOM 0 HH22 ARG A 40 -15.743 3.676 -16.589 1.00 1.09 H new ATOM 1292 N GLU A 41 -12.300 0.879 -10.060 1.00 0.29 N ATOM 1293 CA GLU A 41 -10.960 0.313 -10.191 1.00 0.32 C ATOM 1294 C GLU A 41 -10.699 -0.883 -9.270 1.00 0.35 C ATOM 1295 O GLU A 41 -9.668 -1.533 -9.397 1.00 0.46 O ATOM 1296 CB GLU A 41 -9.902 1.396 -9.981 1.00 0.38 C ATOM 1297 CG GLU A 41 -9.564 2.142 -11.261 1.00 0.47 C ATOM 1298 CD GLU A 41 -8.656 3.337 -11.047 1.00 0.83 C ATOM 1299 OE1 GLU A 41 -7.555 3.163 -10.489 1.00 1.54 O ATOM 1300 OE2 GLU A 41 -9.028 4.453 -11.466 1.00 1.60 O ATOM 0 H GLU A 41 -12.430 1.479 -9.246 1.00 0.29 H new ATOM 0 HA GLU A 41 -10.893 -0.074 -11.208 1.00 0.32 H new ATOM 0 HB2 GLU A 41 -10.258 2.106 -9.235 1.00 0.38 H new ATOM 0 HB3 GLU A 41 -8.996 0.940 -9.581 1.00 0.38 H new ATOM 0 HG2 GLU A 41 -9.086 1.453 -11.957 1.00 0.47 H new ATOM 0 HG3 GLU A 41 -10.489 2.478 -11.730 1.00 0.47 H new ATOM 1307 N LEU A 42 -11.605 -1.181 -8.345 1.00 0.28 N ATOM 1308 CA LEU A 42 -11.421 -2.353 -7.474 1.00 0.29 C ATOM 1309 C LEU A 42 -12.650 -3.278 -7.474 1.00 0.28 C ATOM 1310 O LEU A 42 -13.034 -3.777 -6.416 1.00 0.26 O ATOM 1311 CB LEU A 42 -11.140 -1.930 -6.022 1.00 0.27 C ATOM 1312 CG LEU A 42 -9.891 -1.085 -5.779 1.00 0.27 C ATOM 1313 CD1 LEU A 42 -10.179 0.399 -5.994 1.00 0.27 C ATOM 1314 CD2 LEU A 42 -9.363 -1.331 -4.375 1.00 0.31 C ATOM 0 H LEU A 42 -12.457 -0.647 -8.175 1.00 0.28 H new ATOM 0 HA LEU A 42 -10.567 -2.895 -7.880 1.00 0.29 H new ATOM 0 HB2 LEU A 42 -12.003 -1.373 -5.658 1.00 0.27 H new ATOM 0 HB3 LEU A 42 -11.063 -2.832 -5.415 1.00 0.27 H new ATOM 0 HG LEU A 42 -9.129 -1.382 -6.500 1.00 0.27 H new ATOM 0 HD11 LEU A 42 -9.272 0.976 -5.814 1.00 0.27 H new ATOM 0 HD12 LEU A 42 -10.514 0.560 -7.019 1.00 0.27 H new ATOM 0 HD13 LEU A 42 -10.957 0.722 -5.303 1.00 0.27 H new ATOM 0 HD21 LEU A 42 -8.472 -0.725 -4.210 1.00 0.31 H new ATOM 0 HD22 LEU A 42 -10.127 -1.060 -3.646 1.00 0.31 H new ATOM 0 HD23 LEU A 42 -9.111 -2.385 -4.261 1.00 0.31 H new ATOM 1326 N PRO A 43 -13.270 -3.572 -8.641 1.00 0.32 N ATOM 1327 CA PRO A 43 -14.540 -4.314 -8.684 1.00 0.34 C ATOM 1328 C PRO A 43 -14.390 -5.743 -8.179 1.00 0.35 C ATOM 1329 O PRO A 43 -15.316 -6.314 -7.604 1.00 0.38 O ATOM 1330 CB PRO A 43 -14.924 -4.315 -10.167 1.00 0.43 C ATOM 1331 CG PRO A 43 -14.058 -3.283 -10.803 1.00 0.52 C ATOM 1332 CD PRO A 43 -12.794 -3.257 -9.996 1.00 0.36 C ATOM 0 HA PRO A 43 -15.292 -3.854 -8.042 1.00 0.34 H new ATOM 0 HB2 PRO A 43 -14.759 -5.295 -10.614 1.00 0.43 H new ATOM 0 HB3 PRO A 43 -15.980 -4.077 -10.299 1.00 0.43 H new ATOM 0 HG2 PRO A 43 -13.852 -3.533 -11.844 1.00 0.52 H new ATOM 0 HG3 PRO A 43 -14.545 -2.308 -10.799 1.00 0.52 H new ATOM 0 HD2 PRO A 43 -12.071 -3.991 -10.352 1.00 0.36 H new ATOM 0 HD3 PRO A 43 -12.307 -2.283 -10.038 1.00 0.36 H new ATOM 1340 N SER A 44 -13.207 -6.303 -8.385 1.00 0.37 N ATOM 1341 CA SER A 44 -12.918 -7.663 -7.962 1.00 0.41 C ATOM 1342 C SER A 44 -12.859 -7.748 -6.437 1.00 0.37 C ATOM 1343 O SER A 44 -13.005 -8.821 -5.857 1.00 0.42 O ATOM 1344 CB SER A 44 -11.590 -8.112 -8.581 1.00 0.48 C ATOM 1345 OG SER A 44 -11.569 -7.841 -9.976 1.00 1.09 O ATOM 0 H SER A 44 -12.428 -5.832 -8.846 1.00 0.37 H new ATOM 0 HA SER A 44 -13.714 -8.325 -8.303 1.00 0.41 H new ATOM 0 HB2 SER A 44 -10.763 -7.597 -8.093 1.00 0.48 H new ATOM 0 HB3 SER A 44 -11.446 -9.179 -8.411 1.00 0.48 H new ATOM 0 HG SER A 44 -10.786 -7.292 -10.191 1.00 1.09 H new ATOM 1351 N PHE A 45 -12.705 -6.592 -5.802 1.00 0.33 N ATOM 1352 CA PHE A 45 -12.487 -6.510 -4.364 1.00 0.34 C ATOM 1353 C PHE A 45 -13.749 -6.053 -3.631 1.00 0.36 C ATOM 1354 O PHE A 45 -13.682 -5.622 -2.482 1.00 0.40 O ATOM 1355 CB PHE A 45 -11.331 -5.551 -4.068 1.00 0.33 C ATOM 1356 CG PHE A 45 -10.048 -5.936 -4.750 1.00 0.35 C ATOM 1357 CD1 PHE A 45 -9.220 -6.901 -4.203 1.00 1.31 C ATOM 1358 CD2 PHE A 45 -9.675 -5.337 -5.944 1.00 1.17 C ATOM 1359 CE1 PHE A 45 -8.043 -7.262 -4.830 1.00 1.36 C ATOM 1360 CE2 PHE A 45 -8.499 -5.693 -6.576 1.00 1.15 C ATOM 1361 CZ PHE A 45 -7.682 -6.657 -6.019 1.00 0.46 C ATOM 0 H PHE A 45 -12.728 -5.686 -6.270 1.00 0.33 H new ATOM 0 HA PHE A 45 -12.235 -7.507 -4.003 1.00 0.34 H new ATOM 0 HB2 PHE A 45 -11.613 -4.546 -4.381 1.00 0.33 H new ATOM 0 HB3 PHE A 45 -11.165 -5.515 -2.991 1.00 0.33 H new ATOM 0 HD1 PHE A 45 -9.498 -7.378 -3.274 1.00 1.31 H new ATOM 0 HD2 PHE A 45 -10.311 -4.584 -6.385 1.00 1.17 H new ATOM 0 HE1 PHE A 45 -7.406 -8.016 -4.392 1.00 1.36 H new ATOM 0 HE2 PHE A 45 -8.219 -5.218 -7.505 1.00 1.15 H new ATOM 0 HZ PHE A 45 -6.763 -6.938 -6.512 1.00 0.46 H new ATOM 1371 N LEU A 46 -14.889 -6.091 -4.314 1.00 0.36 N ATOM 1372 CA LEU A 46 -16.140 -5.645 -3.705 1.00 0.40 C ATOM 1373 C LEU A 46 -17.169 -6.756 -3.542 1.00 0.55 C ATOM 1374 O LEU A 46 -18.204 -6.553 -2.901 1.00 0.70 O ATOM 1375 CB LEU A 46 -16.753 -4.527 -4.532 1.00 0.35 C ATOM 1376 CG LEU A 46 -15.973 -3.226 -4.508 1.00 0.32 C ATOM 1377 CD1 LEU A 46 -16.730 -2.148 -5.261 1.00 0.34 C ATOM 1378 CD2 LEU A 46 -15.721 -2.808 -3.070 1.00 0.30 C ATOM 0 H LEU A 46 -14.974 -6.421 -5.275 1.00 0.36 H new ATOM 0 HA LEU A 46 -15.879 -5.295 -2.706 1.00 0.40 H new ATOM 0 HB2 LEU A 46 -16.842 -4.863 -5.565 1.00 0.35 H new ATOM 0 HB3 LEU A 46 -17.763 -4.337 -4.170 1.00 0.35 H new ATOM 0 HG LEU A 46 -15.012 -3.371 -5.001 1.00 0.32 H new ATOM 0 HD11 LEU A 46 -16.160 -1.219 -5.237 1.00 0.34 H new ATOM 0 HD12 LEU A 46 -16.873 -2.459 -6.296 1.00 0.34 H new ATOM 0 HD13 LEU A 46 -17.701 -1.990 -4.792 1.00 0.34 H new ATOM 0 HD21 LEU A 46 -15.161 -1.873 -3.056 1.00 0.30 H new ATOM 0 HD22 LEU A 46 -16.674 -2.668 -2.560 1.00 0.30 H new ATOM 0 HD23 LEU A 46 -15.147 -3.583 -2.561 1.00 0.30 H new ATOM 1390 N GLY A 47 -16.914 -7.912 -4.129 1.00 0.64 N ATOM 1391 CA GLY A 47 -17.906 -8.971 -4.110 1.00 0.82 C ATOM 1392 C GLY A 47 -19.137 -8.614 -4.928 1.00 0.87 C ATOM 1393 O GLY A 47 -20.217 -9.166 -4.709 1.00 1.23 O ATOM 0 H GLY A 47 -16.047 -8.139 -4.615 1.00 0.64 H new ATOM 0 HA2 GLY A 47 -17.465 -9.888 -4.501 1.00 0.82 H new ATOM 0 HA3 GLY A 47 -18.201 -9.173 -3.080 1.00 0.82 H new ATOM 1397 N LYS A 48 -18.964 -7.653 -5.843 1.00 0.79 N ATOM 1398 CA LYS A 48 -19.992 -7.251 -6.810 1.00 0.95 C ATOM 1399 C LYS A 48 -21.117 -6.424 -6.173 1.00 0.73 C ATOM 1400 O LYS A 48 -21.371 -5.294 -6.587 1.00 0.97 O ATOM 1401 CB LYS A 48 -20.570 -8.482 -7.527 1.00 1.43 C ATOM 1402 CG LYS A 48 -21.396 -8.149 -8.761 1.00 2.17 C ATOM 1403 CD LYS A 48 -20.579 -7.385 -9.795 1.00 2.32 C ATOM 1404 CE LYS A 48 -19.323 -8.145 -10.198 1.00 2.88 C ATOM 1405 NZ LYS A 48 -18.492 -7.370 -11.156 1.00 3.51 N ATOM 0 H LYS A 48 -18.095 -7.126 -5.934 1.00 0.79 H new ATOM 0 HA LYS A 48 -19.501 -6.607 -7.540 1.00 0.95 H new ATOM 0 HB2 LYS A 48 -19.750 -9.139 -7.818 1.00 1.43 H new ATOM 0 HB3 LYS A 48 -21.191 -9.039 -6.826 1.00 1.43 H new ATOM 0 HG2 LYS A 48 -21.775 -9.070 -9.205 1.00 2.17 H new ATOM 0 HG3 LYS A 48 -22.262 -7.555 -8.470 1.00 2.17 H new ATOM 0 HD2 LYS A 48 -21.191 -7.201 -10.678 1.00 2.32 H new ATOM 0 HD3 LYS A 48 -20.301 -6.412 -9.391 1.00 2.32 H new ATOM 0 HE2 LYS A 48 -18.735 -8.373 -9.309 1.00 2.88 H new ATOM 0 HE3 LYS A 48 -19.603 -9.098 -10.648 1.00 2.88 H new ATOM 0 HZ1 LYS A 48 -17.646 -7.921 -11.406 1.00 3.51 H new ATOM 0 HZ2 LYS A 48 -19.044 -7.174 -12.015 1.00 3.51 H new ATOM 0 HZ3 LYS A 48 -18.203 -6.472 -10.718 1.00 3.51 H new ATOM 1419 N ARG A 49 -21.764 -6.976 -5.160 1.00 0.73 N ATOM 1420 CA ARG A 49 -22.959 -6.360 -4.569 1.00 0.70 C ATOM 1421 C ARG A 49 -22.609 -5.339 -3.491 1.00 0.61 C ATOM 1422 O ARG A 49 -23.132 -5.387 -2.378 1.00 0.75 O ATOM 1423 CB ARG A 49 -23.871 -7.447 -3.989 1.00 0.97 C ATOM 1424 CG ARG A 49 -23.165 -8.376 -3.011 1.00 1.10 C ATOM 1425 CD ARG A 49 -24.125 -9.349 -2.349 1.00 1.54 C ATOM 1426 NE ARG A 49 -24.785 -10.220 -3.318 1.00 2.02 N ATOM 1427 CZ ARG A 49 -24.622 -11.543 -3.361 1.00 2.68 C ATOM 1428 NH1 ARG A 49 -23.827 -12.150 -2.487 1.00 3.06 N ATOM 1429 NH2 ARG A 49 -25.268 -12.261 -4.267 1.00 3.24 N ATOM 0 H ARG A 49 -21.486 -7.854 -4.722 1.00 0.73 H new ATOM 0 HA ARG A 49 -23.480 -5.826 -5.363 1.00 0.70 H new ATOM 0 HB2 ARG A 49 -24.712 -6.972 -3.484 1.00 0.97 H new ATOM 0 HB3 ARG A 49 -24.283 -8.039 -4.807 1.00 0.97 H new ATOM 0 HG2 ARG A 49 -22.390 -8.934 -3.537 1.00 1.10 H new ATOM 0 HG3 ARG A 49 -22.666 -7.783 -2.245 1.00 1.10 H new ATOM 0 HD2 ARG A 49 -23.581 -9.958 -1.627 1.00 1.54 H new ATOM 0 HD3 ARG A 49 -24.878 -8.791 -1.792 1.00 1.54 H new ATOM 0 HE ARG A 49 -25.408 -9.791 -4.003 1.00 2.02 H new ATOM 0 HH11 ARG A 49 -23.337 -11.604 -1.778 1.00 3.06 H new ATOM 0 HH12 ARG A 49 -23.706 -13.162 -2.525 1.00 3.06 H new ATOM 0 HH21 ARG A 49 -25.890 -11.802 -4.932 1.00 3.24 H new ATOM 0 HH22 ARG A 49 -25.143 -13.273 -4.300 1.00 3.24 H new ATOM 1443 N THR A 50 -21.735 -4.402 -3.815 1.00 0.55 N ATOM 1444 CA THR A 50 -21.273 -3.436 -2.833 1.00 0.50 C ATOM 1445 C THR A 50 -22.202 -2.253 -2.696 1.00 0.50 C ATOM 1446 O THR A 50 -22.315 -1.414 -3.591 1.00 0.56 O ATOM 1447 CB THR A 50 -19.875 -2.929 -3.163 1.00 0.54 C ATOM 1448 OG1 THR A 50 -19.547 -3.287 -4.512 1.00 0.91 O ATOM 1449 CG2 THR A 50 -18.868 -3.513 -2.189 1.00 0.51 C ATOM 0 H THR A 50 -21.333 -4.289 -4.745 1.00 0.55 H new ATOM 0 HA THR A 50 -21.255 -3.970 -1.883 1.00 0.50 H new ATOM 0 HB THR A 50 -19.846 -1.843 -3.070 1.00 0.54 H new ATOM 0 HG1 THR A 50 -19.833 -2.573 -5.119 1.00 0.91 H new ATOM 0 HG21 THR A 50 -17.871 -3.145 -2.432 1.00 0.51 H new ATOM 0 HG22 THR A 50 -19.128 -3.213 -1.174 1.00 0.51 H new ATOM 0 HG23 THR A 50 -18.881 -4.601 -2.261 1.00 0.51 H new ATOM 1457 N ASP A 51 -22.882 -2.213 -1.574 1.00 0.49 N ATOM 1458 CA ASP A 51 -23.666 -1.056 -1.199 1.00 0.51 C ATOM 1459 C ASP A 51 -23.012 -0.399 0.013 1.00 0.44 C ATOM 1460 O ASP A 51 -21.845 -0.668 0.303 1.00 0.43 O ATOM 1461 CB ASP A 51 -25.110 -1.458 -0.895 1.00 0.60 C ATOM 1462 CG ASP A 51 -26.063 -0.294 -1.046 1.00 1.15 C ATOM 1463 OD1 ASP A 51 -26.498 -0.021 -2.186 1.00 1.72 O ATOM 1464 OD2 ASP A 51 -26.371 0.364 -0.035 1.00 1.94 O ATOM 0 H ASP A 51 -22.909 -2.976 -0.898 1.00 0.49 H new ATOM 0 HA ASP A 51 -23.696 -0.345 -2.025 1.00 0.51 H new ATOM 0 HB2 ASP A 51 -25.411 -2.263 -1.565 1.00 0.60 H new ATOM 0 HB3 ASP A 51 -25.172 -1.849 0.121 1.00 0.60 H new ATOM 1469 N GLU A 52 -23.754 0.426 0.736 1.00 0.47 N ATOM 1470 CA GLU A 52 -23.217 1.112 1.906 1.00 0.46 C ATOM 1471 C GLU A 52 -22.942 0.116 3.038 1.00 0.46 C ATOM 1472 O GLU A 52 -22.332 0.459 4.050 1.00 0.46 O ATOM 1473 CB GLU A 52 -24.197 2.185 2.380 1.00 0.49 C ATOM 1474 CG GLU A 52 -24.598 3.178 1.297 1.00 0.52 C ATOM 1475 CD GLU A 52 -23.481 4.124 0.902 1.00 0.71 C ATOM 1476 OE1 GLU A 52 -23.243 5.105 1.636 1.00 1.44 O ATOM 1477 OE2 GLU A 52 -22.868 3.916 -0.160 1.00 1.27 O ATOM 0 H GLU A 52 -24.731 0.638 0.534 1.00 0.47 H new ATOM 0 HA GLU A 52 -22.276 1.586 1.626 1.00 0.46 H new ATOM 0 HB2 GLU A 52 -25.094 1.699 2.764 1.00 0.49 H new ATOM 0 HB3 GLU A 52 -23.749 2.730 3.211 1.00 0.49 H new ATOM 0 HG2 GLU A 52 -24.927 2.629 0.415 1.00 0.52 H new ATOM 0 HG3 GLU A 52 -25.450 3.760 1.646 1.00 0.52 H new ATOM 1484 N ALA A 53 -23.406 -1.118 2.857 1.00 0.52 N ATOM 1485 CA ALA A 53 -23.208 -2.173 3.843 1.00 0.58 C ATOM 1486 C ALA A 53 -21.763 -2.661 3.854 1.00 0.57 C ATOM 1487 O ALA A 53 -21.083 -2.574 4.875 1.00 0.68 O ATOM 1488 CB ALA A 53 -24.158 -3.328 3.572 1.00 0.65 C ATOM 0 H ALA A 53 -23.925 -1.412 2.030 1.00 0.52 H new ATOM 0 HA ALA A 53 -23.425 -1.759 4.828 1.00 0.58 H new ATOM 0 HB1 ALA A 53 -24.001 -4.110 4.315 1.00 0.65 H new ATOM 0 HB2 ALA A 53 -25.187 -2.974 3.630 1.00 0.65 H new ATOM 0 HB3 ALA A 53 -23.968 -3.730 2.577 1.00 0.65 H new ATOM 1494 N ALA A 54 -21.284 -3.157 2.714 1.00 0.49 N ATOM 1495 CA ALA A 54 -19.918 -3.670 2.623 1.00 0.50 C ATOM 1496 C ALA A 54 -18.909 -2.556 2.855 1.00 0.45 C ATOM 1497 O ALA A 54 -17.815 -2.783 3.375 1.00 0.52 O ATOM 1498 CB ALA A 54 -19.672 -4.323 1.268 1.00 0.49 C ATOM 0 H ALA A 54 -21.817 -3.214 1.846 1.00 0.49 H new ATOM 0 HA ALA A 54 -19.792 -4.424 3.400 1.00 0.50 H new ATOM 0 HB1 ALA A 54 -18.649 -4.697 1.225 1.00 0.49 H new ATOM 0 HB2 ALA A 54 -20.367 -5.151 1.132 1.00 0.49 H new ATOM 0 HB3 ALA A 54 -19.824 -3.588 0.477 1.00 0.49 H new ATOM 1504 N PHE A 55 -19.298 -1.346 2.485 1.00 0.36 N ATOM 1505 CA PHE A 55 -18.435 -0.186 2.613 1.00 0.32 C ATOM 1506 C PHE A 55 -18.392 0.336 4.043 1.00 0.34 C ATOM 1507 O PHE A 55 -17.480 1.071 4.409 1.00 0.34 O ATOM 1508 CB PHE A 55 -18.889 0.908 1.650 1.00 0.31 C ATOM 1509 CG PHE A 55 -18.340 0.716 0.269 1.00 0.28 C ATOM 1510 CD1 PHE A 55 -17.090 1.204 -0.059 1.00 1.20 C ATOM 1511 CD2 PHE A 55 -19.060 0.030 -0.694 1.00 1.20 C ATOM 1512 CE1 PHE A 55 -16.567 1.015 -1.319 1.00 1.20 C ATOM 1513 CE2 PHE A 55 -18.544 -0.159 -1.959 1.00 1.21 C ATOM 1514 CZ PHE A 55 -17.295 0.334 -2.273 1.00 0.31 C ATOM 0 H PHE A 55 -20.216 -1.143 2.090 1.00 0.36 H new ATOM 0 HA PHE A 55 -17.421 -0.491 2.355 1.00 0.32 H new ATOM 0 HB2 PHE A 55 -19.978 0.921 1.607 1.00 0.31 H new ATOM 0 HB3 PHE A 55 -18.573 1.879 2.032 1.00 0.31 H new ATOM 0 HD1 PHE A 55 -16.516 1.740 0.682 1.00 1.20 H new ATOM 0 HD2 PHE A 55 -20.037 -0.362 -0.452 1.00 1.20 H new ATOM 0 HE1 PHE A 55 -15.587 1.400 -1.560 1.00 1.20 H new ATOM 0 HE2 PHE A 55 -19.117 -0.692 -2.703 1.00 1.21 H new ATOM 0 HZ PHE A 55 -16.888 0.188 -3.263 1.00 0.31 H new ATOM 1524 N GLN A 56 -19.365 -0.062 4.851 1.00 0.37 N ATOM 1525 CA GLN A 56 -19.441 0.389 6.234 1.00 0.40 C ATOM 1526 C GLN A 56 -18.273 -0.156 7.053 1.00 0.37 C ATOM 1527 O GLN A 56 -17.576 0.597 7.736 1.00 0.42 O ATOM 1528 CB GLN A 56 -20.767 -0.044 6.854 1.00 0.46 C ATOM 1529 CG GLN A 56 -20.981 0.468 8.264 1.00 0.58 C ATOM 1530 CD GLN A 56 -22.285 -0.016 8.852 1.00 0.68 C ATOM 1531 OE1 GLN A 56 -23.324 0.632 8.711 1.00 1.42 O ATOM 1532 NE2 GLN A 56 -22.242 -1.161 9.512 1.00 1.00 N ATOM 0 H GLN A 56 -20.113 -0.697 4.573 1.00 0.37 H new ATOM 0 HA GLN A 56 -19.382 1.477 6.242 1.00 0.40 H new ATOM 0 HB2 GLN A 56 -21.584 0.306 6.223 1.00 0.46 H new ATOM 0 HB3 GLN A 56 -20.815 -1.133 6.862 1.00 0.46 H new ATOM 0 HG2 GLN A 56 -20.155 0.142 8.897 1.00 0.58 H new ATOM 0 HG3 GLN A 56 -20.968 1.558 8.259 1.00 0.58 H new ATOM 0 HE21 GLN A 56 -21.359 -1.664 9.604 1.00 1.00 H new ATOM 0 HE22 GLN A 56 -23.092 -1.541 9.929 1.00 1.00 H new ATOM 1541 N LYS A 57 -18.044 -1.464 6.971 1.00 0.34 N ATOM 1542 CA LYS A 57 -16.961 -2.082 7.722 1.00 0.35 C ATOM 1543 C LYS A 57 -15.631 -1.658 7.129 1.00 0.29 C ATOM 1544 O LYS A 57 -14.649 -1.473 7.847 1.00 0.34 O ATOM 1545 CB LYS A 57 -17.088 -3.610 7.725 1.00 0.47 C ATOM 1546 CG LYS A 57 -15.888 -4.343 8.322 1.00 0.85 C ATOM 1547 CD LYS A 57 -15.946 -4.489 9.847 1.00 0.57 C ATOM 1548 CE LYS A 57 -15.923 -3.155 10.581 1.00 0.63 C ATOM 1549 NZ LYS A 57 -15.770 -3.332 12.051 1.00 0.92 N ATOM 0 H LYS A 57 -18.589 -2.109 6.398 1.00 0.34 H new ATOM 0 HA LYS A 57 -17.018 -1.747 8.758 1.00 0.35 H new ATOM 0 HB2 LYS A 57 -17.982 -3.887 8.284 1.00 0.47 H new ATOM 0 HB3 LYS A 57 -17.234 -3.952 6.700 1.00 0.47 H new ATOM 0 HG2 LYS A 57 -15.820 -5.334 7.874 1.00 0.85 H new ATOM 0 HG3 LYS A 57 -14.977 -3.809 8.052 1.00 0.85 H new ATOM 0 HD2 LYS A 57 -16.852 -5.030 10.119 1.00 0.57 H new ATOM 0 HD3 LYS A 57 -15.102 -5.093 10.180 1.00 0.57 H new ATOM 0 HE2 LYS A 57 -15.102 -2.546 10.201 1.00 0.63 H new ATOM 0 HE3 LYS A 57 -16.845 -2.611 10.375 1.00 0.63 H new ATOM 0 HZ1 LYS A 57 -15.759 -2.401 12.514 1.00 0.92 H new ATOM 0 HZ2 LYS A 57 -16.566 -3.891 12.418 1.00 0.92 H new ATOM 0 HZ3 LYS A 57 -14.878 -3.828 12.250 1.00 0.92 H new ATOM 1563 N LEU A 58 -15.617 -1.498 5.811 1.00 0.24 N ATOM 1564 CA LEU A 58 -14.453 -0.978 5.117 1.00 0.20 C ATOM 1565 C LEU A 58 -14.063 0.372 5.701 1.00 0.20 C ATOM 1566 O LEU A 58 -12.997 0.512 6.291 1.00 0.22 O ATOM 1567 CB LEU A 58 -14.741 -0.840 3.619 1.00 0.20 C ATOM 1568 CG LEU A 58 -13.661 -0.116 2.818 1.00 0.19 C ATOM 1569 CD1 LEU A 58 -12.307 -0.749 3.073 1.00 0.20 C ATOM 1570 CD2 LEU A 58 -13.997 -0.125 1.333 1.00 0.23 C ATOM 0 H LEU A 58 -16.404 -1.723 5.202 1.00 0.24 H new ATOM 0 HA LEU A 58 -13.626 -1.676 5.248 1.00 0.20 H new ATOM 0 HB2 LEU A 58 -14.879 -1.836 3.198 1.00 0.20 H new ATOM 0 HB3 LEU A 58 -15.684 -0.308 3.493 1.00 0.20 H new ATOM 0 HG LEU A 58 -13.621 0.923 3.145 1.00 0.19 H new ATOM 0 HD11 LEU A 58 -11.545 -0.224 2.496 1.00 0.20 H new ATOM 0 HD12 LEU A 58 -12.068 -0.683 4.134 1.00 0.20 H new ATOM 0 HD13 LEU A 58 -12.332 -1.796 2.772 1.00 0.20 H new ATOM 0 HD21 LEU A 58 -13.215 0.396 0.780 1.00 0.23 H new ATOM 0 HD22 LEU A 58 -14.066 -1.155 0.982 1.00 0.23 H new ATOM 0 HD23 LEU A 58 -14.951 0.377 1.173 1.00 0.23 H new ATOM 1582 N MET A 59 -14.950 1.343 5.521 1.00 0.21 N ATOM 1583 CA MET A 59 -14.810 2.684 6.075 1.00 0.26 C ATOM 1584 C MET A 59 -14.270 2.678 7.503 1.00 0.27 C ATOM 1585 O MET A 59 -13.324 3.396 7.822 1.00 0.33 O ATOM 1586 CB MET A 59 -16.176 3.370 6.072 1.00 0.36 C ATOM 1587 CG MET A 59 -16.090 4.847 5.797 1.00 0.34 C ATOM 1588 SD MET A 59 -15.478 5.163 4.139 1.00 0.72 S ATOM 1589 CE MET A 59 -14.813 6.798 4.357 1.00 0.32 C ATOM 0 H MET A 59 -15.803 1.218 4.976 1.00 0.21 H new ATOM 0 HA MET A 59 -14.094 3.219 5.452 1.00 0.26 H new ATOM 0 HB2 MET A 59 -16.810 2.902 5.319 1.00 0.36 H new ATOM 0 HB3 MET A 59 -16.658 3.213 7.037 1.00 0.36 H new ATOM 0 HG2 MET A 59 -17.074 5.300 5.917 1.00 0.34 H new ATOM 0 HG3 MET A 59 -15.431 5.318 6.527 1.00 0.34 H new ATOM 0 HE1 MET A 59 -14.110 7.015 3.553 1.00 0.32 H new ATOM 0 HE2 MET A 59 -15.624 7.526 4.336 1.00 0.32 H new ATOM 0 HE3 MET A 59 -14.297 6.856 5.316 1.00 0.32 H new ATOM 1599 N SER A 60 -14.881 1.867 8.352 1.00 0.28 N ATOM 1600 CA SER A 60 -14.555 1.851 9.772 1.00 0.35 C ATOM 1601 C SER A 60 -13.174 1.253 10.035 1.00 0.32 C ATOM 1602 O SER A 60 -12.438 1.743 10.887 1.00 0.36 O ATOM 1603 CB SER A 60 -15.598 1.046 10.526 1.00 0.41 C ATOM 1604 OG SER A 60 -15.500 1.254 11.925 1.00 0.64 O ATOM 0 H SER A 60 -15.610 1.207 8.082 1.00 0.28 H new ATOM 0 HA SER A 60 -14.547 2.884 10.119 1.00 0.35 H new ATOM 0 HB2 SER A 60 -16.594 1.327 10.184 1.00 0.41 H new ATOM 0 HB3 SER A 60 -15.472 -0.014 10.304 1.00 0.41 H new ATOM 0 HG SER A 60 -16.185 0.724 12.383 1.00 0.64 H new ATOM 1610 N ASN A 61 -12.835 0.181 9.327 1.00 0.30 N ATOM 1611 CA ASN A 61 -11.533 -0.457 9.498 1.00 0.31 C ATOM 1612 C ASN A 61 -10.461 0.406 8.877 1.00 0.31 C ATOM 1613 O ASN A 61 -9.297 0.381 9.279 1.00 0.39 O ATOM 1614 CB ASN A 61 -11.496 -1.835 8.839 1.00 0.34 C ATOM 1615 CG ASN A 61 -12.267 -2.888 9.603 1.00 0.43 C ATOM 1616 OD1 ASN A 61 -12.489 -2.765 10.805 1.00 0.95 O ATOM 1617 ND2 ASN A 61 -12.662 -3.945 8.912 1.00 0.57 N ATOM 0 H ASN A 61 -13.438 -0.262 8.634 1.00 0.30 H new ATOM 0 HA ASN A 61 -11.357 -0.576 10.567 1.00 0.31 H new ATOM 0 HB2 ASN A 61 -11.903 -1.758 7.831 1.00 0.34 H new ATOM 0 HB3 ASN A 61 -10.459 -2.155 8.741 1.00 0.34 H new ATOM 0 HD21 ASN A 61 -13.171 -4.697 9.377 1.00 0.57 H new ATOM 0 HD22 ASN A 61 -12.457 -4.008 7.915 1.00 0.57 H new ATOM 1624 N LEU A 62 -10.886 1.163 7.887 1.00 0.30 N ATOM 1625 CA LEU A 62 -9.994 2.011 7.124 1.00 0.33 C ATOM 1626 C LEU A 62 -9.594 3.225 7.935 1.00 0.33 C ATOM 1627 O LEU A 62 -8.409 3.472 8.154 1.00 0.38 O ATOM 1628 CB LEU A 62 -10.677 2.453 5.835 1.00 0.37 C ATOM 1629 CG LEU A 62 -9.785 2.407 4.610 1.00 0.24 C ATOM 1630 CD1 LEU A 62 -9.150 1.038 4.502 1.00 0.52 C ATOM 1631 CD2 LEU A 62 -10.581 2.725 3.355 1.00 0.28 C ATOM 0 H LEU A 62 -11.860 1.208 7.588 1.00 0.30 H new ATOM 0 HA LEU A 62 -9.096 1.443 6.880 1.00 0.33 H new ATOM 0 HB2 LEU A 62 -11.546 1.818 5.662 1.00 0.37 H new ATOM 0 HB3 LEU A 62 -11.046 3.470 5.963 1.00 0.37 H new ATOM 0 HG LEU A 62 -9.002 3.159 4.711 1.00 0.24 H new ATOM 0 HD11 LEU A 62 -8.508 1.003 3.622 1.00 0.52 H new ATOM 0 HD12 LEU A 62 -8.554 0.842 5.393 1.00 0.52 H new ATOM 0 HD13 LEU A 62 -9.930 0.281 4.413 1.00 0.52 H new ATOM 0 HD21 LEU A 62 -9.923 2.687 2.487 1.00 0.28 H new ATOM 0 HD22 LEU A 62 -11.381 1.994 3.236 1.00 0.28 H new ATOM 0 HD23 LEU A 62 -11.011 3.723 3.440 1.00 0.28 H new ATOM 1643 N ASP A 63 -10.592 3.975 8.373 1.00 0.37 N ATOM 1644 CA ASP A 63 -10.357 5.156 9.179 1.00 0.43 C ATOM 1645 C ASP A 63 -9.883 4.730 10.559 1.00 0.38 C ATOM 1646 O ASP A 63 -10.691 4.368 11.416 1.00 0.43 O ATOM 1647 CB ASP A 63 -11.635 5.988 9.295 1.00 0.56 C ATOM 1648 CG ASP A 63 -11.371 7.421 9.718 1.00 0.85 C ATOM 1649 OD1 ASP A 63 -10.652 7.636 10.713 1.00 1.35 O ATOM 1650 OD2 ASP A 63 -11.906 8.337 9.068 1.00 1.56 O ATOM 0 H ASP A 63 -11.575 3.784 8.182 1.00 0.37 H new ATOM 0 HA ASP A 63 -9.593 5.770 8.703 1.00 0.43 H new ATOM 0 HB2 ASP A 63 -12.151 5.987 8.335 1.00 0.56 H new ATOM 0 HB3 ASP A 63 -12.304 5.519 10.017 1.00 0.56 H new ATOM 1655 N SER A 64 -8.576 4.764 10.762 1.00 0.37 N ATOM 1656 CA SER A 64 -7.970 4.288 11.996 1.00 0.41 C ATOM 1657 C SER A 64 -8.443 5.113 13.187 1.00 0.52 C ATOM 1658 O SER A 64 -8.456 4.647 14.329 1.00 0.64 O ATOM 1659 CB SER A 64 -6.449 4.354 11.877 1.00 0.45 C ATOM 1660 OG SER A 64 -6.006 5.686 11.689 1.00 0.58 O ATOM 0 H SER A 64 -7.907 5.121 10.079 1.00 0.37 H new ATOM 0 HA SER A 64 -8.275 3.254 12.160 1.00 0.41 H new ATOM 0 HB2 SER A 64 -5.993 3.940 12.777 1.00 0.45 H new ATOM 0 HB3 SER A 64 -6.120 3.737 11.040 1.00 0.45 H new ATOM 0 HG SER A 64 -5.955 5.882 10.730 1.00 0.58 H new ATOM 1666 N ASN A 65 -8.854 6.332 12.899 1.00 0.60 N ATOM 1667 CA ASN A 65 -9.289 7.266 13.917 1.00 0.83 C ATOM 1668 C ASN A 65 -10.811 7.223 14.075 1.00 0.89 C ATOM 1669 O ASN A 65 -11.360 7.731 15.055 1.00 1.10 O ATOM 1670 CB ASN A 65 -8.796 8.662 13.536 1.00 0.95 C ATOM 1671 CG ASN A 65 -9.414 9.772 14.363 1.00 0.99 C ATOM 1672 OD1 ASN A 65 -10.481 10.367 13.856 1.00 1.52 O flip ATOM 1673 ND2 ASN A 65 -8.926 10.099 15.442 1.00 1.44 N flip ATOM 0 H ASN A 65 -8.896 6.703 11.950 1.00 0.60 H new ATOM 0 HA ASN A 65 -8.866 6.992 14.884 1.00 0.83 H new ATOM 0 HB2 ASN A 65 -7.712 8.698 13.647 1.00 0.95 H new ATOM 0 HB3 ASN A 65 -9.015 8.840 12.483 1.00 0.95 H new ATOM 0 HD21 ASN A 65 -8.102 9.614 15.797 1.00 1.44 H new ATOM 0 HD22 ASN A 65 -9.345 10.856 15.983 1.00 1.44 H new ATOM 1680 N ARG A 66 -11.474 6.591 13.109 1.00 0.79 N ATOM 1681 CA ARG A 66 -12.930 6.430 13.109 1.00 0.98 C ATOM 1682 C ARG A 66 -13.643 7.767 12.929 1.00 1.05 C ATOM 1683 O ARG A 66 -14.585 8.085 13.656 1.00 1.34 O ATOM 1684 CB ARG A 66 -13.420 5.734 14.386 1.00 1.26 C ATOM 1685 CG ARG A 66 -13.373 4.215 14.320 1.00 1.46 C ATOM 1686 CD ARG A 66 -11.953 3.681 14.244 1.00 1.25 C ATOM 1687 NE ARG A 66 -11.933 2.227 14.087 1.00 1.91 N ATOM 1688 CZ ARG A 66 -10.824 1.506 13.934 1.00 2.60 C ATOM 1689 NH1 ARG A 66 -9.629 2.089 14.001 1.00 2.85 N ATOM 1690 NH2 ARG A 66 -10.911 0.198 13.731 1.00 3.45 N ATOM 0 H ARG A 66 -11.016 6.173 12.299 1.00 0.79 H new ATOM 0 HA ARG A 66 -13.177 5.795 12.258 1.00 0.98 H new ATOM 0 HB2 ARG A 66 -12.813 6.070 15.226 1.00 1.26 H new ATOM 0 HB3 ARG A 66 -14.444 6.047 14.588 1.00 1.26 H new ATOM 0 HG2 ARG A 66 -13.867 3.801 15.199 1.00 1.46 H new ATOM 0 HG3 ARG A 66 -13.933 3.875 13.449 1.00 1.46 H new ATOM 0 HD2 ARG A 66 -11.433 4.145 13.406 1.00 1.25 H new ATOM 0 HD3 ARG A 66 -11.411 3.958 15.148 1.00 1.25 H new ATOM 0 HE ARG A 66 -12.826 1.734 14.095 1.00 1.91 H new ATOM 0 HH11 ARG A 66 -9.560 3.092 14.170 1.00 2.85 H new ATOM 0 HH12 ARG A 66 -8.783 1.532 13.883 1.00 2.85 H new ATOM 0 HH21 ARG A 66 -11.825 -0.252 13.692 1.00 3.45 H new ATOM 0 HH22 ARG A 66 -10.064 -0.357 13.613 1.00 3.45 H new ATOM 1704 N ASP A 67 -13.198 8.542 11.950 1.00 0.86 N ATOM 1705 CA ASP A 67 -13.864 9.795 11.614 1.00 1.00 C ATOM 1706 C ASP A 67 -14.846 9.559 10.470 1.00 0.88 C ATOM 1707 O ASP A 67 -15.718 10.387 10.194 1.00 0.94 O ATOM 1708 CB ASP A 67 -12.838 10.861 11.225 1.00 1.13 C ATOM 1709 CG ASP A 67 -13.456 12.234 11.056 1.00 1.57 C ATOM 1710 OD1 ASP A 67 -13.676 12.922 12.076 1.00 2.02 O ATOM 1711 OD2 ASP A 67 -13.711 12.643 9.907 1.00 2.08 O ATOM 0 H ASP A 67 -12.382 8.328 11.376 1.00 0.86 H new ATOM 0 HA ASP A 67 -14.410 10.153 12.487 1.00 1.00 H new ATOM 0 HB2 ASP A 67 -12.062 10.908 11.989 1.00 1.13 H new ATOM 0 HB3 ASP A 67 -12.352 10.569 10.294 1.00 1.13 H new ATOM 1716 N ASN A 68 -14.681 8.406 9.815 1.00 0.77 N ATOM 1717 CA ASN A 68 -15.544 7.971 8.713 1.00 0.74 C ATOM 1718 C ASN A 68 -15.291 8.810 7.467 1.00 0.65 C ATOM 1719 O ASN A 68 -16.123 8.875 6.560 1.00 0.66 O ATOM 1720 CB ASN A 68 -17.027 8.002 9.110 1.00 0.92 C ATOM 1721 CG ASN A 68 -17.356 6.984 10.189 1.00 1.13 C ATOM 1722 OD1 ASN A 68 -17.280 7.275 11.383 1.00 1.54 O ATOM 1723 ND2 ASN A 68 -17.735 5.782 9.781 1.00 1.75 N ATOM 0 H ASN A 68 -13.938 7.743 10.037 1.00 0.77 H new ATOM 0 HA ASN A 68 -15.292 6.936 8.483 1.00 0.74 H new ATOM 0 HB2 ASN A 68 -17.285 9.000 9.464 1.00 0.92 H new ATOM 0 HB3 ASN A 68 -17.641 7.807 8.230 1.00 0.92 H new ATOM 0 HD21 ASN A 68 -17.975 5.064 10.464 1.00 1.75 H new ATOM 0 HD22 ASN A 68 -17.787 5.575 8.784 1.00 1.75 H new ATOM 1730 N GLU A 69 -14.119 9.421 7.428 1.00 0.64 N ATOM 1731 CA GLU A 69 -13.652 10.164 6.270 1.00 0.63 C ATOM 1732 C GLU A 69 -12.173 9.872 6.077 1.00 0.54 C ATOM 1733 O GLU A 69 -11.324 10.398 6.797 1.00 0.65 O ATOM 1734 CB GLU A 69 -13.890 11.668 6.430 1.00 0.82 C ATOM 1735 CG GLU A 69 -15.355 12.064 6.343 1.00 0.95 C ATOM 1736 CD GLU A 69 -15.565 13.559 6.435 1.00 1.13 C ATOM 1737 OE1 GLU A 69 -15.240 14.272 5.462 1.00 1.59 O ATOM 1738 OE2 GLU A 69 -16.060 14.033 7.479 1.00 1.65 O ATOM 0 H GLU A 69 -13.459 9.415 8.206 1.00 0.64 H new ATOM 0 HA GLU A 69 -14.215 9.848 5.392 1.00 0.63 H new ATOM 0 HB2 GLU A 69 -13.491 11.990 7.392 1.00 0.82 H new ATOM 0 HB3 GLU A 69 -13.332 12.200 5.659 1.00 0.82 H new ATOM 0 HG2 GLU A 69 -15.769 11.701 5.403 1.00 0.95 H new ATOM 0 HG3 GLU A 69 -15.907 11.574 7.145 1.00 0.95 H new ATOM 1745 N VAL A 70 -11.878 9.026 5.107 1.00 0.40 N ATOM 1746 CA VAL A 70 -10.548 8.468 4.953 1.00 0.31 C ATOM 1747 C VAL A 70 -9.535 9.509 4.510 1.00 0.33 C ATOM 1748 O VAL A 70 -9.639 10.089 3.425 1.00 0.39 O ATOM 1749 CB VAL A 70 -10.554 7.286 3.962 1.00 0.28 C ATOM 1750 CG1 VAL A 70 -9.149 6.840 3.603 1.00 0.32 C ATOM 1751 CG2 VAL A 70 -11.337 6.128 4.544 1.00 0.29 C ATOM 0 H VAL A 70 -12.549 8.708 4.408 1.00 0.40 H new ATOM 0 HA VAL A 70 -10.247 8.107 5.936 1.00 0.31 H new ATOM 0 HB VAL A 70 -11.034 7.626 3.044 1.00 0.28 H new ATOM 0 HG11 VAL A 70 -9.200 6.006 2.903 1.00 0.32 H new ATOM 0 HG12 VAL A 70 -8.611 7.668 3.142 1.00 0.32 H new ATOM 0 HG13 VAL A 70 -8.625 6.525 4.506 1.00 0.32 H new ATOM 0 HG21 VAL A 70 -11.337 5.297 3.838 1.00 0.29 H new ATOM 0 HG22 VAL A 70 -10.876 5.810 5.479 1.00 0.29 H new ATOM 0 HG23 VAL A 70 -12.363 6.442 4.734 1.00 0.29 H new ATOM 1761 N ASP A 71 -8.578 9.754 5.389 1.00 0.36 N ATOM 1762 CA ASP A 71 -7.404 10.544 5.067 1.00 0.40 C ATOM 1763 C ASP A 71 -6.478 9.685 4.218 1.00 0.32 C ATOM 1764 O ASP A 71 -6.661 8.471 4.150 1.00 0.29 O ATOM 1765 CB ASP A 71 -6.701 10.967 6.360 1.00 0.49 C ATOM 1766 CG ASP A 71 -5.638 12.024 6.146 1.00 0.61 C ATOM 1767 OD1 ASP A 71 -4.509 11.677 5.750 1.00 1.22 O ATOM 1768 OD2 ASP A 71 -5.926 13.209 6.401 1.00 1.32 O ATOM 0 H ASP A 71 -8.594 9.409 6.349 1.00 0.36 H new ATOM 0 HA ASP A 71 -7.683 11.443 4.518 1.00 0.40 H new ATOM 0 HB2 ASP A 71 -7.444 11.346 7.062 1.00 0.49 H new ATOM 0 HB3 ASP A 71 -6.245 10.091 6.821 1.00 0.49 H new ATOM 1773 N PHE A 72 -5.481 10.281 3.589 1.00 0.36 N ATOM 1774 CA PHE A 72 -4.604 9.525 2.711 1.00 0.36 C ATOM 1775 C PHE A 72 -3.908 8.388 3.457 1.00 0.30 C ATOM 1776 O PHE A 72 -3.643 7.330 2.888 1.00 0.39 O ATOM 1777 CB PHE A 72 -3.558 10.414 2.060 1.00 0.51 C ATOM 1778 CG PHE A 72 -2.728 9.633 1.099 1.00 0.58 C ATOM 1779 CD1 PHE A 72 -3.335 8.928 0.073 1.00 1.38 C ATOM 1780 CD2 PHE A 72 -1.362 9.559 1.237 1.00 1.26 C ATOM 1781 CE1 PHE A 72 -2.591 8.172 -0.798 1.00 1.46 C ATOM 1782 CE2 PHE A 72 -0.618 8.802 0.372 1.00 1.29 C ATOM 1783 CZ PHE A 72 -1.221 8.110 -0.638 1.00 0.78 C ATOM 0 H PHE A 72 -5.259 11.274 3.667 1.00 0.36 H new ATOM 0 HA PHE A 72 -5.238 9.101 1.932 1.00 0.36 H new ATOM 0 HB2 PHE A 72 -4.046 11.238 1.540 1.00 0.51 H new ATOM 0 HB3 PHE A 72 -2.919 10.854 2.826 1.00 0.51 H new ATOM 0 HD1 PHE A 72 -4.408 8.974 -0.043 1.00 1.38 H new ATOM 0 HD2 PHE A 72 -0.873 10.101 2.033 1.00 1.26 H new ATOM 0 HE1 PHE A 72 -3.072 7.631 -1.600 1.00 1.46 H new ATOM 0 HE2 PHE A 72 0.454 8.752 0.490 1.00 1.29 H new ATOM 0 HZ PHE A 72 -0.626 7.513 -1.313 1.00 0.78 H new ATOM 1793 N GLN A 73 -3.630 8.592 4.733 1.00 0.30 N ATOM 1794 CA GLN A 73 -2.946 7.576 5.520 1.00 0.41 C ATOM 1795 C GLN A 73 -3.818 6.339 5.703 1.00 0.38 C ATOM 1796 O GLN A 73 -3.308 5.218 5.775 1.00 0.44 O ATOM 1797 CB GLN A 73 -2.517 8.123 6.876 1.00 0.61 C ATOM 1798 CG GLN A 73 -1.525 9.266 6.771 1.00 0.85 C ATOM 1799 CD GLN A 73 -0.732 9.475 8.044 1.00 0.83 C ATOM 1800 OE1 GLN A 73 -0.332 10.591 8.363 1.00 1.20 O ATOM 1801 NE2 GLN A 73 -0.478 8.397 8.770 1.00 1.48 N ATOM 0 H GLN A 73 -3.864 9.443 5.244 1.00 0.30 H new ATOM 0 HA GLN A 73 -2.052 7.287 4.968 1.00 0.41 H new ATOM 0 HB2 GLN A 73 -3.399 8.464 7.419 1.00 0.61 H new ATOM 0 HB3 GLN A 73 -2.074 7.318 7.462 1.00 0.61 H new ATOM 0 HG2 GLN A 73 -0.837 9.070 5.948 1.00 0.85 H new ATOM 0 HG3 GLN A 73 -2.060 10.184 6.527 1.00 0.85 H new ATOM 0 HE21 GLN A 73 -0.828 7.487 8.471 1.00 1.48 H new ATOM 0 HE22 GLN A 73 0.068 8.477 9.628 1.00 1.48 H new ATOM 1810 N GLU A 74 -5.132 6.536 5.749 1.00 0.34 N ATOM 1811 CA GLU A 74 -6.058 5.425 5.898 1.00 0.37 C ATOM 1812 C GLU A 74 -6.220 4.753 4.544 1.00 0.32 C ATOM 1813 O GLU A 74 -6.633 3.601 4.429 1.00 0.36 O ATOM 1814 CB GLU A 74 -7.423 5.914 6.401 1.00 0.44 C ATOM 1815 CG GLU A 74 -7.367 7.153 7.286 1.00 0.52 C ATOM 1816 CD GLU A 74 -6.469 6.991 8.489 1.00 0.58 C ATOM 1817 OE1 GLU A 74 -6.774 6.155 9.347 1.00 1.16 O ATOM 1818 OE2 GLU A 74 -5.453 7.714 8.577 1.00 1.29 O ATOM 0 H GLU A 74 -5.576 7.452 5.685 1.00 0.34 H new ATOM 0 HA GLU A 74 -5.663 4.720 6.630 1.00 0.37 H new ATOM 0 HB2 GLU A 74 -8.057 6.127 5.541 1.00 0.44 H new ATOM 0 HB3 GLU A 74 -7.900 5.108 6.958 1.00 0.44 H new ATOM 0 HG2 GLU A 74 -7.018 7.998 6.693 1.00 0.52 H new ATOM 0 HG3 GLU A 74 -8.375 7.395 7.624 1.00 0.52 H new ATOM 1825 N TYR A 75 -5.858 5.505 3.520 1.00 0.26 N ATOM 1826 CA TYR A 75 -5.976 5.076 2.143 1.00 0.25 C ATOM 1827 C TYR A 75 -4.778 4.198 1.753 1.00 0.24 C ATOM 1828 O TYR A 75 -4.911 3.250 0.977 1.00 0.28 O ATOM 1829 CB TYR A 75 -6.064 6.327 1.265 1.00 0.25 C ATOM 1830 CG TYR A 75 -6.436 6.078 -0.171 1.00 0.26 C ATOM 1831 CD1 TYR A 75 -5.578 5.394 -1.021 1.00 1.17 C ATOM 1832 CD2 TYR A 75 -7.644 6.540 -0.679 1.00 1.27 C ATOM 1833 CE1 TYR A 75 -5.904 5.171 -2.339 1.00 1.17 C ATOM 1834 CE2 TYR A 75 -7.977 6.323 -2.007 1.00 1.30 C ATOM 1835 CZ TYR A 75 -7.099 5.636 -2.829 1.00 0.38 C ATOM 1836 OH TYR A 75 -7.410 5.424 -4.150 1.00 0.47 O ATOM 0 H TYR A 75 -5.469 6.442 3.626 1.00 0.26 H new ATOM 0 HA TYR A 75 -6.873 4.472 2.005 1.00 0.25 H new ATOM 0 HB2 TYR A 75 -6.797 7.006 1.701 1.00 0.25 H new ATOM 0 HB3 TYR A 75 -5.101 6.838 1.291 1.00 0.25 H new ATOM 0 HD1 TYR A 75 -4.635 5.029 -0.640 1.00 1.17 H new ATOM 0 HD2 TYR A 75 -8.328 7.072 -0.035 1.00 1.27 H new ATOM 0 HE1 TYR A 75 -5.224 4.634 -2.984 1.00 1.17 H new ATOM 0 HE2 TYR A 75 -8.915 6.687 -2.398 1.00 1.30 H new ATOM 0 HH TYR A 75 -6.679 4.936 -4.584 1.00 0.47 H new ATOM 1846 N CYS A 76 -3.610 4.515 2.292 1.00 0.22 N ATOM 1847 CA CYS A 76 -2.422 3.695 2.076 1.00 0.21 C ATOM 1848 C CYS A 76 -2.608 2.319 2.680 1.00 0.15 C ATOM 1849 O CYS A 76 -2.373 1.301 2.025 1.00 0.17 O ATOM 1850 CB CYS A 76 -1.199 4.367 2.684 1.00 0.27 C ATOM 1851 SG CYS A 76 -0.912 6.044 2.095 1.00 1.65 S ATOM 0 H CYS A 76 -3.457 5.333 2.882 1.00 0.22 H new ATOM 0 HA CYS A 76 -2.271 3.588 1.002 1.00 0.21 H new ATOM 0 HB2 CYS A 76 -1.311 4.388 3.768 1.00 0.27 H new ATOM 0 HB3 CYS A 76 -0.319 3.761 2.466 1.00 0.27 H new ATOM 0 HG CYS A 76 -1.953 6.778 2.352 1.00 1.65 H new ATOM 1857 N VAL A 77 -3.050 2.289 3.924 1.00 0.16 N ATOM 1858 CA VAL A 77 -3.266 1.034 4.610 1.00 0.17 C ATOM 1859 C VAL A 77 -4.477 0.315 4.046 1.00 0.17 C ATOM 1860 O VAL A 77 -4.648 -0.876 4.268 1.00 0.19 O ATOM 1861 CB VAL A 77 -3.404 1.231 6.126 1.00 0.20 C ATOM 1862 CG1 VAL A 77 -2.092 1.742 6.691 1.00 0.23 C ATOM 1863 CG2 VAL A 77 -4.538 2.186 6.459 1.00 0.19 C ATOM 0 H VAL A 77 -3.265 3.119 4.477 1.00 0.16 H new ATOM 0 HA VAL A 77 -2.387 0.413 4.441 1.00 0.17 H new ATOM 0 HB VAL A 77 -3.643 0.270 6.581 1.00 0.20 H new ATOM 0 HG11 VAL A 77 -2.189 1.882 7.768 1.00 0.23 H new ATOM 0 HG12 VAL A 77 -1.302 1.018 6.489 1.00 0.23 H new ATOM 0 HG13 VAL A 77 -1.840 2.693 6.223 1.00 0.23 H new ATOM 0 HG21 VAL A 77 -4.609 2.304 7.540 1.00 0.19 H new ATOM 0 HG22 VAL A 77 -4.344 3.156 6.000 1.00 0.19 H new ATOM 0 HG23 VAL A 77 -5.476 1.785 6.075 1.00 0.19 H new ATOM 1873 N PHE A 78 -5.311 1.046 3.312 1.00 0.20 N ATOM 1874 CA PHE A 78 -6.367 0.443 2.528 1.00 0.22 C ATOM 1875 C PHE A 78 -5.754 -0.570 1.582 1.00 0.19 C ATOM 1876 O PHE A 78 -5.884 -1.771 1.781 1.00 0.18 O ATOM 1877 CB PHE A 78 -7.120 1.539 1.750 1.00 0.30 C ATOM 1878 CG PHE A 78 -8.188 1.067 0.814 1.00 0.22 C ATOM 1879 CD1 PHE A 78 -9.213 0.239 1.233 1.00 1.21 C ATOM 1880 CD2 PHE A 78 -8.162 1.482 -0.503 1.00 1.19 C ATOM 1881 CE1 PHE A 78 -10.191 -0.169 0.349 1.00 1.20 C ATOM 1882 CE2 PHE A 78 -9.131 1.084 -1.391 1.00 1.21 C ATOM 1883 CZ PHE A 78 -10.149 0.257 -0.966 1.00 0.22 C ATOM 0 H PHE A 78 -5.269 2.063 3.248 1.00 0.20 H new ATOM 0 HA PHE A 78 -7.080 -0.065 3.177 1.00 0.22 H new ATOM 0 HB2 PHE A 78 -7.572 2.222 2.470 1.00 0.30 H new ATOM 0 HB3 PHE A 78 -6.393 2.115 1.178 1.00 0.30 H new ATOM 0 HD1 PHE A 78 -9.249 -0.091 2.261 1.00 1.21 H new ATOM 0 HD2 PHE A 78 -7.367 2.130 -0.840 1.00 1.19 H new ATOM 0 HE1 PHE A 78 -10.986 -0.819 0.683 1.00 1.20 H new ATOM 0 HE2 PHE A 78 -9.096 1.417 -2.418 1.00 1.21 H new ATOM 0 HZ PHE A 78 -10.914 -0.058 -1.660 1.00 0.22 H new ATOM 1893 N LEU A 79 -5.009 -0.068 0.614 1.00 0.20 N ATOM 1894 CA LEU A 79 -4.486 -0.893 -0.460 1.00 0.19 C ATOM 1895 C LEU A 79 -3.466 -1.901 0.011 1.00 0.16 C ATOM 1896 O LEU A 79 -3.514 -3.062 -0.373 1.00 0.18 O ATOM 1897 CB LEU A 79 -3.896 -0.014 -1.545 1.00 0.22 C ATOM 1898 CG LEU A 79 -4.947 0.764 -2.305 1.00 0.15 C ATOM 1899 CD1 LEU A 79 -4.333 1.449 -3.513 1.00 0.16 C ATOM 1900 CD2 LEU A 79 -6.065 -0.186 -2.698 1.00 0.16 C ATOM 0 H LEU A 79 -4.751 0.917 0.550 1.00 0.20 H new ATOM 0 HA LEU A 79 -5.324 -1.464 -0.860 1.00 0.19 H new ATOM 0 HB2 LEU A 79 -3.188 0.683 -1.097 1.00 0.22 H new ATOM 0 HB3 LEU A 79 -3.334 -0.634 -2.243 1.00 0.22 H new ATOM 0 HG LEU A 79 -5.362 1.551 -1.675 1.00 0.15 H new ATOM 0 HD11 LEU A 79 -5.104 2.004 -4.048 1.00 0.16 H new ATOM 0 HD12 LEU A 79 -3.553 2.136 -3.184 1.00 0.16 H new ATOM 0 HD13 LEU A 79 -3.900 0.699 -4.175 1.00 0.16 H new ATOM 0 HD21 LEU A 79 -6.831 0.361 -3.247 1.00 0.16 H new ATOM 0 HD22 LEU A 79 -5.663 -0.979 -3.328 1.00 0.16 H new ATOM 0 HD23 LEU A 79 -6.504 -0.622 -1.801 1.00 0.16 H new ATOM 1912 N SER A 80 -2.554 -1.484 0.845 1.00 0.15 N ATOM 1913 CA SER A 80 -1.519 -2.382 1.298 1.00 0.15 C ATOM 1914 C SER A 80 -2.118 -3.549 2.081 1.00 0.15 C ATOM 1915 O SER A 80 -1.570 -4.648 2.105 1.00 0.18 O ATOM 1916 CB SER A 80 -0.512 -1.610 2.117 1.00 0.17 C ATOM 1917 OG SER A 80 0.088 -0.601 1.332 1.00 0.23 O ATOM 0 H SER A 80 -2.503 -0.538 1.224 1.00 0.15 H new ATOM 0 HA SER A 80 -1.005 -2.811 0.438 1.00 0.15 H new ATOM 0 HB2 SER A 80 -1.002 -1.164 2.982 1.00 0.17 H new ATOM 0 HB3 SER A 80 0.253 -2.287 2.498 1.00 0.17 H new ATOM 0 HG SER A 80 1.062 -0.709 1.349 1.00 0.23 H new ATOM 1923 N CYS A 81 -3.249 -3.310 2.717 1.00 0.14 N ATOM 1924 CA CYS A 81 -3.974 -4.373 3.379 1.00 0.15 C ATOM 1925 C CYS A 81 -4.834 -5.158 2.397 1.00 0.14 C ATOM 1926 O CYS A 81 -5.243 -6.283 2.682 1.00 0.16 O ATOM 1927 CB CYS A 81 -4.793 -3.816 4.525 1.00 0.17 C ATOM 1928 SG CYS A 81 -3.764 -3.242 5.888 1.00 0.22 S ATOM 0 H CYS A 81 -3.684 -2.390 2.788 1.00 0.14 H new ATOM 0 HA CYS A 81 -3.251 -5.076 3.793 1.00 0.15 H new ATOM 0 HB2 CYS A 81 -5.405 -2.990 4.163 1.00 0.17 H new ATOM 0 HB3 CYS A 81 -5.476 -4.584 4.887 1.00 0.17 H new ATOM 0 HG CYS A 81 -3.586 -1.958 5.786 1.00 0.22 H new ATOM 1934 N ILE A 82 -5.098 -4.580 1.231 1.00 0.13 N ATOM 1935 CA ILE A 82 -5.801 -5.312 0.191 1.00 0.14 C ATOM 1936 C ILE A 82 -4.796 -6.172 -0.574 1.00 0.17 C ATOM 1937 O ILE A 82 -5.175 -7.104 -1.270 1.00 0.21 O ATOM 1938 CB ILE A 82 -6.588 -4.406 -0.786 1.00 0.15 C ATOM 1939 CG1 ILE A 82 -7.351 -3.328 -0.036 1.00 0.15 C ATOM 1940 CG2 ILE A 82 -7.591 -5.232 -1.572 1.00 0.16 C ATOM 1941 CD1 ILE A 82 -8.184 -2.457 -0.941 1.00 0.18 C ATOM 0 H ILE A 82 -4.840 -3.624 0.987 1.00 0.13 H new ATOM 0 HA ILE A 82 -6.549 -5.934 0.683 1.00 0.14 H new ATOM 0 HB ILE A 82 -5.865 -3.942 -1.457 1.00 0.15 H new ATOM 0 HG12 ILE A 82 -7.999 -3.798 0.704 1.00 0.15 H new ATOM 0 HG13 ILE A 82 -6.644 -2.703 0.510 1.00 0.15 H new ATOM 0 HG21 ILE A 82 -8.139 -4.584 -2.256 1.00 0.16 H new ATOM 0 HG22 ILE A 82 -7.065 -5.998 -2.141 1.00 0.16 H new ATOM 0 HG23 ILE A 82 -8.290 -5.707 -0.884 1.00 0.16 H new ATOM 0 HD11 ILE A 82 -8.705 -1.707 -0.346 1.00 0.18 H new ATOM 0 HD12 ILE A 82 -7.537 -1.961 -1.665 1.00 0.18 H new ATOM 0 HD13 ILE A 82 -8.913 -3.072 -1.468 1.00 0.18 H new ATOM 1953 N ALA A 83 -3.505 -5.842 -0.463 1.00 0.18 N ATOM 1954 CA ALA A 83 -2.454 -6.783 -0.829 1.00 0.23 C ATOM 1955 C ALA A 83 -2.633 -8.060 -0.033 1.00 0.20 C ATOM 1956 O ALA A 83 -2.718 -9.155 -0.588 1.00 0.21 O ATOM 1957 CB ALA A 83 -1.083 -6.207 -0.539 1.00 0.30 C ATOM 0 H ALA A 83 -3.170 -4.939 -0.126 1.00 0.18 H new ATOM 0 HA ALA A 83 -2.526 -6.985 -1.898 1.00 0.23 H new ATOM 0 HB1 ALA A 83 -0.318 -6.930 -0.821 1.00 0.30 H new ATOM 0 HB2 ALA A 83 -0.945 -5.290 -1.112 1.00 0.30 H new ATOM 0 HB3 ALA A 83 -0.999 -5.986 0.525 1.00 0.30 H new ATOM 1963 N MET A 84 -2.701 -7.897 1.283 1.00 0.22 N ATOM 1964 CA MET A 84 -2.973 -9.012 2.181 1.00 0.25 C ATOM 1965 C MET A 84 -4.307 -9.659 1.839 1.00 0.24 C ATOM 1966 O MET A 84 -4.451 -10.880 1.912 1.00 0.28 O ATOM 1967 CB MET A 84 -2.952 -8.562 3.641 1.00 0.30 C ATOM 1968 CG MET A 84 -1.552 -8.506 4.233 1.00 0.34 C ATOM 1969 SD MET A 84 -1.515 -7.738 5.860 1.00 0.36 S ATOM 1970 CE MET A 84 -1.981 -6.070 5.419 1.00 0.20 C ATOM 0 H MET A 84 -2.571 -7.001 1.753 1.00 0.22 H new ATOM 0 HA MET A 84 -2.184 -9.752 2.047 1.00 0.25 H new ATOM 0 HB2 MET A 84 -3.411 -7.576 3.717 1.00 0.30 H new ATOM 0 HB3 MET A 84 -3.562 -9.244 4.233 1.00 0.30 H new ATOM 0 HG2 MET A 84 -1.152 -9.517 4.304 1.00 0.34 H new ATOM 0 HG3 MET A 84 -0.899 -7.951 3.559 1.00 0.34 H new ATOM 0 HE1 MET A 84 -1.658 -5.383 6.201 1.00 0.20 H new ATOM 0 HE2 MET A 84 -1.506 -5.796 4.477 1.00 0.20 H new ATOM 0 HE3 MET A 84 -3.064 -6.012 5.309 1.00 0.20 H new ATOM 1980 N MET A 85 -5.278 -8.837 1.452 1.00 0.25 N ATOM 1981 CA MET A 85 -6.546 -9.348 0.948 1.00 0.36 C ATOM 1982 C MET A 85 -6.298 -10.218 -0.271 1.00 0.33 C ATOM 1983 O MET A 85 -6.745 -11.350 -0.323 1.00 0.43 O ATOM 1984 CB MET A 85 -7.496 -8.222 0.537 1.00 0.62 C ATOM 1985 CG MET A 85 -8.883 -8.736 0.177 1.00 0.77 C ATOM 1986 SD MET A 85 -9.780 -7.634 -0.923 1.00 0.67 S ATOM 1987 CE MET A 85 -10.292 -6.381 0.240 1.00 0.30 C ATOM 0 H MET A 85 -5.211 -7.820 1.478 1.00 0.25 H new ATOM 0 HA MET A 85 -7.005 -9.919 1.755 1.00 0.36 H new ATOM 0 HB2 MET A 85 -7.578 -7.504 1.353 1.00 0.62 H new ATOM 0 HB3 MET A 85 -7.076 -7.689 -0.316 1.00 0.62 H new ATOM 0 HG2 MET A 85 -8.790 -9.714 -0.295 1.00 0.77 H new ATOM 0 HG3 MET A 85 -9.460 -8.876 1.091 1.00 0.77 H new ATOM 0 HE1 MET A 85 -10.953 -5.671 -0.257 1.00 0.30 H new ATOM 0 HE2 MET A 85 -10.821 -6.849 1.070 1.00 0.30 H new ATOM 0 HE3 MET A 85 -9.415 -5.856 0.619 1.00 0.30 H new ATOM 1997 N CYS A 86 -5.562 -9.672 -1.236 1.00 0.32 N ATOM 1998 CA CYS A 86 -5.334 -10.330 -2.519 1.00 0.43 C ATOM 1999 C CYS A 86 -4.566 -11.642 -2.364 1.00 0.43 C ATOM 2000 O CYS A 86 -4.538 -12.454 -3.280 1.00 0.58 O ATOM 2001 CB CYS A 86 -4.589 -9.391 -3.473 1.00 0.49 C ATOM 2002 SG CYS A 86 -4.462 -10.011 -5.168 1.00 0.57 S ATOM 0 H CYS A 86 -5.108 -8.763 -1.151 1.00 0.32 H new ATOM 0 HA CYS A 86 -6.311 -10.571 -2.938 1.00 0.43 H new ATOM 0 HB2 CYS A 86 -5.097 -8.427 -3.487 1.00 0.49 H new ATOM 0 HB3 CYS A 86 -3.585 -9.217 -3.085 1.00 0.49 H new ATOM 0 HG CYS A 86 -4.434 -11.311 -5.154 1.00 0.57 H new ATOM 2008 N ASN A 87 -3.924 -11.841 -1.220 1.00 0.36 N ATOM 2009 CA ASN A 87 -3.285 -13.122 -0.931 1.00 0.44 C ATOM 2010 C ASN A 87 -4.351 -14.185 -0.694 1.00 0.47 C ATOM 2011 O ASN A 87 -4.283 -15.290 -1.232 1.00 0.54 O ATOM 2012 CB ASN A 87 -2.374 -13.014 0.292 1.00 0.54 C ATOM 2013 CG ASN A 87 -1.652 -14.315 0.600 1.00 0.72 C ATOM 2014 OD1 ASN A 87 -0.571 -14.574 0.073 1.00 1.43 O ATOM 2015 ND2 ASN A 87 -2.233 -15.130 1.467 1.00 1.23 N ATOM 0 H ASN A 87 -3.831 -11.142 -0.483 1.00 0.36 H new ATOM 0 HA ASN A 87 -2.673 -13.405 -1.788 1.00 0.44 H new ATOM 0 HB2 ASN A 87 -1.640 -12.226 0.125 1.00 0.54 H new ATOM 0 HB3 ASN A 87 -2.967 -12.718 1.157 1.00 0.54 H new ATOM 0 HD21 ASN A 87 -1.783 -16.010 1.720 1.00 1.23 H new ATOM 0 HD22 ASN A 87 -3.130 -14.878 1.882 1.00 1.23 H new ATOM 2022 N GLU A 88 -5.341 -13.831 0.109 1.00 0.56 N ATOM 2023 CA GLU A 88 -6.475 -14.705 0.375 1.00 0.70 C ATOM 2024 C GLU A 88 -7.426 -14.706 -0.815 1.00 0.73 C ATOM 2025 O GLU A 88 -7.861 -15.751 -1.293 1.00 0.82 O ATOM 2026 CB GLU A 88 -7.212 -14.225 1.625 1.00 0.96 C ATOM 2027 CG GLU A 88 -6.409 -14.373 2.906 1.00 1.81 C ATOM 2028 CD GLU A 88 -6.029 -15.809 3.184 1.00 2.18 C ATOM 2029 OE1 GLU A 88 -6.938 -16.636 3.404 1.00 2.78 O ATOM 2030 OE2 GLU A 88 -4.818 -16.118 3.178 1.00 2.60 O ATOM 0 H GLU A 88 -5.383 -12.934 0.593 1.00 0.56 H new ATOM 0 HA GLU A 88 -6.111 -15.720 0.537 1.00 0.70 H new ATOM 0 HB2 GLU A 88 -7.482 -13.177 1.496 1.00 0.96 H new ATOM 0 HB3 GLU A 88 -8.142 -14.784 1.724 1.00 0.96 H new ATOM 0 HG2 GLU A 88 -5.505 -13.767 2.837 1.00 1.81 H new ATOM 0 HG3 GLU A 88 -6.990 -13.985 3.743 1.00 1.81 H new ATOM 2037 N PHE A 89 -7.702 -13.511 -1.308 1.00 0.78 N ATOM 2038 CA PHE A 89 -8.615 -13.297 -2.420 1.00 0.98 C ATOM 2039 C PHE A 89 -7.948 -13.660 -3.747 1.00 0.94 C ATOM 2040 O PHE A 89 -8.503 -13.423 -4.815 1.00 1.28 O ATOM 2041 CB PHE A 89 -9.086 -11.836 -2.435 1.00 1.19 C ATOM 2042 CG PHE A 89 -10.504 -11.675 -2.903 1.00 1.49 C ATOM 2043 CD1 PHE A 89 -10.803 -11.583 -4.250 1.00 2.09 C ATOM 2044 CD2 PHE A 89 -11.539 -11.627 -1.986 1.00 2.23 C ATOM 2045 CE1 PHE A 89 -12.108 -11.447 -4.675 1.00 2.74 C ATOM 2046 CE2 PHE A 89 -12.846 -11.488 -2.405 1.00 2.94 C ATOM 2047 CZ PHE A 89 -13.132 -11.398 -3.750 1.00 3.02 C ATOM 0 H PHE A 89 -7.294 -12.650 -0.943 1.00 0.78 H new ATOM 0 HA PHE A 89 -9.481 -13.946 -2.290 1.00 0.98 H new ATOM 0 HB2 PHE A 89 -8.992 -11.421 -1.432 1.00 1.19 H new ATOM 0 HB3 PHE A 89 -8.429 -11.256 -3.083 1.00 1.19 H new ATOM 0 HD1 PHE A 89 -10.006 -11.618 -4.977 1.00 2.09 H new ATOM 0 HD2 PHE A 89 -11.321 -11.699 -0.931 1.00 2.23 H new ATOM 0 HE1 PHE A 89 -12.329 -11.379 -5.730 1.00 2.74 H new ATOM 0 HE2 PHE A 89 -13.645 -11.450 -1.679 1.00 2.94 H new ATOM 0 HZ PHE A 89 -14.155 -11.289 -4.080 1.00 3.02 H new ATOM 2057 N PHE A 90 -6.742 -14.214 -3.665 1.00 0.69 N ATOM 2058 CA PHE A 90 -5.969 -14.613 -4.842 1.00 0.84 C ATOM 2059 C PHE A 90 -6.801 -15.508 -5.758 1.00 1.24 C ATOM 2060 O PHE A 90 -6.744 -15.392 -6.982 1.00 1.57 O ATOM 2061 CB PHE A 90 -4.702 -15.350 -4.395 1.00 0.96 C ATOM 2062 CG PHE A 90 -3.606 -15.377 -5.422 1.00 1.08 C ATOM 2063 CD1 PHE A 90 -2.715 -14.319 -5.530 1.00 1.59 C ATOM 2064 CD2 PHE A 90 -3.457 -16.459 -6.272 1.00 1.75 C ATOM 2065 CE1 PHE A 90 -1.699 -14.342 -6.466 1.00 1.81 C ATOM 2066 CE2 PHE A 90 -2.442 -16.487 -7.207 1.00 1.92 C ATOM 2067 CZ PHE A 90 -1.562 -15.427 -7.305 1.00 1.59 C ATOM 0 H PHE A 90 -6.270 -14.400 -2.780 1.00 0.69 H new ATOM 0 HA PHE A 90 -5.692 -13.719 -5.400 1.00 0.84 H new ATOM 0 HB2 PHE A 90 -4.323 -14.878 -3.488 1.00 0.96 H new ATOM 0 HB3 PHE A 90 -4.965 -16.375 -4.135 1.00 0.96 H new ATOM 0 HD1 PHE A 90 -2.817 -13.467 -4.874 1.00 1.59 H new ATOM 0 HD2 PHE A 90 -4.143 -17.291 -6.203 1.00 1.75 H new ATOM 0 HE1 PHE A 90 -1.013 -13.511 -6.540 1.00 1.81 H new ATOM 0 HE2 PHE A 90 -2.336 -17.339 -7.863 1.00 1.92 H new ATOM 0 HZ PHE A 90 -0.768 -15.448 -8.037 1.00 1.59 H new ATOM 2077 N GLU A 91 -7.577 -16.400 -5.155 1.00 1.36 N ATOM 2078 CA GLU A 91 -8.465 -17.269 -5.910 1.00 1.84 C ATOM 2079 C GLU A 91 -9.893 -16.736 -5.901 1.00 1.99 C ATOM 2080 O GLU A 91 -10.750 -17.212 -6.645 1.00 2.44 O ATOM 2081 CB GLU A 91 -8.429 -18.687 -5.345 1.00 2.02 C ATOM 2082 CG GLU A 91 -7.157 -19.440 -5.690 1.00 2.25 C ATOM 2083 CD GLU A 91 -6.987 -19.609 -7.186 1.00 2.76 C ATOM 2084 OE1 GLU A 91 -7.719 -20.430 -7.776 1.00 3.28 O ATOM 2085 OE2 GLU A 91 -6.132 -18.916 -7.777 1.00 3.15 O ATOM 0 H GLU A 91 -7.608 -16.539 -4.145 1.00 1.36 H new ATOM 0 HA GLU A 91 -8.116 -17.291 -6.942 1.00 1.84 H new ATOM 0 HB2 GLU A 91 -8.533 -18.641 -4.261 1.00 2.02 H new ATOM 0 HB3 GLU A 91 -9.286 -19.243 -5.724 1.00 2.02 H new ATOM 0 HG2 GLU A 91 -6.298 -18.905 -5.285 1.00 2.25 H new ATOM 0 HG3 GLU A 91 -7.175 -20.420 -5.214 1.00 2.25 H new ATOM 2092 N GLY A 92 -10.134 -15.731 -5.066 1.00 1.77 N ATOM 2093 CA GLY A 92 -11.465 -15.166 -4.929 1.00 2.10 C ATOM 2094 C GLY A 92 -12.436 -16.150 -4.317 1.00 2.32 C ATOM 2095 O GLY A 92 -13.630 -16.103 -4.604 1.00 2.82 O ATOM 0 H GLY A 92 -9.425 -15.294 -4.477 1.00 1.77 H new ATOM 0 HA2 GLY A 92 -11.417 -14.271 -4.309 1.00 2.10 H new ATOM 0 HA3 GLY A 92 -11.831 -14.857 -5.908 1.00 2.10 H new ATOM 2099 N PHE A 93 -11.896 -17.020 -3.460 1.00 2.16 N ATOM 2100 CA PHE A 93 -12.624 -18.126 -2.831 1.00 2.47 C ATOM 2101 C PHE A 93 -13.660 -18.779 -3.744 1.00 2.93 C ATOM 2102 O PHE A 93 -14.833 -18.408 -3.754 1.00 3.33 O ATOM 2103 CB PHE A 93 -13.244 -17.731 -1.472 1.00 2.75 C ATOM 2104 CG PHE A 93 -14.142 -16.516 -1.475 1.00 3.31 C ATOM 2105 CD1 PHE A 93 -13.612 -15.245 -1.314 1.00 3.92 C ATOM 2106 CD2 PHE A 93 -15.515 -16.648 -1.618 1.00 3.95 C ATOM 2107 CE1 PHE A 93 -14.433 -14.134 -1.300 1.00 4.93 C ATOM 2108 CE2 PHE A 93 -16.338 -15.539 -1.609 1.00 4.95 C ATOM 2109 CZ PHE A 93 -15.796 -14.280 -1.450 1.00 5.37 C ATOM 0 H PHE A 93 -10.917 -16.974 -3.177 1.00 2.16 H new ATOM 0 HA PHE A 93 -11.865 -18.885 -2.639 1.00 2.47 H new ATOM 0 HB2 PHE A 93 -13.817 -18.579 -1.098 1.00 2.75 H new ATOM 0 HB3 PHE A 93 -12.434 -17.556 -0.764 1.00 2.75 H new ATOM 0 HD1 PHE A 93 -12.545 -15.122 -1.198 1.00 3.92 H new ATOM 0 HD2 PHE A 93 -15.946 -17.631 -1.738 1.00 3.95 H new ATOM 0 HE1 PHE A 93 -14.007 -13.150 -1.171 1.00 4.93 H new ATOM 0 HE2 PHE A 93 -17.405 -15.657 -1.726 1.00 4.95 H new ATOM 0 HZ PHE A 93 -16.438 -13.411 -1.443 1.00 5.37 H new ATOM 2119 N PRO A 94 -13.233 -19.750 -4.559 1.00 3.52 N ATOM 2120 CA PRO A 94 -14.160 -20.622 -5.257 1.00 4.40 C ATOM 2121 C PRO A 94 -14.864 -21.516 -4.247 1.00 4.49 C ATOM 2122 O PRO A 94 -14.330 -22.554 -3.844 1.00 4.82 O ATOM 2123 CB PRO A 94 -13.276 -21.449 -6.201 1.00 5.24 C ATOM 2124 CG PRO A 94 -11.945 -20.774 -6.197 1.00 4.98 C ATOM 2125 CD PRO A 94 -11.836 -20.064 -4.876 1.00 3.95 C ATOM 0 HA PRO A 94 -14.934 -20.081 -5.802 1.00 4.40 H new ATOM 0 HB2 PRO A 94 -13.194 -22.480 -5.858 1.00 5.24 H new ATOM 0 HB3 PRO A 94 -13.697 -21.480 -7.206 1.00 5.24 H new ATOM 0 HG2 PRO A 94 -11.141 -21.500 -6.316 1.00 4.98 H new ATOM 0 HG3 PRO A 94 -11.864 -20.070 -7.025 1.00 4.98 H new ATOM 0 HD2 PRO A 94 -11.381 -20.696 -4.114 1.00 3.95 H new ATOM 0 HD3 PRO A 94 -11.226 -19.164 -4.950 1.00 3.95 H new ATOM 2133 N ASP A 95 -16.022 -21.063 -3.781 1.00 4.54 N ATOM 2134 CA ASP A 95 -16.749 -21.760 -2.731 1.00 4.97 C ATOM 2135 C ASP A 95 -17.258 -23.098 -3.234 1.00 4.96 C ATOM 2136 O ASP A 95 -18.287 -23.177 -3.904 1.00 5.41 O ATOM 2137 CB ASP A 95 -17.914 -20.908 -2.220 1.00 5.81 C ATOM 2138 CG ASP A 95 -18.569 -21.505 -0.992 1.00 6.62 C ATOM 2139 OD1 ASP A 95 -18.054 -21.283 0.125 1.00 7.10 O ATOM 2140 OD2 ASP A 95 -19.602 -22.190 -1.127 1.00 7.06 O ATOM 0 H ASP A 95 -16.477 -20.214 -4.116 1.00 4.54 H new ATOM 0 HA ASP A 95 -16.062 -21.937 -1.903 1.00 4.97 H new ATOM 0 HB2 ASP A 95 -17.553 -19.907 -1.986 1.00 5.81 H new ATOM 0 HB3 ASP A 95 -18.657 -20.802 -3.010 1.00 5.81 H new ATOM 2145 N LYS A 96 -16.493 -24.139 -2.945 1.00 4.87 N ATOM 2146 CA LYS A 96 -16.849 -25.490 -3.352 1.00 5.33 C ATOM 2147 C LYS A 96 -18.183 -25.908 -2.734 1.00 5.99 C ATOM 2148 O LYS A 96 -18.374 -25.846 -1.518 1.00 6.19 O ATOM 2149 CB LYS A 96 -15.737 -26.500 -2.997 1.00 5.44 C ATOM 2150 CG LYS A 96 -15.586 -26.823 -1.511 1.00 6.10 C ATOM 2151 CD LYS A 96 -15.062 -25.643 -0.709 1.00 6.48 C ATOM 2152 CE LYS A 96 -14.893 -25.998 0.757 1.00 7.03 C ATOM 2153 NZ LYS A 96 -14.380 -24.849 1.544 1.00 7.33 N ATOM 0 H LYS A 96 -15.617 -24.074 -2.427 1.00 4.87 H new ATOM 0 HA LYS A 96 -16.958 -25.491 -4.436 1.00 5.33 H new ATOM 0 HB2 LYS A 96 -15.930 -27.429 -3.534 1.00 5.44 H new ATOM 0 HB3 LYS A 96 -14.787 -26.111 -3.364 1.00 5.44 H new ATOM 0 HG2 LYS A 96 -16.551 -27.131 -1.110 1.00 6.10 H new ATOM 0 HG3 LYS A 96 -14.908 -27.668 -1.393 1.00 6.10 H new ATOM 0 HD2 LYS A 96 -14.105 -25.319 -1.119 1.00 6.48 H new ATOM 0 HD3 LYS A 96 -15.750 -24.803 -0.804 1.00 6.48 H new ATOM 0 HE2 LYS A 96 -15.850 -26.321 1.166 1.00 7.03 H new ATOM 0 HE3 LYS A 96 -14.206 -26.839 0.851 1.00 7.03 H new ATOM 0 HZ1 LYS A 96 -14.277 -25.129 2.540 1.00 7.33 H new ATOM 0 HZ2 LYS A 96 -13.455 -24.557 1.169 1.00 7.33 H new ATOM 0 HZ3 LYS A 96 -15.048 -24.055 1.475 1.00 7.33 H new ATOM 2167 N GLN A 97 -19.104 -26.313 -3.588 1.00 6.62 N ATOM 2168 CA GLN A 97 -20.426 -26.732 -3.164 1.00 7.47 C ATOM 2169 C GLN A 97 -20.843 -27.963 -3.956 1.00 8.21 C ATOM 2170 O GLN A 97 -21.052 -27.884 -5.165 1.00 8.51 O ATOM 2171 CB GLN A 97 -21.438 -25.599 -3.375 1.00 8.07 C ATOM 2172 CG GLN A 97 -22.843 -25.936 -2.903 1.00 8.68 C ATOM 2173 CD GLN A 97 -22.911 -26.177 -1.409 1.00 9.30 C ATOM 2174 OE1 GLN A 97 -22.143 -25.602 -0.639 1.00 9.68 O ATOM 2175 NE2 GLN A 97 -23.826 -27.032 -0.988 1.00 9.64 N ATOM 0 H GLN A 97 -18.956 -26.361 -4.596 1.00 6.62 H new ATOM 0 HA GLN A 97 -20.401 -26.977 -2.102 1.00 7.47 H new ATOM 0 HB2 GLN A 97 -21.091 -24.711 -2.847 1.00 8.07 H new ATOM 0 HB3 GLN A 97 -21.471 -25.347 -4.435 1.00 8.07 H new ATOM 0 HG2 GLN A 97 -23.517 -25.121 -3.167 1.00 8.68 H new ATOM 0 HG3 GLN A 97 -23.196 -26.824 -3.427 1.00 8.68 H new ATOM 0 HE21 GLN A 97 -24.444 -27.488 -1.659 1.00 9.64 H new ATOM 0 HE22 GLN A 97 -23.914 -27.236 0.008 1.00 9.64 H new ATOM 2184 N PRO A 98 -20.951 -29.120 -3.287 1.00 8.78 N ATOM 2185 CA PRO A 98 -21.297 -30.384 -3.941 1.00 9.71 C ATOM 2186 C PRO A 98 -22.674 -30.346 -4.596 1.00 10.51 C ATOM 2187 O PRO A 98 -23.699 -30.487 -3.923 1.00 10.91 O ATOM 2188 CB PRO A 98 -21.278 -31.408 -2.798 1.00 10.26 C ATOM 2189 CG PRO A 98 -20.490 -30.763 -1.709 1.00 9.76 C ATOM 2190 CD PRO A 98 -20.738 -29.290 -1.841 1.00 8.82 C ATOM 0 HA PRO A 98 -20.603 -30.618 -4.749 1.00 9.71 H new ATOM 0 HB2 PRO A 98 -22.288 -31.646 -2.465 1.00 10.26 H new ATOM 0 HB3 PRO A 98 -20.818 -32.344 -3.115 1.00 10.26 H new ATOM 0 HG2 PRO A 98 -20.805 -31.126 -0.731 1.00 9.76 H new ATOM 0 HG3 PRO A 98 -19.429 -30.991 -1.807 1.00 9.76 H new ATOM 0 HD2 PRO A 98 -21.607 -28.974 -1.265 1.00 8.82 H new ATOM 0 HD3 PRO A 98 -19.890 -28.704 -1.486 1.00 8.82 H new ATOM 2198 N ARG A 99 -22.692 -30.120 -5.901 1.00 10.91 N ATOM 2199 CA ARG A 99 -23.930 -30.133 -6.662 1.00 11.80 C ATOM 2200 C ARG A 99 -23.828 -31.101 -7.828 1.00 12.49 C ATOM 2201 O ARG A 99 -23.409 -30.735 -8.931 1.00 13.03 O ATOM 2202 CB ARG A 99 -24.286 -28.736 -7.172 1.00 12.07 C ATOM 2203 CG ARG A 99 -24.741 -27.786 -6.078 1.00 12.32 C ATOM 2204 CD ARG A 99 -25.161 -26.445 -6.654 1.00 12.98 C ATOM 2205 NE ARG A 99 -24.033 -25.721 -7.240 1.00 13.45 N ATOM 2206 CZ ARG A 99 -24.028 -25.199 -8.466 1.00 14.07 C ATOM 2207 NH1 ARG A 99 -25.052 -25.397 -9.287 1.00 14.29 N ATOM 2208 NH2 ARG A 99 -22.978 -24.505 -8.878 1.00 14.62 N ATOM 0 H ARG A 99 -21.859 -29.925 -6.456 1.00 10.91 H new ATOM 0 HA ARG A 99 -24.725 -30.463 -5.993 1.00 11.80 H new ATOM 0 HB2 ARG A 99 -23.417 -28.309 -7.674 1.00 12.07 H new ATOM 0 HB3 ARG A 99 -25.075 -28.821 -7.919 1.00 12.07 H new ATOM 0 HG2 ARG A 99 -25.575 -28.228 -5.533 1.00 12.32 H new ATOM 0 HG3 ARG A 99 -23.933 -27.640 -5.361 1.00 12.32 H new ATOM 0 HD2 ARG A 99 -25.926 -26.601 -7.415 1.00 12.98 H new ATOM 0 HD3 ARG A 99 -25.612 -25.839 -5.868 1.00 12.98 H new ATOM 0 HE ARG A 99 -23.194 -25.608 -6.672 1.00 13.45 H new ATOM 0 HH11 ARG A 99 -25.851 -25.952 -8.981 1.00 14.29 H new ATOM 0 HH12 ARG A 99 -25.040 -24.994 -10.224 1.00 14.29 H new ATOM 0 HH21 ARG A 99 -22.179 -24.373 -8.258 1.00 14.62 H new ATOM 0 HH22 ARG A 99 -22.968 -24.103 -9.815 1.00 14.62 H new ATOM 2222 N LYS A 100 -24.167 -32.348 -7.561 1.00 12.64 N ATOM 2223 CA LYS A 100 -24.198 -33.376 -8.580 1.00 13.44 C ATOM 2224 C LYS A 100 -25.070 -34.532 -8.123 1.00 14.06 C ATOM 2225 O LYS A 100 -24.738 -35.233 -7.164 1.00 14.46 O ATOM 2226 CB LYS A 100 -22.791 -33.887 -8.899 1.00 13.66 C ATOM 2227 CG LYS A 100 -22.789 -35.019 -9.910 1.00 13.92 C ATOM 2228 CD LYS A 100 -21.395 -35.560 -10.161 1.00 14.26 C ATOM 2229 CE LYS A 100 -21.442 -36.791 -11.050 1.00 15.02 C ATOM 2230 NZ LYS A 100 -22.220 -37.892 -10.421 1.00 15.75 N ATOM 0 H LYS A 100 -24.428 -32.675 -6.631 1.00 12.64 H new ATOM 0 HA LYS A 100 -24.615 -32.938 -9.487 1.00 13.44 H new ATOM 0 HB2 LYS A 100 -22.189 -33.063 -9.282 1.00 13.66 H new ATOM 0 HB3 LYS A 100 -22.316 -34.228 -7.979 1.00 13.66 H new ATOM 0 HG2 LYS A 100 -23.431 -35.824 -9.552 1.00 13.92 H new ATOM 0 HG3 LYS A 100 -23.214 -34.666 -10.849 1.00 13.92 H new ATOM 0 HD2 LYS A 100 -20.781 -34.791 -10.630 1.00 14.26 H new ATOM 0 HD3 LYS A 100 -20.921 -35.810 -9.212 1.00 14.26 H new ATOM 0 HE2 LYS A 100 -21.889 -36.531 -12.009 1.00 15.02 H new ATOM 0 HE3 LYS A 100 -20.427 -37.132 -11.254 1.00 15.02 H new ATOM 0 HZ1 LYS A 100 -21.687 -38.782 -10.498 1.00 15.75 H new ATOM 0 HZ2 LYS A 100 -22.384 -37.672 -9.418 1.00 15.75 H new ATOM 0 HZ3 LYS A 100 -23.134 -37.993 -10.907 1.00 15.75 H new ATOM 2244 N LYS A 101 -26.190 -34.715 -8.791 1.00 14.28 N ATOM 2245 CA LYS A 101 -27.088 -35.808 -8.483 1.00 15.00 C ATOM 2246 C LYS A 101 -27.851 -36.199 -9.738 1.00 15.28 C ATOM 2247 O LYS A 101 -27.355 -37.068 -10.485 1.00 15.57 O ATOM 2248 CB LYS A 101 -28.050 -35.411 -7.361 1.00 15.30 C ATOM 2249 CG LYS A 101 -28.924 -36.553 -6.875 1.00 15.68 C ATOM 2250 CD LYS A 101 -29.783 -36.131 -5.697 1.00 15.85 C ATOM 2251 CE LYS A 101 -30.672 -37.265 -5.217 1.00 16.60 C ATOM 2252 NZ LYS A 101 -31.643 -37.689 -6.259 1.00 17.06 N ATOM 2253 OXT LYS A 101 -28.918 -35.612 -9.997 1.00 15.35 O ATOM 0 H LYS A 101 -26.501 -34.116 -9.556 1.00 14.28 H new ATOM 0 HA LYS A 101 -26.510 -36.665 -8.137 1.00 15.00 H new ATOM 0 HB2 LYS A 101 -27.474 -35.023 -6.521 1.00 15.30 H new ATOM 0 HB3 LYS A 101 -28.688 -34.600 -7.712 1.00 15.30 H new ATOM 0 HG2 LYS A 101 -29.563 -36.896 -7.689 1.00 15.68 H new ATOM 0 HG3 LYS A 101 -28.296 -37.396 -6.586 1.00 15.68 H new ATOM 0 HD2 LYS A 101 -29.143 -35.799 -4.880 1.00 15.85 H new ATOM 0 HD3 LYS A 101 -30.401 -35.280 -5.983 1.00 15.85 H new ATOM 0 HE2 LYS A 101 -30.053 -38.115 -4.931 1.00 16.60 H new ATOM 0 HE3 LYS A 101 -31.212 -36.949 -4.325 1.00 16.60 H new ATOM 0 HZ1 LYS A 101 -32.357 -38.314 -5.834 1.00 17.06 H new ATOM 0 HZ2 LYS A 101 -32.111 -36.851 -6.659 1.00 17.06 H new ATOM 0 HZ3 LYS A 101 -31.142 -38.199 -7.014 1.00 17.06 H new TER 2267 LYS A 101 ATOM 2268 N MET B 1 -3.865 -0.653 -21.542 1.00 1.49 N ATOM 2269 CA MET B 1 -3.435 -0.242 -20.186 1.00 0.60 C ATOM 2270 C MET B 1 -3.954 -1.224 -19.145 1.00 0.49 C ATOM 2271 O MET B 1 -4.778 -2.088 -19.449 1.00 0.58 O ATOM 2272 CB MET B 1 -3.938 1.170 -19.868 1.00 1.30 C ATOM 2273 CG MET B 1 -3.276 2.260 -20.694 1.00 1.88 C ATOM 2274 SD MET B 1 -1.490 2.347 -20.433 1.00 2.89 S ATOM 2275 CE MET B 1 -1.063 3.718 -21.505 1.00 3.54 C ATOM 0 H1 MET B 1 -3.028 -0.857 -22.125 1.00 1.49 H new ATOM 0 H2 MET B 1 -4.456 -1.506 -21.475 1.00 1.49 H new ATOM 0 H3 MET B 1 -4.413 0.115 -21.980 1.00 1.49 H new ATOM 0 HA MET B 1 -2.345 -0.241 -20.158 1.00 0.60 H new ATOM 0 HB2 MET B 1 -5.015 1.207 -20.032 1.00 1.30 H new ATOM 0 HB3 MET B 1 -3.769 1.376 -18.811 1.00 1.30 H new ATOM 0 HG2 MET B 1 -3.476 2.081 -21.750 1.00 1.88 H new ATOM 0 HG3 MET B 1 -3.723 3.222 -20.443 1.00 1.88 H new ATOM 0 HE1 MET B 1 0.011 3.898 -21.455 1.00 3.54 H new ATOM 0 HE2 MET B 1 -1.344 3.479 -22.531 1.00 3.54 H new ATOM 0 HE3 MET B 1 -1.596 4.612 -21.182 1.00 3.54 H new ATOM 2285 N ALA B 2 -3.469 -1.099 -17.919 1.00 0.34 N ATOM 2286 CA ALA B 2 -3.878 -1.974 -16.846 1.00 0.30 C ATOM 2287 C ALA B 2 -4.873 -1.242 -15.962 1.00 0.27 C ATOM 2288 O ALA B 2 -4.934 -0.015 -16.002 1.00 0.36 O ATOM 2289 CB ALA B 2 -2.659 -2.422 -16.053 1.00 0.30 C ATOM 0 H ALA B 2 -2.786 -0.392 -17.647 1.00 0.34 H new ATOM 0 HA ALA B 2 -4.360 -2.864 -17.250 1.00 0.30 H new ATOM 0 HB1 ALA B 2 -2.973 -3.082 -15.245 1.00 0.30 H new ATOM 0 HB2 ALA B 2 -1.973 -2.955 -16.711 1.00 0.30 H new ATOM 0 HB3 ALA B 2 -2.156 -1.550 -15.635 1.00 0.30 H new ATOM 2295 N CYS B 3 -5.666 -1.978 -15.198 1.00 0.25 N ATOM 2296 CA CYS B 3 -6.546 -1.370 -14.218 1.00 0.23 C ATOM 2297 C CYS B 3 -5.694 -0.779 -13.113 1.00 0.17 C ATOM 2298 O CYS B 3 -5.144 -1.511 -12.295 1.00 0.17 O ATOM 2299 CB CYS B 3 -7.510 -2.404 -13.647 1.00 0.28 C ATOM 2300 SG CYS B 3 -8.387 -3.365 -14.898 1.00 0.39 S ATOM 0 H CYS B 3 -5.717 -2.996 -15.239 1.00 0.25 H new ATOM 0 HA CYS B 3 -7.139 -0.588 -14.692 1.00 0.23 H new ATOM 0 HB2 CYS B 3 -6.954 -3.086 -13.004 1.00 0.28 H new ATOM 0 HB3 CYS B 3 -8.240 -1.895 -13.017 1.00 0.28 H new ATOM 0 HG CYS B 3 -8.769 -4.497 -14.386 1.00 0.39 H new ATOM 2306 N PRO B 4 -5.567 0.550 -13.090 1.00 0.16 N ATOM 2307 CA PRO B 4 -4.590 1.246 -12.246 1.00 0.13 C ATOM 2308 C PRO B 4 -4.611 0.797 -10.787 1.00 0.12 C ATOM 2309 O PRO B 4 -3.627 0.248 -10.286 1.00 0.12 O ATOM 2310 CB PRO B 4 -5.029 2.700 -12.371 1.00 0.17 C ATOM 2311 CG PRO B 4 -5.629 2.780 -13.726 1.00 0.20 C ATOM 2312 CD PRO B 4 -6.380 1.496 -13.881 1.00 0.20 C ATOM 0 HA PRO B 4 -3.565 1.050 -12.562 1.00 0.13 H new ATOM 0 HB2 PRO B 4 -5.751 2.967 -11.599 1.00 0.17 H new ATOM 0 HB3 PRO B 4 -4.185 3.382 -12.268 1.00 0.17 H new ATOM 0 HG2 PRO B 4 -6.292 3.641 -13.816 1.00 0.20 H new ATOM 0 HG3 PRO B 4 -4.862 2.886 -14.494 1.00 0.20 H new ATOM 0 HD2 PRO B 4 -7.398 1.573 -13.499 1.00 0.20 H new ATOM 0 HD3 PRO B 4 -6.453 1.193 -14.925 1.00 0.20 H new ATOM 2320 N LEU B 5 -5.737 0.999 -10.120 1.00 0.13 N ATOM 2321 CA LEU B 5 -5.856 0.639 -8.716 1.00 0.14 C ATOM 2322 C LEU B 5 -5.904 -0.880 -8.549 1.00 0.16 C ATOM 2323 O LEU B 5 -5.333 -1.420 -7.608 1.00 0.22 O ATOM 2324 CB LEU B 5 -7.110 1.280 -8.115 1.00 0.15 C ATOM 2325 CG LEU B 5 -6.979 1.809 -6.685 1.00 0.16 C ATOM 2326 CD1 LEU B 5 -6.722 0.682 -5.723 1.00 0.18 C ATOM 2327 CD2 LEU B 5 -5.877 2.845 -6.575 1.00 0.17 C ATOM 0 H LEU B 5 -6.578 1.409 -10.526 1.00 0.13 H new ATOM 0 HA LEU B 5 -4.979 1.012 -8.187 1.00 0.14 H new ATOM 0 HB2 LEU B 5 -7.415 2.105 -8.759 1.00 0.15 H new ATOM 0 HB3 LEU B 5 -7.914 0.545 -8.136 1.00 0.15 H new ATOM 0 HG LEU B 5 -7.923 2.288 -6.427 1.00 0.16 H new ATOM 0 HD11 LEU B 5 -6.632 1.080 -4.712 1.00 0.18 H new ATOM 0 HD12 LEU B 5 -7.550 -0.026 -5.762 1.00 0.18 H new ATOM 0 HD13 LEU B 5 -5.797 0.174 -5.996 1.00 0.18 H new ATOM 0 HD21 LEU B 5 -5.812 3.199 -5.546 1.00 0.17 H new ATOM 0 HD22 LEU B 5 -4.927 2.397 -6.866 1.00 0.17 H new ATOM 0 HD23 LEU B 5 -6.099 3.684 -7.234 1.00 0.17 H new ATOM 2339 N GLU B 6 -6.567 -1.567 -9.476 1.00 0.16 N ATOM 2340 CA GLU B 6 -6.729 -3.015 -9.374 1.00 0.20 C ATOM 2341 C GLU B 6 -5.379 -3.725 -9.424 1.00 0.18 C ATOM 2342 O GLU B 6 -5.114 -4.636 -8.637 1.00 0.23 O ATOM 2343 CB GLU B 6 -7.640 -3.546 -10.485 1.00 0.29 C ATOM 2344 CG GLU B 6 -7.871 -5.049 -10.416 1.00 0.43 C ATOM 2345 CD GLU B 6 -8.880 -5.539 -11.435 1.00 0.90 C ATOM 2346 OE1 GLU B 6 -8.605 -5.444 -12.649 1.00 1.39 O ATOM 2347 OE2 GLU B 6 -9.953 -6.038 -11.026 1.00 1.79 O ATOM 0 H GLU B 6 -6.998 -1.148 -10.300 1.00 0.16 H new ATOM 0 HA GLU B 6 -7.195 -3.224 -8.411 1.00 0.20 H new ATOM 0 HB2 GLU B 6 -8.602 -3.036 -10.430 1.00 0.29 H new ATOM 0 HB3 GLU B 6 -7.203 -3.298 -11.452 1.00 0.29 H new ATOM 0 HG2 GLU B 6 -6.924 -5.565 -10.574 1.00 0.43 H new ATOM 0 HG3 GLU B 6 -8.215 -5.313 -9.416 1.00 0.43 H new ATOM 2354 N LYS B 7 -4.519 -3.292 -10.340 1.00 0.16 N ATOM 2355 CA LYS B 7 -3.213 -3.912 -10.501 1.00 0.18 C ATOM 2356 C LYS B 7 -2.341 -3.653 -9.286 1.00 0.17 C ATOM 2357 O LYS B 7 -1.473 -4.453 -8.974 1.00 0.19 O ATOM 2358 CB LYS B 7 -2.525 -3.431 -11.789 1.00 0.25 C ATOM 2359 CG LYS B 7 -3.237 -3.882 -13.055 1.00 0.41 C ATOM 2360 CD LYS B 7 -3.299 -5.399 -13.183 1.00 0.90 C ATOM 2361 CE LYS B 7 -1.930 -6.002 -13.449 1.00 0.84 C ATOM 2362 NZ LYS B 7 -1.978 -7.487 -13.482 1.00 1.18 N ATOM 0 H LYS B 7 -4.703 -2.518 -10.978 1.00 0.16 H new ATOM 0 HA LYS B 7 -3.360 -4.989 -10.588 1.00 0.18 H new ATOM 0 HB2 LYS B 7 -2.471 -2.342 -11.779 1.00 0.25 H new ATOM 0 HB3 LYS B 7 -1.500 -3.801 -11.805 1.00 0.25 H new ATOM 0 HG2 LYS B 7 -4.250 -3.479 -13.061 1.00 0.41 H new ATOM 0 HG3 LYS B 7 -2.724 -3.468 -13.923 1.00 0.41 H new ATOM 0 HD2 LYS B 7 -3.711 -5.824 -12.268 1.00 0.90 H new ATOM 0 HD3 LYS B 7 -3.977 -5.668 -13.993 1.00 0.90 H new ATOM 0 HE2 LYS B 7 -1.547 -5.630 -14.399 1.00 0.84 H new ATOM 0 HE3 LYS B 7 -1.234 -5.678 -12.676 1.00 0.84 H new ATOM 0 HZ1 LYS B 7 -1.390 -7.836 -14.266 1.00 1.18 H new ATOM 0 HZ2 LYS B 7 -1.617 -7.866 -12.583 1.00 1.18 H new ATOM 0 HZ3 LYS B 7 -2.960 -7.800 -13.620 1.00 1.18 H new ATOM 2376 N ALA B 8 -2.600 -2.557 -8.584 1.00 0.17 N ATOM 2377 CA ALA B 8 -1.858 -2.230 -7.371 1.00 0.17 C ATOM 2378 C ALA B 8 -1.880 -3.394 -6.382 1.00 0.17 C ATOM 2379 O ALA B 8 -0.836 -3.810 -5.893 1.00 0.22 O ATOM 2380 CB ALA B 8 -2.416 -0.970 -6.724 1.00 0.18 C ATOM 0 H ALA B 8 -3.319 -1.878 -8.834 1.00 0.17 H new ATOM 0 HA ALA B 8 -0.821 -2.045 -7.652 1.00 0.17 H new ATOM 0 HB1 ALA B 8 -1.849 -0.743 -5.821 1.00 0.18 H new ATOM 0 HB2 ALA B 8 -2.336 -0.137 -7.422 1.00 0.18 H new ATOM 0 HB3 ALA B 8 -3.463 -1.127 -6.465 1.00 0.18 H new ATOM 2386 N LEU B 9 -3.065 -3.935 -6.114 1.00 0.13 N ATOM 2387 CA LEU B 9 -3.195 -5.043 -5.169 1.00 0.12 C ATOM 2388 C LEU B 9 -2.677 -6.337 -5.784 1.00 0.14 C ATOM 2389 O LEU B 9 -2.032 -7.145 -5.115 1.00 0.18 O ATOM 2390 CB LEU B 9 -4.651 -5.243 -4.715 1.00 0.13 C ATOM 2391 CG LEU B 9 -5.327 -4.034 -4.062 1.00 0.13 C ATOM 2392 CD1 LEU B 9 -4.385 -3.360 -3.097 1.00 0.15 C ATOM 2393 CD2 LEU B 9 -5.822 -3.038 -5.091 1.00 0.13 C ATOM 0 H LEU B 9 -3.943 -3.628 -6.533 1.00 0.13 H new ATOM 0 HA LEU B 9 -2.596 -4.787 -4.295 1.00 0.12 H new ATOM 0 HB2 LEU B 9 -5.242 -5.540 -5.581 1.00 0.13 H new ATOM 0 HB3 LEU B 9 -4.679 -6.074 -4.010 1.00 0.13 H new ATOM 0 HG LEU B 9 -6.195 -4.404 -3.516 1.00 0.13 H new ATOM 0 HD11 LEU B 9 -4.882 -2.503 -2.642 1.00 0.15 H new ATOM 0 HD12 LEU B 9 -4.095 -4.066 -2.319 1.00 0.15 H new ATOM 0 HD13 LEU B 9 -3.497 -3.023 -3.631 1.00 0.15 H new ATOM 0 HD21 LEU B 9 -6.295 -2.196 -4.585 1.00 0.13 H new ATOM 0 HD22 LEU B 9 -4.981 -2.679 -5.684 1.00 0.13 H new ATOM 0 HD23 LEU B 9 -6.547 -3.521 -5.746 1.00 0.13 H new ATOM 2405 N ASP B 10 -2.961 -6.518 -7.066 1.00 0.14 N ATOM 2406 CA ASP B 10 -2.540 -7.710 -7.798 1.00 0.16 C ATOM 2407 C ASP B 10 -1.022 -7.856 -7.802 1.00 0.15 C ATOM 2408 O ASP B 10 -0.486 -8.918 -7.486 1.00 0.19 O ATOM 2409 CB ASP B 10 -3.075 -7.651 -9.235 1.00 0.20 C ATOM 2410 CG ASP B 10 -2.382 -8.621 -10.178 1.00 0.51 C ATOM 2411 OD1 ASP B 10 -2.700 -9.829 -10.155 1.00 1.22 O ATOM 2412 OD2 ASP B 10 -1.525 -8.171 -10.966 1.00 1.19 O ATOM 0 H ASP B 10 -3.487 -5.848 -7.628 1.00 0.14 H new ATOM 0 HA ASP B 10 -2.953 -8.584 -7.294 1.00 0.16 H new ATOM 0 HB2 ASP B 10 -4.144 -7.866 -9.226 1.00 0.20 H new ATOM 0 HB3 ASP B 10 -2.957 -6.637 -9.617 1.00 0.20 H new ATOM 2417 N VAL B 11 -0.329 -6.777 -8.130 1.00 0.15 N ATOM 2418 CA VAL B 11 1.121 -6.812 -8.241 1.00 0.16 C ATOM 2419 C VAL B 11 1.781 -6.913 -6.874 1.00 0.16 C ATOM 2420 O VAL B 11 2.910 -7.377 -6.760 1.00 0.20 O ATOM 2421 CB VAL B 11 1.658 -5.579 -8.984 1.00 0.18 C ATOM 2422 CG1 VAL B 11 0.967 -5.447 -10.329 1.00 0.21 C ATOM 2423 CG2 VAL B 11 1.478 -4.317 -8.154 1.00 0.17 C ATOM 0 H VAL B 11 -0.747 -5.867 -8.324 1.00 0.15 H new ATOM 0 HA VAL B 11 1.371 -7.703 -8.817 1.00 0.16 H new ATOM 0 HB VAL B 11 2.727 -5.711 -9.150 1.00 0.18 H new ATOM 0 HG11 VAL B 11 1.352 -4.571 -10.851 1.00 0.21 H new ATOM 0 HG12 VAL B 11 1.159 -6.339 -10.926 1.00 0.21 H new ATOM 0 HG13 VAL B 11 -0.107 -5.336 -10.177 1.00 0.21 H new ATOM 0 HG21 VAL B 11 1.867 -3.461 -8.705 1.00 0.17 H new ATOM 0 HG22 VAL B 11 0.418 -4.165 -7.948 1.00 0.17 H new ATOM 0 HG23 VAL B 11 2.019 -4.420 -7.214 1.00 0.17 H new ATOM 2433 N MET B 12 1.064 -6.494 -5.839 1.00 0.16 N ATOM 2434 CA MET B 12 1.566 -6.588 -4.475 1.00 0.20 C ATOM 2435 C MET B 12 1.931 -8.020 -4.129 1.00 0.23 C ATOM 2436 O MET B 12 2.982 -8.270 -3.555 1.00 0.39 O ATOM 2437 CB MET B 12 0.531 -6.051 -3.496 1.00 0.27 C ATOM 2438 CG MET B 12 0.565 -4.541 -3.370 1.00 0.16 C ATOM 2439 SD MET B 12 -0.894 -3.876 -2.555 1.00 0.78 S ATOM 2440 CE MET B 12 -0.333 -2.230 -2.163 1.00 0.19 C ATOM 0 H MET B 12 0.133 -6.086 -5.919 1.00 0.16 H new ATOM 0 HA MET B 12 2.469 -5.982 -4.400 1.00 0.20 H new ATOM 0 HB2 MET B 12 -0.463 -6.361 -3.819 1.00 0.27 H new ATOM 0 HB3 MET B 12 0.701 -6.496 -2.516 1.00 0.27 H new ATOM 0 HG2 MET B 12 1.453 -4.248 -2.811 1.00 0.16 H new ATOM 0 HG3 MET B 12 0.654 -4.100 -4.363 1.00 0.16 H new ATOM 0 HE1 MET B 12 -1.122 -1.693 -1.636 1.00 0.19 H new ATOM 0 HE2 MET B 12 0.552 -2.288 -1.530 1.00 0.19 H new ATOM 0 HE3 MET B 12 -0.086 -1.701 -3.083 1.00 0.19 H new ATOM 2450 N VAL B 13 1.061 -8.960 -4.482 1.00 0.18 N ATOM 2451 CA VAL B 13 1.341 -10.373 -4.249 1.00 0.19 C ATOM 2452 C VAL B 13 2.021 -11.027 -5.459 1.00 0.19 C ATOM 2453 O VAL B 13 2.682 -12.060 -5.326 1.00 0.25 O ATOM 2454 CB VAL B 13 0.067 -11.158 -3.872 1.00 0.20 C ATOM 2455 CG1 VAL B 13 -0.500 -10.644 -2.560 1.00 0.21 C ATOM 2456 CG2 VAL B 13 -0.979 -11.075 -4.971 1.00 0.22 C ATOM 0 H VAL B 13 0.163 -8.772 -4.927 1.00 0.18 H new ATOM 0 HA VAL B 13 2.030 -10.413 -3.405 1.00 0.19 H new ATOM 0 HB VAL B 13 0.341 -12.206 -3.751 1.00 0.20 H new ATOM 0 HG11 VAL B 13 -1.398 -11.207 -2.307 1.00 0.21 H new ATOM 0 HG12 VAL B 13 0.241 -10.768 -1.770 1.00 0.21 H new ATOM 0 HG13 VAL B 13 -0.750 -9.588 -2.661 1.00 0.21 H new ATOM 0 HG21 VAL B 13 -1.864 -11.638 -4.674 1.00 0.22 H new ATOM 0 HG22 VAL B 13 -1.251 -10.033 -5.136 1.00 0.22 H new ATOM 0 HG23 VAL B 13 -0.574 -11.495 -5.892 1.00 0.22 H new ATOM 2466 N SER B 14 1.869 -10.419 -6.632 1.00 0.18 N ATOM 2467 CA SER B 14 2.454 -10.960 -7.855 1.00 0.21 C ATOM 2468 C SER B 14 3.955 -10.673 -7.914 1.00 0.23 C ATOM 2469 O SER B 14 4.768 -11.599 -7.993 1.00 0.26 O ATOM 2470 CB SER B 14 1.749 -10.376 -9.083 1.00 0.23 C ATOM 2471 OG SER B 14 2.139 -11.042 -10.272 1.00 1.12 O ATOM 0 H SER B 14 1.346 -9.553 -6.762 1.00 0.18 H new ATOM 0 HA SER B 14 2.315 -12.041 -7.852 1.00 0.21 H new ATOM 0 HB2 SER B 14 0.669 -10.457 -8.957 1.00 0.23 H new ATOM 0 HB3 SER B 14 1.981 -9.314 -9.167 1.00 0.23 H new ATOM 0 HG SER B 14 1.670 -10.647 -11.037 1.00 1.12 H new ATOM 2477 N THR B 15 4.315 -9.391 -7.857 1.00 0.24 N ATOM 2478 CA THR B 15 5.712 -8.973 -7.829 1.00 0.26 C ATOM 2479 C THR B 15 6.388 -9.520 -6.571 1.00 0.28 C ATOM 2480 O THR B 15 7.587 -9.795 -6.554 1.00 0.31 O ATOM 2481 CB THR B 15 5.812 -7.431 -7.864 1.00 0.27 C ATOM 2482 OG1 THR B 15 5.042 -6.920 -8.965 1.00 0.33 O ATOM 2483 CG2 THR B 15 7.252 -6.965 -8.001 1.00 0.25 C ATOM 0 H THR B 15 3.649 -8.619 -7.829 1.00 0.24 H new ATOM 0 HA THR B 15 6.220 -9.371 -8.708 1.00 0.26 H new ATOM 0 HB THR B 15 5.419 -7.051 -6.921 1.00 0.27 H new ATOM 0 HG1 THR B 15 5.579 -6.272 -9.467 1.00 0.33 H new ATOM 0 HG21 THR B 15 7.281 -5.876 -8.022 1.00 0.25 H new ATOM 0 HG22 THR B 15 7.834 -7.327 -7.154 1.00 0.25 H new ATOM 0 HG23 THR B 15 7.675 -7.357 -8.926 1.00 0.25 H new ATOM 2491 N PHE B 16 5.576 -9.695 -5.535 1.00 0.30 N ATOM 2492 CA PHE B 16 5.988 -10.336 -4.294 1.00 0.36 C ATOM 2493 C PHE B 16 6.645 -11.686 -4.578 1.00 0.40 C ATOM 2494 O PHE B 16 7.857 -11.835 -4.439 1.00 0.51 O ATOM 2495 CB PHE B 16 4.746 -10.522 -3.423 1.00 0.44 C ATOM 2496 CG PHE B 16 4.984 -11.020 -2.033 1.00 0.34 C ATOM 2497 CD1 PHE B 16 5.680 -10.257 -1.118 1.00 1.21 C ATOM 2498 CD2 PHE B 16 4.479 -12.242 -1.634 1.00 1.27 C ATOM 2499 CE1 PHE B 16 5.877 -10.705 0.172 1.00 1.38 C ATOM 2500 CE2 PHE B 16 4.666 -12.694 -0.346 1.00 1.42 C ATOM 2501 CZ PHE B 16 5.366 -11.923 0.558 1.00 0.97 C ATOM 0 H PHE B 16 4.602 -9.392 -5.534 1.00 0.30 H new ATOM 0 HA PHE B 16 6.720 -9.714 -3.779 1.00 0.36 H new ATOM 0 HB2 PHE B 16 4.225 -9.567 -3.360 1.00 0.44 H new ATOM 0 HB3 PHE B 16 4.075 -11.218 -3.926 1.00 0.44 H new ATOM 0 HD1 PHE B 16 6.076 -9.297 -1.415 1.00 1.21 H new ATOM 0 HD2 PHE B 16 3.932 -12.850 -2.339 1.00 1.27 H new ATOM 0 HE1 PHE B 16 6.430 -10.102 0.876 1.00 1.38 H new ATOM 0 HE2 PHE B 16 4.265 -13.651 -0.045 1.00 1.42 H new ATOM 0 HZ PHE B 16 5.513 -12.275 1.568 1.00 0.97 H new ATOM 2511 N HIS B 17 5.837 -12.644 -5.039 1.00 0.41 N ATOM 2512 CA HIS B 17 6.312 -14.003 -5.321 1.00 0.51 C ATOM 2513 C HIS B 17 7.341 -14.013 -6.450 1.00 0.45 C ATOM 2514 O HIS B 17 8.077 -14.984 -6.633 1.00 0.51 O ATOM 2515 CB HIS B 17 5.135 -14.914 -5.695 1.00 0.68 C ATOM 2516 CG HIS B 17 4.318 -15.375 -4.527 1.00 1.09 C ATOM 2517 ND1 HIS B 17 3.534 -14.685 -3.665 1.00 2.16 N flip ATOM 2518 CD2 HIS B 17 4.254 -16.690 -4.126 1.00 1.26 C flip ATOM 2519 CE1 HIS B 17 3.021 -15.587 -2.766 1.00 2.82 C flip ATOM 2520 NE2 HIS B 17 3.470 -16.789 -3.071 1.00 2.30 N flip ATOM 0 H HIS B 17 4.844 -12.503 -5.226 1.00 0.41 H new ATOM 0 HA HIS B 17 6.790 -14.377 -4.415 1.00 0.51 H new ATOM 0 HB2 HIS B 17 4.486 -14.382 -6.391 1.00 0.68 H new ATOM 0 HB3 HIS B 17 5.520 -15.787 -6.222 1.00 0.68 H new ATOM 0 HD2 HIS B 17 4.767 -17.513 -4.602 1.00 1.26 H new ATOM 0 HE1 HIS B 17 2.360 -15.351 -1.945 1.00 2.82 H new ATOM 0 HE2 HIS B 17 3.248 -17.651 -2.574 1.00 2.30 H new ATOM 2529 N LYS B 18 7.380 -12.923 -7.200 1.00 0.42 N ATOM 2530 CA LYS B 18 8.263 -12.795 -8.349 1.00 0.46 C ATOM 2531 C LYS B 18 9.723 -12.628 -7.922 1.00 0.45 C ATOM 2532 O LYS B 18 10.637 -13.003 -8.656 1.00 0.62 O ATOM 2533 CB LYS B 18 7.801 -11.600 -9.189 1.00 0.55 C ATOM 2534 CG LYS B 18 8.658 -11.287 -10.402 1.00 0.76 C ATOM 2535 CD LYS B 18 8.084 -10.105 -11.164 1.00 0.71 C ATOM 2536 CE LYS B 18 8.994 -9.651 -12.290 1.00 1.40 C ATOM 2537 NZ LYS B 18 8.411 -8.501 -13.030 1.00 1.67 N ATOM 0 H LYS B 18 6.800 -12.101 -7.029 1.00 0.42 H new ATOM 0 HA LYS B 18 8.211 -13.708 -8.942 1.00 0.46 H new ATOM 0 HB2 LYS B 18 6.781 -11.786 -9.524 1.00 0.55 H new ATOM 0 HB3 LYS B 18 7.771 -10.718 -8.549 1.00 0.55 H new ATOM 0 HG2 LYS B 18 9.678 -11.065 -10.087 1.00 0.76 H new ATOM 0 HG3 LYS B 18 8.709 -12.159 -11.054 1.00 0.76 H new ATOM 0 HD2 LYS B 18 7.111 -10.377 -11.573 1.00 0.71 H new ATOM 0 HD3 LYS B 18 7.920 -9.276 -10.475 1.00 0.71 H new ATOM 0 HE2 LYS B 18 9.965 -9.369 -11.883 1.00 1.40 H new ATOM 0 HE3 LYS B 18 9.165 -10.479 -12.978 1.00 1.40 H new ATOM 0 HZ1 LYS B 18 9.172 -7.964 -13.493 1.00 1.67 H new ATOM 0 HZ2 LYS B 18 7.748 -8.852 -13.750 1.00 1.67 H new ATOM 0 HZ3 LYS B 18 7.905 -7.881 -12.366 1.00 1.67 H new ATOM 2551 N TYR B 19 9.942 -12.072 -6.734 1.00 0.39 N ATOM 2552 CA TYR B 19 11.302 -11.809 -6.270 1.00 0.43 C ATOM 2553 C TYR B 19 11.628 -12.530 -4.968 1.00 0.50 C ATOM 2554 O TYR B 19 12.755 -12.976 -4.784 1.00 0.74 O ATOM 2555 CB TYR B 19 11.534 -10.304 -6.113 1.00 0.46 C ATOM 2556 CG TYR B 19 11.569 -9.567 -7.433 1.00 0.41 C ATOM 2557 CD1 TYR B 19 12.738 -9.498 -8.178 1.00 1.17 C ATOM 2558 CD2 TYR B 19 10.433 -8.952 -7.938 1.00 1.17 C ATOM 2559 CE1 TYR B 19 12.774 -8.837 -9.391 1.00 1.21 C ATOM 2560 CE2 TYR B 19 10.460 -8.288 -9.148 1.00 1.17 C ATOM 2561 CZ TYR B 19 11.631 -8.233 -9.871 1.00 0.50 C ATOM 2562 OH TYR B 19 11.656 -7.582 -11.082 1.00 0.61 O ATOM 0 H TYR B 19 9.207 -11.798 -6.082 1.00 0.39 H new ATOM 0 HA TYR B 19 11.975 -12.202 -7.032 1.00 0.43 H new ATOM 0 HB2 TYR B 19 10.744 -9.884 -5.490 1.00 0.46 H new ATOM 0 HB3 TYR B 19 12.475 -10.141 -5.588 1.00 0.46 H new ATOM 0 HD1 TYR B 19 13.635 -9.969 -7.803 1.00 1.17 H new ATOM 0 HD2 TYR B 19 9.512 -8.993 -7.375 1.00 1.17 H new ATOM 0 HE1 TYR B 19 13.691 -8.794 -9.959 1.00 1.21 H new ATOM 0 HE2 TYR B 19 9.567 -7.814 -9.526 1.00 1.17 H new ATOM 0 HH TYR B 19 10.769 -7.213 -11.273 1.00 0.61 H new ATOM 2572 N SER B 20 10.654 -12.654 -4.076 1.00 0.41 N ATOM 2573 CA SER B 20 10.891 -13.266 -2.770 1.00 0.48 C ATOM 2574 C SER B 20 11.344 -14.717 -2.910 1.00 0.57 C ATOM 2575 O SER B 20 12.215 -15.185 -2.178 1.00 0.70 O ATOM 2576 CB SER B 20 9.619 -13.193 -1.928 1.00 0.49 C ATOM 2577 OG SER B 20 8.518 -13.738 -2.631 1.00 0.53 O ATOM 0 H SER B 20 9.695 -12.341 -4.229 1.00 0.41 H new ATOM 0 HA SER B 20 11.689 -12.713 -2.274 1.00 0.48 H new ATOM 0 HB2 SER B 20 9.764 -13.736 -0.994 1.00 0.49 H new ATOM 0 HB3 SER B 20 9.411 -12.156 -1.665 1.00 0.49 H new ATOM 0 HG SER B 20 8.176 -13.076 -3.267 1.00 0.53 H new ATOM 2583 N GLY B 21 10.762 -15.419 -3.873 1.00 0.57 N ATOM 2584 CA GLY B 21 11.055 -16.827 -4.047 1.00 0.68 C ATOM 2585 C GLY B 21 12.323 -17.080 -4.837 1.00 0.71 C ATOM 2586 O GLY B 21 12.522 -18.178 -5.361 1.00 0.86 O ATOM 0 H GLY B 21 10.090 -15.037 -4.538 1.00 0.57 H new ATOM 0 HA2 GLY B 21 11.145 -17.296 -3.067 1.00 0.68 H new ATOM 0 HA3 GLY B 21 10.217 -17.306 -4.554 1.00 0.68 H new ATOM 2590 N LYS B 22 13.184 -16.075 -4.926 1.00 0.73 N ATOM 2591 CA LYS B 22 14.451 -16.222 -5.626 1.00 0.79 C ATOM 2592 C LYS B 22 15.535 -16.718 -4.677 1.00 0.88 C ATOM 2593 O LYS B 22 16.080 -17.808 -4.856 1.00 0.96 O ATOM 2594 CB LYS B 22 14.887 -14.900 -6.264 1.00 0.81 C ATOM 2595 CG LYS B 22 14.144 -14.544 -7.537 1.00 1.23 C ATOM 2596 CD LYS B 22 14.860 -13.432 -8.282 1.00 1.30 C ATOM 2597 CE LYS B 22 14.158 -13.071 -9.580 1.00 1.75 C ATOM 2598 NZ LYS B 22 15.000 -12.185 -10.423 1.00 2.10 N ATOM 0 H LYS B 22 13.028 -15.151 -4.523 1.00 0.73 H new ATOM 0 HA LYS B 22 14.307 -16.958 -6.417 1.00 0.79 H new ATOM 0 HB2 LYS B 22 14.747 -14.098 -5.540 1.00 0.81 H new ATOM 0 HB3 LYS B 22 15.954 -14.950 -6.482 1.00 0.81 H new ATOM 0 HG2 LYS B 22 14.064 -15.424 -8.176 1.00 1.23 H new ATOM 0 HG3 LYS B 22 13.128 -14.232 -7.296 1.00 1.23 H new ATOM 0 HD2 LYS B 22 14.920 -12.549 -7.645 1.00 1.30 H new ATOM 0 HD3 LYS B 22 15.883 -13.740 -8.497 1.00 1.30 H new ATOM 0 HE2 LYS B 22 13.919 -13.980 -10.131 1.00 1.75 H new ATOM 0 HE3 LYS B 22 13.213 -12.575 -9.359 1.00 1.75 H new ATOM 0 HZ1 LYS B 22 14.414 -11.754 -11.166 1.00 2.10 H new ATOM 0 HZ2 LYS B 22 15.416 -11.437 -9.833 1.00 2.10 H new ATOM 0 HZ3 LYS B 22 15.760 -12.743 -10.861 1.00 2.10 H new ATOM 2612 N GLU B 23 15.828 -15.915 -3.667 1.00 0.97 N ATOM 2613 CA GLU B 23 16.878 -16.229 -2.704 1.00 1.14 C ATOM 2614 C GLU B 23 16.268 -16.631 -1.367 1.00 1.25 C ATOM 2615 O GLU B 23 16.715 -17.584 -0.727 1.00 1.57 O ATOM 2616 CB GLU B 23 17.797 -15.022 -2.498 1.00 1.46 C ATOM 2617 CG GLU B 23 18.516 -14.560 -3.756 1.00 1.92 C ATOM 2618 CD GLU B 23 19.561 -15.545 -4.232 1.00 2.47 C ATOM 2619 OE1 GLU B 23 20.659 -15.586 -3.638 1.00 2.95 O ATOM 2620 OE2 GLU B 23 19.301 -16.268 -5.214 1.00 3.11 O ATOM 0 H GLU B 23 15.350 -15.032 -3.490 1.00 0.97 H new ATOM 0 HA GLU B 23 17.462 -17.060 -3.099 1.00 1.14 H new ATOM 0 HB2 GLU B 23 17.207 -14.194 -2.106 1.00 1.46 H new ATOM 0 HB3 GLU B 23 18.540 -15.271 -1.740 1.00 1.46 H new ATOM 0 HG2 GLU B 23 17.785 -14.402 -4.549 1.00 1.92 H new ATOM 0 HG3 GLU B 23 18.991 -13.598 -3.564 1.00 1.92 H new ATOM 2627 N GLY B 24 15.250 -15.892 -0.945 1.00 1.31 N ATOM 2628 CA GLY B 24 14.612 -16.167 0.324 1.00 1.56 C ATOM 2629 C GLY B 24 13.467 -17.144 0.191 1.00 1.33 C ATOM 2630 O GLY B 24 13.554 -18.123 -0.560 1.00 1.43 O ATOM 0 H GLY B 24 14.855 -15.106 -1.461 1.00 1.31 H new ATOM 0 HA2 GLY B 24 15.349 -16.568 1.020 1.00 1.56 H new ATOM 0 HA3 GLY B 24 14.243 -15.235 0.752 1.00 1.56 H new ATOM 2634 N ASP B 25 12.403 -16.896 0.933 1.00 1.16 N ATOM 2635 CA ASP B 25 11.220 -17.736 0.867 1.00 1.06 C ATOM 2636 C ASP B 25 10.173 -17.057 -0.008 1.00 0.90 C ATOM 2637 O ASP B 25 10.274 -15.865 -0.276 1.00 0.91 O ATOM 2638 CB ASP B 25 10.669 -17.998 2.271 1.00 1.15 C ATOM 2639 CG ASP B 25 9.712 -19.170 2.308 1.00 1.33 C ATOM 2640 OD1 ASP B 25 8.553 -19.011 1.891 1.00 1.98 O ATOM 2641 OD2 ASP B 25 10.119 -20.264 2.751 1.00 1.82 O ATOM 0 H ASP B 25 12.333 -16.118 1.589 1.00 1.16 H new ATOM 0 HA ASP B 25 11.482 -18.699 0.428 1.00 1.06 H new ATOM 0 HB2 ASP B 25 11.497 -18.188 2.953 1.00 1.15 H new ATOM 0 HB3 ASP B 25 10.158 -17.104 2.630 1.00 1.15 H new ATOM 2646 N LYS B 26 9.147 -17.797 -0.405 1.00 0.95 N ATOM 2647 CA LYS B 26 8.164 -17.314 -1.376 1.00 0.88 C ATOM 2648 C LYS B 26 7.409 -16.088 -0.858 1.00 0.83 C ATOM 2649 O LYS B 26 6.729 -15.397 -1.618 1.00 0.88 O ATOM 2650 CB LYS B 26 7.155 -18.422 -1.702 1.00 1.08 C ATOM 2651 CG LYS B 26 7.793 -19.750 -2.090 1.00 1.43 C ATOM 2652 CD LYS B 26 8.559 -19.665 -3.401 1.00 1.59 C ATOM 2653 CE LYS B 26 7.623 -19.546 -4.595 1.00 1.81 C ATOM 2654 NZ LYS B 26 8.346 -19.679 -5.887 1.00 2.62 N ATOM 0 H LYS B 26 8.970 -18.743 -0.068 1.00 0.95 H new ATOM 0 HA LYS B 26 8.710 -17.028 -2.275 1.00 0.88 H new ATOM 0 HB2 LYS B 26 6.512 -18.579 -0.836 1.00 1.08 H new ATOM 0 HB3 LYS B 26 6.515 -18.087 -2.518 1.00 1.08 H new ATOM 0 HG2 LYS B 26 8.469 -20.070 -1.297 1.00 1.43 H new ATOM 0 HG3 LYS B 26 7.018 -20.511 -2.174 1.00 1.43 H new ATOM 0 HD2 LYS B 26 9.228 -18.805 -3.376 1.00 1.59 H new ATOM 0 HD3 LYS B 26 9.183 -20.551 -3.515 1.00 1.59 H new ATOM 0 HE2 LYS B 26 6.853 -20.315 -4.530 1.00 1.81 H new ATOM 0 HE3 LYS B 26 7.115 -18.582 -4.562 1.00 1.81 H new ATOM 0 HZ1 LYS B 26 7.671 -19.592 -6.673 1.00 2.62 H new ATOM 0 HZ2 LYS B 26 9.063 -18.930 -5.962 1.00 2.62 H new ATOM 0 HZ3 LYS B 26 8.810 -20.609 -5.931 1.00 2.62 H new ATOM 2668 N PHE B 27 7.518 -15.837 0.435 1.00 0.79 N ATOM 2669 CA PHE B 27 6.857 -14.701 1.062 1.00 0.79 C ATOM 2670 C PHE B 27 7.818 -13.904 1.936 1.00 0.71 C ATOM 2671 O PHE B 27 7.396 -13.051 2.714 1.00 0.70 O ATOM 2672 CB PHE B 27 5.647 -15.177 1.871 1.00 0.99 C ATOM 2673 CG PHE B 27 5.905 -16.406 2.695 1.00 0.72 C ATOM 2674 CD1 PHE B 27 6.565 -16.320 3.907 1.00 1.64 C ATOM 2675 CD2 PHE B 27 5.472 -17.646 2.255 1.00 1.53 C ATOM 2676 CE1 PHE B 27 6.793 -17.448 4.667 1.00 2.41 C ATOM 2677 CE2 PHE B 27 5.693 -18.778 3.014 1.00 2.34 C ATOM 2678 CZ PHE B 27 6.355 -18.680 4.221 1.00 2.60 C ATOM 0 H PHE B 27 8.064 -16.410 1.079 1.00 0.79 H new ATOM 0 HA PHE B 27 6.511 -14.033 0.273 1.00 0.79 H new ATOM 0 HB2 PHE B 27 5.325 -14.371 2.531 1.00 0.99 H new ATOM 0 HB3 PHE B 27 4.822 -15.378 1.187 1.00 0.99 H new ATOM 0 HD1 PHE B 27 6.906 -15.359 4.262 1.00 1.64 H new ATOM 0 HD2 PHE B 27 4.957 -17.728 1.309 1.00 1.53 H new ATOM 0 HE1 PHE B 27 7.313 -17.368 5.610 1.00 2.41 H new ATOM 0 HE2 PHE B 27 5.348 -19.740 2.663 1.00 2.34 H new ATOM 0 HZ PHE B 27 6.530 -19.564 4.816 1.00 2.60 H new ATOM 2688 N LYS B 28 9.105 -14.183 1.815 1.00 0.69 N ATOM 2689 CA LYS B 28 10.105 -13.456 2.584 1.00 0.68 C ATOM 2690 C LYS B 28 11.085 -12.760 1.652 1.00 0.50 C ATOM 2691 O LYS B 28 11.778 -13.413 0.873 1.00 0.54 O ATOM 2692 CB LYS B 28 10.878 -14.401 3.505 1.00 0.92 C ATOM 2693 CG LYS B 28 10.014 -15.184 4.480 1.00 0.93 C ATOM 2694 CD LYS B 28 9.370 -14.289 5.525 1.00 0.98 C ATOM 2695 CE LYS B 28 8.716 -15.118 6.620 1.00 1.51 C ATOM 2696 NZ LYS B 28 8.197 -14.279 7.730 1.00 1.98 N ATOM 0 H LYS B 28 9.482 -14.902 1.197 1.00 0.69 H new ATOM 0 HA LYS B 28 9.584 -12.714 3.190 1.00 0.68 H new ATOM 0 HB2 LYS B 28 11.440 -15.105 2.892 1.00 0.92 H new ATOM 0 HB3 LYS B 28 11.606 -13.820 4.071 1.00 0.92 H new ATOM 0 HG2 LYS B 28 9.237 -15.714 3.929 1.00 0.93 H new ATOM 0 HG3 LYS B 28 10.623 -15.939 4.977 1.00 0.93 H new ATOM 0 HD2 LYS B 28 10.123 -13.632 5.961 1.00 0.98 H new ATOM 0 HD3 LYS B 28 8.624 -13.650 5.053 1.00 0.98 H new ATOM 0 HE2 LYS B 28 7.898 -15.698 6.193 1.00 1.51 H new ATOM 0 HE3 LYS B 28 9.440 -15.831 7.014 1.00 1.51 H new ATOM 0 HZ1 LYS B 28 7.884 -14.891 8.511 1.00 1.98 H new ATOM 0 HZ2 LYS B 28 8.949 -13.645 8.067 1.00 1.98 H new ATOM 0 HZ3 LYS B 28 7.393 -13.713 7.391 1.00 1.98 H new ATOM 2710 N LEU B 29 11.147 -11.443 1.733 1.00 0.38 N ATOM 2711 CA LEU B 29 12.117 -10.693 0.949 1.00 0.32 C ATOM 2712 C LEU B 29 13.228 -10.162 1.834 1.00 0.33 C ATOM 2713 O LEU B 29 12.990 -9.328 2.706 1.00 0.42 O ATOM 2714 CB LEU B 29 11.476 -9.514 0.208 1.00 0.29 C ATOM 2715 CG LEU B 29 10.550 -9.876 -0.952 1.00 0.29 C ATOM 2716 CD1 LEU B 29 9.136 -10.070 -0.457 1.00 0.34 C ATOM 2717 CD2 LEU B 29 10.598 -8.803 -2.029 1.00 0.31 C ATOM 0 H LEU B 29 10.544 -10.873 2.327 1.00 0.38 H new ATOM 0 HA LEU B 29 12.522 -11.388 0.214 1.00 0.32 H new ATOM 0 HB2 LEU B 29 10.910 -8.923 0.928 1.00 0.29 H new ATOM 0 HB3 LEU B 29 12.272 -8.875 -0.174 1.00 0.29 H new ATOM 0 HG LEU B 29 10.894 -10.814 -1.389 1.00 0.29 H new ATOM 0 HD11 LEU B 29 8.489 -10.327 -1.296 1.00 0.34 H new ATOM 0 HD12 LEU B 29 9.115 -10.875 0.278 1.00 0.34 H new ATOM 0 HD13 LEU B 29 8.782 -9.148 0.004 1.00 0.34 H new ATOM 0 HD21 LEU B 29 9.932 -9.078 -2.847 1.00 0.31 H new ATOM 0 HD22 LEU B 29 10.280 -7.850 -1.607 1.00 0.31 H new ATOM 0 HD23 LEU B 29 11.617 -8.711 -2.406 1.00 0.31 H new ATOM 2729 N ASN B 30 14.436 -10.646 1.615 1.00 0.31 N ATOM 2730 CA ASN B 30 15.599 -10.073 2.271 1.00 0.31 C ATOM 2731 C ASN B 30 16.071 -8.866 1.471 1.00 0.27 C ATOM 2732 O ASN B 30 15.389 -8.441 0.534 1.00 0.26 O ATOM 2733 CB ASN B 30 16.731 -11.097 2.422 1.00 0.35 C ATOM 2734 CG ASN B 30 17.360 -11.489 1.105 1.00 0.58 C ATOM 2735 OD1 ASN B 30 18.286 -10.835 0.625 1.00 1.17 O ATOM 2736 ND2 ASN B 30 16.891 -12.577 0.533 1.00 0.60 N ATOM 0 H ASN B 30 14.638 -11.429 0.993 1.00 0.31 H new ATOM 0 HA ASN B 30 15.315 -9.764 3.277 1.00 0.31 H new ATOM 0 HB2 ASN B 30 17.500 -10.685 3.076 1.00 0.35 H new ATOM 0 HB3 ASN B 30 16.341 -11.990 2.911 1.00 0.35 H new ATOM 0 HD21 ASN B 30 17.296 -12.908 -0.342 1.00 0.60 H new ATOM 0 HD22 ASN B 30 16.122 -13.089 0.965 1.00 0.60 H new ATOM 2743 N LYS B 31 17.222 -8.314 1.837 1.00 0.27 N ATOM 2744 CA LYS B 31 17.732 -7.112 1.187 1.00 0.26 C ATOM 2745 C LYS B 31 17.812 -7.289 -0.330 1.00 0.25 C ATOM 2746 O LYS B 31 17.347 -6.443 -1.089 1.00 0.28 O ATOM 2747 CB LYS B 31 19.118 -6.746 1.725 1.00 0.29 C ATOM 2748 CG LYS B 31 19.147 -6.501 3.220 1.00 0.40 C ATOM 2749 CD LYS B 31 20.484 -5.940 3.678 1.00 0.49 C ATOM 2750 CE LYS B 31 21.635 -6.890 3.389 1.00 1.20 C ATOM 2751 NZ LYS B 31 21.484 -8.187 4.099 1.00 1.72 N ATOM 0 H LYS B 31 17.819 -8.679 2.579 1.00 0.27 H new ATOM 0 HA LYS B 31 17.033 -6.306 1.411 1.00 0.26 H new ATOM 0 HB2 LYS B 31 19.815 -7.549 1.484 1.00 0.29 H new ATOM 0 HB3 LYS B 31 19.472 -5.852 1.212 1.00 0.29 H new ATOM 0 HG2 LYS B 31 18.351 -5.807 3.489 1.00 0.40 H new ATOM 0 HG3 LYS B 31 18.947 -7.435 3.745 1.00 0.40 H new ATOM 0 HD2 LYS B 31 20.667 -4.988 3.179 1.00 0.49 H new ATOM 0 HD3 LYS B 31 20.443 -5.736 4.748 1.00 0.49 H new ATOM 0 HE2 LYS B 31 21.695 -7.070 2.316 1.00 1.20 H new ATOM 0 HE3 LYS B 31 22.574 -6.422 3.686 1.00 1.20 H new ATOM 0 HZ1 LYS B 31 22.423 -8.596 4.279 1.00 1.72 H new ATOM 0 HZ2 LYS B 31 20.995 -8.033 5.004 1.00 1.72 H new ATOM 0 HZ3 LYS B 31 20.928 -8.841 3.512 1.00 1.72 H new ATOM 2765 N SER B 32 18.381 -8.407 -0.756 1.00 0.25 N ATOM 2766 CA SER B 32 18.590 -8.678 -2.177 1.00 0.27 C ATOM 2767 C SER B 32 17.258 -8.767 -2.929 1.00 0.24 C ATOM 2768 O SER B 32 17.148 -8.309 -4.071 1.00 0.27 O ATOM 2769 CB SER B 32 19.386 -9.978 -2.348 1.00 0.35 C ATOM 2770 OG SER B 32 19.781 -10.180 -3.695 1.00 1.27 O ATOM 0 H SER B 32 18.709 -9.148 -0.136 1.00 0.25 H new ATOM 0 HA SER B 32 19.157 -7.850 -2.602 1.00 0.27 H new ATOM 0 HB2 SER B 32 20.270 -9.950 -1.710 1.00 0.35 H new ATOM 0 HB3 SER B 32 18.780 -10.821 -2.016 1.00 0.35 H new ATOM 0 HG SER B 32 20.287 -11.016 -3.766 1.00 1.27 H new ATOM 2776 N GLU B 33 16.244 -9.322 -2.274 1.00 0.25 N ATOM 2777 CA GLU B 33 14.948 -9.538 -2.910 1.00 0.27 C ATOM 2778 C GLU B 33 14.247 -8.209 -3.124 1.00 0.24 C ATOM 2779 O GLU B 33 13.755 -7.913 -4.213 1.00 0.26 O ATOM 2780 CB GLU B 33 14.068 -10.443 -2.049 1.00 0.34 C ATOM 2781 CG GLU B 33 14.773 -11.686 -1.538 1.00 0.47 C ATOM 2782 CD GLU B 33 15.255 -12.599 -2.643 1.00 0.83 C ATOM 2783 OE1 GLU B 33 16.160 -12.198 -3.405 1.00 1.43 O ATOM 2784 OE2 GLU B 33 14.749 -13.730 -2.735 1.00 1.65 O ATOM 0 H GLU B 33 16.294 -9.631 -1.303 1.00 0.25 H new ATOM 0 HA GLU B 33 15.116 -10.022 -3.872 1.00 0.27 H new ATOM 0 HB2 GLU B 33 13.700 -9.871 -1.197 1.00 0.34 H new ATOM 0 HB3 GLU B 33 13.197 -10.745 -2.630 1.00 0.34 H new ATOM 0 HG2 GLU B 33 15.624 -11.387 -0.927 1.00 0.47 H new ATOM 0 HG3 GLU B 33 14.094 -12.239 -0.890 1.00 0.47 H new ATOM 2791 N LEU B 34 14.214 -7.408 -2.069 1.00 0.21 N ATOM 2792 CA LEU B 34 13.611 -6.089 -2.134 1.00 0.21 C ATOM 2793 C LEU B 34 14.382 -5.193 -3.087 1.00 0.20 C ATOM 2794 O LEU B 34 13.795 -4.367 -3.778 1.00 0.24 O ATOM 2795 CB LEU B 34 13.551 -5.455 -0.748 1.00 0.21 C ATOM 2796 CG LEU B 34 12.329 -5.831 0.085 1.00 0.21 C ATOM 2797 CD1 LEU B 34 12.480 -5.320 1.505 1.00 0.24 C ATOM 2798 CD2 LEU B 34 11.075 -5.256 -0.552 1.00 0.21 C ATOM 0 H LEU B 34 14.599 -7.651 -1.156 1.00 0.21 H new ATOM 0 HA LEU B 34 12.594 -6.201 -2.509 1.00 0.21 H new ATOM 0 HB2 LEU B 34 14.448 -5.738 -0.197 1.00 0.21 H new ATOM 0 HB3 LEU B 34 13.575 -4.371 -0.860 1.00 0.21 H new ATOM 0 HG LEU B 34 12.244 -6.917 0.118 1.00 0.21 H new ATOM 0 HD11 LEU B 34 11.600 -5.596 2.087 1.00 0.24 H new ATOM 0 HD12 LEU B 34 13.368 -5.761 1.958 1.00 0.24 H new ATOM 0 HD13 LEU B 34 12.581 -4.235 1.492 1.00 0.24 H new ATOM 0 HD21 LEU B 34 10.206 -5.527 0.047 1.00 0.21 H new ATOM 0 HD22 LEU B 34 11.157 -4.170 -0.601 1.00 0.21 H new ATOM 0 HD23 LEU B 34 10.962 -5.657 -1.559 1.00 0.21 H new ATOM 2810 N LYS B 35 15.694 -5.361 -3.134 1.00 0.21 N ATOM 2811 CA LYS B 35 16.511 -4.570 -4.035 1.00 0.26 C ATOM 2812 C LYS B 35 16.105 -4.841 -5.471 1.00 0.22 C ATOM 2813 O LYS B 35 15.795 -3.914 -6.204 1.00 0.24 O ATOM 2814 CB LYS B 35 18.001 -4.840 -3.829 1.00 0.37 C ATOM 2815 CG LYS B 35 18.883 -3.750 -4.420 1.00 0.54 C ATOM 2816 CD LYS B 35 20.299 -3.811 -3.877 1.00 0.68 C ATOM 2817 CE LYS B 35 21.042 -5.021 -4.405 1.00 0.61 C ATOM 2818 NZ LYS B 35 22.388 -5.159 -3.792 1.00 0.95 N ATOM 0 H LYS B 35 16.210 -6.031 -2.564 1.00 0.21 H new ATOM 0 HA LYS B 35 16.342 -3.517 -3.812 1.00 0.26 H new ATOM 0 HB2 LYS B 35 18.206 -4.929 -2.762 1.00 0.37 H new ATOM 0 HB3 LYS B 35 18.259 -5.797 -4.284 1.00 0.37 H new ATOM 0 HG2 LYS B 35 18.906 -3.850 -5.505 1.00 0.54 H new ATOM 0 HG3 LYS B 35 18.451 -2.774 -4.199 1.00 0.54 H new ATOM 0 HD2 LYS B 35 20.836 -2.903 -4.153 1.00 0.68 H new ATOM 0 HD3 LYS B 35 20.271 -3.846 -2.788 1.00 0.68 H new ATOM 0 HE2 LYS B 35 20.459 -5.920 -4.205 1.00 0.61 H new ATOM 0 HE3 LYS B 35 21.143 -4.940 -5.487 1.00 0.61 H new ATOM 0 HZ1 LYS B 35 22.944 -5.855 -4.329 1.00 0.95 H new ATOM 0 HZ2 LYS B 35 22.874 -4.240 -3.810 1.00 0.95 H new ATOM 0 HZ3 LYS B 35 22.290 -5.479 -2.807 1.00 0.95 H new ATOM 2832 N GLU B 36 16.064 -6.107 -5.862 1.00 0.22 N ATOM 2833 CA GLU B 36 15.613 -6.453 -7.202 1.00 0.24 C ATOM 2834 C GLU B 36 14.188 -5.974 -7.436 1.00 0.25 C ATOM 2835 O GLU B 36 13.852 -5.508 -8.522 1.00 0.32 O ATOM 2836 CB GLU B 36 15.699 -7.950 -7.452 1.00 0.28 C ATOM 2837 CG GLU B 36 17.008 -8.390 -8.075 1.00 0.65 C ATOM 2838 CD GLU B 36 17.007 -9.857 -8.439 1.00 0.77 C ATOM 2839 OE1 GLU B 36 16.412 -10.208 -9.483 1.00 1.48 O ATOM 2840 OE2 GLU B 36 17.604 -10.662 -7.701 1.00 1.30 O ATOM 0 H GLU B 36 16.333 -6.901 -5.280 1.00 0.22 H new ATOM 0 HA GLU B 36 16.278 -5.949 -7.904 1.00 0.24 H new ATOM 0 HB2 GLU B 36 15.562 -8.476 -6.507 1.00 0.28 H new ATOM 0 HB3 GLU B 36 14.878 -8.248 -8.104 1.00 0.28 H new ATOM 0 HG2 GLU B 36 17.200 -7.797 -8.969 1.00 0.65 H new ATOM 0 HG3 GLU B 36 17.823 -8.191 -7.380 1.00 0.65 H new ATOM 2847 N LEU B 37 13.361 -6.083 -6.406 1.00 0.23 N ATOM 2848 CA LEU B 37 11.990 -5.589 -6.455 1.00 0.26 C ATOM 2849 C LEU B 37 11.970 -4.125 -6.894 1.00 0.22 C ATOM 2850 O LEU B 37 11.390 -3.773 -7.924 1.00 0.22 O ATOM 2851 CB LEU B 37 11.356 -5.703 -5.068 1.00 0.32 C ATOM 2852 CG LEU B 37 9.833 -5.666 -5.035 1.00 0.41 C ATOM 2853 CD1 LEU B 37 9.273 -7.071 -5.176 1.00 0.34 C ATOM 2854 CD2 LEU B 37 9.347 -5.015 -3.750 1.00 0.74 C ATOM 0 H LEU B 37 13.618 -6.513 -5.518 1.00 0.23 H new ATOM 0 HA LEU B 37 11.427 -6.187 -7.172 1.00 0.26 H new ATOM 0 HB2 LEU B 37 11.689 -6.635 -4.612 1.00 0.32 H new ATOM 0 HB3 LEU B 37 11.735 -4.891 -4.447 1.00 0.32 H new ATOM 0 HG LEU B 37 9.476 -5.068 -5.874 1.00 0.41 H new ATOM 0 HD11 LEU B 37 8.184 -7.033 -5.151 1.00 0.34 H new ATOM 0 HD12 LEU B 37 9.600 -7.499 -6.124 1.00 0.34 H new ATOM 0 HD13 LEU B 37 9.633 -7.690 -4.355 1.00 0.34 H new ATOM 0 HD21 LEU B 37 8.257 -4.996 -3.741 1.00 0.74 H new ATOM 0 HD22 LEU B 37 9.707 -5.586 -2.894 1.00 0.74 H new ATOM 0 HD23 LEU B 37 9.728 -3.995 -3.692 1.00 0.74 H new ATOM 2866 N LEU B 38 12.638 -3.287 -6.111 1.00 0.19 N ATOM 2867 CA LEU B 38 12.629 -1.850 -6.332 1.00 0.19 C ATOM 2868 C LEU B 38 13.485 -1.438 -7.536 1.00 0.19 C ATOM 2869 O LEU B 38 13.145 -0.495 -8.232 1.00 0.21 O ATOM 2870 CB LEU B 38 13.086 -1.115 -5.067 1.00 0.19 C ATOM 2871 CG LEU B 38 12.052 -1.046 -3.936 1.00 0.19 C ATOM 2872 CD1 LEU B 38 12.509 -1.854 -2.733 1.00 0.20 C ATOM 2873 CD2 LEU B 38 11.801 0.398 -3.530 1.00 0.20 C ATOM 0 H LEU B 38 13.197 -3.583 -5.311 1.00 0.19 H new ATOM 0 HA LEU B 38 11.602 -1.564 -6.561 1.00 0.19 H new ATOM 0 HB2 LEU B 38 13.983 -1.604 -4.687 1.00 0.19 H new ATOM 0 HB3 LEU B 38 13.369 -0.098 -5.340 1.00 0.19 H new ATOM 0 HG LEU B 38 11.121 -1.475 -4.306 1.00 0.19 H new ATOM 0 HD11 LEU B 38 11.759 -1.789 -1.945 1.00 0.20 H new ATOM 0 HD12 LEU B 38 12.641 -2.896 -3.024 1.00 0.20 H new ATOM 0 HD13 LEU B 38 13.456 -1.457 -2.366 1.00 0.20 H new ATOM 0 HD21 LEU B 38 11.065 0.427 -2.727 1.00 0.20 H new ATOM 0 HD22 LEU B 38 12.733 0.846 -3.185 1.00 0.20 H new ATOM 0 HD23 LEU B 38 11.425 0.957 -4.387 1.00 0.20 H new ATOM 2885 N THR B 39 14.574 -2.145 -7.796 1.00 0.20 N ATOM 2886 CA THR B 39 15.453 -1.789 -8.915 1.00 0.22 C ATOM 2887 C THR B 39 14.739 -1.934 -10.249 1.00 0.23 C ATOM 2888 O THR B 39 14.958 -1.153 -11.177 1.00 0.27 O ATOM 2889 CB THR B 39 16.727 -2.657 -8.958 1.00 0.25 C ATOM 2890 OG1 THR B 39 16.384 -4.043 -8.889 1.00 0.30 O ATOM 2891 CG2 THR B 39 17.656 -2.316 -7.819 1.00 0.27 C ATOM 0 H THR B 39 14.873 -2.959 -7.259 1.00 0.20 H new ATOM 0 HA THR B 39 15.733 -0.749 -8.750 1.00 0.22 H new ATOM 0 HB THR B 39 17.237 -2.452 -9.899 1.00 0.25 H new ATOM 0 HG1 THR B 39 15.412 -4.136 -8.803 1.00 0.30 H new ATOM 0 HG21 THR B 39 18.546 -2.943 -7.875 1.00 0.27 H new ATOM 0 HG22 THR B 39 17.946 -1.268 -7.888 1.00 0.27 H new ATOM 0 HG23 THR B 39 17.148 -2.490 -6.870 1.00 0.27 H new ATOM 2899 N ARG B 40 13.889 -2.939 -10.331 1.00 0.24 N ATOM 2900 CA ARG B 40 13.224 -3.280 -11.570 1.00 0.27 C ATOM 2901 C ARG B 40 11.899 -2.535 -11.713 1.00 0.27 C ATOM 2902 O ARG B 40 11.692 -1.804 -12.683 1.00 0.30 O ATOM 2903 CB ARG B 40 12.994 -4.788 -11.617 1.00 0.31 C ATOM 2904 CG ARG B 40 14.275 -5.606 -11.537 1.00 0.34 C ATOM 2905 CD ARG B 40 15.102 -5.500 -12.804 1.00 0.44 C ATOM 2906 NE ARG B 40 14.431 -6.136 -13.936 1.00 0.64 N ATOM 2907 CZ ARG B 40 14.614 -5.789 -15.211 1.00 0.87 C ATOM 2908 NH1 ARG B 40 15.468 -4.823 -15.532 1.00 1.22 N ATOM 2909 NH2 ARG B 40 13.942 -6.419 -16.169 1.00 1.06 N ATOM 0 H ARG B 40 13.642 -3.539 -9.544 1.00 0.24 H new ATOM 0 HA ARG B 40 13.860 -2.979 -12.403 1.00 0.27 H new ATOM 0 HB2 ARG B 40 12.340 -5.073 -10.793 1.00 0.31 H new ATOM 0 HB3 ARG B 40 12.471 -5.038 -12.540 1.00 0.31 H new ATOM 0 HG2 ARG B 40 14.869 -5.266 -10.688 1.00 0.34 H new ATOM 0 HG3 ARG B 40 14.026 -6.651 -11.354 1.00 0.34 H new ATOM 0 HD2 ARG B 40 15.287 -4.450 -13.032 1.00 0.44 H new ATOM 0 HD3 ARG B 40 16.074 -5.968 -12.646 1.00 0.44 H new ATOM 0 HE ARG B 40 13.780 -6.896 -13.738 1.00 0.64 H new ATOM 0 HH11 ARG B 40 15.990 -4.340 -14.801 1.00 1.22 H new ATOM 0 HH12 ARG B 40 15.602 -4.564 -16.510 1.00 1.22 H new ATOM 0 HH21 ARG B 40 13.289 -7.165 -15.928 1.00 1.06 H new ATOM 0 HH22 ARG B 40 14.079 -6.157 -17.145 1.00 1.06 H new ATOM 2923 N GLU B 41 11.006 -2.716 -10.747 1.00 0.27 N ATOM 2924 CA GLU B 41 9.655 -2.174 -10.855 1.00 0.30 C ATOM 2925 C GLU B 41 9.438 -0.894 -10.050 1.00 0.34 C ATOM 2926 O GLU B 41 8.394 -0.274 -10.176 1.00 0.46 O ATOM 2927 CB GLU B 41 8.615 -3.228 -10.478 1.00 0.36 C ATOM 2928 CG GLU B 41 8.202 -4.103 -11.656 1.00 0.45 C ATOM 2929 CD GLU B 41 7.330 -5.271 -11.244 1.00 0.83 C ATOM 2930 OE1 GLU B 41 6.278 -5.041 -10.617 1.00 1.54 O ATOM 2931 OE2 GLU B 41 7.682 -6.427 -11.570 1.00 1.59 O ATOM 0 H GLU B 41 11.190 -3.230 -9.885 1.00 0.27 H new ATOM 0 HA GLU B 41 9.528 -1.898 -11.902 1.00 0.30 H new ATOM 0 HB2 GLU B 41 9.016 -3.860 -9.686 1.00 0.36 H new ATOM 0 HB3 GLU B 41 7.733 -2.732 -10.074 1.00 0.36 H new ATOM 0 HG2 GLU B 41 7.666 -3.494 -12.384 1.00 0.45 H new ATOM 0 HG3 GLU B 41 9.096 -4.481 -12.153 1.00 0.45 H new ATOM 2938 N LEU B 42 10.393 -0.491 -9.217 1.00 0.27 N ATOM 2939 CA LEU B 42 10.241 0.767 -8.470 1.00 0.28 C ATOM 2940 C LEU B 42 11.447 1.705 -8.641 1.00 0.27 C ATOM 2941 O LEU B 42 11.866 2.334 -7.671 1.00 0.26 O ATOM 2942 CB LEU B 42 10.052 0.506 -6.968 1.00 0.27 C ATOM 2943 CG LEU B 42 8.808 -0.285 -6.565 1.00 0.27 C ATOM 2944 CD1 LEU B 42 9.059 -1.775 -6.663 1.00 0.26 C ATOM 2945 CD2 LEU B 42 8.379 0.090 -5.157 1.00 0.32 C ATOM 0 H LEU B 42 11.261 -0.997 -9.040 1.00 0.27 H new ATOM 0 HA LEU B 42 9.355 1.248 -8.885 1.00 0.28 H new ATOM 0 HB2 LEU B 42 10.929 -0.027 -6.601 1.00 0.27 H new ATOM 0 HB3 LEU B 42 10.026 1.467 -6.455 1.00 0.27 H new ATOM 0 HG LEU B 42 8.004 -0.032 -7.256 1.00 0.27 H new ATOM 0 HD11 LEU B 42 8.159 -2.316 -6.371 1.00 0.26 H new ATOM 0 HD12 LEU B 42 9.321 -2.033 -7.689 1.00 0.26 H new ATOM 0 HD13 LEU B 42 9.879 -2.050 -5.999 1.00 0.26 H new ATOM 0 HD21 LEU B 42 7.492 -0.481 -4.883 1.00 0.32 H new ATOM 0 HD22 LEU B 42 9.185 -0.135 -4.459 1.00 0.32 H new ATOM 0 HD23 LEU B 42 8.152 1.155 -5.118 1.00 0.32 H new ATOM 2957 N PRO B 43 11.996 1.873 -9.864 1.00 0.31 N ATOM 2958 CA PRO B 43 13.247 2.617 -10.056 1.00 0.33 C ATOM 2959 C PRO B 43 13.100 4.092 -9.692 1.00 0.33 C ATOM 2960 O PRO B 43 14.052 4.736 -9.244 1.00 0.36 O ATOM 2961 CB PRO B 43 13.545 2.466 -11.553 1.00 0.41 C ATOM 2962 CG PRO B 43 12.658 1.364 -12.026 1.00 0.51 C ATOM 2963 CD PRO B 43 11.445 1.411 -11.147 1.00 0.35 C ATOM 0 HA PRO B 43 14.043 2.236 -9.416 1.00 0.33 H new ATOM 0 HB2 PRO B 43 13.340 3.392 -12.089 1.00 0.41 H new ATOM 0 HB3 PRO B 43 14.595 2.225 -11.722 1.00 0.41 H new ATOM 0 HG2 PRO B 43 12.388 1.501 -13.073 1.00 0.51 H new ATOM 0 HG3 PRO B 43 13.159 0.399 -11.950 1.00 0.51 H new ATOM 0 HD2 PRO B 43 10.690 2.096 -11.534 1.00 0.35 H new ATOM 0 HD3 PRO B 43 10.972 0.433 -11.056 1.00 0.35 H new ATOM 2971 N SER B 44 11.894 4.612 -9.881 1.00 0.36 N ATOM 2972 CA SER B 44 11.601 6.010 -9.604 1.00 0.39 C ATOM 2973 C SER B 44 11.582 6.289 -8.099 1.00 0.35 C ATOM 2974 O SER B 44 11.998 7.357 -7.653 1.00 0.40 O ATOM 2975 CB SER B 44 10.250 6.375 -10.215 1.00 0.46 C ATOM 2976 OG SER B 44 10.174 5.933 -11.561 1.00 1.09 O ATOM 0 H SER B 44 11.097 4.079 -10.229 1.00 0.36 H new ATOM 0 HA SER B 44 12.388 6.620 -10.048 1.00 0.39 H new ATOM 0 HB2 SER B 44 9.447 5.923 -9.632 1.00 0.46 H new ATOM 0 HB3 SER B 44 10.105 7.455 -10.173 1.00 0.46 H new ATOM 0 HG SER B 44 9.446 5.284 -11.651 1.00 1.09 H new ATOM 2982 N PHE B 45 11.110 5.322 -7.322 1.00 0.30 N ATOM 2983 CA PHE B 45 10.968 5.486 -5.882 1.00 0.28 C ATOM 2984 C PHE B 45 12.262 5.155 -5.161 1.00 0.28 C ATOM 2985 O PHE B 45 12.244 4.837 -3.982 1.00 0.27 O ATOM 2986 CB PHE B 45 9.860 4.574 -5.343 1.00 0.31 C ATOM 2987 CG PHE B 45 8.614 4.559 -6.172 1.00 0.28 C ATOM 2988 CD1 PHE B 45 7.714 5.610 -6.131 1.00 1.17 C ATOM 2989 CD2 PHE B 45 8.341 3.477 -6.988 1.00 1.28 C ATOM 2990 CE1 PHE B 45 6.563 5.578 -6.892 1.00 1.18 C ATOM 2991 CE2 PHE B 45 7.195 3.438 -7.748 1.00 1.34 C ATOM 2992 CZ PHE B 45 6.303 4.487 -7.701 1.00 0.47 C ATOM 0 H PHE B 45 10.817 4.409 -7.670 1.00 0.30 H new ATOM 0 HA PHE B 45 10.712 6.530 -5.699 1.00 0.28 H new ATOM 0 HB2 PHE B 45 10.246 3.557 -5.271 1.00 0.31 H new ATOM 0 HB3 PHE B 45 9.605 4.891 -4.332 1.00 0.31 H new ATOM 0 HD1 PHE B 45 7.914 6.462 -5.498 1.00 1.17 H new ATOM 0 HD2 PHE B 45 9.036 2.652 -7.029 1.00 1.28 H new ATOM 0 HE1 PHE B 45 5.867 6.403 -6.856 1.00 1.18 H new ATOM 0 HE2 PHE B 45 6.995 2.586 -8.381 1.00 1.34 H new ATOM 0 HZ PHE B 45 5.402 4.457 -8.295 1.00 0.47 H new ATOM 3002 N LEU B 46 13.384 5.220 -5.855 1.00 0.32 N ATOM 3003 CA LEU B 46 14.661 5.007 -5.193 1.00 0.33 C ATOM 3004 C LEU B 46 15.350 6.340 -4.948 1.00 0.39 C ATOM 3005 O LEU B 46 16.240 6.451 -4.102 1.00 0.47 O ATOM 3006 CB LEU B 46 15.564 4.064 -6.002 1.00 0.35 C ATOM 3007 CG LEU B 46 14.915 2.740 -6.419 1.00 0.32 C ATOM 3008 CD1 LEU B 46 15.974 1.721 -6.805 1.00 0.41 C ATOM 3009 CD2 LEU B 46 14.006 2.201 -5.319 1.00 0.30 C ATOM 0 H LEU B 46 13.440 5.414 -6.855 1.00 0.32 H new ATOM 0 HA LEU B 46 14.470 4.528 -4.233 1.00 0.33 H new ATOM 0 HB2 LEU B 46 15.897 4.586 -6.899 1.00 0.35 H new ATOM 0 HB3 LEU B 46 16.454 3.844 -5.413 1.00 0.35 H new ATOM 0 HG LEU B 46 14.294 2.929 -7.294 1.00 0.32 H new ATOM 0 HD11 LEU B 46 15.492 0.788 -7.098 1.00 0.41 H new ATOM 0 HD12 LEU B 46 16.560 2.104 -7.640 1.00 0.41 H new ATOM 0 HD13 LEU B 46 16.631 1.539 -5.954 1.00 0.41 H new ATOM 0 HD21 LEU B 46 13.560 1.261 -5.644 1.00 0.30 H new ATOM 0 HD22 LEU B 46 14.590 2.032 -4.414 1.00 0.30 H new ATOM 0 HD23 LEU B 46 13.217 2.924 -5.112 1.00 0.30 H new ATOM 3021 N GLY B 47 14.918 7.355 -5.690 1.00 0.41 N ATOM 3022 CA GLY B 47 15.471 8.696 -5.565 1.00 0.49 C ATOM 3023 C GLY B 47 16.882 8.813 -6.117 1.00 0.53 C ATOM 3024 O GLY B 47 17.260 9.845 -6.670 1.00 0.60 O ATOM 0 H GLY B 47 14.180 7.271 -6.389 1.00 0.41 H new ATOM 0 HA2 GLY B 47 14.823 9.400 -6.088 1.00 0.49 H new ATOM 0 HA3 GLY B 47 15.473 8.985 -4.514 1.00 0.49 H new ATOM 3028 N LYS B 48 17.651 7.748 -5.981 1.00 0.54 N ATOM 3029 CA LYS B 48 18.970 7.668 -6.578 1.00 0.67 C ATOM 3030 C LYS B 48 19.245 6.243 -7.034 1.00 0.70 C ATOM 3031 O LYS B 48 19.233 5.960 -8.232 1.00 1.18 O ATOM 3032 CB LYS B 48 20.046 8.132 -5.588 1.00 0.82 C ATOM 3033 CG LYS B 48 21.456 8.124 -6.165 1.00 1.41 C ATOM 3034 CD LYS B 48 21.582 9.047 -7.372 1.00 2.04 C ATOM 3035 CE LYS B 48 21.421 10.515 -6.992 1.00 2.61 C ATOM 3036 NZ LYS B 48 22.500 10.973 -6.076 1.00 3.21 N ATOM 0 H LYS B 48 17.379 6.917 -5.455 1.00 0.54 H new ATOM 0 HA LYS B 48 19.001 8.330 -7.444 1.00 0.67 H new ATOM 0 HB2 LYS B 48 19.807 9.141 -5.252 1.00 0.82 H new ATOM 0 HB3 LYS B 48 20.019 7.488 -4.709 1.00 0.82 H new ATOM 0 HG2 LYS B 48 22.164 8.433 -5.396 1.00 1.41 H new ATOM 0 HG3 LYS B 48 21.724 7.108 -6.455 1.00 1.41 H new ATOM 0 HD2 LYS B 48 22.555 8.899 -7.841 1.00 2.04 H new ATOM 0 HD3 LYS B 48 20.828 8.780 -8.112 1.00 2.04 H new ATOM 0 HE2 LYS B 48 21.427 11.126 -7.894 1.00 2.61 H new ATOM 0 HE3 LYS B 48 20.452 10.662 -6.514 1.00 2.61 H new ATOM 0 HZ1 LYS B 48 22.487 12.011 -6.016 1.00 3.21 H new ATOM 0 HZ2 LYS B 48 22.347 10.570 -5.130 1.00 3.21 H new ATOM 0 HZ3 LYS B 48 23.422 10.659 -6.441 1.00 3.21 H new ATOM 3050 N ARG B 49 19.464 5.349 -6.077 1.00 0.54 N ATOM 3051 CA ARG B 49 19.727 3.947 -6.375 1.00 0.54 C ATOM 3052 C ARG B 49 19.870 3.154 -5.083 1.00 0.51 C ATOM 3053 O ARG B 49 20.300 3.694 -4.064 1.00 0.55 O ATOM 3054 CB ARG B 49 20.999 3.805 -7.220 1.00 0.66 C ATOM 3055 CG ARG B 49 21.218 2.402 -7.762 1.00 0.74 C ATOM 3056 CD ARG B 49 20.045 1.953 -8.620 1.00 0.73 C ATOM 3057 NE ARG B 49 19.917 2.738 -9.845 1.00 1.28 N ATOM 3058 CZ ARG B 49 18.977 2.527 -10.764 1.00 1.46 C ATOM 3059 NH1 ARG B 49 18.138 1.506 -10.632 1.00 1.43 N ATOM 3060 NH2 ARG B 49 18.890 3.319 -11.824 1.00 2.26 N ATOM 0 H ARG B 49 19.464 5.573 -5.082 1.00 0.54 H new ATOM 0 HA ARG B 49 18.885 3.552 -6.944 1.00 0.54 H new ATOM 0 HB2 ARG B 49 20.950 4.504 -8.055 1.00 0.66 H new ATOM 0 HB3 ARG B 49 21.860 4.090 -6.616 1.00 0.66 H new ATOM 0 HG2 ARG B 49 22.134 2.376 -8.352 1.00 0.74 H new ATOM 0 HG3 ARG B 49 21.353 1.707 -6.934 1.00 0.74 H new ATOM 0 HD2 ARG B 49 20.169 0.901 -8.877 1.00 0.73 H new ATOM 0 HD3 ARG B 49 19.124 2.034 -8.042 1.00 0.73 H new ATOM 0 HE ARG B 49 20.586 3.491 -10.006 1.00 1.28 H new ATOM 0 HH11 ARG B 49 18.214 0.884 -9.827 1.00 1.43 H new ATOM 0 HH12 ARG B 49 17.418 1.344 -11.336 1.00 1.43 H new ATOM 0 HH21 ARG B 49 19.545 4.093 -11.937 1.00 2.26 H new ATOM 0 HH22 ARG B 49 18.169 3.154 -12.526 1.00 2.26 H new ATOM 3074 N THR B 50 19.497 1.884 -5.128 1.00 0.51 N ATOM 3075 CA THR B 50 19.603 1.012 -3.975 1.00 0.51 C ATOM 3076 C THR B 50 20.978 0.354 -3.897 1.00 0.61 C ATOM 3077 O THR B 50 21.248 -0.626 -4.589 1.00 0.82 O ATOM 3078 CB THR B 50 18.518 -0.072 -4.019 1.00 0.57 C ATOM 3079 OG1 THR B 50 18.401 -0.579 -5.353 1.00 0.69 O ATOM 3080 CG2 THR B 50 17.176 0.472 -3.558 1.00 0.57 C ATOM 0 H THR B 50 19.115 1.434 -5.960 1.00 0.51 H new ATOM 0 HA THR B 50 19.464 1.628 -3.087 1.00 0.51 H new ATOM 0 HB THR B 50 18.809 -0.875 -3.341 1.00 0.57 H new ATOM 0 HG1 THR B 50 19.291 -0.802 -5.697 1.00 0.69 H new ATOM 0 HG21 THR B 50 16.428 -0.320 -3.601 1.00 0.57 H new ATOM 0 HG22 THR B 50 17.263 0.834 -2.534 1.00 0.57 H new ATOM 0 HG23 THR B 50 16.873 1.292 -4.209 1.00 0.57 H new ATOM 3088 N ASP B 51 21.851 0.905 -3.067 1.00 0.58 N ATOM 3089 CA ASP B 51 23.181 0.339 -2.883 1.00 0.72 C ATOM 3090 C ASP B 51 23.256 -0.393 -1.554 1.00 0.60 C ATOM 3091 O ASP B 51 22.358 -0.266 -0.725 1.00 0.58 O ATOM 3092 CB ASP B 51 24.256 1.422 -2.938 1.00 0.91 C ATOM 3093 CG ASP B 51 24.215 2.227 -4.223 1.00 1.35 C ATOM 3094 OD1 ASP B 51 24.546 1.670 -5.293 1.00 1.98 O ATOM 3095 OD2 ASP B 51 23.858 3.421 -4.169 1.00 1.91 O ATOM 0 H ASP B 51 21.665 1.740 -2.512 1.00 0.58 H new ATOM 0 HA ASP B 51 23.363 -0.364 -3.696 1.00 0.72 H new ATOM 0 HB2 ASP B 51 24.131 2.095 -2.089 1.00 0.91 H new ATOM 0 HB3 ASP B 51 25.237 0.959 -2.836 1.00 0.91 H new ATOM 3100 N GLU B 52 24.340 -1.121 -1.340 1.00 0.68 N ATOM 3101 CA GLU B 52 24.452 -2.016 -0.194 1.00 0.66 C ATOM 3102 C GLU B 52 24.573 -1.267 1.134 1.00 0.55 C ATOM 3103 O GLU B 52 23.913 -1.629 2.110 1.00 0.50 O ATOM 3104 CB GLU B 52 25.632 -2.970 -0.369 1.00 0.83 C ATOM 3105 CG GLU B 52 25.400 -4.043 -1.424 1.00 1.57 C ATOM 3106 CD GLU B 52 25.467 -3.522 -2.844 1.00 2.22 C ATOM 3107 OE1 GLU B 52 26.586 -3.262 -3.332 1.00 2.89 O ATOM 3108 OE2 GLU B 52 24.405 -3.373 -3.479 1.00 2.79 O ATOM 0 H GLU B 52 25.160 -1.111 -1.947 1.00 0.68 H new ATOM 0 HA GLU B 52 23.525 -2.589 -0.156 1.00 0.66 H new ATOM 0 HB2 GLU B 52 26.517 -2.394 -0.638 1.00 0.83 H new ATOM 0 HB3 GLU B 52 25.843 -3.451 0.586 1.00 0.83 H new ATOM 0 HG2 GLU B 52 26.144 -4.830 -1.299 1.00 1.57 H new ATOM 0 HG3 GLU B 52 24.423 -4.498 -1.259 1.00 1.57 H new ATOM 3115 N ALA B 53 25.400 -0.228 1.176 1.00 0.58 N ATOM 3116 CA ALA B 53 25.607 0.527 2.413 1.00 0.58 C ATOM 3117 C ALA B 53 24.336 1.261 2.824 1.00 0.53 C ATOM 3118 O ALA B 53 24.131 1.575 3.996 1.00 0.58 O ATOM 3119 CB ALA B 53 26.761 1.505 2.263 1.00 0.70 C ATOM 0 H ALA B 53 25.935 0.111 0.377 1.00 0.58 H new ATOM 0 HA ALA B 53 25.859 -0.184 3.200 1.00 0.58 H new ATOM 0 HB1 ALA B 53 26.896 2.054 3.195 1.00 0.70 H new ATOM 0 HB2 ALA B 53 27.674 0.957 2.029 1.00 0.70 H new ATOM 0 HB3 ALA B 53 26.542 2.205 1.457 1.00 0.70 H new ATOM 3125 N ALA B 54 23.487 1.537 1.850 1.00 0.52 N ATOM 3126 CA ALA B 54 22.195 2.145 2.112 1.00 0.51 C ATOM 3127 C ALA B 54 21.163 1.077 2.443 1.00 0.39 C ATOM 3128 O ALA B 54 20.302 1.268 3.301 1.00 0.35 O ATOM 3129 CB ALA B 54 21.740 2.950 0.909 1.00 0.63 C ATOM 0 H ALA B 54 23.671 1.348 0.865 1.00 0.52 H new ATOM 0 HA ALA B 54 22.295 2.813 2.967 1.00 0.51 H new ATOM 0 HB1 ALA B 54 20.770 3.401 1.119 1.00 0.63 H new ATOM 0 HB2 ALA B 54 22.467 3.735 0.700 1.00 0.63 H new ATOM 0 HB3 ALA B 54 21.656 2.294 0.043 1.00 0.63 H new ATOM 3135 N PHE B 55 21.252 -0.049 1.751 1.00 0.38 N ATOM 3136 CA PHE B 55 20.280 -1.124 1.907 1.00 0.32 C ATOM 3137 C PHE B 55 20.406 -1.807 3.260 1.00 0.31 C ATOM 3138 O PHE B 55 19.432 -2.365 3.769 1.00 0.31 O ATOM 3139 CB PHE B 55 20.425 -2.156 0.795 1.00 0.41 C ATOM 3140 CG PHE B 55 19.106 -2.623 0.270 1.00 0.36 C ATOM 3141 CD1 PHE B 55 18.268 -3.400 1.054 1.00 1.23 C ATOM 3142 CD2 PHE B 55 18.693 -2.272 -0.998 1.00 1.25 C ATOM 3143 CE1 PHE B 55 17.044 -3.818 0.577 1.00 1.30 C ATOM 3144 CE2 PHE B 55 17.474 -2.687 -1.482 1.00 1.22 C ATOM 3145 CZ PHE B 55 16.647 -3.463 -0.694 1.00 0.46 C ATOM 0 H PHE B 55 21.989 -0.244 1.074 1.00 0.38 H new ATOM 0 HA PHE B 55 19.291 -0.669 1.845 1.00 0.32 H new ATOM 0 HB2 PHE B 55 21.005 -1.726 -0.021 1.00 0.41 H new ATOM 0 HB3 PHE B 55 20.987 -3.012 1.169 1.00 0.41 H new ATOM 0 HD1 PHE B 55 18.577 -3.681 2.050 1.00 1.23 H new ATOM 0 HD2 PHE B 55 19.334 -1.664 -1.619 1.00 1.25 H new ATOM 0 HE1 PHE B 55 16.398 -4.422 1.197 1.00 1.30 H new ATOM 0 HE2 PHE B 55 17.164 -2.406 -2.478 1.00 1.22 H new ATOM 0 HZ PHE B 55 15.691 -3.791 -1.073 1.00 0.46 H new ATOM 3155 N GLN B 56 21.596 -1.761 3.848 1.00 0.35 N ATOM 3156 CA GLN B 56 21.793 -2.302 5.187 1.00 0.41 C ATOM 3157 C GLN B 56 20.996 -1.485 6.199 1.00 0.42 C ATOM 3158 O GLN B 56 20.783 -1.913 7.334 1.00 0.52 O ATOM 3159 CB GLN B 56 23.275 -2.335 5.563 1.00 0.51 C ATOM 3160 CG GLN B 56 23.914 -0.966 5.680 1.00 0.53 C ATOM 3161 CD GLN B 56 25.382 -1.045 6.040 1.00 0.69 C ATOM 3162 OE1 GLN B 56 26.075 -1.998 5.677 1.00 1.15 O ATOM 3163 NE2 GLN B 56 25.866 -0.049 6.762 1.00 1.53 N ATOM 0 H GLN B 56 22.432 -1.359 3.423 1.00 0.35 H new ATOM 0 HA GLN B 56 21.431 -3.330 5.198 1.00 0.41 H new ATOM 0 HB2 GLN B 56 23.386 -2.858 6.513 1.00 0.51 H new ATOM 0 HB3 GLN B 56 23.816 -2.914 4.814 1.00 0.51 H new ATOM 0 HG2 GLN B 56 23.802 -0.434 4.735 1.00 0.53 H new ATOM 0 HG3 GLN B 56 23.387 -0.385 6.437 1.00 0.53 H new ATOM 0 HE21 GLN B 56 25.258 0.721 7.041 1.00 1.53 H new ATOM 0 HE22 GLN B 56 26.848 -0.050 7.040 1.00 1.53 H new ATOM 3172 N LYS B 57 20.578 -0.296 5.781 1.00 0.36 N ATOM 3173 CA LYS B 57 19.618 0.488 6.537 1.00 0.39 C ATOM 3174 C LYS B 57 18.214 0.069 6.120 1.00 0.34 C ATOM 3175 O LYS B 57 17.389 -0.278 6.953 1.00 0.41 O ATOM 3176 CB LYS B 57 19.782 1.988 6.262 1.00 0.44 C ATOM 3177 CG LYS B 57 21.210 2.500 6.350 1.00 0.54 C ATOM 3178 CD LYS B 57 21.288 3.960 5.916 1.00 0.61 C ATOM 3179 CE LYS B 57 22.726 4.449 5.845 1.00 0.79 C ATOM 3180 NZ LYS B 57 23.425 4.333 7.151 1.00 1.27 N ATOM 0 H LYS B 57 20.893 0.145 4.917 1.00 0.36 H new ATOM 0 HA LYS B 57 19.785 0.310 7.599 1.00 0.39 H new ATOM 0 HB2 LYS B 57 19.394 2.205 5.267 1.00 0.44 H new ATOM 0 HB3 LYS B 57 19.168 2.542 6.972 1.00 0.44 H new ATOM 0 HG2 LYS B 57 21.575 2.399 7.372 1.00 0.54 H new ATOM 0 HG3 LYS B 57 21.859 1.893 5.719 1.00 0.54 H new ATOM 0 HD2 LYS B 57 20.816 4.075 4.940 1.00 0.61 H new ATOM 0 HD3 LYS B 57 20.727 4.579 6.617 1.00 0.61 H new ATOM 0 HE2 LYS B 57 23.267 3.874 5.093 1.00 0.79 H new ATOM 0 HE3 LYS B 57 22.738 5.489 5.520 1.00 0.79 H new ATOM 0 HZ1 LYS B 57 24.359 4.785 7.086 1.00 1.27 H new ATOM 0 HZ2 LYS B 57 22.863 4.804 7.889 1.00 1.27 H new ATOM 0 HZ3 LYS B 57 23.543 3.329 7.394 1.00 1.27 H new ATOM 3194 N LEU B 58 17.995 0.061 4.803 1.00 0.27 N ATOM 3195 CA LEU B 58 16.671 -0.134 4.206 1.00 0.25 C ATOM 3196 C LEU B 58 15.935 -1.341 4.774 1.00 0.24 C ATOM 3197 O LEU B 58 14.837 -1.204 5.309 1.00 0.26 O ATOM 3198 CB LEU B 58 16.796 -0.283 2.689 1.00 0.22 C ATOM 3199 CG LEU B 58 15.469 -0.253 1.936 1.00 0.22 C ATOM 3200 CD1 LEU B 58 14.809 1.094 2.113 1.00 0.26 C ATOM 3201 CD2 LEU B 58 15.669 -0.532 0.461 1.00 0.23 C ATOM 0 H LEU B 58 18.737 0.191 4.115 1.00 0.27 H new ATOM 0 HA LEU B 58 16.084 0.750 4.453 1.00 0.25 H new ATOM 0 HB2 LEU B 58 17.432 0.517 2.310 1.00 0.22 H new ATOM 0 HB3 LEU B 58 17.302 -1.223 2.470 1.00 0.22 H new ATOM 0 HG LEU B 58 14.829 -1.033 2.348 1.00 0.22 H new ATOM 0 HD11 LEU B 58 13.862 1.109 1.573 1.00 0.26 H new ATOM 0 HD12 LEU B 58 14.625 1.273 3.172 1.00 0.26 H new ATOM 0 HD13 LEU B 58 15.462 1.874 1.721 1.00 0.26 H new ATOM 0 HD21 LEU B 58 14.706 -0.504 -0.048 1.00 0.23 H new ATOM 0 HD22 LEU B 58 16.328 0.224 0.034 1.00 0.23 H new ATOM 0 HD23 LEU B 58 16.118 -1.517 0.335 1.00 0.23 H new ATOM 3213 N MET B 59 16.532 -2.513 4.635 1.00 0.24 N ATOM 3214 CA MET B 59 15.936 -3.745 5.144 1.00 0.27 C ATOM 3215 C MET B 59 15.549 -3.611 6.612 1.00 0.34 C ATOM 3216 O MET B 59 14.415 -3.888 6.985 1.00 0.41 O ATOM 3217 CB MET B 59 16.908 -4.908 4.950 1.00 0.28 C ATOM 3218 CG MET B 59 16.596 -6.148 5.778 1.00 0.30 C ATOM 3219 SD MET B 59 14.924 -6.783 5.548 1.00 0.31 S ATOM 3220 CE MET B 59 14.836 -6.912 3.769 1.00 0.25 C ATOM 0 H MET B 59 17.432 -2.641 4.173 1.00 0.24 H new ATOM 0 HA MET B 59 15.024 -3.942 4.581 1.00 0.27 H new ATOM 0 HB2 MET B 59 16.915 -5.185 3.896 1.00 0.28 H new ATOM 0 HB3 MET B 59 17.914 -4.567 5.197 1.00 0.28 H new ATOM 0 HG2 MET B 59 17.309 -6.932 5.523 1.00 0.30 H new ATOM 0 HG3 MET B 59 16.743 -5.914 6.832 1.00 0.30 H new ATOM 0 HE1 MET B 59 13.891 -7.375 3.484 1.00 0.25 H new ATOM 0 HE2 MET B 59 14.900 -5.917 3.328 1.00 0.25 H new ATOM 0 HE3 MET B 59 15.663 -7.523 3.407 1.00 0.25 H new ATOM 3230 N SER B 60 16.484 -3.154 7.428 1.00 0.39 N ATOM 3231 CA SER B 60 16.253 -3.023 8.857 1.00 0.51 C ATOM 3232 C SER B 60 15.352 -1.828 9.178 1.00 0.44 C ATOM 3233 O SER B 60 14.970 -1.613 10.329 1.00 0.51 O ATOM 3234 CB SER B 60 17.592 -2.904 9.580 1.00 0.70 C ATOM 3235 OG SER B 60 18.378 -1.849 9.047 1.00 1.36 O ATOM 0 H SER B 60 17.414 -2.866 7.124 1.00 0.39 H new ATOM 0 HA SER B 60 15.733 -3.916 9.205 1.00 0.51 H new ATOM 0 HB2 SER B 60 17.419 -2.730 10.642 1.00 0.70 H new ATOM 0 HB3 SER B 60 18.137 -3.844 9.496 1.00 0.70 H new ATOM 0 HG SER B 60 17.861 -1.366 8.369 1.00 1.36 H new ATOM 3241 N ASN B 61 15.016 -1.054 8.153 1.00 0.37 N ATOM 3242 CA ASN B 61 14.111 0.071 8.309 1.00 0.42 C ATOM 3243 C ASN B 61 12.687 -0.395 8.072 1.00 0.44 C ATOM 3244 O ASN B 61 11.747 0.127 8.664 1.00 0.64 O ATOM 3245 CB ASN B 61 14.488 1.218 7.376 1.00 0.46 C ATOM 3246 CG ASN B 61 15.565 2.113 7.967 1.00 0.47 C ATOM 3247 OD1 ASN B 61 15.518 3.391 7.633 1.00 0.96 O flip ATOM 3248 ND2 ASN B 61 16.424 1.666 8.727 1.00 0.92 N flip ATOM 0 H ASN B 61 15.360 -1.188 7.202 1.00 0.37 H new ATOM 0 HA ASN B 61 14.191 0.455 9.326 1.00 0.42 H new ATOM 0 HB2 ASN B 61 14.837 0.811 6.427 1.00 0.46 H new ATOM 0 HB3 ASN B 61 13.601 1.814 7.160 1.00 0.46 H new ATOM 0 HD21 ASN B 61 16.430 0.674 8.963 1.00 0.92 H new ATOM 0 HD22 ASN B 61 17.130 2.288 9.121 1.00 0.92 H new ATOM 3255 N LEU B 62 12.540 -1.400 7.217 1.00 0.33 N ATOM 3256 CA LEU B 62 11.258 -2.061 7.039 1.00 0.39 C ATOM 3257 C LEU B 62 11.063 -3.100 8.133 1.00 0.54 C ATOM 3258 O LEU B 62 10.170 -2.978 8.968 1.00 1.18 O ATOM 3259 CB LEU B 62 11.171 -2.749 5.670 1.00 0.35 C ATOM 3260 CG LEU B 62 10.756 -1.870 4.487 1.00 0.25 C ATOM 3261 CD1 LEU B 62 9.449 -1.150 4.784 1.00 0.24 C ATOM 3262 CD2 LEU B 62 11.853 -0.889 4.114 1.00 0.22 C ATOM 0 H LEU B 62 13.293 -1.773 6.638 1.00 0.33 H new ATOM 0 HA LEU B 62 10.477 -1.303 7.096 1.00 0.39 H new ATOM 0 HB2 LEU B 62 12.144 -3.185 5.445 1.00 0.35 H new ATOM 0 HB3 LEU B 62 10.462 -3.573 5.747 1.00 0.35 H new ATOM 0 HG LEU B 62 10.596 -2.520 3.627 1.00 0.25 H new ATOM 0 HD11 LEU B 62 9.172 -0.531 3.930 1.00 0.24 H new ATOM 0 HD12 LEU B 62 8.664 -1.883 4.970 1.00 0.24 H new ATOM 0 HD13 LEU B 62 9.573 -0.519 5.664 1.00 0.24 H new ATOM 0 HD21 LEU B 62 11.526 -0.281 3.271 1.00 0.22 H new ATOM 0 HD22 LEU B 62 12.069 -0.243 4.965 1.00 0.22 H new ATOM 0 HD23 LEU B 62 12.753 -1.438 3.838 1.00 0.22 H new ATOM 3274 N ASP B 63 11.947 -4.095 8.126 1.00 0.31 N ATOM 3275 CA ASP B 63 11.880 -5.238 9.033 1.00 0.33 C ATOM 3276 C ASP B 63 11.787 -4.775 10.487 1.00 0.37 C ATOM 3277 O ASP B 63 12.707 -4.138 11.011 1.00 0.43 O ATOM 3278 CB ASP B 63 13.120 -6.118 8.826 1.00 0.40 C ATOM 3279 CG ASP B 63 13.039 -7.460 9.524 1.00 0.38 C ATOM 3280 OD1 ASP B 63 12.282 -7.584 10.504 1.00 1.08 O ATOM 3281 OD2 ASP B 63 13.756 -8.395 9.103 1.00 1.15 O ATOM 0 H ASP B 63 12.738 -4.131 7.484 1.00 0.31 H new ATOM 0 HA ASP B 63 10.983 -5.817 8.812 1.00 0.33 H new ATOM 0 HB2 ASP B 63 13.264 -6.282 7.758 1.00 0.40 H new ATOM 0 HB3 ASP B 63 13.998 -5.583 9.187 1.00 0.40 H new ATOM 3286 N SER B 64 10.668 -5.092 11.123 1.00 0.43 N ATOM 3287 CA SER B 64 10.398 -4.662 12.487 1.00 0.52 C ATOM 3288 C SER B 64 11.314 -5.341 13.506 1.00 0.58 C ATOM 3289 O SER B 64 11.773 -4.700 14.452 1.00 0.71 O ATOM 3290 CB SER B 64 8.939 -4.943 12.837 1.00 0.67 C ATOM 3291 OG SER B 64 8.065 -4.222 11.986 1.00 1.14 O ATOM 0 H SER B 64 9.924 -5.653 10.709 1.00 0.43 H new ATOM 0 HA SER B 64 10.597 -3.591 12.535 1.00 0.52 H new ATOM 0 HB2 SER B 64 8.739 -6.011 12.749 1.00 0.67 H new ATOM 0 HB3 SER B 64 8.751 -4.668 13.875 1.00 0.67 H new ATOM 0 HG SER B 64 7.716 -4.820 11.293 1.00 1.14 H new ATOM 3297 N ASN B 65 11.582 -6.628 13.323 1.00 0.60 N ATOM 3298 CA ASN B 65 12.405 -7.362 14.282 1.00 0.75 C ATOM 3299 C ASN B 65 13.833 -7.504 13.775 1.00 0.76 C ATOM 3300 O ASN B 65 14.721 -7.963 14.495 1.00 0.91 O ATOM 3301 CB ASN B 65 11.788 -8.733 14.628 1.00 0.89 C ATOM 3302 CG ASN B 65 11.409 -9.591 13.426 1.00 1.52 C ATOM 3303 OD1 ASN B 65 12.231 -9.597 12.392 1.00 1.87 O flip ATOM 3304 ND2 ASN B 65 10.383 -10.273 13.445 1.00 2.34 N flip ATOM 0 H ASN B 65 11.248 -7.180 12.533 1.00 0.60 H new ATOM 0 HA ASN B 65 12.435 -6.783 15.205 1.00 0.75 H new ATOM 0 HB2 ASN B 65 12.496 -9.288 15.243 1.00 0.89 H new ATOM 0 HB3 ASN B 65 10.897 -8.571 15.235 1.00 0.89 H new ATOM 0 HD21 ASN B 65 9.768 -10.247 14.258 1.00 2.34 H new ATOM 0 HD22 ASN B 65 10.148 -10.864 12.647 1.00 2.34 H new ATOM 3311 N ARG B 66 14.035 -7.104 12.524 1.00 0.68 N ATOM 3312 CA ARG B 66 15.357 -7.044 11.908 1.00 0.81 C ATOM 3313 C ARG B 66 16.023 -8.414 11.841 1.00 0.88 C ATOM 3314 O ARG B 66 16.909 -8.733 12.633 1.00 1.11 O ATOM 3315 CB ARG B 66 16.257 -6.042 12.633 1.00 1.04 C ATOM 3316 CG ARG B 66 15.814 -4.601 12.451 1.00 1.10 C ATOM 3317 CD ARG B 66 16.763 -3.630 13.134 1.00 1.39 C ATOM 3318 NE ARG B 66 16.477 -2.248 12.760 1.00 2.08 N ATOM 3319 CZ ARG B 66 17.378 -1.267 12.775 1.00 2.77 C ATOM 3320 NH1 ARG B 66 18.612 -1.495 13.213 1.00 2.86 N ATOM 3321 NH2 ARG B 66 17.035 -0.054 12.359 1.00 3.79 N ATOM 0 H ARG B 66 13.281 -6.810 11.904 1.00 0.68 H new ATOM 0 HA ARG B 66 15.213 -6.702 10.883 1.00 0.81 H new ATOM 0 HB2 ARG B 66 16.271 -6.280 13.697 1.00 1.04 H new ATOM 0 HB3 ARG B 66 17.278 -6.150 12.268 1.00 1.04 H new ATOM 0 HG2 ARG B 66 15.759 -4.369 11.387 1.00 1.10 H new ATOM 0 HG3 ARG B 66 14.810 -4.475 12.857 1.00 1.10 H new ATOM 0 HD2 ARG B 66 16.681 -3.740 14.215 1.00 1.39 H new ATOM 0 HD3 ARG B 66 17.791 -3.875 12.866 1.00 1.39 H new ATOM 0 HE ARG B 66 15.527 -2.019 12.469 1.00 2.08 H new ATOM 0 HH11 ARG B 66 18.873 -2.425 13.540 1.00 2.86 H new ATOM 0 HH12 ARG B 66 19.298 -0.740 13.222 1.00 2.86 H new ATOM 0 HH21 ARG B 66 16.086 0.123 12.030 1.00 3.79 H new ATOM 0 HH22 ARG B 66 17.721 0.701 12.368 1.00 3.79 H new ATOM 3335 N ASP B 67 15.571 -9.226 10.901 1.00 0.75 N ATOM 3336 CA ASP B 67 16.183 -10.523 10.646 1.00 0.88 C ATOM 3337 C ASP B 67 16.662 -10.573 9.201 1.00 0.77 C ATOM 3338 O ASP B 67 17.256 -11.554 8.754 1.00 0.96 O ATOM 3339 CB ASP B 67 15.193 -11.658 10.926 1.00 1.00 C ATOM 3340 CG ASP B 67 15.815 -13.028 10.738 1.00 1.39 C ATOM 3341 OD1 ASP B 67 16.792 -13.344 11.448 1.00 1.93 O ATOM 3342 OD2 ASP B 67 15.345 -13.788 9.867 1.00 1.95 O ATOM 0 H ASP B 67 14.778 -9.010 10.297 1.00 0.75 H new ATOM 0 HA ASP B 67 17.034 -10.655 11.315 1.00 0.88 H new ATOM 0 HB2 ASP B 67 14.821 -11.568 11.947 1.00 1.00 H new ATOM 0 HB3 ASP B 67 14.333 -11.558 10.263 1.00 1.00 H new ATOM 3347 N ASN B 68 16.405 -9.475 8.493 1.00 0.62 N ATOM 3348 CA ASN B 68 16.769 -9.329 7.086 1.00 0.55 C ATOM 3349 C ASN B 68 15.831 -10.141 6.212 1.00 0.43 C ATOM 3350 O ASN B 68 16.266 -10.869 5.321 1.00 0.57 O ATOM 3351 CB ASN B 68 18.234 -9.710 6.810 1.00 0.77 C ATOM 3352 CG ASN B 68 19.218 -8.612 7.183 1.00 1.30 C ATOM 3353 OD1 ASN B 68 20.253 -8.449 6.536 1.00 1.41 O ATOM 3354 ND2 ASN B 68 18.913 -7.857 8.227 1.00 2.22 N ATOM 0 H ASN B 68 15.936 -8.657 8.882 1.00 0.62 H new ATOM 0 HA ASN B 68 16.667 -8.273 6.837 1.00 0.55 H new ATOM 0 HB2 ASN B 68 18.479 -10.614 7.368 1.00 0.77 H new ATOM 0 HB3 ASN B 68 18.348 -9.948 5.752 1.00 0.77 H new ATOM 0 HD21 ASN B 68 19.545 -7.111 8.519 1.00 2.22 H new ATOM 0 HD22 ASN B 68 18.046 -8.021 8.739 1.00 2.22 H new ATOM 3361 N GLU B 69 14.542 -10.012 6.483 1.00 0.42 N ATOM 3362 CA GLU B 69 13.514 -10.596 5.641 1.00 0.42 C ATOM 3363 C GLU B 69 12.156 -9.989 5.965 1.00 0.39 C ATOM 3364 O GLU B 69 11.565 -10.241 7.019 1.00 0.54 O ATOM 3365 CB GLU B 69 13.466 -12.125 5.762 1.00 0.60 C ATOM 3366 CG GLU B 69 13.376 -12.640 7.188 1.00 1.04 C ATOM 3367 CD GLU B 69 13.029 -14.110 7.241 1.00 1.44 C ATOM 3368 OE1 GLU B 69 13.844 -14.936 6.776 1.00 2.09 O ATOM 3369 OE2 GLU B 69 11.931 -14.445 7.731 1.00 1.84 O ATOM 0 H GLU B 69 14.182 -9.502 7.289 1.00 0.42 H new ATOM 0 HA GLU B 69 13.769 -10.364 4.607 1.00 0.42 H new ATOM 0 HB2 GLU B 69 12.608 -12.495 5.200 1.00 0.60 H new ATOM 0 HB3 GLU B 69 14.357 -12.542 5.294 1.00 0.60 H new ATOM 0 HG2 GLU B 69 14.327 -12.474 7.694 1.00 1.04 H new ATOM 0 HG3 GLU B 69 12.622 -12.070 7.732 1.00 1.04 H new ATOM 3376 N VAL B 70 11.684 -9.176 5.046 1.00 0.28 N ATOM 3377 CA VAL B 70 10.421 -8.484 5.186 1.00 0.25 C ATOM 3378 C VAL B 70 9.243 -9.444 5.039 1.00 0.25 C ATOM 3379 O VAL B 70 9.193 -10.250 4.104 1.00 0.33 O ATOM 3380 CB VAL B 70 10.336 -7.329 4.161 1.00 0.26 C ATOM 3381 CG1 VAL B 70 8.908 -7.029 3.757 1.00 0.29 C ATOM 3382 CG2 VAL B 70 10.978 -6.084 4.739 1.00 0.30 C ATOM 0 H VAL B 70 12.170 -8.975 4.172 1.00 0.28 H new ATOM 0 HA VAL B 70 10.367 -8.062 6.189 1.00 0.25 H new ATOM 0 HB VAL B 70 10.871 -7.644 3.265 1.00 0.26 H new ATOM 0 HG11 VAL B 70 8.898 -6.211 3.036 1.00 0.29 H new ATOM 0 HG12 VAL B 70 8.464 -7.916 3.306 1.00 0.29 H new ATOM 0 HG13 VAL B 70 8.333 -6.743 4.638 1.00 0.29 H new ATOM 0 HG21 VAL B 70 10.916 -5.273 4.014 1.00 0.30 H new ATOM 0 HG22 VAL B 70 10.456 -5.796 5.652 1.00 0.30 H new ATOM 0 HG23 VAL B 70 12.024 -6.287 4.968 1.00 0.30 H new ATOM 3392 N ASP B 71 8.319 -9.364 5.991 1.00 0.25 N ATOM 3393 CA ASP B 71 7.122 -10.196 5.992 1.00 0.29 C ATOM 3394 C ASP B 71 6.031 -9.539 5.150 1.00 0.22 C ATOM 3395 O ASP B 71 6.266 -8.505 4.540 1.00 0.21 O ATOM 3396 CB ASP B 71 6.640 -10.424 7.431 1.00 0.42 C ATOM 3397 CG ASP B 71 5.666 -11.580 7.545 1.00 1.18 C ATOM 3398 OD1 ASP B 71 6.123 -12.736 7.627 1.00 1.72 O ATOM 3399 OD2 ASP B 71 4.444 -11.344 7.558 1.00 2.06 O ATOM 0 H ASP B 71 8.379 -8.722 6.781 1.00 0.25 H new ATOM 0 HA ASP B 71 7.358 -11.166 5.554 1.00 0.29 H new ATOM 0 HB2 ASP B 71 7.501 -10.615 8.072 1.00 0.42 H new ATOM 0 HB3 ASP B 71 6.164 -9.515 7.799 1.00 0.42 H new ATOM 3404 N PHE B 72 4.837 -10.116 5.130 1.00 0.21 N ATOM 3405 CA PHE B 72 3.816 -9.696 4.185 1.00 0.19 C ATOM 3406 C PHE B 72 3.270 -8.298 4.504 1.00 0.15 C ATOM 3407 O PHE B 72 3.296 -7.421 3.641 1.00 0.14 O ATOM 3408 CB PHE B 72 2.684 -10.720 4.121 1.00 0.21 C ATOM 3409 CG PHE B 72 1.789 -10.556 2.923 1.00 0.20 C ATOM 3410 CD1 PHE B 72 2.223 -9.873 1.792 1.00 1.19 C ATOM 3411 CD2 PHE B 72 0.516 -11.094 2.924 1.00 1.18 C ATOM 3412 CE1 PHE B 72 1.403 -9.729 0.693 1.00 1.20 C ATOM 3413 CE2 PHE B 72 -0.306 -10.955 1.826 1.00 1.20 C ATOM 3414 CZ PHE B 72 0.137 -10.272 0.710 1.00 0.32 C ATOM 0 H PHE B 72 4.554 -10.872 5.754 1.00 0.21 H new ATOM 0 HA PHE B 72 4.289 -9.638 3.205 1.00 0.19 H new ATOM 0 HB2 PHE B 72 3.112 -11.722 4.109 1.00 0.21 H new ATOM 0 HB3 PHE B 72 2.083 -10.641 5.027 1.00 0.21 H new ATOM 0 HD1 PHE B 72 3.216 -9.449 1.774 1.00 1.19 H new ATOM 0 HD2 PHE B 72 0.162 -11.628 3.793 1.00 1.18 H new ATOM 0 HE1 PHE B 72 1.752 -9.193 -0.177 1.00 1.20 H new ATOM 0 HE2 PHE B 72 -1.298 -11.381 1.838 1.00 1.20 H new ATOM 0 HZ PHE B 72 -0.509 -10.164 -0.149 1.00 0.32 H new ATOM 3424 N GLN B 73 2.774 -8.076 5.723 1.00 0.15 N ATOM 3425 CA GLN B 73 2.302 -6.740 6.091 1.00 0.14 C ATOM 3426 C GLN B 73 3.467 -5.754 6.072 1.00 0.12 C ATOM 3427 O GLN B 73 3.282 -4.590 5.741 1.00 0.13 O ATOM 3428 CB GLN B 73 1.581 -6.719 7.453 1.00 0.16 C ATOM 3429 CG GLN B 73 1.135 -5.336 7.894 1.00 0.26 C ATOM 3430 CD GLN B 73 0.383 -5.364 9.206 1.00 0.22 C ATOM 3431 OE1 GLN B 73 -0.358 -6.302 9.491 1.00 0.68 O ATOM 3432 NE2 GLN B 73 0.609 -4.366 10.037 1.00 0.60 N ATOM 0 H GLN B 73 2.690 -8.782 6.454 1.00 0.15 H new ATOM 0 HA GLN B 73 1.563 -6.437 5.349 1.00 0.14 H new ATOM 0 HB2 GLN B 73 0.709 -7.371 7.401 1.00 0.16 H new ATOM 0 HB3 GLN B 73 2.245 -7.134 8.211 1.00 0.16 H new ATOM 0 HG2 GLN B 73 2.007 -4.690 7.992 1.00 0.26 H new ATOM 0 HG3 GLN B 73 0.500 -4.899 7.123 1.00 0.26 H new ATOM 0 HE21 GLN B 73 1.231 -3.605 9.763 1.00 0.60 H new ATOM 0 HE22 GLN B 73 0.162 -4.354 10.954 1.00 0.60 H new ATOM 3441 N GLU B 74 4.673 -6.244 6.374 1.00 0.14 N ATOM 3442 CA GLU B 74 5.877 -5.420 6.318 1.00 0.17 C ATOM 3443 C GLU B 74 6.127 -4.984 4.878 1.00 0.14 C ATOM 3444 O GLU B 74 6.513 -3.849 4.606 1.00 0.16 O ATOM 3445 CB GLU B 74 7.086 -6.208 6.821 1.00 0.27 C ATOM 3446 CG GLU B 74 8.153 -5.344 7.468 1.00 0.38 C ATOM 3447 CD GLU B 74 7.794 -4.990 8.893 1.00 0.43 C ATOM 3448 OE1 GLU B 74 7.062 -4.005 9.104 1.00 1.10 O ATOM 3449 OE2 GLU B 74 8.223 -5.720 9.813 1.00 1.21 O ATOM 0 H GLU B 74 4.838 -7.209 6.660 1.00 0.14 H new ATOM 0 HA GLU B 74 5.733 -4.546 6.953 1.00 0.17 H new ATOM 0 HB2 GLU B 74 6.748 -6.953 7.542 1.00 0.27 H new ATOM 0 HB3 GLU B 74 7.528 -6.750 5.985 1.00 0.27 H new ATOM 0 HG2 GLU B 74 9.107 -5.871 7.453 1.00 0.38 H new ATOM 0 HG3 GLU B 74 8.284 -4.431 6.888 1.00 0.38 H new ATOM 3456 N TYR B 75 5.896 -5.913 3.966 1.00 0.14 N ATOM 3457 CA TYR B 75 6.042 -5.670 2.543 1.00 0.14 C ATOM 3458 C TYR B 75 5.034 -4.624 2.086 1.00 0.11 C ATOM 3459 O TYR B 75 5.320 -3.802 1.222 1.00 0.13 O ATOM 3460 CB TYR B 75 5.835 -6.993 1.786 1.00 0.16 C ATOM 3461 CG TYR B 75 5.982 -6.905 0.286 1.00 0.17 C ATOM 3462 CD1 TYR B 75 4.961 -6.396 -0.506 1.00 1.21 C ATOM 3463 CD2 TYR B 75 7.143 -7.339 -0.336 1.00 1.19 C ATOM 3464 CE1 TYR B 75 5.091 -6.316 -1.877 1.00 1.22 C ATOM 3465 CE2 TYR B 75 7.281 -7.263 -1.712 1.00 1.20 C ATOM 3466 CZ TYR B 75 6.252 -6.750 -2.476 1.00 0.22 C ATOM 3467 OH TYR B 75 6.383 -6.672 -3.843 1.00 0.26 O ATOM 0 H TYR B 75 5.600 -6.862 4.194 1.00 0.14 H new ATOM 0 HA TYR B 75 7.042 -5.290 2.333 1.00 0.14 H new ATOM 0 HB2 TYR B 75 6.550 -7.724 2.163 1.00 0.16 H new ATOM 0 HB3 TYR B 75 4.839 -7.373 2.016 1.00 0.16 H new ATOM 0 HD1 TYR B 75 4.048 -6.056 -0.040 1.00 1.21 H new ATOM 0 HD2 TYR B 75 7.949 -7.741 0.260 1.00 1.19 H new ATOM 0 HE1 TYR B 75 4.287 -5.915 -2.477 1.00 1.22 H new ATOM 0 HE2 TYR B 75 8.190 -7.604 -2.185 1.00 1.20 H new ATOM 0 HH TYR B 75 5.503 -6.521 -4.248 1.00 0.26 H new ATOM 3477 N CYS B 76 3.861 -4.643 2.691 1.00 0.11 N ATOM 3478 CA CYS B 76 2.788 -3.778 2.260 1.00 0.12 C ATOM 3479 C CYS B 76 2.830 -2.420 2.962 1.00 0.12 C ATOM 3480 O CYS B 76 2.486 -1.410 2.361 1.00 0.13 O ATOM 3481 CB CYS B 76 1.448 -4.468 2.484 1.00 0.14 C ATOM 3482 SG CYS B 76 1.369 -6.141 1.808 1.00 0.22 S ATOM 0 H CYS B 76 3.631 -5.247 3.480 1.00 0.11 H new ATOM 0 HA CYS B 76 2.916 -3.585 1.195 1.00 0.12 H new ATOM 0 HB2 CYS B 76 1.245 -4.508 3.554 1.00 0.14 H new ATOM 0 HB3 CYS B 76 0.660 -3.866 2.032 1.00 0.14 H new ATOM 0 HG CYS B 76 2.010 -6.957 2.592 1.00 0.22 H new ATOM 3488 N VAL B 77 3.243 -2.386 4.226 1.00 0.13 N ATOM 3489 CA VAL B 77 3.444 -1.108 4.910 1.00 0.14 C ATOM 3490 C VAL B 77 4.579 -0.365 4.224 1.00 0.14 C ATOM 3491 O VAL B 77 4.584 0.859 4.141 1.00 0.19 O ATOM 3492 CB VAL B 77 3.752 -1.296 6.415 1.00 0.16 C ATOM 3493 CG1 VAL B 77 4.933 -2.209 6.586 1.00 0.14 C ATOM 3494 CG2 VAL B 77 4.016 0.029 7.115 1.00 0.20 C ATOM 0 H VAL B 77 3.443 -3.212 4.791 1.00 0.13 H new ATOM 0 HA VAL B 77 2.522 -0.531 4.849 1.00 0.14 H new ATOM 0 HB VAL B 77 2.871 -1.742 6.877 1.00 0.16 H new ATOM 0 HG11 VAL B 77 5.144 -2.336 7.648 1.00 0.14 H new ATOM 0 HG12 VAL B 77 4.710 -3.179 6.141 1.00 0.14 H new ATOM 0 HG13 VAL B 77 5.803 -1.775 6.093 1.00 0.14 H new ATOM 0 HG21 VAL B 77 4.227 -0.152 8.169 1.00 0.20 H new ATOM 0 HG22 VAL B 77 4.872 0.521 6.652 1.00 0.20 H new ATOM 0 HG23 VAL B 77 3.138 0.669 7.026 1.00 0.20 H new ATOM 3504 N PHE B 78 5.528 -1.143 3.721 1.00 0.11 N ATOM 3505 CA PHE B 78 6.552 -0.651 2.817 1.00 0.11 C ATOM 3506 C PHE B 78 5.900 0.096 1.656 1.00 0.11 C ATOM 3507 O PHE B 78 6.326 1.186 1.275 1.00 0.11 O ATOM 3508 CB PHE B 78 7.355 -1.851 2.297 1.00 0.12 C ATOM 3509 CG PHE B 78 8.085 -1.625 1.005 1.00 0.12 C ATOM 3510 CD1 PHE B 78 7.467 -1.888 -0.214 1.00 1.18 C ATOM 3511 CD2 PHE B 78 9.388 -1.171 1.006 1.00 1.17 C ATOM 3512 CE1 PHE B 78 8.139 -1.696 -1.402 1.00 1.18 C ATOM 3513 CE2 PHE B 78 10.067 -0.982 -0.180 1.00 1.18 C ATOM 3514 CZ PHE B 78 9.444 -1.243 -1.384 1.00 0.15 C ATOM 0 H PHE B 78 5.607 -2.138 3.931 1.00 0.11 H new ATOM 0 HA PHE B 78 7.217 0.038 3.337 1.00 0.11 H new ATOM 0 HB2 PHE B 78 8.079 -2.139 3.059 1.00 0.12 H new ATOM 0 HB3 PHE B 78 6.675 -2.693 2.168 1.00 0.12 H new ATOM 0 HD1 PHE B 78 6.448 -2.247 -0.229 1.00 1.18 H new ATOM 0 HD2 PHE B 78 9.881 -0.962 1.944 1.00 1.17 H new ATOM 0 HE1 PHE B 78 7.648 -1.899 -2.342 1.00 1.18 H new ATOM 0 HE2 PHE B 78 11.088 -0.629 -0.167 1.00 1.18 H new ATOM 0 HZ PHE B 78 9.977 -1.093 -2.311 1.00 0.15 H new ATOM 3524 N LEU B 79 4.852 -0.510 1.115 1.00 0.14 N ATOM 3525 CA LEU B 79 4.130 0.046 -0.014 1.00 0.16 C ATOM 3526 C LEU B 79 3.367 1.297 0.364 1.00 0.17 C ATOM 3527 O LEU B 79 3.502 2.337 -0.278 1.00 0.20 O ATOM 3528 CB LEU B 79 3.168 -0.983 -0.591 1.00 0.15 C ATOM 3529 CG LEU B 79 3.756 -1.879 -1.666 1.00 0.15 C ATOM 3530 CD1 LEU B 79 3.581 -3.334 -1.298 1.00 0.19 C ATOM 3531 CD2 LEU B 79 3.089 -1.589 -2.986 1.00 0.14 C ATOM 0 H LEU B 79 4.481 -1.400 1.448 1.00 0.14 H new ATOM 0 HA LEU B 79 4.871 0.316 -0.767 1.00 0.16 H new ATOM 0 HB2 LEU B 79 2.800 -1.609 0.221 1.00 0.15 H new ATOM 0 HB3 LEU B 79 2.306 -0.460 -1.006 1.00 0.15 H new ATOM 0 HG LEU B 79 4.823 -1.676 -1.752 1.00 0.15 H new ATOM 0 HD11 LEU B 79 4.009 -3.961 -2.080 1.00 0.19 H new ATOM 0 HD12 LEU B 79 4.089 -3.534 -0.354 1.00 0.19 H new ATOM 0 HD13 LEU B 79 2.519 -3.558 -1.193 1.00 0.19 H new ATOM 0 HD21 LEU B 79 3.512 -2.233 -3.757 1.00 0.14 H new ATOM 0 HD22 LEU B 79 2.019 -1.778 -2.902 1.00 0.14 H new ATOM 0 HD23 LEU B 79 3.253 -0.545 -3.255 1.00 0.14 H new ATOM 3543 N SER B 80 2.572 1.196 1.409 1.00 0.19 N ATOM 3544 CA SER B 80 1.772 2.312 1.855 1.00 0.21 C ATOM 3545 C SER B 80 2.669 3.444 2.312 1.00 0.20 C ATOM 3546 O SER B 80 2.289 4.616 2.281 1.00 0.24 O ATOM 3547 CB SER B 80 0.836 1.853 2.959 1.00 0.22 C ATOM 3548 OG SER B 80 1.475 0.932 3.822 1.00 0.18 O ATOM 0 H SER B 80 2.464 0.348 1.966 1.00 0.19 H new ATOM 0 HA SER B 80 1.165 2.688 1.031 1.00 0.21 H new ATOM 0 HB2 SER B 80 0.495 2.715 3.532 1.00 0.22 H new ATOM 0 HB3 SER B 80 -0.049 1.391 2.521 1.00 0.22 H new ATOM 0 HG SER B 80 0.810 0.314 4.191 1.00 0.18 H new ATOM 3554 N CYS B 81 3.871 3.080 2.720 1.00 0.17 N ATOM 3555 CA CYS B 81 4.909 4.039 2.971 1.00 0.18 C ATOM 3556 C CYS B 81 5.220 4.807 1.715 1.00 0.33 C ATOM 3557 O CYS B 81 5.117 6.009 1.709 1.00 0.72 O ATOM 3558 CB CYS B 81 6.173 3.364 3.473 1.00 0.30 C ATOM 3559 SG CYS B 81 7.685 4.282 3.113 1.00 1.83 S ATOM 0 H CYS B 81 4.146 2.111 2.884 1.00 0.17 H new ATOM 0 HA CYS B 81 4.551 4.722 3.741 1.00 0.18 H new ATOM 0 HB2 CYS B 81 6.094 3.222 4.551 1.00 0.30 H new ATOM 0 HB3 CYS B 81 6.246 2.373 3.025 1.00 0.30 H new ATOM 0 HG CYS B 81 8.236 3.806 2.036 1.00 1.83 H new ATOM 3565 N ILE B 82 5.569 4.117 0.641 1.00 0.17 N ATOM 3566 CA ILE B 82 5.973 4.805 -0.575 1.00 0.19 C ATOM 3567 C ILE B 82 4.841 5.688 -1.107 1.00 0.21 C ATOM 3568 O ILE B 82 5.081 6.672 -1.796 1.00 0.28 O ATOM 3569 CB ILE B 82 6.456 3.837 -1.677 1.00 0.19 C ATOM 3570 CG1 ILE B 82 7.479 2.850 -1.119 1.00 0.24 C ATOM 3571 CG2 ILE B 82 7.085 4.632 -2.808 1.00 0.24 C ATOM 3572 CD1 ILE B 82 8.406 2.280 -2.174 1.00 0.41 C ATOM 0 H ILE B 82 5.581 3.099 0.585 1.00 0.17 H new ATOM 0 HA ILE B 82 6.821 5.435 -0.304 1.00 0.19 H new ATOM 0 HB ILE B 82 5.598 3.277 -2.049 1.00 0.19 H new ATOM 0 HG12 ILE B 82 8.075 3.349 -0.355 1.00 0.24 H new ATOM 0 HG13 ILE B 82 6.952 2.031 -0.629 1.00 0.24 H new ATOM 0 HG21 ILE B 82 7.426 3.950 -3.586 1.00 0.24 H new ATOM 0 HG22 ILE B 82 6.347 5.318 -3.225 1.00 0.24 H new ATOM 0 HG23 ILE B 82 7.933 5.200 -2.426 1.00 0.24 H new ATOM 0 HD11 ILE B 82 9.106 1.587 -1.707 1.00 0.41 H new ATOM 0 HD12 ILE B 82 7.820 1.752 -2.926 1.00 0.41 H new ATOM 0 HD13 ILE B 82 8.960 3.090 -2.648 1.00 0.41 H new ATOM 3584 N ALA B 83 3.610 5.354 -0.761 1.00 0.26 N ATOM 3585 CA ALA B 83 2.472 6.178 -1.139 1.00 0.32 C ATOM 3586 C ALA B 83 2.321 7.383 -0.208 1.00 0.32 C ATOM 3587 O ALA B 83 2.163 8.511 -0.658 1.00 0.35 O ATOM 3588 CB ALA B 83 1.202 5.353 -1.136 1.00 0.42 C ATOM 0 H ALA B 83 3.372 4.522 -0.221 1.00 0.26 H new ATOM 0 HA ALA B 83 2.652 6.553 -2.147 1.00 0.32 H new ATOM 0 HB1 ALA B 83 0.359 5.982 -1.421 1.00 0.42 H new ATOM 0 HB2 ALA B 83 1.299 4.533 -1.847 1.00 0.42 H new ATOM 0 HB3 ALA B 83 1.033 4.949 -0.138 1.00 0.42 H new ATOM 3594 N MET B 84 2.382 7.133 1.092 1.00 0.33 N ATOM 3595 CA MET B 84 2.185 8.173 2.107 1.00 0.36 C ATOM 3596 C MET B 84 3.444 8.997 2.310 1.00 0.36 C ATOM 3597 O MET B 84 3.394 10.136 2.762 1.00 0.48 O ATOM 3598 CB MET B 84 1.761 7.515 3.395 1.00 0.38 C ATOM 3599 CG MET B 84 1.651 8.441 4.585 1.00 0.44 C ATOM 3600 SD MET B 84 1.382 7.482 6.075 1.00 0.38 S ATOM 3601 CE MET B 84 2.351 6.048 5.618 1.00 0.22 C ATOM 0 H MET B 84 2.569 6.208 1.478 1.00 0.33 H new ATOM 0 HA MET B 84 1.408 8.859 1.770 1.00 0.36 H new ATOM 0 HB2 MET B 84 0.795 7.035 3.238 1.00 0.38 H new ATOM 0 HB3 MET B 84 2.474 6.726 3.633 1.00 0.38 H new ATOM 0 HG2 MET B 84 2.561 9.034 4.682 1.00 0.44 H new ATOM 0 HG3 MET B 84 0.829 9.141 4.438 1.00 0.44 H new ATOM 0 HE1 MET B 84 2.778 5.597 6.514 1.00 0.22 H new ATOM 0 HE2 MET B 84 1.712 5.322 5.116 1.00 0.22 H new ATOM 0 HE3 MET B 84 3.154 6.351 4.946 1.00 0.22 H new ATOM 3611 N MET B 85 4.567 8.416 1.980 1.00 0.28 N ATOM 3612 CA MET B 85 5.797 9.151 1.916 1.00 0.29 C ATOM 3613 C MET B 85 5.738 10.045 0.683 1.00 0.34 C ATOM 3614 O MET B 85 6.274 11.146 0.664 1.00 0.48 O ATOM 3615 CB MET B 85 6.973 8.196 1.860 1.00 0.28 C ATOM 3616 CG MET B 85 8.252 8.831 2.349 1.00 0.32 C ATOM 3617 SD MET B 85 9.670 8.434 1.308 1.00 0.29 S ATOM 3618 CE MET B 85 9.681 6.671 1.554 1.00 0.25 C ATOM 0 H MET B 85 4.652 7.426 1.750 1.00 0.28 H new ATOM 0 HA MET B 85 5.931 9.768 2.805 1.00 0.29 H new ATOM 0 HB2 MET B 85 6.753 7.316 2.465 1.00 0.28 H new ATOM 0 HB3 MET B 85 7.110 7.852 0.835 1.00 0.28 H new ATOM 0 HG2 MET B 85 8.125 9.913 2.385 1.00 0.32 H new ATOM 0 HG3 MET B 85 8.451 8.499 3.368 1.00 0.32 H new ATOM 0 HE1 MET B 85 10.595 6.251 1.134 1.00 0.25 H new ATOM 0 HE2 MET B 85 9.638 6.452 2.621 1.00 0.25 H new ATOM 0 HE3 MET B 85 8.817 6.229 1.058 1.00 0.25 H new ATOM 3628 N CYS B 86 5.026 9.555 -0.335 1.00 0.31 N ATOM 3629 CA CYS B 86 4.712 10.337 -1.525 1.00 0.34 C ATOM 3630 C CYS B 86 3.675 11.406 -1.191 1.00 0.39 C ATOM 3631 O CYS B 86 3.606 12.443 -1.840 1.00 0.46 O ATOM 3632 CB CYS B 86 4.185 9.421 -2.632 1.00 0.39 C ATOM 3633 SG CYS B 86 3.613 10.284 -4.111 1.00 0.94 S ATOM 0 H CYS B 86 4.653 8.606 -0.354 1.00 0.31 H new ATOM 0 HA CYS B 86 5.621 10.826 -1.875 1.00 0.34 H new ATOM 0 HB2 CYS B 86 4.974 8.724 -2.916 1.00 0.39 H new ATOM 0 HB3 CYS B 86 3.363 8.826 -2.233 1.00 0.39 H new ATOM 0 HG CYS B 86 2.741 9.547 -4.733 1.00 0.94 H new ATOM 3639 N ASN B 87 2.864 11.139 -0.175 1.00 0.45 N ATOM 3640 CA ASN B 87 1.925 12.130 0.344 1.00 0.58 C ATOM 3641 C ASN B 87 2.679 13.381 0.788 1.00 0.68 C ATOM 3642 O ASN B 87 2.171 14.497 0.719 1.00 0.89 O ATOM 3643 CB ASN B 87 1.134 11.551 1.522 1.00 0.72 C ATOM 3644 CG ASN B 87 0.307 12.584 2.268 1.00 1.10 C ATOM 3645 OD1 ASN B 87 -0.928 12.786 1.836 1.00 1.72 O flip ATOM 3646 ND2 ASN B 87 0.768 13.185 3.234 1.00 1.77 N flip ATOM 0 H ASN B 87 2.837 10.241 0.309 1.00 0.45 H new ATOM 0 HA ASN B 87 1.226 12.397 -0.449 1.00 0.58 H new ATOM 0 HB2 ASN B 87 0.473 10.766 1.154 1.00 0.72 H new ATOM 0 HB3 ASN B 87 1.828 11.082 2.219 1.00 0.72 H new ATOM 0 HD21 ASN B 87 1.724 13.003 3.539 1.00 1.77 H new ATOM 0 HD22 ASN B 87 0.195 13.866 3.732 1.00 1.77 H new ATOM 3653 N GLU B 88 3.909 13.175 1.226 1.00 0.70 N ATOM 3654 CA GLU B 88 4.761 14.264 1.660 1.00 0.89 C ATOM 3655 C GLU B 88 5.346 15.000 0.452 1.00 0.86 C ATOM 3656 O GLU B 88 5.530 16.214 0.486 1.00 1.06 O ATOM 3657 CB GLU B 88 5.872 13.712 2.561 1.00 1.03 C ATOM 3658 CG GLU B 88 5.332 12.857 3.701 1.00 1.51 C ATOM 3659 CD GLU B 88 6.415 12.236 4.564 1.00 1.72 C ATOM 3660 OE1 GLU B 88 6.871 11.117 4.252 1.00 1.98 O ATOM 3661 OE2 GLU B 88 6.795 12.845 5.583 1.00 2.33 O ATOM 0 H GLU B 88 4.341 12.253 1.290 1.00 0.70 H new ATOM 0 HA GLU B 88 4.171 14.981 2.230 1.00 0.89 H new ATOM 0 HB2 GLU B 88 6.560 13.117 1.960 1.00 1.03 H new ATOM 0 HB3 GLU B 88 6.445 14.542 2.974 1.00 1.03 H new ATOM 0 HG2 GLU B 88 4.686 13.471 4.329 1.00 1.51 H new ATOM 0 HG3 GLU B 88 4.711 12.063 3.285 1.00 1.51 H new ATOM 3668 N PHE B 89 5.622 14.258 -0.621 1.00 0.69 N ATOM 3669 CA PHE B 89 6.198 14.837 -1.839 1.00 0.71 C ATOM 3670 C PHE B 89 5.133 15.284 -2.845 1.00 0.73 C ATOM 3671 O PHE B 89 4.912 16.476 -3.038 1.00 0.88 O ATOM 3672 CB PHE B 89 7.128 13.831 -2.511 1.00 0.69 C ATOM 3673 CG PHE B 89 8.363 13.524 -1.715 1.00 0.91 C ATOM 3674 CD1 PHE B 89 9.510 14.282 -1.872 1.00 1.53 C ATOM 3675 CD2 PHE B 89 8.376 12.476 -0.816 1.00 1.65 C ATOM 3676 CE1 PHE B 89 10.649 13.998 -1.142 1.00 1.89 C ATOM 3677 CE2 PHE B 89 9.509 12.188 -0.084 1.00 1.99 C ATOM 3678 CZ PHE B 89 10.648 12.949 -0.247 1.00 1.81 C ATOM 0 H PHE B 89 5.456 13.253 -0.673 1.00 0.69 H new ATOM 0 HA PHE B 89 6.754 15.722 -1.529 1.00 0.71 H new ATOM 0 HB2 PHE B 89 6.581 12.905 -2.687 1.00 0.69 H new ATOM 0 HB3 PHE B 89 7.422 14.217 -3.487 1.00 0.69 H new ATOM 0 HD1 PHE B 89 9.515 15.104 -2.572 1.00 1.53 H new ATOM 0 HD2 PHE B 89 7.489 11.875 -0.684 1.00 1.65 H new ATOM 0 HE1 PHE B 89 11.538 14.597 -1.272 1.00 1.89 H new ATOM 0 HE2 PHE B 89 9.504 11.366 0.617 1.00 1.99 H new ATOM 0 HZ PHE B 89 11.536 12.724 0.325 1.00 1.81 H new ATOM 3688 N PHE B 90 4.474 14.316 -3.477 1.00 0.63 N ATOM 3689 CA PHE B 90 3.532 14.585 -4.563 1.00 0.66 C ATOM 3690 C PHE B 90 2.282 15.286 -4.047 1.00 0.69 C ATOM 3691 O PHE B 90 1.897 16.341 -4.552 1.00 0.83 O ATOM 3692 CB PHE B 90 3.153 13.275 -5.262 1.00 0.69 C ATOM 3693 CG PHE B 90 2.170 13.435 -6.388 1.00 0.95 C ATOM 3694 CD1 PHE B 90 2.602 13.791 -7.656 1.00 1.79 C ATOM 3695 CD2 PHE B 90 0.816 13.218 -6.183 1.00 1.44 C ATOM 3696 CE1 PHE B 90 1.701 13.932 -8.696 1.00 2.09 C ATOM 3697 CE2 PHE B 90 -0.088 13.358 -7.219 1.00 1.68 C ATOM 3698 CZ PHE B 90 0.355 13.713 -8.476 1.00 1.67 C ATOM 0 H PHE B 90 4.576 13.326 -3.253 1.00 0.63 H new ATOM 0 HA PHE B 90 4.018 15.248 -5.279 1.00 0.66 H new ATOM 0 HB2 PHE B 90 4.059 12.809 -5.650 1.00 0.69 H new ATOM 0 HB3 PHE B 90 2.734 12.591 -4.524 1.00 0.69 H new ATOM 0 HD1 PHE B 90 3.654 13.960 -7.834 1.00 1.79 H new ATOM 0 HD2 PHE B 90 0.463 12.936 -5.202 1.00 1.44 H new ATOM 0 HE1 PHE B 90 2.049 14.213 -9.679 1.00 2.09 H new ATOM 0 HE2 PHE B 90 -1.140 13.190 -7.044 1.00 1.68 H new ATOM 0 HZ PHE B 90 -0.350 13.820 -9.287 1.00 1.67 H new ATOM 3708 N GLU B 91 1.641 14.682 -3.057 1.00 0.70 N ATOM 3709 CA GLU B 91 0.504 15.302 -2.392 1.00 0.83 C ATOM 3710 C GLU B 91 0.961 16.594 -1.726 1.00 1.01 C ATOM 3711 O GLU B 91 0.261 17.605 -1.751 1.00 1.21 O ATOM 3712 CB GLU B 91 -0.090 14.334 -1.368 1.00 0.95 C ATOM 3713 CG GLU B 91 -1.145 14.953 -0.463 1.00 1.64 C ATOM 3714 CD GLU B 91 -2.413 15.295 -1.204 1.00 2.04 C ATOM 3715 OE1 GLU B 91 -3.168 14.365 -1.537 1.00 2.62 O ATOM 3716 OE2 GLU B 91 -2.653 16.494 -1.469 1.00 2.45 O ATOM 0 H GLU B 91 1.890 13.761 -2.696 1.00 0.70 H new ATOM 0 HA GLU B 91 -0.272 15.538 -3.120 1.00 0.83 H new ATOM 0 HB2 GLU B 91 -0.531 13.489 -1.897 1.00 0.95 H new ATOM 0 HB3 GLU B 91 0.715 13.937 -0.750 1.00 0.95 H new ATOM 0 HG2 GLU B 91 -1.376 14.260 0.346 1.00 1.64 H new ATOM 0 HG3 GLU B 91 -0.741 15.856 -0.004 1.00 1.64 H new ATOM 3723 N GLY B 92 2.160 16.547 -1.159 1.00 1.09 N ATOM 3724 CA GLY B 92 2.751 17.717 -0.543 1.00 1.36 C ATOM 3725 C GLY B 92 1.926 18.247 0.610 1.00 1.53 C ATOM 3726 O GLY B 92 1.759 19.459 0.751 1.00 1.90 O ATOM 0 H GLY B 92 2.739 15.708 -1.116 1.00 1.09 H new ATOM 0 HA2 GLY B 92 3.751 17.469 -0.186 1.00 1.36 H new ATOM 0 HA3 GLY B 92 2.865 18.500 -1.293 1.00 1.36 H new ATOM 3730 N PHE B 93 1.407 17.346 1.431 1.00 1.50 N ATOM 3731 CA PHE B 93 0.575 17.748 2.556 1.00 1.82 C ATOM 3732 C PHE B 93 1.232 17.362 3.875 1.00 1.98 C ATOM 3733 O PHE B 93 0.985 16.282 4.409 1.00 2.12 O ATOM 3734 CB PHE B 93 -0.809 17.104 2.462 1.00 2.19 C ATOM 3735 CG PHE B 93 -1.876 17.858 3.204 1.00 2.75 C ATOM 3736 CD1 PHE B 93 -2.007 19.230 3.049 1.00 3.14 C ATOM 3737 CD2 PHE B 93 -2.755 17.197 4.045 1.00 3.37 C ATOM 3738 CE1 PHE B 93 -2.992 19.926 3.722 1.00 3.73 C ATOM 3739 CE2 PHE B 93 -3.740 17.888 4.721 1.00 3.97 C ATOM 3740 CZ PHE B 93 -3.859 19.254 4.560 1.00 4.00 C ATOM 0 H PHE B 93 1.545 16.339 1.341 1.00 1.50 H new ATOM 0 HA PHE B 93 0.463 18.832 2.520 1.00 1.82 H new ATOM 0 HB2 PHE B 93 -1.094 17.027 1.413 1.00 2.19 H new ATOM 0 HB3 PHE B 93 -0.755 16.088 2.853 1.00 2.19 H new ATOM 0 HD1 PHE B 93 -1.331 19.760 2.395 1.00 3.14 H new ATOM 0 HD2 PHE B 93 -2.669 16.128 4.174 1.00 3.37 H new ATOM 0 HE1 PHE B 93 -3.084 20.994 3.593 1.00 3.73 H new ATOM 0 HE2 PHE B 93 -4.418 17.360 5.376 1.00 3.97 H new ATOM 0 HZ PHE B 93 -4.629 19.796 5.089 1.00 4.00 H new ATOM 3750 N PRO B 94 2.084 18.236 4.419 1.00 2.52 N ATOM 3751 CA PRO B 94 2.751 17.991 5.680 1.00 3.07 C ATOM 3752 C PRO B 94 1.926 18.489 6.855 1.00 3.02 C ATOM 3753 O PRO B 94 2.419 19.203 7.730 1.00 3.41 O ATOM 3754 CB PRO B 94 4.057 18.776 5.539 1.00 3.84 C ATOM 3755 CG PRO B 94 3.790 19.845 4.521 1.00 3.90 C ATOM 3756 CD PRO B 94 2.470 19.533 3.854 1.00 3.08 C ATOM 0 HA PRO B 94 2.909 16.931 5.880 1.00 3.07 H new ATOM 0 HB2 PRO B 94 4.355 19.211 6.493 1.00 3.84 H new ATOM 0 HB3 PRO B 94 4.870 18.125 5.217 1.00 3.84 H new ATOM 0 HG2 PRO B 94 3.755 20.825 4.997 1.00 3.90 H new ATOM 0 HG3 PRO B 94 4.592 19.878 3.783 1.00 3.90 H new ATOM 0 HD2 PRO B 94 1.724 20.299 4.067 1.00 3.08 H new ATOM 0 HD3 PRO B 94 2.573 19.481 2.770 1.00 3.08 H new ATOM 3764 N ASP B 95 0.668 18.082 6.872 1.00 2.85 N ATOM 3765 CA ASP B 95 -0.254 18.486 7.927 1.00 3.20 C ATOM 3766 C ASP B 95 0.067 17.711 9.193 1.00 3.38 C ATOM 3767 O ASP B 95 0.034 18.248 10.300 1.00 3.79 O ATOM 3768 CB ASP B 95 -1.715 18.244 7.513 1.00 3.91 C ATOM 3769 CG ASP B 95 -2.131 16.783 7.585 1.00 4.67 C ATOM 3770 OD1 ASP B 95 -1.532 15.948 6.875 1.00 5.10 O ATOM 3771 OD2 ASP B 95 -3.051 16.461 8.365 1.00 5.19 O ATOM 0 H ASP B 95 0.258 17.470 6.166 1.00 2.85 H new ATOM 0 HA ASP B 95 -0.134 19.554 8.107 1.00 3.20 H new ATOM 0 HB2 ASP B 95 -2.369 18.832 8.157 1.00 3.91 H new ATOM 0 HB3 ASP B 95 -1.861 18.605 6.495 1.00 3.91 H new ATOM 3776 N LYS B 96 0.397 16.444 9.008 1.00 3.54 N ATOM 3777 CA LYS B 96 0.800 15.579 10.105 1.00 4.45 C ATOM 3778 C LYS B 96 2.072 14.836 9.732 1.00 4.54 C ATOM 3779 O LYS B 96 2.495 13.906 10.419 1.00 4.98 O ATOM 3780 CB LYS B 96 -0.326 14.599 10.428 1.00 5.36 C ATOM 3781 CG LYS B 96 -0.861 13.886 9.201 1.00 6.28 C ATOM 3782 CD LYS B 96 -2.135 13.126 9.505 1.00 7.13 C ATOM 3783 CE LYS B 96 -2.803 12.650 8.228 1.00 7.93 C ATOM 3784 NZ LYS B 96 -3.253 13.787 7.376 1.00 8.39 N ATOM 0 H LYS B 96 0.393 15.987 8.096 1.00 3.54 H new ATOM 0 HA LYS B 96 0.999 16.181 10.991 1.00 4.45 H new ATOM 0 HB2 LYS B 96 0.037 13.859 11.142 1.00 5.36 H new ATOM 0 HB3 LYS B 96 -1.141 15.137 10.913 1.00 5.36 H new ATOM 0 HG2 LYS B 96 -1.051 14.613 8.412 1.00 6.28 H new ATOM 0 HG3 LYS B 96 -0.107 13.196 8.824 1.00 6.28 H new ATOM 0 HD2 LYS B 96 -1.909 12.271 10.142 1.00 7.13 H new ATOM 0 HD3 LYS B 96 -2.820 13.766 10.061 1.00 7.13 H new ATOM 0 HE2 LYS B 96 -2.107 12.028 7.665 1.00 7.93 H new ATOM 0 HE3 LYS B 96 -3.659 12.024 8.478 1.00 7.93 H new ATOM 0 HZ1 LYS B 96 -4.121 13.519 6.869 1.00 8.39 H new ATOM 0 HZ2 LYS B 96 -3.444 14.615 7.975 1.00 8.39 H new ATOM 0 HZ3 LYS B 96 -2.509 14.021 6.688 1.00 8.39 H new ATOM 3798 N GLN B 97 2.678 15.265 8.635 1.00 4.59 N ATOM 3799 CA GLN B 97 3.908 14.662 8.153 1.00 5.12 C ATOM 3800 C GLN B 97 5.099 15.463 8.656 1.00 5.38 C ATOM 3801 O GLN B 97 5.167 16.678 8.454 1.00 5.51 O ATOM 3802 CB GLN B 97 3.930 14.606 6.622 1.00 5.83 C ATOM 3803 CG GLN B 97 2.693 13.970 6.003 1.00 6.21 C ATOM 3804 CD GLN B 97 2.399 12.581 6.539 1.00 6.95 C ATOM 3805 OE1 GLN B 97 3.301 11.837 6.927 1.00 7.21 O ATOM 3806 NE2 GLN B 97 1.128 12.220 6.552 1.00 7.59 N ATOM 0 H GLN B 97 2.334 16.034 8.060 1.00 4.59 H new ATOM 0 HA GLN B 97 3.964 13.642 8.532 1.00 5.12 H new ATOM 0 HB2 GLN B 97 4.037 15.619 6.234 1.00 5.83 H new ATOM 0 HB3 GLN B 97 4.810 14.048 6.303 1.00 5.83 H new ATOM 0 HG2 GLN B 97 1.832 14.613 6.187 1.00 6.21 H new ATOM 0 HG3 GLN B 97 2.824 13.915 4.922 1.00 6.21 H new ATOM 0 HE21 GLN B 97 0.411 12.866 6.222 1.00 7.59 H new ATOM 0 HE22 GLN B 97 0.864 11.295 6.892 1.00 7.59 H new ATOM 3815 N PRO B 98 6.035 14.799 9.342 1.00 5.81 N ATOM 3816 CA PRO B 98 7.230 15.447 9.885 1.00 6.41 C ATOM 3817 C PRO B 98 8.178 15.938 8.793 1.00 6.44 C ATOM 3818 O PRO B 98 8.123 15.470 7.651 1.00 6.84 O ATOM 3819 CB PRO B 98 7.894 14.347 10.713 1.00 7.08 C ATOM 3820 CG PRO B 98 7.387 13.073 10.138 1.00 6.87 C ATOM 3821 CD PRO B 98 5.999 13.359 9.646 1.00 6.10 C ATOM 0 HA PRO B 98 6.977 16.337 10.461 1.00 6.41 H new ATOM 0 HB2 PRO B 98 8.980 14.405 10.647 1.00 7.08 H new ATOM 0 HB3 PRO B 98 7.633 14.435 11.768 1.00 7.08 H new ATOM 0 HG2 PRO B 98 8.026 12.732 9.324 1.00 6.87 H new ATOM 0 HG3 PRO B 98 7.379 12.283 10.889 1.00 6.87 H new ATOM 0 HD2 PRO B 98 5.756 12.768 8.763 1.00 6.10 H new ATOM 0 HD3 PRO B 98 5.249 13.126 10.402 1.00 6.10 H new ATOM 3829 N ARG B 99 9.051 16.874 9.161 1.00 6.34 N ATOM 3830 CA ARG B 99 10.008 17.475 8.231 1.00 6.64 C ATOM 3831 C ARG B 99 9.283 18.315 7.181 1.00 6.40 C ATOM 3832 O ARG B 99 8.089 18.593 7.306 1.00 6.77 O ATOM 3833 CB ARG B 99 10.888 16.410 7.550 1.00 6.94 C ATOM 3834 CG ARG B 99 11.995 15.847 8.437 1.00 7.54 C ATOM 3835 CD ARG B 99 11.462 14.898 9.498 1.00 7.94 C ATOM 3836 NE ARG B 99 12.501 14.515 10.455 1.00 8.46 N ATOM 3837 CZ ARG B 99 12.370 13.544 11.361 1.00 8.94 C ATOM 3838 NH1 ARG B 99 11.289 12.772 11.373 1.00 8.99 N ATOM 3839 NH2 ARG B 99 13.336 13.331 12.243 1.00 9.56 N ATOM 0 H ARG B 99 9.116 17.238 10.112 1.00 6.34 H new ATOM 0 HA ARG B 99 10.663 18.124 8.812 1.00 6.64 H new ATOM 0 HB2 ARG B 99 10.252 15.589 7.218 1.00 6.94 H new ATOM 0 HB3 ARG B 99 11.339 16.845 6.658 1.00 6.94 H new ATOM 0 HG2 ARG B 99 12.722 15.323 7.817 1.00 7.54 H new ATOM 0 HG3 ARG B 99 12.522 16.669 8.921 1.00 7.54 H new ATOM 0 HD2 ARG B 99 10.636 15.372 10.028 1.00 7.94 H new ATOM 0 HD3 ARG B 99 11.062 14.005 9.019 1.00 7.94 H new ATOM 0 HE ARG B 99 13.384 15.024 10.428 1.00 8.46 H new ATOM 0 HH11 ARG B 99 10.550 12.919 10.686 1.00 8.99 H new ATOM 0 HH12 ARG B 99 11.198 12.032 12.070 1.00 8.99 H new ATOM 0 HH21 ARG B 99 14.177 13.909 12.228 1.00 9.56 H new ATOM 0 HH22 ARG B 99 13.239 12.590 12.937 1.00 9.56 H new ATOM 3853 N LYS B 100 10.012 18.743 6.162 1.00 6.04 N ATOM 3854 CA LYS B 100 9.435 19.548 5.099 1.00 5.97 C ATOM 3855 C LYS B 100 9.407 18.782 3.786 1.00 5.32 C ATOM 3856 O LYS B 100 9.769 17.604 3.727 1.00 5.54 O ATOM 3857 CB LYS B 100 10.235 20.833 4.900 1.00 6.71 C ATOM 3858 CG LYS B 100 10.164 21.808 6.060 1.00 7.02 C ATOM 3859 CD LYS B 100 10.940 23.071 5.737 1.00 7.50 C ATOM 3860 CE LYS B 100 10.386 23.757 4.496 1.00 8.06 C ATOM 3861 NZ LYS B 100 11.310 24.797 3.976 1.00 8.50 N ATOM 0 H LYS B 100 11.006 18.545 6.049 1.00 6.04 H new ATOM 0 HA LYS B 100 8.415 19.792 5.395 1.00 5.97 H new ATOM 0 HB2 LYS B 100 11.279 20.572 4.725 1.00 6.71 H new ATOM 0 HB3 LYS B 100 9.877 21.333 4.000 1.00 6.71 H new ATOM 0 HG2 LYS B 100 9.124 22.057 6.271 1.00 7.02 H new ATOM 0 HG3 LYS B 100 10.570 21.344 6.959 1.00 7.02 H new ATOM 0 HD2 LYS B 100 10.895 23.755 6.584 1.00 7.50 H new ATOM 0 HD3 LYS B 100 11.991 22.825 5.581 1.00 7.50 H new ATOM 0 HE2 LYS B 100 10.205 23.013 3.721 1.00 8.06 H new ATOM 0 HE3 LYS B 100 9.424 24.212 4.732 1.00 8.06 H new ATOM 0 HZ1 LYS B 100 10.895 25.239 3.131 1.00 8.50 H new ATOM 0 HZ2 LYS B 100 11.463 25.522 4.706 1.00 8.50 H new ATOM 0 HZ3 LYS B 100 12.220 24.359 3.726 1.00 8.50 H new ATOM 3875 N LYS B 101 8.985 19.468 2.735 1.00 4.83 N ATOM 3876 CA LYS B 101 8.998 18.910 1.400 1.00 4.42 C ATOM 3877 C LYS B 101 10.113 19.565 0.601 1.00 4.87 C ATOM 3878 O LYS B 101 9.893 20.675 0.075 1.00 5.44 O ATOM 3879 CB LYS B 101 7.655 19.139 0.705 1.00 3.91 C ATOM 3880 CG LYS B 101 7.563 18.492 -0.668 1.00 3.27 C ATOM 3881 CD LYS B 101 6.335 18.969 -1.424 1.00 3.64 C ATOM 3882 CE LYS B 101 6.443 20.439 -1.798 1.00 4.21 C ATOM 3883 NZ LYS B 101 5.236 20.917 -2.521 1.00 4.79 N ATOM 3884 OXT LYS B 101 11.214 18.985 0.528 1.00 5.06 O ATOM 0 H LYS B 101 8.627 20.422 2.787 1.00 4.83 H new ATOM 0 HA LYS B 101 9.169 17.835 1.464 1.00 4.42 H new ATOM 0 HB2 LYS B 101 6.857 18.748 1.336 1.00 3.91 H new ATOM 0 HB3 LYS B 101 7.485 20.211 0.605 1.00 3.91 H new ATOM 0 HG2 LYS B 101 8.459 18.725 -1.243 1.00 3.27 H new ATOM 0 HG3 LYS B 101 7.527 17.408 -0.559 1.00 3.27 H new ATOM 0 HD2 LYS B 101 6.208 18.372 -2.327 1.00 3.64 H new ATOM 0 HD3 LYS B 101 5.447 18.813 -0.812 1.00 3.64 H new ATOM 0 HE2 LYS B 101 6.585 21.034 -0.896 1.00 4.21 H new ATOM 0 HE3 LYS B 101 7.324 20.591 -2.422 1.00 4.21 H new ATOM 0 HZ1 LYS B 101 5.349 21.923 -2.758 1.00 4.79 H new ATOM 0 HZ2 LYS B 101 5.114 20.367 -3.395 1.00 4.79 H new ATOM 0 HZ3 LYS B 101 4.398 20.796 -1.916 1.00 4.79 H new TER 3898 LYS B 101