USER MOD reduce.3.24.130724 H: found=0, std=0, add=1944, rem=0, adj=75 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 35:sc= -6.45! USER MOD Set 1.2: C1934 MET CE :methyl -134:sc= -3.12 (180deg=-2.31!) USER MOD Set 2.1: B 97 GLN : amide:sc= -0.0565 X(o=-0.051,f=-0.27) USER MOD Set 2.2: C1919 ASN : amide:sc= 0.00593 X(o=-0.051,f=-0.54) USER MOD Set 3.1: B 81 CYS SG : rot -91:sc= -13.1! USER MOD Set 3.2: B 85 MET CE :methyl -156:sc= 0 (180deg=-0.374) USER MOD Set 4.1: B 64 SER OG : rot 101:sc= 0.168 USER MOD Set 4.2: C1920 LYS NZ :NH3+ -167:sc= 0.0171 (180deg=0) USER MOD Set 5.1: B 30 ASN : amide:sc= -1.56! C(o=-0.36!,f=-2.1!) USER MOD Set 5.2: B 32 SER OG : rot 81:sc= 1.21 USER MOD Set 6.1: B 31 LYS NZ :NH3+ -137:sc= 1.21 (180deg=-0.109) USER MOD Set 6.2: B 68 ASN : amide:sc= 0.711 K(o=1.9,f=-7.8!) USER MOD Set 7.1: A 12 MET CE :methyl 148:sc= -0.46 (180deg=-1.72!) USER MOD Set 7.2: A 80 SER OG : rot -60:sc= -0.744 USER MOD Set 7.3: B 12 MET CE :methyl 177:sc= -2.49 (180deg=-2.28) USER MOD Set 7.4: B 80 SER OG : rot -150:sc= -1.58! USER MOD Set 8.1: A 81 CYS SG : rot 34:sc= -5.06! USER MOD Set 8.2: A 84 MET CE :methyl 177:sc= -4.62! (180deg=-4.7!) USER MOD Set 8.3: C1910 MET CE :methyl -175:sc= -5.58! (180deg=-5.87!) USER MOD Set 9.1: A 73 GLN : amide:sc= -0.451 X(o=-10,f=-11) USER MOD Set 9.2: A 76 CYS SG : rot -45:sc= -4.16! USER MOD Set 9.3: B 84 MET CE :methyl 152:sc= -6.73! (180deg=-13.3!) USER MOD Set 9.4: C1915 SER OG : rot 180:sc= 0 USER MOD Set 9.5: C1918 LYS NZ :NH3+ 161:sc= 0.988 (180deg=0.753) USER MOD Set10.1: A 64 SER OG : rot -26:sc= 1.28 USER MOD Set10.2: C1911 ASN :FLIP amide:sc= -0.821 F(o=-2.8!,f=0.46) USER MOD Set11.1: A 57 LYS NZ :NH3+ -170:sc= 1.29 (180deg=0) USER MOD Set11.2: A 61 ASN : amide:sc= 0.831 K(o=2.1,f=-9.1!) USER MOD Set12.1: A 30 ASN : amide:sc= -1.31! C(o=-0.097!,f=-2.1!) USER MOD Set12.2: A 32 SER OG : rot 64:sc= 1.21 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 3 CYS SG : rot 180:sc= 0 USER MOD Single : A 7 LYS NZ :NH3+ 142:sc= 1.27 (180deg=0.573) USER MOD Single : A 14 SER OG : rot 90:sc= 1.27 USER MOD Single : A 15 THR OG1 : rot -130:sc= 1.09 USER MOD Single : A 17 HIS :FLIP no HE2:sc= -0.698 F(o=-1.8,f=-0.7) USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 TYR OH : rot 24:sc= 1.18 USER MOD Single : A 20 SER OG : rot 163:sc= 0.716 USER MOD Single : A 22 LYS NZ :NH3+ 166:sc= 1.25 (180deg=0.822) USER MOD Single : A 26 LYS NZ :NH3+ 166:sc= 1.08 (180deg=0.657) USER MOD Single : A 28 LYS NZ :NH3+ 149:sc= 1.08 (180deg=0.3) USER MOD Single : A 31 LYS NZ :NH3+ -170:sc=-0.00361 (180deg=-0.103) USER MOD Single : A 35 LYS NZ :NH3+ 164:sc= 1.29 (180deg=1.12) USER MOD Single : A 39 THR OG1 : rot -8:sc= 0.0257 USER MOD Single : A 44 SER OG : rot 114:sc= 1.24 USER MOD Single : A 48 LYS NZ :NH3+ 176:sc= 0 (180deg=-0.00836) USER MOD Single : A 50 THR OG1 : rot 90:sc= -2.24! USER MOD Single : A 56 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 59 MET CE :methyl 141:sc= -2.28! (180deg=-3.56!) USER MOD Single : A 60 SER OG : rot 180:sc= 1.03 USER MOD Single : A 65 ASN : amide:sc= 0.83 K(o=0.83,f=-0.75) USER MOD Single : A 68 ASN : amide:sc= -0.0499 K(o=-0.05,f=-1.9!) USER MOD Single : A 75 TYR OH : rot 30:sc= -0.363 USER MOD Single : A 85 MET CE :methyl 178:sc= -9.7! (180deg=-10.1!) USER MOD Single : A 86 CYS SG : rot -31:sc= 0.0536 USER MOD Single : A 87 ASN : amide:sc=-0.00584 X(o=-0.0058,f=0) USER MOD Single : A 96 LYS NZ :NH3+ -149:sc= -1.18 (180deg=-2.66!) USER MOD Single : A 97 GLN :FLIP amide:sc= 0 F(o=-1.2,f=0) USER MOD Single : A 100 LYS NZ :NH3+ 165:sc= -0.0493 (180deg=-0.295) USER MOD Single : A 101 LYS NZ :NH3+ 165:sc= -0.0391 (180deg=-0.367) USER MOD Single : B 1 MET CE :methyl -161:sc= -0.14 (180deg=-0.696) USER MOD Single : B 1 MET N :NH3+ -119:sc= 0.179 (180deg=0) USER MOD Single : B 3 CYS SG : rot 180:sc= 0 USER MOD Single : B 7 LYS NZ :NH3+ 125:sc= 1.23 (180deg=0.532) USER MOD Single : B 14 SER OG : rot 77:sc= 1.24 USER MOD Single : B 15 THR OG1 : rot -125:sc= 1.25 USER MOD Single : B 17 HIS :FLIP no HE2:sc= -0.659 F(o=-1.8,f=-0.66) USER MOD Single : B 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 19 TYR OH : rot 28:sc= 1.19 USER MOD Single : B 20 SER OG : rot 161:sc= 0.594 USER MOD Single : B 22 LYS NZ :NH3+ 167:sc= 1.15 (180deg=0.873) USER MOD Single : B 26 LYS NZ :NH3+ 167:sc= 1.05 (180deg=0.673) USER MOD Single : B 28 LYS NZ :NH3+ 139:sc= 1.17 (180deg=0.802) USER MOD Single : B 35 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 39 THR OG1 : rot -12:sc= 0.134 USER MOD Single : B 44 SER OG : rot 115:sc= 1.24 USER MOD Single : B 48 LYS NZ :NH3+ 174:sc= 0 (180deg=-0.0568) USER MOD Single : B 50 THR OG1 : rot 49:sc= 0.268 USER MOD Single : B 56 GLN :FLIP amide:sc= -0.303 F(o=-1.7!,f=-0.3) USER MOD Single : B 57 LYS NZ :NH3+ -164:sc= 1.17 (180deg=0.515) USER MOD Single : B 59 MET CE :methyl 167:sc= -2.27 (180deg=-2.74) USER MOD Single : B 60 SER OG : rot 9:sc= 1.09 USER MOD Single : B 61 ASN : amide:sc= -0.44 K(o=-0.44,f=-1.2) USER MOD Single : B 65 ASN : amide:sc= 0 K(o=0,f=-0.71) USER MOD Single : B 73 GLN : amide:sc= -0.212! X(o=-0.21!,f=-0.37) USER MOD Single : B 75 TYR OH : rot 0:sc= -0.277 USER MOD Single : B 76 CYS SG : rot 70:sc= -0.238 USER MOD Single : B 87 ASN :FLIP amide:sc= -1.47! C(o=-2.7!,f=-1.5!) USER MOD Single : B 96 LYS NZ :NH3+ -163:sc= 1.14 (180deg=0.959) 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 : amide:sc= -1.37! K(o=-1.4!,f=-2.1) USER MOD Single : C1904 THR OG1 : rot -50:sc= -1.38! USER MOD Single : C1906 THR OG1 : rot 67:sc= 1.32 USER MOD Single : C1916 SER OG : rot 180:sc= 0 USER MOD ----------------------------------------------------------------- ATOM 1 N GLN C1897 -19.479 -12.164 0.457 1.00 1.90 N ATOM 2 CA GLN C1897 -18.994 -10.808 0.124 1.00 1.28 C ATOM 3 C GLN C1897 -18.221 -10.219 1.295 1.00 1.03 C ATOM 4 O GLN C1897 -18.295 -10.719 2.418 1.00 1.73 O ATOM 5 CB GLN C1897 -20.175 -9.887 -0.221 1.00 1.38 C ATOM 6 CG GLN C1897 -19.765 -8.476 -0.623 1.00 1.18 C ATOM 7 CD GLN C1897 -20.948 -7.555 -0.799 1.00 1.58 C ATOM 8 OE1 GLN C1897 -21.974 -7.701 -0.136 1.00 2.33 O ATOM 9 NE2 GLN C1897 -20.811 -6.601 -1.698 1.00 1.78 N ATOM 0 HA GLN C1897 -18.334 -10.885 -0.740 1.00 1.28 H new ATOM 0 HB2 GLN C1897 -20.745 -10.334 -1.035 1.00 1.38 H new ATOM 0 HB3 GLN C1897 -20.841 -9.829 0.640 1.00 1.38 H new ATOM 0 HG2 GLN C1897 -19.099 -8.065 0.136 1.00 1.18 H new ATOM 0 HG3 GLN C1897 -19.200 -8.517 -1.554 1.00 1.18 H new ATOM 0 HE21 GLN C1897 -19.942 -6.518 -2.225 1.00 1.78 H new ATOM 0 HE22 GLN C1897 -21.574 -5.946 -1.867 1.00 1.78 H new ATOM 20 N ARG C1898 -17.449 -9.181 0.995 1.00 0.67 N ATOM 21 CA ARG C1898 -16.826 -8.334 1.970 1.00 0.76 C ATOM 22 C ARG C1898 -15.535 -8.934 2.486 1.00 0.64 C ATOM 23 O ARG C1898 -15.432 -9.467 3.590 1.00 0.95 O ATOM 24 CB ARG C1898 -17.788 -7.934 3.071 1.00 1.15 C ATOM 25 CG ARG C1898 -17.160 -7.035 4.124 1.00 1.54 C ATOM 26 CD ARG C1898 -16.247 -5.987 3.491 1.00 2.04 C ATOM 27 NE ARG C1898 -16.949 -4.987 2.684 1.00 2.71 N ATOM 28 CZ ARG C1898 -16.805 -4.836 1.354 1.00 3.58 C ATOM 29 NH1 ARG C1898 -16.245 -5.788 0.620 1.00 3.84 N ATOM 30 NH2 ARG C1898 -17.270 -3.748 0.754 1.00 4.54 N ATOM 0 H ARG C1898 -17.241 -8.909 0.034 1.00 0.67 H new ATOM 0 HA ARG C1898 -16.548 -7.405 1.473 1.00 0.76 H new ATOM 0 HB2 ARG C1898 -18.642 -7.421 2.629 1.00 1.15 H new ATOM 0 HB3 ARG C1898 -18.171 -8.833 3.553 1.00 1.15 H new ATOM 0 HG2 ARG C1898 -17.944 -6.539 4.695 1.00 1.54 H new ATOM 0 HG3 ARG C1898 -16.588 -7.641 4.827 1.00 1.54 H new ATOM 0 HD2 ARG C1898 -15.695 -5.478 4.281 1.00 2.04 H new ATOM 0 HD3 ARG C1898 -15.512 -6.493 2.864 1.00 2.04 H new ATOM 0 HE ARG C1898 -17.594 -4.359 3.164 1.00 2.71 H new ATOM 0 HH11 ARG C1898 -15.918 -6.647 1.062 1.00 3.84 H new ATOM 0 HH12 ARG C1898 -16.142 -5.661 -0.387 1.00 3.84 H new ATOM 0 HH21 ARG C1898 -17.737 -3.025 1.300 1.00 4.54 H new ATOM 0 HH22 ARG C1898 -17.160 -3.635 -0.254 1.00 4.54 H new ATOM 44 N GLU C1899 -14.573 -8.843 1.611 1.00 0.40 N ATOM 45 CA GLU C1899 -13.184 -9.106 1.888 1.00 0.29 C ATOM 46 C GLU C1899 -12.616 -8.007 2.770 1.00 0.24 C ATOM 47 O GLU C1899 -11.717 -8.237 3.571 1.00 0.27 O ATOM 48 CB GLU C1899 -12.440 -9.102 0.563 1.00 0.30 C ATOM 49 CG GLU C1899 -12.909 -7.963 -0.337 1.00 0.35 C ATOM 50 CD GLU C1899 -14.103 -8.354 -1.182 1.00 0.62 C ATOM 51 OE1 GLU C1899 -13.890 -9.042 -2.208 1.00 0.76 O ATOM 52 OE2 GLU C1899 -15.230 -7.940 -0.870 1.00 0.97 O ATOM 0 H GLU C1899 -14.741 -8.572 0.642 1.00 0.40 H new ATOM 0 HA GLU C1899 -13.078 -10.064 2.398 1.00 0.29 H new ATOM 0 HB2 GLU C1899 -11.370 -9.006 0.746 1.00 0.30 H new ATOM 0 HB3 GLU C1899 -12.593 -10.055 0.056 1.00 0.30 H new ATOM 0 HG2 GLU C1899 -13.168 -7.100 0.277 1.00 0.35 H new ATOM 0 HG3 GLU C1899 -12.090 -7.657 -0.988 1.00 0.35 H new ATOM 59 N LEU C1900 -13.173 -6.804 2.617 1.00 0.24 N ATOM 60 CA LEU C1900 -12.663 -5.625 3.299 1.00 0.25 C ATOM 61 C LEU C1900 -12.809 -5.738 4.819 1.00 0.28 C ATOM 62 O LEU C1900 -12.240 -4.942 5.561 1.00 0.44 O ATOM 63 CB LEU C1900 -13.347 -4.341 2.796 1.00 0.33 C ATOM 64 CG LEU C1900 -12.892 -3.801 1.435 1.00 0.20 C ATOM 65 CD1 LEU C1900 -11.383 -3.844 1.298 1.00 0.22 C ATOM 66 CD2 LEU C1900 -13.570 -4.508 0.297 1.00 0.31 C ATOM 0 H LEU C1900 -13.982 -6.626 2.022 1.00 0.24 H new ATOM 0 HA LEU C1900 -11.600 -5.565 3.064 1.00 0.25 H new ATOM 0 HB2 LEU C1900 -14.420 -4.525 2.746 1.00 0.33 H new ATOM 0 HB3 LEU C1900 -13.192 -3.560 3.540 1.00 0.33 H new ATOM 0 HG LEU C1900 -13.196 -2.755 1.387 1.00 0.20 H new ATOM 0 HD11 LEU C1900 -11.095 -3.454 0.322 1.00 0.22 H new ATOM 0 HD12 LEU C1900 -10.929 -3.235 2.080 1.00 0.22 H new ATOM 0 HD13 LEU C1900 -11.038 -4.874 1.394 1.00 0.22 H new ATOM 0 HD21 LEU C1900 -13.219 -4.095 -0.649 1.00 0.31 H new ATOM 0 HD22 LEU C1900 -13.335 -5.572 0.338 1.00 0.31 H new ATOM 0 HD23 LEU C1900 -14.649 -4.371 0.375 1.00 0.31 H new ATOM 78 N GLU C1901 -13.562 -6.730 5.283 1.00 0.27 N ATOM 79 CA GLU C1901 -13.678 -6.981 6.713 1.00 0.34 C ATOM 80 C GLU C1901 -12.365 -7.547 7.232 1.00 0.37 C ATOM 81 O GLU C1901 -11.901 -7.188 8.309 1.00 0.52 O ATOM 82 CB GLU C1901 -14.824 -7.953 7.007 1.00 0.48 C ATOM 83 CG GLU C1901 -15.047 -8.194 8.490 1.00 1.00 C ATOM 84 CD GLU C1901 -16.082 -9.264 8.765 1.00 1.11 C ATOM 85 OE1 GLU C1901 -17.284 -8.934 8.832 1.00 1.44 O ATOM 86 OE2 GLU C1901 -15.694 -10.439 8.931 1.00 1.48 O ATOM 0 H GLU C1901 -14.097 -7.368 4.694 1.00 0.27 H new ATOM 0 HA GLU C1901 -13.897 -6.041 7.219 1.00 0.34 H new ATOM 0 HB2 GLU C1901 -15.742 -7.563 6.568 1.00 0.48 H new ATOM 0 HB3 GLU C1901 -14.617 -8.905 6.519 1.00 0.48 H new ATOM 0 HG2 GLU C1901 -14.103 -8.482 8.952 1.00 1.00 H new ATOM 0 HG3 GLU C1901 -15.361 -7.263 8.961 1.00 1.00 H new ATOM 93 N ASP C1902 -11.773 -8.430 6.439 1.00 0.37 N ATOM 94 CA ASP C1902 -10.473 -9.007 6.755 1.00 0.46 C ATOM 95 C ASP C1902 -9.366 -8.072 6.291 1.00 0.44 C ATOM 96 O ASP C1902 -8.362 -7.886 6.977 1.00 0.58 O ATOM 97 CB ASP C1902 -10.306 -10.368 6.067 1.00 0.60 C ATOM 98 CG ASP C1902 -11.339 -11.388 6.500 1.00 1.18 C ATOM 99 OD1 ASP C1902 -12.486 -11.330 6.002 1.00 2.01 O ATOM 100 OD2 ASP C1902 -11.004 -12.264 7.329 1.00 1.42 O ATOM 0 H ASP C1902 -12.177 -8.765 5.564 1.00 0.37 H new ATOM 0 HA ASP C1902 -10.411 -9.144 7.835 1.00 0.46 H new ATOM 0 HB2 ASP C1902 -10.370 -10.232 4.987 1.00 0.60 H new ATOM 0 HB3 ASP C1902 -9.310 -10.756 6.281 1.00 0.60 H new ATOM 105 N ALA C1903 -9.583 -7.478 5.120 1.00 0.36 N ATOM 106 CA ALA C1903 -8.608 -6.598 4.478 1.00 0.46 C ATOM 107 C ALA C1903 -8.133 -5.495 5.388 1.00 0.37 C ATOM 108 O ALA C1903 -6.994 -5.476 5.857 1.00 0.37 O ATOM 109 CB ALA C1903 -9.226 -5.928 3.266 1.00 0.66 C ATOM 0 H ALA C1903 -10.445 -7.594 4.586 1.00 0.36 H new ATOM 0 HA ALA C1903 -7.765 -7.233 4.207 1.00 0.46 H new ATOM 0 HB1 ALA C1903 -8.490 -5.275 2.796 1.00 0.66 H new ATOM 0 HB2 ALA C1903 -9.544 -6.688 2.553 1.00 0.66 H new ATOM 0 HB3 ALA C1903 -10.088 -5.338 3.577 1.00 0.66 H new ATOM 115 N THR C1904 -9.037 -4.573 5.629 1.00 0.37 N ATOM 116 CA THR C1904 -8.698 -3.322 6.238 1.00 0.36 C ATOM 117 C THR C1904 -8.811 -3.413 7.749 1.00 0.34 C ATOM 118 O THR C1904 -8.535 -2.459 8.472 1.00 0.36 O ATOM 119 CB THR C1904 -9.570 -2.213 5.636 1.00 0.40 C ATOM 120 OG1 THR C1904 -10.959 -2.516 5.813 1.00 0.42 O ATOM 121 CG2 THR C1904 -9.278 -2.101 4.146 1.00 0.40 C ATOM 0 H THR C1904 -10.027 -4.676 5.405 1.00 0.37 H new ATOM 0 HA THR C1904 -7.658 -3.073 6.028 1.00 0.36 H new ATOM 0 HB THR C1904 -9.342 -1.274 6.141 1.00 0.40 H new ATOM 0 HG1 THR C1904 -11.134 -3.433 5.515 1.00 0.42 H new ATOM 0 HG21 THR C1904 -9.895 -1.314 3.712 1.00 0.40 H new ATOM 0 HG22 THR C1904 -8.225 -1.859 3.999 1.00 0.40 H new ATOM 0 HG23 THR C1904 -9.504 -3.049 3.659 1.00 0.40 H new ATOM 129 N GLU C1905 -9.206 -4.588 8.214 1.00 0.32 N ATOM 130 CA GLU C1905 -9.059 -4.949 9.610 1.00 0.32 C ATOM 131 C GLU C1905 -7.614 -4.733 9.997 1.00 0.28 C ATOM 132 O GLU C1905 -7.289 -4.035 10.958 1.00 0.32 O ATOM 133 CB GLU C1905 -9.378 -6.423 9.777 1.00 0.36 C ATOM 134 CG GLU C1905 -9.213 -6.946 11.193 1.00 0.62 C ATOM 135 CD GLU C1905 -9.404 -8.445 11.277 1.00 1.25 C ATOM 136 OE1 GLU C1905 -10.551 -8.898 11.452 1.00 1.76 O ATOM 137 OE2 GLU C1905 -8.404 -9.181 11.156 1.00 2.06 O ATOM 0 H GLU C1905 -9.634 -5.312 7.637 1.00 0.32 H new ATOM 0 HA GLU C1905 -9.726 -4.349 10.228 1.00 0.32 H new ATOM 0 HB2 GLU C1905 -10.405 -6.598 9.456 1.00 0.36 H new ATOM 0 HB3 GLU C1905 -8.733 -6.999 9.113 1.00 0.36 H new ATOM 0 HG2 GLU C1905 -8.220 -6.687 11.560 1.00 0.62 H new ATOM 0 HG3 GLU C1905 -9.933 -6.453 11.846 1.00 0.62 H new ATOM 144 N THR C1906 -6.761 -5.349 9.196 1.00 0.25 N ATOM 145 CA THR C1906 -5.333 -5.245 9.340 1.00 0.24 C ATOM 146 C THR C1906 -4.835 -3.866 8.926 1.00 0.21 C ATOM 147 O THR C1906 -3.712 -3.487 9.265 1.00 0.19 O ATOM 148 CB THR C1906 -4.646 -6.328 8.494 1.00 0.29 C ATOM 149 OG1 THR C1906 -5.618 -6.975 7.657 1.00 0.48 O ATOM 150 CG2 THR C1906 -3.981 -7.359 9.389 1.00 0.47 C ATOM 0 H THR C1906 -7.053 -5.942 8.419 1.00 0.25 H new ATOM 0 HA THR C1906 -5.084 -5.391 10.391 1.00 0.24 H new ATOM 0 HB THR C1906 -3.883 -5.856 7.874 1.00 0.29 H new ATOM 0 HG1 THR C1906 -5.951 -6.339 6.990 1.00 0.48 H new ATOM 0 HG21 THR C1906 -3.499 -8.119 8.773 1.00 0.47 H new ATOM 0 HG22 THR C1906 -3.233 -6.870 10.014 1.00 0.47 H new ATOM 0 HG23 THR C1906 -4.733 -7.829 10.023 1.00 0.47 H new ATOM 158 N ALA C1907 -5.665 -3.116 8.189 1.00 0.23 N ATOM 159 CA ALA C1907 -5.298 -1.751 7.818 1.00 0.21 C ATOM 160 C ALA C1907 -5.007 -0.917 9.057 1.00 0.21 C ATOM 161 O ALA C1907 -4.029 -0.171 9.096 1.00 0.21 O ATOM 162 CB ALA C1907 -6.363 -1.072 6.965 1.00 0.22 C ATOM 0 H ALA C1907 -6.574 -3.426 7.846 1.00 0.23 H new ATOM 0 HA ALA C1907 -4.394 -1.822 7.212 1.00 0.21 H new ATOM 0 HB1 ALA C1907 -6.041 -0.061 6.717 1.00 0.22 H new ATOM 0 HB2 ALA C1907 -6.511 -1.641 6.047 1.00 0.22 H new ATOM 0 HB3 ALA C1907 -7.300 -1.028 7.520 1.00 0.22 H new ATOM 168 N ASP C1908 -5.852 -1.062 10.069 1.00 0.24 N ATOM 169 CA ASP C1908 -5.661 -0.372 11.341 1.00 0.26 C ATOM 170 C ASP C1908 -4.279 -0.673 11.926 1.00 0.27 C ATOM 171 O ASP C1908 -3.602 0.221 12.434 1.00 0.34 O ATOM 172 CB ASP C1908 -6.752 -0.779 12.333 1.00 0.33 C ATOM 173 CG ASP C1908 -6.581 -0.140 13.697 1.00 0.44 C ATOM 174 OD1 ASP C1908 -6.891 1.063 13.838 1.00 0.58 O ATOM 175 OD2 ASP C1908 -6.106 -0.821 14.629 1.00 0.68 O ATOM 0 H ASP C1908 -6.682 -1.655 10.034 1.00 0.24 H new ATOM 0 HA ASP C1908 -5.728 0.700 11.158 1.00 0.26 H new ATOM 0 HB2 ASP C1908 -7.725 -0.502 11.928 1.00 0.33 H new ATOM 0 HB3 ASP C1908 -6.749 -1.863 12.443 1.00 0.33 H new ATOM 180 N ALA C1909 -3.854 -1.930 11.824 1.00 0.23 N ATOM 181 CA ALA C1909 -2.548 -2.334 12.341 1.00 0.24 C ATOM 182 C ALA C1909 -1.414 -1.750 11.495 1.00 0.22 C ATOM 183 O ALA C1909 -0.541 -1.049 12.018 1.00 0.24 O ATOM 184 CB ALA C1909 -2.444 -3.848 12.402 1.00 0.27 C ATOM 0 H ALA C1909 -4.390 -2.682 11.391 1.00 0.23 H new ATOM 0 HA ALA C1909 -2.450 -1.939 13.352 1.00 0.24 H new ATOM 0 HB1 ALA C1909 -1.465 -4.130 12.789 1.00 0.27 H new ATOM 0 HB2 ALA C1909 -3.221 -4.240 13.059 1.00 0.27 H new ATOM 0 HB3 ALA C1909 -2.572 -4.262 11.402 1.00 0.27 H new ATOM 190 N MET C1910 -1.428 -2.053 10.194 1.00 0.19 N ATOM 191 CA MET C1910 -0.482 -1.472 9.239 1.00 0.19 C ATOM 192 C MET C1910 -0.363 0.040 9.384 1.00 0.19 C ATOM 193 O MET C1910 0.703 0.591 9.193 1.00 0.22 O ATOM 194 CB MET C1910 -0.895 -1.821 7.805 1.00 0.18 C ATOM 195 CG MET C1910 -0.244 -0.954 6.727 1.00 0.20 C ATOM 196 SD MET C1910 -0.514 -1.621 5.083 1.00 0.20 S ATOM 197 CE MET C1910 0.132 -3.277 5.304 1.00 0.14 C ATOM 0 H MET C1910 -2.092 -2.704 9.775 1.00 0.19 H new ATOM 0 HA MET C1910 0.495 -1.901 9.459 1.00 0.19 H new ATOM 0 HB2 MET C1910 -0.646 -2.865 7.613 1.00 0.18 H new ATOM 0 HB3 MET C1910 -1.978 -1.731 7.720 1.00 0.18 H new ATOM 0 HG2 MET C1910 -0.648 0.057 6.780 1.00 0.20 H new ATOM 0 HG3 MET C1910 0.827 -0.879 6.918 1.00 0.20 H new ATOM 0 HE1 MET C1910 0.122 -3.802 4.349 1.00 0.14 H new ATOM 0 HE2 MET C1910 1.155 -3.222 5.677 1.00 0.14 H new ATOM 0 HE3 MET C1910 -0.487 -3.816 6.021 1.00 0.14 H new ATOM 207 N ASN C1911 -1.443 0.708 9.730 1.00 0.21 N ATOM 208 CA ASN C1911 -1.429 2.164 9.839 1.00 0.22 C ATOM 209 C ASN C1911 -0.486 2.635 10.932 1.00 0.23 C ATOM 210 O ASN C1911 0.224 3.629 10.775 1.00 0.27 O ATOM 211 CB ASN C1911 -2.829 2.672 10.132 1.00 0.24 C ATOM 212 CG ASN C1911 -2.925 4.169 10.015 1.00 0.25 C ATOM 213 OD1 ASN C1911 -3.212 4.627 8.815 1.00 0.42 O flip ATOM 214 ND2 ASN C1911 -2.739 4.902 10.987 1.00 0.25 N flip ATOM 0 H ASN C1911 -2.342 0.275 9.941 1.00 0.21 H new ATOM 0 HA ASN C1911 -1.076 2.564 8.888 1.00 0.22 H new ATOM 0 HB2 ASN C1911 -3.534 2.209 9.441 1.00 0.24 H new ATOM 0 HB3 ASN C1911 -3.121 2.368 11.137 1.00 0.24 H new ATOM 0 HD21 ASN C1911 -2.519 4.497 11.897 1.00 0.25 H new ATOM 0 HD22 ASN C1911 -2.805 5.914 10.882 1.00 0.25 H new ATOM 221 N ARG C1912 -0.462 1.912 12.032 1.00 0.23 N ATOM 222 CA ARG C1912 0.331 2.317 13.179 1.00 0.26 C ATOM 223 C ARG C1912 1.806 2.176 12.858 1.00 0.28 C ATOM 224 O ARG C1912 2.626 3.005 13.245 1.00 0.38 O ATOM 225 CB ARG C1912 -0.020 1.475 14.398 1.00 0.30 C ATOM 226 CG ARG C1912 -1.519 1.300 14.612 1.00 0.75 C ATOM 227 CD ARG C1912 -2.286 2.593 14.352 1.00 1.46 C ATOM 228 NE ARG C1912 -1.831 3.689 15.206 1.00 2.17 N ATOM 229 CZ ARG C1912 -2.205 4.959 15.053 1.00 2.91 C ATOM 230 NH1 ARG C1912 -3.013 5.307 14.059 1.00 3.13 N ATOM 231 NH2 ARG C1912 -1.764 5.885 15.892 1.00 3.76 N ATOM 0 H ARG C1912 -0.980 1.043 12.158 1.00 0.23 H new ATOM 0 HA ARG C1912 0.110 3.360 13.406 1.00 0.26 H new ATOM 0 HB2 ARG C1912 0.440 0.492 14.294 1.00 0.30 H new ATOM 0 HB3 ARG C1912 0.413 1.938 15.285 1.00 0.30 H new ATOM 0 HG2 ARG C1912 -1.891 0.518 13.950 1.00 0.75 H new ATOM 0 HG3 ARG C1912 -1.703 0.968 15.634 1.00 0.75 H new ATOM 0 HD2 ARG C1912 -2.170 2.878 13.306 1.00 1.46 H new ATOM 0 HD3 ARG C1912 -3.349 2.422 14.520 1.00 1.46 H new ATOM 0 HE ARG C1912 -1.188 3.468 15.966 1.00 2.17 H new ATOM 0 HH11 ARG C1912 -3.352 4.600 13.406 1.00 3.13 H new ATOM 0 HH12 ARG C1912 -3.295 6.281 13.948 1.00 3.13 H new ATOM 0 HH21 ARG C1912 -1.138 5.626 16.655 1.00 3.76 H new ATOM 0 HH22 ARG C1912 -2.050 6.857 15.775 1.00 3.76 H new ATOM 245 N GLU C1913 2.127 1.128 12.120 1.00 0.23 N ATOM 246 CA GLU C1913 3.493 0.885 11.715 1.00 0.25 C ATOM 247 C GLU C1913 3.826 1.699 10.481 1.00 0.22 C ATOM 248 O GLU C1913 4.958 2.095 10.299 1.00 0.27 O ATOM 249 CB GLU C1913 3.705 -0.600 11.437 1.00 0.29 C ATOM 250 CG GLU C1913 2.742 -1.155 10.407 1.00 0.29 C ATOM 251 CD GLU C1913 2.822 -2.659 10.288 1.00 0.39 C ATOM 252 OE1 GLU C1913 2.975 -3.340 11.319 1.00 0.79 O ATOM 253 OE2 GLU C1913 2.742 -3.168 9.150 1.00 0.57 O ATOM 0 H GLU C1913 1.457 0.433 11.791 1.00 0.23 H new ATOM 0 HA GLU C1913 4.156 1.188 12.525 1.00 0.25 H new ATOM 0 HB2 GLU C1913 4.727 -0.757 11.092 1.00 0.29 H new ATOM 0 HB3 GLU C1913 3.594 -1.157 12.367 1.00 0.29 H new ATOM 0 HG2 GLU C1913 1.725 -0.869 10.675 1.00 0.29 H new ATOM 0 HG3 GLU C1913 2.955 -0.706 9.437 1.00 0.29 H new ATOM 260 N VAL C1914 2.827 1.963 9.650 1.00 0.19 N ATOM 261 CA VAL C1914 3.034 2.673 8.394 1.00 0.20 C ATOM 262 C VAL C1914 3.433 4.108 8.659 1.00 0.18 C ATOM 263 O VAL C1914 4.282 4.668 7.967 1.00 0.20 O ATOM 264 CB VAL C1914 1.771 2.636 7.493 1.00 0.24 C ATOM 265 CG1 VAL C1914 0.803 3.755 7.809 1.00 0.26 C ATOM 266 CG2 VAL C1914 2.143 2.689 6.035 1.00 0.29 C ATOM 0 H VAL C1914 1.859 1.694 9.824 1.00 0.19 H new ATOM 0 HA VAL C1914 3.839 2.164 7.863 1.00 0.20 H new ATOM 0 HB VAL C1914 1.272 1.690 7.705 1.00 0.24 H new ATOM 0 HG11 VAL C1914 -0.063 3.684 7.151 1.00 0.26 H new ATOM 0 HG12 VAL C1914 0.478 3.673 8.846 1.00 0.26 H new ATOM 0 HG13 VAL C1914 1.295 4.716 7.658 1.00 0.26 H new ATOM 0 HG21 VAL C1914 1.238 2.662 5.427 1.00 0.29 H new ATOM 0 HG22 VAL C1914 2.689 3.610 5.832 1.00 0.29 H new ATOM 0 HG23 VAL C1914 2.772 1.833 5.789 1.00 0.29 H new ATOM 276 N SER C1915 2.831 4.688 9.683 1.00 0.21 N ATOM 277 CA SER C1915 3.099 6.057 10.027 1.00 0.28 C ATOM 278 C SER C1915 4.520 6.172 10.562 1.00 0.28 C ATOM 279 O SER C1915 5.224 7.145 10.291 1.00 0.36 O ATOM 280 CB SER C1915 2.077 6.537 11.046 1.00 0.36 C ATOM 281 OG SER C1915 2.139 7.944 11.213 1.00 1.31 O ATOM 0 H SER C1915 2.153 4.223 10.287 1.00 0.21 H new ATOM 0 HA SER C1915 3.015 6.691 9.144 1.00 0.28 H new ATOM 0 HB2 SER C1915 1.076 6.250 10.723 1.00 0.36 H new ATOM 0 HB3 SER C1915 2.256 6.047 12.003 1.00 0.36 H new ATOM 0 HG SER C1915 1.470 8.225 11.872 1.00 1.31 H new ATOM 287 N SER C1916 4.949 5.146 11.294 1.00 0.25 N ATOM 288 CA SER C1916 6.316 5.087 11.782 1.00 0.27 C ATOM 289 C SER C1916 7.274 4.671 10.662 1.00 0.27 C ATOM 290 O SER C1916 8.335 5.268 10.488 1.00 0.29 O ATOM 291 CB SER C1916 6.420 4.109 12.960 1.00 0.31 C ATOM 292 OG SER C1916 7.738 4.076 13.489 1.00 1.04 O ATOM 0 H SER C1916 4.369 4.350 11.559 1.00 0.25 H new ATOM 0 HA SER C1916 6.600 6.082 12.125 1.00 0.27 H new ATOM 0 HB2 SER C1916 5.719 4.402 13.742 1.00 0.31 H new ATOM 0 HB3 SER C1916 6.132 3.110 12.632 1.00 0.31 H new ATOM 0 HG SER C1916 7.774 3.446 14.239 1.00 1.04 H new ATOM 298 N LEU C1917 6.882 3.662 9.890 1.00 0.30 N ATOM 299 CA LEU C1917 7.736 3.106 8.856 1.00 0.30 C ATOM 300 C LEU C1917 8.000 4.116 7.758 1.00 0.26 C ATOM 301 O LEU C1917 9.150 4.326 7.372 1.00 0.26 O ATOM 302 CB LEU C1917 7.145 1.812 8.269 1.00 0.42 C ATOM 303 CG LEU C1917 8.101 1.009 7.370 1.00 0.57 C ATOM 304 CD1 LEU C1917 7.583 -0.390 7.129 1.00 1.25 C ATOM 305 CD2 LEU C1917 8.303 1.695 6.042 1.00 1.16 C ATOM 0 H LEU C1917 5.970 3.212 9.966 1.00 0.30 H new ATOM 0 HA LEU C1917 8.688 2.857 9.326 1.00 0.30 H new ATOM 0 HB2 LEU C1917 6.821 1.173 9.091 1.00 0.42 H new ATOM 0 HB3 LEU C1917 6.255 2.066 7.692 1.00 0.42 H new ATOM 0 HG LEU C1917 9.055 0.950 7.894 1.00 0.57 H new ATOM 0 HD11 LEU C1917 8.281 -0.931 6.490 1.00 1.25 H new ATOM 0 HD12 LEU C1917 7.484 -0.910 8.082 1.00 1.25 H new ATOM 0 HD13 LEU C1917 6.610 -0.339 6.641 1.00 1.25 H new ATOM 0 HD21 LEU C1917 8.983 1.105 5.427 1.00 1.16 H new ATOM 0 HD22 LEU C1917 7.344 1.791 5.533 1.00 1.16 H new ATOM 0 HD23 LEU C1917 8.728 2.685 6.205 1.00 1.16 H new ATOM 317 N LYS C1918 6.960 4.757 7.252 1.00 0.28 N ATOM 318 CA LYS C1918 7.151 5.693 6.164 1.00 0.29 C ATOM 319 C LYS C1918 8.022 6.864 6.631 1.00 0.32 C ATOM 320 O LYS C1918 8.546 7.625 5.823 1.00 0.38 O ATOM 321 CB LYS C1918 5.808 6.168 5.584 1.00 0.39 C ATOM 322 CG LYS C1918 5.490 7.625 5.830 1.00 0.29 C ATOM 323 CD LYS C1918 4.934 7.835 7.234 1.00 0.40 C ATOM 324 CE LYS C1918 5.078 9.276 7.679 1.00 0.69 C ATOM 325 NZ LYS C1918 4.399 9.540 8.978 1.00 1.36 N ATOM 0 H LYS C1918 5.997 4.649 7.570 1.00 0.28 H new ATOM 0 HA LYS C1918 7.672 5.184 5.353 1.00 0.29 H new ATOM 0 HB2 LYS C1918 5.809 5.987 4.509 1.00 0.39 H new ATOM 0 HB3 LYS C1918 5.010 5.560 6.009 1.00 0.39 H new ATOM 0 HG2 LYS C1918 6.391 8.224 5.699 1.00 0.29 H new ATOM 0 HG3 LYS C1918 4.766 7.972 5.093 1.00 0.29 H new ATOM 0 HD2 LYS C1918 3.882 7.550 7.256 1.00 0.40 H new ATOM 0 HD3 LYS C1918 5.456 7.183 7.934 1.00 0.40 H new ATOM 0 HE2 LYS C1918 6.136 9.522 7.769 1.00 0.69 H new ATOM 0 HE3 LYS C1918 4.662 9.933 6.915 1.00 0.69 H new ATOM 0 HZ1 LYS C1918 4.779 10.413 9.397 1.00 1.36 H new ATOM 0 HZ2 LYS C1918 3.377 9.648 8.820 1.00 1.36 H new ATOM 0 HZ3 LYS C1918 4.566 8.744 9.625 1.00 1.36 H new ATOM 339 N ASN C1919 8.179 6.982 7.952 1.00 0.31 N ATOM 340 CA ASN C1919 9.034 7.999 8.547 1.00 0.33 C ATOM 341 C ASN C1919 10.469 7.487 8.707 1.00 0.32 C ATOM 342 O ASN C1919 11.412 8.274 8.683 1.00 0.41 O ATOM 343 CB ASN C1919 8.474 8.460 9.897 1.00 0.37 C ATOM 344 CG ASN C1919 9.369 9.474 10.590 1.00 0.43 C ATOM 345 OD1 ASN C1919 9.314 10.670 10.302 1.00 1.05 O ATOM 346 ND2 ASN C1919 10.177 9.009 11.530 1.00 1.15 N ATOM 0 H ASN C1919 7.718 6.377 8.631 1.00 0.31 H new ATOM 0 HA ASN C1919 9.053 8.855 7.873 1.00 0.33 H new ATOM 0 HB2 ASN C1919 7.487 8.897 9.746 1.00 0.37 H new ATOM 0 HB3 ASN C1919 8.343 7.594 10.546 1.00 0.37 H new ATOM 0 HD21 ASN C1919 10.782 9.649 12.044 1.00 1.15 H new ATOM 0 HD22 ASN C1919 10.194 8.011 11.740 1.00 1.15 H new ATOM 353 N LYS C1920 10.648 6.169 8.831 1.00 0.28 N ATOM 354 CA LYS C1920 11.993 5.624 8.922 1.00 0.37 C ATOM 355 C LYS C1920 12.583 5.554 7.533 1.00 0.41 C ATOM 356 O LYS C1920 13.788 5.704 7.342 1.00 0.53 O ATOM 357 CB LYS C1920 12.067 4.251 9.639 1.00 0.48 C ATOM 358 CG LYS C1920 10.825 3.356 9.582 1.00 0.33 C ATOM 359 CD LYS C1920 10.993 2.175 10.535 1.00 0.44 C ATOM 360 CE LYS C1920 9.835 1.193 10.445 1.00 1.36 C ATOM 361 NZ LYS C1920 9.977 0.076 11.415 1.00 1.64 N ATOM 0 H LYS C1920 9.897 5.480 8.869 1.00 0.28 H new ATOM 0 HA LYS C1920 12.580 6.296 9.549 1.00 0.37 H new ATOM 0 HB2 LYS C1920 12.903 3.694 9.215 1.00 0.48 H new ATOM 0 HB3 LYS C1920 12.304 4.431 10.688 1.00 0.48 H new ATOM 0 HG2 LYS C1920 9.939 3.930 9.853 1.00 0.33 H new ATOM 0 HG3 LYS C1920 10.672 2.995 8.565 1.00 0.33 H new ATOM 0 HD2 LYS C1920 11.925 1.657 10.308 1.00 0.44 H new ATOM 0 HD3 LYS C1920 11.075 2.544 11.557 1.00 0.44 H new ATOM 0 HE2 LYS C1920 8.898 1.719 10.631 1.00 1.36 H new ATOM 0 HE3 LYS C1920 9.779 0.790 9.434 1.00 1.36 H new ATOM 0 HZ1 LYS C1920 9.300 -0.677 11.179 1.00 1.64 H new ATOM 0 HZ2 LYS C1920 10.945 -0.302 11.370 1.00 1.64 H new ATOM 0 HZ3 LYS C1920 9.785 0.424 12.376 1.00 1.64 H new ATOM 375 N LEU C1921 11.715 5.383 6.555 1.00 0.38 N ATOM 376 CA LEU C1921 12.128 5.426 5.168 1.00 0.46 C ATOM 377 C LEU C1921 12.358 6.873 4.742 1.00 0.59 C ATOM 378 O LEU C1921 13.024 7.154 3.750 1.00 0.92 O ATOM 379 CB LEU C1921 11.081 4.757 4.272 1.00 0.44 C ATOM 380 CG LEU C1921 10.707 3.321 4.659 1.00 0.38 C ATOM 381 CD1 LEU C1921 10.117 2.581 3.477 1.00 0.40 C ATOM 382 CD2 LEU C1921 11.897 2.565 5.207 1.00 0.48 C ATOM 0 H LEU C1921 10.719 5.213 6.696 1.00 0.38 H new ATOM 0 HA LEU C1921 13.063 4.875 5.061 1.00 0.46 H new ATOM 0 HB2 LEU C1921 10.177 5.365 4.282 1.00 0.44 H new ATOM 0 HB3 LEU C1921 11.452 4.754 3.247 1.00 0.44 H new ATOM 0 HG LEU C1921 9.955 3.382 5.446 1.00 0.38 H new ATOM 0 HD11 LEU C1921 9.859 1.565 3.776 1.00 0.40 H new ATOM 0 HD12 LEU C1921 9.220 3.097 3.136 1.00 0.40 H new ATOM 0 HD13 LEU C1921 10.846 2.547 2.668 1.00 0.40 H new ATOM 0 HD21 LEU C1921 11.594 1.552 5.471 1.00 0.48 H new ATOM 0 HD22 LEU C1921 12.682 2.524 4.451 1.00 0.48 H new ATOM 0 HD23 LEU C1921 12.274 3.073 6.094 1.00 0.48 H new ATOM 394 N ARG C1922 11.810 7.781 5.528 1.00 0.49 N ATOM 395 CA ARG C1922 11.909 9.205 5.277 1.00 0.66 C ATOM 396 C ARG C1922 13.065 9.820 6.068 1.00 0.65 C ATOM 397 O ARG C1922 13.358 11.006 5.931 1.00 0.78 O ATOM 398 CB ARG C1922 10.599 9.837 5.721 1.00 0.87 C ATOM 399 CG ARG C1922 9.976 10.797 4.732 1.00 1.15 C ATOM 400 CD ARG C1922 8.498 10.489 4.589 1.00 1.07 C ATOM 401 NE ARG C1922 7.732 11.597 4.022 1.00 1.64 N ATOM 402 CZ ARG C1922 6.403 11.686 4.074 1.00 2.45 C ATOM 403 NH1 ARG C1922 5.684 10.703 4.601 1.00 2.92 N ATOM 404 NH2 ARG C1922 5.797 12.756 3.592 1.00 3.23 N ATOM 0 H ARG C1922 11.279 7.547 6.367 1.00 0.49 H new ATOM 0 HA ARG C1922 12.097 9.383 4.218 1.00 0.66 H new ATOM 0 HB2 ARG C1922 9.884 9.042 5.930 1.00 0.87 H new ATOM 0 HB3 ARG C1922 10.770 10.367 6.658 1.00 0.87 H new ATOM 0 HG2 ARG C1922 10.113 11.824 5.070 1.00 1.15 H new ATOM 0 HG3 ARG C1922 10.471 10.711 3.765 1.00 1.15 H new ATOM 0 HD2 ARG C1922 8.376 9.610 3.956 1.00 1.07 H new ATOM 0 HD3 ARG C1922 8.090 10.236 5.568 1.00 1.07 H new ATOM 0 HE ARG C1922 8.245 12.347 3.559 1.00 1.64 H new ATOM 0 HH11 ARG C1922 6.148 9.873 4.970 1.00 2.92 H new ATOM 0 HH12 ARG C1922 4.667 10.778 4.638 1.00 2.92 H new ATOM 0 HH21 ARG C1922 6.346 13.511 3.181 1.00 3.23 H new ATOM 0 HH22 ARG C1922 4.780 12.827 3.630 1.00 3.23 H new ATOM 418 N ARG C1923 13.713 9.003 6.897 1.00 0.58 N ATOM 419 CA ARG C1923 14.715 9.504 7.838 1.00 0.73 C ATOM 420 C ARG C1923 15.990 9.951 7.126 1.00 1.24 C ATOM 421 O ARG C1923 16.549 11.000 7.446 1.00 2.11 O ATOM 422 CB ARG C1923 15.054 8.438 8.880 1.00 0.81 C ATOM 423 CG ARG C1923 15.823 8.984 10.072 1.00 1.13 C ATOM 424 CD ARG C1923 16.374 7.870 10.944 1.00 1.55 C ATOM 425 NE ARG C1923 15.334 6.947 11.395 1.00 2.40 N ATOM 426 CZ ARG C1923 15.464 5.622 11.391 1.00 3.28 C ATOM 427 NH1 ARG C1923 16.553 5.059 10.881 1.00 3.55 N ATOM 428 NH2 ARG C1923 14.492 4.865 11.871 1.00 4.28 N ATOM 0 H ARG C1923 13.563 7.995 6.937 1.00 0.58 H new ATOM 0 HA ARG C1923 14.283 10.372 8.335 1.00 0.73 H new ATOM 0 HB2 ARG C1923 14.131 7.978 9.232 1.00 0.81 H new ATOM 0 HB3 ARG C1923 15.642 7.652 8.407 1.00 0.81 H new ATOM 0 HG2 ARG C1923 16.643 9.610 9.720 1.00 1.13 H new ATOM 0 HG3 ARG C1923 15.168 9.621 10.666 1.00 1.13 H new ATOM 0 HD2 ARG C1923 17.130 7.317 10.387 1.00 1.55 H new ATOM 0 HD3 ARG C1923 16.871 8.304 11.811 1.00 1.55 H new ATOM 0 HE ARG C1923 14.456 7.342 11.733 1.00 2.40 H new ATOM 0 HH11 ARG C1923 17.293 5.642 10.491 1.00 3.55 H new ATOM 0 HH12 ARG C1923 16.649 4.044 10.880 1.00 3.55 H new ATOM 0 HH21 ARG C1923 13.646 5.296 12.243 1.00 4.28 H new ATOM 0 HH22 ARG C1923 14.588 3.850 11.869 1.00 4.28 H new ATOM 442 N GLY C1924 16.458 9.146 6.180 1.00 1.22 N ATOM 443 CA GLY C1924 17.643 9.504 5.425 1.00 1.93 C ATOM 444 C GLY C1924 18.614 8.352 5.339 1.00 1.43 C ATOM 445 O GLY C1924 19.586 8.398 4.590 1.00 1.98 O ATOM 0 H GLY C1924 16.038 8.253 5.923 1.00 1.22 H new ATOM 0 HA2 GLY C1924 17.355 9.814 4.420 1.00 1.93 H new ATOM 0 HA3 GLY C1924 18.131 10.358 5.895 1.00 1.93 H new ATOM 449 N ASP C1925 18.333 7.310 6.110 1.00 0.81 N ATOM 450 CA ASP C1925 19.112 6.078 6.066 1.00 1.16 C ATOM 451 C ASP C1925 18.783 5.289 4.807 1.00 0.95 C ATOM 452 O ASP C1925 19.444 4.307 4.477 1.00 1.23 O ATOM 453 CB ASP C1925 18.805 5.210 7.289 1.00 1.89 C ATOM 454 CG ASP C1925 19.217 5.852 8.594 1.00 2.48 C ATOM 455 OD1 ASP C1925 20.422 5.866 8.905 1.00 2.71 O ATOM 456 OD2 ASP C1925 18.332 6.326 9.326 1.00 2.98 O ATOM 0 H ASP C1925 17.564 7.293 6.780 1.00 0.81 H new ATOM 0 HA ASP C1925 20.169 6.345 6.064 1.00 1.16 H new ATOM 0 HB2 ASP C1925 17.736 4.999 7.317 1.00 1.89 H new ATOM 0 HB3 ASP C1925 19.317 4.253 7.185 1.00 1.89 H new ATOM 461 N LEU C1926 17.748 5.729 4.116 1.00 0.64 N ATOM 462 CA LEU C1926 17.218 5.002 2.982 1.00 0.60 C ATOM 463 C LEU C1926 17.915 5.341 1.674 1.00 0.54 C ATOM 464 O LEU C1926 18.191 6.503 1.380 1.00 0.72 O ATOM 465 CB LEU C1926 15.731 5.293 2.842 1.00 0.93 C ATOM 466 CG LEU C1926 14.799 4.425 3.682 1.00 0.48 C ATOM 467 CD1 LEU C1926 13.739 3.840 2.772 1.00 0.56 C ATOM 468 CD2 LEU C1926 15.560 3.319 4.397 1.00 0.57 C ATOM 0 H LEU C1926 17.254 6.597 4.325 1.00 0.64 H new ATOM 0 HA LEU C1926 17.394 3.944 3.177 1.00 0.60 H new ATOM 0 HB2 LEU C1926 15.559 6.337 3.105 1.00 0.93 H new ATOM 0 HB3 LEU C1926 15.455 5.179 1.794 1.00 0.93 H new ATOM 0 HG LEU C1926 14.334 5.040 4.452 1.00 0.48 H new ATOM 0 HD11 LEU C1926 13.063 3.216 3.356 1.00 0.56 H new ATOM 0 HD12 LEU C1926 13.175 4.647 2.304 1.00 0.56 H new ATOM 0 HD13 LEU C1926 14.215 3.236 2.000 1.00 0.56 H new ATOM 0 HD21 LEU C1926 14.865 2.721 4.986 1.00 0.57 H new ATOM 0 HD22 LEU C1926 16.054 2.683 3.662 1.00 0.57 H new ATOM 0 HD23 LEU C1926 16.308 3.759 5.056 1.00 0.57 H new ATOM 480 N PRO C1927 18.193 4.304 0.868 1.00 0.46 N ATOM 481 CA PRO C1927 18.641 4.462 -0.511 1.00 0.55 C ATOM 482 C PRO C1927 17.463 4.584 -1.463 1.00 0.63 C ATOM 483 O PRO C1927 17.635 4.670 -2.679 1.00 1.12 O ATOM 484 CB PRO C1927 19.379 3.159 -0.785 1.00 0.54 C ATOM 485 CG PRO C1927 18.708 2.143 0.079 1.00 0.44 C ATOM 486 CD PRO C1927 18.118 2.883 1.257 1.00 0.41 C ATOM 0 HA PRO C1927 19.246 5.357 -0.652 1.00 0.55 H new ATOM 0 HB2 PRO C1927 19.316 2.884 -1.838 1.00 0.54 H new ATOM 0 HB3 PRO C1927 20.438 3.247 -0.541 1.00 0.54 H new ATOM 0 HG2 PRO C1927 17.930 1.619 -0.476 1.00 0.44 H new ATOM 0 HG3 PRO C1927 19.422 1.391 0.415 1.00 0.44 H new ATOM 0 HD2 PRO C1927 17.089 2.576 1.445 1.00 0.41 H new ATOM 0 HD3 PRO C1927 18.681 2.690 2.170 1.00 0.41 H new ATOM 494 N PHE C1928 16.266 4.573 -0.894 1.00 0.30 N ATOM 495 CA PHE C1928 15.047 4.568 -1.673 1.00 0.27 C ATOM 496 C PHE C1928 14.033 5.504 -1.052 1.00 0.27 C ATOM 497 O PHE C1928 13.836 5.497 0.159 1.00 0.31 O ATOM 498 CB PHE C1928 14.518 3.130 -1.787 1.00 0.24 C ATOM 499 CG PHE C1928 13.217 2.831 -1.117 1.00 0.23 C ATOM 500 CD1 PHE C1928 12.042 3.433 -1.517 1.00 0.30 C ATOM 501 CD2 PHE C1928 13.181 1.915 -0.104 1.00 0.26 C ATOM 502 CE1 PHE C1928 10.860 3.131 -0.903 1.00 0.33 C ATOM 503 CE2 PHE C1928 11.994 1.597 0.513 1.00 0.29 C ATOM 504 CZ PHE C1928 10.836 2.210 0.111 1.00 0.27 C ATOM 0 H PHE C1928 16.118 4.567 0.115 1.00 0.30 H new ATOM 0 HA PHE C1928 15.245 4.930 -2.682 1.00 0.27 H new ATOM 0 HB2 PHE C1928 14.417 2.889 -2.845 1.00 0.24 H new ATOM 0 HB3 PHE C1928 15.272 2.458 -1.377 1.00 0.24 H new ATOM 0 HD1 PHE C1928 12.057 4.151 -2.324 1.00 0.30 H new ATOM 0 HD2 PHE C1928 14.094 1.436 0.216 1.00 0.26 H new ATOM 0 HE1 PHE C1928 9.947 3.617 -1.216 1.00 0.33 H new ATOM 0 HE2 PHE C1928 11.974 0.868 1.310 1.00 0.29 H new ATOM 0 HZ PHE C1928 9.902 1.966 0.595 1.00 0.27 H new ATOM 514 N VAL C1929 13.393 6.291 -1.901 1.00 0.25 N ATOM 515 CA VAL C1929 12.460 7.324 -1.480 1.00 0.25 C ATOM 516 C VAL C1929 11.616 7.767 -2.641 1.00 0.25 C ATOM 517 O VAL C1929 11.994 7.580 -3.795 1.00 0.27 O ATOM 518 CB VAL C1929 13.186 8.567 -0.967 1.00 0.29 C ATOM 519 CG1 VAL C1929 13.703 8.342 0.426 1.00 0.62 C ATOM 520 CG2 VAL C1929 14.313 8.898 -1.919 1.00 0.62 C ATOM 0 H VAL C1929 13.508 6.230 -2.913 1.00 0.25 H new ATOM 0 HA VAL C1929 11.854 6.889 -0.686 1.00 0.25 H new ATOM 0 HB VAL C1929 12.493 9.407 -0.924 1.00 0.29 H new ATOM 0 HG11 VAL C1929 14.217 9.239 0.773 1.00 0.62 H new ATOM 0 HG12 VAL C1929 12.869 8.121 1.092 1.00 0.62 H new ATOM 0 HG13 VAL C1929 14.399 7.503 0.425 1.00 0.62 H new ATOM 0 HG21 VAL C1929 14.840 9.784 -1.565 1.00 0.62 H new ATOM 0 HG22 VAL C1929 15.006 8.058 -1.968 1.00 0.62 H new ATOM 0 HG23 VAL C1929 13.906 9.091 -2.912 1.00 0.62 H new ATOM 530 N VAL C1930 10.499 8.387 -2.348 1.00 0.26 N ATOM 531 CA VAL C1930 9.677 8.923 -3.396 1.00 0.26 C ATOM 532 C VAL C1930 10.315 10.175 -3.984 1.00 0.29 C ATOM 533 O VAL C1930 10.676 11.102 -3.258 1.00 0.32 O ATOM 534 CB VAL C1930 8.265 9.266 -2.921 1.00 0.28 C ATOM 535 CG1 VAL C1930 7.447 9.806 -4.082 1.00 0.34 C ATOM 536 CG2 VAL C1930 7.603 8.050 -2.314 1.00 0.32 C ATOM 0 H VAL C1930 10.144 8.530 -1.402 1.00 0.26 H new ATOM 0 HA VAL C1930 9.599 8.144 -4.154 1.00 0.26 H new ATOM 0 HB VAL C1930 8.325 10.036 -2.151 1.00 0.28 H new ATOM 0 HG11 VAL C1930 6.442 10.049 -3.737 1.00 0.34 H new ATOM 0 HG12 VAL C1930 7.922 10.705 -4.475 1.00 0.34 H new ATOM 0 HG13 VAL C1930 7.389 9.053 -4.868 1.00 0.34 H new ATOM 0 HG21 VAL C1930 6.599 8.311 -1.981 1.00 0.32 H new ATOM 0 HG22 VAL C1930 7.543 7.258 -3.060 1.00 0.32 H new ATOM 0 HG23 VAL C1930 8.189 7.704 -1.463 1.00 0.32 H new ATOM 546 N PRO C1931 10.490 10.192 -5.300 1.00 0.34 N ATOM 547 CA PRO C1931 10.976 11.363 -6.025 1.00 0.42 C ATOM 548 C PRO C1931 9.941 12.479 -6.048 1.00 0.45 C ATOM 549 O PRO C1931 8.774 12.265 -5.710 1.00 0.45 O ATOM 550 CB PRO C1931 11.205 10.827 -7.442 1.00 0.56 C ATOM 551 CG PRO C1931 10.280 9.665 -7.554 1.00 0.48 C ATOM 552 CD PRO C1931 10.241 9.050 -6.187 1.00 0.36 C ATOM 0 HA PRO C1931 11.866 11.795 -5.568 1.00 0.42 H new ATOM 0 HB2 PRO C1931 10.984 11.585 -8.194 1.00 0.56 H new ATOM 0 HB3 PRO C1931 12.242 10.525 -7.590 1.00 0.56 H new ATOM 0 HG2 PRO C1931 9.286 9.983 -7.869 1.00 0.48 H new ATOM 0 HG3 PRO C1931 10.636 8.950 -8.296 1.00 0.48 H new ATOM 0 HD2 PRO C1931 9.277 8.584 -5.982 1.00 0.36 H new ATOM 0 HD3 PRO C1931 11.000 8.277 -6.071 1.00 0.36 H new ATOM 560 N ARG C1932 10.370 13.672 -6.426 1.00 0.54 N ATOM 561 CA ARG C1932 9.446 14.774 -6.630 1.00 0.70 C ATOM 562 C ARG C1932 8.484 14.435 -7.759 1.00 0.89 C ATOM 563 O ARG C1932 8.881 14.374 -8.927 1.00 1.79 O ATOM 564 CB ARG C1932 10.204 16.072 -6.926 1.00 0.83 C ATOM 565 CG ARG C1932 11.271 15.944 -8.003 1.00 1.53 C ATOM 566 CD ARG C1932 12.073 17.226 -8.146 1.00 2.00 C ATOM 567 NE ARG C1932 12.673 17.641 -6.877 1.00 2.79 N ATOM 568 CZ ARG C1932 13.895 18.157 -6.764 1.00 3.62 C ATOM 569 NH1 ARG C1932 14.674 18.276 -7.830 1.00 3.88 N ATOM 570 NH2 ARG C1932 14.349 18.537 -5.578 1.00 4.56 N ATOM 0 H ARG C1932 11.349 13.901 -6.597 1.00 0.54 H new ATOM 0 HA ARG C1932 8.873 14.928 -5.716 1.00 0.70 H new ATOM 0 HB2 ARG C1932 9.488 16.836 -7.230 1.00 0.83 H new ATOM 0 HB3 ARG C1932 10.673 16.423 -6.007 1.00 0.83 H new ATOM 0 HG2 ARG C1932 11.941 15.120 -7.757 1.00 1.53 H new ATOM 0 HG3 ARG C1932 10.801 15.699 -8.955 1.00 1.53 H new ATOM 0 HD2 ARG C1932 12.858 17.082 -8.888 1.00 2.00 H new ATOM 0 HD3 ARG C1932 11.425 18.020 -8.518 1.00 2.00 H new ATOM 0 HE ARG C1932 12.121 17.528 -6.027 1.00 2.79 H new ATOM 0 HH11 ARG C1932 14.338 17.971 -8.744 1.00 3.88 H new ATOM 0 HH12 ARG C1932 15.609 18.672 -7.737 1.00 3.88 H new ATOM 0 HH21 ARG C1932 13.762 18.434 -4.750 1.00 4.56 H new ATOM 0 HH22 ARG C1932 15.286 18.932 -5.493 1.00 4.56 H new ATOM 584 N ARG C1933 7.223 14.182 -7.394 1.00 0.74 N ATOM 585 CA ARG C1933 6.217 13.717 -8.338 1.00 0.76 C ATOM 586 C ARG C1933 6.585 12.307 -8.819 1.00 0.65 C ATOM 587 O ARG C1933 7.582 11.740 -8.380 1.00 0.69 O ATOM 588 CB ARG C1933 6.113 14.703 -9.514 1.00 0.95 C ATOM 589 CG ARG C1933 4.978 14.421 -10.474 1.00 1.66 C ATOM 590 CD ARG C1933 5.069 15.293 -11.713 1.00 1.80 C ATOM 591 NE ARG C1933 4.095 14.892 -12.723 1.00 2.56 N ATOM 592 CZ ARG C1933 3.186 15.707 -13.253 1.00 2.86 C ATOM 593 NH1 ARG C1933 3.124 16.980 -12.878 1.00 2.53 N ATOM 594 NH2 ARG C1933 2.336 15.248 -14.163 1.00 3.92 N ATOM 0 H ARG C1933 6.878 14.295 -6.441 1.00 0.74 H new ATOM 0 HA ARG C1933 5.242 13.670 -7.853 1.00 0.76 H new ATOM 0 HB2 ARG C1933 5.993 15.711 -9.116 1.00 0.95 H new ATOM 0 HB3 ARG C1933 7.052 14.688 -10.068 1.00 0.95 H new ATOM 0 HG2 ARG C1933 4.998 13.371 -10.765 1.00 1.66 H new ATOM 0 HG3 ARG C1933 4.025 14.595 -9.974 1.00 1.66 H new ATOM 0 HD2 ARG C1933 4.902 16.335 -11.439 1.00 1.80 H new ATOM 0 HD3 ARG C1933 6.074 15.230 -12.130 1.00 1.80 H new ATOM 0 HE ARG C1933 4.112 13.924 -13.044 1.00 2.56 H new ATOM 0 HH11 ARG C1933 3.776 17.338 -12.180 1.00 2.53 H new ATOM 0 HH12 ARG C1933 2.425 17.599 -13.288 1.00 2.53 H new ATOM 0 HH21 ARG C1933 2.380 14.272 -14.455 1.00 3.92 H new ATOM 0 HH22 ARG C1933 1.639 15.871 -14.570 1.00 3.92 H new ATOM 608 N MET C1934 5.787 11.734 -9.703 1.00 0.70 N ATOM 609 CA MET C1934 6.113 10.443 -10.290 1.00 0.73 C ATOM 610 C MET C1934 7.064 10.626 -11.464 1.00 0.84 C ATOM 611 O MET C1934 7.252 9.721 -12.278 1.00 1.02 O ATOM 612 CB MET C1934 4.843 9.710 -10.714 1.00 0.81 C ATOM 613 CG MET C1934 4.033 9.231 -9.526 1.00 0.89 C ATOM 614 SD MET C1934 4.964 8.080 -8.499 1.00 1.18 S ATOM 615 CE MET C1934 4.045 8.168 -6.968 1.00 0.55 C ATOM 0 H MET C1934 4.910 12.140 -10.030 1.00 0.70 H new ATOM 0 HA MET C1934 6.614 9.831 -9.540 1.00 0.73 H new ATOM 0 HB2 MET C1934 4.230 10.373 -11.325 1.00 0.81 H new ATOM 0 HB3 MET C1934 5.109 8.857 -11.337 1.00 0.81 H new ATOM 0 HG2 MET C1934 3.727 10.088 -8.926 1.00 0.89 H new ATOM 0 HG3 MET C1934 3.122 8.748 -9.879 1.00 0.89 H new ATOM 0 HE1 MET C1934 4.738 8.268 -6.133 1.00 0.55 H new ATOM 0 HE2 MET C1934 3.379 9.030 -6.993 1.00 0.55 H new ATOM 0 HE3 MET C1934 3.457 7.259 -6.844 1.00 0.55 H new ATOM 625 N ALA C1935 7.657 11.819 -11.521 1.00 0.93 N ATOM 626 CA ALA C1935 8.680 12.158 -12.496 1.00 1.04 C ATOM 627 C ALA C1935 8.189 11.938 -13.923 1.00 1.66 C ATOM 628 O ALA C1935 8.644 10.981 -14.584 1.00 2.07 O ATOM 629 CB ALA C1935 9.945 11.364 -12.205 1.00 1.04 C ATOM 630 OXT ALA C1935 7.331 12.726 -14.376 1.00 2.38 O ATOM 0 H ALA C1935 7.434 12.582 -10.882 1.00 0.93 H new ATOM 0 HA ALA C1935 8.910 13.220 -12.409 1.00 1.04 H new ATOM 0 HB1 ALA C1935 10.711 11.619 -12.937 1.00 1.04 H new ATOM 0 HB2 ALA C1935 10.304 11.605 -11.205 1.00 1.04 H new ATOM 0 HB3 ALA C1935 9.727 10.298 -12.265 1.00 1.04 H new TER 636 ALA C1935 ATOM 637 N MET A 1 1.864 -4.949 -19.055 1.00 1.37 N ATOM 638 CA MET A 1 1.151 -3.743 -19.541 1.00 0.72 C ATOM 639 C MET A 1 1.870 -2.485 -19.058 1.00 0.58 C ATOM 640 O MET A 1 2.547 -1.804 -19.830 1.00 0.77 O ATOM 641 CB MET A 1 -0.300 -3.755 -19.044 1.00 1.65 C ATOM 642 CG MET A 1 -1.203 -2.754 -19.746 1.00 2.36 C ATOM 643 SD MET A 1 -1.414 -3.124 -21.498 1.00 3.50 S ATOM 644 CE MET A 1 -2.623 -1.887 -21.962 1.00 4.47 C ATOM 0 H1 MET A 1 1.370 -5.802 -19.387 1.00 1.37 H new ATOM 0 H2 MET A 1 2.837 -4.948 -19.421 1.00 1.37 H new ATOM 0 H3 MET A 1 1.886 -4.944 -18.015 1.00 1.37 H new ATOM 0 HA MET A 1 1.145 -3.746 -20.631 1.00 0.72 H new ATOM 0 HB2 MET A 1 -0.711 -4.756 -19.178 1.00 1.65 H new ATOM 0 HB3 MET A 1 -0.308 -3.548 -17.974 1.00 1.65 H new ATOM 0 HG2 MET A 1 -2.178 -2.746 -19.260 1.00 2.36 H new ATOM 0 HG3 MET A 1 -0.785 -1.753 -19.637 1.00 2.36 H new ATOM 0 HE1 MET A 1 -2.858 -1.987 -23.022 1.00 4.47 H new ATOM 0 HE2 MET A 1 -3.531 -2.027 -21.375 1.00 4.47 H new ATOM 0 HE3 MET A 1 -2.218 -0.893 -21.772 1.00 4.47 H new ATOM 654 N ALA A 2 1.716 -2.183 -17.777 1.00 0.37 N ATOM 655 CA ALA A 2 2.442 -1.090 -17.147 1.00 0.33 C ATOM 656 C ALA A 2 3.410 -1.650 -16.113 1.00 0.30 C ATOM 657 O ALA A 2 3.376 -2.850 -15.841 1.00 0.39 O ATOM 658 CB ALA A 2 1.462 -0.133 -16.492 1.00 0.33 C ATOM 0 H ALA A 2 1.089 -2.685 -17.149 1.00 0.37 H new ATOM 0 HA ALA A 2 3.009 -0.546 -17.902 1.00 0.33 H new ATOM 0 HB1 ALA A 2 2.010 0.683 -16.022 1.00 0.33 H new ATOM 0 HB2 ALA A 2 0.787 0.270 -17.247 1.00 0.33 H new ATOM 0 HB3 ALA A 2 0.884 -0.665 -15.736 1.00 0.33 H new ATOM 664 N CYS A 3 4.269 -0.800 -15.546 1.00 0.29 N ATOM 665 CA CYS A 3 5.157 -1.215 -14.472 1.00 0.27 C ATOM 666 C CYS A 3 4.330 -1.576 -13.248 1.00 0.22 C ATOM 667 O CYS A 3 3.827 -0.700 -12.548 1.00 0.21 O ATOM 668 CB CYS A 3 6.162 -0.110 -14.138 1.00 0.32 C ATOM 669 SG CYS A 3 7.279 0.305 -15.498 1.00 0.43 S ATOM 0 H CYS A 3 4.364 0.179 -15.817 1.00 0.29 H new ATOM 0 HA CYS A 3 5.722 -2.089 -14.795 1.00 0.27 H new ATOM 0 HB2 CYS A 3 5.616 0.786 -13.844 1.00 0.32 H new ATOM 0 HB3 CYS A 3 6.754 -0.420 -13.277 1.00 0.32 H new ATOM 0 HG CYS A 3 8.089 1.249 -15.121 1.00 0.43 H new ATOM 675 N PRO A 4 4.184 -2.879 -12.988 1.00 0.20 N ATOM 676 CA PRO A 4 3.225 -3.408 -12.006 1.00 0.18 C ATOM 677 C PRO A 4 3.357 -2.773 -10.629 1.00 0.16 C ATOM 678 O PRO A 4 2.442 -2.093 -10.159 1.00 0.16 O ATOM 679 CB PRO A 4 3.612 -4.883 -11.937 1.00 0.21 C ATOM 680 CG PRO A 4 4.173 -5.177 -13.278 1.00 0.24 C ATOM 681 CD PRO A 4 4.962 -3.958 -13.629 1.00 0.24 C ATOM 0 HA PRO A 4 2.194 -3.211 -12.299 1.00 0.18 H new ATOM 0 HB2 PRO A 4 4.344 -5.066 -11.151 1.00 0.21 H new ATOM 0 HB3 PRO A 4 2.748 -5.511 -11.721 1.00 0.21 H new ATOM 0 HG2 PRO A 4 4.804 -6.066 -13.258 1.00 0.24 H new ATOM 0 HG3 PRO A 4 3.384 -5.362 -14.007 1.00 0.24 H new ATOM 0 HD2 PRO A 4 5.980 -4.009 -13.243 1.00 0.24 H new ATOM 0 HD3 PRO A 4 5.036 -3.819 -14.708 1.00 0.24 H new ATOM 689 N LEU A 5 4.506 -2.965 -10.003 1.00 0.16 N ATOM 690 CA LEU A 5 4.724 -2.467 -8.658 1.00 0.17 C ATOM 691 C LEU A 5 4.830 -0.944 -8.661 1.00 0.19 C ATOM 692 O LEU A 5 4.430 -0.291 -7.702 1.00 0.24 O ATOM 693 CB LEU A 5 5.990 -3.098 -8.065 1.00 0.17 C ATOM 694 CG LEU A 5 5.904 -3.520 -6.591 1.00 0.18 C ATOM 695 CD1 LEU A 5 5.694 -2.321 -5.685 1.00 0.20 C ATOM 696 CD2 LEU A 5 4.792 -4.537 -6.383 1.00 0.20 C ATOM 0 H LEU A 5 5.301 -3.462 -10.405 1.00 0.16 H new ATOM 0 HA LEU A 5 3.872 -2.745 -8.037 1.00 0.17 H new ATOM 0 HB2 LEU A 5 6.248 -3.975 -8.659 1.00 0.17 H new ATOM 0 HB3 LEU A 5 6.810 -2.388 -8.172 1.00 0.17 H new ATOM 0 HG LEU A 5 6.855 -3.983 -6.327 1.00 0.18 H new ATOM 0 HD11 LEU A 5 5.637 -2.654 -4.649 1.00 0.20 H new ATOM 0 HD12 LEU A 5 6.528 -1.628 -5.799 1.00 0.20 H new ATOM 0 HD13 LEU A 5 4.766 -1.818 -5.956 1.00 0.20 H new ATOM 0 HD21 LEU A 5 4.751 -4.821 -5.331 1.00 0.20 H new ATOM 0 HD22 LEU A 5 3.839 -4.099 -6.679 1.00 0.20 H new ATOM 0 HD23 LEU A 5 4.989 -5.421 -6.990 1.00 0.20 H new ATOM 708 N GLU A 6 5.334 -0.374 -9.750 1.00 0.19 N ATOM 709 CA GLU A 6 5.520 1.068 -9.814 1.00 0.23 C ATOM 710 C GLU A 6 4.177 1.785 -9.865 1.00 0.21 C ATOM 711 O GLU A 6 3.968 2.788 -9.180 1.00 0.25 O ATOM 712 CB GLU A 6 6.383 1.476 -11.011 1.00 0.32 C ATOM 713 CG GLU A 6 6.795 2.940 -10.983 1.00 0.47 C ATOM 714 CD GLU A 6 7.875 3.272 -11.989 1.00 0.90 C ATOM 715 OE1 GLU A 6 7.554 3.434 -13.182 1.00 1.39 O ATOM 716 OE2 GLU A 6 9.052 3.399 -11.591 1.00 1.78 O ATOM 0 H GLU A 6 5.617 -0.881 -10.589 1.00 0.19 H new ATOM 0 HA GLU A 6 6.045 1.366 -8.906 1.00 0.23 H new ATOM 0 HB2 GLU A 6 7.278 0.854 -11.034 1.00 0.32 H new ATOM 0 HB3 GLU A 6 5.833 1.278 -11.931 1.00 0.32 H new ATOM 0 HG2 GLU A 6 5.921 3.561 -11.179 1.00 0.47 H new ATOM 0 HG3 GLU A 6 7.148 3.193 -9.983 1.00 0.47 H new ATOM 723 N LYS A 7 3.258 1.256 -10.666 1.00 0.18 N ATOM 724 CA LYS A 7 1.934 1.845 -10.782 1.00 0.20 C ATOM 725 C LYS A 7 1.180 1.724 -9.469 1.00 0.17 C ATOM 726 O LYS A 7 0.342 2.559 -9.164 1.00 0.19 O ATOM 727 CB LYS A 7 1.132 1.203 -11.921 1.00 0.26 C ATOM 728 CG LYS A 7 1.719 1.463 -13.303 1.00 0.41 C ATOM 729 CD LYS A 7 1.821 2.950 -13.610 1.00 0.90 C ATOM 730 CE LYS A 7 0.456 3.595 -13.810 1.00 0.83 C ATOM 731 NZ LYS A 7 0.564 5.065 -14.005 1.00 1.16 N ATOM 0 H LYS A 7 3.406 0.426 -11.240 1.00 0.18 H new ATOM 0 HA LYS A 7 2.061 2.902 -11.018 1.00 0.20 H new ATOM 0 HB2 LYS A 7 1.078 0.127 -11.755 1.00 0.26 H new ATOM 0 HB3 LYS A 7 0.110 1.581 -11.893 1.00 0.26 H new ATOM 0 HG2 LYS A 7 2.709 1.011 -13.367 1.00 0.41 H new ATOM 0 HG3 LYS A 7 1.098 0.979 -14.057 1.00 0.41 H new ATOM 0 HD2 LYS A 7 2.341 3.452 -12.794 1.00 0.90 H new ATOM 0 HD3 LYS A 7 2.423 3.093 -14.508 1.00 0.90 H new ATOM 0 HE2 LYS A 7 -0.034 3.148 -14.675 1.00 0.83 H new ATOM 0 HE3 LYS A 7 -0.174 3.388 -12.945 1.00 0.83 H new ATOM 0 HZ1 LYS A 7 -0.131 5.373 -14.715 1.00 1.16 H new ATOM 0 HZ2 LYS A 7 0.376 5.549 -13.104 1.00 1.16 H new ATOM 0 HZ3 LYS A 7 1.522 5.302 -14.332 1.00 1.16 H new ATOM 745 N ALA A 8 1.498 0.698 -8.686 1.00 0.18 N ATOM 746 CA ALA A 8 0.857 0.494 -7.390 1.00 0.19 C ATOM 747 C ALA A 8 0.911 1.759 -6.538 1.00 0.17 C ATOM 748 O ALA A 8 -0.119 2.237 -6.070 1.00 0.21 O ATOM 749 CB ALA A 8 1.500 -0.673 -6.654 1.00 0.20 C ATOM 0 H ALA A 8 2.196 -0.006 -8.926 1.00 0.18 H new ATOM 0 HA ALA A 8 -0.192 0.258 -7.570 1.00 0.19 H new ATOM 0 HB1 ALA A 8 1.009 -0.810 -5.690 1.00 0.20 H new ATOM 0 HB2 ALA A 8 1.393 -1.581 -7.248 1.00 0.20 H new ATOM 0 HB3 ALA A 8 2.558 -0.465 -6.496 1.00 0.20 H new ATOM 755 N LEU A 9 2.105 2.316 -6.357 1.00 0.14 N ATOM 756 CA LEU A 9 2.251 3.526 -5.549 1.00 0.14 C ATOM 757 C LEU A 9 1.789 4.753 -6.331 1.00 0.13 C ATOM 758 O LEU A 9 1.238 5.697 -5.762 1.00 0.16 O ATOM 759 CB LEU A 9 3.700 3.728 -5.076 1.00 0.15 C ATOM 760 CG LEU A 9 4.342 2.546 -4.333 1.00 0.16 C ATOM 761 CD1 LEU A 9 3.354 1.901 -3.377 1.00 0.19 C ATOM 762 CD2 LEU A 9 4.894 1.518 -5.302 1.00 0.15 C ATOM 0 H LEU A 9 2.974 1.957 -6.752 1.00 0.14 H new ATOM 0 HA LEU A 9 1.622 3.401 -4.667 1.00 0.14 H new ATOM 0 HB2 LEU A 9 4.315 3.961 -5.945 1.00 0.15 H new ATOM 0 HB3 LEU A 9 3.729 4.600 -4.422 1.00 0.15 H new ATOM 0 HG LEU A 9 5.175 2.940 -3.750 1.00 0.16 H new ATOM 0 HD11 LEU A 9 3.835 1.068 -2.865 1.00 0.19 H new ATOM 0 HD12 LEU A 9 3.024 2.637 -2.643 1.00 0.19 H new ATOM 0 HD13 LEU A 9 2.493 1.535 -3.936 1.00 0.19 H new ATOM 0 HD21 LEU A 9 5.341 0.695 -4.744 1.00 0.15 H new ATOM 0 HD22 LEU A 9 4.086 1.136 -5.927 1.00 0.15 H new ATOM 0 HD23 LEU A 9 5.652 1.983 -5.933 1.00 0.15 H new ATOM 774 N ASP A 10 2.014 4.725 -7.640 1.00 0.14 N ATOM 775 CA ASP A 10 1.609 5.817 -8.525 1.00 0.15 C ATOM 776 C ASP A 10 0.104 6.057 -8.455 1.00 0.15 C ATOM 777 O ASP A 10 -0.352 7.188 -8.286 1.00 0.18 O ATOM 778 CB ASP A 10 2.021 5.503 -9.967 1.00 0.19 C ATOM 779 CG ASP A 10 1.415 6.457 -10.981 1.00 0.48 C ATOM 780 OD1 ASP A 10 1.979 7.545 -11.201 1.00 1.19 O ATOM 781 OD2 ASP A 10 0.374 6.108 -11.576 1.00 1.18 O ATOM 0 H ASP A 10 2.478 3.952 -8.117 1.00 0.14 H new ATOM 0 HA ASP A 10 2.113 6.725 -8.193 1.00 0.15 H new ATOM 0 HB2 ASP A 10 3.108 5.542 -10.045 1.00 0.19 H new ATOM 0 HB3 ASP A 10 1.720 4.484 -10.211 1.00 0.19 H new ATOM 786 N VAL A 11 -0.664 4.984 -8.563 1.00 0.16 N ATOM 787 CA VAL A 11 -2.115 5.083 -8.599 1.00 0.18 C ATOM 788 C VAL A 11 -2.684 5.386 -7.219 1.00 0.18 C ATOM 789 O VAL A 11 -3.774 5.936 -7.101 1.00 0.23 O ATOM 790 CB VAL A 11 -2.757 3.799 -9.153 1.00 0.20 C ATOM 791 CG1 VAL A 11 -2.151 3.465 -10.504 1.00 0.23 C ATOM 792 CG2 VAL A 11 -2.601 2.638 -8.182 1.00 0.18 C ATOM 0 H VAL A 11 -0.305 4.031 -8.627 1.00 0.16 H new ATOM 0 HA VAL A 11 -2.357 5.908 -9.268 1.00 0.18 H new ATOM 0 HB VAL A 11 -3.826 3.972 -9.279 1.00 0.20 H new ATOM 0 HG11 VAL A 11 -2.608 2.555 -10.893 1.00 0.23 H new ATOM 0 HG12 VAL A 11 -2.332 4.287 -11.197 1.00 0.23 H new ATOM 0 HG13 VAL A 11 -1.077 3.313 -10.394 1.00 0.23 H new ATOM 0 HG21 VAL A 11 -3.065 1.746 -8.603 1.00 0.18 H new ATOM 0 HG22 VAL A 11 -1.542 2.448 -8.009 1.00 0.18 H new ATOM 0 HG23 VAL A 11 -3.084 2.887 -7.237 1.00 0.18 H new ATOM 802 N MET A 12 -1.932 5.040 -6.181 1.00 0.16 N ATOM 803 CA MET A 12 -2.350 5.303 -4.811 1.00 0.20 C ATOM 804 C MET A 12 -2.617 6.782 -4.598 1.00 0.24 C ATOM 805 O MET A 12 -3.599 7.151 -3.966 1.00 0.40 O ATOM 806 CB MET A 12 -1.292 4.815 -3.832 1.00 0.25 C ATOM 807 CG MET A 12 -1.365 3.326 -3.568 1.00 0.17 C ATOM 808 SD MET A 12 0.065 2.705 -2.676 1.00 0.72 S ATOM 809 CE MET A 12 -0.527 1.094 -2.198 1.00 0.19 C ATOM 0 H MET A 12 -1.028 4.576 -6.263 1.00 0.16 H new ATOM 0 HA MET A 12 -3.277 4.759 -4.630 1.00 0.20 H new ATOM 0 HB2 MET A 12 -0.304 5.060 -4.222 1.00 0.25 H new ATOM 0 HB3 MET A 12 -1.404 5.351 -2.889 1.00 0.25 H new ATOM 0 HG2 MET A 12 -2.267 3.107 -2.997 1.00 0.17 H new ATOM 0 HG3 MET A 12 -1.453 2.797 -4.517 1.00 0.17 H new ATOM 0 HE1 MET A 12 0.308 0.394 -2.166 1.00 0.19 H new ATOM 0 HE2 MET A 12 -0.989 1.154 -1.212 1.00 0.19 H new ATOM 0 HE3 MET A 12 -1.263 0.747 -2.923 1.00 0.19 H new ATOM 819 N VAL A 13 -1.742 7.624 -5.131 1.00 0.17 N ATOM 820 CA VAL A 13 -1.928 9.064 -5.034 1.00 0.19 C ATOM 821 C VAL A 13 -2.704 9.616 -6.235 1.00 0.20 C ATOM 822 O VAL A 13 -3.354 10.653 -6.132 1.00 0.28 O ATOM 823 CB VAL A 13 -0.581 9.810 -4.879 1.00 0.18 C ATOM 824 CG1 VAL A 13 0.031 9.537 -3.512 1.00 0.21 C ATOM 825 CG2 VAL A 13 0.393 9.414 -5.977 1.00 0.19 C ATOM 0 H VAL A 13 -0.901 7.336 -5.632 1.00 0.17 H new ATOM 0 HA VAL A 13 -2.518 9.241 -4.135 1.00 0.19 H new ATOM 0 HB VAL A 13 -0.781 10.878 -4.966 1.00 0.18 H new ATOM 0 HG11 VAL A 13 0.977 10.071 -3.424 1.00 0.21 H new ATOM 0 HG12 VAL A 13 -0.652 9.877 -2.733 1.00 0.21 H new ATOM 0 HG13 VAL A 13 0.206 8.467 -3.399 1.00 0.21 H new ATOM 0 HG21 VAL A 13 1.331 9.953 -5.843 1.00 0.19 H new ATOM 0 HG22 VAL A 13 0.581 8.341 -5.927 1.00 0.19 H new ATOM 0 HG23 VAL A 13 -0.033 9.663 -6.949 1.00 0.19 H new ATOM 835 N SER A 14 -2.658 8.908 -7.363 1.00 0.19 N ATOM 836 CA SER A 14 -3.341 9.357 -8.580 1.00 0.22 C ATOM 837 C SER A 14 -4.852 9.122 -8.500 1.00 0.24 C ATOM 838 O SER A 14 -5.640 10.060 -8.647 1.00 0.28 O ATOM 839 CB SER A 14 -2.761 8.651 -9.807 1.00 0.24 C ATOM 840 OG SER A 14 -1.393 8.987 -9.986 1.00 1.12 O ATOM 0 H SER A 14 -2.158 8.025 -7.461 1.00 0.19 H new ATOM 0 HA SER A 14 -3.176 10.430 -8.674 1.00 0.22 H new ATOM 0 HB2 SER A 14 -2.862 7.572 -9.692 1.00 0.24 H new ATOM 0 HB3 SER A 14 -3.328 8.932 -10.695 1.00 0.24 H new ATOM 0 HG SER A 14 -0.833 8.350 -9.495 1.00 1.12 H new ATOM 846 N THR A 15 -5.250 7.877 -8.262 1.00 0.25 N ATOM 847 CA THR A 15 -6.658 7.526 -8.115 1.00 0.28 C ATOM 848 C THR A 15 -7.244 8.237 -6.895 1.00 0.30 C ATOM 849 O THR A 15 -8.427 8.579 -6.861 1.00 0.33 O ATOM 850 CB THR A 15 -6.814 5.995 -7.976 1.00 0.28 C ATOM 851 OG1 THR A 15 -6.191 5.344 -9.096 1.00 0.34 O ATOM 852 CG2 THR A 15 -8.274 5.582 -7.905 1.00 0.26 C ATOM 0 H THR A 15 -4.611 7.088 -8.166 1.00 0.25 H new ATOM 0 HA THR A 15 -7.201 7.848 -9.004 1.00 0.28 H new ATOM 0 HB THR A 15 -6.331 5.694 -7.046 1.00 0.28 H new ATOM 0 HG1 THR A 15 -6.813 4.693 -9.484 1.00 0.34 H new ATOM 0 HG21 THR A 15 -8.341 4.498 -7.808 1.00 0.26 H new ATOM 0 HG22 THR A 15 -8.744 6.054 -7.042 1.00 0.26 H new ATOM 0 HG23 THR A 15 -8.786 5.897 -8.814 1.00 0.26 H new ATOM 860 N PHE A 16 -6.375 8.479 -5.918 1.00 0.31 N ATOM 861 CA PHE A 16 -6.713 9.225 -4.713 1.00 0.37 C ATOM 862 C PHE A 16 -7.402 10.546 -5.058 1.00 0.42 C ATOM 863 O PHE A 16 -8.606 10.692 -4.863 1.00 0.54 O ATOM 864 CB PHE A 16 -5.421 9.483 -3.932 1.00 0.45 C ATOM 865 CG PHE A 16 -5.590 10.151 -2.600 1.00 0.36 C ATOM 866 CD1 PHE A 16 -6.237 9.505 -1.564 1.00 1.26 C ATOM 867 CD2 PHE A 16 -5.073 11.417 -2.383 1.00 1.24 C ATOM 868 CE1 PHE A 16 -6.371 10.111 -0.330 1.00 1.43 C ATOM 869 CE2 PHE A 16 -5.200 12.026 -1.152 1.00 1.39 C ATOM 870 CZ PHE A 16 -5.851 11.372 -0.124 1.00 0.99 C ATOM 0 H PHE A 16 -5.407 8.159 -5.942 1.00 0.31 H new ATOM 0 HA PHE A 16 -7.410 8.645 -4.108 1.00 0.37 H new ATOM 0 HB2 PHE A 16 -4.914 8.530 -3.779 1.00 0.45 H new ATOM 0 HB3 PHE A 16 -4.764 10.099 -4.546 1.00 0.45 H new ATOM 0 HD1 PHE A 16 -6.642 8.516 -1.721 1.00 1.26 H new ATOM 0 HD2 PHE A 16 -4.566 11.932 -3.185 1.00 1.24 H new ATOM 0 HE1 PHE A 16 -6.882 9.599 0.472 1.00 1.43 H new ATOM 0 HE2 PHE A 16 -4.791 13.013 -0.992 1.00 1.39 H new ATOM 0 HZ PHE A 16 -5.953 11.848 0.840 1.00 0.99 H new ATOM 880 N HIS A 17 -6.644 11.484 -5.623 1.00 0.44 N ATOM 881 CA HIS A 17 -7.168 12.814 -5.942 1.00 0.54 C ATOM 882 C HIS A 17 -8.237 12.768 -7.041 1.00 0.47 C ATOM 883 O HIS A 17 -8.930 13.754 -7.282 1.00 0.52 O ATOM 884 CB HIS A 17 -6.031 13.770 -6.349 1.00 0.72 C ATOM 885 CG HIS A 17 -5.365 13.453 -7.659 1.00 1.09 C ATOM 886 ND1 HIS A 17 -4.216 12.789 -7.932 1.00 2.16 N flip ATOM 887 CD2 HIS A 17 -5.869 13.848 -8.883 1.00 1.23 C flip ATOM 888 CE1 HIS A 17 -4.053 12.797 -9.295 1.00 2.80 C flip ATOM 889 NE2 HIS A 17 -5.060 13.440 -9.844 1.00 2.27 N flip ATOM 0 H HIS A 17 -5.664 11.349 -5.870 1.00 0.44 H new ATOM 0 HA HIS A 17 -7.642 13.191 -5.036 1.00 0.54 H new ATOM 0 HB2 HIS A 17 -6.430 14.783 -6.399 1.00 0.72 H new ATOM 0 HB3 HIS A 17 -5.274 13.764 -5.564 1.00 0.72 H new ATOM 0 HD1 HIS A 17 -3.588 12.362 -7.251 1.00 2.16 H new ATOM 0 HD2 HIS A 17 -6.783 14.404 -9.031 1.00 1.23 H new ATOM 0 HE1 HIS A 17 -3.230 12.347 -9.830 1.00 2.80 H new ATOM 898 N LYS A 18 -8.363 11.627 -7.701 1.00 0.43 N ATOM 899 CA LYS A 18 -9.244 11.497 -8.854 1.00 0.46 C ATOM 900 C LYS A 18 -10.720 11.370 -8.446 1.00 0.44 C ATOM 901 O LYS A 18 -11.607 11.777 -9.192 1.00 0.62 O ATOM 902 CB LYS A 18 -8.817 10.283 -9.684 1.00 0.55 C ATOM 903 CG LYS A 18 -9.619 10.081 -10.960 1.00 0.77 C ATOM 904 CD LYS A 18 -9.219 8.795 -11.662 1.00 0.73 C ATOM 905 CE LYS A 18 -10.093 8.523 -12.877 1.00 1.41 C ATOM 906 NZ LYS A 18 -9.813 9.471 -13.985 1.00 1.69 N ATOM 0 H LYS A 18 -7.863 10.772 -7.457 1.00 0.43 H new ATOM 0 HA LYS A 18 -9.155 12.406 -9.449 1.00 0.46 H new ATOM 0 HB2 LYS A 18 -7.764 10.388 -9.944 1.00 0.55 H new ATOM 0 HB3 LYS A 18 -8.905 9.388 -9.068 1.00 0.55 H new ATOM 0 HG2 LYS A 18 -10.683 10.054 -10.724 1.00 0.77 H new ATOM 0 HG3 LYS A 18 -9.463 10.927 -11.629 1.00 0.77 H new ATOM 0 HD2 LYS A 18 -8.176 8.858 -11.971 1.00 0.73 H new ATOM 0 HD3 LYS A 18 -9.295 7.961 -10.965 1.00 0.73 H new ATOM 0 HE2 LYS A 18 -9.927 7.502 -13.222 1.00 1.41 H new ATOM 0 HE3 LYS A 18 -11.143 8.597 -12.593 1.00 1.41 H new ATOM 0 HZ1 LYS A 18 -10.429 9.252 -14.794 1.00 1.69 H new ATOM 0 HZ2 LYS A 18 -9.995 10.443 -13.664 1.00 1.69 H new ATOM 0 HZ3 LYS A 18 -8.818 9.383 -14.274 1.00 1.69 H new ATOM 920 N TYR A 19 -10.986 10.815 -7.268 1.00 0.37 N ATOM 921 CA TYR A 19 -12.369 10.535 -6.867 1.00 0.41 C ATOM 922 C TYR A 19 -12.835 11.417 -5.714 1.00 0.48 C ATOM 923 O TYR A 19 -13.896 12.025 -5.798 1.00 0.73 O ATOM 924 CB TYR A 19 -12.530 9.056 -6.493 1.00 0.43 C ATOM 925 CG TYR A 19 -12.409 8.110 -7.669 1.00 0.38 C ATOM 926 CD1 TYR A 19 -11.174 7.829 -8.229 1.00 1.18 C ATOM 927 CD2 TYR A 19 -13.531 7.500 -8.219 1.00 1.14 C ATOM 928 CE1 TYR A 19 -11.054 6.973 -9.302 1.00 1.21 C ATOM 929 CE2 TYR A 19 -13.417 6.637 -9.295 1.00 1.14 C ATOM 930 CZ TYR A 19 -12.174 6.379 -9.831 1.00 0.48 C ATOM 931 OH TYR A 19 -12.048 5.524 -10.903 1.00 0.59 O ATOM 0 H TYR A 19 -10.279 10.552 -6.581 1.00 0.37 H new ATOM 0 HA TYR A 19 -12.998 10.765 -7.727 1.00 0.41 H new ATOM 0 HB2 TYR A 19 -11.776 8.795 -5.750 1.00 0.43 H new ATOM 0 HB3 TYR A 19 -13.503 8.914 -6.023 1.00 0.43 H new ATOM 0 HD1 TYR A 19 -10.288 8.289 -7.817 1.00 1.18 H new ATOM 0 HD2 TYR A 19 -14.506 7.703 -7.800 1.00 1.14 H new ATOM 0 HE1 TYR A 19 -10.082 6.770 -9.726 1.00 1.21 H new ATOM 0 HE2 TYR A 19 -14.296 6.169 -9.712 1.00 1.14 H new ATOM 0 HH TYR A 19 -11.139 5.158 -10.924 1.00 0.59 H new ATOM 941 N SER A 20 -12.040 11.498 -4.660 1.00 0.38 N ATOM 942 CA SER A 20 -12.436 12.206 -3.442 1.00 0.45 C ATOM 943 C SER A 20 -12.661 13.697 -3.683 1.00 0.54 C ATOM 944 O SER A 20 -13.453 14.337 -2.988 1.00 0.68 O ATOM 945 CB SER A 20 -11.363 11.996 -2.389 1.00 0.47 C ATOM 946 OG SER A 20 -10.092 11.964 -3.003 1.00 0.52 O ATOM 0 H SER A 20 -11.110 11.081 -4.618 1.00 0.38 H new ATOM 0 HA SER A 20 -13.388 11.800 -3.102 1.00 0.45 H new ATOM 0 HB2 SER A 20 -11.401 12.798 -1.652 1.00 0.47 H new ATOM 0 HB3 SER A 20 -11.543 11.063 -1.854 1.00 0.47 H new ATOM 0 HG SER A 20 -9.398 12.109 -2.326 1.00 0.52 H new ATOM 952 N GLY A 21 -11.983 14.239 -4.690 1.00 0.54 N ATOM 953 CA GLY A 21 -12.118 15.648 -5.008 1.00 0.65 C ATOM 954 C GLY A 21 -13.394 15.950 -5.767 1.00 0.68 C ATOM 955 O GLY A 21 -13.521 17.004 -6.395 1.00 0.82 O ATOM 0 H GLY A 21 -11.341 13.725 -5.293 1.00 0.54 H new ATOM 0 HA2 GLY A 21 -12.101 16.229 -4.086 1.00 0.65 H new ATOM 0 HA3 GLY A 21 -11.261 15.967 -5.602 1.00 0.65 H new ATOM 959 N LYS A 22 -14.340 15.026 -5.719 1.00 0.70 N ATOM 960 CA LYS A 22 -15.610 15.198 -6.397 1.00 0.76 C ATOM 961 C LYS A 22 -16.703 15.606 -5.417 1.00 0.85 C ATOM 962 O LYS A 22 -17.522 16.475 -5.718 1.00 0.93 O ATOM 963 CB LYS A 22 -15.978 13.921 -7.154 1.00 0.78 C ATOM 964 CG LYS A 22 -15.293 13.820 -8.504 1.00 1.19 C ATOM 965 CD LYS A 22 -15.458 12.442 -9.117 1.00 1.26 C ATOM 966 CE LYS A 22 -14.927 12.401 -10.540 1.00 1.71 C ATOM 967 NZ LYS A 22 -13.529 12.898 -10.638 1.00 2.08 N ATOM 0 H LYS A 22 -14.249 14.145 -5.214 1.00 0.70 H new ATOM 0 HA LYS A 22 -15.513 16.006 -7.122 1.00 0.76 H new ATOM 0 HB2 LYS A 22 -15.709 13.055 -6.549 1.00 0.78 H new ATOM 0 HB3 LYS A 22 -17.058 13.887 -7.296 1.00 0.78 H new ATOM 0 HG2 LYS A 22 -15.706 14.570 -9.178 1.00 1.19 H new ATOM 0 HG3 LYS A 22 -14.232 14.043 -8.391 1.00 1.19 H new ATOM 0 HD2 LYS A 22 -14.931 11.706 -8.509 1.00 1.26 H new ATOM 0 HD3 LYS A 22 -16.512 12.164 -9.112 1.00 1.26 H new ATOM 0 HE2 LYS A 22 -14.973 11.378 -10.913 1.00 1.71 H new ATOM 0 HE3 LYS A 22 -15.570 13.003 -11.182 1.00 1.71 H new ATOM 0 HZ1 LYS A 22 -13.131 12.635 -11.562 1.00 2.08 H new ATOM 0 HZ2 LYS A 22 -13.521 13.933 -10.539 1.00 2.08 H new ATOM 0 HZ3 LYS A 22 -12.956 12.474 -9.881 1.00 2.08 H new ATOM 981 N GLU A 23 -16.727 14.985 -4.244 1.00 0.96 N ATOM 982 CA GLU A 23 -17.645 15.395 -3.193 1.00 1.13 C ATOM 983 C GLU A 23 -16.981 16.429 -2.289 1.00 1.24 C ATOM 984 O GLU A 23 -17.518 17.516 -2.069 1.00 1.56 O ATOM 985 CB GLU A 23 -18.079 14.182 -2.375 1.00 1.44 C ATOM 986 CG GLU A 23 -19.081 14.491 -1.281 1.00 1.91 C ATOM 987 CD GLU A 23 -20.410 14.977 -1.823 1.00 2.47 C ATOM 988 OE1 GLU A 23 -21.224 14.138 -2.260 1.00 2.94 O ATOM 989 OE2 GLU A 23 -20.650 16.203 -1.816 1.00 3.12 O ATOM 0 H GLU A 23 -16.124 14.200 -3.999 1.00 0.96 H new ATOM 0 HA GLU A 23 -18.526 15.845 -3.651 1.00 1.13 H new ATOM 0 HB2 GLU A 23 -18.511 13.441 -3.048 1.00 1.44 H new ATOM 0 HB3 GLU A 23 -17.196 13.728 -1.925 1.00 1.44 H new ATOM 0 HG2 GLU A 23 -19.244 13.596 -0.680 1.00 1.91 H new ATOM 0 HG3 GLU A 23 -18.665 15.249 -0.617 1.00 1.91 H new ATOM 996 N GLY A 24 -15.803 16.093 -1.786 1.00 1.31 N ATOM 997 CA GLY A 24 -15.094 16.987 -0.894 1.00 1.56 C ATOM 998 C GLY A 24 -13.737 17.366 -1.439 1.00 1.32 C ATOM 999 O GLY A 24 -13.627 17.834 -2.574 1.00 1.41 O ATOM 0 H GLY A 24 -15.324 15.214 -1.980 1.00 1.31 H new ATOM 0 HA2 GLY A 24 -15.687 17.888 -0.736 1.00 1.56 H new ATOM 0 HA3 GLY A 24 -14.974 16.510 0.079 1.00 1.56 H new ATOM 1003 N ASP A 25 -12.702 17.169 -0.633 1.00 1.15 N ATOM 1004 CA ASP A 25 -11.338 17.416 -1.080 1.00 1.05 C ATOM 1005 C ASP A 25 -10.688 16.112 -1.500 1.00 0.89 C ATOM 1006 O ASP A 25 -11.004 15.051 -0.963 1.00 0.91 O ATOM 1007 CB ASP A 25 -10.499 18.080 0.019 1.00 1.15 C ATOM 1008 CG ASP A 25 -9.097 18.416 -0.463 1.00 1.30 C ATOM 1009 OD1 ASP A 25 -8.915 19.485 -1.076 1.00 1.80 O ATOM 1010 OD2 ASP A 25 -8.176 17.597 -0.265 1.00 1.94 O ATOM 0 H ASP A 25 -12.780 16.840 0.329 1.00 1.15 H new ATOM 0 HA ASP A 25 -11.383 18.096 -1.931 1.00 1.05 H new ATOM 0 HB2 ASP A 25 -10.995 18.991 0.354 1.00 1.15 H new ATOM 0 HB3 ASP A 25 -10.437 17.415 0.880 1.00 1.15 H new ATOM 1015 N LYS A 26 -9.776 16.201 -2.454 1.00 0.93 N ATOM 1016 CA LYS A 26 -9.085 15.034 -2.992 1.00 0.87 C ATOM 1017 C LYS A 26 -8.322 14.249 -1.916 1.00 0.82 C ATOM 1018 O LYS A 26 -7.931 13.108 -2.136 1.00 0.88 O ATOM 1019 CB LYS A 26 -8.142 15.459 -4.132 1.00 1.07 C ATOM 1020 CG LYS A 26 -7.191 16.612 -3.800 1.00 1.37 C ATOM 1021 CD LYS A 26 -6.122 16.208 -2.801 1.00 1.56 C ATOM 1022 CE LYS A 26 -5.268 17.388 -2.381 1.00 1.77 C ATOM 1023 NZ LYS A 26 -6.072 18.473 -1.754 1.00 2.57 N ATOM 0 H LYS A 26 -9.492 17.083 -2.879 1.00 0.93 H new ATOM 0 HA LYS A 26 -9.845 14.359 -3.385 1.00 0.87 H new ATOM 0 HB2 LYS A 26 -7.548 14.595 -4.431 1.00 1.07 H new ATOM 0 HB3 LYS A 26 -8.746 15.745 -4.993 1.00 1.07 H new ATOM 0 HG2 LYS A 26 -6.715 16.963 -4.716 1.00 1.37 H new ATOM 0 HG3 LYS A 26 -7.764 17.448 -3.398 1.00 1.37 H new ATOM 0 HD2 LYS A 26 -6.594 15.770 -1.922 1.00 1.56 H new ATOM 0 HD3 LYS A 26 -5.487 15.438 -3.240 1.00 1.56 H new ATOM 0 HE2 LYS A 26 -4.507 17.050 -1.678 1.00 1.77 H new ATOM 0 HE3 LYS A 26 -4.745 17.783 -3.252 1.00 1.77 H new ATOM 0 HZ1 LYS A 26 -5.437 19.143 -1.274 1.00 2.57 H new ATOM 0 HZ2 LYS A 26 -6.612 18.973 -2.488 1.00 2.57 H new ATOM 0 HZ3 LYS A 26 -6.729 18.062 -1.061 1.00 2.57 H new ATOM 1037 N PHE A 27 -8.102 14.863 -0.763 1.00 0.78 N ATOM 1038 CA PHE A 27 -7.362 14.226 0.302 1.00 0.78 C ATOM 1039 C PHE A 27 -8.285 13.481 1.260 1.00 0.69 C ATOM 1040 O PHE A 27 -7.825 12.766 2.151 1.00 0.68 O ATOM 1041 CB PHE A 27 -6.578 15.283 1.058 1.00 0.98 C ATOM 1042 CG PHE A 27 -5.331 14.765 1.677 1.00 0.66 C ATOM 1043 CD1 PHE A 27 -5.351 14.176 2.924 1.00 1.57 C ATOM 1044 CD2 PHE A 27 -4.137 14.877 1.004 1.00 1.53 C ATOM 1045 CE1 PHE A 27 -4.187 13.704 3.495 1.00 2.34 C ATOM 1046 CE2 PHE A 27 -2.970 14.413 1.567 1.00 2.32 C ATOM 1047 CZ PHE A 27 -2.993 13.826 2.816 1.00 2.54 C ATOM 0 H PHE A 27 -8.429 15.805 -0.546 1.00 0.78 H new ATOM 0 HA PHE A 27 -6.684 13.494 -0.137 1.00 0.78 H new ATOM 0 HB2 PHE A 27 -6.326 16.095 0.375 1.00 0.98 H new ATOM 0 HB3 PHE A 27 -7.212 15.707 1.837 1.00 0.98 H new ATOM 0 HD1 PHE A 27 -6.285 14.084 3.458 1.00 1.57 H new ATOM 0 HD2 PHE A 27 -4.115 15.333 0.025 1.00 1.53 H new ATOM 0 HE1 PHE A 27 -4.211 13.241 4.470 1.00 2.34 H new ATOM 0 HE2 PHE A 27 -2.037 14.508 1.032 1.00 2.32 H new ATOM 0 HZ PHE A 27 -2.078 13.463 3.260 1.00 2.54 H new ATOM 1057 N LYS A 28 -9.581 13.641 1.088 1.00 0.67 N ATOM 1058 CA LYS A 28 -10.520 13.034 2.006 1.00 0.64 C ATOM 1059 C LYS A 28 -11.565 12.226 1.268 1.00 0.48 C ATOM 1060 O LYS A 28 -12.351 12.758 0.486 1.00 0.54 O ATOM 1061 CB LYS A 28 -11.192 14.120 2.854 1.00 0.87 C ATOM 1062 CG LYS A 28 -12.217 13.595 3.848 1.00 1.00 C ATOM 1063 CD LYS A 28 -11.590 12.652 4.859 1.00 1.04 C ATOM 1064 CE LYS A 28 -10.516 13.339 5.689 1.00 1.55 C ATOM 1065 NZ LYS A 28 -11.040 14.528 6.412 1.00 2.03 N ATOM 0 H LYS A 28 -10.003 14.179 0.331 1.00 0.67 H new ATOM 0 HA LYS A 28 -9.971 12.354 2.657 1.00 0.64 H new ATOM 0 HB2 LYS A 28 -10.422 14.667 3.399 1.00 0.87 H new ATOM 0 HB3 LYS A 28 -11.680 14.833 2.189 1.00 0.87 H new ATOM 0 HG2 LYS A 28 -12.679 14.433 4.370 1.00 1.00 H new ATOM 0 HG3 LYS A 28 -13.011 13.077 3.311 1.00 1.00 H new ATOM 0 HD2 LYS A 28 -12.364 12.262 5.519 1.00 1.04 H new ATOM 0 HD3 LYS A 28 -11.155 11.799 4.338 1.00 1.04 H new ATOM 0 HE2 LYS A 28 -10.106 12.630 6.408 1.00 1.55 H new ATOM 0 HE3 LYS A 28 -9.696 13.644 5.039 1.00 1.55 H new ATOM 0 HZ1 LYS A 28 -10.519 14.649 7.304 1.00 2.03 H new ATOM 0 HZ2 LYS A 28 -10.918 15.375 5.821 1.00 2.03 H new ATOM 0 HZ3 LYS A 28 -12.050 14.392 6.617 1.00 2.03 H new ATOM 1079 N LEU A 29 -11.581 10.939 1.542 1.00 0.36 N ATOM 1080 CA LEU A 29 -12.574 10.060 0.952 1.00 0.32 C ATOM 1081 C LEU A 29 -13.591 9.617 1.988 1.00 0.34 C ATOM 1082 O LEU A 29 -13.256 8.914 2.943 1.00 0.40 O ATOM 1083 CB LEU A 29 -11.937 8.824 0.312 1.00 0.30 C ATOM 1084 CG LEU A 29 -11.100 9.081 -0.942 1.00 0.30 C ATOM 1085 CD1 LEU A 29 -9.655 9.376 -0.576 1.00 0.32 C ATOM 1086 CD2 LEU A 29 -11.190 7.900 -1.895 1.00 0.33 C ATOM 0 H LEU A 29 -10.921 10.477 2.167 1.00 0.36 H new ATOM 0 HA LEU A 29 -13.074 10.634 0.172 1.00 0.32 H new ATOM 0 HB2 LEU A 29 -11.304 8.338 1.055 1.00 0.30 H new ATOM 0 HB3 LEU A 29 -12.730 8.120 0.059 1.00 0.30 H new ATOM 0 HG LEU A 29 -11.502 9.958 -1.449 1.00 0.30 H new ATOM 0 HD11 LEU A 29 -9.079 9.555 -1.484 1.00 0.32 H new ATOM 0 HD12 LEU A 29 -9.614 10.260 0.060 1.00 0.32 H new ATOM 0 HD13 LEU A 29 -9.234 8.524 -0.042 1.00 0.32 H new ATOM 0 HD21 LEU A 29 -10.588 8.101 -2.781 1.00 0.33 H new ATOM 0 HD22 LEU A 29 -10.818 7.003 -1.399 1.00 0.33 H new ATOM 0 HD23 LEU A 29 -12.229 7.748 -2.189 1.00 0.33 H new ATOM 1098 N ASN A 30 -14.829 10.046 1.810 1.00 0.35 N ATOM 1099 CA ASN A 30 -15.920 9.527 2.614 1.00 0.35 C ATOM 1100 C ASN A 30 -16.443 8.259 1.943 1.00 0.31 C ATOM 1101 O ASN A 30 -15.852 7.800 0.959 1.00 0.29 O ATOM 1102 CB ASN A 30 -17.040 10.569 2.785 1.00 0.41 C ATOM 1103 CG ASN A 30 -17.927 10.705 1.560 1.00 0.62 C ATOM 1104 OD1 ASN A 30 -18.930 10.004 1.430 1.00 1.20 O ATOM 1105 ND2 ASN A 30 -17.575 11.613 0.664 1.00 0.63 N ATOM 0 H ASN A 30 -15.102 10.747 1.121 1.00 0.35 H new ATOM 0 HA ASN A 30 -15.559 9.295 3.616 1.00 0.35 H new ATOM 0 HB2 ASN A 30 -17.655 10.293 3.642 1.00 0.41 H new ATOM 0 HB3 ASN A 30 -16.594 11.538 3.011 1.00 0.41 H new ATOM 0 HD21 ASN A 30 -18.143 11.752 -0.172 1.00 0.63 H new ATOM 0 HD22 ASN A 30 -16.736 12.174 0.809 1.00 0.63 H new ATOM 1112 N LYS A 31 -17.525 7.696 2.465 1.00 0.32 N ATOM 1113 CA LYS A 31 -18.102 6.468 1.914 1.00 0.31 C ATOM 1114 C LYS A 31 -18.249 6.526 0.389 1.00 0.30 C ATOM 1115 O LYS A 31 -17.789 5.626 -0.313 1.00 0.31 O ATOM 1116 CB LYS A 31 -19.473 6.181 2.531 1.00 0.35 C ATOM 1117 CG LYS A 31 -19.449 5.955 4.037 1.00 0.45 C ATOM 1118 CD LYS A 31 -20.816 5.523 4.547 1.00 0.56 C ATOM 1119 CE LYS A 31 -21.878 6.582 4.286 1.00 1.22 C ATOM 1120 NZ LYS A 31 -21.606 7.842 5.026 1.00 1.70 N ATOM 0 H LYS A 31 -18.025 8.069 3.272 1.00 0.32 H new ATOM 0 HA LYS A 31 -17.407 5.667 2.164 1.00 0.31 H new ATOM 0 HB2 LYS A 31 -20.139 7.016 2.311 1.00 0.35 H new ATOM 0 HB3 LYS A 31 -19.897 5.300 2.050 1.00 0.35 H new ATOM 0 HG2 LYS A 31 -18.709 5.194 4.282 1.00 0.45 H new ATOM 0 HG3 LYS A 31 -19.142 6.872 4.541 1.00 0.45 H new ATOM 0 HD2 LYS A 31 -21.106 4.590 4.063 1.00 0.56 H new ATOM 0 HD3 LYS A 31 -20.758 5.322 5.617 1.00 0.56 H new ATOM 0 HE2 LYS A 31 -21.924 6.793 3.218 1.00 1.22 H new ATOM 0 HE3 LYS A 31 -22.854 6.195 4.577 1.00 1.22 H new ATOM 0 HZ1 LYS A 31 -22.432 8.470 4.957 1.00 1.70 H new ATOM 0 HZ2 LYS A 31 -21.419 7.624 6.026 1.00 1.70 H new ATOM 0 HZ3 LYS A 31 -20.776 8.314 4.614 1.00 1.70 H new ATOM 1134 N SER A 32 -18.862 7.593 -0.118 1.00 0.32 N ATOM 1135 CA SER A 32 -19.177 7.691 -1.542 1.00 0.34 C ATOM 1136 C SER A 32 -17.920 7.737 -2.408 1.00 0.31 C ATOM 1137 O SER A 32 -17.889 7.162 -3.500 1.00 0.34 O ATOM 1138 CB SER A 32 -20.045 8.924 -1.811 1.00 0.43 C ATOM 1139 OG SER A 32 -19.423 10.110 -1.337 1.00 1.29 O ATOM 0 H SER A 32 -19.150 8.401 0.434 1.00 0.32 H new ATOM 0 HA SER A 32 -19.730 6.791 -1.813 1.00 0.34 H new ATOM 0 HB2 SER A 32 -20.232 9.012 -2.881 1.00 0.43 H new ATOM 0 HB3 SER A 32 -21.014 8.801 -1.327 1.00 0.43 H new ATOM 0 HG SER A 32 -18.595 10.267 -1.836 1.00 1.29 H new ATOM 1145 N GLU A 33 -16.877 8.393 -1.911 1.00 0.30 N ATOM 1146 CA GLU A 33 -15.667 8.588 -2.693 1.00 0.31 C ATOM 1147 C GLU A 33 -14.926 7.274 -2.808 1.00 0.26 C ATOM 1148 O GLU A 33 -14.461 6.893 -3.884 1.00 0.27 O ATOM 1149 CB GLU A 33 -14.766 9.640 -2.041 1.00 0.37 C ATOM 1150 CG GLU A 33 -15.489 10.923 -1.664 1.00 0.51 C ATOM 1151 CD GLU A 33 -16.349 11.473 -2.784 1.00 0.88 C ATOM 1152 OE1 GLU A 33 -15.838 12.260 -3.605 1.00 1.68 O ATOM 1153 OE2 GLU A 33 -17.550 11.129 -2.837 1.00 1.46 O ATOM 0 H GLU A 33 -16.847 8.796 -0.974 1.00 0.30 H new ATOM 0 HA GLU A 33 -15.942 8.941 -3.687 1.00 0.31 H new ATOM 0 HB2 GLU A 33 -14.314 9.213 -1.146 1.00 0.37 H new ATOM 0 HB3 GLU A 33 -13.952 9.881 -2.725 1.00 0.37 H new ATOM 0 HG2 GLU A 33 -16.115 10.737 -0.791 1.00 0.51 H new ATOM 0 HG3 GLU A 33 -14.755 11.675 -1.375 1.00 0.51 H new ATOM 1160 N LEU A 34 -14.839 6.575 -1.688 1.00 0.23 N ATOM 1161 CA LEU A 34 -14.229 5.264 -1.657 1.00 0.20 C ATOM 1162 C LEU A 34 -15.036 4.282 -2.482 1.00 0.20 C ATOM 1163 O LEU A 34 -14.475 3.501 -3.244 1.00 0.23 O ATOM 1164 CB LEU A 34 -14.106 4.765 -0.223 1.00 0.18 C ATOM 1165 CG LEU A 34 -12.882 5.268 0.526 1.00 0.18 C ATOM 1166 CD1 LEU A 34 -13.011 4.967 2.004 1.00 0.21 C ATOM 1167 CD2 LEU A 34 -11.632 4.624 -0.049 1.00 0.18 C ATOM 0 H LEU A 34 -15.187 6.900 -0.786 1.00 0.23 H new ATOM 0 HA LEU A 34 -13.230 5.343 -2.086 1.00 0.20 H new ATOM 0 HB2 LEU A 34 -14.999 5.062 0.328 1.00 0.18 H new ATOM 0 HB3 LEU A 34 -14.086 3.675 -0.233 1.00 0.18 H new ATOM 0 HG LEU A 34 -12.806 6.349 0.407 1.00 0.18 H new ATOM 0 HD11 LEU A 34 -12.128 5.332 2.528 1.00 0.21 H new ATOM 0 HD12 LEU A 34 -13.898 5.461 2.400 1.00 0.21 H new ATOM 0 HD13 LEU A 34 -13.100 3.890 2.150 1.00 0.21 H new ATOM 0 HD21 LEU A 34 -10.756 4.986 0.489 1.00 0.18 H new ATOM 0 HD22 LEU A 34 -11.700 3.541 0.055 1.00 0.18 H new ATOM 0 HD23 LEU A 34 -11.542 4.882 -1.104 1.00 0.18 H new ATOM 1179 N LYS A 35 -16.356 4.338 -2.341 1.00 0.23 N ATOM 1180 CA LYS A 35 -17.227 3.425 -3.058 1.00 0.29 C ATOM 1181 C LYS A 35 -16.983 3.506 -4.551 1.00 0.25 C ATOM 1182 O LYS A 35 -16.678 2.499 -5.177 1.00 0.27 O ATOM 1183 CB LYS A 35 -18.704 3.686 -2.748 1.00 0.42 C ATOM 1184 CG LYS A 35 -19.630 2.669 -3.394 1.00 0.60 C ATOM 1185 CD LYS A 35 -21.014 2.671 -2.764 1.00 0.71 C ATOM 1186 CE LYS A 35 -21.815 3.883 -3.181 1.00 0.53 C ATOM 1187 NZ LYS A 35 -23.153 3.904 -2.539 1.00 0.89 N ATOM 0 H LYS A 35 -16.841 5.004 -1.739 1.00 0.23 H new ATOM 0 HA LYS A 35 -16.987 2.418 -2.717 1.00 0.29 H new ATOM 0 HB2 LYS A 35 -18.852 3.671 -1.668 1.00 0.42 H new ATOM 0 HB3 LYS A 35 -18.972 4.685 -3.093 1.00 0.42 H new ATOM 0 HG2 LYS A 35 -19.717 2.884 -4.459 1.00 0.60 H new ATOM 0 HG3 LYS A 35 -19.193 1.674 -3.305 1.00 0.60 H new ATOM 0 HD2 LYS A 35 -21.547 1.765 -3.053 1.00 0.71 H new ATOM 0 HD3 LYS A 35 -20.920 2.653 -1.678 1.00 0.71 H new ATOM 0 HE2 LYS A 35 -21.270 4.789 -2.915 1.00 0.53 H new ATOM 0 HE3 LYS A 35 -21.931 3.887 -4.265 1.00 0.53 H new ATOM 0 HZ1 LYS A 35 -23.563 4.856 -2.623 1.00 0.89 H new ATOM 0 HZ2 LYS A 35 -23.775 3.216 -3.010 1.00 0.89 H new ATOM 0 HZ3 LYS A 35 -23.060 3.655 -1.534 1.00 0.89 H new ATOM 1201 N GLU A 36 -17.075 4.703 -5.111 1.00 0.25 N ATOM 1202 CA GLU A 36 -16.895 4.874 -6.545 1.00 0.28 C ATOM 1203 C GLU A 36 -15.506 4.404 -6.964 1.00 0.28 C ATOM 1204 O GLU A 36 -15.342 3.741 -7.988 1.00 0.34 O ATOM 1205 CB GLU A 36 -17.092 6.330 -6.944 1.00 0.32 C ATOM 1206 CG GLU A 36 -17.393 6.498 -8.420 1.00 0.66 C ATOM 1207 CD GLU A 36 -17.550 7.947 -8.828 1.00 0.77 C ATOM 1208 OE1 GLU A 36 -18.603 8.544 -8.511 1.00 1.28 O ATOM 1209 OE2 GLU A 36 -16.636 8.487 -9.486 1.00 1.49 O ATOM 0 H GLU A 36 -17.271 5.563 -4.600 1.00 0.25 H new ATOM 0 HA GLU A 36 -17.644 4.269 -7.056 1.00 0.28 H new ATOM 0 HB2 GLU A 36 -17.909 6.755 -6.360 1.00 0.32 H new ATOM 0 HB3 GLU A 36 -16.194 6.895 -6.694 1.00 0.32 H new ATOM 0 HG2 GLU A 36 -16.590 6.047 -9.003 1.00 0.66 H new ATOM 0 HG3 GLU A 36 -18.307 5.956 -8.663 1.00 0.66 H new ATOM 1216 N LEU A 37 -14.517 4.735 -6.147 1.00 0.25 N ATOM 1217 CA LEU A 37 -13.144 4.321 -6.381 1.00 0.27 C ATOM 1218 C LEU A 37 -13.058 2.801 -6.479 1.00 0.23 C ATOM 1219 O LEU A 37 -12.507 2.257 -7.439 1.00 0.24 O ATOM 1220 CB LEU A 37 -12.264 4.853 -5.248 1.00 0.32 C ATOM 1221 CG LEU A 37 -10.768 4.907 -5.535 1.00 0.40 C ATOM 1222 CD1 LEU A 37 -10.169 6.154 -4.911 1.00 0.33 C ATOM 1223 CD2 LEU A 37 -10.074 3.667 -4.998 1.00 0.74 C ATOM 0 H LEU A 37 -14.644 5.297 -5.305 1.00 0.25 H new ATOM 0 HA LEU A 37 -12.790 4.732 -7.327 1.00 0.27 H new ATOM 0 HB2 LEU A 37 -12.602 5.858 -4.993 1.00 0.32 H new ATOM 0 HB3 LEU A 37 -12.423 4.230 -4.368 1.00 0.32 H new ATOM 0 HG LEU A 37 -10.621 4.941 -6.614 1.00 0.40 H new ATOM 0 HD11 LEU A 37 -9.100 6.187 -5.119 1.00 0.33 H new ATOM 0 HD12 LEU A 37 -10.648 7.038 -5.332 1.00 0.33 H new ATOM 0 HD13 LEU A 37 -10.328 6.134 -3.833 1.00 0.33 H new ATOM 0 HD21 LEU A 37 -9.007 3.725 -5.213 1.00 0.74 H new ATOM 0 HD22 LEU A 37 -10.224 3.604 -3.920 1.00 0.74 H new ATOM 0 HD23 LEU A 37 -10.492 2.781 -5.475 1.00 0.74 H new ATOM 1235 N LEU A 38 -13.647 2.123 -5.506 1.00 0.20 N ATOM 1236 CA LEU A 38 -13.666 0.669 -5.490 1.00 0.20 C ATOM 1237 C LEU A 38 -14.540 0.106 -6.612 1.00 0.22 C ATOM 1238 O LEU A 38 -14.182 -0.877 -7.238 1.00 0.24 O ATOM 1239 CB LEU A 38 -14.142 0.149 -4.130 1.00 0.19 C ATOM 1240 CG LEU A 38 -13.066 0.083 -3.042 1.00 0.18 C ATOM 1241 CD1 LEU A 38 -13.396 1.021 -1.896 1.00 0.19 C ATOM 1242 CD2 LEU A 38 -12.912 -1.342 -2.535 1.00 0.21 C ATOM 0 H LEU A 38 -14.120 2.559 -4.714 1.00 0.20 H new ATOM 0 HA LEU A 38 -12.645 0.326 -5.658 1.00 0.20 H new ATOM 0 HB2 LEU A 38 -14.952 0.788 -3.778 1.00 0.19 H new ATOM 0 HB3 LEU A 38 -14.559 -0.849 -4.267 1.00 0.19 H new ATOM 0 HG LEU A 38 -12.120 0.402 -3.479 1.00 0.18 H new ATOM 0 HD11 LEU A 38 -12.617 0.956 -1.136 1.00 0.19 H new ATOM 0 HD12 LEU A 38 -13.455 2.044 -2.268 1.00 0.19 H new ATOM 0 HD13 LEU A 38 -14.354 0.738 -1.459 1.00 0.19 H new ATOM 0 HD21 LEU A 38 -12.144 -1.372 -1.762 1.00 0.21 H new ATOM 0 HD22 LEU A 38 -13.859 -1.684 -2.118 1.00 0.21 H new ATOM 0 HD23 LEU A 38 -12.622 -1.993 -3.360 1.00 0.21 H new ATOM 1254 N THR A 39 -15.670 0.738 -6.881 1.00 0.23 N ATOM 1255 CA THR A 39 -16.603 0.226 -7.892 1.00 0.26 C ATOM 1256 C THR A 39 -15.964 0.208 -9.276 1.00 0.27 C ATOM 1257 O THR A 39 -16.263 -0.656 -10.100 1.00 0.30 O ATOM 1258 CB THR A 39 -17.919 1.038 -7.966 1.00 0.29 C ATOM 1259 OG1 THR A 39 -17.649 2.414 -8.257 1.00 0.33 O ATOM 1260 CG2 THR A 39 -18.706 0.935 -6.671 1.00 0.30 C ATOM 0 H THR A 39 -15.969 1.599 -6.423 1.00 0.23 H new ATOM 0 HA THR A 39 -16.844 -0.789 -7.577 1.00 0.26 H new ATOM 0 HB THR A 39 -18.519 0.613 -8.770 1.00 0.29 H new ATOM 0 HG1 THR A 39 -16.682 2.571 -8.226 1.00 0.33 H new ATOM 0 HG21 THR A 39 -19.624 1.516 -6.756 1.00 0.30 H new ATOM 0 HG22 THR A 39 -18.954 -0.109 -6.478 1.00 0.30 H new ATOM 0 HG23 THR A 39 -18.106 1.324 -5.848 1.00 0.30 H new ATOM 1268 N ARG A 40 -15.086 1.168 -9.523 1.00 0.27 N ATOM 1269 CA ARG A 40 -14.453 1.295 -10.822 1.00 0.30 C ATOM 1270 C ARG A 40 -13.146 0.512 -10.882 1.00 0.29 C ATOM 1271 O ARG A 40 -12.962 -0.345 -11.746 1.00 0.33 O ATOM 1272 CB ARG A 40 -14.188 2.767 -11.148 1.00 0.34 C ATOM 1273 CG ARG A 40 -15.438 3.637 -11.149 1.00 0.36 C ATOM 1274 CD ARG A 40 -16.545 3.034 -11.999 1.00 0.47 C ATOM 1275 NE ARG A 40 -16.116 2.769 -13.372 1.00 0.67 N ATOM 1276 CZ ARG A 40 -16.584 1.768 -14.116 1.00 0.90 C ATOM 1277 NH1 ARG A 40 -17.506 0.945 -13.626 1.00 1.24 N ATOM 1278 NH2 ARG A 40 -16.132 1.594 -15.350 1.00 1.09 N ATOM 0 H ARG A 40 -14.797 1.869 -8.840 1.00 0.27 H new ATOM 0 HA ARG A 40 -15.137 0.880 -11.562 1.00 0.30 H new ATOM 0 HB2 ARG A 40 -13.480 3.167 -10.422 1.00 0.34 H new ATOM 0 HB3 ARG A 40 -13.712 2.832 -12.127 1.00 0.34 H new ATOM 0 HG2 ARG A 40 -15.793 3.764 -10.126 1.00 0.36 H new ATOM 0 HG3 ARG A 40 -15.190 4.629 -11.526 1.00 0.36 H new ATOM 0 HD2 ARG A 40 -16.884 2.104 -11.542 1.00 0.47 H new ATOM 0 HD3 ARG A 40 -17.398 3.712 -12.013 1.00 0.47 H new ATOM 0 HE ARG A 40 -15.417 3.387 -13.784 1.00 0.67 H new ATOM 0 HH11 ARG A 40 -17.857 1.079 -12.678 1.00 1.24 H new ATOM 0 HH12 ARG A 40 -17.862 0.180 -14.198 1.00 1.24 H new ATOM 0 HH21 ARG A 40 -15.427 2.226 -15.729 1.00 1.09 H new ATOM 0 HH22 ARG A 40 -16.489 0.828 -15.921 1.00 1.09 H new ATOM 1292 N GLU A 41 -12.243 0.811 -9.962 1.00 0.29 N ATOM 1293 CA GLU A 41 -10.890 0.280 -10.032 1.00 0.32 C ATOM 1294 C GLU A 41 -10.637 -0.896 -9.094 1.00 0.35 C ATOM 1295 O GLU A 41 -9.592 -1.530 -9.175 1.00 0.46 O ATOM 1296 CB GLU A 41 -9.888 1.398 -9.778 1.00 0.38 C ATOM 1297 CG GLU A 41 -9.544 2.163 -11.038 1.00 0.47 C ATOM 1298 CD GLU A 41 -8.828 3.468 -10.769 1.00 0.83 C ATOM 1299 OE1 GLU A 41 -7.639 3.435 -10.392 1.00 1.54 O ATOM 1300 OE2 GLU A 41 -9.450 4.535 -10.961 1.00 1.60 O ATOM 0 H GLU A 41 -12.421 1.416 -9.160 1.00 0.29 H new ATOM 0 HA GLU A 41 -10.762 -0.118 -11.039 1.00 0.32 H new ATOM 0 HB2 GLU A 41 -10.296 2.087 -9.038 1.00 0.38 H new ATOM 0 HB3 GLU A 41 -8.977 0.976 -9.352 1.00 0.38 H new ATOM 0 HG2 GLU A 41 -8.918 1.538 -11.675 1.00 0.47 H new ATOM 0 HG3 GLU A 41 -10.460 2.367 -11.593 1.00 0.47 H new ATOM 1307 N LEU A 42 -11.571 -1.196 -8.202 1.00 0.28 N ATOM 1308 CA LEU A 42 -11.415 -2.357 -7.322 1.00 0.29 C ATOM 1309 C LEU A 42 -12.675 -3.236 -7.320 1.00 0.28 C ATOM 1310 O LEU A 42 -13.057 -3.752 -6.271 1.00 0.26 O ATOM 1311 CB LEU A 42 -11.120 -1.926 -5.876 1.00 0.27 C ATOM 1312 CG LEU A 42 -9.883 -1.054 -5.658 1.00 0.27 C ATOM 1313 CD1 LEU A 42 -10.174 0.406 -5.993 1.00 0.27 C ATOM 1314 CD2 LEU A 42 -9.395 -1.189 -4.225 1.00 0.31 C ATOM 0 H LEU A 42 -12.432 -0.666 -8.066 1.00 0.28 H new ATOM 0 HA LEU A 42 -10.574 -2.930 -7.713 1.00 0.29 H new ATOM 0 HB2 LEU A 42 -11.988 -1.386 -5.498 1.00 0.27 H new ATOM 0 HB3 LEU A 42 -11.014 -2.824 -5.268 1.00 0.27 H new ATOM 0 HG LEU A 42 -9.097 -1.399 -6.330 1.00 0.27 H new ATOM 0 HD11 LEU A 42 -9.277 1.003 -5.829 1.00 0.27 H new ATOM 0 HD12 LEU A 42 -10.477 0.486 -7.037 1.00 0.27 H new ATOM 0 HD13 LEU A 42 -10.976 0.773 -5.353 1.00 0.27 H new ATOM 0 HD21 LEU A 42 -8.514 -0.564 -4.080 1.00 0.31 H new ATOM 0 HD22 LEU A 42 -10.182 -0.871 -3.541 1.00 0.31 H new ATOM 0 HD23 LEU A 42 -9.139 -2.229 -4.024 1.00 0.31 H new ATOM 1326 N PRO A 43 -13.325 -3.471 -8.483 1.00 0.32 N ATOM 1327 CA PRO A 43 -14.624 -4.139 -8.505 1.00 0.34 C ATOM 1328 C PRO A 43 -14.489 -5.625 -8.220 1.00 0.35 C ATOM 1329 O PRO A 43 -15.439 -6.279 -7.790 1.00 0.38 O ATOM 1330 CB PRO A 43 -15.133 -3.895 -9.920 1.00 0.43 C ATOM 1331 CG PRO A 43 -13.906 -3.740 -10.751 1.00 0.52 C ATOM 1332 CD PRO A 43 -12.839 -3.174 -9.847 1.00 0.36 C ATOM 0 HA PRO A 43 -15.302 -3.759 -7.741 1.00 0.34 H new ATOM 0 HB2 PRO A 43 -15.743 -4.728 -10.269 1.00 0.43 H new ATOM 0 HB3 PRO A 43 -15.756 -3.002 -9.967 1.00 0.43 H new ATOM 0 HG2 PRO A 43 -13.594 -4.699 -11.164 1.00 0.52 H new ATOM 0 HG3 PRO A 43 -14.091 -3.075 -11.595 1.00 0.52 H new ATOM 0 HD2 PRO A 43 -11.871 -3.638 -10.035 1.00 0.36 H new ATOM 0 HD3 PRO A 43 -12.714 -2.102 -10.001 1.00 0.36 H new ATOM 1340 N SER A 44 -13.292 -6.144 -8.439 1.00 0.37 N ATOM 1341 CA SER A 44 -12.991 -7.527 -8.131 1.00 0.41 C ATOM 1342 C SER A 44 -13.001 -7.735 -6.616 1.00 0.37 C ATOM 1343 O SER A 44 -13.161 -8.849 -6.133 1.00 0.42 O ATOM 1344 CB SER A 44 -11.627 -7.901 -8.727 1.00 0.48 C ATOM 1345 OG SER A 44 -11.567 -7.554 -10.103 1.00 1.09 O ATOM 0 H SER A 44 -12.509 -5.621 -8.832 1.00 0.37 H new ATOM 0 HA SER A 44 -13.750 -8.174 -8.570 1.00 0.41 H new ATOM 0 HB2 SER A 44 -10.834 -7.388 -8.183 1.00 0.48 H new ATOM 0 HB3 SER A 44 -11.454 -8.971 -8.609 1.00 0.48 H new ATOM 0 HG SER A 44 -10.900 -6.848 -10.234 1.00 1.09 H new ATOM 1351 N PHE A 45 -12.890 -6.630 -5.885 1.00 0.33 N ATOM 1352 CA PHE A 45 -12.801 -6.658 -4.430 1.00 0.34 C ATOM 1353 C PHE A 45 -14.114 -6.221 -3.777 1.00 0.36 C ATOM 1354 O PHE A 45 -14.137 -5.862 -2.599 1.00 0.40 O ATOM 1355 CB PHE A 45 -11.657 -5.758 -3.954 1.00 0.33 C ATOM 1356 CG PHE A 45 -10.317 -6.156 -4.501 1.00 0.35 C ATOM 1357 CD1 PHE A 45 -9.638 -7.246 -3.980 1.00 1.17 C ATOM 1358 CD2 PHE A 45 -9.737 -5.444 -5.539 1.00 1.31 C ATOM 1359 CE1 PHE A 45 -8.405 -7.617 -4.482 1.00 1.15 C ATOM 1360 CE2 PHE A 45 -8.505 -5.810 -6.047 1.00 1.36 C ATOM 1361 CZ PHE A 45 -7.838 -6.897 -5.517 1.00 0.46 C ATOM 0 H PHE A 45 -12.859 -5.692 -6.284 1.00 0.33 H new ATOM 0 HA PHE A 45 -12.603 -7.687 -4.130 1.00 0.34 H new ATOM 0 HB2 PHE A 45 -11.869 -4.729 -4.245 1.00 0.33 H new ATOM 0 HB3 PHE A 45 -11.617 -5.779 -2.865 1.00 0.33 H new ATOM 0 HD1 PHE A 45 -10.078 -7.812 -3.172 1.00 1.17 H new ATOM 0 HD2 PHE A 45 -10.254 -4.593 -5.956 1.00 1.31 H new ATOM 0 HE1 PHE A 45 -7.885 -8.468 -4.067 1.00 1.15 H new ATOM 0 HE2 PHE A 45 -8.065 -5.247 -6.857 1.00 1.36 H new ATOM 0 HZ PHE A 45 -6.874 -7.184 -5.911 1.00 0.46 H new ATOM 1371 N LEU A 46 -15.198 -6.186 -4.542 1.00 0.36 N ATOM 1372 CA LEU A 46 -16.474 -5.736 -3.990 1.00 0.40 C ATOM 1373 C LEU A 46 -17.528 -6.832 -3.944 1.00 0.55 C ATOM 1374 O LEU A 46 -18.376 -6.841 -3.050 1.00 0.70 O ATOM 1375 CB LEU A 46 -17.011 -4.546 -4.776 1.00 0.35 C ATOM 1376 CG LEU A 46 -16.138 -3.299 -4.702 1.00 0.32 C ATOM 1377 CD1 LEU A 46 -16.800 -2.150 -5.436 1.00 0.34 C ATOM 1378 CD2 LEU A 46 -15.877 -2.938 -3.250 1.00 0.30 C ATOM 0 H LEU A 46 -15.224 -6.457 -5.525 1.00 0.36 H new ATOM 0 HA LEU A 46 -16.269 -5.441 -2.961 1.00 0.40 H new ATOM 0 HB2 LEU A 46 -17.122 -4.836 -5.821 1.00 0.35 H new ATOM 0 HB3 LEU A 46 -18.006 -4.301 -4.406 1.00 0.35 H new ATOM 0 HG LEU A 46 -15.182 -3.502 -5.185 1.00 0.32 H new ATOM 0 HD11 LEU A 46 -16.166 -1.266 -5.375 1.00 0.34 H new ATOM 0 HD12 LEU A 46 -16.945 -2.421 -6.482 1.00 0.34 H new ATOM 0 HD13 LEU A 46 -17.766 -1.935 -4.980 1.00 0.34 H new ATOM 0 HD21 LEU A 46 -15.252 -2.046 -3.203 1.00 0.30 H new ATOM 0 HD22 LEU A 46 -16.825 -2.744 -2.747 1.00 0.30 H new ATOM 0 HD23 LEU A 46 -15.366 -3.764 -2.756 1.00 0.30 H new ATOM 1390 N GLY A 47 -17.489 -7.741 -4.901 1.00 0.64 N ATOM 1391 CA GLY A 47 -18.527 -8.752 -4.992 1.00 0.82 C ATOM 1392 C GLY A 47 -19.777 -8.208 -5.657 1.00 0.87 C ATOM 1393 O GLY A 47 -20.875 -8.733 -5.459 1.00 1.23 O ATOM 0 H GLY A 47 -16.763 -7.801 -5.615 1.00 0.64 H new ATOM 0 HA2 GLY A 47 -18.155 -9.606 -5.558 1.00 0.82 H new ATOM 0 HA3 GLY A 47 -18.773 -9.113 -3.993 1.00 0.82 H new ATOM 1397 N LYS A 48 -19.591 -7.129 -6.423 1.00 0.79 N ATOM 1398 CA LYS A 48 -20.653 -6.474 -7.197 1.00 0.95 C ATOM 1399 C LYS A 48 -21.625 -5.703 -6.307 1.00 0.73 C ATOM 1400 O LYS A 48 -21.776 -4.489 -6.444 1.00 0.97 O ATOM 1401 CB LYS A 48 -21.426 -7.484 -8.050 1.00 1.43 C ATOM 1402 CG LYS A 48 -22.408 -6.830 -9.004 1.00 2.17 C ATOM 1403 CD LYS A 48 -21.681 -6.013 -10.056 1.00 2.32 C ATOM 1404 CE LYS A 48 -22.646 -5.285 -10.975 1.00 2.88 C ATOM 1405 NZ LYS A 48 -23.290 -4.125 -10.304 1.00 3.51 N ATOM 0 H LYS A 48 -18.682 -6.677 -6.525 1.00 0.79 H new ATOM 0 HA LYS A 48 -20.156 -5.760 -7.854 1.00 0.95 H new ATOM 0 HB2 LYS A 48 -20.718 -8.084 -8.622 1.00 1.43 H new ATOM 0 HB3 LYS A 48 -21.966 -8.167 -7.394 1.00 1.43 H new ATOM 0 HG2 LYS A 48 -23.015 -7.595 -9.488 1.00 2.17 H new ATOM 0 HG3 LYS A 48 -23.090 -6.188 -8.446 1.00 2.17 H new ATOM 0 HD2 LYS A 48 -21.029 -5.289 -9.567 1.00 2.32 H new ATOM 0 HD3 LYS A 48 -21.042 -6.669 -10.647 1.00 2.32 H new ATOM 0 HE2 LYS A 48 -22.112 -4.940 -11.861 1.00 2.88 H new ATOM 0 HE3 LYS A 48 -23.415 -5.979 -11.316 1.00 2.88 H new ATOM 0 HZ1 LYS A 48 -23.888 -3.617 -10.987 1.00 3.51 H new ATOM 0 HZ2 LYS A 48 -23.876 -4.462 -9.514 1.00 3.51 H new ATOM 0 HZ3 LYS A 48 -22.557 -3.483 -9.942 1.00 3.51 H new ATOM 1419 N ARG A 49 -22.264 -6.416 -5.397 1.00 0.73 N ATOM 1420 CA ARG A 49 -23.334 -5.864 -4.562 1.00 0.70 C ATOM 1421 C ARG A 49 -22.791 -5.012 -3.422 1.00 0.61 C ATOM 1422 O ARG A 49 -23.151 -5.205 -2.260 1.00 0.75 O ATOM 1423 CB ARG A 49 -24.199 -6.998 -4.002 1.00 0.97 C ATOM 1424 CG ARG A 49 -23.393 -8.132 -3.385 1.00 1.10 C ATOM 1425 CD ARG A 49 -24.277 -9.120 -2.640 1.00 1.54 C ATOM 1426 NE ARG A 49 -25.404 -9.579 -3.450 1.00 2.02 N ATOM 1427 CZ ARG A 49 -25.668 -10.855 -3.721 1.00 2.68 C ATOM 1428 NH1 ARG A 49 -24.826 -11.817 -3.354 1.00 3.06 N ATOM 1429 NH2 ARG A 49 -26.769 -11.166 -4.387 1.00 3.24 N ATOM 0 H ARG A 49 -22.060 -7.398 -5.210 1.00 0.73 H new ATOM 0 HA ARG A 49 -23.941 -5.216 -5.194 1.00 0.70 H new ATOM 0 HB2 ARG A 49 -24.873 -6.591 -3.249 1.00 0.97 H new ATOM 0 HB3 ARG A 49 -24.820 -7.399 -4.803 1.00 0.97 H new ATOM 0 HG2 ARG A 49 -22.845 -8.655 -4.169 1.00 1.10 H new ATOM 0 HG3 ARG A 49 -22.653 -7.719 -2.699 1.00 1.10 H new ATOM 0 HD2 ARG A 49 -23.680 -9.979 -2.334 1.00 1.54 H new ATOM 0 HD3 ARG A 49 -24.653 -8.652 -1.730 1.00 1.54 H new ATOM 0 HE ARG A 49 -26.031 -8.872 -3.834 1.00 2.02 H new ATOM 0 HH11 ARG A 49 -23.966 -11.581 -2.859 1.00 3.06 H new ATOM 0 HH12 ARG A 49 -25.040 -12.791 -3.568 1.00 3.06 H new ATOM 0 HH21 ARG A 49 -27.408 -10.430 -4.688 1.00 3.24 H new ATOM 0 HH22 ARG A 49 -26.979 -12.142 -4.599 1.00 3.24 H new ATOM 1443 N THR A 50 -21.941 -4.058 -3.746 1.00 0.55 N ATOM 1444 CA THR A 50 -21.357 -3.206 -2.735 1.00 0.50 C ATOM 1445 C THR A 50 -22.172 -1.957 -2.495 1.00 0.50 C ATOM 1446 O THR A 50 -22.157 -1.009 -3.281 1.00 0.56 O ATOM 1447 CB THR A 50 -19.925 -2.822 -3.083 1.00 0.54 C ATOM 1448 OG1 THR A 50 -19.703 -3.011 -4.486 1.00 0.91 O ATOM 1449 CG2 THR A 50 -18.961 -3.660 -2.265 1.00 0.51 C ATOM 0 H THR A 50 -21.641 -3.855 -4.700 1.00 0.55 H new ATOM 0 HA THR A 50 -21.353 -3.791 -1.815 1.00 0.50 H new ATOM 0 HB THR A 50 -19.757 -1.771 -2.846 1.00 0.54 H new ATOM 0 HG1 THR A 50 -19.925 -2.186 -4.966 1.00 0.91 H new ATOM 0 HG21 THR A 50 -17.937 -3.384 -2.515 1.00 0.51 H new ATOM 0 HG22 THR A 50 -19.136 -3.483 -1.204 1.00 0.51 H new ATOM 0 HG23 THR A 50 -19.117 -4.716 -2.488 1.00 0.51 H new ATOM 1457 N ASP A 51 -22.895 -1.985 -1.405 1.00 0.49 N ATOM 1458 CA ASP A 51 -23.630 -0.827 -0.942 1.00 0.51 C ATOM 1459 C ASP A 51 -23.002 -0.305 0.333 1.00 0.44 C ATOM 1460 O ASP A 51 -21.913 -0.739 0.720 1.00 0.43 O ATOM 1461 CB ASP A 51 -25.107 -1.160 -0.707 1.00 0.60 C ATOM 1462 CG ASP A 51 -25.888 -1.287 -1.999 1.00 1.15 C ATOM 1463 OD1 ASP A 51 -26.151 -0.249 -2.641 1.00 1.94 O ATOM 1464 OD2 ASP A 51 -26.245 -2.421 -2.378 1.00 1.72 O ATOM 0 H ASP A 51 -22.993 -2.808 -0.811 1.00 0.49 H new ATOM 0 HA ASP A 51 -23.583 -0.059 -1.714 1.00 0.51 H new ATOM 0 HB2 ASP A 51 -25.181 -2.093 -0.149 1.00 0.60 H new ATOM 0 HB3 ASP A 51 -25.557 -0.383 -0.089 1.00 0.60 H new ATOM 1469 N GLU A 52 -23.700 0.600 0.996 1.00 0.47 N ATOM 1470 CA GLU A 52 -23.219 1.191 2.238 1.00 0.46 C ATOM 1471 C GLU A 52 -23.070 0.123 3.324 1.00 0.46 C ATOM 1472 O GLU A 52 -22.366 0.324 4.313 1.00 0.46 O ATOM 1473 CB GLU A 52 -24.193 2.278 2.692 1.00 0.49 C ATOM 1474 CG GLU A 52 -24.563 3.258 1.586 1.00 0.52 C ATOM 1475 CD GLU A 52 -23.396 4.105 1.126 1.00 0.71 C ATOM 1476 OE1 GLU A 52 -23.134 5.153 1.752 1.00 1.27 O ATOM 1477 OE2 GLU A 52 -22.751 3.737 0.122 1.00 1.44 O ATOM 0 H GLU A 52 -24.611 0.946 0.694 1.00 0.47 H new ATOM 0 HA GLU A 52 -22.238 1.633 2.064 1.00 0.46 H new ATOM 0 HB2 GLU A 52 -25.101 1.808 3.069 1.00 0.49 H new ATOM 0 HB3 GLU A 52 -23.751 2.828 3.522 1.00 0.49 H new ATOM 0 HG2 GLU A 52 -24.959 2.703 0.735 1.00 0.52 H new ATOM 0 HG3 GLU A 52 -25.361 3.911 1.940 1.00 0.52 H new ATOM 1484 N ALA A 53 -23.731 -1.015 3.122 1.00 0.52 N ATOM 1485 CA ALA A 53 -23.656 -2.129 4.059 1.00 0.58 C ATOM 1486 C ALA A 53 -22.253 -2.733 4.080 1.00 0.57 C ATOM 1487 O ALA A 53 -21.618 -2.805 5.132 1.00 0.68 O ATOM 1488 CB ALA A 53 -24.689 -3.185 3.705 1.00 0.65 C ATOM 0 H ALA A 53 -24.327 -1.188 2.313 1.00 0.52 H new ATOM 0 HA ALA A 53 -23.873 -1.751 5.058 1.00 0.58 H new ATOM 0 HB1 ALA A 53 -24.622 -4.011 4.413 1.00 0.65 H new ATOM 0 HB2 ALA A 53 -25.687 -2.748 3.751 1.00 0.65 H new ATOM 0 HB3 ALA A 53 -24.501 -3.555 2.697 1.00 0.65 H new ATOM 1494 N ALA A 54 -21.761 -3.150 2.914 1.00 0.49 N ATOM 1495 CA ALA A 54 -20.427 -3.733 2.818 1.00 0.50 C ATOM 1496 C ALA A 54 -19.359 -2.668 3.057 1.00 0.45 C ATOM 1497 O ALA A 54 -18.299 -2.943 3.612 1.00 0.52 O ATOM 1498 CB ALA A 54 -20.204 -4.394 1.461 1.00 0.49 C ATOM 0 H ALA A 54 -22.264 -3.095 2.028 1.00 0.49 H new ATOM 0 HA ALA A 54 -20.348 -4.500 3.589 1.00 0.50 H new ATOM 0 HB1 ALA A 54 -19.201 -4.818 1.423 1.00 0.49 H new ATOM 0 HB2 ALA A 54 -20.938 -5.186 1.317 1.00 0.49 H new ATOM 0 HB3 ALA A 54 -20.313 -3.650 0.672 1.00 0.49 H new ATOM 1504 N PHE A 55 -19.636 -1.449 2.630 1.00 0.36 N ATOM 1505 CA PHE A 55 -18.671 -0.367 2.761 1.00 0.32 C ATOM 1506 C PHE A 55 -18.526 0.098 4.202 1.00 0.34 C ATOM 1507 O PHE A 55 -17.547 0.762 4.545 1.00 0.34 O ATOM 1508 CB PHE A 55 -19.031 0.796 1.841 1.00 0.31 C ATOM 1509 CG PHE A 55 -18.444 0.629 0.475 1.00 0.28 C ATOM 1510 CD1 PHE A 55 -17.175 1.105 0.199 1.00 1.20 C ATOM 1511 CD2 PHE A 55 -19.142 -0.026 -0.524 1.00 1.20 C ATOM 1512 CE1 PHE A 55 -16.615 0.934 -1.047 1.00 1.21 C ATOM 1513 CE2 PHE A 55 -18.583 -0.201 -1.774 1.00 1.20 C ATOM 1514 CZ PHE A 55 -17.319 0.280 -2.037 1.00 0.31 C ATOM 0 H PHE A 55 -20.517 -1.182 2.191 1.00 0.36 H new ATOM 0 HA PHE A 55 -17.701 -0.759 2.454 1.00 0.32 H new ATOM 0 HB2 PHE A 55 -20.115 0.875 1.763 1.00 0.31 H new ATOM 0 HB3 PHE A 55 -18.674 1.729 2.278 1.00 0.31 H new ATOM 0 HD1 PHE A 55 -16.617 1.616 0.970 1.00 1.20 H new ATOM 0 HD2 PHE A 55 -20.134 -0.404 -0.324 1.00 1.20 H new ATOM 0 HE1 PHE A 55 -15.624 1.312 -1.250 1.00 1.21 H new ATOM 0 HE2 PHE A 55 -19.137 -0.715 -2.546 1.00 1.20 H new ATOM 0 HZ PHE A 55 -16.881 0.146 -3.015 1.00 0.31 H new ATOM 1524 N GLN A 56 -19.487 -0.261 5.043 1.00 0.37 N ATOM 1525 CA GLN A 56 -19.453 0.118 6.446 1.00 0.40 C ATOM 1526 C GLN A 56 -18.204 -0.434 7.129 1.00 0.37 C ATOM 1527 O GLN A 56 -17.479 0.307 7.782 1.00 0.42 O ATOM 1528 CB GLN A 56 -20.713 -0.365 7.165 1.00 0.46 C ATOM 1529 CG GLN A 56 -20.831 0.142 8.592 1.00 0.58 C ATOM 1530 CD GLN A 56 -22.164 -0.201 9.221 1.00 0.68 C ATOM 1531 OE1 GLN A 56 -23.128 0.559 9.112 1.00 1.42 O ATOM 1532 NE2 GLN A 56 -22.230 -1.341 9.886 1.00 1.00 N ATOM 0 H GLN A 56 -20.300 -0.815 4.776 1.00 0.37 H new ATOM 0 HA GLN A 56 -19.419 1.206 6.501 1.00 0.40 H new ATOM 0 HB2 GLN A 56 -21.589 -0.044 6.601 1.00 0.46 H new ATOM 0 HB3 GLN A 56 -20.721 -1.455 7.174 1.00 0.46 H new ATOM 0 HG2 GLN A 56 -20.029 -0.285 9.193 1.00 0.58 H new ATOM 0 HG3 GLN A 56 -20.696 1.224 8.602 1.00 0.58 H new ATOM 0 HE21 GLN A 56 -21.408 -1.941 9.952 1.00 1.00 H new ATOM 0 HE22 GLN A 56 -23.103 -1.621 10.333 1.00 1.00 H new ATOM 1541 N LYS A 57 -17.925 -1.726 6.946 1.00 0.34 N ATOM 1542 CA LYS A 57 -16.779 -2.349 7.603 1.00 0.35 C ATOM 1543 C LYS A 57 -15.487 -1.900 6.951 1.00 0.29 C ATOM 1544 O LYS A 57 -14.469 -1.737 7.618 1.00 0.34 O ATOM 1545 CB LYS A 57 -16.871 -3.877 7.557 1.00 0.47 C ATOM 1546 CG LYS A 57 -17.194 -4.540 8.896 1.00 0.85 C ATOM 1547 CD LYS A 57 -16.001 -4.562 9.856 1.00 0.57 C ATOM 1548 CE LYS A 57 -15.821 -3.244 10.600 1.00 0.63 C ATOM 1549 NZ LYS A 57 -14.806 -3.348 11.683 1.00 0.92 N ATOM 0 H LYS A 57 -18.471 -2.353 6.355 1.00 0.34 H new ATOM 0 HA LYS A 57 -16.788 -2.034 8.646 1.00 0.35 H new ATOM 0 HB2 LYS A 57 -17.636 -4.159 6.834 1.00 0.47 H new ATOM 0 HB3 LYS A 57 -15.924 -4.273 7.190 1.00 0.47 H new ATOM 0 HG2 LYS A 57 -18.022 -4.011 9.367 1.00 0.85 H new ATOM 0 HG3 LYS A 57 -17.529 -5.562 8.718 1.00 0.85 H new ATOM 0 HD2 LYS A 57 -16.136 -5.367 10.578 1.00 0.57 H new ATOM 0 HD3 LYS A 57 -15.093 -4.785 9.296 1.00 0.57 H new ATOM 0 HE2 LYS A 57 -15.521 -2.468 9.895 1.00 0.63 H new ATOM 0 HE3 LYS A 57 -16.775 -2.935 11.026 1.00 0.63 H new ATOM 0 HZ1 LYS A 57 -14.835 -2.490 12.269 1.00 0.92 H new ATOM 0 HZ2 LYS A 57 -15.013 -4.178 12.274 1.00 0.92 H new ATOM 0 HZ3 LYS A 57 -13.860 -3.449 11.263 1.00 0.92 H new ATOM 1563 N LEU A 58 -15.539 -1.696 5.644 1.00 0.24 N ATOM 1564 CA LEU A 58 -14.385 -1.232 4.893 1.00 0.20 C ATOM 1565 C LEU A 58 -13.895 0.099 5.440 1.00 0.20 C ATOM 1566 O LEU A 58 -12.815 0.179 6.022 1.00 0.22 O ATOM 1567 CB LEU A 58 -14.749 -1.100 3.411 1.00 0.20 C ATOM 1568 CG LEU A 58 -13.708 -0.395 2.541 1.00 0.19 C ATOM 1569 CD1 LEU A 58 -12.319 -0.951 2.808 1.00 0.20 C ATOM 1570 CD2 LEU A 58 -14.074 -0.530 1.070 1.00 0.23 C ATOM 0 H LEU A 58 -16.375 -1.846 5.079 1.00 0.24 H new ATOM 0 HA LEU A 58 -13.581 -1.960 4.996 1.00 0.20 H new ATOM 0 HB2 LEU A 58 -14.921 -2.097 3.006 1.00 0.20 H new ATOM 0 HB3 LEU A 58 -15.691 -0.557 3.333 1.00 0.20 H new ATOM 0 HG LEU A 58 -13.699 0.664 2.798 1.00 0.19 H new ATOM 0 HD11 LEU A 58 -11.594 -0.436 2.179 1.00 0.20 H new ATOM 0 HD12 LEU A 58 -12.062 -0.800 3.856 1.00 0.20 H new ATOM 0 HD13 LEU A 58 -12.304 -2.017 2.581 1.00 0.20 H new ATOM 0 HD21 LEU A 58 -13.325 -0.024 0.461 1.00 0.23 H new ATOM 0 HD22 LEU A 58 -14.109 -1.585 0.799 1.00 0.23 H new ATOM 0 HD23 LEU A 58 -15.050 -0.078 0.895 1.00 0.23 H new ATOM 1582 N MET A 59 -14.702 1.125 5.244 1.00 0.21 N ATOM 1583 CA MET A 59 -14.406 2.468 5.745 1.00 0.26 C ATOM 1584 C MET A 59 -14.134 2.476 7.253 1.00 0.27 C ATOM 1585 O MET A 59 -13.266 3.211 7.721 1.00 0.33 O ATOM 1586 CB MET A 59 -15.550 3.423 5.380 1.00 0.36 C ATOM 1587 CG MET A 59 -15.777 4.560 6.370 1.00 0.34 C ATOM 1588 SD MET A 59 -16.432 6.046 5.602 1.00 0.72 S ATOM 1589 CE MET A 59 -14.914 6.768 5.013 1.00 0.32 C ATOM 0 H MET A 59 -15.583 1.058 4.734 1.00 0.21 H new ATOM 0 HA MET A 59 -13.490 2.813 5.265 1.00 0.26 H new ATOM 0 HB2 MET A 59 -15.348 3.851 4.398 1.00 0.36 H new ATOM 0 HB3 MET A 59 -16.471 2.847 5.293 1.00 0.36 H new ATOM 0 HG2 MET A 59 -16.466 4.226 7.146 1.00 0.34 H new ATOM 0 HG3 MET A 59 -14.834 4.798 6.862 1.00 0.34 H new ATOM 0 HE1 MET A 59 -15.079 7.213 4.032 1.00 0.32 H new ATOM 0 HE2 MET A 59 -14.583 7.538 5.710 1.00 0.32 H new ATOM 0 HE3 MET A 59 -14.149 5.995 4.937 1.00 0.32 H new ATOM 1599 N SER A 60 -14.860 1.655 7.999 1.00 0.28 N ATOM 1600 CA SER A 60 -14.665 1.547 9.443 1.00 0.35 C ATOM 1601 C SER A 60 -13.255 1.071 9.768 1.00 0.32 C ATOM 1602 O SER A 60 -12.567 1.645 10.610 1.00 0.36 O ATOM 1603 CB SER A 60 -15.657 0.549 10.018 1.00 0.41 C ATOM 1604 OG SER A 60 -15.603 0.506 11.433 1.00 0.64 O ATOM 0 H SER A 60 -15.593 1.050 7.628 1.00 0.28 H new ATOM 0 HA SER A 60 -14.819 2.534 9.880 1.00 0.35 H new ATOM 0 HB2 SER A 60 -16.665 0.816 9.701 1.00 0.41 H new ATOM 0 HB3 SER A 60 -15.448 -0.443 9.616 1.00 0.41 H new ATOM 0 HG SER A 60 -16.255 -0.145 11.766 1.00 0.64 H new ATOM 1610 N ASN A 61 -12.838 0.014 9.085 1.00 0.30 N ATOM 1611 CA ASN A 61 -11.538 -0.595 9.325 1.00 0.31 C ATOM 1612 C ASN A 61 -10.459 0.309 8.786 1.00 0.31 C ATOM 1613 O ASN A 61 -9.387 0.455 9.373 1.00 0.39 O ATOM 1614 CB ASN A 61 -11.456 -1.951 8.645 1.00 0.34 C ATOM 1615 CG ASN A 61 -12.177 -3.046 9.396 1.00 0.43 C ATOM 1616 OD1 ASN A 61 -12.334 -2.987 10.612 1.00 0.95 O ATOM 1617 ND2 ASN A 61 -12.613 -4.068 8.674 1.00 0.57 N ATOM 0 H ASN A 61 -13.386 -0.442 8.355 1.00 0.30 H new ATOM 0 HA ASN A 61 -11.402 -0.734 10.397 1.00 0.31 H new ATOM 0 HB2 ASN A 61 -11.876 -1.872 7.642 1.00 0.34 H new ATOM 0 HB3 ASN A 61 -10.408 -2.229 8.531 1.00 0.34 H new ATOM 0 HD21 ASN A 61 -13.098 -4.842 9.127 1.00 0.57 H new ATOM 0 HD22 ASN A 61 -12.463 -4.080 7.665 1.00 0.57 H new ATOM 1624 N LEU A 62 -10.774 0.897 7.651 1.00 0.30 N ATOM 1625 CA LEU A 62 -9.919 1.882 7.014 1.00 0.33 C ATOM 1626 C LEU A 62 -9.574 3.016 7.962 1.00 0.33 C ATOM 1627 O LEU A 62 -8.405 3.290 8.227 1.00 0.38 O ATOM 1628 CB LEU A 62 -10.621 2.455 5.789 1.00 0.37 C ATOM 1629 CG LEU A 62 -9.755 2.497 4.553 1.00 0.24 C ATOM 1630 CD1 LEU A 62 -9.179 1.127 4.316 1.00 0.52 C ATOM 1631 CD2 LEU A 62 -10.548 2.952 3.345 1.00 0.28 C ATOM 0 H LEU A 62 -11.635 0.705 7.140 1.00 0.30 H new ATOM 0 HA LEU A 62 -8.995 1.383 6.722 1.00 0.33 H new ATOM 0 HB2 LEU A 62 -11.509 1.859 5.579 1.00 0.37 H new ATOM 0 HB3 LEU A 62 -10.962 3.465 6.017 1.00 0.37 H new ATOM 0 HG LEU A 62 -8.950 3.216 4.706 1.00 0.24 H new ATOM 0 HD11 LEU A 62 -8.551 1.145 3.425 1.00 0.52 H new ATOM 0 HD12 LEU A 62 -8.579 0.831 5.177 1.00 0.52 H new ATOM 0 HD13 LEU A 62 -9.989 0.411 4.175 1.00 0.52 H new ATOM 0 HD21 LEU A 62 -9.898 2.973 2.470 1.00 0.28 H new ATOM 0 HD22 LEU A 62 -11.372 2.260 3.169 1.00 0.28 H new ATOM 0 HD23 LEU A 62 -10.945 3.951 3.526 1.00 0.28 H new ATOM 1643 N ASP A 63 -10.608 3.671 8.461 1.00 0.37 N ATOM 1644 CA ASP A 63 -10.440 4.806 9.343 1.00 0.43 C ATOM 1645 C ASP A 63 -9.962 4.328 10.710 1.00 0.38 C ATOM 1646 O ASP A 63 -10.750 3.854 11.533 1.00 0.43 O ATOM 1647 CB ASP A 63 -11.758 5.571 9.464 1.00 0.56 C ATOM 1648 CG ASP A 63 -11.574 6.955 10.035 1.00 0.85 C ATOM 1649 OD1 ASP A 63 -11.521 7.088 11.262 1.00 1.35 O ATOM 1650 OD2 ASP A 63 -11.506 7.924 9.257 1.00 1.56 O ATOM 0 H ASP A 63 -11.580 3.431 8.266 1.00 0.37 H new ATOM 0 HA ASP A 63 -9.690 5.480 8.930 1.00 0.43 H new ATOM 0 HB2 ASP A 63 -12.222 5.646 8.481 1.00 0.56 H new ATOM 0 HB3 ASP A 63 -12.444 5.009 10.098 1.00 0.56 H new ATOM 1655 N SER A 64 -8.664 4.440 10.936 1.00 0.37 N ATOM 1656 CA SER A 64 -8.041 3.897 12.128 1.00 0.41 C ATOM 1657 C SER A 64 -8.198 4.860 13.299 1.00 0.52 C ATOM 1658 O SER A 64 -8.140 4.462 14.465 1.00 0.64 O ATOM 1659 CB SER A 64 -6.558 3.621 11.858 1.00 0.45 C ATOM 1660 OG SER A 64 -5.816 4.827 11.762 1.00 0.58 O ATOM 0 H SER A 64 -8.017 4.907 10.301 1.00 0.37 H new ATOM 0 HA SER A 64 -8.534 2.961 12.388 1.00 0.41 H new ATOM 0 HB2 SER A 64 -6.150 3.004 12.658 1.00 0.45 H new ATOM 0 HB3 SER A 64 -6.454 3.054 10.933 1.00 0.45 H new ATOM 0 HG SER A 64 -6.409 5.554 11.480 1.00 0.58 H new ATOM 1666 N ASN A 65 -8.400 6.131 12.978 1.00 0.60 N ATOM 1667 CA ASN A 65 -8.568 7.161 13.994 1.00 0.83 C ATOM 1668 C ASN A 65 -10.016 7.204 14.476 1.00 0.89 C ATOM 1669 O ASN A 65 -10.342 7.910 15.434 1.00 1.10 O ATOM 1670 CB ASN A 65 -8.128 8.529 13.456 1.00 0.95 C ATOM 1671 CG ASN A 65 -9.044 9.068 12.374 1.00 0.99 C ATOM 1672 OD1 ASN A 65 -9.983 9.808 12.660 1.00 1.52 O ATOM 1673 ND2 ASN A 65 -8.781 8.703 11.128 1.00 1.44 N ATOM 0 H ASN A 65 -8.452 6.474 12.019 1.00 0.60 H new ATOM 0 HA ASN A 65 -7.933 6.914 14.845 1.00 0.83 H new ATOM 0 HB2 ASN A 65 -8.091 9.242 14.280 1.00 0.95 H new ATOM 0 HB3 ASN A 65 -7.116 8.448 13.059 1.00 0.95 H new ATOM 0 HD21 ASN A 65 -9.368 9.038 10.364 1.00 1.44 H new ATOM 0 HD22 ASN A 65 -7.992 8.087 10.933 1.00 1.44 H new ATOM 1680 N ARG A 66 -10.874 6.450 13.789 1.00 0.79 N ATOM 1681 CA ARG A 66 -12.261 6.228 14.202 1.00 0.98 C ATOM 1682 C ARG A 66 -13.085 7.516 14.152 1.00 1.05 C ATOM 1683 O ARG A 66 -13.664 7.935 15.154 1.00 1.34 O ATOM 1684 CB ARG A 66 -12.310 5.613 15.608 1.00 1.26 C ATOM 1685 CG ARG A 66 -11.552 4.296 15.727 1.00 1.46 C ATOM 1686 CD ARG A 66 -12.128 3.230 14.809 1.00 1.25 C ATOM 1687 NE ARG A 66 -13.513 2.914 15.151 1.00 1.91 N ATOM 1688 CZ ARG A 66 -14.363 2.289 14.342 1.00 2.60 C ATOM 1689 NH1 ARG A 66 -13.971 1.885 13.140 1.00 2.85 N ATOM 1690 NH2 ARG A 66 -15.606 2.063 14.744 1.00 3.45 N ATOM 0 H ARG A 66 -10.625 5.972 12.923 1.00 0.79 H new ATOM 0 HA ARG A 66 -12.705 5.529 13.493 1.00 0.98 H new ATOM 0 HB2 ARG A 66 -11.896 6.326 16.321 1.00 1.26 H new ATOM 0 HB3 ARG A 66 -13.351 5.450 15.888 1.00 1.26 H new ATOM 0 HG2 ARG A 66 -10.502 4.457 15.483 1.00 1.46 H new ATOM 0 HG3 ARG A 66 -11.590 3.947 16.759 1.00 1.46 H new ATOM 0 HD2 ARG A 66 -12.077 3.573 13.776 1.00 1.25 H new ATOM 0 HD3 ARG A 66 -11.522 2.327 14.875 1.00 1.25 H new ATOM 0 HE ARG A 66 -13.850 3.192 16.073 1.00 1.91 H new ATOM 0 HH11 ARG A 66 -13.013 2.054 12.833 1.00 2.85 H new ATOM 0 HH12 ARG A 66 -14.628 1.406 12.524 1.00 2.85 H new ATOM 0 HH21 ARG A 66 -15.906 2.368 15.670 1.00 3.45 H new ATOM 0 HH22 ARG A 66 -16.262 1.584 14.127 1.00 3.45 H new ATOM 1704 N ASP A 67 -13.124 8.149 12.985 1.00 0.86 N ATOM 1705 CA ASP A 67 -13.939 9.344 12.792 1.00 1.00 C ATOM 1706 C ASP A 67 -14.774 9.223 11.520 1.00 0.88 C ATOM 1707 O ASP A 67 -15.637 10.059 11.250 1.00 0.94 O ATOM 1708 CB ASP A 67 -13.056 10.592 12.740 1.00 1.13 C ATOM 1709 CG ASP A 67 -13.856 11.880 12.732 1.00 1.57 C ATOM 1710 OD1 ASP A 67 -14.480 12.204 13.763 1.00 2.02 O ATOM 1711 OD2 ASP A 67 -13.847 12.589 11.704 1.00 2.08 O ATOM 0 H ASP A 67 -12.602 7.856 12.159 1.00 0.86 H new ATOM 0 HA ASP A 67 -14.618 9.439 13.640 1.00 1.00 H new ATOM 0 HB2 ASP A 67 -12.385 10.592 13.599 1.00 1.13 H new ATOM 0 HB3 ASP A 67 -12.432 10.552 11.847 1.00 1.13 H new ATOM 1716 N ASN A 68 -14.505 8.168 10.749 1.00 0.77 N ATOM 1717 CA ASN A 68 -15.250 7.863 9.519 1.00 0.74 C ATOM 1718 C ASN A 68 -14.957 8.885 8.421 1.00 0.65 C ATOM 1719 O ASN A 68 -15.854 9.297 7.682 1.00 0.66 O ATOM 1720 CB ASN A 68 -16.764 7.785 9.777 1.00 0.92 C ATOM 1721 CG ASN A 68 -17.170 6.609 10.651 1.00 1.13 C ATOM 1722 OD1 ASN A 68 -16.420 6.174 11.525 1.00 1.54 O ATOM 1723 ND2 ASN A 68 -18.367 6.091 10.421 1.00 1.75 N ATOM 0 H ASN A 68 -13.764 7.498 10.957 1.00 0.77 H new ATOM 0 HA ASN A 68 -14.911 6.884 9.180 1.00 0.74 H new ATOM 0 HB2 ASN A 68 -17.092 8.710 10.251 1.00 0.92 H new ATOM 0 HB3 ASN A 68 -17.284 7.714 8.822 1.00 0.92 H new ATOM 0 HD21 ASN A 68 -18.697 5.303 10.978 1.00 1.75 H new ATOM 0 HD22 ASN A 68 -18.959 6.480 9.687 1.00 1.75 H new ATOM 1730 N GLU A 69 -13.695 9.271 8.311 1.00 0.64 N ATOM 1731 CA GLU A 69 -13.233 10.156 7.248 1.00 0.63 C ATOM 1732 C GLU A 69 -11.815 9.775 6.851 1.00 0.54 C ATOM 1733 O GLU A 69 -10.851 10.170 7.506 1.00 0.65 O ATOM 1734 CB GLU A 69 -13.265 11.622 7.686 1.00 0.82 C ATOM 1735 CG GLU A 69 -14.625 12.285 7.554 1.00 0.95 C ATOM 1736 CD GLU A 69 -14.560 13.773 7.811 1.00 1.13 C ATOM 1737 OE1 GLU A 69 -13.797 14.470 7.104 1.00 1.59 O ATOM 1738 OE2 GLU A 69 -15.251 14.254 8.731 1.00 1.65 O ATOM 0 H GLU A 69 -12.960 8.980 8.956 1.00 0.64 H new ATOM 0 HA GLU A 69 -13.904 10.042 6.397 1.00 0.63 H new ATOM 0 HB2 GLU A 69 -12.942 11.685 8.725 1.00 0.82 H new ATOM 0 HB3 GLU A 69 -12.542 12.182 7.093 1.00 0.82 H new ATOM 0 HG2 GLU A 69 -15.019 12.107 6.553 1.00 0.95 H new ATOM 0 HG3 GLU A 69 -15.321 11.826 8.256 1.00 0.95 H new ATOM 1745 N VAL A 70 -11.687 9.023 5.771 1.00 0.40 N ATOM 1746 CA VAL A 70 -10.396 8.471 5.395 1.00 0.31 C ATOM 1747 C VAL A 70 -9.446 9.541 4.880 1.00 0.33 C ATOM 1748 O VAL A 70 -9.617 10.084 3.784 1.00 0.39 O ATOM 1749 CB VAL A 70 -10.530 7.354 4.342 1.00 0.28 C ATOM 1750 CG1 VAL A 70 -9.164 6.837 3.923 1.00 0.32 C ATOM 1751 CG2 VAL A 70 -11.374 6.217 4.883 1.00 0.29 C ATOM 0 H VAL A 70 -12.454 8.782 5.143 1.00 0.40 H new ATOM 0 HA VAL A 70 -9.978 8.043 6.306 1.00 0.31 H new ATOM 0 HB VAL A 70 -11.023 7.773 3.465 1.00 0.28 H new ATOM 0 HG11 VAL A 70 -9.285 6.049 3.179 1.00 0.32 H new ATOM 0 HG12 VAL A 70 -8.582 7.653 3.495 1.00 0.32 H new ATOM 0 HG13 VAL A 70 -8.644 6.437 4.793 1.00 0.32 H new ATOM 0 HG21 VAL A 70 -11.459 5.436 4.128 1.00 0.29 H new ATOM 0 HG22 VAL A 70 -10.903 5.808 5.777 1.00 0.29 H new ATOM 0 HG23 VAL A 70 -12.367 6.589 5.134 1.00 0.29 H new ATOM 1761 N ASP A 71 -8.471 9.861 5.714 1.00 0.36 N ATOM 1762 CA ASP A 71 -7.320 10.648 5.308 1.00 0.40 C ATOM 1763 C ASP A 71 -6.425 9.761 4.450 1.00 0.32 C ATOM 1764 O ASP A 71 -6.607 8.545 4.443 1.00 0.29 O ATOM 1765 CB ASP A 71 -6.559 11.119 6.555 1.00 0.49 C ATOM 1766 CG ASP A 71 -5.387 12.029 6.243 1.00 0.61 C ATOM 1767 OD1 ASP A 71 -4.288 11.520 5.929 1.00 1.32 O ATOM 1768 OD2 ASP A 71 -5.555 13.260 6.327 1.00 1.22 O ATOM 0 H ASP A 71 -8.456 9.581 6.695 1.00 0.36 H new ATOM 0 HA ASP A 71 -7.632 11.525 4.740 1.00 0.40 H new ATOM 0 HB2 ASP A 71 -7.250 11.643 7.215 1.00 0.49 H new ATOM 0 HB3 ASP A 71 -6.197 10.247 7.100 1.00 0.49 H new ATOM 1773 N PHE A 72 -5.467 10.335 3.736 1.00 0.36 N ATOM 1774 CA PHE A 72 -4.533 9.519 2.970 1.00 0.36 C ATOM 1775 C PHE A 72 -3.821 8.534 3.893 1.00 0.30 C ATOM 1776 O PHE A 72 -3.463 7.426 3.491 1.00 0.39 O ATOM 1777 CB PHE A 72 -3.502 10.369 2.237 1.00 0.51 C ATOM 1778 CG PHE A 72 -2.710 9.546 1.273 1.00 0.58 C ATOM 1779 CD1 PHE A 72 -3.160 9.357 -0.017 1.00 1.26 C ATOM 1780 CD2 PHE A 72 -1.545 8.923 1.670 1.00 1.38 C ATOM 1781 CE1 PHE A 72 -2.462 8.570 -0.902 1.00 1.29 C ATOM 1782 CE2 PHE A 72 -0.841 8.135 0.792 1.00 1.46 C ATOM 1783 CZ PHE A 72 -1.293 7.955 -0.490 1.00 0.78 C ATOM 0 H PHE A 72 -5.316 11.342 3.670 1.00 0.36 H new ATOM 0 HA PHE A 72 -5.111 8.976 2.223 1.00 0.36 H new ATOM 0 HB2 PHE A 72 -4.005 11.175 1.703 1.00 0.51 H new ATOM 0 HB3 PHE A 72 -2.831 10.834 2.959 1.00 0.51 H new ATOM 0 HD1 PHE A 72 -4.074 9.834 -0.337 1.00 1.26 H new ATOM 0 HD2 PHE A 72 -1.183 9.056 2.679 1.00 1.38 H new ATOM 0 HE1 PHE A 72 -2.823 8.433 -1.911 1.00 1.29 H new ATOM 0 HE2 PHE A 72 0.072 7.655 1.113 1.00 1.46 H new ATOM 0 HZ PHE A 72 -0.737 7.334 -1.177 1.00 0.78 H new ATOM 1793 N GLN A 73 -3.629 8.948 5.135 1.00 0.30 N ATOM 1794 CA GLN A 73 -3.068 8.092 6.163 1.00 0.41 C ATOM 1795 C GLN A 73 -3.862 6.794 6.280 1.00 0.38 C ATOM 1796 O GLN A 73 -3.290 5.707 6.306 1.00 0.44 O ATOM 1797 CB GLN A 73 -3.063 8.821 7.507 1.00 0.61 C ATOM 1798 CG GLN A 73 -2.479 8.000 8.641 1.00 0.85 C ATOM 1799 CD GLN A 73 -1.027 7.648 8.419 1.00 0.83 C ATOM 1800 OE1 GLN A 73 -0.132 8.371 8.847 1.00 1.20 O ATOM 1801 NE2 GLN A 73 -0.784 6.543 7.738 1.00 1.48 N ATOM 0 H GLN A 73 -3.859 9.888 5.457 1.00 0.30 H new ATOM 0 HA GLN A 73 -2.044 7.847 5.883 1.00 0.41 H new ATOM 0 HB2 GLN A 73 -2.493 9.745 7.408 1.00 0.61 H new ATOM 0 HB3 GLN A 73 -4.085 9.102 7.762 1.00 0.61 H new ATOM 0 HG2 GLN A 73 -2.575 8.556 9.574 1.00 0.85 H new ATOM 0 HG3 GLN A 73 -3.057 7.083 8.755 1.00 0.85 H new ATOM 0 HE21 GLN A 73 -1.558 5.971 7.401 1.00 1.48 H new ATOM 0 HE22 GLN A 73 0.178 6.261 7.549 1.00 1.48 H new ATOM 1810 N GLU A 74 -5.184 6.911 6.320 1.00 0.34 N ATOM 1811 CA GLU A 74 -6.047 5.744 6.465 1.00 0.37 C ATOM 1812 C GLU A 74 -6.230 5.084 5.101 1.00 0.32 C ATOM 1813 O GLU A 74 -6.779 3.992 4.980 1.00 0.36 O ATOM 1814 CB GLU A 74 -7.415 6.152 7.026 1.00 0.44 C ATOM 1815 CG GLU A 74 -7.362 7.278 8.052 1.00 0.52 C ATOM 1816 CD GLU A 74 -6.582 6.929 9.304 1.00 0.58 C ATOM 1817 OE1 GLU A 74 -5.341 7.030 9.288 1.00 1.29 O ATOM 1818 OE2 GLU A 74 -7.210 6.579 10.323 1.00 1.16 O ATOM 0 H GLU A 74 -5.681 7.799 6.254 1.00 0.34 H new ATOM 0 HA GLU A 74 -5.582 5.043 7.159 1.00 0.37 H new ATOM 0 HB2 GLU A 74 -8.056 6.459 6.200 1.00 0.44 H new ATOM 0 HB3 GLU A 74 -7.881 5.280 7.485 1.00 0.44 H new ATOM 0 HG2 GLU A 74 -6.914 8.157 7.590 1.00 0.52 H new ATOM 0 HG3 GLU A 74 -8.380 7.549 8.333 1.00 0.52 H new ATOM 1825 N TYR A 75 -5.751 5.770 4.076 1.00 0.26 N ATOM 1826 CA TYR A 75 -5.904 5.323 2.707 1.00 0.25 C ATOM 1827 C TYR A 75 -4.726 4.441 2.281 1.00 0.24 C ATOM 1828 O TYR A 75 -4.893 3.517 1.488 1.00 0.28 O ATOM 1829 CB TYR A 75 -6.041 6.541 1.786 1.00 0.25 C ATOM 1830 CG TYR A 75 -6.484 6.203 0.383 1.00 0.26 C ATOM 1831 CD1 TYR A 75 -5.626 5.560 -0.498 1.00 1.17 C ATOM 1832 CD2 TYR A 75 -7.766 6.518 -0.052 1.00 1.27 C ATOM 1833 CE1 TYR A 75 -6.025 5.235 -1.777 1.00 1.17 C ATOM 1834 CE2 TYR A 75 -8.173 6.191 -1.334 1.00 1.30 C ATOM 1835 CZ TYR A 75 -7.296 5.549 -2.189 1.00 0.38 C ATOM 1836 OH TYR A 75 -7.689 5.220 -3.462 1.00 0.47 O ATOM 0 H TYR A 75 -5.246 6.651 4.173 1.00 0.26 H new ATOM 0 HA TYR A 75 -6.807 4.717 2.631 1.00 0.25 H new ATOM 0 HB2 TYR A 75 -6.757 7.236 2.224 1.00 0.25 H new ATOM 0 HB3 TYR A 75 -5.082 7.058 1.739 1.00 0.25 H new ATOM 0 HD1 TYR A 75 -4.626 5.309 -0.175 1.00 1.17 H new ATOM 0 HD2 TYR A 75 -8.450 7.022 0.615 1.00 1.27 H new ATOM 0 HE1 TYR A 75 -5.343 4.737 -2.450 1.00 1.17 H new ATOM 0 HE2 TYR A 75 -9.171 6.436 -1.665 1.00 1.30 H new ATOM 0 HH TYR A 75 -7.212 4.416 -3.754 1.00 0.47 H new ATOM 1846 N CYS A 76 -3.535 4.715 2.806 1.00 0.22 N ATOM 1847 CA CYS A 76 -2.366 3.897 2.483 1.00 0.21 C ATOM 1848 C CYS A 76 -2.596 2.467 2.936 1.00 0.15 C ATOM 1849 O CYS A 76 -2.272 1.510 2.230 1.00 0.17 O ATOM 1850 CB CYS A 76 -1.093 4.448 3.145 1.00 0.27 C ATOM 1851 SG CYS A 76 -1.038 4.295 4.944 1.00 1.65 S ATOM 0 H CYS A 76 -3.353 5.486 3.449 1.00 0.22 H new ATOM 0 HA CYS A 76 -2.227 3.925 1.402 1.00 0.21 H new ATOM 0 HB2 CYS A 76 -0.231 3.930 2.725 1.00 0.27 H new ATOM 0 HB3 CYS A 76 -0.992 5.501 2.882 1.00 0.27 H new ATOM 0 HG CYS A 76 -2.178 4.667 5.446 1.00 1.65 H new ATOM 1857 N VAL A 77 -3.188 2.339 4.110 1.00 0.16 N ATOM 1858 CA VAL A 77 -3.432 1.043 4.698 1.00 0.17 C ATOM 1859 C VAL A 77 -4.593 0.344 4.018 1.00 0.17 C ATOM 1860 O VAL A 77 -4.754 -0.862 4.154 1.00 0.19 O ATOM 1861 CB VAL A 77 -3.682 1.155 6.208 1.00 0.20 C ATOM 1862 CG1 VAL A 77 -2.445 1.698 6.889 1.00 0.23 C ATOM 1863 CG2 VAL A 77 -4.883 2.041 6.506 1.00 0.19 C ATOM 0 H VAL A 77 -3.509 3.125 4.675 1.00 0.16 H new ATOM 0 HA VAL A 77 -2.536 0.442 4.547 1.00 0.17 H new ATOM 0 HB VAL A 77 -3.901 0.160 6.595 1.00 0.20 H new ATOM 0 HG11 VAL A 77 -2.625 1.777 7.961 1.00 0.23 H new ATOM 0 HG12 VAL A 77 -1.606 1.025 6.710 1.00 0.23 H new ATOM 0 HG13 VAL A 77 -2.211 2.684 6.487 1.00 0.23 H new ATOM 0 HG21 VAL A 77 -5.033 2.100 7.584 1.00 0.19 H new ATOM 0 HG22 VAL A 77 -4.705 3.041 6.109 1.00 0.19 H new ATOM 0 HG23 VAL A 77 -5.772 1.618 6.038 1.00 0.19 H new ATOM 1873 N PHE A 78 -5.392 1.108 3.279 1.00 0.20 N ATOM 1874 CA PHE A 78 -6.428 0.537 2.449 1.00 0.22 C ATOM 1875 C PHE A 78 -5.806 -0.480 1.523 1.00 0.19 C ATOM 1876 O PHE A 78 -5.974 -1.678 1.698 1.00 0.18 O ATOM 1877 CB PHE A 78 -7.129 1.651 1.647 1.00 0.30 C ATOM 1878 CG PHE A 78 -8.188 1.196 0.692 1.00 0.22 C ATOM 1879 CD1 PHE A 78 -9.152 0.278 1.061 1.00 1.19 C ATOM 1880 CD2 PHE A 78 -8.215 1.718 -0.587 1.00 1.21 C ATOM 1881 CE1 PHE A 78 -10.125 -0.113 0.165 1.00 1.21 C ATOM 1882 CE2 PHE A 78 -9.178 1.334 -1.486 1.00 1.20 C ATOM 1883 CZ PHE A 78 -10.138 0.415 -1.113 1.00 0.22 C ATOM 0 H PHE A 78 -5.335 2.126 3.243 1.00 0.20 H new ATOM 0 HA PHE A 78 -7.176 0.044 3.070 1.00 0.22 H new ATOM 0 HB2 PHE A 78 -7.577 2.352 2.351 1.00 0.30 H new ATOM 0 HB3 PHE A 78 -6.373 2.201 1.087 1.00 0.30 H new ATOM 0 HD1 PHE A 78 -9.144 -0.137 2.058 1.00 1.19 H new ATOM 0 HD2 PHE A 78 -7.467 2.439 -0.884 1.00 1.21 H new ATOM 0 HE1 PHE A 78 -10.876 -0.831 0.461 1.00 1.21 H new ATOM 0 HE2 PHE A 78 -9.185 1.750 -2.483 1.00 1.20 H new ATOM 0 HZ PHE A 78 -10.897 0.109 -1.817 1.00 0.22 H new ATOM 1893 N LEU A 79 -5.004 0.013 0.607 1.00 0.20 N ATOM 1894 CA LEU A 79 -4.495 -0.794 -0.478 1.00 0.19 C ATOM 1895 C LEU A 79 -3.453 -1.798 -0.032 1.00 0.16 C ATOM 1896 O LEU A 79 -3.518 -2.963 -0.397 1.00 0.18 O ATOM 1897 CB LEU A 79 -3.946 0.123 -1.554 1.00 0.22 C ATOM 1898 CG LEU A 79 -5.021 0.984 -2.183 1.00 0.15 C ATOM 1899 CD1 LEU A 79 -4.452 1.846 -3.291 1.00 0.16 C ATOM 1900 CD2 LEU A 79 -6.140 0.087 -2.681 1.00 0.16 C ATOM 0 H LEU A 79 -4.687 0.982 0.593 1.00 0.20 H new ATOM 0 HA LEU A 79 -5.320 -1.385 -0.875 1.00 0.19 H new ATOM 0 HB2 LEU A 79 -3.177 0.764 -1.123 1.00 0.22 H new ATOM 0 HB3 LEU A 79 -3.465 -0.476 -2.327 1.00 0.22 H new ATOM 0 HG LEU A 79 -5.425 1.668 -1.437 1.00 0.15 H new ATOM 0 HD11 LEU A 79 -5.247 2.453 -3.724 1.00 0.16 H new ATOM 0 HD12 LEU A 79 -3.678 2.497 -2.884 1.00 0.16 H new ATOM 0 HD13 LEU A 79 -4.021 1.209 -4.063 1.00 0.16 H new ATOM 0 HD21 LEU A 79 -6.920 0.697 -3.136 1.00 0.16 H new ATOM 0 HD22 LEU A 79 -5.746 -0.610 -3.421 1.00 0.16 H new ATOM 0 HD23 LEU A 79 -6.558 -0.472 -1.844 1.00 0.16 H new ATOM 1912 N SER A 80 -2.510 -1.372 0.771 1.00 0.15 N ATOM 1913 CA SER A 80 -1.444 -2.262 1.172 1.00 0.15 C ATOM 1914 C SER A 80 -1.985 -3.439 1.977 1.00 0.15 C ATOM 1915 O SER A 80 -1.416 -4.524 1.968 1.00 0.18 O ATOM 1916 CB SER A 80 -0.397 -1.488 1.941 1.00 0.17 C ATOM 1917 OG SER A 80 0.196 -0.514 1.106 1.00 0.23 O ATOM 0 H SER A 80 -2.456 -0.429 1.156 1.00 0.15 H new ATOM 0 HA SER A 80 -0.975 -2.680 0.281 1.00 0.15 H new ATOM 0 HB2 SER A 80 -0.852 -1.008 2.807 1.00 0.17 H new ATOM 0 HB3 SER A 80 0.366 -2.169 2.318 1.00 0.17 H new ATOM 0 HG SER A 80 0.621 -0.954 0.340 1.00 0.23 H new ATOM 1923 N CYS A 81 -3.088 -3.228 2.666 1.00 0.14 N ATOM 1924 CA CYS A 81 -3.740 -4.316 3.363 1.00 0.15 C ATOM 1925 C CYS A 81 -4.614 -5.136 2.421 1.00 0.14 C ATOM 1926 O CYS A 81 -4.947 -6.282 2.721 1.00 0.16 O ATOM 1927 CB CYS A 81 -4.524 -3.785 4.544 1.00 0.17 C ATOM 1928 SG CYS A 81 -3.451 -3.162 5.854 1.00 0.22 S ATOM 0 H CYS A 81 -3.548 -2.322 2.758 1.00 0.14 H new ATOM 0 HA CYS A 81 -2.974 -4.991 3.745 1.00 0.15 H new ATOM 0 HB2 CYS A 81 -5.185 -2.986 4.209 1.00 0.17 H new ATOM 0 HB3 CYS A 81 -5.158 -4.577 4.942 1.00 0.17 H new ATOM 0 HG CYS A 81 -2.384 -2.638 5.328 1.00 0.22 H new ATOM 1934 N ILE A 82 -4.963 -4.571 1.269 1.00 0.13 N ATOM 1935 CA ILE A 82 -5.674 -5.343 0.262 1.00 0.14 C ATOM 1936 C ILE A 82 -4.668 -6.201 -0.499 1.00 0.17 C ATOM 1937 O ILE A 82 -5.047 -7.159 -1.145 1.00 0.21 O ATOM 1938 CB ILE A 82 -6.494 -4.492 -0.743 1.00 0.15 C ATOM 1939 CG1 ILE A 82 -7.282 -3.406 -0.031 1.00 0.15 C ATOM 1940 CG2 ILE A 82 -7.476 -5.376 -1.500 1.00 0.16 C ATOM 1941 CD1 ILE A 82 -8.136 -2.577 -0.961 1.00 0.18 C ATOM 0 H ILE A 82 -4.769 -3.602 1.015 1.00 0.13 H new ATOM 0 HA ILE A 82 -6.403 -5.951 0.797 1.00 0.14 H new ATOM 0 HB ILE A 82 -5.787 -4.031 -1.433 1.00 0.15 H new ATOM 0 HG12 ILE A 82 -7.920 -3.866 0.723 1.00 0.15 H new ATOM 0 HG13 ILE A 82 -6.589 -2.750 0.495 1.00 0.15 H new ATOM 0 HG21 ILE A 82 -8.046 -4.768 -2.202 1.00 0.16 H new ATOM 0 HG22 ILE A 82 -6.928 -6.144 -2.046 1.00 0.16 H new ATOM 0 HG23 ILE A 82 -8.158 -5.850 -0.794 1.00 0.16 H new ATOM 0 HD11 ILE A 82 -8.671 -1.821 -0.387 1.00 0.18 H new ATOM 0 HD12 ILE A 82 -7.501 -2.089 -1.700 1.00 0.18 H new ATOM 0 HD13 ILE A 82 -8.853 -3.222 -1.468 1.00 0.18 H new ATOM 1953 N ALA A 83 -3.382 -5.840 -0.437 1.00 0.18 N ATOM 1954 CA ALA A 83 -2.321 -6.749 -0.864 1.00 0.23 C ATOM 1955 C ALA A 83 -2.466 -8.075 -0.143 1.00 0.20 C ATOM 1956 O ALA A 83 -2.665 -9.121 -0.758 1.00 0.21 O ATOM 1957 CB ALA A 83 -0.955 -6.171 -0.551 1.00 0.30 C ATOM 0 H ALA A 83 -3.056 -4.935 -0.099 1.00 0.18 H new ATOM 0 HA ALA A 83 -2.409 -6.892 -1.941 1.00 0.23 H new ATOM 0 HB1 ALA A 83 -0.182 -6.866 -0.878 1.00 0.30 H new ATOM 0 HB2 ALA A 83 -0.833 -5.222 -1.072 1.00 0.30 H new ATOM 0 HB3 ALA A 83 -0.866 -6.009 0.523 1.00 0.30 H new ATOM 1963 N MET A 84 -2.375 -8.001 1.175 1.00 0.22 N ATOM 1964 CA MET A 84 -2.523 -9.175 2.025 1.00 0.25 C ATOM 1965 C MET A 84 -3.872 -9.831 1.811 1.00 0.24 C ATOM 1966 O MET A 84 -3.980 -11.055 1.752 1.00 0.28 O ATOM 1967 CB MET A 84 -2.366 -8.797 3.494 1.00 0.30 C ATOM 1968 CG MET A 84 -0.956 -8.383 3.869 1.00 0.34 C ATOM 1969 SD MET A 84 -0.850 -7.809 5.569 1.00 0.36 S ATOM 1970 CE MET A 84 -1.877 -6.350 5.474 1.00 0.20 C ATOM 0 H MET A 84 -2.198 -7.135 1.684 1.00 0.22 H new ATOM 0 HA MET A 84 -1.741 -9.883 1.753 1.00 0.25 H new ATOM 0 HB2 MET A 84 -3.049 -7.979 3.725 1.00 0.30 H new ATOM 0 HB3 MET A 84 -2.663 -9.644 4.112 1.00 0.30 H new ATOM 0 HG2 MET A 84 -0.281 -9.228 3.729 1.00 0.34 H new ATOM 0 HG3 MET A 84 -0.620 -7.592 3.198 1.00 0.34 H new ATOM 0 HE1 MET A 84 -1.962 -5.900 6.463 1.00 0.20 H new ATOM 0 HE2 MET A 84 -1.428 -5.633 4.786 1.00 0.20 H new ATOM 0 HE3 MET A 84 -2.868 -6.626 5.114 1.00 0.20 H new ATOM 1980 N MET A 85 -4.901 -9.010 1.684 1.00 0.25 N ATOM 1981 CA MET A 85 -6.243 -9.509 1.470 1.00 0.36 C ATOM 1982 C MET A 85 -6.361 -10.196 0.105 1.00 0.33 C ATOM 1983 O MET A 85 -6.987 -11.252 -0.014 1.00 0.43 O ATOM 1984 CB MET A 85 -7.258 -8.372 1.603 1.00 0.62 C ATOM 1985 CG MET A 85 -8.688 -8.843 1.422 1.00 0.77 C ATOM 1986 SD MET A 85 -9.358 -8.383 -0.181 1.00 0.67 S ATOM 1987 CE MET A 85 -10.045 -6.781 0.219 1.00 0.30 C ATOM 0 H MET A 85 -4.829 -7.993 1.726 1.00 0.25 H new ATOM 0 HA MET A 85 -6.461 -10.255 2.235 1.00 0.36 H new ATOM 0 HB2 MET A 85 -7.153 -7.909 2.584 1.00 0.62 H new ATOM 0 HB3 MET A 85 -7.036 -7.603 0.863 1.00 0.62 H new ATOM 0 HG2 MET A 85 -8.728 -9.927 1.533 1.00 0.77 H new ATOM 0 HG3 MET A 85 -9.311 -8.418 2.209 1.00 0.77 H new ATOM 0 HE1 MET A 85 -10.473 -6.334 -0.678 1.00 0.30 H new ATOM 0 HE2 MET A 85 -10.823 -6.897 0.973 1.00 0.30 H new ATOM 0 HE3 MET A 85 -9.258 -6.134 0.606 1.00 0.30 H new ATOM 1997 N CYS A 86 -5.741 -9.611 -0.920 1.00 0.32 N ATOM 1998 CA CYS A 86 -5.729 -10.193 -2.255 1.00 0.43 C ATOM 1999 C CYS A 86 -4.958 -11.511 -2.271 1.00 0.43 C ATOM 2000 O CYS A 86 -5.084 -12.289 -3.209 1.00 0.58 O ATOM 2001 CB CYS A 86 -5.118 -9.212 -3.262 1.00 0.49 C ATOM 2002 SG CYS A 86 -5.245 -9.734 -4.990 1.00 0.57 S ATOM 0 H CYS A 86 -5.238 -8.727 -0.846 1.00 0.32 H new ATOM 0 HA CYS A 86 -6.761 -10.396 -2.542 1.00 0.43 H new ATOM 0 HB2 CYS A 86 -5.608 -8.245 -3.151 1.00 0.49 H new ATOM 0 HB3 CYS A 86 -4.066 -9.067 -3.016 1.00 0.49 H new ATOM 0 HG CYS A 86 -5.214 -11.032 -5.055 1.00 0.57 H new ATOM 2008 N ASN A 87 -4.150 -11.756 -1.243 1.00 0.36 N ATOM 2009 CA ASN A 87 -3.450 -13.032 -1.122 1.00 0.44 C ATOM 2010 C ASN A 87 -4.427 -14.123 -0.698 1.00 0.47 C ATOM 2011 O ASN A 87 -4.299 -15.276 -1.098 1.00 0.54 O ATOM 2012 CB ASN A 87 -2.290 -12.939 -0.125 1.00 0.54 C ATOM 2013 CG ASN A 87 -1.522 -14.245 -0.004 1.00 0.72 C ATOM 2014 OD1 ASN A 87 -0.604 -14.514 -0.780 1.00 1.43 O ATOM 2015 ND2 ASN A 87 -1.874 -15.056 0.983 1.00 1.23 N ATOM 0 H ASN A 87 -3.965 -11.095 -0.488 1.00 0.36 H new ATOM 0 HA ASN A 87 -3.032 -13.284 -2.096 1.00 0.44 H new ATOM 0 HB2 ASN A 87 -1.609 -12.148 -0.438 1.00 0.54 H new ATOM 0 HB3 ASN A 87 -2.678 -12.657 0.854 1.00 0.54 H new ATOM 0 HD21 ASN A 87 -1.379 -15.937 1.120 1.00 1.23 H new ATOM 0 HD22 ASN A 87 -2.640 -14.799 1.606 1.00 1.23 H new ATOM 2022 N GLU A 88 -5.416 -13.750 0.104 1.00 0.56 N ATOM 2023 CA GLU A 88 -6.473 -14.677 0.488 1.00 0.70 C ATOM 2024 C GLU A 88 -7.452 -14.816 -0.670 1.00 0.73 C ATOM 2025 O GLU A 88 -7.981 -15.894 -0.945 1.00 0.82 O ATOM 2026 CB GLU A 88 -7.202 -14.173 1.735 1.00 0.96 C ATOM 2027 CG GLU A 88 -8.153 -15.193 2.343 1.00 1.81 C ATOM 2028 CD GLU A 88 -7.424 -16.361 2.979 1.00 2.18 C ATOM 2029 OE1 GLU A 88 -6.994 -16.227 4.144 1.00 2.60 O ATOM 2030 OE2 GLU A 88 -7.285 -17.418 2.328 1.00 2.78 O ATOM 0 H GLU A 88 -5.508 -12.815 0.500 1.00 0.56 H new ATOM 0 HA GLU A 88 -6.035 -15.648 0.720 1.00 0.70 H new ATOM 0 HB2 GLU A 88 -6.465 -13.885 2.484 1.00 0.96 H new ATOM 0 HB3 GLU A 88 -7.763 -13.274 1.478 1.00 0.96 H new ATOM 0 HG2 GLU A 88 -8.773 -14.704 3.094 1.00 1.81 H new ATOM 0 HG3 GLU A 88 -8.824 -15.566 1.569 1.00 1.81 H new ATOM 2037 N PHE A 89 -7.660 -13.709 -1.366 1.00 0.78 N ATOM 2038 CA PHE A 89 -8.533 -13.670 -2.530 1.00 0.98 C ATOM 2039 C PHE A 89 -7.770 -14.138 -3.774 1.00 0.94 C ATOM 2040 O PHE A 89 -8.293 -14.120 -4.888 1.00 1.28 O ATOM 2041 CB PHE A 89 -9.067 -12.244 -2.716 1.00 1.19 C ATOM 2042 CG PHE A 89 -10.246 -12.147 -3.638 1.00 1.49 C ATOM 2043 CD1 PHE A 89 -11.462 -12.706 -3.283 1.00 2.09 C ATOM 2044 CD2 PHE A 89 -10.141 -11.491 -4.852 1.00 2.23 C ATOM 2045 CE1 PHE A 89 -12.553 -12.614 -4.124 1.00 2.74 C ATOM 2046 CE2 PHE A 89 -11.228 -11.398 -5.696 1.00 2.94 C ATOM 2047 CZ PHE A 89 -12.436 -11.959 -5.332 1.00 3.02 C ATOM 0 H PHE A 89 -7.229 -12.813 -1.140 1.00 0.78 H new ATOM 0 HA PHE A 89 -9.377 -14.343 -2.380 1.00 0.98 H new ATOM 0 HB2 PHE A 89 -9.347 -11.842 -1.742 1.00 1.19 H new ATOM 0 HB3 PHE A 89 -8.265 -11.615 -3.102 1.00 1.19 H new ATOM 0 HD1 PHE A 89 -11.558 -13.220 -2.338 1.00 2.09 H new ATOM 0 HD2 PHE A 89 -9.199 -11.048 -5.141 1.00 2.23 H new ATOM 0 HE1 PHE A 89 -13.496 -13.054 -3.836 1.00 2.74 H new ATOM 0 HE2 PHE A 89 -11.134 -10.886 -6.642 1.00 2.94 H new ATOM 0 HZ PHE A 89 -13.288 -11.885 -5.992 1.00 3.02 H new ATOM 2057 N PHE A 90 -6.528 -14.562 -3.563 1.00 0.69 N ATOM 2058 CA PHE A 90 -5.664 -15.033 -4.642 1.00 0.84 C ATOM 2059 C PHE A 90 -6.248 -16.299 -5.252 1.00 1.24 C ATOM 2060 O PHE A 90 -6.361 -16.418 -6.473 1.00 1.57 O ATOM 2061 CB PHE A 90 -4.254 -15.294 -4.098 1.00 0.96 C ATOM 2062 CG PHE A 90 -3.134 -15.101 -5.091 1.00 1.08 C ATOM 2063 CD1 PHE A 90 -3.225 -14.150 -6.098 1.00 1.59 C ATOM 2064 CD2 PHE A 90 -1.979 -15.860 -4.996 1.00 1.75 C ATOM 2065 CE1 PHE A 90 -2.187 -13.969 -6.992 1.00 1.81 C ATOM 2066 CE2 PHE A 90 -0.937 -15.680 -5.887 1.00 1.92 C ATOM 2067 CZ PHE A 90 -1.041 -14.731 -6.885 1.00 1.59 C ATOM 0 H PHE A 90 -6.092 -14.589 -2.641 1.00 0.69 H new ATOM 0 HA PHE A 90 -5.601 -14.271 -5.419 1.00 0.84 H new ATOM 0 HB2 PHE A 90 -4.082 -14.633 -3.248 1.00 0.96 H new ATOM 0 HB3 PHE A 90 -4.211 -16.316 -3.721 1.00 0.96 H new ATOM 0 HD1 PHE A 90 -4.116 -13.546 -6.184 1.00 1.59 H new ATOM 0 HD2 PHE A 90 -1.891 -16.602 -4.216 1.00 1.75 H new ATOM 0 HE1 PHE A 90 -2.272 -13.230 -7.775 1.00 1.81 H new ATOM 0 HE2 PHE A 90 -0.043 -16.281 -5.803 1.00 1.92 H new ATOM 0 HZ PHE A 90 -0.227 -14.585 -7.580 1.00 1.59 H new ATOM 2077 N GLU A 91 -6.619 -17.244 -4.396 1.00 1.36 N ATOM 2078 CA GLU A 91 -7.328 -18.434 -4.841 1.00 1.84 C ATOM 2079 C GLU A 91 -8.822 -18.140 -4.931 1.00 1.99 C ATOM 2080 O GLU A 91 -9.574 -18.851 -5.601 1.00 2.44 O ATOM 2081 CB GLU A 91 -7.070 -19.607 -3.895 1.00 2.02 C ATOM 2082 CG GLU A 91 -5.606 -20.018 -3.820 1.00 2.25 C ATOM 2083 CD GLU A 91 -5.030 -20.373 -5.176 1.00 2.76 C ATOM 2084 OE1 GLU A 91 -5.456 -21.394 -5.755 1.00 3.15 O ATOM 2085 OE2 GLU A 91 -4.158 -19.629 -5.673 1.00 3.28 O ATOM 0 H GLU A 91 -6.440 -17.208 -3.392 1.00 1.36 H new ATOM 0 HA GLU A 91 -6.959 -18.712 -5.828 1.00 1.84 H new ATOM 0 HB2 GLU A 91 -7.416 -19.340 -2.896 1.00 2.02 H new ATOM 0 HB3 GLU A 91 -7.663 -20.462 -4.220 1.00 2.02 H new ATOM 0 HG2 GLU A 91 -5.026 -19.204 -3.385 1.00 2.25 H new ATOM 0 HG3 GLU A 91 -5.506 -20.873 -3.152 1.00 2.25 H new ATOM 2092 N GLY A 92 -9.242 -17.086 -4.236 1.00 1.77 N ATOM 2093 CA GLY A 92 -10.608 -16.610 -4.335 1.00 2.10 C ATOM 2094 C GLY A 92 -11.384 -16.763 -3.045 1.00 2.32 C ATOM 2095 O GLY A 92 -12.283 -15.969 -2.756 1.00 2.82 O ATOM 0 H GLY A 92 -8.652 -16.549 -3.600 1.00 1.77 H new ATOM 0 HA2 GLY A 92 -10.600 -15.559 -4.625 1.00 2.10 H new ATOM 0 HA3 GLY A 92 -11.120 -17.156 -5.127 1.00 2.10 H new ATOM 2099 N PHE A 93 -11.040 -17.777 -2.268 1.00 2.16 N ATOM 2100 CA PHE A 93 -11.745 -18.071 -1.037 1.00 2.47 C ATOM 2101 C PHE A 93 -10.863 -18.856 -0.071 1.00 2.93 C ATOM 2102 O PHE A 93 -9.914 -19.519 -0.488 1.00 3.33 O ATOM 2103 CB PHE A 93 -13.019 -18.853 -1.363 1.00 2.75 C ATOM 2104 CG PHE A 93 -12.807 -20.010 -2.307 1.00 3.31 C ATOM 2105 CD1 PHE A 93 -12.212 -21.185 -1.877 1.00 3.95 C ATOM 2106 CD2 PHE A 93 -13.205 -19.912 -3.631 1.00 3.92 C ATOM 2107 CE1 PHE A 93 -12.017 -22.238 -2.748 1.00 4.95 C ATOM 2108 CE2 PHE A 93 -13.012 -20.962 -4.507 1.00 4.93 C ATOM 2109 CZ PHE A 93 -12.417 -22.126 -4.065 1.00 5.37 C ATOM 0 H PHE A 93 -10.270 -18.414 -2.473 1.00 2.16 H new ATOM 0 HA PHE A 93 -12.009 -17.134 -0.548 1.00 2.47 H new ATOM 0 HB2 PHE A 93 -13.449 -19.229 -0.435 1.00 2.75 H new ATOM 0 HB3 PHE A 93 -13.749 -18.171 -1.799 1.00 2.75 H new ATOM 0 HD1 PHE A 93 -11.897 -21.278 -0.848 1.00 3.95 H new ATOM 0 HD2 PHE A 93 -13.672 -19.003 -3.982 1.00 3.92 H new ATOM 0 HE1 PHE A 93 -11.552 -23.149 -2.400 1.00 4.95 H new ATOM 0 HE2 PHE A 93 -13.326 -20.872 -5.536 1.00 4.93 H new ATOM 0 HZ PHE A 93 -12.264 -22.948 -4.748 1.00 5.37 H new ATOM 2119 N PRO A 94 -11.142 -18.762 1.236 1.00 3.52 N ATOM 2120 CA PRO A 94 -10.475 -19.558 2.252 1.00 4.40 C ATOM 2121 C PRO A 94 -11.206 -20.872 2.498 1.00 4.49 C ATOM 2122 O PRO A 94 -11.921 -21.022 3.494 1.00 4.82 O ATOM 2123 CB PRO A 94 -10.525 -18.661 3.499 1.00 5.24 C ATOM 2124 CG PRO A 94 -11.463 -17.532 3.173 1.00 4.98 C ATOM 2125 CD PRO A 94 -12.108 -17.851 1.849 1.00 3.95 C ATOM 0 HA PRO A 94 -9.461 -19.839 1.967 1.00 4.40 H new ATOM 0 HB2 PRO A 94 -10.877 -19.220 4.366 1.00 5.24 H new ATOM 0 HB3 PRO A 94 -9.533 -18.283 3.745 1.00 5.24 H new ATOM 0 HG2 PRO A 94 -12.218 -17.423 3.952 1.00 4.98 H new ATOM 0 HG3 PRO A 94 -10.922 -16.587 3.119 1.00 4.98 H new ATOM 0 HD2 PRO A 94 -13.084 -18.320 1.976 1.00 3.95 H new ATOM 0 HD3 PRO A 94 -12.260 -16.956 1.246 1.00 3.95 H new ATOM 2133 N ASP A 95 -11.016 -21.810 1.577 1.00 4.54 N ATOM 2134 CA ASP A 95 -11.702 -23.105 1.592 1.00 4.97 C ATOM 2135 C ASP A 95 -13.219 -22.939 1.549 1.00 4.96 C ATOM 2136 O ASP A 95 -13.880 -22.789 2.580 1.00 5.41 O ATOM 2137 CB ASP A 95 -11.294 -23.953 2.798 1.00 5.81 C ATOM 2138 CG ASP A 95 -12.004 -25.295 2.827 1.00 6.62 C ATOM 2139 OD1 ASP A 95 -11.868 -26.067 1.852 1.00 7.10 O ATOM 2140 OD2 ASP A 95 -12.699 -25.586 3.826 1.00 7.06 O ATOM 0 H ASP A 95 -10.377 -21.696 0.790 1.00 4.54 H new ATOM 0 HA ASP A 95 -11.391 -23.632 0.690 1.00 4.97 H new ATOM 0 HB2 ASP A 95 -10.216 -24.115 2.777 1.00 5.81 H new ATOM 0 HB3 ASP A 95 -11.516 -23.407 3.715 1.00 5.81 H new ATOM 2145 N LYS A 96 -13.757 -22.951 0.341 1.00 4.87 N ATOM 2146 CA LYS A 96 -15.189 -22.842 0.120 1.00 5.33 C ATOM 2147 C LYS A 96 -15.523 -23.227 -1.311 1.00 5.99 C ATOM 2148 O LYS A 96 -15.359 -22.431 -2.235 1.00 6.19 O ATOM 2149 CB LYS A 96 -15.685 -21.417 0.408 1.00 5.44 C ATOM 2150 CG LYS A 96 -17.155 -21.190 0.065 1.00 6.10 C ATOM 2151 CD LYS A 96 -18.087 -22.095 0.863 1.00 6.48 C ATOM 2152 CE LYS A 96 -18.395 -21.538 2.248 1.00 7.03 C ATOM 2153 NZ LYS A 96 -17.194 -21.487 3.122 1.00 7.33 N ATOM 0 H LYS A 96 -13.211 -23.037 -0.516 1.00 4.87 H new ATOM 0 HA LYS A 96 -15.693 -23.524 0.805 1.00 5.33 H new ATOM 0 HB2 LYS A 96 -15.531 -21.196 1.464 1.00 5.44 H new ATOM 0 HB3 LYS A 96 -15.077 -20.711 -0.157 1.00 5.44 H new ATOM 0 HG2 LYS A 96 -17.413 -20.148 0.257 1.00 6.10 H new ATOM 0 HG3 LYS A 96 -17.308 -21.365 -1.000 1.00 6.10 H new ATOM 0 HD2 LYS A 96 -19.018 -22.228 0.313 1.00 6.48 H new ATOM 0 HD3 LYS A 96 -17.633 -23.081 0.964 1.00 6.48 H new ATOM 0 HE2 LYS A 96 -18.811 -20.535 2.148 1.00 7.03 H new ATOM 0 HE3 LYS A 96 -19.159 -22.154 2.722 1.00 7.03 H new ATOM 0 HZ1 LYS A 96 -17.480 -21.621 4.113 1.00 7.33 H new ATOM 0 HZ2 LYS A 96 -16.533 -22.241 2.847 1.00 7.33 H new ATOM 0 HZ3 LYS A 96 -16.728 -20.563 3.018 1.00 7.33 H new ATOM 2167 N GLN A 97 -15.957 -24.462 -1.496 1.00 6.62 N ATOM 2168 CA GLN A 97 -16.377 -24.919 -2.806 1.00 7.47 C ATOM 2169 C GLN A 97 -17.752 -24.339 -3.114 1.00 8.21 C ATOM 2170 O GLN A 97 -18.709 -24.592 -2.382 1.00 8.51 O ATOM 2171 CB GLN A 97 -16.400 -26.449 -2.857 1.00 8.07 C ATOM 2172 CG GLN A 97 -16.494 -27.011 -4.266 1.00 8.68 C ATOM 2173 CD GLN A 97 -16.423 -28.526 -4.305 1.00 9.30 C ATOM 2174 OE1 GLN A 97 -15.737 -29.121 -3.340 1.00 9.68 O flip ATOM 2175 NE2 GLN A 97 -16.986 -29.163 -5.196 1.00 9.64 N flip ATOM 0 H GLN A 97 -16.027 -25.162 -0.758 1.00 6.62 H new ATOM 0 HA GLN A 97 -15.669 -24.577 -3.560 1.00 7.47 H new ATOM 0 HB2 GLN A 97 -15.498 -26.833 -2.381 1.00 8.07 H new ATOM 0 HB3 GLN A 97 -17.247 -26.811 -2.274 1.00 8.07 H new ATOM 0 HG2 GLN A 97 -17.430 -26.685 -4.720 1.00 8.68 H new ATOM 0 HG3 GLN A 97 -15.686 -26.599 -4.870 1.00 8.68 H new ATOM 0 HE21 GLN A 97 -17.506 -28.672 -5.924 1.00 9.64 H new ATOM 0 HE22 GLN A 97 -16.933 -30.182 -5.206 1.00 9.64 H new ATOM 2184 N PRO A 98 -17.858 -23.537 -4.187 1.00 8.78 N ATOM 2185 CA PRO A 98 -19.079 -22.780 -4.522 1.00 9.71 C ATOM 2186 C PRO A 98 -20.333 -23.644 -4.626 1.00 10.51 C ATOM 2187 O PRO A 98 -21.445 -23.160 -4.408 1.00 10.91 O ATOM 2188 CB PRO A 98 -18.749 -22.158 -5.880 1.00 10.26 C ATOM 2189 CG PRO A 98 -17.265 -22.082 -5.911 1.00 9.76 C ATOM 2190 CD PRO A 98 -16.781 -23.291 -5.164 1.00 8.82 C ATOM 0 HA PRO A 98 -19.317 -22.059 -3.740 1.00 9.71 H new ATOM 0 HB2 PRO A 98 -19.131 -22.768 -6.698 1.00 10.26 H new ATOM 0 HB3 PRO A 98 -19.198 -21.170 -5.982 1.00 10.26 H new ATOM 0 HG2 PRO A 98 -16.894 -22.081 -6.936 1.00 9.76 H new ATOM 0 HG3 PRO A 98 -16.910 -21.164 -5.442 1.00 9.76 H new ATOM 0 HD2 PRO A 98 -16.637 -24.144 -5.828 1.00 8.82 H new ATOM 0 HD3 PRO A 98 -15.826 -23.105 -4.672 1.00 8.82 H new ATOM 2198 N ARG A 99 -20.163 -24.919 -4.942 1.00 10.91 N ATOM 2199 CA ARG A 99 -21.298 -25.816 -5.091 1.00 11.80 C ATOM 2200 C ARG A 99 -21.810 -26.293 -3.736 1.00 12.49 C ATOM 2201 O ARG A 99 -21.428 -27.365 -3.265 1.00 13.03 O ATOM 2202 CB ARG A 99 -20.933 -27.034 -5.937 1.00 12.07 C ATOM 2203 CG ARG A 99 -20.472 -26.717 -7.348 1.00 12.32 C ATOM 2204 CD ARG A 99 -20.304 -27.993 -8.161 1.00 12.98 C ATOM 2205 NE ARG A 99 -21.586 -28.661 -8.405 1.00 13.45 N ATOM 2206 CZ ARG A 99 -22.033 -29.715 -7.714 1.00 14.07 C ATOM 2207 NH1 ARG A 99 -21.316 -30.223 -6.719 1.00 14.29 N ATOM 2208 NH2 ARG A 99 -23.203 -30.256 -8.018 1.00 14.62 N ATOM 0 H ARG A 99 -19.254 -25.354 -5.100 1.00 10.91 H new ATOM 0 HA ARG A 99 -22.083 -25.250 -5.593 1.00 11.80 H new ATOM 0 HB2 ARG A 99 -20.144 -27.588 -5.428 1.00 12.07 H new ATOM 0 HB3 ARG A 99 -21.800 -27.692 -5.993 1.00 12.07 H new ATOM 0 HG2 ARG A 99 -21.196 -26.064 -7.834 1.00 12.32 H new ATOM 0 HG3 ARG A 99 -19.527 -26.175 -7.314 1.00 12.32 H new ATOM 0 HD2 ARG A 99 -19.831 -27.756 -9.114 1.00 12.98 H new ATOM 0 HD3 ARG A 99 -19.635 -28.673 -7.634 1.00 12.98 H new ATOM 0 HE ARG A 99 -22.177 -28.297 -9.152 1.00 13.45 H new ATOM 0 HH11 ARG A 99 -20.416 -29.809 -6.476 1.00 14.29 H new ATOM 0 HH12 ARG A 99 -21.665 -31.027 -6.198 1.00 14.29 H new ATOM 0 HH21 ARG A 99 -23.762 -29.869 -8.778 1.00 14.62 H new ATOM 0 HH22 ARG A 99 -23.545 -31.060 -7.492 1.00 14.62 H new ATOM 2222 N LYS A 100 -22.651 -25.497 -3.095 1.00 12.64 N ATOM 2223 CA LYS A 100 -23.310 -25.938 -1.876 1.00 13.44 C ATOM 2224 C LYS A 100 -24.634 -26.623 -2.220 1.00 14.06 C ATOM 2225 O LYS A 100 -25.701 -26.009 -2.206 1.00 14.46 O ATOM 2226 CB LYS A 100 -23.512 -24.776 -0.890 1.00 13.66 C ATOM 2227 CG LYS A 100 -24.206 -23.557 -1.477 1.00 13.92 C ATOM 2228 CD LYS A 100 -24.366 -22.459 -0.435 1.00 14.26 C ATOM 2229 CE LYS A 100 -25.137 -21.268 -0.983 1.00 15.02 C ATOM 2230 NZ LYS A 100 -26.517 -21.641 -1.391 1.00 15.75 N ATOM 0 H LYS A 100 -22.892 -24.552 -3.394 1.00 12.64 H new ATOM 0 HA LYS A 100 -22.666 -26.662 -1.377 1.00 13.44 H new ATOM 0 HB2 LYS A 100 -24.094 -25.135 -0.041 1.00 13.66 H new ATOM 0 HB3 LYS A 100 -22.539 -24.472 -0.504 1.00 13.66 H new ATOM 0 HG2 LYS A 100 -23.630 -23.179 -2.322 1.00 13.92 H new ATOM 0 HG3 LYS A 100 -25.185 -23.843 -1.861 1.00 13.92 H new ATOM 0 HD2 LYS A 100 -24.885 -22.858 0.437 1.00 14.26 H new ATOM 0 HD3 LYS A 100 -23.382 -22.131 -0.098 1.00 14.26 H new ATOM 0 HE2 LYS A 100 -25.181 -20.485 -0.226 1.00 15.02 H new ATOM 0 HE3 LYS A 100 -24.605 -20.854 -1.839 1.00 15.02 H new ATOM 0 HZ1 LYS A 100 -27.087 -20.780 -1.516 1.00 15.75 H new ATOM 0 HZ2 LYS A 100 -26.484 -22.167 -2.287 1.00 15.75 H new ATOM 0 HZ3 LYS A 100 -26.947 -22.237 -0.655 1.00 15.75 H new ATOM 2244 N LYS A 101 -24.543 -27.897 -2.570 1.00 14.28 N ATOM 2245 CA LYS A 101 -25.698 -28.665 -3.000 1.00 15.00 C ATOM 2246 C LYS A 101 -25.515 -30.136 -2.641 1.00 15.28 C ATOM 2247 O LYS A 101 -26.030 -30.556 -1.583 1.00 15.57 O ATOM 2248 CB LYS A 101 -25.904 -28.495 -4.512 1.00 15.30 C ATOM 2249 CG LYS A 101 -27.018 -29.354 -5.092 1.00 15.68 C ATOM 2250 CD LYS A 101 -28.369 -29.044 -4.469 1.00 15.85 C ATOM 2251 CE LYS A 101 -29.453 -29.959 -5.017 1.00 16.60 C ATOM 2252 NZ LYS A 101 -29.162 -31.394 -4.745 1.00 17.06 N ATOM 2253 OXT LYS A 101 -24.844 -30.864 -3.405 1.00 15.35 O ATOM 0 H LYS A 101 -23.670 -28.424 -2.564 1.00 14.28 H new ATOM 0 HA LYS A 101 -26.585 -28.296 -2.485 1.00 15.00 H new ATOM 0 HB2 LYS A 101 -26.122 -27.448 -4.722 1.00 15.30 H new ATOM 0 HB3 LYS A 101 -24.972 -28.735 -5.023 1.00 15.30 H new ATOM 0 HG2 LYS A 101 -27.072 -29.196 -6.169 1.00 15.68 H new ATOM 0 HG3 LYS A 101 -26.781 -30.406 -4.936 1.00 15.68 H new ATOM 0 HD2 LYS A 101 -28.307 -29.157 -3.387 1.00 15.85 H new ATOM 0 HD3 LYS A 101 -28.633 -28.005 -4.666 1.00 15.85 H new ATOM 0 HE2 LYS A 101 -30.412 -29.693 -4.572 1.00 16.60 H new ATOM 0 HE3 LYS A 101 -29.548 -29.806 -6.092 1.00 16.60 H new ATOM 0 HZ1 LYS A 101 -30.022 -31.958 -4.899 1.00 17.06 H new ATOM 0 HZ2 LYS A 101 -28.412 -31.724 -5.386 1.00 17.06 H new ATOM 0 HZ3 LYS A 101 -28.848 -31.504 -3.760 1.00 17.06 H new TER 2267 LYS A 101 ATOM 2268 N MET B 1 -4.039 1.725 -20.852 1.00 1.49 N ATOM 2269 CA MET B 1 -3.234 1.311 -19.680 1.00 0.60 C ATOM 2270 C MET B 1 -3.884 0.086 -19.041 1.00 0.49 C ATOM 2271 O MET B 1 -4.784 -0.512 -19.631 1.00 0.58 O ATOM 2272 CB MET B 1 -3.153 2.472 -18.675 1.00 1.30 C ATOM 2273 CG MET B 1 -2.044 2.331 -17.642 1.00 1.88 C ATOM 2274 SD MET B 1 -2.030 3.675 -16.440 1.00 2.89 S ATOM 2275 CE MET B 1 -1.815 5.088 -17.520 1.00 3.54 C ATOM 0 H1 MET B 1 -3.456 1.668 -21.711 1.00 1.49 H new ATOM 0 H2 MET B 1 -4.861 1.095 -20.949 1.00 1.49 H new ATOM 0 H3 MET B 1 -4.366 2.703 -20.720 1.00 1.49 H new ATOM 0 HA MET B 1 -2.221 1.054 -19.990 1.00 0.60 H new ATOM 0 HB2 MET B 1 -3.006 3.402 -19.224 1.00 1.30 H new ATOM 0 HB3 MET B 1 -4.108 2.555 -18.156 1.00 1.30 H new ATOM 0 HG2 MET B 1 -2.161 1.383 -17.118 1.00 1.88 H new ATOM 0 HG3 MET B 1 -1.081 2.296 -18.152 1.00 1.88 H new ATOM 0 HE1 MET B 1 -1.454 5.937 -16.940 1.00 3.54 H new ATOM 0 HE2 MET B 1 -1.091 4.845 -18.297 1.00 3.54 H new ATOM 0 HE3 MET B 1 -2.770 5.343 -17.980 1.00 3.54 H new ATOM 2285 N ALA B 2 -3.427 -0.300 -17.857 1.00 0.34 N ATOM 2286 CA ALA B 2 -4.066 -1.363 -17.105 1.00 0.30 C ATOM 2287 C ALA B 2 -4.969 -0.728 -16.062 1.00 0.27 C ATOM 2288 O ALA B 2 -4.923 0.487 -15.889 1.00 0.36 O ATOM 2289 CB ALA B 2 -3.021 -2.257 -16.447 1.00 0.30 C ATOM 0 H ALA B 2 -2.614 0.111 -17.399 1.00 0.34 H new ATOM 0 HA ALA B 2 -4.657 -1.991 -17.772 1.00 0.30 H new ATOM 0 HB1 ALA B 2 -3.520 -3.048 -15.887 1.00 0.30 H new ATOM 0 HB2 ALA B 2 -2.386 -2.700 -17.214 1.00 0.30 H new ATOM 0 HB3 ALA B 2 -2.409 -1.663 -15.768 1.00 0.30 H new ATOM 2295 N CYS B 3 -5.791 -1.525 -15.388 1.00 0.25 N ATOM 2296 CA CYS B 3 -6.630 -1.017 -14.314 1.00 0.23 C ATOM 2297 C CYS B 3 -5.746 -0.542 -13.174 1.00 0.17 C ATOM 2298 O CYS B 3 -5.195 -1.349 -12.426 1.00 0.17 O ATOM 2299 CB CYS B 3 -7.603 -2.095 -13.832 1.00 0.28 C ATOM 2300 SG CYS B 3 -8.778 -2.640 -15.093 1.00 0.39 S ATOM 0 H CYS B 3 -5.893 -2.524 -15.568 1.00 0.25 H new ATOM 0 HA CYS B 3 -7.221 -0.179 -14.684 1.00 0.23 H new ATOM 0 HB2 CYS B 3 -7.032 -2.956 -13.485 1.00 0.28 H new ATOM 0 HB3 CYS B 3 -8.157 -1.713 -12.974 1.00 0.28 H new ATOM 0 HG CYS B 3 -9.557 -3.553 -14.594 1.00 0.39 H new ATOM 2306 N PRO B 4 -5.597 0.781 -13.042 1.00 0.16 N ATOM 2307 CA PRO B 4 -4.589 1.396 -12.173 1.00 0.13 C ATOM 2308 C PRO B 4 -4.630 0.887 -10.737 1.00 0.12 C ATOM 2309 O PRO B 4 -3.674 0.274 -10.258 1.00 0.12 O ATOM 2310 CB PRO B 4 -4.970 2.873 -12.216 1.00 0.17 C ATOM 2311 CG PRO B 4 -5.614 3.046 -13.539 1.00 0.20 C ATOM 2312 CD PRO B 4 -6.415 1.797 -13.734 1.00 0.20 C ATOM 0 HA PRO B 4 -3.577 1.171 -12.510 1.00 0.13 H new ATOM 0 HB2 PRO B 4 -5.651 3.132 -11.405 1.00 0.17 H new ATOM 0 HB3 PRO B 4 -4.094 3.513 -12.113 1.00 0.17 H new ATOM 0 HG2 PRO B 4 -6.249 3.932 -13.558 1.00 0.20 H new ATOM 0 HG3 PRO B 4 -4.872 3.169 -14.328 1.00 0.20 H new ATOM 0 HD2 PRO B 4 -7.411 1.881 -13.299 1.00 0.20 H new ATOM 0 HD3 PRO B 4 -6.548 1.561 -14.790 1.00 0.20 H new ATOM 2320 N LEU B 5 -5.745 1.117 -10.068 1.00 0.13 N ATOM 2321 CA LEU B 5 -5.883 0.738 -8.674 1.00 0.14 C ATOM 2322 C LEU B 5 -5.975 -0.783 -8.536 1.00 0.16 C ATOM 2323 O LEU B 5 -5.511 -1.347 -7.550 1.00 0.22 O ATOM 2324 CB LEU B 5 -7.120 1.411 -8.075 1.00 0.15 C ATOM 2325 CG LEU B 5 -6.969 1.969 -6.656 1.00 0.16 C ATOM 2326 CD1 LEU B 5 -6.709 0.861 -5.673 1.00 0.18 C ATOM 2327 CD2 LEU B 5 -5.857 2.999 -6.581 1.00 0.17 C ATOM 0 H LEU B 5 -6.569 1.565 -10.468 1.00 0.13 H new ATOM 0 HA LEU B 5 -5.001 1.072 -8.128 1.00 0.14 H new ATOM 0 HB2 LEU B 5 -7.418 2.227 -8.733 1.00 0.15 H new ATOM 0 HB3 LEU B 5 -7.936 0.688 -8.073 1.00 0.15 H new ATOM 0 HG LEU B 5 -7.907 2.460 -6.397 1.00 0.16 H new ATOM 0 HD11 LEU B 5 -6.605 1.280 -4.672 1.00 0.18 H new ATOM 0 HD12 LEU B 5 -7.542 0.158 -5.688 1.00 0.18 H new ATOM 0 HD13 LEU B 5 -5.791 0.341 -5.946 1.00 0.18 H new ATOM 0 HD21 LEU B 5 -5.777 3.374 -5.561 1.00 0.17 H new ATOM 0 HD22 LEU B 5 -4.914 2.538 -6.873 1.00 0.17 H new ATOM 0 HD23 LEU B 5 -6.081 3.826 -7.255 1.00 0.17 H new ATOM 2339 N GLU B 6 -6.546 -1.449 -9.535 1.00 0.16 N ATOM 2340 CA GLU B 6 -6.724 -2.894 -9.465 1.00 0.20 C ATOM 2341 C GLU B 6 -5.379 -3.609 -9.535 1.00 0.18 C ATOM 2342 O GLU B 6 -5.130 -4.555 -8.783 1.00 0.23 O ATOM 2343 CB GLU B 6 -7.654 -3.398 -10.573 1.00 0.29 C ATOM 2344 CG GLU B 6 -8.051 -4.859 -10.405 1.00 0.43 C ATOM 2345 CD GLU B 6 -9.181 -5.278 -11.323 1.00 0.90 C ATOM 2346 OE1 GLU B 6 -8.921 -5.549 -12.514 1.00 1.39 O ATOM 2347 OE2 GLU B 6 -10.337 -5.359 -10.853 1.00 1.79 O ATOM 0 H GLU B 6 -6.890 -1.017 -10.393 1.00 0.16 H new ATOM 0 HA GLU B 6 -7.190 -3.121 -8.506 1.00 0.20 H new ATOM 0 HB2 GLU B 6 -8.554 -2.783 -10.591 1.00 0.29 H new ATOM 0 HB3 GLU B 6 -7.162 -3.270 -11.537 1.00 0.29 H new ATOM 0 HG2 GLU B 6 -7.183 -5.489 -10.597 1.00 0.43 H new ATOM 0 HG3 GLU B 6 -8.348 -5.032 -9.371 1.00 0.43 H new ATOM 2354 N LYS B 7 -4.505 -3.145 -10.423 1.00 0.16 N ATOM 2355 CA LYS B 7 -3.185 -3.738 -10.561 1.00 0.18 C ATOM 2356 C LYS B 7 -2.361 -3.502 -9.309 1.00 0.17 C ATOM 2357 O LYS B 7 -1.510 -4.310 -8.972 1.00 0.19 O ATOM 2358 CB LYS B 7 -2.453 -3.194 -11.799 1.00 0.25 C ATOM 2359 CG LYS B 7 -3.112 -3.577 -13.117 1.00 0.41 C ATOM 2360 CD LYS B 7 -3.218 -5.087 -13.296 1.00 0.90 C ATOM 2361 CE LYS B 7 -1.860 -5.738 -13.505 1.00 0.84 C ATOM 2362 NZ LYS B 7 -1.959 -7.220 -13.559 1.00 1.18 N ATOM 0 H LYS B 7 -4.688 -2.364 -11.053 1.00 0.16 H new ATOM 0 HA LYS B 7 -3.315 -4.812 -10.696 1.00 0.18 H new ATOM 0 HB2 LYS B 7 -2.401 -2.107 -11.731 1.00 0.25 H new ATOM 0 HB3 LYS B 7 -1.427 -3.563 -11.795 1.00 0.25 H new ATOM 0 HG2 LYS B 7 -4.108 -3.137 -13.163 1.00 0.41 H new ATOM 0 HG3 LYS B 7 -2.539 -3.155 -13.943 1.00 0.41 H new ATOM 0 HD2 LYS B 7 -3.696 -5.522 -12.419 1.00 0.90 H new ATOM 0 HD3 LYS B 7 -3.859 -5.306 -14.150 1.00 0.90 H new ATOM 0 HE2 LYS B 7 -1.419 -5.369 -14.431 1.00 0.84 H new ATOM 0 HE3 LYS B 7 -1.190 -5.448 -12.696 1.00 0.84 H new ATOM 0 HZ1 LYS B 7 -1.531 -7.565 -14.442 1.00 1.18 H new ATOM 0 HZ2 LYS B 7 -1.456 -7.631 -12.747 1.00 1.18 H new ATOM 0 HZ3 LYS B 7 -2.959 -7.503 -13.526 1.00 1.18 H new ATOM 2376 N ALA B 8 -2.640 -2.409 -8.606 1.00 0.17 N ATOM 2377 CA ALA B 8 -1.937 -2.094 -7.366 1.00 0.17 C ATOM 2378 C ALA B 8 -1.937 -3.282 -6.404 1.00 0.17 C ATOM 2379 O ALA B 8 -0.879 -3.708 -5.949 1.00 0.22 O ATOM 2380 CB ALA B 8 -2.548 -0.870 -6.699 1.00 0.18 C ATOM 0 H ALA B 8 -3.348 -1.726 -8.874 1.00 0.17 H new ATOM 0 HA ALA B 8 -0.901 -1.873 -7.622 1.00 0.17 H new ATOM 0 HB1 ALA B 8 -2.010 -0.652 -5.777 1.00 0.18 H new ATOM 0 HB2 ALA B 8 -2.477 -0.015 -7.372 1.00 0.18 H new ATOM 0 HB3 ALA B 8 -3.596 -1.065 -6.470 1.00 0.18 H new ATOM 2386 N LEU B 9 -3.115 -3.835 -6.117 1.00 0.13 N ATOM 2387 CA LEU B 9 -3.205 -4.966 -5.192 1.00 0.12 C ATOM 2388 C LEU B 9 -2.781 -6.254 -5.889 1.00 0.14 C ATOM 2389 O LEU B 9 -2.196 -7.143 -5.272 1.00 0.18 O ATOM 2390 CB LEU B 9 -4.624 -5.140 -4.609 1.00 0.13 C ATOM 2391 CG LEU B 9 -5.258 -3.895 -3.974 1.00 0.13 C ATOM 2392 CD1 LEU B 9 -4.239 -3.135 -3.158 1.00 0.15 C ATOM 2393 CD2 LEU B 9 -5.882 -2.982 -5.013 1.00 0.13 C ATOM 0 H LEU B 9 -4.007 -3.526 -6.504 1.00 0.13 H new ATOM 0 HA LEU B 9 -2.530 -4.751 -4.364 1.00 0.12 H new ATOM 0 HB2 LEU B 9 -5.280 -5.489 -5.406 1.00 0.13 H new ATOM 0 HB3 LEU B 9 -4.590 -5.928 -3.856 1.00 0.13 H new ATOM 0 HG LEU B 9 -6.055 -4.241 -3.316 1.00 0.13 H new ATOM 0 HD11 LEU B 9 -4.709 -2.256 -2.716 1.00 0.15 H new ATOM 0 HD12 LEU B 9 -3.855 -3.778 -2.366 1.00 0.15 H new ATOM 0 HD13 LEU B 9 -3.417 -2.822 -3.802 1.00 0.15 H new ATOM 0 HD21 LEU B 9 -6.319 -2.114 -4.519 1.00 0.13 H new ATOM 0 HD22 LEU B 9 -5.116 -2.653 -5.715 1.00 0.13 H new ATOM 0 HD23 LEU B 9 -6.660 -3.522 -5.552 1.00 0.13 H new ATOM 2405 N ASP B 10 -3.072 -6.336 -7.184 1.00 0.14 N ATOM 2406 CA ASP B 10 -2.711 -7.501 -7.989 1.00 0.16 C ATOM 2407 C ASP B 10 -1.203 -7.732 -7.980 1.00 0.15 C ATOM 2408 O ASP B 10 -0.732 -8.843 -7.735 1.00 0.19 O ATOM 2409 CB ASP B 10 -3.198 -7.315 -9.431 1.00 0.20 C ATOM 2410 CG ASP B 10 -2.652 -8.363 -10.384 1.00 0.51 C ATOM 2411 OD1 ASP B 10 -3.232 -9.463 -10.463 1.00 1.22 O ATOM 2412 OD2 ASP B 10 -1.644 -8.086 -11.070 1.00 1.19 O ATOM 0 H ASP B 10 -3.560 -5.605 -7.702 1.00 0.14 H new ATOM 0 HA ASP B 10 -3.194 -8.375 -7.552 1.00 0.16 H new ATOM 0 HB2 ASP B 10 -4.287 -7.350 -9.448 1.00 0.20 H new ATOM 0 HB3 ASP B 10 -2.905 -6.326 -9.782 1.00 0.20 H new ATOM 2417 N VAL B 11 -0.450 -6.672 -8.222 1.00 0.15 N ATOM 2418 CA VAL B 11 0.998 -6.769 -8.328 1.00 0.16 C ATOM 2419 C VAL B 11 1.647 -6.944 -6.962 1.00 0.16 C ATOM 2420 O VAL B 11 2.745 -7.479 -6.857 1.00 0.20 O ATOM 2421 CB VAL B 11 1.591 -5.535 -9.028 1.00 0.18 C ATOM 2422 CG1 VAL B 11 0.896 -5.314 -10.359 1.00 0.21 C ATOM 2423 CG2 VAL B 11 1.483 -4.296 -8.149 1.00 0.17 C ATOM 0 H VAL B 11 -0.819 -5.730 -8.349 1.00 0.15 H new ATOM 0 HA VAL B 11 1.212 -7.652 -8.931 1.00 0.16 H new ATOM 0 HB VAL B 11 2.651 -5.716 -9.208 1.00 0.18 H new ATOM 0 HG11 VAL B 11 1.320 -4.438 -10.850 1.00 0.21 H new ATOM 0 HG12 VAL B 11 1.037 -6.190 -10.993 1.00 0.21 H new ATOM 0 HG13 VAL B 11 -0.169 -5.155 -10.191 1.00 0.21 H new ATOM 0 HG21 VAL B 11 1.911 -3.441 -8.672 1.00 0.17 H new ATOM 0 HG22 VAL B 11 0.434 -4.098 -7.926 1.00 0.17 H new ATOM 0 HG23 VAL B 11 2.026 -4.461 -7.219 1.00 0.17 H new ATOM 2433 N MET B 12 0.956 -6.505 -5.919 1.00 0.16 N ATOM 2434 CA MET B 12 1.447 -6.649 -4.554 1.00 0.20 C ATOM 2435 C MET B 12 1.732 -8.105 -4.229 1.00 0.23 C ATOM 2436 O MET B 12 2.747 -8.419 -3.620 1.00 0.39 O ATOM 2437 CB MET B 12 0.439 -6.073 -3.574 1.00 0.27 C ATOM 2438 CG MET B 12 0.526 -4.566 -3.463 1.00 0.16 C ATOM 2439 SD MET B 12 -0.870 -3.847 -2.588 1.00 0.78 S ATOM 2440 CE MET B 12 -0.210 -2.245 -2.177 1.00 0.19 C ATOM 0 H MET B 12 0.049 -6.044 -5.992 1.00 0.16 H new ATOM 0 HA MET B 12 2.382 -6.096 -4.465 1.00 0.20 H new ATOM 0 HB2 MET B 12 -0.567 -6.352 -3.888 1.00 0.27 H new ATOM 0 HB3 MET B 12 0.601 -6.515 -2.591 1.00 0.27 H new ATOM 0 HG2 MET B 12 1.448 -4.297 -2.948 1.00 0.16 H new ATOM 0 HG3 MET B 12 0.582 -4.136 -4.463 1.00 0.16 H new ATOM 0 HE1 MET B 12 -0.976 -1.654 -1.676 1.00 0.19 H new ATOM 0 HE2 MET B 12 0.648 -2.364 -1.515 1.00 0.19 H new ATOM 0 HE3 MET B 12 0.103 -1.736 -3.088 1.00 0.19 H new ATOM 2450 N VAL B 13 0.837 -8.991 -4.645 1.00 0.18 N ATOM 2451 CA VAL B 13 1.039 -10.419 -4.438 1.00 0.19 C ATOM 2452 C VAL B 13 1.756 -11.070 -5.626 1.00 0.19 C ATOM 2453 O VAL B 13 2.414 -12.098 -5.471 1.00 0.25 O ATOM 2454 CB VAL B 13 -0.290 -11.152 -4.149 1.00 0.20 C ATOM 2455 CG1 VAL B 13 -0.824 -10.753 -2.784 1.00 0.21 C ATOM 2456 CG2 VAL B 13 -1.324 -10.859 -5.225 1.00 0.22 C ATOM 0 H VAL B 13 -0.030 -8.749 -5.124 1.00 0.18 H new ATOM 0 HA VAL B 13 1.678 -10.516 -3.560 1.00 0.19 H new ATOM 0 HB VAL B 13 -0.093 -12.224 -4.154 1.00 0.20 H new ATOM 0 HG11 VAL B 13 -1.761 -11.276 -2.593 1.00 0.21 H new ATOM 0 HG12 VAL B 13 -0.097 -11.019 -2.017 1.00 0.21 H new ATOM 0 HG13 VAL B 13 -0.998 -9.677 -2.762 1.00 0.21 H new ATOM 0 HG21 VAL B 13 -2.249 -11.388 -4.995 1.00 0.22 H new ATOM 0 HG22 VAL B 13 -1.519 -9.787 -5.260 1.00 0.22 H new ATOM 0 HG23 VAL B 13 -0.947 -11.191 -6.192 1.00 0.22 H new ATOM 2466 N SER B 14 1.646 -10.462 -6.804 1.00 0.18 N ATOM 2467 CA SER B 14 2.264 -11.011 -8.011 1.00 0.21 C ATOM 2468 C SER B 14 3.774 -10.765 -8.035 1.00 0.23 C ATOM 2469 O SER B 14 4.560 -11.710 -8.140 1.00 0.26 O ATOM 2470 CB SER B 14 1.609 -10.419 -9.258 1.00 0.23 C ATOM 2471 OG SER B 14 0.241 -10.787 -9.327 1.00 1.12 O ATOM 0 H SER B 14 1.136 -9.591 -6.950 1.00 0.18 H new ATOM 0 HA SER B 14 2.105 -12.089 -8.003 1.00 0.21 H new ATOM 0 HB2 SER B 14 1.698 -9.333 -9.241 1.00 0.23 H new ATOM 0 HB3 SER B 14 2.130 -10.768 -10.149 1.00 0.23 H new ATOM 0 HG SER B 14 -0.277 -10.241 -8.699 1.00 1.12 H new ATOM 2477 N THR B 15 4.175 -9.502 -7.930 1.00 0.24 N ATOM 2478 CA THR B 15 5.587 -9.140 -7.890 1.00 0.26 C ATOM 2479 C THR B 15 6.242 -9.744 -6.648 1.00 0.28 C ATOM 2480 O THR B 15 7.426 -10.086 -6.650 1.00 0.31 O ATOM 2481 CB THR B 15 5.748 -7.604 -7.884 1.00 0.27 C ATOM 2482 OG1 THR B 15 5.044 -7.046 -9.004 1.00 0.33 O ATOM 2483 CG2 THR B 15 7.213 -7.191 -7.944 1.00 0.25 C ATOM 0 H THR B 15 3.537 -8.708 -7.871 1.00 0.24 H new ATOM 0 HA THR B 15 6.078 -9.536 -8.779 1.00 0.26 H new ATOM 0 HB THR B 15 5.332 -7.225 -6.951 1.00 0.27 H new ATOM 0 HG1 THR B 15 5.656 -6.493 -9.533 1.00 0.33 H new ATOM 0 HG21 THR B 15 7.285 -6.103 -7.938 1.00 0.25 H new ATOM 0 HG22 THR B 15 7.740 -7.594 -7.080 1.00 0.25 H new ATOM 0 HG23 THR B 15 7.663 -7.579 -8.857 1.00 0.25 H new ATOM 2491 N PHE B 16 5.429 -9.899 -5.607 1.00 0.30 N ATOM 2492 CA PHE B 16 5.833 -10.536 -4.359 1.00 0.36 C ATOM 2493 C PHE B 16 6.515 -11.878 -4.624 1.00 0.40 C ATOM 2494 O PHE B 16 7.727 -12.008 -4.478 1.00 0.51 O ATOM 2495 CB PHE B 16 4.586 -10.730 -3.490 1.00 0.44 C ATOM 2496 CG PHE B 16 4.825 -11.279 -2.116 1.00 0.34 C ATOM 2497 CD1 PHE B 16 5.517 -10.542 -1.173 1.00 1.21 C ATOM 2498 CD2 PHE B 16 4.330 -12.522 -1.760 1.00 1.27 C ATOM 2499 CE1 PHE B 16 5.719 -11.036 0.101 1.00 1.38 C ATOM 2500 CE2 PHE B 16 4.524 -13.019 -0.487 1.00 1.42 C ATOM 2501 CZ PHE B 16 5.221 -12.276 0.444 1.00 0.97 C ATOM 0 H PHE B 16 4.460 -9.582 -5.607 1.00 0.30 H new ATOM 0 HA PHE B 16 6.553 -9.902 -3.843 1.00 0.36 H new ATOM 0 HB2 PHE B 16 4.081 -9.769 -3.394 1.00 0.44 H new ATOM 0 HB3 PHE B 16 3.902 -11.398 -4.013 1.00 0.44 H new ATOM 0 HD1 PHE B 16 5.904 -9.569 -1.436 1.00 1.21 H new ATOM 0 HD2 PHE B 16 3.787 -13.109 -2.486 1.00 1.27 H new ATOM 0 HE1 PHE B 16 6.266 -10.453 0.827 1.00 1.38 H new ATOM 0 HE2 PHE B 16 4.131 -13.989 -0.220 1.00 1.42 H new ATOM 0 HZ PHE B 16 5.376 -12.665 1.440 1.00 0.97 H new ATOM 2511 N HIS B 17 5.733 -12.858 -5.075 1.00 0.41 N ATOM 2512 CA HIS B 17 6.241 -14.214 -5.299 1.00 0.51 C ATOM 2513 C HIS B 17 7.257 -14.266 -6.448 1.00 0.45 C ATOM 2514 O HIS B 17 7.953 -15.265 -6.626 1.00 0.51 O ATOM 2515 CB HIS B 17 5.088 -15.204 -5.561 1.00 0.68 C ATOM 2516 CG HIS B 17 4.347 -15.005 -6.854 1.00 1.09 C ATOM 2517 ND1 HIS B 17 3.176 -14.380 -7.117 1.00 2.16 N flip ATOM 2518 CD2 HIS B 17 4.786 -15.502 -8.065 1.00 1.26 C flip ATOM 2519 CE1 HIS B 17 2.935 -14.507 -8.460 1.00 2.82 C flip ATOM 2520 NE2 HIS B 17 3.920 -15.186 -9.009 1.00 2.30 N flip ATOM 0 H HIS B 17 4.744 -12.740 -5.293 1.00 0.41 H new ATOM 0 HA HIS B 17 6.757 -14.512 -4.386 1.00 0.51 H new ATOM 0 HB2 HIS B 17 5.491 -16.217 -5.545 1.00 0.68 H new ATOM 0 HB3 HIS B 17 4.376 -15.131 -4.739 1.00 0.68 H new ATOM 0 HD1 HIS B 17 2.582 -13.902 -6.440 1.00 2.16 H new ATOM 0 HD2 HIS B 17 5.697 -16.062 -8.216 1.00 1.26 H new ATOM 0 HE1 HIS B 17 2.076 -14.114 -8.983 1.00 2.82 H new ATOM 2529 N LYS B 18 7.333 -13.191 -7.218 1.00 0.42 N ATOM 2530 CA LYS B 18 8.154 -13.157 -8.422 1.00 0.46 C ATOM 2531 C LYS B 18 9.647 -12.990 -8.105 1.00 0.45 C ATOM 2532 O LYS B 18 10.499 -13.462 -8.857 1.00 0.62 O ATOM 2533 CB LYS B 18 7.675 -12.019 -9.330 1.00 0.55 C ATOM 2534 CG LYS B 18 8.397 -11.926 -10.664 1.00 0.76 C ATOM 2535 CD LYS B 18 7.943 -10.712 -11.452 1.00 0.71 C ATOM 2536 CE LYS B 18 8.752 -10.545 -12.724 1.00 1.40 C ATOM 2537 NZ LYS B 18 8.417 -11.576 -13.743 1.00 1.67 N ATOM 0 H LYS B 18 6.832 -12.323 -7.029 1.00 0.42 H new ATOM 0 HA LYS B 18 8.042 -14.114 -8.931 1.00 0.46 H new ATOM 0 HB2 LYS B 18 6.609 -12.146 -9.517 1.00 0.55 H new ATOM 0 HB3 LYS B 18 7.795 -11.074 -8.800 1.00 0.55 H new ATOM 0 HG2 LYS B 18 9.472 -11.871 -10.495 1.00 0.76 H new ATOM 0 HG3 LYS B 18 8.211 -12.830 -11.245 1.00 0.76 H new ATOM 0 HD2 LYS B 18 6.887 -10.812 -11.701 1.00 0.71 H new ATOM 0 HD3 LYS B 18 8.042 -9.818 -10.836 1.00 0.71 H new ATOM 0 HE2 LYS B 18 8.571 -9.554 -13.140 1.00 1.40 H new ATOM 0 HE3 LYS B 18 9.814 -10.603 -12.487 1.00 1.40 H new ATOM 0 HZ1 LYS B 18 8.994 -11.423 -14.595 1.00 1.67 H new ATOM 0 HZ2 LYS B 18 8.613 -12.522 -13.358 1.00 1.67 H new ATOM 0 HZ3 LYS B 18 7.409 -11.505 -13.990 1.00 1.67 H new ATOM 2551 N TYR B 19 9.973 -12.332 -6.999 1.00 0.39 N ATOM 2552 CA TYR B 19 11.373 -12.013 -6.698 1.00 0.43 C ATOM 2553 C TYR B 19 11.909 -12.789 -5.504 1.00 0.50 C ATOM 2554 O TYR B 19 12.971 -13.393 -5.592 1.00 0.74 O ATOM 2555 CB TYR B 19 11.542 -10.509 -6.463 1.00 0.46 C ATOM 2556 CG TYR B 19 11.350 -9.671 -7.709 1.00 0.41 C ATOM 2557 CD1 TYR B 19 10.083 -9.443 -8.224 1.00 1.17 C ATOM 2558 CD2 TYR B 19 12.436 -9.106 -8.372 1.00 1.17 C ATOM 2559 CE1 TYR B 19 9.900 -8.682 -9.359 1.00 1.21 C ATOM 2560 CE2 TYR B 19 12.257 -8.342 -9.511 1.00 1.17 C ATOM 2561 CZ TYR B 19 10.983 -8.134 -9.998 1.00 0.50 C ATOM 2562 OH TYR B 19 10.788 -7.375 -11.129 1.00 0.61 O ATOM 0 H TYR B 19 9.302 -12.011 -6.301 1.00 0.39 H new ATOM 0 HA TYR B 19 11.956 -12.315 -7.568 1.00 0.43 H new ATOM 0 HB2 TYR B 19 10.827 -10.186 -5.706 1.00 0.46 H new ATOM 0 HB3 TYR B 19 12.538 -10.323 -6.061 1.00 0.46 H new ATOM 0 HD1 TYR B 19 9.224 -9.869 -7.727 1.00 1.17 H new ATOM 0 HD2 TYR B 19 13.434 -9.267 -7.991 1.00 1.17 H new ATOM 0 HE1 TYR B 19 8.905 -8.517 -9.745 1.00 1.21 H new ATOM 0 HE2 TYR B 19 13.109 -7.911 -10.016 1.00 1.17 H new ATOM 0 HH TYR B 19 9.901 -6.960 -11.095 1.00 0.61 H new ATOM 2572 N SER B 20 11.172 -12.782 -4.404 1.00 0.41 N ATOM 2573 CA SER B 20 11.637 -13.381 -3.155 1.00 0.48 C ATOM 2574 C SER B 20 11.860 -14.885 -3.279 1.00 0.57 C ATOM 2575 O SER B 20 12.690 -15.461 -2.571 1.00 0.70 O ATOM 2576 CB SER B 20 10.621 -13.090 -2.067 1.00 0.49 C ATOM 2577 OG SER B 20 9.318 -13.110 -2.611 1.00 0.53 O ATOM 0 H SER B 20 10.242 -12.366 -4.348 1.00 0.41 H new ATOM 0 HA SER B 20 12.602 -12.941 -2.904 1.00 0.48 H new ATOM 0 HB2 SER B 20 10.704 -13.831 -1.272 1.00 0.49 H new ATOM 0 HB3 SER B 20 10.823 -12.117 -1.619 1.00 0.49 H new ATOM 0 HG SER B 20 8.665 -13.230 -1.891 1.00 0.53 H new ATOM 2583 N GLY B 21 11.133 -15.515 -4.193 1.00 0.57 N ATOM 2584 CA GLY B 21 11.260 -16.947 -4.391 1.00 0.68 C ATOM 2585 C GLY B 21 12.497 -17.317 -5.186 1.00 0.71 C ATOM 2586 O GLY B 21 12.599 -18.427 -5.710 1.00 0.86 O ATOM 0 H GLY B 21 10.455 -15.058 -4.803 1.00 0.57 H new ATOM 0 HA2 GLY B 21 11.294 -17.443 -3.421 1.00 0.68 H new ATOM 0 HA3 GLY B 21 10.375 -17.319 -4.908 1.00 0.68 H new ATOM 2590 N LYS B 22 13.439 -16.389 -5.274 1.00 0.73 N ATOM 2591 CA LYS B 22 14.671 -16.618 -6.007 1.00 0.79 C ATOM 2592 C LYS B 22 15.822 -16.933 -5.057 1.00 0.88 C ATOM 2593 O LYS B 22 16.628 -17.823 -5.327 1.00 0.96 O ATOM 2594 CB LYS B 22 14.987 -15.410 -6.890 1.00 0.81 C ATOM 2595 CG LYS B 22 14.228 -15.428 -8.206 1.00 1.23 C ATOM 2596 CD LYS B 22 14.348 -14.110 -8.945 1.00 1.30 C ATOM 2597 CE LYS B 22 13.745 -14.195 -10.337 1.00 1.75 C ATOM 2598 NZ LYS B 22 12.345 -14.700 -10.315 1.00 2.10 N ATOM 0 H LYS B 22 13.371 -15.467 -4.844 1.00 0.73 H new ATOM 0 HA LYS B 22 14.539 -17.487 -6.652 1.00 0.79 H new ATOM 0 HB2 LYS B 22 14.744 -14.496 -6.348 1.00 0.81 H new ATOM 0 HB3 LYS B 22 16.058 -15.385 -7.094 1.00 0.81 H new ATOM 0 HG2 LYS B 22 14.610 -16.233 -8.834 1.00 1.23 H new ATOM 0 HG3 LYS B 22 13.177 -15.643 -8.016 1.00 1.23 H new ATOM 0 HD2 LYS B 22 13.846 -13.326 -8.377 1.00 1.30 H new ATOM 0 HD3 LYS B 22 15.398 -13.827 -9.019 1.00 1.30 H new ATOM 0 HE2 LYS B 22 13.766 -13.209 -10.801 1.00 1.75 H new ATOM 0 HE3 LYS B 22 14.356 -14.852 -10.956 1.00 1.75 H new ATOM 0 HZ1 LYS B 22 11.902 -14.536 -11.242 1.00 2.10 H new ATOM 0 HZ2 LYS B 22 12.347 -15.719 -10.107 1.00 2.10 H new ATOM 0 HZ3 LYS B 22 11.806 -14.198 -9.580 1.00 2.10 H new ATOM 2612 N GLU B 23 15.903 -16.212 -3.947 1.00 0.97 N ATOM 2613 CA GLU B 23 16.880 -16.527 -2.915 1.00 1.14 C ATOM 2614 C GLU B 23 16.273 -17.482 -1.891 1.00 1.25 C ATOM 2615 O GLU B 23 16.827 -18.547 -1.610 1.00 1.57 O ATOM 2616 CB GLU B 23 17.347 -15.245 -2.232 1.00 1.46 C ATOM 2617 CG GLU B 23 18.407 -15.448 -1.167 1.00 1.92 C ATOM 2618 CD GLU B 23 19.715 -15.965 -1.728 1.00 2.47 C ATOM 2619 OE1 GLU B 23 20.490 -15.158 -2.284 1.00 2.95 O ATOM 2620 OE2 GLU B 23 19.988 -17.175 -1.595 1.00 3.11 O ATOM 0 H GLU B 23 15.308 -15.410 -3.739 1.00 0.97 H new ATOM 0 HA GLU B 23 17.740 -17.013 -3.377 1.00 1.14 H new ATOM 0 HB2 GLU B 23 17.738 -14.566 -2.990 1.00 1.46 H new ATOM 0 HB3 GLU B 23 16.485 -14.755 -1.779 1.00 1.46 H new ATOM 0 HG2 GLU B 23 18.586 -14.503 -0.655 1.00 1.92 H new ATOM 0 HG3 GLU B 23 18.035 -16.150 -0.421 1.00 1.92 H new ATOM 2627 N GLY B 24 15.122 -17.103 -1.351 1.00 1.31 N ATOM 2628 CA GLY B 24 14.469 -17.914 -0.345 1.00 1.56 C ATOM 2629 C GLY B 24 13.085 -18.338 -0.780 1.00 1.33 C ATOM 2630 O GLY B 24 12.918 -18.897 -1.865 1.00 1.43 O ATOM 0 H GLY B 24 14.628 -16.244 -1.594 1.00 1.31 H new ATOM 0 HA2 GLY B 24 15.073 -18.798 -0.142 1.00 1.56 H new ATOM 0 HA3 GLY B 24 14.402 -17.353 0.587 1.00 1.56 H new ATOM 2634 N ASP B 25 12.095 -18.081 0.061 1.00 1.16 N ATOM 2635 CA ASP B 25 10.710 -18.368 -0.286 1.00 1.06 C ATOM 2636 C ASP B 25 10.029 -17.106 -0.786 1.00 0.90 C ATOM 2637 O ASP B 25 10.371 -16.000 -0.369 1.00 0.91 O ATOM 2638 CB ASP B 25 9.937 -18.939 0.909 1.00 1.15 C ATOM 2639 CG ASP B 25 8.513 -19.321 0.541 1.00 1.33 C ATOM 2640 OD1 ASP B 25 8.303 -20.448 0.048 1.00 1.82 O ATOM 2641 OD2 ASP B 25 7.601 -18.485 0.707 1.00 1.98 O ATOM 0 H ASP B 25 12.224 -17.675 0.988 1.00 1.16 H new ATOM 0 HA ASP B 25 10.712 -19.120 -1.075 1.00 1.06 H new ATOM 0 HB2 ASP B 25 10.459 -19.816 1.292 1.00 1.15 H new ATOM 0 HB3 ASP B 25 9.918 -18.203 1.713 1.00 1.15 H new ATOM 2646 N LYS B 26 9.060 -17.282 -1.672 1.00 0.95 N ATOM 2647 CA LYS B 26 8.335 -16.168 -2.274 1.00 0.88 C ATOM 2648 C LYS B 26 7.624 -15.288 -1.234 1.00 0.83 C ATOM 2649 O LYS B 26 7.203 -14.178 -1.539 1.00 0.88 O ATOM 2650 CB LYS B 26 7.336 -16.695 -3.321 1.00 1.08 C ATOM 2651 CG LYS B 26 6.410 -17.817 -2.842 1.00 1.43 C ATOM 2652 CD LYS B 26 5.391 -17.331 -1.824 1.00 1.59 C ATOM 2653 CE LYS B 26 4.570 -18.474 -1.253 1.00 1.81 C ATOM 2654 NZ LYS B 26 5.417 -19.496 -0.577 1.00 2.62 N ATOM 0 H LYS B 26 8.753 -18.199 -1.995 1.00 0.95 H new ATOM 0 HA LYS B 26 9.070 -15.530 -2.764 1.00 0.88 H new ATOM 0 HB2 LYS B 26 6.722 -15.862 -3.663 1.00 1.08 H new ATOM 0 HB3 LYS B 26 7.897 -17.054 -4.184 1.00 1.08 H new ATOM 0 HG2 LYS B 26 5.889 -18.245 -3.698 1.00 1.43 H new ATOM 0 HG3 LYS B 26 7.008 -18.615 -2.401 1.00 1.43 H new ATOM 0 HD2 LYS B 26 5.905 -16.814 -1.014 1.00 1.59 H new ATOM 0 HD3 LYS B 26 4.726 -16.606 -2.294 1.00 1.59 H new ATOM 0 HE2 LYS B 26 3.845 -18.078 -0.542 1.00 1.81 H new ATOM 0 HE3 LYS B 26 4.004 -18.948 -2.055 1.00 1.81 H new ATOM 0 HZ1 LYS B 26 4.813 -20.133 -0.019 1.00 2.62 H new ATOM 0 HZ2 LYS B 26 5.934 -20.047 -1.292 1.00 2.62 H new ATOM 0 HZ3 LYS B 26 6.096 -19.023 0.052 1.00 2.62 H new ATOM 2668 N PHE B 27 7.483 -15.787 -0.016 1.00 0.79 N ATOM 2669 CA PHE B 27 6.793 -15.056 1.033 1.00 0.79 C ATOM 2670 C PHE B 27 7.766 -14.252 1.884 1.00 0.71 C ATOM 2671 O PHE B 27 7.354 -13.475 2.747 1.00 0.70 O ATOM 2672 CB PHE B 27 6.038 -16.055 1.906 1.00 0.99 C ATOM 2673 CG PHE B 27 4.810 -15.498 2.547 1.00 0.72 C ATOM 2674 CD1 PHE B 27 4.884 -14.811 3.742 1.00 1.64 C ATOM 2675 CD2 PHE B 27 3.580 -15.672 1.949 1.00 1.53 C ATOM 2676 CE1 PHE B 27 3.750 -14.302 4.333 1.00 2.41 C ATOM 2677 CE2 PHE B 27 2.436 -15.166 2.533 1.00 2.34 C ATOM 2678 CZ PHE B 27 2.521 -14.480 3.729 1.00 2.60 C ATOM 0 H PHE B 27 7.839 -16.699 0.270 1.00 0.79 H new ATOM 0 HA PHE B 27 6.099 -14.351 0.575 1.00 0.79 H new ATOM 0 HB2 PHE B 27 5.759 -16.915 1.297 1.00 0.99 H new ATOM 0 HB3 PHE B 27 6.708 -16.420 2.685 1.00 0.99 H new ATOM 0 HD1 PHE B 27 5.843 -14.671 4.219 1.00 1.64 H new ATOM 0 HD2 PHE B 27 3.511 -16.209 1.015 1.00 1.53 H new ATOM 0 HE1 PHE B 27 3.821 -13.765 5.267 1.00 2.41 H new ATOM 0 HE2 PHE B 27 1.477 -15.306 2.056 1.00 2.34 H new ATOM 0 HZ PHE B 27 1.629 -14.084 4.191 1.00 2.60 H new ATOM 2688 N LYS B 28 9.050 -14.423 1.648 1.00 0.69 N ATOM 2689 CA LYS B 28 10.038 -13.739 2.457 1.00 0.68 C ATOM 2690 C LYS B 28 11.031 -12.990 1.589 1.00 0.50 C ATOM 2691 O LYS B 28 11.759 -13.588 0.797 1.00 0.54 O ATOM 2692 CB LYS B 28 10.766 -14.743 3.348 1.00 0.92 C ATOM 2693 CG LYS B 28 11.831 -14.128 4.243 1.00 0.93 C ATOM 2694 CD LYS B 28 11.247 -13.106 5.207 1.00 0.98 C ATOM 2695 CE LYS B 28 10.219 -13.720 6.143 1.00 1.51 C ATOM 2696 NZ LYS B 28 10.775 -14.851 6.929 1.00 1.98 N ATOM 0 H LYS B 28 9.431 -15.020 0.914 1.00 0.69 H new ATOM 0 HA LYS B 28 9.523 -13.011 3.084 1.00 0.68 H new ATOM 0 HB2 LYS B 28 10.034 -15.254 3.973 1.00 0.92 H new ATOM 0 HB3 LYS B 28 11.231 -15.501 2.717 1.00 0.92 H new ATOM 0 HG2 LYS B 28 12.328 -14.916 4.808 1.00 0.93 H new ATOM 0 HG3 LYS B 28 12.591 -13.650 3.625 1.00 0.93 H new ATOM 0 HD2 LYS B 28 12.051 -12.662 5.794 1.00 0.98 H new ATOM 0 HD3 LYS B 28 10.783 -12.299 4.640 1.00 0.98 H new ATOM 0 HE2 LYS B 28 9.849 -12.954 6.825 1.00 1.51 H new ATOM 0 HE3 LYS B 28 9.365 -14.069 5.562 1.00 1.51 H new ATOM 0 HZ1 LYS B 28 10.427 -14.798 7.908 1.00 1.98 H new ATOM 0 HZ2 LYS B 28 10.474 -15.751 6.503 1.00 1.98 H new ATOM 0 HZ3 LYS B 28 11.814 -14.798 6.927 1.00 1.98 H new ATOM 2710 N LEU B 29 11.069 -11.682 1.750 1.00 0.38 N ATOM 2711 CA LEU B 29 12.018 -10.865 1.020 1.00 0.32 C ATOM 2712 C LEU B 29 13.083 -10.322 1.949 1.00 0.33 C ATOM 2713 O LEU B 29 12.799 -9.518 2.834 1.00 0.42 O ATOM 2714 CB LEU B 29 11.332 -9.697 0.312 1.00 0.29 C ATOM 2715 CG LEU B 29 10.439 -10.067 -0.868 1.00 0.29 C ATOM 2716 CD1 LEU B 29 9.028 -10.351 -0.395 1.00 0.34 C ATOM 2717 CD2 LEU B 29 10.451 -8.968 -1.918 1.00 0.31 C ATOM 0 H LEU B 29 10.455 -11.163 2.378 1.00 0.38 H new ATOM 0 HA LEU B 29 12.478 -11.507 0.269 1.00 0.32 H new ATOM 0 HB2 LEU B 29 10.730 -9.157 1.043 1.00 0.29 H new ATOM 0 HB3 LEU B 29 12.100 -9.009 -0.040 1.00 0.29 H new ATOM 0 HG LEU B 29 10.833 -10.973 -1.328 1.00 0.29 H new ATOM 0 HD11 LEU B 29 8.404 -10.613 -1.249 1.00 0.34 H new ATOM 0 HD12 LEU B 29 9.041 -11.180 0.313 1.00 0.34 H new ATOM 0 HD13 LEU B 29 8.622 -9.464 0.092 1.00 0.34 H new ATOM 0 HD21 LEU B 29 9.808 -9.253 -2.750 1.00 0.31 H new ATOM 0 HD22 LEU B 29 10.085 -8.040 -1.478 1.00 0.31 H new ATOM 0 HD23 LEU B 29 11.469 -8.822 -2.280 1.00 0.31 H new ATOM 2729 N ASN B 30 14.307 -10.774 1.757 1.00 0.31 N ATOM 2730 CA ASN B 30 15.434 -10.184 2.457 1.00 0.31 C ATOM 2731 C ASN B 30 15.914 -8.982 1.648 1.00 0.27 C ATOM 2732 O ASN B 30 15.255 -8.598 0.678 1.00 0.26 O ATOM 2733 CB ASN B 30 16.562 -11.204 2.659 1.00 0.35 C ATOM 2734 CG ASN B 30 17.380 -11.438 1.409 1.00 0.58 C ATOM 2735 OD1 ASN B 30 18.379 -10.761 1.175 1.00 1.17 O ATOM 2736 ND2 ASN B 30 16.978 -12.401 0.606 1.00 0.60 N ATOM 0 H ASN B 30 14.547 -11.541 1.128 1.00 0.31 H new ATOM 0 HA ASN B 30 15.125 -9.863 3.452 1.00 0.31 H new ATOM 0 HB2 ASN B 30 17.219 -10.857 3.457 1.00 0.35 H new ATOM 0 HB3 ASN B 30 16.133 -12.151 2.988 1.00 0.35 H new ATOM 0 HD21 ASN B 30 17.501 -12.607 -0.245 1.00 0.60 H new ATOM 0 HD22 ASN B 30 16.143 -12.941 0.835 1.00 0.60 H new ATOM 2743 N LYS B 31 17.036 -8.392 2.042 1.00 0.27 N ATOM 2744 CA LYS B 31 17.551 -7.201 1.368 1.00 0.26 C ATOM 2745 C LYS B 31 17.607 -7.383 -0.151 1.00 0.25 C ATOM 2746 O LYS B 31 17.091 -6.556 -0.901 1.00 0.28 O ATOM 2747 CB LYS B 31 18.952 -6.856 1.869 1.00 0.29 C ATOM 2748 CG LYS B 31 19.013 -6.497 3.339 1.00 0.40 C ATOM 2749 CD LYS B 31 20.399 -6.014 3.732 1.00 0.49 C ATOM 2750 CE LYS B 31 21.455 -7.086 3.512 1.00 1.20 C ATOM 2751 NZ LYS B 31 21.232 -8.269 4.382 1.00 1.72 N ATOM 0 H LYS B 31 17.607 -8.716 2.823 1.00 0.27 H new ATOM 0 HA LYS B 31 16.861 -6.390 1.601 1.00 0.26 H new ATOM 0 HB2 LYS B 31 19.611 -7.705 1.686 1.00 0.29 H new ATOM 0 HB3 LYS B 31 19.339 -6.020 1.286 1.00 0.29 H new ATOM 0 HG2 LYS B 31 18.280 -5.721 3.557 1.00 0.40 H new ATOM 0 HG3 LYS B 31 18.745 -7.366 3.939 1.00 0.40 H new ATOM 0 HD2 LYS B 31 20.654 -5.128 3.150 1.00 0.49 H new ATOM 0 HD3 LYS B 31 20.396 -5.716 4.781 1.00 0.49 H new ATOM 0 HE2 LYS B 31 21.445 -7.397 2.467 1.00 1.20 H new ATOM 0 HE3 LYS B 31 22.442 -6.670 3.711 1.00 1.20 H new ATOM 0 HZ1 LYS B 31 22.140 -8.583 4.780 1.00 1.72 H new ATOM 0 HZ2 LYS B 31 20.585 -8.014 5.155 1.00 1.72 H new ATOM 0 HZ3 LYS B 31 20.815 -9.039 3.821 1.00 1.72 H new ATOM 2765 N SER B 32 18.218 -8.472 -0.593 1.00 0.25 N ATOM 2766 CA SER B 32 18.448 -8.698 -2.018 1.00 0.27 C ATOM 2767 C SER B 32 17.139 -8.817 -2.801 1.00 0.24 C ATOM 2768 O SER B 32 17.033 -8.317 -3.924 1.00 0.27 O ATOM 2769 CB SER B 32 19.297 -9.953 -2.223 1.00 0.35 C ATOM 2770 OG SER B 32 18.704 -11.084 -1.600 1.00 1.27 O ATOM 0 H SER B 32 18.565 -9.216 0.013 1.00 0.25 H new ATOM 0 HA SER B 32 18.982 -7.829 -2.403 1.00 0.27 H new ATOM 0 HB2 SER B 32 19.417 -10.144 -3.290 1.00 0.35 H new ATOM 0 HB3 SER B 32 20.294 -9.791 -1.814 1.00 0.35 H new ATOM 0 HG SER B 32 18.004 -11.448 -2.181 1.00 1.27 H new ATOM 2776 N GLU B 33 16.143 -9.456 -2.201 1.00 0.25 N ATOM 2777 CA GLU B 33 14.884 -9.710 -2.888 1.00 0.27 C ATOM 2778 C GLU B 33 14.130 -8.408 -3.076 1.00 0.24 C ATOM 2779 O GLU B 33 13.608 -8.124 -4.154 1.00 0.26 O ATOM 2780 CB GLU B 33 14.025 -10.704 -2.105 1.00 0.34 C ATOM 2781 CG GLU B 33 14.774 -11.949 -1.664 1.00 0.47 C ATOM 2782 CD GLU B 33 15.570 -12.588 -2.784 1.00 0.83 C ATOM 2783 OE1 GLU B 33 15.024 -13.458 -3.488 1.00 1.65 O ATOM 2784 OE2 GLU B 33 16.755 -12.227 -2.952 1.00 1.43 O ATOM 0 H GLU B 33 16.182 -9.807 -1.244 1.00 0.25 H new ATOM 0 HA GLU B 33 15.105 -10.145 -3.863 1.00 0.27 H new ATOM 0 HB2 GLU B 33 13.620 -10.205 -1.225 1.00 0.34 H new ATOM 0 HB3 GLU B 33 13.177 -11.001 -2.722 1.00 0.34 H new ATOM 0 HG2 GLU B 33 15.449 -11.691 -0.848 1.00 0.47 H new ATOM 0 HG3 GLU B 33 14.062 -12.675 -1.272 1.00 0.47 H new ATOM 2791 N LEU B 34 14.094 -7.614 -2.016 1.00 0.21 N ATOM 2792 CA LEU B 34 13.474 -6.307 -2.072 1.00 0.21 C ATOM 2793 C LEU B 34 14.226 -5.398 -3.024 1.00 0.20 C ATOM 2794 O LEU B 34 13.615 -4.693 -3.822 1.00 0.24 O ATOM 2795 CB LEU B 34 13.422 -5.680 -0.682 1.00 0.21 C ATOM 2796 CG LEU B 34 12.232 -6.100 0.164 1.00 0.21 C ATOM 2797 CD1 LEU B 34 12.434 -5.679 1.610 1.00 0.24 C ATOM 2798 CD2 LEU B 34 10.962 -5.482 -0.402 1.00 0.21 C ATOM 0 H LEU B 34 14.489 -7.856 -1.107 1.00 0.21 H new ATOM 0 HA LEU B 34 12.455 -6.430 -2.440 1.00 0.21 H new ATOM 0 HB2 LEU B 34 14.337 -5.937 -0.149 1.00 0.21 H new ATOM 0 HB3 LEU B 34 13.409 -4.595 -0.789 1.00 0.21 H new ATOM 0 HG LEU B 34 12.140 -7.186 0.138 1.00 0.21 H new ATOM 0 HD11 LEU B 34 11.573 -5.987 2.202 1.00 0.24 H new ATOM 0 HD12 LEU B 34 13.334 -6.152 2.004 1.00 0.24 H new ATOM 0 HD13 LEU B 34 12.541 -4.596 1.662 1.00 0.24 H new ATOM 0 HD21 LEU B 34 10.109 -5.784 0.205 1.00 0.21 H new ATOM 0 HD22 LEU B 34 11.050 -4.396 -0.391 1.00 0.21 H new ATOM 0 HD23 LEU B 34 10.817 -5.823 -1.427 1.00 0.21 H new ATOM 2810 N LYS B 35 15.551 -5.433 -2.948 1.00 0.21 N ATOM 2811 CA LYS B 35 16.378 -4.586 -3.791 1.00 0.26 C ATOM 2812 C LYS B 35 16.049 -4.793 -5.253 1.00 0.22 C ATOM 2813 O LYS B 35 15.712 -3.843 -5.947 1.00 0.24 O ATOM 2814 CB LYS B 35 17.868 -4.838 -3.561 1.00 0.37 C ATOM 2815 CG LYS B 35 18.747 -3.894 -4.363 1.00 0.54 C ATOM 2816 CD LYS B 35 20.165 -3.827 -3.811 1.00 0.68 C ATOM 2817 CE LYS B 35 20.955 -5.080 -4.126 1.00 0.61 C ATOM 2818 NZ LYS B 35 22.330 -5.024 -3.563 1.00 0.95 N ATOM 0 H LYS B 35 16.072 -6.037 -2.313 1.00 0.21 H new ATOM 0 HA LYS B 35 16.158 -3.554 -3.516 1.00 0.26 H new ATOM 0 HB2 LYS B 35 18.093 -4.726 -2.500 1.00 0.37 H new ATOM 0 HB3 LYS B 35 18.105 -5.867 -3.830 1.00 0.37 H new ATOM 0 HG2 LYS B 35 18.778 -4.222 -5.402 1.00 0.54 H new ATOM 0 HG3 LYS B 35 18.308 -2.896 -4.356 1.00 0.54 H new ATOM 0 HD2 LYS B 35 20.677 -2.961 -4.230 1.00 0.68 H new ATOM 0 HD3 LYS B 35 20.128 -3.684 -2.731 1.00 0.68 H new ATOM 0 HE2 LYS B 35 20.433 -5.949 -3.724 1.00 0.61 H new ATOM 0 HE3 LYS B 35 21.010 -5.213 -5.207 1.00 0.61 H new ATOM 0 HZ1 LYS B 35 22.838 -5.900 -3.800 1.00 0.95 H new ATOM 0 HZ2 LYS B 35 22.837 -4.210 -3.965 1.00 0.95 H new ATOM 0 HZ3 LYS B 35 22.278 -4.923 -2.529 1.00 0.95 H new ATOM 2832 N GLU B 36 16.120 -6.032 -5.714 1.00 0.22 N ATOM 2833 CA GLU B 36 15.869 -6.325 -7.113 1.00 0.24 C ATOM 2834 C GLU B 36 14.458 -5.897 -7.497 1.00 0.25 C ATOM 2835 O GLU B 36 14.236 -5.323 -8.565 1.00 0.32 O ATOM 2836 CB GLU B 36 16.042 -7.805 -7.397 1.00 0.28 C ATOM 2837 CG GLU B 36 16.301 -8.087 -8.859 1.00 0.65 C ATOM 2838 CD GLU B 36 16.402 -9.564 -9.173 1.00 0.77 C ATOM 2839 OE1 GLU B 36 17.446 -10.171 -8.853 1.00 1.30 O ATOM 2840 OE2 GLU B 36 15.456 -10.120 -9.769 1.00 1.48 O ATOM 0 H GLU B 36 16.348 -6.845 -5.142 1.00 0.22 H new ATOM 0 HA GLU B 36 16.593 -5.767 -7.707 1.00 0.24 H new ATOM 0 HB2 GLU B 36 16.871 -8.191 -6.803 1.00 0.28 H new ATOM 0 HB3 GLU B 36 15.147 -8.340 -7.080 1.00 0.28 H new ATOM 0 HG2 GLU B 36 15.499 -7.650 -9.454 1.00 0.65 H new ATOM 0 HG3 GLU B 36 17.226 -7.594 -9.159 1.00 0.65 H new ATOM 2847 N LEU B 37 13.516 -6.169 -6.607 1.00 0.23 N ATOM 2848 CA LEU B 37 12.126 -5.788 -6.804 1.00 0.26 C ATOM 2849 C LEU B 37 12.027 -4.279 -7.030 1.00 0.22 C ATOM 2850 O LEU B 37 11.417 -3.820 -8.000 1.00 0.22 O ATOM 2851 CB LEU B 37 11.314 -6.211 -5.580 1.00 0.32 C ATOM 2852 CG LEU B 37 9.802 -6.295 -5.772 1.00 0.41 C ATOM 2853 CD1 LEU B 37 9.245 -7.484 -5.006 1.00 0.34 C ATOM 2854 CD2 LEU B 37 9.130 -5.015 -5.307 1.00 0.74 C ATOM 0 H LEU B 37 13.693 -6.659 -5.730 1.00 0.23 H new ATOM 0 HA LEU B 37 11.724 -6.289 -7.685 1.00 0.26 H new ATOM 0 HB2 LEU B 37 11.673 -7.186 -5.251 1.00 0.32 H new ATOM 0 HB3 LEU B 37 11.519 -5.507 -4.773 1.00 0.32 H new ATOM 0 HG LEU B 37 9.596 -6.426 -6.834 1.00 0.41 H new ATOM 0 HD11 LEU B 37 8.166 -7.536 -5.149 1.00 0.34 H new ATOM 0 HD12 LEU B 37 9.704 -8.401 -5.374 1.00 0.34 H new ATOM 0 HD13 LEU B 37 9.465 -7.369 -3.945 1.00 0.34 H new ATOM 0 HD21 LEU B 37 8.053 -5.096 -5.453 1.00 0.74 H new ATOM 0 HD22 LEU B 37 9.342 -4.856 -4.250 1.00 0.74 H new ATOM 0 HD23 LEU B 37 9.512 -4.173 -5.884 1.00 0.74 H new ATOM 2866 N LEU B 38 12.664 -3.520 -6.148 1.00 0.19 N ATOM 2867 CA LEU B 38 12.680 -2.069 -6.250 1.00 0.19 C ATOM 2868 C LEU B 38 13.491 -1.597 -7.462 1.00 0.19 C ATOM 2869 O LEU B 38 13.084 -0.681 -8.156 1.00 0.21 O ATOM 2870 CB LEU B 38 13.226 -1.441 -4.961 1.00 0.19 C ATOM 2871 CG LEU B 38 12.211 -1.269 -3.821 1.00 0.19 C ATOM 2872 CD1 LEU B 38 12.617 -2.091 -2.610 1.00 0.20 C ATOM 2873 CD2 LEU B 38 12.081 0.201 -3.444 1.00 0.20 C ATOM 0 H LEU B 38 13.179 -3.890 -5.349 1.00 0.19 H new ATOM 0 HA LEU B 38 11.651 -1.739 -6.391 1.00 0.19 H new ATOM 0 HB2 LEU B 38 14.050 -2.057 -4.599 1.00 0.19 H new ATOM 0 HB3 LEU B 38 13.642 -0.463 -5.203 1.00 0.19 H new ATOM 0 HG LEU B 38 11.242 -1.628 -4.169 1.00 0.19 H new ATOM 0 HD11 LEU B 38 11.884 -1.954 -1.815 1.00 0.20 H new ATOM 0 HD12 LEU B 38 12.662 -3.145 -2.884 1.00 0.20 H new ATOM 0 HD13 LEU B 38 13.597 -1.765 -2.261 1.00 0.20 H new ATOM 0 HD21 LEU B 38 11.358 0.307 -2.635 1.00 0.20 H new ATOM 0 HD22 LEU B 38 13.049 0.580 -3.117 1.00 0.20 H new ATOM 0 HD23 LEU B 38 11.742 0.770 -4.310 1.00 0.20 H new ATOM 2885 N THR B 39 14.624 -2.232 -7.734 1.00 0.20 N ATOM 2886 CA THR B 39 15.480 -1.813 -8.847 1.00 0.22 C ATOM 2887 C THR B 39 14.756 -1.921 -10.185 1.00 0.23 C ATOM 2888 O THR B 39 14.993 -1.129 -11.099 1.00 0.27 O ATOM 2889 CB THR B 39 16.787 -2.633 -8.929 1.00 0.25 C ATOM 2890 OG1 THR B 39 16.502 -4.027 -9.099 1.00 0.30 O ATOM 2891 CG2 THR B 39 17.628 -2.443 -7.684 1.00 0.27 C ATOM 0 H THR B 39 14.973 -3.033 -7.207 1.00 0.20 H new ATOM 0 HA THR B 39 15.730 -0.771 -8.647 1.00 0.22 H new ATOM 0 HB THR B 39 17.346 -2.272 -9.792 1.00 0.25 H new ATOM 0 HG1 THR B 39 15.549 -4.188 -8.938 1.00 0.30 H new ATOM 0 HG21 THR B 39 18.542 -3.031 -7.769 1.00 0.27 H new ATOM 0 HG22 THR B 39 17.884 -1.389 -7.575 1.00 0.27 H new ATOM 0 HG23 THR B 39 17.065 -2.772 -6.811 1.00 0.27 H new ATOM 2899 N ARG B 40 13.877 -2.905 -10.296 1.00 0.24 N ATOM 2900 CA ARG B 40 13.173 -3.152 -11.541 1.00 0.27 C ATOM 2901 C ARG B 40 11.858 -2.384 -11.597 1.00 0.27 C ATOM 2902 O ARG B 40 11.622 -1.607 -12.519 1.00 0.30 O ATOM 2903 CB ARG B 40 12.908 -4.649 -11.718 1.00 0.31 C ATOM 2904 CG ARG B 40 14.165 -5.507 -11.722 1.00 0.34 C ATOM 2905 CD ARG B 40 15.220 -4.972 -12.679 1.00 0.44 C ATOM 2906 NE ARG B 40 14.714 -4.832 -14.044 1.00 0.64 N ATOM 2907 CZ ARG B 40 15.127 -3.895 -14.898 1.00 0.87 C ATOM 2908 NH1 ARG B 40 16.058 -3.019 -14.532 1.00 1.22 N ATOM 2909 NH2 ARG B 40 14.618 -3.841 -16.123 1.00 1.06 N ATOM 0 H ARG B 40 13.635 -3.544 -9.539 1.00 0.24 H new ATOM 0 HA ARG B 40 13.808 -2.802 -12.354 1.00 0.27 H new ATOM 0 HB2 ARG B 40 12.252 -4.988 -10.916 1.00 0.31 H new ATOM 0 HB3 ARG B 40 12.372 -4.804 -12.655 1.00 0.31 H new ATOM 0 HG2 ARG B 40 14.578 -5.549 -10.714 1.00 0.34 H new ATOM 0 HG3 ARG B 40 13.906 -6.528 -12.003 1.00 0.34 H new ATOM 0 HD2 ARG B 40 15.572 -4.003 -12.323 1.00 0.44 H new ATOM 0 HD3 ARG B 40 16.079 -5.642 -12.680 1.00 0.44 H new ATOM 0 HE ARG B 40 14.003 -5.490 -14.362 1.00 0.64 H new ATOM 0 HH11 ARG B 40 16.459 -3.062 -13.595 1.00 1.22 H new ATOM 0 HH12 ARG B 40 16.371 -2.304 -15.188 1.00 1.22 H new ATOM 0 HH21 ARG B 40 13.910 -4.517 -16.411 1.00 1.06 H new ATOM 0 HH22 ARG B 40 14.935 -3.124 -16.776 1.00 1.06 H new ATOM 2923 N GLU B 41 11.003 -2.604 -10.610 1.00 0.27 N ATOM 2924 CA GLU B 41 9.648 -2.079 -10.655 1.00 0.30 C ATOM 2925 C GLU B 41 9.446 -0.830 -9.805 1.00 0.34 C ATOM 2926 O GLU B 41 8.399 -0.210 -9.879 1.00 0.46 O ATOM 2927 CB GLU B 41 8.657 -3.162 -10.264 1.00 0.36 C ATOM 2928 CG GLU B 41 8.252 -4.036 -11.437 1.00 0.45 C ATOM 2929 CD GLU B 41 7.573 -5.312 -11.001 1.00 0.83 C ATOM 2930 OE1 GLU B 41 6.415 -5.245 -10.544 1.00 1.54 O ATOM 2931 OE2 GLU B 41 8.198 -6.388 -11.134 1.00 1.59 O ATOM 0 H GLU B 41 11.223 -3.141 -9.771 1.00 0.27 H new ATOM 0 HA GLU B 41 9.469 -1.769 -11.685 1.00 0.30 H new ATOM 0 HB2 GLU B 41 9.096 -3.786 -9.485 1.00 0.36 H new ATOM 0 HB3 GLU B 41 7.768 -2.698 -9.838 1.00 0.36 H new ATOM 0 HG2 GLU B 41 7.581 -3.476 -12.089 1.00 0.45 H new ATOM 0 HG3 GLU B 41 9.136 -4.282 -12.025 1.00 0.45 H new ATOM 2938 N LEU B 42 10.421 -0.459 -8.989 1.00 0.27 N ATOM 2939 CA LEU B 42 10.302 0.780 -8.214 1.00 0.28 C ATOM 2940 C LEU B 42 11.547 1.662 -8.353 1.00 0.27 C ATOM 2941 O LEU B 42 11.974 2.273 -7.374 1.00 0.26 O ATOM 2942 CB LEU B 42 10.087 0.483 -6.721 1.00 0.27 C ATOM 2943 CG LEU B 42 8.849 -0.342 -6.363 1.00 0.27 C ATOM 2944 CD1 LEU B 42 9.097 -1.814 -6.607 1.00 0.26 C ATOM 2945 CD2 LEU B 42 8.453 -0.101 -4.918 1.00 0.32 C ATOM 0 H LEU B 42 11.286 -0.979 -8.843 1.00 0.27 H new ATOM 0 HA LEU B 42 9.439 1.310 -8.617 1.00 0.28 H new ATOM 0 HB2 LEU B 42 10.967 -0.041 -6.347 1.00 0.27 H new ATOM 0 HB3 LEU B 42 10.031 1.432 -6.188 1.00 0.27 H new ATOM 0 HG LEU B 42 8.028 -0.025 -7.005 1.00 0.27 H new ATOM 0 HD11 LEU B 42 8.204 -2.382 -6.346 1.00 0.26 H new ATOM 0 HD12 LEU B 42 9.334 -1.974 -7.659 1.00 0.26 H new ATOM 0 HD13 LEU B 42 9.932 -2.149 -5.992 1.00 0.26 H new ATOM 0 HD21 LEU B 42 7.571 -0.695 -4.679 1.00 0.32 H new ATOM 0 HD22 LEU B 42 9.274 -0.391 -4.263 1.00 0.32 H new ATOM 0 HD23 LEU B 42 8.229 0.956 -4.774 1.00 0.32 H new ATOM 2957 N PRO B 43 12.131 1.799 -9.562 1.00 0.31 N ATOM 2958 CA PRO B 43 13.416 2.473 -9.704 1.00 0.33 C ATOM 2959 C PRO B 43 13.276 3.979 -9.546 1.00 0.33 C ATOM 2960 O PRO B 43 14.239 4.678 -9.230 1.00 0.36 O ATOM 2961 CB PRO B 43 13.860 2.108 -11.115 1.00 0.41 C ATOM 2962 CG PRO B 43 12.595 1.874 -11.870 1.00 0.51 C ATOM 2963 CD PRO B 43 11.580 1.381 -10.869 1.00 0.35 C ATOM 0 HA PRO B 43 14.133 2.170 -8.942 1.00 0.33 H new ATOM 0 HB2 PRO B 43 14.445 2.910 -11.564 1.00 0.41 H new ATOM 0 HB3 PRO B 43 14.489 1.218 -11.113 1.00 0.41 H new ATOM 0 HG2 PRO B 43 12.253 2.792 -12.348 1.00 0.51 H new ATOM 0 HG3 PRO B 43 12.746 1.140 -12.662 1.00 0.51 H new ATOM 0 HD2 PRO B 43 10.599 1.820 -11.047 1.00 0.35 H new ATOM 0 HD3 PRO B 43 11.459 0.299 -10.923 1.00 0.35 H new ATOM 2971 N SER B 44 12.062 4.466 -9.756 1.00 0.36 N ATOM 2972 CA SER B 44 11.752 5.869 -9.560 1.00 0.39 C ATOM 2973 C SER B 44 11.755 6.196 -8.074 1.00 0.35 C ATOM 2974 O SER B 44 12.240 7.245 -7.655 1.00 0.40 O ATOM 2975 CB SER B 44 10.381 6.186 -10.150 1.00 0.46 C ATOM 2976 OG SER B 44 10.270 5.699 -11.478 1.00 1.09 O ATOM 0 H SER B 44 11.271 3.902 -10.065 1.00 0.36 H new ATOM 0 HA SER B 44 12.508 6.472 -10.063 1.00 0.39 H new ATOM 0 HB2 SER B 44 9.603 5.740 -9.530 1.00 0.46 H new ATOM 0 HB3 SER B 44 10.218 7.264 -10.140 1.00 0.46 H new ATOM 0 HG SER B 44 9.590 4.994 -11.512 1.00 1.09 H new ATOM 2982 N PHE B 45 11.231 5.266 -7.280 1.00 0.30 N ATOM 2983 CA PHE B 45 11.081 5.463 -5.847 1.00 0.28 C ATOM 2984 C PHE B 45 12.365 5.118 -5.121 1.00 0.28 C ATOM 2985 O PHE B 45 12.339 4.735 -3.964 1.00 0.27 O ATOM 2986 CB PHE B 45 9.945 4.597 -5.294 1.00 0.31 C ATOM 2987 CG PHE B 45 8.713 4.580 -6.145 1.00 0.28 C ATOM 2988 CD1 PHE B 45 8.071 5.753 -6.507 1.00 1.28 C ATOM 2989 CD2 PHE B 45 8.189 3.373 -6.573 1.00 1.17 C ATOM 2990 CE1 PHE B 45 6.929 5.716 -7.280 1.00 1.34 C ATOM 2991 CE2 PHE B 45 7.051 3.332 -7.346 1.00 1.18 C ATOM 2992 CZ PHE B 45 6.420 4.501 -7.701 1.00 0.47 C ATOM 0 H PHE B 45 10.901 4.360 -7.613 1.00 0.30 H new ATOM 0 HA PHE B 45 10.844 6.514 -5.683 1.00 0.28 H new ATOM 0 HB2 PHE B 45 10.306 3.575 -5.178 1.00 0.31 H new ATOM 0 HB3 PHE B 45 9.681 4.957 -4.300 1.00 0.31 H new ATOM 0 HD1 PHE B 45 8.467 6.703 -6.182 1.00 1.28 H new ATOM 0 HD2 PHE B 45 8.679 2.451 -6.297 1.00 1.17 H new ATOM 0 HE1 PHE B 45 6.433 6.635 -7.556 1.00 1.34 H new ATOM 0 HE2 PHE B 45 6.654 2.383 -7.673 1.00 1.18 H new ATOM 0 HZ PHE B 45 5.527 4.470 -8.308 1.00 0.47 H new ATOM 3002 N LEU B 46 13.489 5.253 -5.788 1.00 0.32 N ATOM 3003 CA LEU B 46 14.760 5.080 -5.120 1.00 0.33 C ATOM 3004 C LEU B 46 15.346 6.448 -4.791 1.00 0.39 C ATOM 3005 O LEU B 46 16.098 6.601 -3.831 1.00 0.47 O ATOM 3006 CB LEU B 46 15.720 4.244 -5.978 1.00 0.35 C ATOM 3007 CG LEU B 46 15.165 2.880 -6.416 1.00 0.32 C ATOM 3008 CD1 LEU B 46 16.243 2.058 -7.110 1.00 0.41 C ATOM 3009 CD2 LEU B 46 14.595 2.121 -5.226 1.00 0.30 C ATOM 0 H LEU B 46 13.550 5.479 -6.781 1.00 0.32 H new ATOM 0 HA LEU B 46 14.609 4.533 -4.189 1.00 0.33 H new ATOM 0 HB2 LEU B 46 15.984 4.817 -6.867 1.00 0.35 H new ATOM 0 HB3 LEU B 46 16.641 4.084 -5.418 1.00 0.35 H new ATOM 0 HG LEU B 46 14.357 3.055 -7.127 1.00 0.32 H new ATOM 0 HD11 LEU B 46 15.829 1.096 -7.412 1.00 0.41 H new ATOM 0 HD12 LEU B 46 16.598 2.593 -7.991 1.00 0.41 H new ATOM 0 HD13 LEU B 46 17.075 1.896 -6.424 1.00 0.41 H new ATOM 0 HD21 LEU B 46 14.208 1.158 -5.560 1.00 0.30 H new ATOM 0 HD22 LEU B 46 15.380 1.960 -4.487 1.00 0.30 H new ATOM 0 HD23 LEU B 46 13.788 2.701 -4.777 1.00 0.30 H new ATOM 3021 N GLY B 47 14.950 7.450 -5.575 1.00 0.41 N ATOM 3022 CA GLY B 47 15.445 8.816 -5.414 1.00 0.49 C ATOM 3023 C GLY B 47 16.927 8.968 -5.730 1.00 0.53 C ATOM 3024 O GLY B 47 17.359 10.002 -6.242 1.00 0.60 O ATOM 0 H GLY B 47 14.280 7.338 -6.336 1.00 0.41 H new ATOM 0 HA2 GLY B 47 14.874 9.480 -6.063 1.00 0.49 H new ATOM 0 HA3 GLY B 47 15.265 9.140 -4.389 1.00 0.49 H new ATOM 3028 N LYS B 48 17.691 7.935 -5.434 1.00 0.54 N ATOM 3029 CA LYS B 48 19.102 7.882 -5.757 1.00 0.67 C ATOM 3030 C LYS B 48 19.421 6.536 -6.396 1.00 0.70 C ATOM 3031 O LYS B 48 19.555 6.435 -7.615 1.00 1.18 O ATOM 3032 CB LYS B 48 19.936 8.090 -4.487 1.00 0.82 C ATOM 3033 CG LYS B 48 21.429 7.885 -4.680 1.00 1.41 C ATOM 3034 CD LYS B 48 22.170 7.966 -3.356 1.00 2.04 C ATOM 3035 CE LYS B 48 23.628 7.568 -3.505 1.00 2.61 C ATOM 3036 NZ LYS B 48 24.356 8.457 -4.447 1.00 3.21 N ATOM 0 H LYS B 48 17.346 7.101 -4.958 1.00 0.54 H new ATOM 0 HA LYS B 48 19.349 8.676 -6.462 1.00 0.67 H new ATOM 0 HB2 LYS B 48 19.765 9.100 -4.115 1.00 0.82 H new ATOM 0 HB3 LYS B 48 19.583 7.403 -3.718 1.00 0.82 H new ATOM 0 HG2 LYS B 48 21.609 6.914 -5.142 1.00 1.41 H new ATOM 0 HG3 LYS B 48 21.817 8.640 -5.364 1.00 1.41 H new ATOM 0 HD2 LYS B 48 22.108 8.982 -2.965 1.00 2.04 H new ATOM 0 HD3 LYS B 48 21.687 7.314 -2.628 1.00 2.04 H new ATOM 0 HE2 LYS B 48 24.113 7.599 -2.530 1.00 2.61 H new ATOM 0 HE3 LYS B 48 23.688 6.539 -3.859 1.00 2.61 H new ATOM 0 HZ1 LYS B 48 25.367 8.214 -4.442 1.00 3.21 H new ATOM 0 HZ2 LYS B 48 23.975 8.332 -5.407 1.00 3.21 H new ATOM 0 HZ3 LYS B 48 24.236 9.447 -4.153 1.00 3.21 H new ATOM 3050 N ARG B 49 19.485 5.507 -5.558 1.00 0.54 N ATOM 3051 CA ARG B 49 19.773 4.146 -5.989 1.00 0.54 C ATOM 3052 C ARG B 49 19.929 3.265 -4.761 1.00 0.51 C ATOM 3053 O ARG B 49 20.353 3.739 -3.708 1.00 0.55 O ATOM 3054 CB ARG B 49 21.056 4.080 -6.833 1.00 0.66 C ATOM 3055 CG ARG B 49 21.372 2.686 -7.360 1.00 0.74 C ATOM 3056 CD ARG B 49 20.278 2.176 -8.286 1.00 0.73 C ATOM 3057 NE ARG B 49 20.295 2.847 -9.584 1.00 1.28 N ATOM 3058 CZ ARG B 49 19.516 2.504 -10.612 1.00 1.46 C ATOM 3059 NH1 ARG B 49 18.643 1.508 -10.488 1.00 1.43 N ATOM 3060 NH2 ARG B 49 19.621 3.151 -11.764 1.00 2.26 N ATOM 0 H ARG B 49 19.337 5.596 -4.553 1.00 0.54 H new ATOM 0 HA ARG B 49 18.947 3.798 -6.609 1.00 0.54 H new ATOM 0 HB2 ARG B 49 20.961 4.764 -7.676 1.00 0.66 H new ATOM 0 HB3 ARG B 49 21.895 4.430 -6.231 1.00 0.66 H new ATOM 0 HG2 ARG B 49 22.322 2.705 -7.894 1.00 0.74 H new ATOM 0 HG3 ARG B 49 21.491 1.998 -6.523 1.00 0.74 H new ATOM 0 HD2 ARG B 49 20.400 1.103 -8.432 1.00 0.73 H new ATOM 0 HD3 ARG B 49 19.307 2.325 -7.815 1.00 0.73 H new ATOM 0 HE ARG B 49 20.942 3.625 -9.712 1.00 1.28 H new ATOM 0 HH11 ARG B 49 18.567 1.003 -9.605 1.00 1.43 H new ATOM 0 HH12 ARG B 49 18.049 1.249 -11.276 1.00 1.43 H new ATOM 0 HH21 ARG B 49 20.296 3.909 -11.863 1.00 2.26 H new ATOM 0 HH22 ARG B 49 19.027 2.891 -12.551 1.00 2.26 H new ATOM 3074 N THR B 50 19.571 1.998 -4.890 1.00 0.51 N ATOM 3075 CA THR B 50 19.740 1.051 -3.808 1.00 0.51 C ATOM 3076 C THR B 50 21.220 0.802 -3.534 1.00 0.61 C ATOM 3077 O THR B 50 21.875 0.036 -4.244 1.00 0.82 O ATOM 3078 CB THR B 50 19.042 -0.276 -4.139 1.00 0.57 C ATOM 3079 OG1 THR B 50 19.395 -0.681 -5.469 1.00 0.69 O ATOM 3080 CG2 THR B 50 17.530 -0.142 -4.028 1.00 0.57 C ATOM 0 H THR B 50 19.161 1.604 -5.737 1.00 0.51 H new ATOM 0 HA THR B 50 19.285 1.477 -2.914 1.00 0.51 H new ATOM 0 HB THR B 50 19.371 -1.028 -3.422 1.00 0.57 H new ATOM 0 HG1 THR B 50 20.368 -0.631 -5.579 1.00 0.69 H new ATOM 0 HG21 THR B 50 17.062 -1.097 -4.268 1.00 0.57 H new ATOM 0 HG22 THR B 50 17.264 0.148 -3.011 1.00 0.57 H new ATOM 0 HG23 THR B 50 17.180 0.619 -4.725 1.00 0.57 H new ATOM 3088 N ASP B 51 21.742 1.476 -2.522 1.00 0.58 N ATOM 3089 CA ASP B 51 23.135 1.321 -2.131 1.00 0.72 C ATOM 3090 C ASP B 51 23.251 0.220 -1.088 1.00 0.60 C ATOM 3091 O ASP B 51 22.246 -0.223 -0.542 1.00 0.58 O ATOM 3092 CB ASP B 51 23.676 2.639 -1.572 1.00 0.91 C ATOM 3093 CG ASP B 51 25.179 2.646 -1.406 1.00 1.35 C ATOM 3094 OD1 ASP B 51 25.895 2.775 -2.420 1.00 1.98 O ATOM 3095 OD2 ASP B 51 25.651 2.512 -0.259 1.00 1.91 O ATOM 0 H ASP B 51 21.218 2.140 -1.952 1.00 0.58 H new ATOM 0 HA ASP B 51 23.725 1.048 -3.006 1.00 0.72 H new ATOM 0 HB2 ASP B 51 23.387 3.453 -2.236 1.00 0.91 H new ATOM 0 HB3 ASP B 51 23.210 2.835 -0.606 1.00 0.91 H new ATOM 3100 N GLU B 52 24.468 -0.191 -0.791 1.00 0.68 N ATOM 3101 CA GLU B 52 24.697 -1.321 0.102 1.00 0.66 C ATOM 3102 C GLU B 52 24.742 -0.868 1.554 1.00 0.55 C ATOM 3103 O GLU B 52 24.029 -1.406 2.404 1.00 0.50 O ATOM 3104 CB GLU B 52 25.990 -2.036 -0.276 1.00 0.83 C ATOM 3105 CG GLU B 52 25.903 -2.757 -1.608 1.00 1.57 C ATOM 3106 CD GLU B 52 27.231 -3.327 -2.051 1.00 2.22 C ATOM 3107 OE1 GLU B 52 27.663 -4.357 -1.490 1.00 2.79 O ATOM 3108 OE2 GLU B 52 27.848 -2.747 -2.966 1.00 2.89 O ATOM 0 H GLU B 52 25.319 0.239 -1.154 1.00 0.68 H new ATOM 0 HA GLU B 52 23.866 -2.018 -0.006 1.00 0.66 H new ATOM 0 HB2 GLU B 52 26.802 -1.310 -0.315 1.00 0.83 H new ATOM 0 HB3 GLU B 52 26.242 -2.755 0.504 1.00 0.83 H new ATOM 0 HG2 GLU B 52 25.173 -3.563 -1.533 1.00 1.57 H new ATOM 0 HG3 GLU B 52 25.538 -2.066 -2.367 1.00 1.57 H new ATOM 3115 N ALA B 53 25.562 0.138 1.834 1.00 0.58 N ATOM 3116 CA ALA B 53 25.650 0.706 3.173 1.00 0.58 C ATOM 3117 C ALA B 53 24.321 1.341 3.573 1.00 0.53 C ATOM 3118 O ALA B 53 24.053 1.572 4.752 1.00 0.58 O ATOM 3119 CB ALA B 53 26.772 1.732 3.241 1.00 0.70 C ATOM 0 H ALA B 53 26.177 0.578 1.149 1.00 0.58 H new ATOM 0 HA ALA B 53 25.872 -0.097 3.875 1.00 0.58 H new ATOM 0 HB1 ALA B 53 26.825 2.147 4.247 1.00 0.70 H new ATOM 0 HB2 ALA B 53 27.719 1.252 2.996 1.00 0.70 H new ATOM 0 HB3 ALA B 53 26.576 2.533 2.528 1.00 0.70 H new ATOM 3125 N ALA B 54 23.498 1.622 2.575 1.00 0.52 N ATOM 3126 CA ALA B 54 22.168 2.157 2.804 1.00 0.51 C ATOM 3127 C ALA B 54 21.148 1.041 2.943 1.00 0.39 C ATOM 3128 O ALA B 54 20.204 1.154 3.710 1.00 0.35 O ATOM 3129 CB ALA B 54 21.764 3.062 1.666 1.00 0.63 C ATOM 0 H ALA B 54 23.732 1.487 1.591 1.00 0.52 H new ATOM 0 HA ALA B 54 22.194 2.727 3.733 1.00 0.51 H new ATOM 0 HB1 ALA B 54 20.765 3.456 1.851 1.00 0.63 H new ATOM 0 HB2 ALA B 54 22.471 3.888 1.589 1.00 0.63 H new ATOM 0 HB3 ALA B 54 21.764 2.497 0.734 1.00 0.63 H new ATOM 3135 N PHE B 55 21.325 -0.033 2.185 1.00 0.38 N ATOM 3136 CA PHE B 55 20.367 -1.134 2.211 1.00 0.32 C ATOM 3137 C PHE B 55 20.429 -1.892 3.531 1.00 0.31 C ATOM 3138 O PHE B 55 19.425 -2.445 3.986 1.00 0.31 O ATOM 3139 CB PHE B 55 20.582 -2.099 1.049 1.00 0.41 C ATOM 3140 CG PHE B 55 19.287 -2.607 0.494 1.00 0.36 C ATOM 3141 CD1 PHE B 55 18.471 -3.433 1.247 1.00 1.23 C ATOM 3142 CD2 PHE B 55 18.872 -2.234 -0.770 1.00 1.25 C ATOM 3143 CE1 PHE B 55 17.265 -3.879 0.750 1.00 1.30 C ATOM 3144 CE2 PHE B 55 17.670 -2.680 -1.274 1.00 1.22 C ATOM 3145 CZ PHE B 55 16.863 -3.502 -0.512 1.00 0.46 C ATOM 0 H PHE B 55 22.113 -0.167 1.551 1.00 0.38 H new ATOM 0 HA PHE B 55 19.377 -0.690 2.108 1.00 0.32 H new ATOM 0 HB2 PHE B 55 21.142 -1.597 0.260 1.00 0.41 H new ATOM 0 HB3 PHE B 55 21.188 -2.941 1.384 1.00 0.41 H new ATOM 0 HD1 PHE B 55 18.783 -3.732 2.237 1.00 1.23 H new ATOM 0 HD2 PHE B 55 19.496 -1.587 -1.369 1.00 1.25 H new ATOM 0 HE1 PHE B 55 16.637 -4.522 1.349 1.00 1.30 H new ATOM 0 HE2 PHE B 55 17.358 -2.387 -2.266 1.00 1.22 H new ATOM 0 HZ PHE B 55 15.919 -3.848 -0.905 1.00 0.46 H new ATOM 3155 N GLN B 56 21.603 -1.907 4.152 1.00 0.35 N ATOM 3156 CA GLN B 56 21.744 -2.503 5.475 1.00 0.41 C ATOM 3157 C GLN B 56 20.958 -1.682 6.495 1.00 0.42 C ATOM 3158 O GLN B 56 20.670 -2.142 7.600 1.00 0.52 O ATOM 3159 CB GLN B 56 23.221 -2.618 5.868 1.00 0.51 C ATOM 3160 CG GLN B 56 23.949 -1.291 5.966 1.00 0.53 C ATOM 3161 CD GLN B 56 25.443 -1.459 6.177 1.00 0.69 C ATOM 3162 OE1 GLN B 56 26.008 -2.528 5.634 1.00 1.15 O flip ATOM 3163 NE2 GLN B 56 26.087 -0.628 6.815 1.00 1.53 N flip ATOM 0 H GLN B 56 22.463 -1.518 3.765 1.00 0.35 H new ATOM 0 HA GLN B 56 21.336 -3.513 5.455 1.00 0.41 H new ATOM 0 HB2 GLN B 56 23.290 -3.128 6.829 1.00 0.51 H new ATOM 0 HB3 GLN B 56 23.731 -3.245 5.137 1.00 0.51 H new ATOM 0 HG2 GLN B 56 23.777 -0.718 5.055 1.00 0.53 H new ATOM 0 HG3 GLN B 56 23.532 -0.712 6.790 1.00 0.53 H new ATOM 0 HE21 GLN B 56 25.616 0.182 7.218 1.00 1.53 H new ATOM 0 HE22 GLN B 56 27.092 -0.749 6.941 1.00 1.53 H new ATOM 3172 N LYS B 57 20.615 -0.458 6.103 1.00 0.36 N ATOM 3173 CA LYS B 57 19.683 0.369 6.850 1.00 0.39 C ATOM 3174 C LYS B 57 18.264 0.101 6.353 1.00 0.34 C ATOM 3175 O LYS B 57 17.357 -0.140 7.142 1.00 0.41 O ATOM 3176 CB LYS B 57 20.003 1.854 6.660 1.00 0.44 C ATOM 3177 CG LYS B 57 21.352 2.293 7.201 1.00 0.54 C ATOM 3178 CD LYS B 57 21.687 3.707 6.738 1.00 0.61 C ATOM 3179 CE LYS B 57 22.869 4.292 7.496 1.00 0.79 C ATOM 3180 NZ LYS B 57 22.593 4.400 8.953 1.00 1.27 N ATOM 0 H LYS B 57 20.977 -0.015 5.258 1.00 0.36 H new ATOM 0 HA LYS B 57 19.769 0.122 7.908 1.00 0.39 H new ATOM 0 HB2 LYS B 57 19.962 2.086 5.596 1.00 0.44 H new ATOM 0 HB3 LYS B 57 19.225 2.443 7.145 1.00 0.44 H new ATOM 0 HG2 LYS B 57 21.342 2.255 8.290 1.00 0.54 H new ATOM 0 HG3 LYS B 57 22.126 1.603 6.865 1.00 0.54 H new ATOM 0 HD2 LYS B 57 21.911 3.695 5.671 1.00 0.61 H new ATOM 0 HD3 LYS B 57 20.816 4.348 6.874 1.00 0.61 H new ATOM 0 HE2 LYS B 57 23.747 3.666 7.338 1.00 0.79 H new ATOM 0 HE3 LYS B 57 23.104 5.279 7.097 1.00 0.79 H new ATOM 0 HZ1 LYS B 57 23.288 5.037 9.392 1.00 1.27 H new ATOM 0 HZ2 LYS B 57 21.636 4.780 9.098 1.00 1.27 H new ATOM 0 HZ3 LYS B 57 22.662 3.459 9.390 1.00 1.27 H new ATOM 3194 N LEU B 58 18.109 0.127 5.026 1.00 0.27 N ATOM 3195 CA LEU B 58 16.810 -0.015 4.365 1.00 0.25 C ATOM 3196 C LEU B 58 16.014 -1.195 4.901 1.00 0.24 C ATOM 3197 O LEU B 58 14.884 -1.029 5.353 1.00 0.26 O ATOM 3198 CB LEU B 58 16.988 -0.177 2.852 1.00 0.22 C ATOM 3199 CG LEU B 58 15.681 -0.365 2.082 1.00 0.22 C ATOM 3200 CD1 LEU B 58 14.778 0.821 2.296 1.00 0.26 C ATOM 3201 CD2 LEU B 58 15.930 -0.546 0.600 1.00 0.23 C ATOM 0 H LEU B 58 18.887 0.248 4.377 1.00 0.27 H new ATOM 0 HA LEU B 58 16.252 0.897 4.579 1.00 0.25 H new ATOM 0 HB2 LEU B 58 17.503 0.701 2.462 1.00 0.22 H new ATOM 0 HB3 LEU B 58 17.634 -1.035 2.664 1.00 0.22 H new ATOM 0 HG LEU B 58 15.202 -1.267 2.462 1.00 0.22 H new ATOM 0 HD11 LEU B 58 13.850 0.676 1.743 1.00 0.26 H new ATOM 0 HD12 LEU B 58 14.555 0.922 3.358 1.00 0.26 H new ATOM 0 HD13 LEU B 58 15.274 1.725 1.942 1.00 0.26 H new ATOM 0 HD21 LEU B 58 14.979 -0.677 0.085 1.00 0.23 H new ATOM 0 HD22 LEU B 58 16.438 0.334 0.206 1.00 0.23 H new ATOM 0 HD23 LEU B 58 16.553 -1.426 0.441 1.00 0.23 H new ATOM 3213 N MET B 59 16.599 -2.380 4.830 1.00 0.24 N ATOM 3214 CA MET B 59 15.944 -3.587 5.324 1.00 0.27 C ATOM 3215 C MET B 59 15.440 -3.405 6.750 1.00 0.34 C ATOM 3216 O MET B 59 14.286 -3.700 7.049 1.00 0.41 O ATOM 3217 CB MET B 59 16.903 -4.772 5.250 1.00 0.28 C ATOM 3218 CG MET B 59 16.466 -5.974 6.072 1.00 0.30 C ATOM 3219 SD MET B 59 14.770 -6.494 5.745 1.00 0.31 S ATOM 3220 CE MET B 59 14.860 -6.880 4.006 1.00 0.25 C ATOM 0 H MET B 59 17.527 -2.535 4.435 1.00 0.24 H new ATOM 0 HA MET B 59 15.080 -3.784 4.689 1.00 0.27 H new ATOM 0 HB2 MET B 59 17.009 -5.076 4.209 1.00 0.28 H new ATOM 0 HB3 MET B 59 17.888 -4.451 5.590 1.00 0.28 H new ATOM 0 HG2 MET B 59 17.138 -6.807 5.868 1.00 0.30 H new ATOM 0 HG3 MET B 59 16.566 -5.735 7.131 1.00 0.30 H new ATOM 0 HE1 MET B 59 13.966 -7.429 3.708 1.00 0.25 H new ATOM 0 HE2 MET B 59 14.927 -5.956 3.431 1.00 0.25 H new ATOM 0 HE3 MET B 59 15.742 -7.491 3.814 1.00 0.25 H new ATOM 3230 N SER B 60 16.291 -2.886 7.618 1.00 0.39 N ATOM 3231 CA SER B 60 15.934 -2.716 9.015 1.00 0.51 C ATOM 3232 C SER B 60 15.009 -1.515 9.213 1.00 0.44 C ATOM 3233 O SER B 60 14.534 -1.258 10.319 1.00 0.51 O ATOM 3234 CB SER B 60 17.201 -2.575 9.853 1.00 0.70 C ATOM 3235 OG SER B 60 18.055 -1.572 9.328 1.00 1.36 O ATOM 0 H SER B 60 17.233 -2.575 7.380 1.00 0.39 H new ATOM 0 HA SER B 60 15.387 -3.599 9.344 1.00 0.51 H new ATOM 0 HB2 SER B 60 16.935 -2.328 10.881 1.00 0.70 H new ATOM 0 HB3 SER B 60 17.729 -3.528 9.881 1.00 0.70 H new ATOM 0 HG SER B 60 17.586 -1.080 8.622 1.00 1.36 H new ATOM 3241 N ASN B 61 14.767 -0.771 8.140 1.00 0.37 N ATOM 3242 CA ASN B 61 13.828 0.330 8.168 1.00 0.42 C ATOM 3243 C ASN B 61 12.461 -0.159 7.727 1.00 0.44 C ATOM 3244 O ASN B 61 11.446 0.483 7.974 1.00 0.64 O ATOM 3245 CB ASN B 61 14.311 1.487 7.298 1.00 0.46 C ATOM 3246 CG ASN B 61 15.373 2.328 7.984 1.00 0.47 C ATOM 3247 OD1 ASN B 61 16.137 1.837 8.815 1.00 0.96 O ATOM 3248 ND2 ASN B 61 15.422 3.607 7.650 1.00 0.92 N ATOM 0 H ASN B 61 15.215 -0.917 7.235 1.00 0.37 H new ATOM 0 HA ASN B 61 13.753 0.707 9.188 1.00 0.42 H new ATOM 0 HB2 ASN B 61 14.712 1.092 6.364 1.00 0.46 H new ATOM 0 HB3 ASN B 61 13.463 2.120 7.038 1.00 0.46 H new ATOM 0 HD21 ASN B 61 16.110 4.222 8.086 1.00 0.92 H new ATOM 0 HD22 ASN B 61 14.772 3.978 6.957 1.00 0.92 H new ATOM 3255 N LEU B 62 12.445 -1.303 7.055 1.00 0.33 N ATOM 3256 CA LEU B 62 11.200 -1.977 6.747 1.00 0.39 C ATOM 3257 C LEU B 62 10.887 -2.975 7.842 1.00 0.54 C ATOM 3258 O LEU B 62 9.979 -2.773 8.646 1.00 1.18 O ATOM 3259 CB LEU B 62 11.275 -2.700 5.401 1.00 0.35 C ATOM 3260 CG LEU B 62 10.947 -1.848 4.178 1.00 0.25 C ATOM 3261 CD1 LEU B 62 9.628 -1.130 4.385 1.00 0.24 C ATOM 3262 CD2 LEU B 62 12.057 -0.859 3.881 1.00 0.22 C ATOM 0 H LEU B 62 13.281 -1.779 6.715 1.00 0.33 H new ATOM 0 HA LEU B 62 10.411 -1.228 6.684 1.00 0.39 H new ATOM 0 HB2 LEU B 62 12.280 -3.105 5.281 1.00 0.35 H new ATOM 0 HB3 LEU B 62 10.591 -3.548 5.425 1.00 0.35 H new ATOM 0 HG LEU B 62 10.857 -2.508 3.315 1.00 0.25 H new ATOM 0 HD11 LEU B 62 9.402 -0.524 3.507 1.00 0.24 H new ATOM 0 HD12 LEU B 62 8.835 -1.862 4.535 1.00 0.24 H new ATOM 0 HD13 LEU B 62 9.698 -0.486 5.262 1.00 0.24 H new ATOM 0 HD21 LEU B 62 11.793 -0.268 3.004 1.00 0.22 H new ATOM 0 HD22 LEU B 62 12.194 -0.198 4.737 1.00 0.22 H new ATOM 0 HD23 LEU B 62 12.984 -1.399 3.688 1.00 0.22 H new ATOM 3274 N ASP B 63 11.690 -4.027 7.881 1.00 0.31 N ATOM 3275 CA ASP B 63 11.516 -5.111 8.829 1.00 0.33 C ATOM 3276 C ASP B 63 11.635 -4.601 10.258 1.00 0.37 C ATOM 3277 O ASP B 63 12.716 -4.214 10.707 1.00 0.43 O ATOM 3278 CB ASP B 63 12.556 -6.198 8.561 1.00 0.40 C ATOM 3279 CG ASP B 63 12.489 -7.340 9.549 1.00 0.38 C ATOM 3280 OD1 ASP B 63 11.377 -7.719 9.963 1.00 1.15 O ATOM 3281 OD2 ASP B 63 13.558 -7.869 9.910 1.00 1.08 O ATOM 0 H ASP B 63 12.483 -4.151 7.252 1.00 0.31 H new ATOM 0 HA ASP B 63 10.518 -5.532 8.704 1.00 0.33 H new ATOM 0 HB2 ASP B 63 12.413 -6.588 7.553 1.00 0.40 H new ATOM 0 HB3 ASP B 63 13.552 -5.756 8.593 1.00 0.40 H new ATOM 3286 N SER B 64 10.517 -4.595 10.964 1.00 0.43 N ATOM 3287 CA SER B 64 10.478 -4.111 12.330 1.00 0.52 C ATOM 3288 C SER B 64 11.053 -5.161 13.279 1.00 0.58 C ATOM 3289 O SER B 64 11.364 -4.872 14.436 1.00 0.71 O ATOM 3290 CB SER B 64 9.045 -3.745 12.715 1.00 0.67 C ATOM 3291 OG SER B 64 8.511 -2.775 11.821 1.00 1.14 O ATOM 0 H SER B 64 9.619 -4.923 10.609 1.00 0.43 H new ATOM 0 HA SER B 64 11.091 -3.214 12.409 1.00 0.52 H new ATOM 0 HB2 SER B 64 8.421 -4.639 12.703 1.00 0.67 H new ATOM 0 HB3 SER B 64 9.026 -3.357 13.733 1.00 0.67 H new ATOM 0 HG SER B 64 7.930 -3.217 11.167 1.00 1.14 H new ATOM 3297 N ASN B 65 11.207 -6.379 12.773 1.00 0.60 N ATOM 3298 CA ASN B 65 11.855 -7.443 13.527 1.00 0.75 C ATOM 3299 C ASN B 65 13.361 -7.230 13.508 1.00 0.76 C ATOM 3300 O ASN B 65 14.083 -7.754 14.361 1.00 0.91 O ATOM 3301 CB ASN B 65 11.521 -8.819 12.940 1.00 0.89 C ATOM 3302 CG ASN B 65 10.056 -9.185 13.085 1.00 1.52 C ATOM 3303 OD1 ASN B 65 9.398 -8.803 14.050 1.00 1.87 O ATOM 3304 ND2 ASN B 65 9.535 -9.929 12.121 1.00 2.34 N ATOM 0 H ASN B 65 10.891 -6.654 11.843 1.00 0.60 H new ATOM 0 HA ASN B 65 11.488 -7.413 14.553 1.00 0.75 H new ATOM 0 HB2 ASN B 65 11.790 -8.833 11.884 1.00 0.89 H new ATOM 0 HB3 ASN B 65 12.130 -9.576 13.434 1.00 0.89 H new ATOM 0 HD21 ASN B 65 8.554 -10.205 12.163 1.00 2.34 H new ATOM 0 HD22 ASN B 65 10.115 -10.226 11.336 1.00 2.34 H new ATOM 3311 N ARG B 66 13.816 -6.447 12.524 1.00 0.68 N ATOM 3312 CA ARG B 66 15.229 -6.118 12.364 1.00 0.81 C ATOM 3313 C ARG B 66 16.065 -7.390 12.265 1.00 0.88 C ATOM 3314 O ARG B 66 17.129 -7.508 12.879 1.00 1.11 O ATOM 3315 CB ARG B 66 15.697 -5.234 13.522 1.00 1.04 C ATOM 3316 CG ARG B 66 15.091 -3.840 13.489 1.00 1.10 C ATOM 3317 CD ARG B 66 15.351 -3.077 14.779 1.00 1.39 C ATOM 3318 NE ARG B 66 14.682 -3.698 15.922 1.00 2.08 N ATOM 3319 CZ ARG B 66 13.556 -3.237 16.469 1.00 2.77 C ATOM 3320 NH1 ARG B 66 12.979 -2.139 15.991 1.00 2.86 N ATOM 3321 NH2 ARG B 66 13.009 -3.875 17.493 1.00 3.79 N ATOM 0 H ARG B 66 13.212 -6.026 11.818 1.00 0.68 H new ATOM 0 HA ARG B 66 15.361 -5.561 11.437 1.00 0.81 H new ATOM 0 HB2 ARG B 66 15.438 -5.714 14.466 1.00 1.04 H new ATOM 0 HB3 ARG B 66 16.784 -5.152 13.493 1.00 1.04 H new ATOM 0 HG2 ARG B 66 15.506 -3.284 12.648 1.00 1.10 H new ATOM 0 HG3 ARG B 66 14.016 -3.915 13.322 1.00 1.10 H new ATOM 0 HD2 ARG B 66 16.424 -3.034 14.966 1.00 1.39 H new ATOM 0 HD3 ARG B 66 15.005 -2.049 14.670 1.00 1.39 H new ATOM 0 HE ARG B 66 15.102 -4.535 16.326 1.00 2.08 H new ATOM 0 HH11 ARG B 66 13.397 -1.645 15.203 1.00 2.86 H new ATOM 0 HH12 ARG B 66 12.118 -1.790 16.413 1.00 2.86 H new ATOM 0 HH21 ARG B 66 13.449 -4.718 17.863 1.00 3.79 H new ATOM 0 HH22 ARG B 66 12.148 -3.523 17.912 1.00 3.79 H new ATOM 3335 N ASP B 67 15.582 -8.324 11.457 1.00 0.75 N ATOM 3336 CA ASP B 67 16.219 -9.622 11.306 1.00 0.88 C ATOM 3337 C ASP B 67 16.747 -9.773 9.885 1.00 0.77 C ATOM 3338 O ASP B 67 17.378 -10.773 9.543 1.00 0.96 O ATOM 3339 CB ASP B 67 15.223 -10.737 11.634 1.00 1.00 C ATOM 3340 CG ASP B 67 15.867 -12.106 11.675 1.00 1.39 C ATOM 3341 OD1 ASP B 67 16.752 -12.325 12.531 1.00 1.95 O ATOM 3342 OD2 ASP B 67 15.477 -12.974 10.870 1.00 1.93 O ATOM 0 H ASP B 67 14.742 -8.203 10.891 1.00 0.75 H new ATOM 0 HA ASP B 67 17.057 -9.696 12.000 1.00 0.88 H new ATOM 0 HB2 ASP B 67 14.758 -10.530 12.598 1.00 1.00 H new ATOM 0 HB3 ASP B 67 14.427 -10.737 10.889 1.00 1.00 H new ATOM 3347 N ASN B 68 16.474 -8.753 9.070 1.00 0.62 N ATOM 3348 CA ASN B 68 16.977 -8.663 7.698 1.00 0.55 C ATOM 3349 C ASN B 68 16.198 -9.548 6.736 1.00 0.43 C ATOM 3350 O ASN B 68 16.751 -10.077 5.770 1.00 0.57 O ATOM 3351 CB ASN B 68 18.478 -8.962 7.628 1.00 0.77 C ATOM 3352 CG ASN B 68 19.301 -7.695 7.535 1.00 1.30 C ATOM 3353 OD1 ASN B 68 19.622 -7.236 6.444 1.00 1.41 O ATOM 3354 ND2 ASN B 68 19.623 -7.104 8.670 1.00 2.22 N ATOM 0 H ASN B 68 15.894 -7.961 9.345 1.00 0.62 H new ATOM 0 HA ASN B 68 16.824 -7.632 7.379 1.00 0.55 H new ATOM 0 HB2 ASN B 68 18.778 -9.526 8.511 1.00 0.77 H new ATOM 0 HB3 ASN B 68 18.683 -9.593 6.763 1.00 0.77 H new ATOM 0 HD21 ASN B 68 20.157 -6.235 8.659 1.00 2.22 H new ATOM 0 HD22 ASN B 68 19.338 -7.516 9.558 1.00 2.22 H new ATOM 3361 N GLU B 69 14.900 -9.654 6.975 1.00 0.42 N ATOM 3362 CA GLU B 69 13.999 -10.349 6.072 1.00 0.42 C ATOM 3363 C GLU B 69 12.554 -9.931 6.349 1.00 0.39 C ATOM 3364 O GLU B 69 12.009 -10.190 7.420 1.00 0.54 O ATOM 3365 CB GLU B 69 14.180 -11.869 6.162 1.00 0.60 C ATOM 3366 CG GLU B 69 14.130 -12.437 7.570 1.00 1.04 C ATOM 3367 CD GLU B 69 14.297 -13.941 7.579 1.00 1.44 C ATOM 3368 OE1 GLU B 69 15.441 -14.421 7.456 1.00 2.09 O ATOM 3369 OE2 GLU B 69 13.281 -14.657 7.685 1.00 1.84 O ATOM 0 H GLU B 69 14.444 -9.261 7.798 1.00 0.42 H new ATOM 0 HA GLU B 69 14.244 -10.064 5.049 1.00 0.42 H new ATOM 0 HB2 GLU B 69 13.405 -12.349 5.565 1.00 0.60 H new ATOM 0 HB3 GLU B 69 15.137 -12.133 5.713 1.00 0.60 H new ATOM 0 HG2 GLU B 69 14.915 -11.981 8.173 1.00 1.04 H new ATOM 0 HG3 GLU B 69 13.179 -12.175 8.034 1.00 1.04 H new ATOM 3376 N VAL B 70 11.955 -9.272 5.370 1.00 0.28 N ATOM 3377 CA VAL B 70 10.639 -8.659 5.518 1.00 0.25 C ATOM 3378 C VAL B 70 9.507 -9.665 5.304 1.00 0.25 C ATOM 3379 O VAL B 70 9.543 -10.471 4.368 1.00 0.33 O ATOM 3380 CB VAL B 70 10.501 -7.472 4.532 1.00 0.26 C ATOM 3381 CG1 VAL B 70 9.050 -7.141 4.236 1.00 0.29 C ATOM 3382 CG2 VAL B 70 11.202 -6.248 5.090 1.00 0.30 C ATOM 0 H VAL B 70 12.367 -9.145 4.446 1.00 0.28 H new ATOM 0 HA VAL B 70 10.554 -8.295 6.542 1.00 0.25 H new ATOM 0 HB VAL B 70 10.970 -7.772 3.595 1.00 0.26 H new ATOM 0 HG11 VAL B 70 9.003 -6.303 3.541 1.00 0.29 H new ATOM 0 HG12 VAL B 70 8.562 -8.009 3.792 1.00 0.29 H new ATOM 0 HG13 VAL B 70 8.542 -6.873 5.162 1.00 0.29 H new ATOM 0 HG21 VAL B 70 11.099 -5.419 4.390 1.00 0.30 H new ATOM 0 HG22 VAL B 70 10.752 -5.975 6.044 1.00 0.30 H new ATOM 0 HG23 VAL B 70 12.259 -6.470 5.237 1.00 0.30 H new ATOM 3392 N ASP B 71 8.510 -9.615 6.190 1.00 0.25 N ATOM 3393 CA ASP B 71 7.334 -10.474 6.084 1.00 0.29 C ATOM 3394 C ASP B 71 6.214 -9.743 5.332 1.00 0.22 C ATOM 3395 O ASP B 71 6.421 -8.642 4.830 1.00 0.21 O ATOM 3396 CB ASP B 71 6.861 -10.924 7.469 1.00 0.42 C ATOM 3397 CG ASP B 71 6.016 -12.183 7.408 1.00 1.18 C ATOM 3398 OD1 ASP B 71 6.592 -13.286 7.336 1.00 2.06 O ATOM 3399 OD2 ASP B 71 4.770 -12.074 7.431 1.00 1.72 O ATOM 0 H ASP B 71 8.496 -8.985 6.992 1.00 0.25 H new ATOM 0 HA ASP B 71 7.604 -11.367 5.520 1.00 0.29 H new ATOM 0 HB2 ASP B 71 7.727 -11.101 8.107 1.00 0.42 H new ATOM 0 HB3 ASP B 71 6.283 -10.123 7.931 1.00 0.42 H new ATOM 3404 N PHE B 72 5.032 -10.346 5.260 1.00 0.21 N ATOM 3405 CA PHE B 72 3.999 -9.901 4.328 1.00 0.19 C ATOM 3406 C PHE B 72 3.431 -8.511 4.656 1.00 0.15 C ATOM 3407 O PHE B 72 3.361 -7.659 3.769 1.00 0.14 O ATOM 3408 CB PHE B 72 2.873 -10.931 4.252 1.00 0.21 C ATOM 3409 CG PHE B 72 2.016 -10.821 3.016 1.00 0.20 C ATOM 3410 CD1 PHE B 72 2.503 -10.232 1.853 1.00 1.18 C ATOM 3411 CD2 PHE B 72 0.729 -11.326 3.012 1.00 1.19 C ATOM 3412 CE1 PHE B 72 1.720 -10.151 0.720 1.00 1.20 C ATOM 3413 CE2 PHE B 72 -0.057 -11.247 1.880 1.00 1.20 C ATOM 3414 CZ PHE B 72 0.438 -10.659 0.733 1.00 0.32 C ATOM 0 H PHE B 72 4.764 -11.144 5.836 1.00 0.21 H new ATOM 0 HA PHE B 72 4.483 -9.811 3.356 1.00 0.19 H new ATOM 0 HB2 PHE B 72 3.307 -11.930 4.292 1.00 0.21 H new ATOM 0 HB3 PHE B 72 2.238 -10.824 5.131 1.00 0.21 H new ATOM 0 HD1 PHE B 72 3.507 -9.833 1.837 1.00 1.18 H new ATOM 0 HD2 PHE B 72 0.334 -11.788 3.905 1.00 1.19 H new ATOM 0 HE1 PHE B 72 2.110 -9.691 -0.176 1.00 1.20 H new ATOM 0 HE2 PHE B 72 -1.061 -11.646 1.892 1.00 1.20 H new ATOM 0 HZ PHE B 72 -0.178 -10.597 -0.152 1.00 0.32 H new ATOM 3424 N GLN B 73 3.014 -8.264 5.901 1.00 0.15 N ATOM 3425 CA GLN B 73 2.458 -6.948 6.234 1.00 0.14 C ATOM 3426 C GLN B 73 3.550 -5.897 6.131 1.00 0.12 C ATOM 3427 O GLN B 73 3.296 -4.780 5.687 1.00 0.13 O ATOM 3428 CB GLN B 73 1.816 -6.911 7.629 1.00 0.16 C ATOM 3429 CG GLN B 73 0.723 -5.865 7.748 1.00 0.26 C ATOM 3430 CD GLN B 73 0.153 -5.777 9.145 1.00 0.22 C ATOM 3431 OE1 GLN B 73 -0.797 -6.475 9.489 1.00 0.68 O ATOM 3432 NE2 GLN B 73 0.726 -4.908 9.953 1.00 0.60 N ATOM 0 H GLN B 73 3.048 -8.931 6.672 1.00 0.15 H new ATOM 0 HA GLN B 73 1.664 -6.736 5.518 1.00 0.14 H new ATOM 0 HB2 GLN B 73 1.400 -7.892 7.858 1.00 0.16 H new ATOM 0 HB3 GLN B 73 2.587 -6.710 8.373 1.00 0.16 H new ATOM 0 HG2 GLN B 73 1.123 -4.893 7.461 1.00 0.26 H new ATOM 0 HG3 GLN B 73 -0.078 -6.100 7.047 1.00 0.26 H new ATOM 0 HE21 GLN B 73 1.513 -4.349 9.625 1.00 0.60 H new ATOM 0 HE22 GLN B 73 0.382 -4.795 10.907 1.00 0.60 H new ATOM 3441 N GLU B 74 4.771 -6.278 6.502 1.00 0.14 N ATOM 3442 CA GLU B 74 5.922 -5.391 6.396 1.00 0.17 C ATOM 3443 C GLU B 74 6.171 -5.042 4.932 1.00 0.14 C ATOM 3444 O GLU B 74 6.530 -3.914 4.597 1.00 0.16 O ATOM 3445 CB GLU B 74 7.164 -6.062 6.980 1.00 0.27 C ATOM 3446 CG GLU B 74 8.073 -5.116 7.745 1.00 0.38 C ATOM 3447 CD GLU B 74 7.672 -4.981 9.202 1.00 0.43 C ATOM 3448 OE1 GLU B 74 6.824 -4.127 9.524 1.00 1.10 O ATOM 3449 OE2 GLU B 74 8.206 -5.742 10.039 1.00 1.21 O ATOM 0 H GLU B 74 4.987 -7.200 6.880 1.00 0.14 H new ATOM 0 HA GLU B 74 5.715 -4.480 6.957 1.00 0.17 H new ATOM 0 HB2 GLU B 74 6.851 -6.867 7.645 1.00 0.27 H new ATOM 0 HB3 GLU B 74 7.732 -6.520 6.170 1.00 0.27 H new ATOM 0 HG2 GLU B 74 9.100 -5.476 7.685 1.00 0.38 H new ATOM 0 HG3 GLU B 74 8.051 -4.134 7.272 1.00 0.38 H new ATOM 3456 N TYR B 75 5.965 -6.028 4.068 1.00 0.14 N ATOM 3457 CA TYR B 75 6.082 -5.843 2.628 1.00 0.14 C ATOM 3458 C TYR B 75 5.077 -4.806 2.149 1.00 0.11 C ATOM 3459 O TYR B 75 5.360 -4.011 1.259 1.00 0.13 O ATOM 3460 CB TYR B 75 5.841 -7.183 1.907 1.00 0.16 C ATOM 3461 CG TYR B 75 5.972 -7.118 0.399 1.00 0.17 C ATOM 3462 CD1 TYR B 75 4.959 -6.577 -0.386 1.00 1.21 C ATOM 3463 CD2 TYR B 75 7.109 -7.590 -0.235 1.00 1.19 C ATOM 3464 CE1 TYR B 75 5.076 -6.505 -1.760 1.00 1.22 C ATOM 3465 CE2 TYR B 75 7.235 -7.524 -1.614 1.00 1.20 C ATOM 3466 CZ TYR B 75 6.215 -6.978 -2.368 1.00 0.22 C ATOM 3467 OH TYR B 75 6.336 -6.909 -3.737 1.00 0.26 O ATOM 0 H TYR B 75 5.713 -6.977 4.345 1.00 0.14 H new ATOM 0 HA TYR B 75 7.087 -5.490 2.397 1.00 0.14 H new ATOM 0 HB2 TYR B 75 6.549 -7.919 2.289 1.00 0.16 H new ATOM 0 HB3 TYR B 75 4.842 -7.541 2.157 1.00 0.16 H new ATOM 0 HD1 TYR B 75 4.063 -6.206 0.089 1.00 1.21 H new ATOM 0 HD2 TYR B 75 7.909 -8.015 0.353 1.00 1.19 H new ATOM 0 HE1 TYR B 75 4.279 -6.080 -2.353 1.00 1.22 H new ATOM 0 HE2 TYR B 75 8.126 -7.898 -2.096 1.00 1.20 H new ATOM 0 HH TYR B 75 5.530 -6.501 -4.117 1.00 0.26 H new ATOM 3477 N CYS B 76 3.906 -4.810 2.754 1.00 0.11 N ATOM 3478 CA CYS B 76 2.825 -3.969 2.299 1.00 0.12 C ATOM 3479 C CYS B 76 2.861 -2.587 2.952 1.00 0.12 C ATOM 3480 O CYS B 76 2.557 -1.592 2.299 1.00 0.13 O ATOM 3481 CB CYS B 76 1.499 -4.668 2.570 1.00 0.14 C ATOM 3482 SG CYS B 76 1.409 -6.346 1.903 1.00 0.22 S ATOM 0 H CYS B 76 3.682 -5.389 3.563 1.00 0.11 H new ATOM 0 HA CYS B 76 2.939 -3.809 1.227 1.00 0.12 H new ATOM 0 HB2 CYS B 76 1.332 -4.706 3.646 1.00 0.14 H new ATOM 0 HB3 CYS B 76 0.692 -4.073 2.143 1.00 0.14 H new ATOM 0 HG CYS B 76 2.203 -7.124 2.577 1.00 0.22 H new ATOM 3488 N VAL B 77 3.227 -2.513 4.229 1.00 0.13 N ATOM 3489 CA VAL B 77 3.408 -1.217 4.888 1.00 0.14 C ATOM 3490 C VAL B 77 4.560 -0.481 4.220 1.00 0.14 C ATOM 3491 O VAL B 77 4.595 0.745 4.172 1.00 0.19 O ATOM 3492 CB VAL B 77 3.666 -1.369 6.408 1.00 0.16 C ATOM 3493 CG1 VAL B 77 4.827 -2.300 6.643 1.00 0.14 C ATOM 3494 CG2 VAL B 77 3.929 -0.030 7.084 1.00 0.20 C ATOM 0 H VAL B 77 3.403 -3.322 4.824 1.00 0.13 H new ATOM 0 HA VAL B 77 2.487 -0.643 4.782 1.00 0.14 H new ATOM 0 HB VAL B 77 2.762 -1.787 6.852 1.00 0.16 H new ATOM 0 HG11 VAL B 77 5.001 -2.401 7.714 1.00 0.14 H new ATOM 0 HG12 VAL B 77 4.601 -3.278 6.218 1.00 0.14 H new ATOM 0 HG13 VAL B 77 5.720 -1.895 6.167 1.00 0.14 H new ATOM 0 HG21 VAL B 77 4.104 -0.188 8.148 1.00 0.20 H new ATOM 0 HG22 VAL B 77 4.807 0.437 6.637 1.00 0.20 H new ATOM 0 HG23 VAL B 77 3.065 0.621 6.951 1.00 0.20 H new ATOM 3504 N PHE B 78 5.487 -1.264 3.692 1.00 0.11 N ATOM 3505 CA PHE B 78 6.513 -0.776 2.792 1.00 0.11 C ATOM 3506 C PHE B 78 5.885 0.026 1.659 1.00 0.11 C ATOM 3507 O PHE B 78 6.316 1.133 1.335 1.00 0.11 O ATOM 3508 CB PHE B 78 7.263 -1.985 2.229 1.00 0.12 C ATOM 3509 CG PHE B 78 8.070 -1.710 1.002 1.00 0.12 C ATOM 3510 CD1 PHE B 78 9.378 -1.296 1.115 1.00 1.17 C ATOM 3511 CD2 PHE B 78 7.523 -1.876 -0.262 1.00 1.18 C ATOM 3512 CE1 PHE B 78 10.138 -1.050 -0.009 1.00 1.18 C ATOM 3513 CE2 PHE B 78 8.273 -1.629 -1.392 1.00 1.18 C ATOM 3514 CZ PHE B 78 9.585 -1.215 -1.264 1.00 0.15 C ATOM 0 H PHE B 78 5.547 -2.265 3.879 1.00 0.11 H new ATOM 0 HA PHE B 78 7.200 -0.121 3.327 1.00 0.11 H new ATOM 0 HB2 PHE B 78 7.925 -2.375 3.002 1.00 0.12 H new ATOM 0 HB3 PHE B 78 6.540 -2.769 2.003 1.00 0.12 H new ATOM 0 HD1 PHE B 78 9.814 -1.162 2.094 1.00 1.17 H new ATOM 0 HD2 PHE B 78 6.498 -2.202 -0.362 1.00 1.18 H new ATOM 0 HE1 PHE B 78 11.164 -0.729 0.092 1.00 1.18 H new ATOM 0 HE2 PHE B 78 7.838 -1.758 -2.372 1.00 1.18 H new ATOM 0 HZ PHE B 78 10.178 -1.020 -2.145 1.00 0.15 H new ATOM 3524 N LEU B 79 4.847 -0.551 1.077 1.00 0.14 N ATOM 3525 CA LEU B 79 4.149 0.048 -0.043 1.00 0.16 C ATOM 3526 C LEU B 79 3.378 1.281 0.368 1.00 0.17 C ATOM 3527 O LEU B 79 3.474 2.329 -0.272 1.00 0.20 O ATOM 3528 CB LEU B 79 3.201 -0.967 -0.665 1.00 0.15 C ATOM 3529 CG LEU B 79 3.846 -1.921 -1.652 1.00 0.15 C ATOM 3530 CD1 LEU B 79 3.672 -3.356 -1.209 1.00 0.19 C ATOM 3531 CD2 LEU B 79 3.233 -1.706 -3.005 1.00 0.14 C ATOM 0 H LEU B 79 4.465 -1.450 1.370 1.00 0.14 H new ATOM 0 HA LEU B 79 4.898 0.352 -0.774 1.00 0.16 H new ATOM 0 HB2 LEU B 79 2.741 -1.549 0.133 1.00 0.15 H new ATOM 0 HB3 LEU B 79 2.399 -0.430 -1.172 1.00 0.15 H new ATOM 0 HG LEU B 79 4.917 -1.721 -1.700 1.00 0.15 H new ATOM 0 HD11 LEU B 79 4.143 -4.020 -1.934 1.00 0.19 H new ATOM 0 HD12 LEU B 79 4.138 -3.495 -0.233 1.00 0.19 H new ATOM 0 HD13 LEU B 79 2.609 -3.589 -1.140 1.00 0.19 H new ATOM 0 HD21 LEU B 79 3.689 -2.387 -3.724 1.00 0.14 H new ATOM 0 HD22 LEU B 79 2.161 -1.898 -2.953 1.00 0.14 H new ATOM 0 HD23 LEU B 79 3.403 -0.677 -3.322 1.00 0.14 H new ATOM 3543 N SER B 80 2.628 1.165 1.442 1.00 0.19 N ATOM 3544 CA SER B 80 1.806 2.259 1.893 1.00 0.21 C ATOM 3545 C SER B 80 2.678 3.370 2.425 1.00 0.20 C ATOM 3546 O SER B 80 2.283 4.538 2.449 1.00 0.24 O ATOM 3547 CB SER B 80 0.825 1.758 2.933 1.00 0.22 C ATOM 3548 OG SER B 80 1.416 0.777 3.766 1.00 0.18 O ATOM 0 H SER B 80 2.572 0.324 2.017 1.00 0.19 H new ATOM 0 HA SER B 80 1.232 2.665 1.060 1.00 0.21 H new ATOM 0 HB2 SER B 80 0.478 2.593 3.541 1.00 0.22 H new ATOM 0 HB3 SER B 80 -0.051 1.338 2.438 1.00 0.22 H new ATOM 0 HG SER B 80 0.728 0.150 4.072 1.00 0.18 H new ATOM 3554 N CYS B 81 3.879 2.997 2.834 1.00 0.17 N ATOM 3555 CA CYS B 81 4.898 3.961 3.142 1.00 0.18 C ATOM 3556 C CYS B 81 5.189 4.801 1.923 1.00 0.33 C ATOM 3557 O CYS B 81 5.086 6.011 1.982 1.00 0.72 O ATOM 3558 CB CYS B 81 6.185 3.289 3.595 1.00 0.30 C ATOM 3559 SG CYS B 81 7.622 4.366 3.436 1.00 1.83 S ATOM 0 H CYS B 81 4.164 2.026 2.958 1.00 0.17 H new ATOM 0 HA CYS B 81 4.528 4.585 3.955 1.00 0.18 H new ATOM 0 HB2 CYS B 81 6.082 2.978 4.635 1.00 0.30 H new ATOM 0 HB3 CYS B 81 6.346 2.386 3.007 1.00 0.30 H new ATOM 0 HG CYS B 81 8.166 4.194 2.268 1.00 1.83 H new ATOM 3565 N ILE B 82 5.532 4.150 0.813 1.00 0.17 N ATOM 3566 CA ILE B 82 5.912 4.863 -0.397 1.00 0.19 C ATOM 3567 C ILE B 82 4.809 5.819 -0.839 1.00 0.21 C ATOM 3568 O ILE B 82 5.068 6.988 -1.099 1.00 0.28 O ATOM 3569 CB ILE B 82 6.267 3.911 -1.564 1.00 0.19 C ATOM 3570 CG1 ILE B 82 7.417 2.981 -1.164 1.00 0.24 C ATOM 3571 CG2 ILE B 82 6.651 4.722 -2.793 1.00 0.24 C ATOM 3572 CD1 ILE B 82 8.205 2.454 -2.345 1.00 0.41 C ATOM 0 H ILE B 82 5.553 3.134 0.730 1.00 0.17 H new ATOM 0 HA ILE B 82 6.808 5.431 -0.145 1.00 0.19 H new ATOM 0 HB ILE B 82 5.395 3.301 -1.798 1.00 0.19 H new ATOM 0 HG12 ILE B 82 8.092 3.517 -0.497 1.00 0.24 H new ATOM 0 HG13 ILE B 82 7.014 2.139 -0.601 1.00 0.24 H new ATOM 0 HG21 ILE B 82 6.900 4.047 -3.611 1.00 0.24 H new ATOM 0 HG22 ILE B 82 5.814 5.355 -3.087 1.00 0.24 H new ATOM 0 HG23 ILE B 82 7.514 5.346 -2.562 1.00 0.24 H new ATOM 0 HD11 ILE B 82 9.003 1.803 -1.988 1.00 0.41 H new ATOM 0 HD12 ILE B 82 7.543 1.890 -3.002 1.00 0.41 H new ATOM 0 HD13 ILE B 82 8.637 3.289 -2.896 1.00 0.41 H new ATOM 3584 N ALA B 83 3.582 5.333 -0.890 1.00 0.26 N ATOM 3585 CA ALA B 83 2.454 6.158 -1.301 1.00 0.32 C ATOM 3586 C ALA B 83 2.287 7.375 -0.393 1.00 0.32 C ATOM 3587 O ALA B 83 2.165 8.508 -0.859 1.00 0.35 O ATOM 3588 CB ALA B 83 1.187 5.333 -1.301 1.00 0.42 C ATOM 0 H ALA B 83 3.338 4.371 -0.652 1.00 0.26 H new ATOM 0 HA ALA B 83 2.653 6.521 -2.309 1.00 0.32 H new ATOM 0 HB1 ALA B 83 0.347 5.956 -1.609 1.00 0.42 H new ATOM 0 HB2 ALA B 83 1.295 4.500 -1.996 1.00 0.42 H new ATOM 0 HB3 ALA B 83 1.004 4.947 -0.298 1.00 0.42 H new ATOM 3594 N MET B 84 2.299 7.130 0.905 1.00 0.33 N ATOM 3595 CA MET B 84 2.104 8.177 1.902 1.00 0.36 C ATOM 3596 C MET B 84 3.357 9.019 2.072 1.00 0.36 C ATOM 3597 O MET B 84 3.305 10.157 2.539 1.00 0.48 O ATOM 3598 CB MET B 84 1.693 7.523 3.208 1.00 0.38 C ATOM 3599 CG MET B 84 1.711 8.431 4.416 1.00 0.44 C ATOM 3600 SD MET B 84 1.568 7.470 5.924 1.00 0.38 S ATOM 3601 CE MET B 84 2.542 6.046 5.436 1.00 0.22 C ATOM 0 H MET B 84 2.444 6.201 1.301 1.00 0.33 H new ATOM 0 HA MET B 84 1.318 8.856 1.572 1.00 0.36 H new ATOM 0 HB2 MET B 84 0.687 7.118 3.093 1.00 0.38 H new ATOM 0 HB3 MET B 84 2.356 6.679 3.398 1.00 0.38 H new ATOM 0 HG2 MET B 84 2.636 9.008 4.431 1.00 0.44 H new ATOM 0 HG3 MET B 84 0.890 9.146 4.354 1.00 0.44 H new ATOM 0 HE1 MET B 84 2.987 5.589 6.320 1.00 0.22 H new ATOM 0 HE2 MET B 84 1.900 5.320 4.937 1.00 0.22 H new ATOM 0 HE3 MET B 84 3.332 6.362 4.754 1.00 0.22 H new ATOM 3611 N MET B 85 4.482 8.457 1.696 1.00 0.28 N ATOM 3612 CA MET B 85 5.709 9.203 1.640 1.00 0.29 C ATOM 3613 C MET B 85 5.660 10.140 0.438 1.00 0.34 C ATOM 3614 O MET B 85 6.104 11.281 0.495 1.00 0.48 O ATOM 3615 CB MET B 85 6.890 8.259 1.535 1.00 0.28 C ATOM 3616 CG MET B 85 8.188 8.958 1.835 1.00 0.32 C ATOM 3617 SD MET B 85 9.567 8.334 0.870 1.00 0.29 S ATOM 3618 CE MET B 85 9.568 6.660 1.475 1.00 0.25 C ATOM 0 H MET B 85 4.569 7.478 1.423 1.00 0.28 H new ATOM 0 HA MET B 85 5.828 9.790 2.551 1.00 0.29 H new ATOM 0 HB2 MET B 85 6.755 7.429 2.228 1.00 0.28 H new ATOM 0 HB3 MET B 85 6.929 7.834 0.532 1.00 0.28 H new ATOM 0 HG2 MET B 85 8.072 10.025 1.643 1.00 0.32 H new ATOM 0 HG3 MET B 85 8.416 8.848 2.895 1.00 0.32 H new ATOM 0 HE1 MET B 85 10.560 6.228 1.347 1.00 0.25 H new ATOM 0 HE2 MET B 85 9.303 6.655 2.532 1.00 0.25 H new ATOM 0 HE3 MET B 85 8.841 6.071 0.916 1.00 0.25 H new ATOM 3628 N CYS B 86 5.063 9.638 -0.639 1.00 0.31 N ATOM 3629 CA CYS B 86 4.872 10.393 -1.870 1.00 0.34 C ATOM 3630 C CYS B 86 3.858 11.506 -1.670 1.00 0.39 C ATOM 3631 O CYS B 86 3.778 12.442 -2.468 1.00 0.46 O ATOM 3632 CB CYS B 86 4.384 9.463 -2.980 1.00 0.39 C ATOM 3633 SG CYS B 86 4.171 10.274 -4.577 1.00 0.94 S ATOM 0 H CYS B 86 4.696 8.687 -0.681 1.00 0.31 H new ATOM 0 HA CYS B 86 5.829 10.834 -2.150 1.00 0.34 H new ATOM 0 HB2 CYS B 86 5.094 8.644 -3.092 1.00 0.39 H new ATOM 0 HB3 CYS B 86 3.434 9.022 -2.679 1.00 0.39 H new ATOM 0 HG CYS B 86 5.083 11.189 -4.724 1.00 0.94 H new ATOM 3639 N ASN B 87 3.081 11.382 -0.607 1.00 0.45 N ATOM 3640 CA ASN B 87 2.007 12.314 -0.310 1.00 0.58 C ATOM 3641 C ASN B 87 2.495 13.767 -0.340 1.00 0.68 C ATOM 3642 O ASN B 87 1.788 14.658 -0.808 1.00 0.89 O ATOM 3643 CB ASN B 87 1.420 12.001 1.060 1.00 0.72 C ATOM 3644 CG ASN B 87 0.146 12.763 1.333 1.00 1.10 C ATOM 3645 OD1 ASN B 87 -0.678 12.927 0.309 1.00 1.72 O flip ATOM 3646 ND2 ASN B 87 -0.109 13.174 2.461 1.00 1.77 N flip ATOM 0 H ASN B 87 3.178 10.630 0.076 1.00 0.45 H new ATOM 0 HA ASN B 87 1.242 12.199 -1.078 1.00 0.58 H new ATOM 0 HB2 ASN B 87 1.222 10.932 1.131 1.00 0.72 H new ATOM 0 HB3 ASN B 87 2.154 12.240 1.829 1.00 0.72 H new ATOM 0 HD21 ASN B 87 0.556 13.025 3.220 1.00 1.77 H new ATOM 0 HD22 ASN B 87 -0.985 13.664 2.639 1.00 1.77 H new ATOM 3653 N GLU B 88 3.715 13.995 0.141 1.00 0.70 N ATOM 3654 CA GLU B 88 4.282 15.343 0.179 1.00 0.89 C ATOM 3655 C GLU B 88 4.827 15.742 -1.193 1.00 0.86 C ATOM 3656 O GLU B 88 4.761 16.906 -1.584 1.00 1.06 O ATOM 3657 CB GLU B 88 5.399 15.429 1.223 1.00 1.03 C ATOM 3658 CG GLU B 88 6.602 14.558 0.900 1.00 1.51 C ATOM 3659 CD GLU B 88 7.757 14.759 1.856 1.00 1.72 C ATOM 3660 OE1 GLU B 88 8.275 15.885 1.934 1.00 2.33 O ATOM 3661 OE2 GLU B 88 8.147 13.787 2.541 1.00 1.98 O ATOM 0 H GLU B 88 4.329 13.268 0.509 1.00 0.70 H new ATOM 0 HA GLU B 88 3.485 16.033 0.455 1.00 0.89 H new ATOM 0 HB2 GLU B 88 5.724 16.466 1.310 1.00 1.03 H new ATOM 0 HB3 GLU B 88 5.000 15.137 2.195 1.00 1.03 H new ATOM 0 HG2 GLU B 88 6.300 13.511 0.920 1.00 1.51 H new ATOM 0 HG3 GLU B 88 6.937 14.774 -0.115 1.00 1.51 H new ATOM 3668 N PHE B 89 5.348 14.763 -1.920 1.00 0.69 N ATOM 3669 CA PHE B 89 5.986 15.011 -3.206 1.00 0.71 C ATOM 3670 C PHE B 89 4.963 15.221 -4.315 1.00 0.73 C ATOM 3671 O PHE B 89 4.892 16.291 -4.915 1.00 0.88 O ATOM 3672 CB PHE B 89 6.895 13.839 -3.572 1.00 0.69 C ATOM 3673 CG PHE B 89 8.044 13.650 -2.627 1.00 0.91 C ATOM 3674 CD1 PHE B 89 9.190 14.419 -2.743 1.00 1.53 C ATOM 3675 CD2 PHE B 89 7.979 12.700 -1.622 1.00 1.65 C ATOM 3676 CE1 PHE B 89 10.250 14.244 -1.875 1.00 1.89 C ATOM 3677 CE2 PHE B 89 9.035 12.519 -0.750 1.00 1.99 C ATOM 3678 CZ PHE B 89 10.173 13.293 -0.876 1.00 1.81 C ATOM 0 H PHE B 89 5.341 13.783 -1.638 1.00 0.69 H new ATOM 0 HA PHE B 89 6.573 15.924 -3.109 1.00 0.71 H new ATOM 0 HB2 PHE B 89 6.302 12.925 -3.597 1.00 0.69 H new ATOM 0 HB3 PHE B 89 7.285 13.993 -4.578 1.00 0.69 H new ATOM 0 HD1 PHE B 89 9.256 15.165 -3.522 1.00 1.53 H new ATOM 0 HD2 PHE B 89 7.092 12.093 -1.518 1.00 1.65 H new ATOM 0 HE1 PHE B 89 11.138 14.850 -1.977 1.00 1.89 H new ATOM 0 HE2 PHE B 89 8.971 11.774 0.029 1.00 1.99 H new ATOM 0 HZ PHE B 89 11.000 13.155 -0.195 1.00 1.81 H new ATOM 3688 N PHE B 90 4.178 14.189 -4.582 1.00 0.63 N ATOM 3689 CA PHE B 90 3.260 14.203 -5.711 1.00 0.66 C ATOM 3690 C PHE B 90 2.024 15.035 -5.402 1.00 0.69 C ATOM 3691 O PHE B 90 1.697 15.971 -6.133 1.00 0.83 O ATOM 3692 CB PHE B 90 2.864 12.770 -6.080 1.00 0.69 C ATOM 3693 CG PHE B 90 1.969 12.672 -7.285 1.00 0.95 C ATOM 3694 CD1 PHE B 90 2.511 12.607 -8.559 1.00 1.79 C ATOM 3695 CD2 PHE B 90 0.589 12.636 -7.146 1.00 1.44 C ATOM 3696 CE1 PHE B 90 1.697 12.511 -9.670 1.00 2.09 C ATOM 3697 CE2 PHE B 90 -0.230 12.539 -8.255 1.00 1.68 C ATOM 3698 CZ PHE B 90 0.326 12.477 -9.518 1.00 1.67 C ATOM 0 H PHE B 90 4.158 13.330 -4.032 1.00 0.63 H new ATOM 0 HA PHE B 90 3.766 14.661 -6.560 1.00 0.66 H new ATOM 0 HB2 PHE B 90 3.769 12.190 -6.264 1.00 0.69 H new ATOM 0 HB3 PHE B 90 2.360 12.313 -5.228 1.00 0.69 H new ATOM 0 HD1 PHE B 90 3.583 12.632 -8.684 1.00 1.79 H new ATOM 0 HD2 PHE B 90 0.150 12.684 -6.160 1.00 1.44 H new ATOM 0 HE1 PHE B 90 2.133 12.463 -10.657 1.00 2.09 H new ATOM 0 HE2 PHE B 90 -1.303 12.512 -8.134 1.00 1.68 H new ATOM 0 HZ PHE B 90 -0.312 12.402 -10.386 1.00 1.67 H new ATOM 3708 N GLU B 91 1.340 14.695 -4.321 1.00 0.70 N ATOM 3709 CA GLU B 91 0.125 15.398 -3.950 1.00 0.83 C ATOM 3710 C GLU B 91 0.469 16.770 -3.374 1.00 1.01 C ATOM 3711 O GLU B 91 -0.133 17.780 -3.746 1.00 1.21 O ATOM 3712 CB GLU B 91 -0.691 14.563 -2.962 1.00 0.95 C ATOM 3713 CG GLU B 91 -2.113 15.065 -2.781 1.00 1.64 C ATOM 3714 CD GLU B 91 -2.825 15.242 -4.110 1.00 2.04 C ATOM 3715 OE1 GLU B 91 -3.049 14.237 -4.810 1.00 2.62 O ATOM 3716 OE2 GLU B 91 -3.151 16.395 -4.464 1.00 2.45 O ATOM 0 H GLU B 91 1.605 13.940 -3.688 1.00 0.70 H new ATOM 0 HA GLU B 91 -0.487 15.551 -4.839 1.00 0.83 H new ATOM 0 HB2 GLU B 91 -0.719 13.530 -3.307 1.00 0.95 H new ATOM 0 HB3 GLU B 91 -0.188 14.562 -1.995 1.00 0.95 H new ATOM 0 HG2 GLU B 91 -2.670 14.362 -2.162 1.00 1.64 H new ATOM 0 HG3 GLU B 91 -2.097 16.016 -2.248 1.00 1.64 H new ATOM 3723 N GLY B 92 1.452 16.805 -2.486 1.00 1.09 N ATOM 3724 CA GLY B 92 1.939 18.071 -1.975 1.00 1.36 C ATOM 3725 C GLY B 92 1.053 18.658 -0.897 1.00 1.53 C ATOM 3726 O GLY B 92 0.774 19.858 -0.903 1.00 1.90 O ATOM 0 H GLY B 92 1.921 15.981 -2.110 1.00 1.09 H new ATOM 0 HA2 GLY B 92 2.944 17.932 -1.575 1.00 1.36 H new ATOM 0 HA3 GLY B 92 2.019 18.781 -2.798 1.00 1.36 H new ATOM 3730 N PHE B 93 0.595 17.820 0.019 1.00 1.50 N ATOM 3731 CA PHE B 93 -0.268 18.281 1.093 1.00 1.82 C ATOM 3732 C PHE B 93 0.535 18.407 2.379 1.00 1.98 C ATOM 3733 O PHE B 93 1.025 17.411 2.916 1.00 2.12 O ATOM 3734 CB PHE B 93 -1.441 17.326 1.295 1.00 2.19 C ATOM 3735 CG PHE B 93 -2.511 17.866 2.202 1.00 2.75 C ATOM 3736 CD1 PHE B 93 -3.528 18.657 1.693 1.00 3.37 C ATOM 3737 CD2 PHE B 93 -2.502 17.585 3.559 1.00 3.14 C ATOM 3738 CE1 PHE B 93 -4.516 19.157 2.519 1.00 3.97 C ATOM 3739 CE2 PHE B 93 -3.487 18.083 4.389 1.00 3.73 C ATOM 3740 CZ PHE B 93 -4.496 18.871 3.869 1.00 4.00 C ATOM 0 H PHE B 93 0.805 16.822 0.040 1.00 1.50 H new ATOM 0 HA PHE B 93 -0.669 19.258 0.822 1.00 1.82 H new ATOM 0 HB2 PHE B 93 -1.882 17.096 0.325 1.00 2.19 H new ATOM 0 HB3 PHE B 93 -1.068 16.388 1.706 1.00 2.19 H new ATOM 0 HD1 PHE B 93 -3.549 18.886 0.638 1.00 3.37 H new ATOM 0 HD2 PHE B 93 -1.716 16.970 3.972 1.00 3.14 H new ATOM 0 HE1 PHE B 93 -5.304 19.771 2.109 1.00 3.97 H new ATOM 0 HE2 PHE B 93 -3.469 17.857 5.445 1.00 3.73 H new ATOM 0 HZ PHE B 93 -5.267 19.262 4.517 1.00 4.00 H new ATOM 3750 N PRO B 94 0.685 19.635 2.883 1.00 2.52 N ATOM 3751 CA PRO B 94 1.497 19.896 4.064 1.00 3.07 C ATOM 3752 C PRO B 94 0.798 19.500 5.364 1.00 3.02 C ATOM 3753 O PRO B 94 0.048 20.286 5.948 1.00 3.41 O ATOM 3754 CB PRO B 94 1.721 21.406 4.007 1.00 3.84 C ATOM 3755 CG PRO B 94 0.525 21.942 3.295 1.00 3.90 C ATOM 3756 CD PRO B 94 0.081 20.864 2.338 1.00 3.08 C ATOM 0 HA PRO B 94 2.418 19.313 4.061 1.00 3.07 H new ATOM 0 HB2 PRO B 94 1.809 21.831 5.007 1.00 3.84 H new ATOM 0 HB3 PRO B 94 2.640 21.650 3.475 1.00 3.84 H new ATOM 0 HG2 PRO B 94 -0.269 22.187 4.000 1.00 3.90 H new ATOM 0 HG3 PRO B 94 0.770 22.859 2.760 1.00 3.90 H new ATOM 0 HD2 PRO B 94 -1.006 20.790 2.296 1.00 3.08 H new ATOM 0 HD3 PRO B 94 0.427 21.063 1.324 1.00 3.08 H new ATOM 3764 N ASP B 95 1.025 18.270 5.800 1.00 2.85 N ATOM 3765 CA ASP B 95 0.480 17.804 7.071 1.00 3.20 C ATOM 3766 C ASP B 95 1.379 16.748 7.699 1.00 3.38 C ATOM 3767 O ASP B 95 1.815 16.894 8.841 1.00 3.79 O ATOM 3768 CB ASP B 95 -0.931 17.240 6.891 1.00 3.91 C ATOM 3769 CG ASP B 95 -1.536 16.776 8.203 1.00 4.67 C ATOM 3770 OD1 ASP B 95 -2.132 17.608 8.917 1.00 5.10 O ATOM 3771 OD2 ASP B 95 -1.418 15.577 8.527 1.00 5.19 O ATOM 0 H ASP B 95 1.580 17.578 5.297 1.00 2.85 H new ATOM 0 HA ASP B 95 0.432 18.665 7.738 1.00 3.20 H new ATOM 0 HB2 ASP B 95 -1.571 18.003 6.448 1.00 3.91 H new ATOM 0 HB3 ASP B 95 -0.900 16.404 6.192 1.00 3.91 H new ATOM 3776 N LYS B 96 1.674 15.694 6.949 1.00 3.54 N ATOM 3777 CA LYS B 96 2.452 14.582 7.483 1.00 4.45 C ATOM 3778 C LYS B 96 3.852 14.520 6.872 1.00 4.54 C ATOM 3779 O LYS B 96 4.042 14.030 5.756 1.00 4.98 O ATOM 3780 CB LYS B 96 1.696 13.253 7.305 1.00 5.36 C ATOM 3781 CG LYS B 96 1.221 12.956 5.885 1.00 6.28 C ATOM 3782 CD LYS B 96 -0.248 12.555 5.874 1.00 7.13 C ATOM 3783 CE LYS B 96 -1.151 13.764 6.063 1.00 7.93 C ATOM 3784 NZ LYS B 96 -2.503 13.399 6.565 1.00 8.39 N ATOM 0 H LYS B 96 1.389 15.585 5.976 1.00 3.54 H new ATOM 0 HA LYS B 96 2.584 14.753 8.551 1.00 4.45 H new ATOM 0 HB2 LYS B 96 2.344 12.439 7.631 1.00 5.36 H new ATOM 0 HB3 LYS B 96 0.830 13.256 7.967 1.00 5.36 H new ATOM 0 HG2 LYS B 96 1.366 13.835 5.258 1.00 6.28 H new ATOM 0 HG3 LYS B 96 1.824 12.155 5.456 1.00 6.28 H new ATOM 0 HD2 LYS B 96 -0.486 12.064 4.930 1.00 7.13 H new ATOM 0 HD3 LYS B 96 -0.436 11.831 6.667 1.00 7.13 H new ATOM 0 HE2 LYS B 96 -0.683 14.456 6.763 1.00 7.93 H new ATOM 0 HE3 LYS B 96 -1.250 14.290 5.113 1.00 7.93 H new ATOM 0 HZ1 LYS B 96 -3.158 14.191 6.406 1.00 8.39 H new ATOM 0 HZ2 LYS B 96 -2.846 12.559 6.058 1.00 8.39 H new ATOM 0 HZ3 LYS B 96 -2.451 13.192 7.583 1.00 8.39 H new ATOM 3798 N GLN B 97 4.819 15.044 7.632 1.00 4.59 N ATOM 3799 CA GLN B 97 6.235 15.075 7.247 1.00 5.12 C ATOM 3800 C GLN B 97 6.462 15.628 5.833 1.00 5.38 C ATOM 3801 O GLN B 97 7.023 14.943 4.984 1.00 5.51 O ATOM 3802 CB GLN B 97 6.848 13.676 7.373 1.00 5.83 C ATOM 3803 CG GLN B 97 6.913 13.168 8.806 1.00 6.21 C ATOM 3804 CD GLN B 97 7.837 14.000 9.675 1.00 6.95 C ATOM 3805 OE1 GLN B 97 7.425 14.993 10.270 1.00 7.21 O ATOM 3806 NE2 GLN B 97 9.089 13.585 9.768 1.00 7.59 N ATOM 0 H GLN B 97 4.639 15.464 8.544 1.00 4.59 H new ATOM 0 HA GLN B 97 6.732 15.759 7.935 1.00 5.12 H new ATOM 0 HB2 GLN B 97 6.264 12.977 6.774 1.00 5.83 H new ATOM 0 HB3 GLN B 97 7.855 13.690 6.955 1.00 5.83 H new ATOM 0 HG2 GLN B 97 5.911 13.174 9.236 1.00 6.21 H new ATOM 0 HG3 GLN B 97 7.254 12.133 8.806 1.00 6.21 H new ATOM 0 HE21 GLN B 97 9.390 12.755 9.257 1.00 7.59 H new ATOM 0 HE22 GLN B 97 9.753 14.095 10.351 1.00 7.59 H new ATOM 3815 N PRO B 98 6.042 16.877 5.564 1.00 5.81 N ATOM 3816 CA PRO B 98 6.237 17.517 4.272 1.00 6.41 C ATOM 3817 C PRO B 98 7.500 18.382 4.240 1.00 6.44 C ATOM 3818 O PRO B 98 7.581 19.411 4.921 1.00 6.84 O ATOM 3819 CB PRO B 98 4.982 18.384 4.138 1.00 7.08 C ATOM 3820 CG PRO B 98 4.454 18.572 5.536 1.00 6.87 C ATOM 3821 CD PRO B 98 5.331 17.774 6.472 1.00 6.10 C ATOM 0 HA PRO B 98 6.371 16.799 3.463 1.00 6.41 H new ATOM 0 HB2 PRO B 98 5.218 19.344 3.678 1.00 7.08 H new ATOM 0 HB3 PRO B 98 4.240 17.900 3.503 1.00 7.08 H new ATOM 0 HG2 PRO B 98 4.464 19.627 5.809 1.00 6.87 H new ATOM 0 HG3 PRO B 98 3.419 18.236 5.602 1.00 6.87 H new ATOM 0 HD2 PRO B 98 6.017 18.414 7.028 1.00 6.10 H new ATOM 0 HD3 PRO B 98 4.743 17.223 7.206 1.00 6.10 H new ATOM 3829 N ARG B 99 8.485 17.959 3.458 1.00 6.34 N ATOM 3830 CA ARG B 99 9.770 18.644 3.389 1.00 6.64 C ATOM 3831 C ARG B 99 10.287 18.677 1.952 1.00 6.40 C ATOM 3832 O ARG B 99 10.914 17.716 1.497 1.00 6.77 O ATOM 3833 CB ARG B 99 10.803 17.929 4.265 1.00 6.94 C ATOM 3834 CG ARG B 99 10.331 17.630 5.677 1.00 7.54 C ATOM 3835 CD ARG B 99 11.256 16.643 6.362 1.00 7.94 C ATOM 3836 NE ARG B 99 11.459 15.445 5.546 1.00 8.46 N ATOM 3837 CZ ARG B 99 12.166 14.384 5.932 1.00 8.94 C ATOM 3838 NH1 ARG B 99 12.670 14.322 7.159 1.00 8.99 N ATOM 3839 NH2 ARG B 99 12.349 13.378 5.089 1.00 9.56 N ATOM 0 H ARG B 99 8.417 17.137 2.857 1.00 6.34 H new ATOM 0 HA ARG B 99 9.624 19.663 3.747 1.00 6.64 H new ATOM 0 HB2 ARG B 99 11.084 16.992 3.783 1.00 6.94 H new ATOM 0 HB3 ARG B 99 11.703 18.542 4.318 1.00 6.94 H new ATOM 0 HG2 ARG B 99 10.289 18.554 6.253 1.00 7.54 H new ATOM 0 HG3 ARG B 99 9.319 17.226 5.648 1.00 7.54 H new ATOM 0 HD2 ARG B 99 12.217 17.119 6.558 1.00 7.94 H new ATOM 0 HD3 ARG B 99 10.838 16.360 7.328 1.00 7.94 H new ATOM 0 HE ARG B 99 11.031 15.421 4.621 1.00 8.46 H new ATOM 0 HH11 ARG B 99 12.517 15.090 7.813 1.00 8.99 H new ATOM 0 HH12 ARG B 99 13.210 13.507 7.448 1.00 8.99 H new ATOM 0 HH21 ARG B 99 11.950 13.419 4.151 1.00 9.56 H new ATOM 0 HH22 ARG B 99 12.889 12.562 5.378 1.00 9.56 H new ATOM 3853 N LYS B 100 10.008 19.777 1.249 1.00 6.04 N ATOM 3854 CA LYS B 100 10.490 19.997 -0.123 1.00 5.97 C ATOM 3855 C LYS B 100 9.777 19.096 -1.132 1.00 5.32 C ATOM 3856 O LYS B 100 9.104 18.133 -0.765 1.00 5.54 O ATOM 3857 CB LYS B 100 12.003 19.768 -0.240 1.00 6.71 C ATOM 3858 CG LYS B 100 12.855 20.681 0.625 1.00 7.02 C ATOM 3859 CD LYS B 100 14.337 20.480 0.333 1.00 7.50 C ATOM 3860 CE LYS B 100 14.761 19.032 0.545 1.00 8.06 C ATOM 3861 NZ LYS B 100 16.157 18.785 0.091 1.00 8.50 N ATOM 0 H LYS B 100 9.441 20.543 1.612 1.00 6.04 H new ATOM 0 HA LYS B 100 10.265 21.038 -0.354 1.00 5.97 H new ATOM 0 HB2 LYS B 100 12.221 18.733 0.024 1.00 6.71 H new ATOM 0 HB3 LYS B 100 12.297 19.900 -1.281 1.00 6.71 H new ATOM 0 HG2 LYS B 100 12.582 21.720 0.442 1.00 7.02 H new ATOM 0 HG3 LYS B 100 12.657 20.480 1.678 1.00 7.02 H new ATOM 0 HD2 LYS B 100 14.549 20.775 -0.695 1.00 7.50 H new ATOM 0 HD3 LYS B 100 14.927 21.130 0.979 1.00 7.50 H new ATOM 0 HE2 LYS B 100 14.674 18.780 1.602 1.00 8.06 H new ATOM 0 HE3 LYS B 100 14.082 18.373 0.004 1.00 8.06 H new ATOM 0 HZ1 LYS B 100 16.404 17.788 0.254 1.00 8.50 H new ATOM 0 HZ2 LYS B 100 16.235 19.000 -0.924 1.00 8.50 H new ATOM 0 HZ3 LYS B 100 16.809 19.394 0.625 1.00 8.50 H new ATOM 3875 N LYS B 101 9.915 19.437 -2.408 1.00 4.83 N ATOM 3876 CA LYS B 101 9.413 18.606 -3.496 1.00 4.42 C ATOM 3877 C LYS B 101 10.468 18.513 -4.589 1.00 4.87 C ATOM 3878 O LYS B 101 10.412 19.314 -5.549 1.00 5.44 O ATOM 3879 CB LYS B 101 8.104 19.156 -4.089 1.00 3.91 C ATOM 3880 CG LYS B 101 6.892 19.037 -3.174 1.00 3.27 C ATOM 3881 CD LYS B 101 6.831 20.168 -2.164 1.00 3.64 C ATOM 3882 CE LYS B 101 5.671 19.991 -1.202 1.00 4.21 C ATOM 3883 NZ LYS B 101 5.535 21.148 -0.283 1.00 4.79 N ATOM 3884 OXT LYS B 101 11.373 17.661 -4.474 1.00 5.06 O ATOM 0 H LYS B 101 10.376 20.293 -2.717 1.00 4.83 H new ATOM 0 HA LYS B 101 9.200 17.618 -3.088 1.00 4.42 H new ATOM 0 HB2 LYS B 101 8.249 20.206 -4.343 1.00 3.91 H new ATOM 0 HB3 LYS B 101 7.893 18.629 -5.020 1.00 3.91 H new ATOM 0 HG2 LYS B 101 5.982 19.038 -3.775 1.00 3.27 H new ATOM 0 HG3 LYS B 101 6.926 18.083 -2.648 1.00 3.27 H new ATOM 0 HD2 LYS B 101 7.766 20.209 -1.605 1.00 3.64 H new ATOM 0 HD3 LYS B 101 6.730 21.119 -2.687 1.00 3.64 H new ATOM 0 HE2 LYS B 101 4.747 19.865 -1.766 1.00 4.21 H new ATOM 0 HE3 LYS B 101 5.817 19.080 -0.621 1.00 4.21 H new ATOM 0 HZ1 LYS B 101 4.732 20.989 0.358 1.00 4.79 H new ATOM 0 HZ2 LYS B 101 6.407 21.254 0.274 1.00 4.79 H new ATOM 0 HZ3 LYS B 101 5.371 22.013 -0.836 1.00 4.79 H new TER 3898 LYS B 101