USER MOD reduce.3.24.130724 H: found=0, std=0, add=1436, rem=0, adj=58 USER MOD reduce.3.24.130724 removed 1436 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 51 ASN : amide:sc=-0.000602 X(o=0.015,f=0.11) USER MOD Set 1.2: B 87 LYS NZ :NH3+ -175:sc= 0.0154 (180deg=8.8e-05) USER MOD Set 2.1: B 64 SER OG : rot -142:sc= 0.159 USER MOD Set 2.2: B 75 TYR OH : rot -34:sc= 1.64 USER MOD Set 3.1: A 67 THR OG1 : rot 180:sc= 0.0665 USER MOD Set 3.2: A 68 HIS :FLIP no HE2:sc= -4.69! C(o=-5.3!,f=-4.6!) USER MOD Set 4.1: A 64 SER OG : rot -134:sc= -0.374 USER MOD Set 4.2: A 75 TYR OH : rot 0:sc= 0.713 USER MOD Set 5.1: A 55 HIS : no HE2:sc= -21.7! C(o=-34!,f=-47!) USER MOD Set 5.2: A 88 SER OG : rot 85:sc= 1.78 USER MOD Set 5.3: B 55 HIS : no HE2:sc= -14.7! C(o=-34!,f=-44!) USER MOD Set 5.4: B 88 SER OG : rot -160:sc= 0.428! USER MOD Set 6.1: A 31 LYS NZ :NH3+ 169:sc= 0.238 (180deg=0) USER MOD Set 6.2: A 32 TYR OH : rot 180:sc= 0.228 USER MOD Single : A 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 1 MET N :NH3+ 167:sc= -0.022 (180deg=-0.22) USER MOD Single : A 2 CYS SG : rot 180:sc= 0 USER MOD Single : A 5 LYS NZ :NH3+ 172:sc= -0.626 (180deg=-0.881) USER MOD Single : A 9 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.0174) USER MOD Single : A 10 ASN : amide:sc= -0.812 X(o=-0.81,f=-0.56) USER MOD Single : A 13 MET CE :methyl -179:sc= -0.861 (180deg=-0.932) USER MOD Single : A 14 SER OG : rot 180:sc= 0 USER MOD Single : A 17 MET CE :methyl 148:sc= -3.68! (180deg=-6.19!) USER MOD Single : A 18 GLN :FLIP amide:sc= -6.24! C(o=-11!,f=-6.2!) USER MOD Single : A 19 GLN :FLIP amide:sc= -0.721 F(o=-5.3!,f=-0.72) USER MOD Single : A 21 SER OG : rot -83:sc= -7.5! USER MOD Single : A 24 CYS SG : rot -60:sc= 0.0141 USER MOD Single : A 26 THR OG1 : rot -5:sc= -1.59! USER MOD Single : A 27 GLN :FLIP amide:sc= -0.182 F(o=-1.5!,f=-0.18) USER MOD Single : A 33 ASN : amide:sc= -0.651 K(o=-0.65,f=-2.4!) USER MOD Single : A 36 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 41 HIS : no HE2:sc= -25.5! C(o=-25!,f=-29!) USER MOD Single : A 43 LYS NZ :NH3+ -110:sc= -0.238! (180deg=-2.59!) USER MOD Single : A 44 LYS NZ :NH3+ -148:sc= -0.289 (180deg=-1.49!) USER MOD Single : A 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 TYR OH : rot -130:sc= -1.81 USER MOD Single : A 51 ASN : amide:sc= -1.44 K(o=-1.4,f=-3.9!) USER MOD Single : A 53 THR OG1 : rot 180:sc= 0 USER MOD Single : A 56 CYS SG : rot -49:sc= -7.31! USER MOD Single : A 61 ASN :FLIP amide:sc= -0.224 F(o=-1.3!,f=-0.22) USER MOD Single : A 65 TYR OH : rot 180:sc= -0.307 USER MOD Single : A 70 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 72 HIS : no HD1:sc= -3.39! C(o=-3.4!,f=-3.6!) USER MOD Single : A 77 TYR OH : rot 180:sc= 0 USER MOD Single : A 80 GLN : amide:sc= -0.123 K(o=-0.12,f=-0.76) USER MOD Single : A 87 LYS NZ :NH3+ -135:sc= -10.3! (180deg=-12.3!) USER MOD Single : B 1 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 1 MET N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 2 CYS SG : rot 37:sc= 0.607 USER MOD Single : B 5 LYS NZ :NH3+ -156:sc= -0.167 (180deg=-0.677) USER MOD Single : B 9 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 10 ASN : amide:sc= 0.849 K(o=0.85,f=0) USER MOD Single : B 13 MET CE :methyl 150:sc= -1.6 (180deg=-3.32!) USER MOD Single : B 14 SER OG : rot 180:sc= 0 USER MOD Single : B 17 MET CE :methyl 160:sc= -12.1! (180deg=-14.7!) USER MOD Single : B 18 GLN : amide:sc= -15.3! C(o=-15!,f=-16!) USER MOD Single : B 19 GLN : amide:sc= -1.34 K(o=-1.3,f=-3.8!) USER MOD Single : B 21 SER OG : rot -15:sc= -6.88! USER MOD Single : B 24 CYS SG : rot -49:sc= 0.0258 USER MOD Single : B 26 THR OG1 : rot 79:sc= 1.23 USER MOD Single : B 27 GLN : amide:sc= -0.115 K(o=-0.11,f=-1.3!) USER MOD Single : B 31 LYS NZ :NH3+ 165:sc=-0.00626 (180deg=-0.0824) USER MOD Single : B 32 TYR OH : rot 180:sc= 0 USER MOD Single : B 33 ASN : amide:sc= -5.14! C(o=-5.1!,f=-12!) USER MOD Single : B 36 LYS NZ :NH3+ -170:sc= -1.53 (180deg=-2.01) USER MOD Single : B 41 HIS : no HD1:sc= -22.2! C(o=-22!,f=-27!) USER MOD Single : B 43 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 44 LYS NZ :NH3+ 172:sc= -1.4 (180deg=-1.65) USER MOD Single : B 48 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 50 TYR OH : rot 71:sc= -0.997! USER MOD Single : B 53 THR OG1 : rot 112:sc= -1.89 USER MOD Single : B 56 CYS SG : rot 123:sc= -1.91 USER MOD Single : B 61 ASN : amide:sc= -0.619 X(o=-0.62,f=-0.6) USER MOD Single : B 65 TYR OH : rot 180:sc= 0 USER MOD Single : B 67 THR OG1 : rot 102:sc= -0.366! USER MOD Single : B 68 HIS :FLIP no HD1:sc= -3.8! C(o=-5.7!,f=-3.8!) USER MOD Single : B 70 THR OG1 : rot 180:sc= 0.0557 USER MOD Single : B 71 LYS NZ :NH3+ -130:sc= -3.12! (180deg=-5.89!) USER MOD Single : B 72 HIS : no HD1:sc= -4.09! C(o=-4.1!,f=-5.3!) USER MOD Single : B 77 TYR OH : rot 180:sc= -0.29 USER MOD Single : B 80 GLN : amide:sc= -0.349 K(o=-0.35,f=-1.5!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 -27.917 3.247 5.065 1.00 0.00 N ATOM 2 CA MET A 1 -26.482 2.927 4.849 1.00 0.00 C ATOM 3 C MET A 1 -25.863 3.857 3.812 1.00 0.00 C ATOM 4 O MET A 1 -24.940 3.476 3.093 1.00 0.00 O ATOM 5 CB MET A 1 -26.372 1.473 4.387 1.00 0.00 C ATOM 6 CG MET A 1 -24.941 1.021 4.144 1.00 0.00 C ATOM 7 SD MET A 1 -24.474 -0.384 5.172 1.00 0.00 S ATOM 8 CE MET A 1 -24.967 -1.747 4.120 1.00 0.00 C ATOM 0 H1 MET A 1 -28.368 2.477 5.598 1.00 0.00 H new ATOM 0 H2 MET A 1 -27.998 4.134 5.602 1.00 0.00 H new ATOM 0 H3 MET A 1 -28.391 3.355 4.146 1.00 0.00 H new ATOM 0 HA MET A 1 -25.938 3.067 5.783 1.00 0.00 H new ATOM 0 HB2 MET A 1 -26.827 0.826 5.137 1.00 0.00 H new ATOM 0 HB3 MET A 1 -26.945 1.347 3.469 1.00 0.00 H new ATOM 0 HG2 MET A 1 -24.822 0.754 3.094 1.00 0.00 H new ATOM 0 HG3 MET A 1 -24.263 1.852 4.341 1.00 0.00 H new ATOM 0 HE1 MET A 1 -24.742 -2.690 4.618 1.00 0.00 H new ATOM 0 HE2 MET A 1 -26.037 -1.686 3.924 1.00 0.00 H new ATOM 0 HE3 MET A 1 -24.422 -1.695 3.178 1.00 0.00 H new ATOM 20 N CYS A 2 -26.378 5.080 3.744 1.00 0.00 N ATOM 21 CA CYS A 2 -25.878 6.068 2.796 1.00 0.00 C ATOM 22 C CYS A 2 -24.982 7.087 3.492 1.00 0.00 C ATOM 23 O CYS A 2 -25.068 8.286 3.227 1.00 0.00 O ATOM 24 CB CYS A 2 -27.042 6.784 2.110 1.00 0.00 C ATOM 25 SG CYS A 2 -27.572 6.016 0.561 1.00 0.00 S ATOM 0 H CYS A 2 -27.141 5.410 4.334 1.00 0.00 H new ATOM 0 HA CYS A 2 -25.288 5.544 2.044 1.00 0.00 H new ATOM 0 HB2 CYS A 2 -27.889 6.817 2.795 1.00 0.00 H new ATOM 0 HB3 CYS A 2 -26.753 7.816 1.911 1.00 0.00 H new ATOM 0 HG CYS A 2 -28.562 6.692 0.058 1.00 0.00 H new ATOM 31 N ASP A 3 -24.123 6.604 4.382 1.00 0.00 N ATOM 32 CA ASP A 3 -23.211 7.476 5.113 1.00 0.00 C ATOM 33 C ASP A 3 -21.763 7.199 4.724 1.00 0.00 C ATOM 34 O ASP A 3 -21.461 6.182 4.100 1.00 0.00 O ATOM 35 CB ASP A 3 -23.390 7.293 6.622 1.00 0.00 C ATOM 36 CG ASP A 3 -24.747 6.721 6.980 1.00 0.00 C ATOM 37 OD1 ASP A 3 -25.707 7.509 7.107 1.00 0.00 O ATOM 38 OD2 ASP A 3 -24.849 5.485 7.131 1.00 0.00 O ATOM 0 H ASP A 3 -24.039 5.614 4.615 1.00 0.00 H new ATOM 0 HA ASP A 3 -23.449 8.507 4.850 1.00 0.00 H new ATOM 0 HB2 ASP A 3 -22.610 6.632 7.000 1.00 0.00 H new ATOM 0 HB3 ASP A 3 -23.262 8.255 7.119 1.00 0.00 H new ATOM 43 N ARG A 4 -20.871 8.112 5.095 1.00 0.00 N ATOM 44 CA ARG A 4 -19.455 7.966 4.781 1.00 0.00 C ATOM 45 C ARG A 4 -18.633 7.748 6.048 1.00 0.00 C ATOM 46 O ARG A 4 -17.994 8.672 6.550 1.00 0.00 O ATOM 47 CB ARG A 4 -18.942 9.200 4.035 1.00 0.00 C ATOM 48 CG ARG A 4 -19.915 10.368 4.042 1.00 0.00 C ATOM 49 CD ARG A 4 -20.684 10.458 2.735 1.00 0.00 C ATOM 50 NE ARG A 4 -21.741 11.464 2.790 1.00 0.00 N ATOM 51 CZ ARG A 4 -21.559 12.743 2.476 1.00 0.00 C ATOM 52 NH1 ARG A 4 -20.363 13.171 2.094 1.00 0.00 N ATOM 53 NH2 ARG A 4 -22.573 13.595 2.543 1.00 0.00 N ATOM 0 H ARG A 4 -21.104 8.960 5.613 1.00 0.00 H new ATOM 0 HA ARG A 4 -19.343 7.091 4.141 1.00 0.00 H new ATOM 0 HB2 ARG A 4 -18.001 9.520 4.484 1.00 0.00 H new ATOM 0 HB3 ARG A 4 -18.726 8.925 3.003 1.00 0.00 H new ATOM 0 HG2 ARG A 4 -20.615 10.255 4.870 1.00 0.00 H new ATOM 0 HG3 ARG A 4 -19.369 11.297 4.209 1.00 0.00 H new ATOM 0 HD2 ARG A 4 -19.995 10.700 1.925 1.00 0.00 H new ATOM 0 HD3 ARG A 4 -21.120 9.486 2.503 1.00 0.00 H new ATOM 0 HE ARG A 4 -22.671 11.169 3.086 1.00 0.00 H new ATOM 0 HH11 ARG A 4 -19.581 12.518 2.041 1.00 0.00 H new ATOM 0 HH12 ARG A 4 -20.225 14.153 1.854 1.00 0.00 H new ATOM 0 HH21 ARG A 4 -23.494 13.269 2.836 1.00 0.00 H new ATOM 0 HH22 ARG A 4 -22.432 14.576 2.302 1.00 0.00 H new ATOM 67 N LYS A 5 -18.655 6.521 6.557 1.00 0.00 N ATOM 68 CA LYS A 5 -17.910 6.184 7.764 1.00 0.00 C ATOM 69 C LYS A 5 -16.409 6.319 7.528 1.00 0.00 C ATOM 70 O LYS A 5 -15.816 5.527 6.797 1.00 0.00 O ATOM 71 CB LYS A 5 -18.245 4.761 8.216 1.00 0.00 C ATOM 72 CG LYS A 5 -18.524 4.644 9.706 1.00 0.00 C ATOM 73 CD LYS A 5 -17.281 4.940 10.529 1.00 0.00 C ATOM 74 CE LYS A 5 -17.461 4.521 11.979 1.00 0.00 C ATOM 75 NZ LYS A 5 -18.511 3.475 12.131 1.00 0.00 N ATOM 0 H LYS A 5 -19.180 5.745 6.153 1.00 0.00 H new ATOM 0 HA LYS A 5 -18.200 6.882 8.550 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -19.116 4.409 7.663 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -17.416 4.102 7.958 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -19.319 5.336 9.984 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -18.881 3.640 9.933 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -16.426 4.416 10.101 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -17.057 6.006 10.482 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -16.515 4.144 12.368 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -17.727 5.392 12.578 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -18.509 3.121 13.109 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -19.442 3.884 11.913 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -18.316 2.690 11.478 1.00 0.00 H new ATOM 89 N ALA A 6 -15.806 7.328 8.155 1.00 0.00 N ATOM 90 CA ALA A 6 -14.374 7.584 8.026 1.00 0.00 C ATOM 91 C ALA A 6 -14.049 9.027 8.397 1.00 0.00 C ATOM 92 O ALA A 6 -14.949 9.838 8.617 1.00 0.00 O ATOM 93 CB ALA A 6 -13.900 7.286 6.611 1.00 0.00 C ATOM 0 H ALA A 6 -16.293 7.987 8.763 1.00 0.00 H new ATOM 0 HA ALA A 6 -13.849 6.922 8.715 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -12.831 7.483 6.536 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -14.093 6.239 6.375 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -14.436 7.922 5.906 1.00 0.00 H new ATOM 99 N VAL A 7 -12.760 9.344 8.463 1.00 0.00 N ATOM 100 CA VAL A 7 -12.325 10.693 8.807 1.00 0.00 C ATOM 101 C VAL A 7 -11.283 11.205 7.819 1.00 0.00 C ATOM 102 O VAL A 7 -10.113 11.361 8.164 1.00 0.00 O ATOM 103 CB VAL A 7 -11.738 10.751 10.230 1.00 0.00 C ATOM 104 CG1 VAL A 7 -11.589 12.193 10.687 1.00 0.00 C ATOM 105 CG2 VAL A 7 -12.605 9.962 11.199 1.00 0.00 C ATOM 0 H VAL A 7 -12.000 8.687 8.283 1.00 0.00 H new ATOM 0 HA VAL A 7 -13.209 11.329 8.761 1.00 0.00 H new ATOM 0 HB VAL A 7 -10.748 10.296 10.214 1.00 0.00 H new ATOM 0 HG11 VAL A 7 -11.173 12.214 11.694 1.00 0.00 H new ATOM 0 HG12 VAL A 7 -10.922 12.723 10.007 1.00 0.00 H new ATOM 0 HG13 VAL A 7 -12.566 12.677 10.687 1.00 0.00 H new ATOM 0 HG21 VAL A 7 -12.174 10.015 12.199 1.00 0.00 H new ATOM 0 HG22 VAL A 7 -13.610 10.384 11.214 1.00 0.00 H new ATOM 0 HG23 VAL A 7 -12.653 8.921 10.879 1.00 0.00 H new ATOM 115 N ILE A 8 -11.716 11.465 6.589 1.00 0.00 N ATOM 116 CA ILE A 8 -10.815 11.961 5.557 1.00 0.00 C ATOM 117 C ILE A 8 -9.741 12.860 6.167 1.00 0.00 C ATOM 118 O ILE A 8 -9.975 13.533 7.171 1.00 0.00 O ATOM 119 CB ILE A 8 -11.603 12.707 4.439 1.00 0.00 C ATOM 120 CG1 ILE A 8 -11.724 11.811 3.206 1.00 0.00 C ATOM 121 CG2 ILE A 8 -10.958 14.038 4.059 1.00 0.00 C ATOM 122 CD1 ILE A 8 -12.863 10.818 3.289 1.00 0.00 C ATOM 0 H ILE A 8 -12.682 11.341 6.285 1.00 0.00 H new ATOM 0 HA ILE A 8 -10.319 11.106 5.098 1.00 0.00 H new ATOM 0 HB ILE A 8 -12.594 12.933 4.833 1.00 0.00 H new ATOM 0 HG12 ILE A 8 -11.862 12.437 2.324 1.00 0.00 H new ATOM 0 HG13 ILE A 8 -10.789 11.268 3.068 1.00 0.00 H new ATOM 0 HG21 ILE A 8 -11.546 14.517 3.276 1.00 0.00 H new ATOM 0 HG22 ILE A 8 -10.921 14.687 4.934 1.00 0.00 H new ATOM 0 HG23 ILE A 8 -9.946 13.861 3.695 1.00 0.00 H new ATOM 0 HD11 ILE A 8 -12.888 10.216 2.380 1.00 0.00 H new ATOM 0 HD12 ILE A 8 -12.716 10.167 4.151 1.00 0.00 H new ATOM 0 HD13 ILE A 8 -13.806 11.354 3.395 1.00 0.00 H new ATOM 134 N LYS A 9 -8.565 12.864 5.551 1.00 0.00 N ATOM 135 CA LYS A 9 -7.452 13.678 6.032 1.00 0.00 C ATOM 136 C LYS A 9 -6.774 14.404 4.877 1.00 0.00 C ATOM 137 O LYS A 9 -5.970 15.313 5.086 1.00 0.00 O ATOM 138 CB LYS A 9 -6.433 12.806 6.767 1.00 0.00 C ATOM 139 CG LYS A 9 -7.047 11.944 7.859 1.00 0.00 C ATOM 140 CD LYS A 9 -6.948 12.614 9.220 1.00 0.00 C ATOM 141 CE LYS A 9 -8.314 12.754 9.872 1.00 0.00 C ATOM 142 NZ LYS A 9 -8.625 14.169 10.214 1.00 0.00 N ATOM 0 H LYS A 9 -8.356 12.314 4.718 1.00 0.00 H new ATOM 0 HA LYS A 9 -7.850 14.420 6.724 1.00 0.00 H new ATOM 0 HB2 LYS A 9 -5.931 12.161 6.046 1.00 0.00 H new ATOM 0 HB3 LYS A 9 -5.669 13.447 7.207 1.00 0.00 H new ATOM 0 HG2 LYS A 9 -8.093 11.748 7.624 1.00 0.00 H new ATOM 0 HG3 LYS A 9 -6.541 10.979 7.890 1.00 0.00 H new ATOM 0 HD2 LYS A 9 -6.293 12.031 9.867 1.00 0.00 H new ATOM 0 HD3 LYS A 9 -6.493 13.599 9.110 1.00 0.00 H new ATOM 0 HE2 LYS A 9 -9.079 12.367 9.199 1.00 0.00 H new ATOM 0 HE3 LYS A 9 -8.348 12.146 10.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 9 -9.517 14.209 10.747 1.00 0.00 H new ATOM 0 HZ2 LYS A 9 -7.857 14.563 10.794 1.00 0.00 H new ATOM 0 HZ3 LYS A 9 -8.718 14.725 9.340 1.00 0.00 H new ATOM 156 N ASN A 10 -7.104 13.995 3.659 1.00 0.00 N ATOM 157 CA ASN A 10 -6.527 14.602 2.466 1.00 0.00 C ATOM 158 C ASN A 10 -7.032 13.903 1.210 1.00 0.00 C ATOM 159 O ASN A 10 -6.472 12.893 0.783 1.00 0.00 O ATOM 160 CB ASN A 10 -5.002 14.534 2.525 1.00 0.00 C ATOM 161 CG ASN A 10 -4.370 15.892 2.757 1.00 0.00 C ATOM 162 OD1 ASN A 10 -3.503 16.047 3.617 1.00 0.00 O ATOM 163 ND2 ASN A 10 -4.804 16.885 1.990 1.00 0.00 N ATOM 0 H ASN A 10 -7.769 13.245 3.471 1.00 0.00 H new ATOM 0 HA ASN A 10 -6.835 15.647 2.429 1.00 0.00 H new ATOM 0 HB2 ASN A 10 -4.702 13.856 3.324 1.00 0.00 H new ATOM 0 HB3 ASN A 10 -4.624 14.115 1.593 1.00 0.00 H new ATOM 0 HD21 ASN A 10 -4.417 17.822 2.101 1.00 0.00 H new ATOM 0 HD22 ASN A 10 -5.525 16.711 1.289 1.00 0.00 H new ATOM 170 N ALA A 11 -8.098 14.440 0.627 1.00 0.00 N ATOM 171 CA ALA A 11 -8.679 13.859 -0.574 1.00 0.00 C ATOM 172 C ALA A 11 -8.885 14.904 -1.663 1.00 0.00 C ATOM 173 O ALA A 11 -9.825 15.697 -1.607 1.00 0.00 O ATOM 174 CB ALA A 11 -10.001 13.187 -0.243 1.00 0.00 C ATOM 0 H ALA A 11 -8.575 15.275 0.967 1.00 0.00 H new ATOM 0 HA ALA A 11 -7.978 13.115 -0.954 1.00 0.00 H new ATOM 0 HB1 ALA A 11 -10.427 12.756 -1.149 1.00 0.00 H new ATOM 0 HB2 ALA A 11 -9.835 12.398 0.491 1.00 0.00 H new ATOM 0 HB3 ALA A 11 -10.691 13.924 0.167 1.00 0.00 H new ATOM 180 N ASP A 12 -8.014 14.883 -2.663 1.00 0.00 N ATOM 181 CA ASP A 12 -8.110 15.814 -3.777 1.00 0.00 C ATOM 182 C ASP A 12 -8.850 15.159 -4.937 1.00 0.00 C ATOM 183 O ASP A 12 -8.631 15.490 -6.102 1.00 0.00 O ATOM 184 CB ASP A 12 -6.719 16.262 -4.225 1.00 0.00 C ATOM 185 CG ASP A 12 -6.191 17.421 -3.401 1.00 0.00 C ATOM 186 OD1 ASP A 12 -6.996 18.302 -3.031 1.00 0.00 O ATOM 187 OD2 ASP A 12 -4.973 17.448 -3.126 1.00 0.00 O ATOM 0 H ASP A 12 -7.233 14.230 -2.725 1.00 0.00 H new ATOM 0 HA ASP A 12 -8.665 16.693 -3.450 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -6.028 15.422 -4.150 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -6.755 16.553 -5.275 1.00 0.00 H new ATOM 192 N MET A 13 -9.723 14.217 -4.598 1.00 0.00 N ATOM 193 CA MET A 13 -10.504 13.491 -5.591 1.00 0.00 C ATOM 194 C MET A 13 -11.944 14.000 -5.626 1.00 0.00 C ATOM 195 O MET A 13 -12.366 14.759 -4.753 1.00 0.00 O ATOM 196 CB MET A 13 -10.469 11.991 -5.273 1.00 0.00 C ATOM 197 CG MET A 13 -11.669 11.210 -5.788 1.00 0.00 C ATOM 198 SD MET A 13 -12.212 9.940 -4.629 1.00 0.00 S ATOM 199 CE MET A 13 -10.739 8.926 -4.520 1.00 0.00 C ATOM 0 H MET A 13 -9.908 13.937 -3.635 1.00 0.00 H new ATOM 0 HA MET A 13 -10.068 13.658 -6.576 1.00 0.00 H new ATOM 0 HB2 MET A 13 -9.562 11.563 -5.700 1.00 0.00 H new ATOM 0 HB3 MET A 13 -10.404 11.863 -4.193 1.00 0.00 H new ATOM 0 HG2 MET A 13 -12.492 11.899 -5.980 1.00 0.00 H new ATOM 0 HG3 MET A 13 -11.414 10.744 -6.740 1.00 0.00 H new ATOM 0 HE1 MET A 13 -10.924 8.086 -3.851 1.00 0.00 H new ATOM 0 HE2 MET A 13 -10.481 8.551 -5.511 1.00 0.00 H new ATOM 0 HE3 MET A 13 -9.914 9.523 -4.132 1.00 0.00 H new ATOM 209 N SER A 14 -12.691 13.578 -6.640 1.00 0.00 N ATOM 210 CA SER A 14 -14.082 13.990 -6.790 1.00 0.00 C ATOM 211 C SER A 14 -14.862 13.756 -5.501 1.00 0.00 C ATOM 212 O SER A 14 -14.912 12.638 -4.991 1.00 0.00 O ATOM 213 CB SER A 14 -14.740 13.226 -7.941 1.00 0.00 C ATOM 214 OG SER A 14 -15.209 14.114 -8.941 1.00 0.00 O ATOM 0 H SER A 14 -12.356 12.950 -7.371 1.00 0.00 H new ATOM 0 HA SER A 14 -14.096 15.057 -7.014 1.00 0.00 H new ATOM 0 HB2 SER A 14 -14.023 12.530 -8.376 1.00 0.00 H new ATOM 0 HB3 SER A 14 -15.570 12.632 -7.559 1.00 0.00 H new ATOM 0 HG SER A 14 -15.623 13.601 -9.666 1.00 0.00 H new ATOM 220 N GLU A 15 -15.470 14.818 -4.981 1.00 0.00 N ATOM 221 CA GLU A 15 -16.248 14.722 -3.751 1.00 0.00 C ATOM 222 C GLU A 15 -16.959 13.376 -3.663 1.00 0.00 C ATOM 223 O GLU A 15 -16.613 12.535 -2.834 1.00 0.00 O ATOM 224 CB GLU A 15 -17.273 15.858 -3.675 1.00 0.00 C ATOM 225 CG GLU A 15 -17.394 16.661 -4.960 1.00 0.00 C ATOM 226 CD GLU A 15 -18.186 15.933 -6.029 1.00 0.00 C ATOM 227 OE1 GLU A 15 -19.319 15.498 -5.734 1.00 0.00 O ATOM 228 OE2 GLU A 15 -17.673 15.797 -7.159 1.00 0.00 O ATOM 0 H GLU A 15 -15.439 15.752 -5.391 1.00 0.00 H new ATOM 0 HA GLU A 15 -15.560 14.808 -2.910 1.00 0.00 H new ATOM 0 HB2 GLU A 15 -18.248 15.439 -3.426 1.00 0.00 H new ATOM 0 HB3 GLU A 15 -16.998 16.530 -2.862 1.00 0.00 H new ATOM 0 HG2 GLU A 15 -17.874 17.616 -4.744 1.00 0.00 H new ATOM 0 HG3 GLU A 15 -16.397 16.884 -5.340 1.00 0.00 H new ATOM 235 N GLU A 16 -17.951 13.177 -4.523 1.00 0.00 N ATOM 236 CA GLU A 16 -18.702 11.929 -4.540 1.00 0.00 C ATOM 237 C GLU A 16 -17.757 10.737 -4.631 1.00 0.00 C ATOM 238 O GLU A 16 -18.070 9.645 -4.157 1.00 0.00 O ATOM 239 CB GLU A 16 -19.681 11.910 -5.716 1.00 0.00 C ATOM 240 CG GLU A 16 -20.233 10.527 -6.023 1.00 0.00 C ATOM 241 CD GLU A 16 -21.284 10.546 -7.116 1.00 0.00 C ATOM 242 OE1 GLU A 16 -21.107 11.298 -8.097 1.00 0.00 O ATOM 243 OE2 GLU A 16 -22.283 9.807 -6.991 1.00 0.00 O ATOM 0 H GLU A 16 -18.253 13.862 -5.216 1.00 0.00 H new ATOM 0 HA GLU A 16 -19.267 11.858 -3.610 1.00 0.00 H new ATOM 0 HB2 GLU A 16 -20.510 12.584 -5.499 1.00 0.00 H new ATOM 0 HB3 GLU A 16 -19.179 12.297 -6.603 1.00 0.00 H new ATOM 0 HG2 GLU A 16 -19.415 9.872 -6.323 1.00 0.00 H new ATOM 0 HG3 GLU A 16 -20.665 10.103 -5.116 1.00 0.00 H new ATOM 250 N MET A 17 -16.597 10.956 -5.243 1.00 0.00 N ATOM 251 CA MET A 17 -15.603 9.902 -5.393 1.00 0.00 C ATOM 252 C MET A 17 -14.944 9.582 -4.054 1.00 0.00 C ATOM 253 O MET A 17 -14.725 8.418 -3.722 1.00 0.00 O ATOM 254 CB MET A 17 -14.542 10.310 -6.418 1.00 0.00 C ATOM 255 CG MET A 17 -14.883 9.901 -7.843 1.00 0.00 C ATOM 256 SD MET A 17 -13.680 8.755 -8.543 1.00 0.00 S ATOM 257 CE MET A 17 -13.813 7.382 -7.400 1.00 0.00 C ATOM 0 H MET A 17 -16.324 11.854 -5.642 1.00 0.00 H new ATOM 0 HA MET A 17 -16.111 9.006 -5.750 1.00 0.00 H new ATOM 0 HB2 MET A 17 -14.410 11.391 -6.381 1.00 0.00 H new ATOM 0 HB3 MET A 17 -13.588 9.863 -6.139 1.00 0.00 H new ATOM 0 HG2 MET A 17 -15.870 9.439 -7.858 1.00 0.00 H new ATOM 0 HG3 MET A 17 -14.938 10.791 -8.469 1.00 0.00 H new ATOM 0 HE1 MET A 17 -13.625 6.448 -7.930 1.00 0.00 H new ATOM 0 HE2 MET A 17 -13.080 7.500 -6.602 1.00 0.00 H new ATOM 0 HE3 MET A 17 -14.815 7.361 -6.972 1.00 0.00 H new ATOM 267 N GLN A 18 -14.637 10.623 -3.282 1.00 0.00 N ATOM 268 CA GLN A 18 -14.013 10.443 -1.975 1.00 0.00 C ATOM 269 C GLN A 18 -14.984 9.770 -1.013 1.00 0.00 C ATOM 270 O GLN A 18 -14.576 9.040 -0.109 1.00 0.00 O ATOM 271 CB GLN A 18 -13.552 11.789 -1.407 1.00 0.00 C ATOM 272 CG GLN A 18 -14.112 12.990 -2.147 1.00 0.00 C ATOM 273 CD GLN A 18 -13.070 14.065 -2.391 1.00 0.00 C ATOM 274 OE1 GLN A 18 -11.857 13.647 -2.738 1.00 0.00 O flip ATOM 275 NE2 GLN A 18 -13.350 15.258 -2.268 1.00 0.00 N flip ATOM 0 H GLN A 18 -14.810 11.595 -3.538 1.00 0.00 H new ATOM 0 HA GLN A 18 -13.140 9.802 -2.097 1.00 0.00 H new ATOM 0 HB2 GLN A 18 -13.846 11.850 -0.359 1.00 0.00 H new ATOM 0 HB3 GLN A 18 -12.463 11.831 -1.436 1.00 0.00 H new ATOM 0 HG2 GLN A 18 -14.522 12.664 -3.103 1.00 0.00 H new ATOM 0 HG3 GLN A 18 -14.937 13.413 -1.574 1.00 0.00 H new ATOM 0 HE21 GLN A 18 -14.294 15.535 -2.000 1.00 0.00 H new ATOM 0 HE22 GLN A 18 -12.638 15.969 -2.434 1.00 0.00 H new ATOM 284 N GLN A 19 -16.276 10.007 -1.227 1.00 0.00 N ATOM 285 CA GLN A 19 -17.308 9.410 -0.393 1.00 0.00 C ATOM 286 C GLN A 19 -17.503 7.956 -0.792 1.00 0.00 C ATOM 287 O GLN A 19 -17.624 7.071 0.057 1.00 0.00 O ATOM 288 CB GLN A 19 -18.622 10.188 -0.524 1.00 0.00 C ATOM 289 CG GLN A 19 -19.503 9.725 -1.675 1.00 0.00 C ATOM 290 CD GLN A 19 -20.958 9.583 -1.273 1.00 0.00 C ATOM 291 OE1 GLN A 19 -21.199 9.396 0.020 1.00 0.00 O flip ATOM 292 NE2 GLN A 19 -21.856 9.641 -2.114 1.00 0.00 N flip ATOM 0 H GLN A 19 -16.630 10.608 -1.971 1.00 0.00 H new ATOM 0 HA GLN A 19 -16.995 9.454 0.650 1.00 0.00 H new ATOM 0 HB2 GLN A 19 -19.181 10.097 0.407 1.00 0.00 H new ATOM 0 HB3 GLN A 19 -18.394 11.246 -0.657 1.00 0.00 H new ATOM 0 HG2 GLN A 19 -19.425 10.436 -2.497 1.00 0.00 H new ATOM 0 HG3 GLN A 19 -19.137 8.768 -2.046 1.00 0.00 H new ATOM 0 HE21 GLN A 19 -21.626 9.786 -3.097 1.00 0.00 H new ATOM 0 HE22 GLN A 19 -22.830 9.544 -1.827 1.00 0.00 H new ATOM 301 N ASP A 20 -17.511 7.719 -2.098 1.00 0.00 N ATOM 302 CA ASP A 20 -17.666 6.376 -2.624 1.00 0.00 C ATOM 303 C ASP A 20 -16.419 5.561 -2.315 1.00 0.00 C ATOM 304 O ASP A 20 -16.478 4.341 -2.159 1.00 0.00 O ATOM 305 CB ASP A 20 -17.916 6.414 -4.133 1.00 0.00 C ATOM 306 CG ASP A 20 -19.163 5.651 -4.532 1.00 0.00 C ATOM 307 OD1 ASP A 20 -19.190 4.416 -4.343 1.00 0.00 O ATOM 308 OD2 ASP A 20 -20.114 6.288 -5.033 1.00 0.00 O ATOM 0 H ASP A 20 -17.412 8.443 -2.810 1.00 0.00 H new ATOM 0 HA ASP A 20 -18.528 5.907 -2.149 1.00 0.00 H new ATOM 0 HB2 ASP A 20 -18.008 7.451 -4.457 1.00 0.00 H new ATOM 0 HB3 ASP A 20 -17.055 5.993 -4.652 1.00 0.00 H new ATOM 313 N SER A 21 -15.288 6.256 -2.210 1.00 0.00 N ATOM 314 CA SER A 21 -14.020 5.614 -1.898 1.00 0.00 C ATOM 315 C SER A 21 -14.050 5.067 -0.479 1.00 0.00 C ATOM 316 O SER A 21 -13.751 3.896 -0.247 1.00 0.00 O ATOM 317 CB SER A 21 -12.866 6.607 -2.053 1.00 0.00 C ATOM 318 OG SER A 21 -11.646 6.047 -1.597 1.00 0.00 O ATOM 0 H SER A 21 -15.228 7.266 -2.337 1.00 0.00 H new ATOM 0 HA SER A 21 -13.865 4.790 -2.594 1.00 0.00 H new ATOM 0 HB2 SER A 21 -12.769 6.896 -3.100 1.00 0.00 H new ATOM 0 HB3 SER A 21 -13.085 7.515 -1.491 1.00 0.00 H new ATOM 0 HG SER A 21 -11.586 6.141 -0.623 1.00 0.00 H new ATOM 324 N VAL A 22 -14.431 5.919 0.468 1.00 0.00 N ATOM 325 CA VAL A 22 -14.519 5.508 1.860 1.00 0.00 C ATOM 326 C VAL A 22 -15.410 4.281 1.983 1.00 0.00 C ATOM 327 O VAL A 22 -15.058 3.305 2.647 1.00 0.00 O ATOM 328 CB VAL A 22 -15.080 6.631 2.753 1.00 0.00 C ATOM 329 CG1 VAL A 22 -15.203 6.157 4.192 1.00 0.00 C ATOM 330 CG2 VAL A 22 -14.206 7.873 2.666 1.00 0.00 C ATOM 0 H VAL A 22 -14.682 6.893 0.296 1.00 0.00 H new ATOM 0 HA VAL A 22 -13.509 5.275 2.197 1.00 0.00 H new ATOM 0 HB VAL A 22 -16.076 6.891 2.393 1.00 0.00 H new ATOM 0 HG11 VAL A 22 -15.601 6.963 4.808 1.00 0.00 H new ATOM 0 HG12 VAL A 22 -15.876 5.301 4.237 1.00 0.00 H new ATOM 0 HG13 VAL A 22 -14.221 5.867 4.565 1.00 0.00 H new ATOM 0 HG21 VAL A 22 -14.619 8.654 3.304 1.00 0.00 H new ATOM 0 HG22 VAL A 22 -13.196 7.631 2.997 1.00 0.00 H new ATOM 0 HG23 VAL A 22 -14.175 8.225 1.635 1.00 0.00 H new ATOM 340 N GLU A 23 -16.564 4.335 1.324 1.00 0.00 N ATOM 341 CA GLU A 23 -17.506 3.224 1.343 1.00 0.00 C ATOM 342 C GLU A 23 -16.818 1.939 0.904 1.00 0.00 C ATOM 343 O GLU A 23 -16.999 0.885 1.514 1.00 0.00 O ATOM 344 CB GLU A 23 -18.698 3.518 0.429 1.00 0.00 C ATOM 345 CG GLU A 23 -19.752 4.405 1.071 1.00 0.00 C ATOM 346 CD GLU A 23 -20.912 3.613 1.646 1.00 0.00 C ATOM 347 OE1 GLU A 23 -21.891 3.372 0.907 1.00 0.00 O ATOM 348 OE2 GLU A 23 -20.841 3.233 2.833 1.00 0.00 O ATOM 0 H GLU A 23 -16.868 5.136 0.771 1.00 0.00 H new ATOM 0 HA GLU A 23 -17.869 3.098 2.363 1.00 0.00 H new ATOM 0 HB2 GLU A 23 -18.338 3.997 -0.482 1.00 0.00 H new ATOM 0 HB3 GLU A 23 -19.159 2.576 0.133 1.00 0.00 H new ATOM 0 HG2 GLU A 23 -19.291 4.994 1.864 1.00 0.00 H new ATOM 0 HG3 GLU A 23 -20.130 5.109 0.329 1.00 0.00 H new ATOM 355 N CYS A 24 -16.016 2.037 -0.151 1.00 0.00 N ATOM 356 CA CYS A 24 -15.286 0.884 -0.664 1.00 0.00 C ATOM 357 C CYS A 24 -14.325 0.364 0.396 1.00 0.00 C ATOM 358 O CYS A 24 -14.176 -0.848 0.582 1.00 0.00 O ATOM 359 CB CYS A 24 -14.522 1.257 -1.935 1.00 0.00 C ATOM 360 SG CYS A 24 -14.941 0.242 -3.372 1.00 0.00 S ATOM 0 H CYS A 24 -15.855 2.902 -0.667 1.00 0.00 H new ATOM 0 HA CYS A 24 -16.000 0.098 -0.910 1.00 0.00 H new ATOM 0 HB2 CYS A 24 -14.720 2.302 -2.172 1.00 0.00 H new ATOM 0 HB3 CYS A 24 -13.453 1.171 -1.742 1.00 0.00 H new ATOM 0 HG CYS A 24 -14.662 -1.003 -3.121 1.00 0.00 H new ATOM 366 N ALA A 25 -13.698 1.289 1.118 1.00 0.00 N ATOM 367 CA ALA A 25 -12.784 0.920 2.182 1.00 0.00 C ATOM 368 C ALA A 25 -13.589 0.316 3.312 1.00 0.00 C ATOM 369 O ALA A 25 -13.128 -0.573 4.028 1.00 0.00 O ATOM 370 CB ALA A 25 -11.996 2.130 2.662 1.00 0.00 C ATOM 0 H ALA A 25 -13.809 2.294 0.983 1.00 0.00 H new ATOM 0 HA ALA A 25 -12.062 0.191 1.814 1.00 0.00 H new ATOM 0 HB1 ALA A 25 -11.317 1.829 3.460 1.00 0.00 H new ATOM 0 HB2 ALA A 25 -11.421 2.542 1.833 1.00 0.00 H new ATOM 0 HB3 ALA A 25 -12.685 2.887 3.038 1.00 0.00 H new ATOM 376 N THR A 26 -14.819 0.799 3.434 1.00 0.00 N ATOM 377 CA THR A 26 -15.738 0.312 4.441 1.00 0.00 C ATOM 378 C THR A 26 -16.184 -1.096 4.085 1.00 0.00 C ATOM 379 O THR A 26 -16.342 -1.950 4.955 1.00 0.00 O ATOM 380 CB THR A 26 -16.949 1.233 4.543 1.00 0.00 C ATOM 381 OG1 THR A 26 -16.601 2.563 4.206 1.00 0.00 O ATOM 382 CG2 THR A 26 -17.560 1.252 5.921 1.00 0.00 C ATOM 0 H THR A 26 -15.201 1.535 2.839 1.00 0.00 H new ATOM 0 HA THR A 26 -15.232 0.297 5.406 1.00 0.00 H new ATOM 0 HB THR A 26 -17.680 0.832 3.841 1.00 0.00 H new ATOM 0 HG1 THR A 26 -15.634 2.620 4.055 1.00 0.00 H new ATOM 0 HG21 THR A 26 -18.417 1.925 5.930 1.00 0.00 H new ATOM 0 HG22 THR A 26 -17.885 0.247 6.189 1.00 0.00 H new ATOM 0 HG23 THR A 26 -16.820 1.598 6.642 1.00 0.00 H new ATOM 390 N GLN A 27 -16.364 -1.334 2.788 1.00 0.00 N ATOM 391 CA GLN A 27 -16.767 -2.646 2.308 1.00 0.00 C ATOM 392 C GLN A 27 -15.733 -3.674 2.738 1.00 0.00 C ATOM 393 O GLN A 27 -16.072 -4.767 3.192 1.00 0.00 O ATOM 394 CB GLN A 27 -16.908 -2.643 0.785 1.00 0.00 C ATOM 395 CG GLN A 27 -18.241 -2.097 0.299 1.00 0.00 C ATOM 396 CD GLN A 27 -18.598 -2.584 -1.092 1.00 0.00 C ATOM 397 OE1 GLN A 27 -18.262 -3.834 -1.386 1.00 0.00 O flip ATOM 398 NE2 GLN A 27 -19.169 -1.844 -1.893 1.00 0.00 N flip ATOM 0 H GLN A 27 -16.237 -0.636 2.056 1.00 0.00 H new ATOM 0 HA GLN A 27 -17.736 -2.901 2.737 1.00 0.00 H new ATOM 0 HB2 GLN A 27 -16.102 -2.048 0.355 1.00 0.00 H new ATOM 0 HB3 GLN A 27 -16.785 -3.661 0.415 1.00 0.00 H new ATOM 0 HG2 GLN A 27 -19.026 -2.392 0.996 1.00 0.00 H new ATOM 0 HG3 GLN A 27 -18.206 -1.008 0.301 1.00 0.00 H new ATOM 0 HE21 GLN A 27 -19.409 -0.890 -1.624 1.00 0.00 H new ATOM 0 HE22 GLN A 27 -19.403 -2.185 -2.825 1.00 0.00 H new ATOM 407 N ALA A 28 -14.466 -3.297 2.610 1.00 0.00 N ATOM 408 CA ALA A 28 -13.363 -4.166 3.002 1.00 0.00 C ATOM 409 C ALA A 28 -13.159 -4.113 4.513 1.00 0.00 C ATOM 410 O ALA A 28 -12.603 -5.033 5.110 1.00 0.00 O ATOM 411 CB ALA A 28 -12.088 -3.766 2.278 1.00 0.00 C ATOM 0 H ALA A 28 -14.177 -2.393 2.237 1.00 0.00 H new ATOM 0 HA ALA A 28 -13.610 -5.190 2.721 1.00 0.00 H new ATOM 0 HB1 ALA A 28 -11.275 -4.425 2.582 1.00 0.00 H new ATOM 0 HB2 ALA A 28 -12.239 -3.849 1.202 1.00 0.00 H new ATOM 0 HB3 ALA A 28 -11.834 -2.736 2.530 1.00 0.00 H new ATOM 417 N LEU A 29 -13.616 -3.023 5.122 1.00 0.00 N ATOM 418 CA LEU A 29 -13.494 -2.840 6.561 1.00 0.00 C ATOM 419 C LEU A 29 -14.593 -3.592 7.303 1.00 0.00 C ATOM 420 O LEU A 29 -14.430 -3.966 8.465 1.00 0.00 O ATOM 421 CB LEU A 29 -13.559 -1.358 6.909 1.00 0.00 C ATOM 422 CG LEU A 29 -12.263 -0.596 6.662 1.00 0.00 C ATOM 423 CD1 LEU A 29 -12.561 0.812 6.190 1.00 0.00 C ATOM 424 CD2 LEU A 29 -11.412 -0.570 7.923 1.00 0.00 C ATOM 0 H LEU A 29 -14.075 -2.252 4.638 1.00 0.00 H new ATOM 0 HA LEU A 29 -12.530 -3.242 6.872 1.00 0.00 H new ATOM 0 HB2 LEU A 29 -14.355 -0.895 6.326 1.00 0.00 H new ATOM 0 HB3 LEU A 29 -13.832 -1.256 7.959 1.00 0.00 H new ATOM 0 HG LEU A 29 -11.702 -1.109 5.881 1.00 0.00 H new ATOM 0 HD11 LEU A 29 -11.625 1.344 6.018 1.00 0.00 H new ATOM 0 HD12 LEU A 29 -13.131 0.772 5.262 1.00 0.00 H new ATOM 0 HD13 LEU A 29 -13.141 1.335 6.950 1.00 0.00 H new ATOM 0 HD21 LEU A 29 -10.490 -0.022 7.729 1.00 0.00 H new ATOM 0 HD22 LEU A 29 -11.964 -0.079 8.724 1.00 0.00 H new ATOM 0 HD23 LEU A 29 -11.171 -1.591 8.221 1.00 0.00 H new ATOM 436 N GLU A 30 -15.716 -3.802 6.622 1.00 0.00 N ATOM 437 CA GLU A 30 -16.852 -4.499 7.209 1.00 0.00 C ATOM 438 C GLU A 30 -16.794 -5.995 6.914 1.00 0.00 C ATOM 439 O GLU A 30 -17.231 -6.813 7.722 1.00 0.00 O ATOM 440 CB GLU A 30 -18.161 -3.910 6.678 1.00 0.00 C ATOM 441 CG GLU A 30 -18.860 -2.993 7.668 1.00 0.00 C ATOM 442 CD GLU A 30 -19.291 -3.716 8.929 1.00 0.00 C ATOM 443 OE1 GLU A 30 -18.852 -4.868 9.132 1.00 0.00 O ATOM 444 OE2 GLU A 30 -20.068 -3.131 9.713 1.00 0.00 O ATOM 0 H GLU A 30 -15.862 -3.497 5.660 1.00 0.00 H new ATOM 0 HA GLU A 30 -16.809 -4.365 8.290 1.00 0.00 H new ATOM 0 HB2 GLU A 30 -17.955 -3.354 5.763 1.00 0.00 H new ATOM 0 HB3 GLU A 30 -18.835 -4.724 6.411 1.00 0.00 H new ATOM 0 HG2 GLU A 30 -18.191 -2.174 7.934 1.00 0.00 H new ATOM 0 HG3 GLU A 30 -19.734 -2.549 7.192 1.00 0.00 H new ATOM 451 N LYS A 31 -16.250 -6.346 5.752 1.00 0.00 N ATOM 452 CA LYS A 31 -16.135 -7.745 5.356 1.00 0.00 C ATOM 453 C LYS A 31 -14.857 -8.361 5.912 1.00 0.00 C ATOM 454 O LYS A 31 -14.770 -9.573 6.103 1.00 0.00 O ATOM 455 CB LYS A 31 -16.156 -7.870 3.832 1.00 0.00 C ATOM 456 CG LYS A 31 -17.555 -8.025 3.257 1.00 0.00 C ATOM 457 CD LYS A 31 -17.647 -7.445 1.858 1.00 0.00 C ATOM 458 CE LYS A 31 -18.095 -8.491 0.849 1.00 0.00 C ATOM 459 NZ LYS A 31 -17.173 -8.572 -0.317 1.00 0.00 N ATOM 0 H LYS A 31 -15.883 -5.682 5.070 1.00 0.00 H new ATOM 0 HA LYS A 31 -16.987 -8.286 5.767 1.00 0.00 H new ATOM 0 HB2 LYS A 31 -15.688 -6.987 3.396 1.00 0.00 H new ATOM 0 HB3 LYS A 31 -15.553 -8.729 3.537 1.00 0.00 H new ATOM 0 HG2 LYS A 31 -17.825 -9.081 3.233 1.00 0.00 H new ATOM 0 HG3 LYS A 31 -18.274 -7.527 3.907 1.00 0.00 H new ATOM 0 HD2 LYS A 31 -18.348 -6.611 1.854 1.00 0.00 H new ATOM 0 HD3 LYS A 31 -16.676 -7.046 1.564 1.00 0.00 H new ATOM 0 HE2 LYS A 31 -18.150 -9.465 1.336 1.00 0.00 H new ATOM 0 HE3 LYS A 31 -19.100 -8.252 0.501 1.00 0.00 H new ATOM 0 HZ1 LYS A 31 -17.403 -9.413 -0.884 1.00 0.00 H new ATOM 0 HZ2 LYS A 31 -17.279 -7.720 -0.903 1.00 0.00 H new ATOM 0 HZ3 LYS A 31 -16.192 -8.640 0.020 1.00 0.00 H new ATOM 473 N TYR A 32 -13.867 -7.513 6.173 1.00 0.00 N ATOM 474 CA TYR A 32 -12.591 -7.967 6.710 1.00 0.00 C ATOM 475 C TYR A 32 -11.955 -6.882 7.573 1.00 0.00 C ATOM 476 O TYR A 32 -12.240 -5.696 7.405 1.00 0.00 O ATOM 477 CB TYR A 32 -11.635 -8.354 5.578 1.00 0.00 C ATOM 478 CG TYR A 32 -12.304 -8.486 4.226 1.00 0.00 C ATOM 479 CD1 TYR A 32 -12.975 -7.414 3.652 1.00 0.00 C ATOM 480 CD2 TYR A 32 -12.258 -9.682 3.521 1.00 0.00 C ATOM 481 CE1 TYR A 32 -13.583 -7.529 2.416 1.00 0.00 C ATOM 482 CE2 TYR A 32 -12.861 -9.806 2.284 1.00 0.00 C ATOM 483 CZ TYR A 32 -13.522 -8.728 1.735 1.00 0.00 C ATOM 484 OH TYR A 32 -14.123 -8.847 0.504 1.00 0.00 O ATOM 0 H TYR A 32 -13.925 -6.506 6.021 1.00 0.00 H new ATOM 0 HA TYR A 32 -12.780 -8.845 7.328 1.00 0.00 H new ATOM 0 HB2 TYR A 32 -10.846 -7.605 5.510 1.00 0.00 H new ATOM 0 HB3 TYR A 32 -11.155 -9.300 5.829 1.00 0.00 H new ATOM 0 HD1 TYR A 32 -13.023 -6.474 4.181 1.00 0.00 H new ATOM 0 HD2 TYR A 32 -11.742 -10.530 3.947 1.00 0.00 H new ATOM 0 HE1 TYR A 32 -14.103 -6.686 1.986 1.00 0.00 H new ATOM 0 HE2 TYR A 32 -12.815 -10.743 1.750 1.00 0.00 H new ATOM 0 HH TYR A 32 -13.986 -9.754 0.160 1.00 0.00 H new ATOM 494 N ASN A 33 -11.091 -7.292 8.495 1.00 0.00 N ATOM 495 CA ASN A 33 -10.414 -6.352 9.380 1.00 0.00 C ATOM 496 C ASN A 33 -8.902 -6.501 9.270 1.00 0.00 C ATOM 497 O ASN A 33 -8.166 -6.231 10.220 1.00 0.00 O ATOM 498 CB ASN A 33 -10.856 -6.572 10.828 1.00 0.00 C ATOM 499 CG ASN A 33 -12.105 -7.424 10.926 1.00 0.00 C ATOM 500 OD1 ASN A 33 -13.094 -7.176 10.234 1.00 0.00 O ATOM 501 ND2 ASN A 33 -12.068 -8.433 11.786 1.00 0.00 N ATOM 0 H ASN A 33 -10.843 -8.269 8.649 1.00 0.00 H new ATOM 0 HA ASN A 33 -10.687 -5.342 9.075 1.00 0.00 H new ATOM 0 HB2 ASN A 33 -10.049 -7.050 11.383 1.00 0.00 H new ATOM 0 HB3 ASN A 33 -11.040 -5.607 11.300 1.00 0.00 H new ATOM 0 HD21 ASN A 33 -12.880 -9.041 11.895 1.00 0.00 H new ATOM 0 HD22 ASN A 33 -11.227 -8.601 12.339 1.00 0.00 H new ATOM 508 N ILE A 34 -8.448 -6.932 8.100 1.00 0.00 N ATOM 509 CA ILE A 34 -7.026 -7.120 7.851 1.00 0.00 C ATOM 510 C ILE A 34 -6.484 -6.027 6.943 1.00 0.00 C ATOM 511 O ILE A 34 -6.770 -6.010 5.748 1.00 0.00 O ATOM 512 CB ILE A 34 -6.746 -8.490 7.202 1.00 0.00 C ATOM 513 CG1 ILE A 34 -7.500 -9.598 7.939 1.00 0.00 C ATOM 514 CG2 ILE A 34 -5.252 -8.773 7.182 1.00 0.00 C ATOM 515 CD1 ILE A 34 -7.301 -9.575 9.437 1.00 0.00 C ATOM 0 H ILE A 34 -9.047 -7.158 7.306 1.00 0.00 H new ATOM 0 HA ILE A 34 -6.525 -7.073 8.818 1.00 0.00 H new ATOM 0 HB ILE A 34 -7.102 -8.465 6.172 1.00 0.00 H new ATOM 0 HG12 ILE A 34 -8.564 -9.508 7.721 1.00 0.00 H new ATOM 0 HG13 ILE A 34 -7.176 -10.565 7.553 1.00 0.00 H new ATOM 0 HG21 ILE A 34 -5.072 -9.744 6.721 1.00 0.00 H new ATOM 0 HG22 ILE A 34 -4.743 -7.999 6.609 1.00 0.00 H new ATOM 0 HG23 ILE A 34 -4.869 -8.780 8.203 1.00 0.00 H new ATOM 0 HD11 ILE A 34 -7.866 -10.389 9.892 1.00 0.00 H new ATOM 0 HD12 ILE A 34 -6.242 -9.696 9.665 1.00 0.00 H new ATOM 0 HD13 ILE A 34 -7.652 -8.623 9.836 1.00 0.00 H new ATOM 527 N GLU A 35 -5.705 -5.118 7.518 1.00 0.00 N ATOM 528 CA GLU A 35 -5.120 -4.016 6.762 1.00 0.00 C ATOM 529 C GLU A 35 -4.949 -4.390 5.292 1.00 0.00 C ATOM 530 O GLU A 35 -5.809 -4.093 4.463 1.00 0.00 O ATOM 531 CB GLU A 35 -3.769 -3.622 7.362 1.00 0.00 C ATOM 532 CG GLU A 35 -3.880 -2.889 8.689 1.00 0.00 C ATOM 533 CD GLU A 35 -4.743 -3.625 9.694 1.00 0.00 C ATOM 534 OE1 GLU A 35 -4.215 -4.518 10.390 1.00 0.00 O ATOM 535 OE2 GLU A 35 -5.949 -3.310 9.786 1.00 0.00 O ATOM 0 H GLU A 35 -5.463 -5.122 8.509 1.00 0.00 H new ATOM 0 HA GLU A 35 -5.800 -3.166 6.822 1.00 0.00 H new ATOM 0 HB2 GLU A 35 -3.168 -4.520 7.502 1.00 0.00 H new ATOM 0 HB3 GLU A 35 -3.236 -2.990 6.651 1.00 0.00 H new ATOM 0 HG2 GLU A 35 -2.883 -2.749 9.106 1.00 0.00 H new ATOM 0 HG3 GLU A 35 -4.296 -1.896 8.517 1.00 0.00 H new ATOM 542 N LYS A 36 -3.839 -5.045 4.980 1.00 0.00 N ATOM 543 CA LYS A 36 -3.556 -5.463 3.610 1.00 0.00 C ATOM 544 C LYS A 36 -4.813 -5.976 2.916 1.00 0.00 C ATOM 545 O LYS A 36 -5.102 -5.600 1.779 1.00 0.00 O ATOM 546 CB LYS A 36 -2.477 -6.549 3.595 1.00 0.00 C ATOM 547 CG LYS A 36 -2.097 -7.058 4.976 1.00 0.00 C ATOM 548 CD LYS A 36 -0.964 -8.070 4.898 1.00 0.00 C ATOM 549 CE LYS A 36 -0.483 -8.478 6.281 1.00 0.00 C ATOM 550 NZ LYS A 36 0.328 -9.726 6.239 1.00 0.00 N ATOM 0 H LYS A 36 -3.119 -5.299 5.656 1.00 0.00 H new ATOM 0 HA LYS A 36 -3.196 -4.590 3.066 1.00 0.00 H new ATOM 0 HB2 LYS A 36 -2.827 -7.387 2.993 1.00 0.00 H new ATOM 0 HB3 LYS A 36 -1.586 -6.156 3.106 1.00 0.00 H new ATOM 0 HG2 LYS A 36 -1.797 -6.220 5.605 1.00 0.00 H new ATOM 0 HG3 LYS A 36 -2.965 -7.516 5.449 1.00 0.00 H new ATOM 0 HD2 LYS A 36 -1.300 -8.953 4.354 1.00 0.00 H new ATOM 0 HD3 LYS A 36 -0.134 -7.645 4.334 1.00 0.00 H new ATOM 0 HE2 LYS A 36 0.112 -7.672 6.711 1.00 0.00 H new ATOM 0 HE3 LYS A 36 -1.342 -8.625 6.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 36 0.637 -9.971 7.201 1.00 0.00 H new ATOM 0 HZ2 LYS A 36 -0.247 -10.501 5.852 1.00 0.00 H new ATOM 0 HZ3 LYS A 36 1.161 -9.578 5.634 1.00 0.00 H new ATOM 564 N ASP A 37 -5.554 -6.842 3.599 1.00 0.00 N ATOM 565 CA ASP A 37 -6.774 -7.409 3.040 1.00 0.00 C ATOM 566 C ASP A 37 -7.734 -6.312 2.588 1.00 0.00 C ATOM 567 O ASP A 37 -8.051 -6.199 1.404 1.00 0.00 O ATOM 568 CB ASP A 37 -7.459 -8.312 4.068 1.00 0.00 C ATOM 569 CG ASP A 37 -8.047 -9.560 3.444 1.00 0.00 C ATOM 570 OD1 ASP A 37 -7.268 -10.406 2.958 1.00 0.00 O ATOM 571 OD2 ASP A 37 -9.290 -9.694 3.440 1.00 0.00 O ATOM 0 H ASP A 37 -5.331 -7.166 4.540 1.00 0.00 H new ATOM 0 HA ASP A 37 -6.499 -8.003 2.169 1.00 0.00 H new ATOM 0 HB2 ASP A 37 -6.738 -8.598 4.833 1.00 0.00 H new ATOM 0 HB3 ASP A 37 -8.250 -7.753 4.568 1.00 0.00 H new ATOM 576 N ILE A 38 -8.195 -5.509 3.539 1.00 0.00 N ATOM 577 CA ILE A 38 -9.123 -4.423 3.244 1.00 0.00 C ATOM 578 C ILE A 38 -8.644 -3.592 2.057 1.00 0.00 C ATOM 579 O ILE A 38 -9.411 -3.309 1.137 1.00 0.00 O ATOM 580 CB ILE A 38 -9.316 -3.503 4.465 1.00 0.00 C ATOM 581 CG1 ILE A 38 -9.876 -4.296 5.646 1.00 0.00 C ATOM 582 CG2 ILE A 38 -10.238 -2.345 4.114 1.00 0.00 C ATOM 583 CD1 ILE A 38 -9.020 -4.212 6.891 1.00 0.00 C ATOM 0 H ILE A 38 -7.941 -5.589 4.524 1.00 0.00 H new ATOM 0 HA ILE A 38 -10.079 -4.883 2.993 1.00 0.00 H new ATOM 0 HB ILE A 38 -8.346 -3.097 4.752 1.00 0.00 H new ATOM 0 HG12 ILE A 38 -10.876 -3.930 5.877 1.00 0.00 H new ATOM 0 HG13 ILE A 38 -9.978 -5.341 5.355 1.00 0.00 H new ATOM 0 HG21 ILE A 38 -10.365 -1.704 4.986 1.00 0.00 H new ATOM 0 HG22 ILE A 38 -9.802 -1.767 3.299 1.00 0.00 H new ATOM 0 HG23 ILE A 38 -11.208 -2.733 3.805 1.00 0.00 H new ATOM 0 HD11 ILE A 38 -9.478 -4.798 7.688 1.00 0.00 H new ATOM 0 HD12 ILE A 38 -8.026 -4.605 6.677 1.00 0.00 H new ATOM 0 HD13 ILE A 38 -8.938 -3.172 7.207 1.00 0.00 H new ATOM 595 N ALA A 39 -7.373 -3.204 2.082 1.00 0.00 N ATOM 596 CA ALA A 39 -6.797 -2.407 1.005 1.00 0.00 C ATOM 597 C ALA A 39 -6.883 -3.143 -0.327 1.00 0.00 C ATOM 598 O ALA A 39 -7.202 -2.549 -1.357 1.00 0.00 O ATOM 599 CB ALA A 39 -5.352 -2.057 1.324 1.00 0.00 C ATOM 0 H ALA A 39 -6.723 -3.428 2.835 1.00 0.00 H new ATOM 0 HA ALA A 39 -7.372 -1.485 0.919 1.00 0.00 H new ATOM 0 HB1 ALA A 39 -4.934 -1.462 0.512 1.00 0.00 H new ATOM 0 HB2 ALA A 39 -5.312 -1.485 2.251 1.00 0.00 H new ATOM 0 HB3 ALA A 39 -4.772 -2.973 1.438 1.00 0.00 H new ATOM 605 N ALA A 40 -6.595 -4.440 -0.299 1.00 0.00 N ATOM 606 CA ALA A 40 -6.640 -5.262 -1.503 1.00 0.00 C ATOM 607 C ALA A 40 -8.003 -5.171 -2.178 1.00 0.00 C ATOM 608 O ALA A 40 -8.120 -4.675 -3.298 1.00 0.00 O ATOM 609 CB ALA A 40 -6.313 -6.710 -1.165 1.00 0.00 C ATOM 0 H ALA A 40 -6.328 -4.945 0.546 1.00 0.00 H new ATOM 0 HA ALA A 40 -5.892 -4.884 -2.200 1.00 0.00 H new ATOM 0 HB1 ALA A 40 -6.350 -7.313 -2.072 1.00 0.00 H new ATOM 0 HB2 ALA A 40 -5.314 -6.766 -0.733 1.00 0.00 H new ATOM 0 HB3 ALA A 40 -7.041 -7.089 -0.447 1.00 0.00 H new ATOM 615 N HIS A 41 -9.030 -5.654 -1.487 1.00 0.00 N ATOM 616 CA HIS A 41 -10.388 -5.627 -2.019 1.00 0.00 C ATOM 617 C HIS A 41 -10.759 -4.220 -2.476 1.00 0.00 C ATOM 618 O HIS A 41 -11.408 -4.043 -3.508 1.00 0.00 O ATOM 619 CB HIS A 41 -11.384 -6.114 -0.964 1.00 0.00 C ATOM 620 CG HIS A 41 -10.742 -6.835 0.183 1.00 0.00 C ATOM 621 ND1 HIS A 41 -11.082 -6.608 1.500 1.00 0.00 N ATOM 622 CD2 HIS A 41 -9.776 -7.783 0.204 1.00 0.00 C ATOM 623 CE1 HIS A 41 -10.352 -7.385 2.281 1.00 0.00 C ATOM 624 NE2 HIS A 41 -9.552 -8.109 1.519 1.00 0.00 N ATOM 0 H HIS A 41 -8.948 -6.068 -0.559 1.00 0.00 H new ATOM 0 HA HIS A 41 -10.430 -6.295 -2.879 1.00 0.00 H new ATOM 0 HB2 HIS A 41 -11.939 -5.259 -0.579 1.00 0.00 H new ATOM 0 HB3 HIS A 41 -12.108 -6.776 -1.439 1.00 0.00 H new ATOM 0 HD1 HIS A 41 -11.787 -5.944 1.821 1.00 0.00 H new ATOM 0 HD2 HIS A 41 -9.274 -8.205 -0.654 1.00 0.00 H new ATOM 0 HE1 HIS A 41 -10.401 -7.422 3.359 1.00 0.00 H new ATOM 633 N ILE A 42 -10.340 -3.222 -1.705 1.00 0.00 N ATOM 634 CA ILE A 42 -10.626 -1.830 -2.033 1.00 0.00 C ATOM 635 C ILE A 42 -10.067 -1.467 -3.403 1.00 0.00 C ATOM 636 O ILE A 42 -10.802 -1.032 -4.289 1.00 0.00 O ATOM 637 CB ILE A 42 -10.038 -0.874 -0.976 1.00 0.00 C ATOM 638 CG1 ILE A 42 -10.750 -1.063 0.364 1.00 0.00 C ATOM 639 CG2 ILE A 42 -10.150 0.572 -1.441 1.00 0.00 C ATOM 640 CD1 ILE A 42 -10.017 -0.443 1.533 1.00 0.00 C ATOM 0 H ILE A 42 -9.801 -3.351 -0.849 1.00 0.00 H new ATOM 0 HA ILE A 42 -11.710 -1.720 -2.046 1.00 0.00 H new ATOM 0 HB ILE A 42 -8.982 -1.110 -0.845 1.00 0.00 H new ATOM 0 HG12 ILE A 42 -11.748 -0.629 0.300 1.00 0.00 H new ATOM 0 HG13 ILE A 42 -10.878 -2.129 0.551 1.00 0.00 H new ATOM 0 HG21 ILE A 42 -9.730 1.232 -0.682 1.00 0.00 H new ATOM 0 HG22 ILE A 42 -9.602 0.697 -2.375 1.00 0.00 H new ATOM 0 HG23 ILE A 42 -11.199 0.823 -1.600 1.00 0.00 H new ATOM 0 HD11 ILE A 42 -10.581 -0.617 2.450 1.00 0.00 H new ATOM 0 HD12 ILE A 42 -9.029 -0.894 1.624 1.00 0.00 H new ATOM 0 HD13 ILE A 42 -9.912 0.630 1.369 1.00 0.00 H new ATOM 652 N LYS A 43 -8.762 -1.650 -3.572 1.00 0.00 N ATOM 653 CA LYS A 43 -8.107 -1.342 -4.837 1.00 0.00 C ATOM 654 C LYS A 43 -8.833 -2.012 -5.998 1.00 0.00 C ATOM 655 O LYS A 43 -9.327 -1.342 -6.905 1.00 0.00 O ATOM 656 CB LYS A 43 -6.646 -1.796 -4.802 1.00 0.00 C ATOM 657 CG LYS A 43 -5.755 -1.053 -5.782 1.00 0.00 C ATOM 658 CD LYS A 43 -4.749 -1.986 -6.437 1.00 0.00 C ATOM 659 CE LYS A 43 -5.410 -2.875 -7.479 1.00 0.00 C ATOM 660 NZ LYS A 43 -5.103 -4.315 -7.255 1.00 0.00 N ATOM 0 H LYS A 43 -8.138 -2.010 -2.850 1.00 0.00 H new ATOM 0 HA LYS A 43 -8.140 -0.262 -4.984 1.00 0.00 H new ATOM 0 HB2 LYS A 43 -6.256 -1.659 -3.793 1.00 0.00 H new ATOM 0 HB3 LYS A 43 -6.600 -2.863 -5.019 1.00 0.00 H new ATOM 0 HG2 LYS A 43 -6.369 -0.582 -6.549 1.00 0.00 H new ATOM 0 HG3 LYS A 43 -5.227 -0.254 -5.262 1.00 0.00 H new ATOM 0 HD2 LYS A 43 -3.959 -1.400 -6.906 1.00 0.00 H new ATOM 0 HD3 LYS A 43 -4.276 -2.606 -5.675 1.00 0.00 H new ATOM 0 HE2 LYS A 43 -6.489 -2.725 -7.452 1.00 0.00 H new ATOM 0 HE3 LYS A 43 -5.072 -2.582 -8.473 1.00 0.00 H new ATOM 0 HZ1 LYS A 43 -4.471 -4.656 -8.007 1.00 0.00 H new ATOM 0 HZ2 LYS A 43 -4.637 -4.431 -6.332 1.00 0.00 H new ATOM 0 HZ3 LYS A 43 -5.986 -4.864 -7.269 1.00 0.00 H new ATOM 674 N LYS A 44 -8.898 -3.339 -5.961 1.00 0.00 N ATOM 675 CA LYS A 44 -9.569 -4.099 -7.008 1.00 0.00 C ATOM 676 C LYS A 44 -10.881 -3.435 -7.403 1.00 0.00 C ATOM 677 O LYS A 44 -11.059 -3.016 -8.546 1.00 0.00 O ATOM 678 CB LYS A 44 -9.829 -5.532 -6.539 1.00 0.00 C ATOM 679 CG LYS A 44 -9.359 -6.591 -7.524 1.00 0.00 C ATOM 680 CD LYS A 44 -9.198 -7.944 -6.852 1.00 0.00 C ATOM 681 CE LYS A 44 -7.796 -8.500 -7.045 1.00 0.00 C ATOM 682 NZ LYS A 44 -7.322 -8.341 -8.446 1.00 0.00 N ATOM 0 H LYS A 44 -8.494 -3.909 -5.218 1.00 0.00 H new ATOM 0 HA LYS A 44 -8.917 -4.123 -7.881 1.00 0.00 H new ATOM 0 HB2 LYS A 44 -9.328 -5.689 -5.584 1.00 0.00 H new ATOM 0 HB3 LYS A 44 -10.897 -5.660 -6.364 1.00 0.00 H new ATOM 0 HG2 LYS A 44 -10.075 -6.673 -8.341 1.00 0.00 H new ATOM 0 HG3 LYS A 44 -8.409 -6.286 -7.962 1.00 0.00 H new ATOM 0 HD2 LYS A 44 -9.409 -7.850 -5.787 1.00 0.00 H new ATOM 0 HD3 LYS A 44 -9.927 -8.643 -7.261 1.00 0.00 H new ATOM 0 HE2 LYS A 44 -7.108 -7.991 -6.370 1.00 0.00 H new ATOM 0 HE3 LYS A 44 -7.785 -9.556 -6.776 1.00 0.00 H new ATOM 0 HZ1 LYS A 44 -6.692 -9.131 -8.691 1.00 0.00 H new ATOM 0 HZ2 LYS A 44 -8.138 -8.336 -9.090 1.00 0.00 H new ATOM 0 HZ3 LYS A 44 -6.803 -7.444 -8.537 1.00 0.00 H new ATOM 696 N GLU A 45 -11.794 -3.345 -6.446 1.00 0.00 N ATOM 697 CA GLU A 45 -13.096 -2.731 -6.684 1.00 0.00 C ATOM 698 C GLU A 45 -12.954 -1.451 -7.500 1.00 0.00 C ATOM 699 O GLU A 45 -13.390 -1.386 -8.647 1.00 0.00 O ATOM 700 CB GLU A 45 -13.791 -2.427 -5.357 1.00 0.00 C ATOM 701 CG GLU A 45 -14.507 -3.625 -4.755 1.00 0.00 C ATOM 702 CD GLU A 45 -14.026 -3.948 -3.355 1.00 0.00 C ATOM 703 OE1 GLU A 45 -14.005 -3.029 -2.508 1.00 0.00 O ATOM 704 OE2 GLU A 45 -13.672 -5.119 -3.103 1.00 0.00 O ATOM 0 H GLU A 45 -11.658 -3.689 -5.496 1.00 0.00 H new ATOM 0 HA GLU A 45 -13.703 -3.437 -7.251 1.00 0.00 H new ATOM 0 HB2 GLU A 45 -13.051 -2.061 -4.645 1.00 0.00 H new ATOM 0 HB3 GLU A 45 -14.511 -1.623 -5.510 1.00 0.00 H new ATOM 0 HG2 GLU A 45 -15.579 -3.428 -4.731 1.00 0.00 H new ATOM 0 HG3 GLU A 45 -14.357 -4.493 -5.396 1.00 0.00 H new ATOM 711 N PHE A 46 -12.343 -0.435 -6.900 1.00 0.00 N ATOM 712 CA PHE A 46 -12.146 0.845 -7.572 1.00 0.00 C ATOM 713 C PHE A 46 -11.657 0.644 -9.003 1.00 0.00 C ATOM 714 O PHE A 46 -12.221 1.200 -9.945 1.00 0.00 O ATOM 715 CB PHE A 46 -11.147 1.705 -6.795 1.00 0.00 C ATOM 716 CG PHE A 46 -11.791 2.812 -6.011 1.00 0.00 C ATOM 717 CD1 PHE A 46 -12.321 2.572 -4.753 1.00 0.00 C ATOM 718 CD2 PHE A 46 -11.867 4.096 -6.530 1.00 0.00 C ATOM 719 CE1 PHE A 46 -12.915 3.589 -4.030 1.00 0.00 C ATOM 720 CE2 PHE A 46 -12.459 5.116 -5.811 1.00 0.00 C ATOM 721 CZ PHE A 46 -12.983 4.863 -4.559 1.00 0.00 C ATOM 0 H PHE A 46 -11.975 -0.473 -5.949 1.00 0.00 H new ATOM 0 HA PHE A 46 -13.107 1.358 -7.607 1.00 0.00 H new ATOM 0 HB2 PHE A 46 -10.584 1.067 -6.113 1.00 0.00 H new ATOM 0 HB3 PHE A 46 -10.430 2.135 -7.494 1.00 0.00 H new ATOM 0 HD1 PHE A 46 -12.269 1.578 -4.333 1.00 0.00 H new ATOM 0 HD2 PHE A 46 -11.458 4.301 -7.508 1.00 0.00 H new ATOM 0 HE1 PHE A 46 -13.326 3.388 -3.052 1.00 0.00 H new ATOM 0 HE2 PHE A 46 -12.512 6.111 -6.228 1.00 0.00 H new ATOM 0 HZ PHE A 46 -13.445 5.659 -3.995 1.00 0.00 H new ATOM 731 N ASP A 47 -10.603 -0.151 -9.158 1.00 0.00 N ATOM 732 CA ASP A 47 -10.037 -0.423 -10.476 1.00 0.00 C ATOM 733 C ASP A 47 -11.084 -1.022 -11.410 1.00 0.00 C ATOM 734 O ASP A 47 -10.978 -0.911 -12.631 1.00 0.00 O ATOM 735 CB ASP A 47 -8.845 -1.373 -10.354 1.00 0.00 C ATOM 736 CG ASP A 47 -7.528 -0.636 -10.207 1.00 0.00 C ATOM 737 OD1 ASP A 47 -7.231 -0.169 -9.087 1.00 0.00 O ATOM 738 OD2 ASP A 47 -6.794 -0.526 -11.211 1.00 0.00 O ATOM 0 H ASP A 47 -10.123 -0.618 -8.388 1.00 0.00 H new ATOM 0 HA ASP A 47 -9.700 0.523 -10.899 1.00 0.00 H new ATOM 0 HB2 ASP A 47 -8.991 -2.025 -9.493 1.00 0.00 H new ATOM 0 HB3 ASP A 47 -8.803 -2.013 -11.235 1.00 0.00 H new ATOM 743 N LYS A 48 -12.091 -1.663 -10.826 1.00 0.00 N ATOM 744 CA LYS A 48 -13.155 -2.286 -11.603 1.00 0.00 C ATOM 745 C LYS A 48 -14.516 -1.705 -11.238 1.00 0.00 C ATOM 746 O LYS A 48 -15.555 -2.272 -11.574 1.00 0.00 O ATOM 747 CB LYS A 48 -13.163 -3.795 -11.367 1.00 0.00 C ATOM 748 CG LYS A 48 -12.328 -4.576 -12.369 1.00 0.00 C ATOM 749 CD LYS A 48 -12.969 -4.580 -13.747 1.00 0.00 C ATOM 750 CE LYS A 48 -14.234 -5.422 -13.772 1.00 0.00 C ATOM 751 NZ LYS A 48 -14.347 -6.219 -15.024 1.00 0.00 N ATOM 0 H LYS A 48 -12.192 -1.764 -9.816 1.00 0.00 H new ATOM 0 HA LYS A 48 -12.964 -2.082 -12.657 1.00 0.00 H new ATOM 0 HB2 LYS A 48 -12.793 -3.998 -10.362 1.00 0.00 H new ATOM 0 HB3 LYS A 48 -14.191 -4.154 -11.406 1.00 0.00 H new ATOM 0 HG2 LYS A 48 -11.331 -4.139 -12.432 1.00 0.00 H new ATOM 0 HG3 LYS A 48 -12.206 -5.602 -12.021 1.00 0.00 H new ATOM 0 HD2 LYS A 48 -13.206 -3.558 -14.042 1.00 0.00 H new ATOM 0 HD3 LYS A 48 -12.259 -4.967 -14.478 1.00 0.00 H new ATOM 0 HE2 LYS A 48 -14.240 -6.093 -12.913 1.00 0.00 H new ATOM 0 HE3 LYS A 48 -15.104 -4.773 -13.676 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 -15.223 -6.779 -15.001 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 -14.367 -5.578 -15.843 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 -13.530 -6.858 -15.104 1.00 0.00 H new ATOM 765 N LYS A 49 -14.504 -0.578 -10.539 1.00 0.00 N ATOM 766 CA LYS A 49 -15.739 0.072 -10.120 1.00 0.00 C ATOM 767 C LYS A 49 -15.754 1.545 -10.515 1.00 0.00 C ATOM 768 O LYS A 49 -16.705 2.267 -10.213 1.00 0.00 O ATOM 769 CB LYS A 49 -15.918 -0.063 -8.607 1.00 0.00 C ATOM 770 CG LYS A 49 -17.364 0.048 -8.155 1.00 0.00 C ATOM 771 CD LYS A 49 -17.461 0.477 -6.700 1.00 0.00 C ATOM 772 CE LYS A 49 -18.556 1.511 -6.498 1.00 0.00 C ATOM 773 NZ LYS A 49 -19.880 0.879 -6.245 1.00 0.00 N ATOM 0 H LYS A 49 -13.653 -0.095 -10.250 1.00 0.00 H new ATOM 0 HA LYS A 49 -16.566 -0.423 -10.628 1.00 0.00 H new ATOM 0 HB2 LYS A 49 -15.518 -1.025 -8.286 1.00 0.00 H new ATOM 0 HB3 LYS A 49 -15.330 0.708 -8.109 1.00 0.00 H new ATOM 0 HG2 LYS A 49 -17.889 0.768 -8.783 1.00 0.00 H new ATOM 0 HG3 LYS A 49 -17.862 -0.913 -8.286 1.00 0.00 H new ATOM 0 HD2 LYS A 49 -17.661 -0.393 -6.075 1.00 0.00 H new ATOM 0 HD3 LYS A 49 -16.505 0.889 -6.376 1.00 0.00 H new ATOM 0 HE2 LYS A 49 -18.296 2.156 -5.658 1.00 0.00 H new ATOM 0 HE3 LYS A 49 -18.621 2.148 -7.380 1.00 0.00 H new ATOM 0 HZ1 LYS A 49 -20.598 1.619 -6.113 1.00 0.00 H new ATOM 0 HZ2 LYS A 49 -20.141 0.284 -7.057 1.00 0.00 H new ATOM 0 HZ3 LYS A 49 -19.826 0.292 -5.388 1.00 0.00 H new ATOM 787 N TYR A 50 -14.699 1.987 -11.190 1.00 0.00 N ATOM 788 CA TYR A 50 -14.603 3.377 -11.622 1.00 0.00 C ATOM 789 C TYR A 50 -13.734 3.508 -12.868 1.00 0.00 C ATOM 790 O TYR A 50 -14.207 3.937 -13.920 1.00 0.00 O ATOM 791 CB TYR A 50 -14.036 4.247 -10.499 1.00 0.00 C ATOM 792 CG TYR A 50 -14.804 4.144 -9.200 1.00 0.00 C ATOM 793 CD1 TYR A 50 -16.000 4.828 -9.020 1.00 0.00 C ATOM 794 CD2 TYR A 50 -14.330 3.366 -8.151 1.00 0.00 C ATOM 795 CE1 TYR A 50 -16.702 4.738 -7.833 1.00 0.00 C ATOM 796 CE2 TYR A 50 -15.026 3.271 -6.962 1.00 0.00 C ATOM 797 CZ TYR A 50 -16.212 3.958 -6.807 1.00 0.00 C ATOM 798 OH TYR A 50 -16.907 3.868 -5.623 1.00 0.00 O ATOM 0 H TYR A 50 -13.901 1.406 -11.449 1.00 0.00 H new ATOM 0 HA TYR A 50 -15.608 3.720 -11.867 1.00 0.00 H new ATOM 0 HB2 TYR A 50 -12.999 3.963 -10.321 1.00 0.00 H new ATOM 0 HB3 TYR A 50 -14.030 5.287 -10.825 1.00 0.00 H new ATOM 0 HD1 TYR A 50 -16.387 5.440 -9.821 1.00 0.00 H new ATOM 0 HD2 TYR A 50 -13.402 2.826 -8.267 1.00 0.00 H new ATOM 0 HE1 TYR A 50 -17.630 5.276 -7.710 1.00 0.00 H new ATOM 0 HE2 TYR A 50 -14.643 2.661 -6.157 1.00 0.00 H new ATOM 0 HH TYR A 50 -16.299 4.037 -4.873 1.00 0.00 H new ATOM 808 N ASN A 51 -12.461 3.137 -12.741 1.00 0.00 N ATOM 809 CA ASN A 51 -11.523 3.214 -13.853 1.00 0.00 C ATOM 810 C ASN A 51 -10.084 3.182 -13.344 1.00 0.00 C ATOM 811 O ASN A 51 -9.658 4.073 -12.609 1.00 0.00 O ATOM 812 CB ASN A 51 -11.760 4.486 -14.669 1.00 0.00 C ATOM 813 CG ASN A 51 -12.447 4.202 -15.989 1.00 0.00 C ATOM 814 OD1 ASN A 51 -12.389 3.086 -16.506 1.00 0.00 O ATOM 815 ND2 ASN A 51 -13.106 5.213 -16.544 1.00 0.00 N ATOM 0 H ASN A 51 -12.057 2.779 -11.875 1.00 0.00 H new ATOM 0 HA ASN A 51 -11.687 2.349 -14.496 1.00 0.00 H new ATOM 0 HB2 ASN A 51 -12.367 5.180 -14.088 1.00 0.00 H new ATOM 0 HB3 ASN A 51 -10.806 4.978 -14.857 1.00 0.00 H new ATOM 0 HD21 ASN A 51 -13.589 5.080 -17.432 1.00 0.00 H new ATOM 0 HD22 ASN A 51 -13.129 6.122 -16.082 1.00 0.00 H new ATOM 822 N PRO A 52 -9.312 2.151 -13.729 1.00 0.00 N ATOM 823 CA PRO A 52 -7.915 2.010 -13.304 1.00 0.00 C ATOM 824 C PRO A 52 -7.049 3.194 -13.748 1.00 0.00 C ATOM 825 O PRO A 52 -7.493 4.017 -14.549 1.00 0.00 O ATOM 826 CB PRO A 52 -7.453 0.718 -13.988 1.00 0.00 C ATOM 827 CG PRO A 52 -8.431 0.486 -15.090 1.00 0.00 C ATOM 828 CD PRO A 52 -9.736 1.043 -14.603 1.00 0.00 C ATOM 0 HA PRO A 52 -7.824 1.983 -12.218 1.00 0.00 H new ATOM 0 HB2 PRO A 52 -6.439 0.819 -14.376 1.00 0.00 H new ATOM 0 HB3 PRO A 52 -7.444 -0.117 -13.287 1.00 0.00 H new ATOM 0 HG2 PRO A 52 -8.112 0.982 -16.007 1.00 0.00 H new ATOM 0 HG3 PRO A 52 -8.520 -0.576 -15.317 1.00 0.00 H new ATOM 0 HD2 PRO A 52 -10.359 1.393 -15.426 1.00 0.00 H new ATOM 0 HD3 PRO A 52 -10.316 0.298 -14.059 1.00 0.00 H new ATOM 836 N THR A 53 -5.811 3.289 -13.232 1.00 0.00 N ATOM 837 CA THR A 53 -5.269 2.322 -12.279 1.00 0.00 C ATOM 838 C THR A 53 -5.252 2.915 -10.880 1.00 0.00 C ATOM 839 O THR A 53 -4.790 4.037 -10.680 1.00 0.00 O ATOM 840 CB THR A 53 -3.857 1.899 -12.688 1.00 0.00 C ATOM 841 OG1 THR A 53 -3.871 1.254 -13.949 1.00 0.00 O ATOM 842 CG2 THR A 53 -3.206 0.958 -11.697 1.00 0.00 C ATOM 0 H THR A 53 -5.163 4.041 -13.468 1.00 0.00 H new ATOM 0 HA THR A 53 -5.910 1.440 -12.281 1.00 0.00 H new ATOM 0 HB THR A 53 -3.277 2.821 -12.725 1.00 0.00 H new ATOM 0 HG1 THR A 53 -2.958 0.993 -14.193 1.00 0.00 H new ATOM 0 HG21 THR A 53 -2.207 0.696 -12.046 1.00 0.00 H new ATOM 0 HG22 THR A 53 -3.135 1.446 -10.725 1.00 0.00 H new ATOM 0 HG23 THR A 53 -3.807 0.053 -11.606 1.00 0.00 H new ATOM 850 N TRP A 54 -5.773 2.168 -9.918 1.00 0.00 N ATOM 851 CA TRP A 54 -5.834 2.644 -8.545 1.00 0.00 C ATOM 852 C TRP A 54 -4.739 2.044 -7.673 1.00 0.00 C ATOM 853 O TRP A 54 -4.030 1.119 -8.071 1.00 0.00 O ATOM 854 CB TRP A 54 -7.203 2.328 -7.942 1.00 0.00 C ATOM 855 CG TRP A 54 -8.338 2.938 -8.704 1.00 0.00 C ATOM 856 CD1 TRP A 54 -8.916 2.452 -9.842 1.00 0.00 C ATOM 857 CD2 TRP A 54 -9.029 4.150 -8.386 1.00 0.00 C ATOM 858 NE1 TRP A 54 -9.926 3.287 -10.249 1.00 0.00 N ATOM 859 CE2 TRP A 54 -10.016 4.337 -9.373 1.00 0.00 C ATOM 860 CE3 TRP A 54 -8.911 5.094 -7.363 1.00 0.00 C ATOM 861 CZ2 TRP A 54 -10.879 5.430 -9.364 1.00 0.00 C ATOM 862 CZ3 TRP A 54 -9.767 6.178 -7.356 1.00 0.00 C ATOM 863 CH2 TRP A 54 -10.740 6.338 -8.350 1.00 0.00 C ATOM 0 H TRP A 54 -6.158 1.234 -10.062 1.00 0.00 H new ATOM 0 HA TRP A 54 -5.678 3.722 -8.572 1.00 0.00 H new ATOM 0 HB2 TRP A 54 -7.337 1.247 -7.907 1.00 0.00 H new ATOM 0 HB3 TRP A 54 -7.231 2.686 -6.913 1.00 0.00 H new ATOM 0 HD1 TRP A 54 -8.621 1.544 -10.347 1.00 0.00 H new ATOM 0 HE1 TRP A 54 -10.514 3.149 -11.071 1.00 0.00 H new ATOM 0 HE3 TRP A 54 -8.164 4.978 -6.592 1.00 0.00 H new ATOM 0 HZ2 TRP A 54 -11.630 5.556 -10.129 1.00 0.00 H new ATOM 0 HZ3 TRP A 54 -9.684 6.915 -6.571 1.00 0.00 H new ATOM 0 HH2 TRP A 54 -11.395 7.196 -8.316 1.00 0.00 H new ATOM 874 N HIS A 55 -4.631 2.592 -6.472 1.00 0.00 N ATOM 875 CA HIS A 55 -3.657 2.160 -5.480 1.00 0.00 C ATOM 876 C HIS A 55 -4.087 2.690 -4.121 1.00 0.00 C ATOM 877 O HIS A 55 -3.958 3.883 -3.843 1.00 0.00 O ATOM 878 CB HIS A 55 -2.259 2.674 -5.832 1.00 0.00 C ATOM 879 CG HIS A 55 -2.123 3.122 -7.254 1.00 0.00 C ATOM 880 ND1 HIS A 55 -1.710 2.287 -8.270 1.00 0.00 N ATOM 881 CD2 HIS A 55 -2.348 4.328 -7.828 1.00 0.00 C ATOM 882 CE1 HIS A 55 -1.686 2.959 -9.407 1.00 0.00 C ATOM 883 NE2 HIS A 55 -2.069 4.199 -9.167 1.00 0.00 N ATOM 0 H HIS A 55 -5.224 3.359 -6.155 1.00 0.00 H new ATOM 0 HA HIS A 55 -3.614 1.071 -5.460 1.00 0.00 H new ATOM 0 HB2 HIS A 55 -2.011 3.506 -5.173 1.00 0.00 H new ATOM 0 HB3 HIS A 55 -1.532 1.885 -5.638 1.00 0.00 H new ATOM 0 HD1 HIS A 55 -1.462 1.304 -8.161 1.00 0.00 H new ATOM 0 HD2 HIS A 55 -2.684 5.224 -7.327 1.00 0.00 H new ATOM 0 HE1 HIS A 55 -1.401 2.561 -10.370 1.00 0.00 H new ATOM 892 N CYS A 56 -4.642 1.817 -3.291 1.00 0.00 N ATOM 893 CA CYS A 56 -5.132 2.238 -1.988 1.00 0.00 C ATOM 894 C CYS A 56 -4.408 1.555 -0.837 1.00 0.00 C ATOM 895 O CYS A 56 -3.857 0.463 -0.980 1.00 0.00 O ATOM 896 CB CYS A 56 -6.632 1.966 -1.886 1.00 0.00 C ATOM 897 SG CYS A 56 -7.438 1.683 -3.480 1.00 0.00 S ATOM 0 H CYS A 56 -4.763 0.825 -3.494 1.00 0.00 H new ATOM 0 HA CYS A 56 -4.935 3.307 -1.903 1.00 0.00 H new ATOM 0 HB2 CYS A 56 -6.790 1.095 -1.251 1.00 0.00 H new ATOM 0 HB3 CYS A 56 -7.112 2.812 -1.393 1.00 0.00 H new ATOM 0 HG CYS A 56 -7.098 2.623 -4.311 1.00 0.00 H new ATOM 903 N ILE A 57 -4.438 2.220 0.311 1.00 0.00 N ATOM 904 CA ILE A 57 -3.814 1.714 1.526 1.00 0.00 C ATOM 905 C ILE A 57 -4.819 1.717 2.673 1.00 0.00 C ATOM 906 O ILE A 57 -5.801 2.459 2.641 1.00 0.00 O ATOM 907 CB ILE A 57 -2.594 2.565 1.930 1.00 0.00 C ATOM 908 CG1 ILE A 57 -1.684 2.796 0.724 1.00 0.00 C ATOM 909 CG2 ILE A 57 -1.827 1.896 3.061 1.00 0.00 C ATOM 910 CD1 ILE A 57 -1.160 1.517 0.111 1.00 0.00 C ATOM 0 H ILE A 57 -4.895 3.125 0.426 1.00 0.00 H new ATOM 0 HA ILE A 57 -3.480 0.697 1.323 1.00 0.00 H new ATOM 0 HB ILE A 57 -2.949 3.533 2.284 1.00 0.00 H new ATOM 0 HG12 ILE A 57 -2.233 3.355 -0.034 1.00 0.00 H new ATOM 0 HG13 ILE A 57 -0.841 3.416 1.028 1.00 0.00 H new ATOM 0 HG21 ILE A 57 -0.969 2.511 3.333 1.00 0.00 H new ATOM 0 HG22 ILE A 57 -2.480 1.782 3.926 1.00 0.00 H new ATOM 0 HG23 ILE A 57 -1.481 0.915 2.736 1.00 0.00 H new ATOM 0 HD11 ILE A 57 -0.522 1.756 -0.740 1.00 0.00 H new ATOM 0 HD12 ILE A 57 -0.583 0.967 0.854 1.00 0.00 H new ATOM 0 HD13 ILE A 57 -1.997 0.905 -0.224 1.00 0.00 H new ATOM 922 N VAL A 58 -4.575 0.892 3.682 1.00 0.00 N ATOM 923 CA VAL A 58 -5.472 0.819 4.828 1.00 0.00 C ATOM 924 C VAL A 58 -4.728 0.387 6.086 1.00 0.00 C ATOM 925 O VAL A 58 -4.272 -0.752 6.191 1.00 0.00 O ATOM 926 CB VAL A 58 -6.642 -0.147 4.568 1.00 0.00 C ATOM 927 CG1 VAL A 58 -6.125 -1.504 4.126 1.00 0.00 C ATOM 928 CG2 VAL A 58 -7.517 -0.275 5.805 1.00 0.00 C ATOM 0 H VAL A 58 -3.770 0.268 3.731 1.00 0.00 H new ATOM 0 HA VAL A 58 -5.872 1.821 4.979 1.00 0.00 H new ATOM 0 HB VAL A 58 -7.253 0.261 3.763 1.00 0.00 H new ATOM 0 HG11 VAL A 58 -6.966 -2.173 3.947 1.00 0.00 H new ATOM 0 HG12 VAL A 58 -5.548 -1.392 3.208 1.00 0.00 H new ATOM 0 HG13 VAL A 58 -5.488 -1.922 4.906 1.00 0.00 H new ATOM 0 HG21 VAL A 58 -8.338 -0.962 5.600 1.00 0.00 H new ATOM 0 HG22 VAL A 58 -6.922 -0.658 6.634 1.00 0.00 H new ATOM 0 HG23 VAL A 58 -7.920 0.703 6.069 1.00 0.00 H new ATOM 938 N GLY A 59 -4.612 1.308 7.036 1.00 0.00 N ATOM 939 CA GLY A 59 -3.923 1.012 8.278 1.00 0.00 C ATOM 940 C GLY A 59 -4.464 1.821 9.438 1.00 0.00 C ATOM 941 O GLY A 59 -5.611 2.261 9.412 1.00 0.00 O ATOM 0 H GLY A 59 -4.983 2.256 6.968 1.00 0.00 H new ATOM 0 HA2 GLY A 59 -4.020 -0.050 8.501 1.00 0.00 H new ATOM 0 HA3 GLY A 59 -2.859 1.217 8.159 1.00 0.00 H new ATOM 945 N ARG A 60 -3.642 2.016 10.463 1.00 0.00 N ATOM 946 CA ARG A 60 -4.056 2.773 11.631 1.00 0.00 C ATOM 947 C ARG A 60 -2.855 3.202 12.467 1.00 0.00 C ATOM 948 O ARG A 60 -2.931 3.261 13.695 1.00 0.00 O ATOM 949 CB ARG A 60 -5.006 1.934 12.475 1.00 0.00 C ATOM 950 CG ARG A 60 -4.517 0.516 12.717 1.00 0.00 C ATOM 951 CD ARG A 60 -5.456 -0.248 13.635 1.00 0.00 C ATOM 952 NE ARG A 60 -4.755 -0.817 14.781 1.00 0.00 N ATOM 953 CZ ARG A 60 -4.166 -0.083 15.719 1.00 0.00 C ATOM 954 NH1 ARG A 60 -4.203 1.240 15.647 1.00 0.00 N ATOM 955 NH2 ARG A 60 -3.545 -0.671 16.731 1.00 0.00 N ATOM 0 H ARG A 60 -2.687 1.660 10.506 1.00 0.00 H new ATOM 0 HA ARG A 60 -4.567 3.674 11.291 1.00 0.00 H new ATOM 0 HB2 ARG A 60 -5.155 2.426 13.436 1.00 0.00 H new ATOM 0 HB3 ARG A 60 -5.978 1.895 11.982 1.00 0.00 H new ATOM 0 HG2 ARG A 60 -4.431 -0.008 11.765 1.00 0.00 H new ATOM 0 HG3 ARG A 60 -3.520 0.544 13.156 1.00 0.00 H new ATOM 0 HD2 ARG A 60 -6.243 0.420 13.986 1.00 0.00 H new ATOM 0 HD3 ARG A 60 -5.942 -1.046 13.074 1.00 0.00 H new ATOM 0 HE ARG A 60 -4.715 -1.833 14.867 1.00 0.00 H new ATOM 0 HH11 ARG A 60 -4.684 1.695 14.871 1.00 0.00 H new ATOM 0 HH12 ARG A 60 -3.751 1.803 16.367 1.00 0.00 H new ATOM 0 HH21 ARG A 60 -3.518 -1.689 16.791 1.00 0.00 H new ATOM 0 HH22 ARG A 60 -3.093 -0.106 17.450 1.00 0.00 H new ATOM 969 N ASN A 61 -1.749 3.502 11.798 1.00 0.00 N ATOM 970 CA ASN A 61 -0.534 3.928 12.484 1.00 0.00 C ATOM 971 C ASN A 61 0.639 3.996 11.515 1.00 0.00 C ATOM 972 O ASN A 61 1.795 3.857 11.913 1.00 0.00 O ATOM 973 CB ASN A 61 -0.208 2.974 13.634 1.00 0.00 C ATOM 974 CG ASN A 61 0.129 3.705 14.919 1.00 0.00 C ATOM 975 OD1 ASN A 61 0.537 4.962 14.797 1.00 0.00 O flip ATOM 976 ND2 ASN A 61 0.024 3.145 16.011 1.00 0.00 N flip ATOM 0 H ASN A 61 -1.667 3.459 10.782 1.00 0.00 H new ATOM 0 HA ASN A 61 -0.706 4.925 12.890 1.00 0.00 H new ATOM 0 HB2 ASN A 61 -1.059 2.315 13.807 1.00 0.00 H new ATOM 0 HB3 ASN A 61 0.632 2.341 13.349 1.00 0.00 H new ATOM 0 HD21 ASN A 61 -0.294 2.177 16.059 1.00 0.00 H new ATOM 0 HD22 ASN A 61 0.255 3.649 16.867 1.00 0.00 H new ATOM 983 N PHE A 62 0.332 4.211 10.243 1.00 0.00 N ATOM 984 CA PHE A 62 1.360 4.299 9.215 1.00 0.00 C ATOM 985 C PHE A 62 1.468 5.721 8.678 1.00 0.00 C ATOM 986 O PHE A 62 0.741 6.616 9.108 1.00 0.00 O ATOM 987 CB PHE A 62 1.052 3.330 8.073 1.00 0.00 C ATOM 988 CG PHE A 62 -0.035 3.816 7.160 1.00 0.00 C ATOM 989 CD1 PHE A 62 -1.361 3.521 7.424 1.00 0.00 C ATOM 990 CD2 PHE A 62 0.271 4.568 6.038 1.00 0.00 C ATOM 991 CE1 PHE A 62 -2.365 3.969 6.586 1.00 0.00 C ATOM 992 CE2 PHE A 62 -0.728 5.019 5.197 1.00 0.00 C ATOM 993 CZ PHE A 62 -2.048 4.719 5.471 1.00 0.00 C ATOM 0 H PHE A 62 -0.621 4.328 9.898 1.00 0.00 H new ATOM 0 HA PHE A 62 2.315 4.026 9.664 1.00 0.00 H new ATOM 0 HB2 PHE A 62 1.959 3.165 7.491 1.00 0.00 H new ATOM 0 HB3 PHE A 62 0.762 2.366 8.492 1.00 0.00 H new ATOM 0 HD1 PHE A 62 -1.614 2.934 8.295 1.00 0.00 H new ATOM 0 HD2 PHE A 62 1.302 4.804 5.818 1.00 0.00 H new ATOM 0 HE1 PHE A 62 -3.396 3.733 6.803 1.00 0.00 H new ATOM 0 HE2 PHE A 62 -0.477 5.606 4.326 1.00 0.00 H new ATOM 0 HZ PHE A 62 -2.830 5.070 4.815 1.00 0.00 H new ATOM 1003 N GLY A 63 2.378 5.922 7.732 1.00 0.00 N ATOM 1004 CA GLY A 63 2.566 7.239 7.149 1.00 0.00 C ATOM 1005 C GLY A 63 2.689 7.188 5.641 1.00 0.00 C ATOM 1006 O GLY A 63 3.769 6.938 5.108 1.00 0.00 O ATOM 0 H GLY A 63 2.990 5.197 7.358 1.00 0.00 H new ATOM 0 HA2 GLY A 63 1.726 7.878 7.421 1.00 0.00 H new ATOM 0 HA3 GLY A 63 3.462 7.695 7.569 1.00 0.00 H new ATOM 1010 N SER A 64 1.578 7.421 4.952 1.00 0.00 N ATOM 1011 CA SER A 64 1.566 7.392 3.496 1.00 0.00 C ATOM 1012 C SER A 64 2.059 8.708 2.906 1.00 0.00 C ATOM 1013 O SER A 64 1.594 9.785 3.279 1.00 0.00 O ATOM 1014 CB SER A 64 0.160 7.086 2.978 1.00 0.00 C ATOM 1015 OG SER A 64 -0.821 7.803 3.707 1.00 0.00 O ATOM 0 H SER A 64 0.676 7.632 5.378 1.00 0.00 H new ATOM 0 HA SER A 64 2.246 6.601 3.179 1.00 0.00 H new ATOM 0 HB2 SER A 64 0.094 7.346 1.921 1.00 0.00 H new ATOM 0 HB3 SER A 64 -0.035 6.016 3.056 1.00 0.00 H new ATOM 0 HG SER A 64 -1.560 7.203 3.938 1.00 0.00 H new ATOM 1021 N TYR A 65 3.002 8.606 1.975 1.00 0.00 N ATOM 1022 CA TYR A 65 3.565 9.776 1.312 1.00 0.00 C ATOM 1023 C TYR A 65 3.852 9.462 -0.150 1.00 0.00 C ATOM 1024 O TYR A 65 4.974 9.100 -0.511 1.00 0.00 O ATOM 1025 CB TYR A 65 4.847 10.225 2.018 1.00 0.00 C ATOM 1026 CG TYR A 65 5.476 11.458 1.408 1.00 0.00 C ATOM 1027 CD1 TYR A 65 5.115 12.730 1.835 1.00 0.00 C ATOM 1028 CD2 TYR A 65 6.431 11.349 0.405 1.00 0.00 C ATOM 1029 CE1 TYR A 65 5.688 13.858 1.279 1.00 0.00 C ATOM 1030 CE2 TYR A 65 7.010 12.473 -0.155 1.00 0.00 C ATOM 1031 CZ TYR A 65 6.635 13.725 0.286 1.00 0.00 C ATOM 1032 OH TYR A 65 7.208 14.845 -0.269 1.00 0.00 O ATOM 0 H TYR A 65 3.394 7.718 1.661 1.00 0.00 H new ATOM 0 HA TYR A 65 2.839 10.588 1.362 1.00 0.00 H new ATOM 0 HB2 TYR A 65 4.624 10.422 3.067 1.00 0.00 H new ATOM 0 HB3 TYR A 65 5.570 9.409 1.994 1.00 0.00 H new ATOM 0 HD1 TYR A 65 4.375 12.839 2.614 1.00 0.00 H new ATOM 0 HD2 TYR A 65 6.726 10.370 0.057 1.00 0.00 H new ATOM 0 HE1 TYR A 65 5.395 14.840 1.621 1.00 0.00 H new ATOM 0 HE2 TYR A 65 7.752 12.371 -0.933 1.00 0.00 H new ATOM 0 HH TYR A 65 7.856 14.576 -0.953 1.00 0.00 H new ATOM 1042 N VAL A 66 2.828 9.589 -0.989 1.00 0.00 N ATOM 1043 CA VAL A 66 2.969 9.305 -2.411 1.00 0.00 C ATOM 1044 C VAL A 66 2.293 10.377 -3.260 1.00 0.00 C ATOM 1045 O VAL A 66 1.427 11.109 -2.783 1.00 0.00 O ATOM 1046 CB VAL A 66 2.371 7.930 -2.766 1.00 0.00 C ATOM 1047 CG1 VAL A 66 2.863 6.867 -1.797 1.00 0.00 C ATOM 1048 CG2 VAL A 66 0.851 7.992 -2.771 1.00 0.00 C ATOM 0 H VAL A 66 1.894 9.886 -0.708 1.00 0.00 H new ATOM 0 HA VAL A 66 4.037 9.299 -2.629 1.00 0.00 H new ATOM 0 HB VAL A 66 2.704 7.659 -3.768 1.00 0.00 H new ATOM 0 HG11 VAL A 66 2.430 5.903 -2.064 1.00 0.00 H new ATOM 0 HG12 VAL A 66 3.950 6.803 -1.848 1.00 0.00 H new ATOM 0 HG13 VAL A 66 2.562 7.132 -0.783 1.00 0.00 H new ATOM 0 HG21 VAL A 66 0.448 7.011 -3.024 1.00 0.00 H new ATOM 0 HG22 VAL A 66 0.496 8.287 -1.784 1.00 0.00 H new ATOM 0 HG23 VAL A 66 0.519 8.722 -3.509 1.00 0.00 H new ATOM 1058 N THR A 67 2.697 10.458 -4.523 1.00 0.00 N ATOM 1059 CA THR A 67 2.134 11.437 -5.445 1.00 0.00 C ATOM 1060 C THR A 67 0.665 11.137 -5.733 1.00 0.00 C ATOM 1061 O THR A 67 0.064 10.266 -5.104 1.00 0.00 O ATOM 1062 CB THR A 67 2.935 11.460 -6.749 1.00 0.00 C ATOM 1063 OG1 THR A 67 2.827 12.722 -7.384 1.00 0.00 O ATOM 1064 CG2 THR A 67 2.496 10.410 -7.744 1.00 0.00 C ATOM 0 H THR A 67 3.413 9.857 -4.932 1.00 0.00 H new ATOM 0 HA THR A 67 2.195 12.419 -4.975 1.00 0.00 H new ATOM 0 HB THR A 67 3.964 11.251 -6.455 1.00 0.00 H new ATOM 0 HG1 THR A 67 3.347 12.716 -8.214 1.00 0.00 H new ATOM 0 HG21 THR A 67 3.106 10.484 -8.644 1.00 0.00 H new ATOM 0 HG22 THR A 67 2.616 9.420 -7.305 1.00 0.00 H new ATOM 0 HG23 THR A 67 1.449 10.568 -8.002 1.00 0.00 H new ATOM 1072 N HIS A 68 0.093 11.866 -6.688 1.00 0.00 N ATOM 1073 CA HIS A 68 -1.304 11.681 -7.058 1.00 0.00 C ATOM 1074 C HIS A 68 -1.452 11.507 -8.567 1.00 0.00 C ATOM 1075 O HIS A 68 -0.490 11.665 -9.319 1.00 0.00 O ATOM 1076 CB HIS A 68 -2.142 12.872 -6.587 1.00 0.00 C ATOM 1077 CG HIS A 68 -1.468 13.702 -5.539 1.00 0.00 C ATOM 1078 ND1 HIS A 68 -1.939 14.223 -4.382 1.00 0.00 N flip ATOM 1079 CD2 HIS A 68 -0.146 14.088 -5.621 1.00 0.00 C flip ATOM 1080 CE1 HIS A 68 -0.904 14.905 -3.792 1.00 0.00 C flip ATOM 1081 NE2 HIS A 68 0.166 14.808 -4.558 1.00 0.00 N flip ATOM 0 H HIS A 68 0.577 12.590 -7.219 1.00 0.00 H new ATOM 0 HA HIS A 68 -1.664 10.776 -6.569 1.00 0.00 H new ATOM 0 HB2 HIS A 68 -2.375 13.503 -7.444 1.00 0.00 H new ATOM 0 HB3 HIS A 68 -3.090 12.506 -6.194 1.00 0.00 H new ATOM 0 HD1 HIS A 68 -2.886 14.127 -4.017 1.00 0.00 H new ATOM 0 HD2 HIS A 68 0.528 13.840 -6.428 1.00 0.00 H new ATOM 0 HE1 HIS A 68 -0.957 15.435 -2.853 1.00 0.00 H new ATOM 1090 N GLU A 69 -2.665 11.181 -9.001 1.00 0.00 N ATOM 1091 CA GLU A 69 -2.946 10.986 -10.420 1.00 0.00 C ATOM 1092 C GLU A 69 -4.447 11.016 -10.686 1.00 0.00 C ATOM 1093 O GLU A 69 -5.241 10.544 -9.873 1.00 0.00 O ATOM 1094 CB GLU A 69 -2.359 9.656 -10.900 1.00 0.00 C ATOM 1095 CG GLU A 69 -0.884 9.736 -11.262 1.00 0.00 C ATOM 1096 CD GLU A 69 -0.546 10.981 -12.059 1.00 0.00 C ATOM 1097 OE1 GLU A 69 -1.481 11.626 -12.578 1.00 0.00 O ATOM 1098 OE2 GLU A 69 0.654 11.311 -12.165 1.00 0.00 O ATOM 0 H GLU A 69 -3.471 11.046 -8.390 1.00 0.00 H new ATOM 0 HA GLU A 69 -2.480 11.802 -10.972 1.00 0.00 H new ATOM 0 HB2 GLU A 69 -2.493 8.907 -10.120 1.00 0.00 H new ATOM 0 HB3 GLU A 69 -2.920 9.314 -11.770 1.00 0.00 H new ATOM 0 HG2 GLU A 69 -0.288 9.720 -10.349 1.00 0.00 H new ATOM 0 HG3 GLU A 69 -0.607 8.854 -11.839 1.00 0.00 H new ATOM 1105 N THR A 70 -4.829 11.578 -11.828 1.00 0.00 N ATOM 1106 CA THR A 70 -6.238 11.672 -12.198 1.00 0.00 C ATOM 1107 C THR A 70 -7.069 12.203 -11.035 1.00 0.00 C ATOM 1108 O THR A 70 -7.069 13.401 -10.756 1.00 0.00 O ATOM 1109 CB THR A 70 -6.766 10.303 -12.633 1.00 0.00 C ATOM 1110 OG1 THR A 70 -6.140 9.882 -13.832 1.00 0.00 O ATOM 1111 CG2 THR A 70 -8.262 10.287 -12.864 1.00 0.00 C ATOM 0 H THR A 70 -4.185 11.975 -12.512 1.00 0.00 H new ATOM 0 HA THR A 70 -6.324 12.368 -13.032 1.00 0.00 H new ATOM 0 HB THR A 70 -6.534 9.627 -11.810 1.00 0.00 H new ATOM 0 HG1 THR A 70 -6.489 9.004 -14.093 1.00 0.00 H new ATOM 0 HG21 THR A 70 -8.572 9.288 -13.170 1.00 0.00 H new ATOM 0 HG22 THR A 70 -8.775 10.560 -11.942 1.00 0.00 H new ATOM 0 HG23 THR A 70 -8.517 11.002 -13.646 1.00 0.00 H new ATOM 1119 N LYS A 71 -7.775 11.303 -10.358 1.00 0.00 N ATOM 1120 CA LYS A 71 -8.608 11.682 -9.224 1.00 0.00 C ATOM 1121 C LYS A 71 -7.748 12.000 -8.004 1.00 0.00 C ATOM 1122 O LYS A 71 -8.152 11.756 -6.867 1.00 0.00 O ATOM 1123 CB LYS A 71 -9.592 10.559 -8.889 1.00 0.00 C ATOM 1124 CG LYS A 71 -10.384 10.068 -10.089 1.00 0.00 C ATOM 1125 CD LYS A 71 -11.212 11.184 -10.705 1.00 0.00 C ATOM 1126 CE LYS A 71 -12.458 10.639 -11.383 1.00 0.00 C ATOM 1127 NZ LYS A 71 -12.795 11.396 -12.620 1.00 0.00 N ATOM 0 H LYS A 71 -7.786 10.307 -10.576 1.00 0.00 H new ATOM 0 HA LYS A 71 -9.168 12.576 -9.497 1.00 0.00 H new ATOM 0 HB2 LYS A 71 -9.042 9.722 -8.459 1.00 0.00 H new ATOM 0 HB3 LYS A 71 -10.286 10.911 -8.125 1.00 0.00 H new ATOM 0 HG2 LYS A 71 -9.701 9.665 -10.837 1.00 0.00 H new ATOM 0 HG3 LYS A 71 -11.040 9.253 -9.784 1.00 0.00 H new ATOM 0 HD2 LYS A 71 -11.499 11.896 -9.931 1.00 0.00 H new ATOM 0 HD3 LYS A 71 -10.609 11.728 -11.432 1.00 0.00 H new ATOM 0 HE2 LYS A 71 -12.306 9.588 -11.631 1.00 0.00 H new ATOM 0 HE3 LYS A 71 -13.298 10.685 -10.690 1.00 0.00 H new ATOM 0 HZ1 LYS A 71 -13.651 10.992 -13.052 1.00 0.00 H new ATOM 0 HZ2 LYS A 71 -12.965 12.394 -12.381 1.00 0.00 H new ATOM 0 HZ3 LYS A 71 -12.005 11.331 -13.293 1.00 0.00 H new ATOM 1141 N HIS A 72 -6.560 12.543 -8.249 1.00 0.00 N ATOM 1142 CA HIS A 72 -5.641 12.891 -7.171 1.00 0.00 C ATOM 1143 C HIS A 72 -5.486 11.729 -6.195 1.00 0.00 C ATOM 1144 O HIS A 72 -4.588 10.899 -6.341 1.00 0.00 O ATOM 1145 CB HIS A 72 -6.137 14.132 -6.427 1.00 0.00 C ATOM 1146 CG HIS A 72 -5.999 15.399 -7.214 1.00 0.00 C ATOM 1147 ND1 HIS A 72 -5.019 16.337 -6.966 1.00 0.00 N ATOM 1148 CD2 HIS A 72 -6.724 15.880 -8.252 1.00 0.00 C ATOM 1149 CE1 HIS A 72 -5.149 17.341 -7.815 1.00 0.00 C ATOM 1150 NE2 HIS A 72 -6.175 17.088 -8.606 1.00 0.00 N ATOM 0 H HIS A 72 -6.211 12.752 -9.184 1.00 0.00 H new ATOM 0 HA HIS A 72 -4.668 13.107 -7.613 1.00 0.00 H new ATOM 0 HB2 HIS A 72 -7.185 13.991 -6.162 1.00 0.00 H new ATOM 0 HB3 HIS A 72 -5.582 14.232 -5.494 1.00 0.00 H new ATOM 0 HD2 HIS A 72 -7.575 15.403 -8.715 1.00 0.00 H new ATOM 0 HE1 HIS A 72 -4.522 18.220 -7.855 1.00 0.00 H new ATOM 0 HE2 HIS A 72 -6.506 17.692 -9.358 1.00 0.00 H new ATOM 1159 N PHE A 73 -6.369 11.674 -5.203 1.00 0.00 N ATOM 1160 CA PHE A 73 -6.334 10.615 -4.201 1.00 0.00 C ATOM 1161 C PHE A 73 -7.166 10.997 -2.980 1.00 0.00 C ATOM 1162 O PHE A 73 -7.398 12.178 -2.720 1.00 0.00 O ATOM 1163 CB PHE A 73 -4.886 10.324 -3.786 1.00 0.00 C ATOM 1164 CG PHE A 73 -4.389 11.194 -2.664 1.00 0.00 C ATOM 1165 CD1 PHE A 73 -4.203 12.554 -2.854 1.00 0.00 C ATOM 1166 CD2 PHE A 73 -4.114 10.651 -1.419 1.00 0.00 C ATOM 1167 CE1 PHE A 73 -3.751 13.356 -1.822 1.00 0.00 C ATOM 1168 CE2 PHE A 73 -3.662 11.447 -0.384 1.00 0.00 C ATOM 1169 CZ PHE A 73 -3.480 12.802 -0.586 1.00 0.00 C ATOM 0 H PHE A 73 -7.119 12.352 -5.072 1.00 0.00 H new ATOM 0 HA PHE A 73 -6.763 9.714 -4.640 1.00 0.00 H new ATOM 0 HB2 PHE A 73 -4.807 9.279 -3.485 1.00 0.00 H new ATOM 0 HB3 PHE A 73 -4.236 10.457 -4.651 1.00 0.00 H new ATOM 0 HD1 PHE A 73 -4.413 12.992 -3.818 1.00 0.00 H new ATOM 0 HD2 PHE A 73 -4.255 9.593 -1.256 1.00 0.00 H new ATOM 0 HE1 PHE A 73 -3.610 14.415 -1.982 1.00 0.00 H new ATOM 0 HE2 PHE A 73 -3.451 11.011 0.581 1.00 0.00 H new ATOM 0 HZ PHE A 73 -3.127 13.427 0.221 1.00 0.00 H new ATOM 1179 N ILE A 74 -7.609 9.994 -2.231 1.00 0.00 N ATOM 1180 CA ILE A 74 -8.406 10.234 -1.034 1.00 0.00 C ATOM 1181 C ILE A 74 -7.817 9.506 0.171 1.00 0.00 C ATOM 1182 O ILE A 74 -7.921 8.285 0.290 1.00 0.00 O ATOM 1183 CB ILE A 74 -9.872 9.796 -1.225 1.00 0.00 C ATOM 1184 CG1 ILE A 74 -10.729 10.339 -0.062 1.00 0.00 C ATOM 1185 CG2 ILE A 74 -9.956 8.278 -1.345 1.00 0.00 C ATOM 1186 CD1 ILE A 74 -11.982 9.540 0.249 1.00 0.00 C ATOM 0 H ILE A 74 -7.431 9.010 -2.430 1.00 0.00 H new ATOM 0 HA ILE A 74 -8.385 11.309 -0.854 1.00 0.00 H new ATOM 0 HB ILE A 74 -10.267 10.213 -2.151 1.00 0.00 H new ATOM 0 HG12 ILE A 74 -10.111 10.378 0.835 1.00 0.00 H new ATOM 0 HG13 ILE A 74 -11.020 11.364 -0.294 1.00 0.00 H new ATOM 0 HG21 ILE A 74 -10.996 7.981 -1.479 1.00 0.00 H new ATOM 0 HG22 ILE A 74 -9.370 7.948 -2.203 1.00 0.00 H new ATOM 0 HG23 ILE A 74 -9.562 7.819 -0.438 1.00 0.00 H new ATOM 0 HD11 ILE A 74 -12.512 10.004 1.080 1.00 0.00 H new ATOM 0 HD12 ILE A 74 -12.628 9.521 -0.628 1.00 0.00 H new ATOM 0 HD13 ILE A 74 -11.706 8.521 0.519 1.00 0.00 H new ATOM 1198 N TYR A 75 -7.196 10.265 1.066 1.00 0.00 N ATOM 1199 CA TYR A 75 -6.594 9.693 2.264 1.00 0.00 C ATOM 1200 C TYR A 75 -7.430 10.028 3.492 1.00 0.00 C ATOM 1201 O TYR A 75 -7.268 11.088 4.096 1.00 0.00 O ATOM 1202 CB TYR A 75 -5.166 10.211 2.445 1.00 0.00 C ATOM 1203 CG TYR A 75 -4.423 9.549 3.584 1.00 0.00 C ATOM 1204 CD1 TYR A 75 -4.052 8.211 3.511 1.00 0.00 C ATOM 1205 CD2 TYR A 75 -4.091 10.260 4.729 1.00 0.00 C ATOM 1206 CE1 TYR A 75 -3.372 7.603 4.550 1.00 0.00 C ATOM 1207 CE2 TYR A 75 -3.411 9.660 5.771 1.00 0.00 C ATOM 1208 CZ TYR A 75 -3.054 8.331 5.676 1.00 0.00 C ATOM 1209 OH TYR A 75 -2.377 7.729 6.712 1.00 0.00 O ATOM 0 H TYR A 75 -7.096 11.277 0.985 1.00 0.00 H new ATOM 0 HA TYR A 75 -6.562 8.610 2.147 1.00 0.00 H new ATOM 0 HB2 TYR A 75 -4.611 10.054 1.520 1.00 0.00 H new ATOM 0 HB3 TYR A 75 -5.198 11.287 2.619 1.00 0.00 H new ATOM 0 HD1 TYR A 75 -4.299 7.638 2.629 1.00 0.00 H new ATOM 0 HD2 TYR A 75 -4.369 11.301 4.807 1.00 0.00 H new ATOM 0 HE1 TYR A 75 -3.091 6.562 4.479 1.00 0.00 H new ATOM 0 HE2 TYR A 75 -3.160 10.228 6.655 1.00 0.00 H new ATOM 0 HH TYR A 75 -2.199 6.792 6.486 1.00 0.00 H new ATOM 1219 N PHE A 76 -8.331 9.121 3.851 1.00 0.00 N ATOM 1220 CA PHE A 76 -9.200 9.327 5.002 1.00 0.00 C ATOM 1221 C PHE A 76 -8.800 8.428 6.167 1.00 0.00 C ATOM 1222 O PHE A 76 -7.994 7.510 6.011 1.00 0.00 O ATOM 1223 CB PHE A 76 -10.660 9.071 4.621 1.00 0.00 C ATOM 1224 CG PHE A 76 -10.848 7.890 3.710 1.00 0.00 C ATOM 1225 CD1 PHE A 76 -10.333 7.900 2.423 1.00 0.00 C ATOM 1226 CD2 PHE A 76 -11.544 6.772 4.141 1.00 0.00 C ATOM 1227 CE1 PHE A 76 -10.508 6.816 1.584 1.00 0.00 C ATOM 1228 CE2 PHE A 76 -11.722 5.685 3.305 1.00 0.00 C ATOM 1229 CZ PHE A 76 -11.203 5.707 2.025 1.00 0.00 C ATOM 0 H PHE A 76 -8.478 8.238 3.362 1.00 0.00 H new ATOM 0 HA PHE A 76 -9.090 10.364 5.320 1.00 0.00 H new ATOM 0 HB2 PHE A 76 -11.241 8.914 5.530 1.00 0.00 H new ATOM 0 HB3 PHE A 76 -11.061 9.961 4.136 1.00 0.00 H new ATOM 0 HD1 PHE A 76 -9.789 8.765 2.072 1.00 0.00 H new ATOM 0 HD2 PHE A 76 -11.952 6.749 5.141 1.00 0.00 H new ATOM 0 HE1 PHE A 76 -10.101 6.836 0.584 1.00 0.00 H new ATOM 0 HE2 PHE A 76 -12.266 4.819 3.653 1.00 0.00 H new ATOM 0 HZ PHE A 76 -11.340 4.859 1.371 1.00 0.00 H new ATOM 1239 N TYR A 77 -9.372 8.701 7.335 1.00 0.00 N ATOM 1240 CA TYR A 77 -9.083 7.924 8.533 1.00 0.00 C ATOM 1241 C TYR A 77 -10.372 7.420 9.173 1.00 0.00 C ATOM 1242 O TYR A 77 -10.933 8.069 10.056 1.00 0.00 O ATOM 1243 CB TYR A 77 -8.298 8.771 9.538 1.00 0.00 C ATOM 1244 CG TYR A 77 -7.882 8.014 10.780 1.00 0.00 C ATOM 1245 CD1 TYR A 77 -6.891 7.043 10.725 1.00 0.00 C ATOM 1246 CD2 TYR A 77 -8.480 8.271 12.009 1.00 0.00 C ATOM 1247 CE1 TYR A 77 -6.507 6.349 11.857 1.00 0.00 C ATOM 1248 CE2 TYR A 77 -8.101 7.582 13.145 1.00 0.00 C ATOM 1249 CZ TYR A 77 -7.115 6.622 13.063 1.00 0.00 C ATOM 1250 OH TYR A 77 -6.734 5.933 14.193 1.00 0.00 O ATOM 0 H TYR A 77 -10.041 9.458 7.477 1.00 0.00 H new ATOM 0 HA TYR A 77 -8.479 7.064 8.244 1.00 0.00 H new ATOM 0 HB2 TYR A 77 -7.407 9.166 9.049 1.00 0.00 H new ATOM 0 HB3 TYR A 77 -8.906 9.626 9.832 1.00 0.00 H new ATOM 0 HD1 TYR A 77 -6.412 6.826 9.782 1.00 0.00 H new ATOM 0 HD2 TYR A 77 -9.254 9.022 12.077 1.00 0.00 H new ATOM 0 HE1 TYR A 77 -5.734 5.597 11.797 1.00 0.00 H new ATOM 0 HE2 TYR A 77 -8.575 7.794 14.092 1.00 0.00 H new ATOM 0 HH TYR A 77 -7.259 6.246 14.959 1.00 0.00 H new ATOM 1260 N LEU A 78 -10.835 6.259 8.722 1.00 0.00 N ATOM 1261 CA LEU A 78 -12.057 5.664 9.249 1.00 0.00 C ATOM 1262 C LEU A 78 -12.135 5.831 10.763 1.00 0.00 C ATOM 1263 O LEU A 78 -11.156 6.202 11.409 1.00 0.00 O ATOM 1264 CB LEU A 78 -12.122 4.176 8.885 1.00 0.00 C ATOM 1265 CG LEU A 78 -12.466 3.849 7.423 1.00 0.00 C ATOM 1266 CD1 LEU A 78 -13.968 3.717 7.248 1.00 0.00 C ATOM 1267 CD2 LEU A 78 -11.908 4.898 6.466 1.00 0.00 C ATOM 0 H LEU A 78 -10.381 5.711 7.991 1.00 0.00 H new ATOM 0 HA LEU A 78 -12.906 6.180 8.800 1.00 0.00 H new ATOM 0 HB2 LEU A 78 -11.158 3.724 9.120 1.00 0.00 H new ATOM 0 HB3 LEU A 78 -12.863 3.699 9.526 1.00 0.00 H new ATOM 0 HG LEU A 78 -11.997 2.896 7.179 1.00 0.00 H new ATOM 0 HD11 LEU A 78 -14.194 3.485 6.207 1.00 0.00 H new ATOM 0 HD12 LEU A 78 -14.340 2.916 7.887 1.00 0.00 H new ATOM 0 HD13 LEU A 78 -14.450 4.655 7.524 1.00 0.00 H new ATOM 0 HD21 LEU A 78 -12.171 4.633 5.442 1.00 0.00 H new ATOM 0 HD22 LEU A 78 -12.330 5.873 6.708 1.00 0.00 H new ATOM 0 HD23 LEU A 78 -10.823 4.938 6.563 1.00 0.00 H new ATOM 1279 N GLY A 79 -13.308 5.554 11.320 1.00 0.00 N ATOM 1280 CA GLY A 79 -13.497 5.678 12.753 1.00 0.00 C ATOM 1281 C GLY A 79 -12.240 5.362 13.540 1.00 0.00 C ATOM 1282 O GLY A 79 -11.849 6.120 14.427 1.00 0.00 O ATOM 0 H GLY A 79 -14.132 5.245 10.804 1.00 0.00 H new ATOM 0 HA2 GLY A 79 -13.821 6.692 12.986 1.00 0.00 H new ATOM 0 HA3 GLY A 79 -14.296 5.008 13.069 1.00 0.00 H new ATOM 1286 N GLN A 80 -11.605 4.238 13.218 1.00 0.00 N ATOM 1287 CA GLN A 80 -10.387 3.829 13.906 1.00 0.00 C ATOM 1288 C GLN A 80 -9.368 3.258 12.925 1.00 0.00 C ATOM 1289 O GLN A 80 -8.455 2.529 13.316 1.00 0.00 O ATOM 1290 CB GLN A 80 -10.710 2.793 14.985 1.00 0.00 C ATOM 1291 CG GLN A 80 -10.855 3.390 16.375 1.00 0.00 C ATOM 1292 CD GLN A 80 -9.977 2.702 17.401 1.00 0.00 C ATOM 1293 OE1 GLN A 80 -8.851 2.303 17.104 1.00 0.00 O ATOM 1294 NE2 GLN A 80 -10.490 2.559 18.617 1.00 0.00 N ATOM 0 H GLN A 80 -11.914 3.597 12.487 1.00 0.00 H new ATOM 0 HA GLN A 80 -9.953 4.712 14.376 1.00 0.00 H new ATOM 0 HB2 GLN A 80 -11.635 2.281 14.720 1.00 0.00 H new ATOM 0 HB3 GLN A 80 -9.922 2.040 15.002 1.00 0.00 H new ATOM 0 HG2 GLN A 80 -10.603 4.450 16.339 1.00 0.00 H new ATOM 0 HG3 GLN A 80 -11.896 3.321 16.689 1.00 0.00 H new ATOM 0 HE21 GLN A 80 -11.428 2.905 18.819 1.00 0.00 H new ATOM 0 HE22 GLN A 80 -9.946 2.103 19.350 1.00 0.00 H new ATOM 1303 N VAL A 81 -9.527 3.596 11.650 1.00 0.00 N ATOM 1304 CA VAL A 81 -8.619 3.121 10.613 1.00 0.00 C ATOM 1305 C VAL A 81 -8.336 4.219 9.594 1.00 0.00 C ATOM 1306 O VAL A 81 -8.918 5.301 9.658 1.00 0.00 O ATOM 1307 CB VAL A 81 -9.192 1.888 9.887 1.00 0.00 C ATOM 1308 CG1 VAL A 81 -8.184 1.331 8.894 1.00 0.00 C ATOM 1309 CG2 VAL A 81 -9.601 0.824 10.893 1.00 0.00 C ATOM 0 H VAL A 81 -10.277 4.198 11.310 1.00 0.00 H new ATOM 0 HA VAL A 81 -7.689 2.838 11.105 1.00 0.00 H new ATOM 0 HB VAL A 81 -10.078 2.196 9.332 1.00 0.00 H new ATOM 0 HG11 VAL A 81 -8.609 0.461 8.393 1.00 0.00 H new ATOM 0 HG12 VAL A 81 -7.942 2.094 8.154 1.00 0.00 H new ATOM 0 HG13 VAL A 81 -7.277 1.038 9.422 1.00 0.00 H new ATOM 0 HG21 VAL A 81 -10.004 -0.040 10.365 1.00 0.00 H new ATOM 0 HG22 VAL A 81 -8.731 0.520 11.475 1.00 0.00 H new ATOM 0 HG23 VAL A 81 -10.362 1.228 11.561 1.00 0.00 H new ATOM 1319 N ALA A 82 -7.442 3.937 8.655 1.00 0.00 N ATOM 1320 CA ALA A 82 -7.087 4.902 7.627 1.00 0.00 C ATOM 1321 C ALA A 82 -6.992 4.227 6.267 1.00 0.00 C ATOM 1322 O ALA A 82 -6.547 3.084 6.161 1.00 0.00 O ATOM 1323 CB ALA A 82 -5.777 5.591 7.974 1.00 0.00 C ATOM 0 H ALA A 82 -6.950 3.046 8.586 1.00 0.00 H new ATOM 0 HA ALA A 82 -7.872 5.657 7.579 1.00 0.00 H new ATOM 0 HB1 ALA A 82 -5.526 6.310 7.194 1.00 0.00 H new ATOM 0 HB2 ALA A 82 -5.880 6.110 8.927 1.00 0.00 H new ATOM 0 HB3 ALA A 82 -4.984 4.847 8.050 1.00 0.00 H new ATOM 1329 N ILE A 83 -7.415 4.936 5.230 1.00 0.00 N ATOM 1330 CA ILE A 83 -7.381 4.398 3.878 1.00 0.00 C ATOM 1331 C ILE A 83 -6.775 5.399 2.903 1.00 0.00 C ATOM 1332 O ILE A 83 -7.367 6.441 2.616 1.00 0.00 O ATOM 1333 CB ILE A 83 -8.788 4.000 3.388 1.00 0.00 C ATOM 1334 CG1 ILE A 83 -9.748 3.847 4.573 1.00 0.00 C ATOM 1335 CG2 ILE A 83 -8.722 2.712 2.582 1.00 0.00 C ATOM 1336 CD1 ILE A 83 -9.459 2.638 5.438 1.00 0.00 C ATOM 0 H ILE A 83 -7.785 5.884 5.299 1.00 0.00 H new ATOM 0 HA ILE A 83 -6.756 3.505 3.912 1.00 0.00 H new ATOM 0 HB ILE A 83 -9.167 4.792 2.743 1.00 0.00 H new ATOM 0 HG12 ILE A 83 -9.696 4.744 5.189 1.00 0.00 H new ATOM 0 HG13 ILE A 83 -10.768 3.778 4.196 1.00 0.00 H new ATOM 0 HG21 ILE A 83 -9.722 2.443 2.243 1.00 0.00 H new ATOM 0 HG22 ILE A 83 -8.073 2.856 1.719 1.00 0.00 H new ATOM 0 HG23 ILE A 83 -8.324 1.912 3.206 1.00 0.00 H new ATOM 0 HD11 ILE A 83 -10.178 2.595 6.256 1.00 0.00 H new ATOM 0 HD12 ILE A 83 -9.539 1.733 4.836 1.00 0.00 H new ATOM 0 HD13 ILE A 83 -8.451 2.715 5.845 1.00 0.00 H new ATOM 1348 N LEU A 84 -5.591 5.069 2.400 1.00 0.00 N ATOM 1349 CA LEU A 84 -4.892 5.925 1.453 1.00 0.00 C ATOM 1350 C LEU A 84 -5.189 5.489 0.022 1.00 0.00 C ATOM 1351 O LEU A 84 -4.474 4.665 -0.549 1.00 0.00 O ATOM 1352 CB LEU A 84 -3.384 5.876 1.718 1.00 0.00 C ATOM 1353 CG LEU A 84 -2.506 6.445 0.603 1.00 0.00 C ATOM 1354 CD1 LEU A 84 -2.275 7.933 0.817 1.00 0.00 C ATOM 1355 CD2 LEU A 84 -1.181 5.702 0.539 1.00 0.00 C ATOM 0 H LEU A 84 -5.094 4.210 2.635 1.00 0.00 H new ATOM 0 HA LEU A 84 -5.242 6.949 1.583 1.00 0.00 H new ATOM 0 HB2 LEU A 84 -3.175 6.423 2.637 1.00 0.00 H new ATOM 0 HB3 LEU A 84 -3.096 4.839 1.892 1.00 0.00 H new ATOM 0 HG LEU A 84 -3.022 6.310 -0.348 1.00 0.00 H new ATOM 0 HD11 LEU A 84 -1.648 8.323 0.015 1.00 0.00 H new ATOM 0 HD12 LEU A 84 -3.233 8.454 0.815 1.00 0.00 H new ATOM 0 HD13 LEU A 84 -1.778 8.090 1.775 1.00 0.00 H new ATOM 0 HD21 LEU A 84 -0.568 6.119 -0.260 1.00 0.00 H new ATOM 0 HD22 LEU A 84 -0.659 5.807 1.490 1.00 0.00 H new ATOM 0 HD23 LEU A 84 -1.365 4.646 0.341 1.00 0.00 H new ATOM 1367 N LEU A 85 -6.257 6.038 -0.549 1.00 0.00 N ATOM 1368 CA LEU A 85 -6.656 5.695 -1.910 1.00 0.00 C ATOM 1369 C LEU A 85 -6.071 6.670 -2.925 1.00 0.00 C ATOM 1370 O LEU A 85 -6.010 7.874 -2.682 1.00 0.00 O ATOM 1371 CB LEU A 85 -8.181 5.687 -2.028 1.00 0.00 C ATOM 1372 CG LEU A 85 -8.788 4.359 -2.479 1.00 0.00 C ATOM 1373 CD1 LEU A 85 -9.104 3.488 -1.274 1.00 0.00 C ATOM 1374 CD2 LEU A 85 -10.041 4.597 -3.309 1.00 0.00 C ATOM 0 H LEU A 85 -6.861 6.721 -0.091 1.00 0.00 H new ATOM 0 HA LEU A 85 -6.267 4.700 -2.127 1.00 0.00 H new ATOM 0 HB2 LEU A 85 -8.606 5.953 -1.060 1.00 0.00 H new ATOM 0 HB3 LEU A 85 -8.480 6.463 -2.732 1.00 0.00 H new ATOM 0 HG LEU A 85 -8.060 3.840 -3.102 1.00 0.00 H new ATOM 0 HD11 LEU A 85 -9.536 2.545 -1.610 1.00 0.00 H new ATOM 0 HD12 LEU A 85 -8.188 3.290 -0.718 1.00 0.00 H new ATOM 0 HD13 LEU A 85 -9.815 4.004 -0.629 1.00 0.00 H new ATOM 0 HD21 LEU A 85 -10.458 3.639 -3.621 1.00 0.00 H new ATOM 0 HD22 LEU A 85 -10.776 5.136 -2.712 1.00 0.00 H new ATOM 0 HD23 LEU A 85 -9.787 5.186 -4.190 1.00 0.00 H new ATOM 1386 N PHE A 86 -5.652 6.137 -4.069 1.00 0.00 N ATOM 1387 CA PHE A 86 -5.082 6.966 -5.130 1.00 0.00 C ATOM 1388 C PHE A 86 -4.754 6.140 -6.377 1.00 0.00 C ATOM 1389 O PHE A 86 -4.478 4.944 -6.288 1.00 0.00 O ATOM 1390 CB PHE A 86 -3.828 7.690 -4.624 1.00 0.00 C ATOM 1391 CG PHE A 86 -2.547 6.930 -4.841 1.00 0.00 C ATOM 1392 CD1 PHE A 86 -2.142 5.957 -3.941 1.00 0.00 C ATOM 1393 CD2 PHE A 86 -1.751 7.193 -5.944 1.00 0.00 C ATOM 1394 CE1 PHE A 86 -0.965 5.260 -4.138 1.00 0.00 C ATOM 1395 CE2 PHE A 86 -0.574 6.498 -6.146 1.00 0.00 C ATOM 1396 CZ PHE A 86 -0.180 5.532 -5.242 1.00 0.00 C ATOM 0 H PHE A 86 -5.695 5.141 -4.286 1.00 0.00 H new ATOM 0 HA PHE A 86 -5.831 7.706 -5.411 1.00 0.00 H new ATOM 0 HB2 PHE A 86 -3.753 8.656 -5.124 1.00 0.00 H new ATOM 0 HB3 PHE A 86 -3.943 7.890 -3.559 1.00 0.00 H new ATOM 0 HD1 PHE A 86 -2.753 5.741 -3.077 1.00 0.00 H new ATOM 0 HD2 PHE A 86 -2.054 7.949 -6.653 1.00 0.00 H new ATOM 0 HE1 PHE A 86 -0.659 4.504 -3.430 1.00 0.00 H new ATOM 0 HE2 PHE A 86 0.037 6.710 -7.011 1.00 0.00 H new ATOM 0 HZ PHE A 86 0.741 4.989 -5.398 1.00 0.00 H new ATOM 1406 N LYS A 87 -4.787 6.796 -7.535 1.00 0.00 N ATOM 1407 CA LYS A 87 -4.494 6.140 -8.807 1.00 0.00 C ATOM 1408 C LYS A 87 -3.196 6.670 -9.404 1.00 0.00 C ATOM 1409 O LYS A 87 -2.439 7.381 -8.742 1.00 0.00 O ATOM 1410 CB LYS A 87 -5.642 6.363 -9.795 1.00 0.00 C ATOM 1411 CG LYS A 87 -6.932 6.817 -9.137 1.00 0.00 C ATOM 1412 CD LYS A 87 -8.122 6.643 -10.065 1.00 0.00 C ATOM 1413 CE LYS A 87 -7.923 7.395 -11.371 1.00 0.00 C ATOM 1414 NZ LYS A 87 -9.217 7.790 -11.990 1.00 0.00 N ATOM 0 H LYS A 87 -5.015 7.787 -7.618 1.00 0.00 H new ATOM 0 HA LYS A 87 -4.382 5.072 -8.618 1.00 0.00 H new ATOM 0 HB2 LYS A 87 -5.338 7.108 -10.530 1.00 0.00 H new ATOM 0 HB3 LYS A 87 -5.828 5.436 -10.338 1.00 0.00 H new ATOM 0 HG2 LYS A 87 -7.096 6.246 -8.223 1.00 0.00 H new ATOM 0 HG3 LYS A 87 -6.845 7.864 -8.848 1.00 0.00 H new ATOM 0 HD2 LYS A 87 -8.271 5.583 -10.273 1.00 0.00 H new ATOM 0 HD3 LYS A 87 -9.025 7.001 -9.571 1.00 0.00 H new ATOM 0 HE2 LYS A 87 -7.322 8.286 -11.188 1.00 0.00 H new ATOM 0 HE3 LYS A 87 -7.364 6.770 -12.067 1.00 0.00 H new ATOM 0 HZ1 LYS A 87 -9.194 7.578 -13.008 1.00 0.00 H new ATOM 0 HZ2 LYS A 87 -9.992 7.259 -11.543 1.00 0.00 H new ATOM 0 HZ3 LYS A 87 -9.371 8.809 -11.852 1.00 0.00 H new ATOM 1428 N SER A 88 -2.949 6.326 -10.663 1.00 0.00 N ATOM 1429 CA SER A 88 -1.746 6.771 -11.357 1.00 0.00 C ATOM 1430 C SER A 88 -2.040 7.019 -12.826 1.00 0.00 C ATOM 1431 O SER A 88 -1.135 7.074 -13.659 1.00 0.00 O ATOM 1432 CB SER A 88 -0.638 5.733 -11.219 1.00 0.00 C ATOM 1433 OG SER A 88 -0.130 5.701 -9.898 1.00 0.00 O ATOM 0 H SER A 88 -3.567 5.740 -11.224 1.00 0.00 H new ATOM 0 HA SER A 88 -1.415 7.705 -10.902 1.00 0.00 H new ATOM 0 HB2 SER A 88 -1.022 4.749 -11.488 1.00 0.00 H new ATOM 0 HB3 SER A 88 0.168 5.962 -11.916 1.00 0.00 H new ATOM 0 HG SER A 88 -0.689 5.114 -9.347 1.00 0.00 H new ATOM 1439 N GLY A 89 -3.316 7.166 -13.125 1.00 0.00 N ATOM 1440 CA GLY A 89 -3.742 7.408 -14.490 1.00 0.00 C ATOM 1441 C GLY A 89 -3.180 6.388 -15.461 1.00 0.00 C ATOM 1442 O GLY A 89 -3.811 5.323 -15.635 1.00 0.00 O ATOM 1443 OXT GLY A 89 -2.111 6.654 -16.049 1.00 0.00 O ATOM 0 H GLY A 89 -4.074 7.122 -12.444 1.00 0.00 H new ATOM 0 HA2 GLY A 89 -4.831 7.388 -14.537 1.00 0.00 H new ATOM 0 HA3 GLY A 89 -3.428 8.406 -14.794 1.00 0.00 H new TER 1447 GLY A 89 ATOM 1448 N MET B 1 23.718 2.421 11.636 1.00 0.00 N ATOM 1449 CA MET B 1 24.933 1.630 11.963 1.00 0.00 C ATOM 1450 C MET B 1 25.053 0.411 11.056 1.00 0.00 C ATOM 1451 O MET B 1 25.639 0.483 9.974 1.00 0.00 O ATOM 1452 CB MET B 1 24.851 1.194 13.427 1.00 0.00 C ATOM 1453 CG MET B 1 26.147 1.392 14.196 1.00 0.00 C ATOM 1454 SD MET B 1 26.277 3.034 14.930 1.00 0.00 S ATOM 1455 CE MET B 1 27.771 2.853 15.899 1.00 0.00 C ATOM 0 H1 MET B 1 23.660 3.245 12.268 1.00 0.00 H new ATOM 0 H2 MET B 1 23.770 2.744 10.649 1.00 0.00 H new ATOM 0 H3 MET B 1 22.873 1.828 11.762 1.00 0.00 H new ATOM 0 HA MET B 1 25.818 2.247 11.805 1.00 0.00 H new ATOM 0 HB2 MET B 1 24.057 1.755 13.920 1.00 0.00 H new ATOM 0 HB3 MET B 1 24.571 0.141 13.468 1.00 0.00 H new ATOM 0 HG2 MET B 1 26.216 0.640 14.982 1.00 0.00 H new ATOM 0 HG3 MET B 1 26.991 1.230 13.525 1.00 0.00 H new ATOM 0 HE1 MET B 1 27.986 3.789 16.415 1.00 0.00 H new ATOM 0 HE2 MET B 1 27.635 2.057 16.632 1.00 0.00 H new ATOM 0 HE3 MET B 1 28.603 2.602 15.241 1.00 0.00 H new ATOM 1467 N CYS B 2 24.491 -0.708 11.500 1.00 0.00 N ATOM 1468 CA CYS B 2 24.530 -1.943 10.728 1.00 0.00 C ATOM 1469 C CYS B 2 23.787 -1.780 9.406 1.00 0.00 C ATOM 1470 O CYS B 2 23.987 -2.554 8.469 1.00 0.00 O ATOM 1471 CB CYS B 2 23.917 -3.088 11.535 1.00 0.00 C ATOM 1472 SG CYS B 2 22.171 -3.390 11.179 1.00 0.00 S ATOM 0 H CYS B 2 24.002 -0.784 12.392 1.00 0.00 H new ATOM 0 HA CYS B 2 25.572 -2.177 10.511 1.00 0.00 H new ATOM 0 HB2 CYS B 2 24.480 -4.000 11.337 1.00 0.00 H new ATOM 0 HB3 CYS B 2 24.028 -2.870 12.597 1.00 0.00 H new ATOM 0 HG CYS B 2 21.947 -3.198 9.913 1.00 0.00 H new ATOM 1478 N ASP B 3 22.927 -0.768 9.338 1.00 0.00 N ATOM 1479 CA ASP B 3 22.154 -0.501 8.131 1.00 0.00 C ATOM 1480 C ASP B 3 20.946 -1.428 8.042 1.00 0.00 C ATOM 1481 O ASP B 3 20.789 -2.340 8.855 1.00 0.00 O ATOM 1482 CB ASP B 3 23.029 -0.668 6.889 1.00 0.00 C ATOM 1483 CG ASP B 3 24.315 0.132 6.977 1.00 0.00 C ATOM 1484 OD1 ASP B 3 24.397 1.033 7.837 1.00 0.00 O ATOM 1485 OD2 ASP B 3 25.241 -0.146 6.186 1.00 0.00 O ATOM 0 H ASP B 3 22.748 -0.120 10.105 1.00 0.00 H new ATOM 0 HA ASP B 3 21.799 0.528 8.180 1.00 0.00 H new ATOM 0 HB2 ASP B 3 23.269 -1.723 6.756 1.00 0.00 H new ATOM 0 HB3 ASP B 3 22.469 -0.355 6.008 1.00 0.00 H new ATOM 1490 N ARG B 4 20.096 -1.188 7.050 1.00 0.00 N ATOM 1491 CA ARG B 4 18.902 -2.001 6.851 1.00 0.00 C ATOM 1492 C ARG B 4 17.949 -1.867 8.035 1.00 0.00 C ATOM 1493 O ARG B 4 16.961 -1.135 7.969 1.00 0.00 O ATOM 1494 CB ARG B 4 19.285 -3.469 6.656 1.00 0.00 C ATOM 1495 CG ARG B 4 19.117 -3.958 5.226 1.00 0.00 C ATOM 1496 CD ARG B 4 20.416 -4.526 4.676 1.00 0.00 C ATOM 1497 NE ARG B 4 20.753 -5.809 5.284 1.00 0.00 N ATOM 1498 CZ ARG B 4 21.606 -5.943 6.296 1.00 0.00 C ATOM 1499 NH1 ARG B 4 22.202 -4.876 6.808 1.00 0.00 N ATOM 1500 NH2 ARG B 4 21.862 -7.145 6.794 1.00 0.00 N ATOM 0 H ARG B 4 20.212 -0.436 6.370 1.00 0.00 H new ATOM 0 HA ARG B 4 18.395 -1.642 5.955 1.00 0.00 H new ATOM 0 HB2 ARG B 4 20.323 -3.608 6.959 1.00 0.00 H new ATOM 0 HB3 ARG B 4 18.675 -4.086 7.316 1.00 0.00 H new ATOM 0 HG2 ARG B 4 18.340 -4.722 5.190 1.00 0.00 H new ATOM 0 HG3 ARG B 4 18.783 -3.134 4.595 1.00 0.00 H new ATOM 0 HD2 ARG B 4 20.330 -4.648 3.596 1.00 0.00 H new ATOM 0 HD3 ARG B 4 21.225 -3.817 4.853 1.00 0.00 H new ATOM 0 HE ARG B 4 20.310 -6.649 4.913 1.00 0.00 H new ATOM 0 HH11 ARG B 4 22.007 -3.950 6.426 1.00 0.00 H new ATOM 0 HH12 ARG B 4 22.856 -4.980 7.584 1.00 0.00 H new ATOM 0 HH21 ARG B 4 21.405 -7.968 6.401 1.00 0.00 H new ATOM 0 HH22 ARG B 4 22.516 -7.247 7.570 1.00 0.00 H new ATOM 1514 N LYS B 5 18.252 -2.579 9.115 1.00 0.00 N ATOM 1515 CA LYS B 5 17.422 -2.541 10.315 1.00 0.00 C ATOM 1516 C LYS B 5 15.945 -2.672 9.962 1.00 0.00 C ATOM 1517 O LYS B 5 15.081 -2.131 10.652 1.00 0.00 O ATOM 1518 CB LYS B 5 17.661 -1.241 11.084 1.00 0.00 C ATOM 1519 CG LYS B 5 18.752 -1.349 12.137 1.00 0.00 C ATOM 1520 CD LYS B 5 18.219 -1.944 13.430 1.00 0.00 C ATOM 1521 CE LYS B 5 17.412 -0.926 14.220 1.00 0.00 C ATOM 1522 NZ LYS B 5 18.230 0.258 14.596 1.00 0.00 N ATOM 0 H LYS B 5 19.066 -3.190 9.185 1.00 0.00 H new ATOM 0 HA LYS B 5 17.701 -3.385 10.945 1.00 0.00 H new ATOM 0 HB2 LYS B 5 17.926 -0.454 10.378 1.00 0.00 H new ATOM 0 HB3 LYS B 5 16.732 -0.937 11.566 1.00 0.00 H new ATOM 0 HG2 LYS B 5 19.565 -1.968 11.758 1.00 0.00 H new ATOM 0 HG3 LYS B 5 19.169 -0.361 12.334 1.00 0.00 H new ATOM 0 HD2 LYS B 5 17.595 -2.809 13.204 1.00 0.00 H new ATOM 0 HD3 LYS B 5 19.051 -2.301 14.037 1.00 0.00 H new ATOM 0 HE2 LYS B 5 16.556 -0.603 13.628 1.00 0.00 H new ATOM 0 HE3 LYS B 5 17.017 -1.396 15.121 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 17.816 0.714 15.434 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 19.201 -0.045 14.811 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 18.245 0.934 13.806 1.00 0.00 H new ATOM 1536 N ALA B 6 15.663 -3.395 8.885 1.00 0.00 N ATOM 1537 CA ALA B 6 14.292 -3.599 8.437 1.00 0.00 C ATOM 1538 C ALA B 6 13.997 -5.077 8.216 1.00 0.00 C ATOM 1539 O ALA B 6 14.851 -5.935 8.443 1.00 0.00 O ATOM 1540 CB ALA B 6 14.032 -2.816 7.161 1.00 0.00 C ATOM 0 H ALA B 6 16.368 -3.851 8.305 1.00 0.00 H new ATOM 0 HA ALA B 6 13.626 -3.235 9.219 1.00 0.00 H new ATOM 0 HB1 ALA B 6 13.004 -2.978 6.838 1.00 0.00 H new ATOM 0 HB2 ALA B 6 14.191 -1.754 7.347 1.00 0.00 H new ATOM 0 HB3 ALA B 6 14.715 -3.154 6.381 1.00 0.00 H new ATOM 1546 N VAL B 7 12.783 -5.364 7.765 1.00 0.00 N ATOM 1547 CA VAL B 7 12.362 -6.732 7.501 1.00 0.00 C ATOM 1548 C VAL B 7 11.491 -6.792 6.253 1.00 0.00 C ATOM 1549 O VAL B 7 10.290 -7.048 6.331 1.00 0.00 O ATOM 1550 CB VAL B 7 11.579 -7.320 8.689 1.00 0.00 C ATOM 1551 CG1 VAL B 7 11.006 -8.681 8.328 1.00 0.00 C ATOM 1552 CG2 VAL B 7 12.469 -7.414 9.919 1.00 0.00 C ATOM 0 H VAL B 7 12.069 -4.662 7.574 1.00 0.00 H new ATOM 0 HA VAL B 7 13.265 -7.324 7.349 1.00 0.00 H new ATOM 0 HB VAL B 7 10.748 -6.654 8.921 1.00 0.00 H new ATOM 0 HG11 VAL B 7 10.456 -9.082 9.179 1.00 0.00 H new ATOM 0 HG12 VAL B 7 10.333 -8.578 7.477 1.00 0.00 H new ATOM 0 HG13 VAL B 7 11.818 -9.360 8.069 1.00 0.00 H new ATOM 0 HG21 VAL B 7 11.899 -7.832 10.749 1.00 0.00 H new ATOM 0 HG22 VAL B 7 13.321 -8.058 9.703 1.00 0.00 H new ATOM 0 HG23 VAL B 7 12.825 -6.419 10.187 1.00 0.00 H new ATOM 1562 N ILE B 8 12.107 -6.547 5.102 1.00 0.00 N ATOM 1563 CA ILE B 8 11.392 -6.566 3.835 1.00 0.00 C ATOM 1564 C ILE B 8 10.360 -7.692 3.813 1.00 0.00 C ATOM 1565 O ILE B 8 10.540 -8.732 4.446 1.00 0.00 O ATOM 1566 CB ILE B 8 12.376 -6.697 2.637 1.00 0.00 C ATOM 1567 CG1 ILE B 8 12.674 -5.314 2.054 1.00 0.00 C ATOM 1568 CG2 ILE B 8 11.837 -7.616 1.543 1.00 0.00 C ATOM 1569 CD1 ILE B 8 14.009 -4.747 2.489 1.00 0.00 C ATOM 0 H ILE B 8 13.101 -6.333 5.022 1.00 0.00 H new ATOM 0 HA ILE B 8 10.866 -5.617 3.734 1.00 0.00 H new ATOM 0 HB ILE B 8 13.294 -7.145 3.017 1.00 0.00 H new ATOM 0 HG12 ILE B 8 12.652 -5.375 0.966 1.00 0.00 H new ATOM 0 HG13 ILE B 8 11.882 -4.626 2.351 1.00 0.00 H new ATOM 0 HG21 ILE B 8 12.559 -7.675 0.729 1.00 0.00 H new ATOM 0 HG22 ILE B 8 11.671 -8.612 1.954 1.00 0.00 H new ATOM 0 HG23 ILE B 8 10.896 -7.218 1.164 1.00 0.00 H new ATOM 0 HD11 ILE B 8 14.152 -3.765 2.037 1.00 0.00 H new ATOM 0 HD12 ILE B 8 14.028 -4.653 3.575 1.00 0.00 H new ATOM 0 HD13 ILE B 8 14.809 -5.414 2.169 1.00 0.00 H new ATOM 1581 N LYS B 9 9.286 -7.471 3.066 1.00 0.00 N ATOM 1582 CA LYS B 9 8.221 -8.457 2.938 1.00 0.00 C ATOM 1583 C LYS B 9 7.758 -8.538 1.490 1.00 0.00 C ATOM 1584 O LYS B 9 7.076 -9.484 1.093 1.00 0.00 O ATOM 1585 CB LYS B 9 7.044 -8.094 3.844 1.00 0.00 C ATOM 1586 CG LYS B 9 7.449 -7.774 5.272 1.00 0.00 C ATOM 1587 CD LYS B 9 7.192 -8.948 6.201 1.00 0.00 C ATOM 1588 CE LYS B 9 8.472 -9.415 6.872 1.00 0.00 C ATOM 1589 NZ LYS B 9 8.748 -10.853 6.604 1.00 0.00 N ATOM 0 H LYS B 9 9.129 -6.613 2.537 1.00 0.00 H new ATOM 0 HA LYS B 9 8.608 -9.429 3.244 1.00 0.00 H new ATOM 0 HB2 LYS B 9 6.524 -7.234 3.422 1.00 0.00 H new ATOM 0 HB3 LYS B 9 6.335 -8.922 3.854 1.00 0.00 H new ATOM 0 HG2 LYS B 9 8.506 -7.511 5.301 1.00 0.00 H new ATOM 0 HG3 LYS B 9 6.894 -6.904 5.622 1.00 0.00 H new ATOM 0 HD2 LYS B 9 6.465 -8.660 6.961 1.00 0.00 H new ATOM 0 HD3 LYS B 9 6.754 -9.771 5.637 1.00 0.00 H new ATOM 0 HE2 LYS B 9 9.308 -8.813 6.517 1.00 0.00 H new ATOM 0 HE3 LYS B 9 8.397 -9.254 7.947 1.00 0.00 H new ATOM 0 HZ1 LYS B 9 9.630 -11.132 7.080 1.00 0.00 H new ATOM 0 HZ2 LYS B 9 7.962 -11.431 6.965 1.00 0.00 H new ATOM 0 HZ3 LYS B 9 8.845 -11.003 5.579 1.00 0.00 H new ATOM 1603 N ASN B 10 8.135 -7.533 0.709 1.00 0.00 N ATOM 1604 CA ASN B 10 7.766 -7.470 -0.699 1.00 0.00 C ATOM 1605 C ASN B 10 8.418 -6.265 -1.366 1.00 0.00 C ATOM 1606 O ASN B 10 8.228 -5.130 -0.933 1.00 0.00 O ATOM 1607 CB ASN B 10 6.248 -7.382 -0.843 1.00 0.00 C ATOM 1608 CG ASN B 10 5.696 -8.424 -1.795 1.00 0.00 C ATOM 1609 OD1 ASN B 10 5.092 -8.091 -2.815 1.00 0.00 O ATOM 1610 ND2 ASN B 10 5.901 -9.693 -1.466 1.00 0.00 N ATOM 0 H ASN B 10 8.699 -6.746 1.030 1.00 0.00 H new ATOM 0 HA ASN B 10 8.119 -8.378 -1.189 1.00 0.00 H new ATOM 0 HB2 ASN B 10 5.785 -7.507 0.136 1.00 0.00 H new ATOM 0 HB3 ASN B 10 5.977 -6.388 -1.199 1.00 0.00 H new ATOM 0 HD21 ASN B 10 5.553 -10.439 -2.068 1.00 0.00 H new ATOM 0 HD22 ASN B 10 6.407 -9.923 -0.611 1.00 0.00 H new ATOM 1617 N ALA B 11 9.190 -6.515 -2.416 1.00 0.00 N ATOM 1618 CA ALA B 11 9.866 -5.438 -3.125 1.00 0.00 C ATOM 1619 C ALA B 11 10.038 -5.755 -4.606 1.00 0.00 C ATOM 1620 O ALA B 11 10.932 -6.508 -4.989 1.00 0.00 O ATOM 1621 CB ALA B 11 11.219 -5.158 -2.487 1.00 0.00 C ATOM 0 H ALA B 11 9.362 -7.447 -2.793 1.00 0.00 H new ATOM 0 HA ALA B 11 9.240 -4.549 -3.049 1.00 0.00 H new ATOM 0 HB1 ALA B 11 11.715 -4.351 -3.026 1.00 0.00 H new ATOM 0 HB2 ALA B 11 11.077 -4.866 -1.446 1.00 0.00 H new ATOM 0 HB3 ALA B 11 11.835 -6.056 -2.531 1.00 0.00 H new ATOM 1627 N ASP B 12 9.187 -5.159 -5.434 1.00 0.00 N ATOM 1628 CA ASP B 12 9.261 -5.360 -6.874 1.00 0.00 C ATOM 1629 C ASP B 12 10.277 -4.402 -7.478 1.00 0.00 C ATOM 1630 O ASP B 12 10.183 -4.023 -8.645 1.00 0.00 O ATOM 1631 CB ASP B 12 7.888 -5.149 -7.517 1.00 0.00 C ATOM 1632 CG ASP B 12 7.225 -6.454 -7.907 1.00 0.00 C ATOM 1633 OD1 ASP B 12 7.626 -7.041 -8.935 1.00 0.00 O ATOM 1634 OD2 ASP B 12 6.305 -6.892 -7.185 1.00 0.00 O ATOM 0 H ASP B 12 8.440 -4.534 -5.132 1.00 0.00 H new ATOM 0 HA ASP B 12 9.578 -6.385 -7.069 1.00 0.00 H new ATOM 0 HB2 ASP B 12 7.243 -4.611 -6.822 1.00 0.00 H new ATOM 0 HB3 ASP B 12 7.997 -4.522 -8.402 1.00 0.00 H new ATOM 1639 N MET B 13 11.246 -4.012 -6.659 1.00 0.00 N ATOM 1640 CA MET B 13 12.292 -3.090 -7.079 1.00 0.00 C ATOM 1641 C MET B 13 13.652 -3.785 -7.076 1.00 0.00 C ATOM 1642 O MET B 13 13.803 -4.874 -6.525 1.00 0.00 O ATOM 1643 CB MET B 13 12.308 -1.872 -6.146 1.00 0.00 C ATOM 1644 CG MET B 13 13.666 -1.200 -6.011 1.00 0.00 C ATOM 1645 SD MET B 13 14.085 -0.832 -4.298 1.00 0.00 S ATOM 1646 CE MET B 13 13.013 0.566 -3.980 1.00 0.00 C ATOM 0 H MET B 13 11.328 -4.324 -5.691 1.00 0.00 H new ATOM 0 HA MET B 13 12.085 -2.757 -8.096 1.00 0.00 H new ATOM 0 HB2 MET B 13 11.589 -1.140 -6.513 1.00 0.00 H new ATOM 0 HB3 MET B 13 11.970 -2.183 -5.157 1.00 0.00 H new ATOM 0 HG2 MET B 13 14.432 -1.847 -6.438 1.00 0.00 H new ATOM 0 HG3 MET B 13 13.670 -0.276 -6.589 1.00 0.00 H new ATOM 0 HE1 MET B 13 12.739 0.582 -2.925 1.00 0.00 H new ATOM 0 HE2 MET B 13 13.534 1.489 -4.233 1.00 0.00 H new ATOM 0 HE3 MET B 13 12.112 0.479 -4.588 1.00 0.00 H new ATOM 1656 N SER B 14 14.639 -3.144 -7.693 1.00 0.00 N ATOM 1657 CA SER B 14 15.985 -3.699 -7.758 1.00 0.00 C ATOM 1658 C SER B 14 16.510 -4.009 -6.359 1.00 0.00 C ATOM 1659 O SER B 14 16.272 -3.256 -5.416 1.00 0.00 O ATOM 1660 CB SER B 14 16.927 -2.723 -8.464 1.00 0.00 C ATOM 1661 OG SER B 14 17.508 -3.316 -9.614 1.00 0.00 O ATOM 0 H SER B 14 14.532 -2.241 -8.155 1.00 0.00 H new ATOM 0 HA SER B 14 15.943 -4.628 -8.327 1.00 0.00 H new ATOM 0 HB2 SER B 14 16.378 -1.826 -8.751 1.00 0.00 H new ATOM 0 HB3 SER B 14 17.713 -2.409 -7.777 1.00 0.00 H new ATOM 0 HG SER B 14 18.105 -2.671 -10.048 1.00 0.00 H new ATOM 1667 N GLU B 15 17.226 -5.123 -6.234 1.00 0.00 N ATOM 1668 CA GLU B 15 17.785 -5.532 -4.950 1.00 0.00 C ATOM 1669 C GLU B 15 18.574 -4.392 -4.313 1.00 0.00 C ATOM 1670 O GLU B 15 18.292 -3.980 -3.187 1.00 0.00 O ATOM 1671 CB GLU B 15 18.689 -6.754 -5.129 1.00 0.00 C ATOM 1672 CG GLU B 15 18.248 -7.676 -6.255 1.00 0.00 C ATOM 1673 CD GLU B 15 17.097 -8.576 -5.851 1.00 0.00 C ATOM 1674 OE1 GLU B 15 15.941 -8.102 -5.861 1.00 0.00 O ATOM 1675 OE2 GLU B 15 17.350 -9.756 -5.530 1.00 0.00 O ATOM 0 H GLU B 15 17.432 -5.758 -7.005 1.00 0.00 H new ATOM 0 HA GLU B 15 16.959 -5.793 -4.289 1.00 0.00 H new ATOM 0 HB2 GLU B 15 19.707 -6.417 -5.324 1.00 0.00 H new ATOM 0 HB3 GLU B 15 18.713 -7.318 -4.197 1.00 0.00 H new ATOM 0 HG2 GLU B 15 17.952 -7.077 -7.116 1.00 0.00 H new ATOM 0 HG3 GLU B 15 19.092 -8.290 -6.569 1.00 0.00 H new ATOM 1682 N GLU B 16 19.562 -3.884 -5.040 1.00 0.00 N ATOM 1683 CA GLU B 16 20.386 -2.790 -4.543 1.00 0.00 C ATOM 1684 C GLU B 16 19.524 -1.586 -4.187 1.00 0.00 C ATOM 1685 O GLU B 16 19.871 -0.797 -3.306 1.00 0.00 O ATOM 1686 CB GLU B 16 21.429 -2.398 -5.588 1.00 0.00 C ATOM 1687 CG GLU B 16 22.827 -2.897 -5.264 1.00 0.00 C ATOM 1688 CD GLU B 16 23.693 -1.829 -4.627 1.00 0.00 C ATOM 1689 OE1 GLU B 16 23.182 -1.093 -3.757 1.00 0.00 O ATOM 1690 OE2 GLU B 16 24.881 -1.728 -4.998 1.00 0.00 O ATOM 0 H GLU B 16 19.811 -4.211 -5.973 1.00 0.00 H new ATOM 0 HA GLU B 16 20.897 -3.128 -3.641 1.00 0.00 H new ATOM 0 HB2 GLU B 16 21.126 -2.793 -6.558 1.00 0.00 H new ATOM 0 HB3 GLU B 16 21.451 -1.312 -5.679 1.00 0.00 H new ATOM 0 HG2 GLU B 16 22.757 -3.752 -4.591 1.00 0.00 H new ATOM 0 HG3 GLU B 16 23.304 -3.249 -6.178 1.00 0.00 H new ATOM 1697 N MET B 17 18.395 -1.453 -4.875 1.00 0.00 N ATOM 1698 CA MET B 17 17.477 -0.347 -4.632 1.00 0.00 C ATOM 1699 C MET B 17 16.688 -0.569 -3.346 1.00 0.00 C ATOM 1700 O MET B 17 16.448 0.367 -2.584 1.00 0.00 O ATOM 1701 CB MET B 17 16.516 -0.189 -5.811 1.00 0.00 C ATOM 1702 CG MET B 17 17.149 0.465 -7.029 1.00 0.00 C ATOM 1703 SD MET B 17 16.378 2.040 -7.451 1.00 0.00 S ATOM 1704 CE MET B 17 16.421 2.875 -5.867 1.00 0.00 C ATOM 0 H MET B 17 18.094 -2.098 -5.606 1.00 0.00 H new ATOM 0 HA MET B 17 18.064 0.565 -4.525 1.00 0.00 H new ATOM 0 HB2 MET B 17 16.135 -1.171 -6.093 1.00 0.00 H new ATOM 0 HB3 MET B 17 15.659 0.406 -5.494 1.00 0.00 H new ATOM 0 HG2 MET B 17 18.211 0.624 -6.841 1.00 0.00 H new ATOM 0 HG3 MET B 17 17.074 -0.212 -7.880 1.00 0.00 H new ATOM 0 HE1 MET B 17 16.320 3.950 -6.019 1.00 0.00 H new ATOM 0 HE2 MET B 17 15.600 2.518 -5.245 1.00 0.00 H new ATOM 0 HE3 MET B 17 17.369 2.666 -5.371 1.00 0.00 H new ATOM 1714 N GLN B 18 16.284 -1.814 -3.113 1.00 0.00 N ATOM 1715 CA GLN B 18 15.518 -2.161 -1.922 1.00 0.00 C ATOM 1716 C GLN B 18 16.357 -1.988 -0.662 1.00 0.00 C ATOM 1717 O GLN B 18 15.829 -1.691 0.412 1.00 0.00 O ATOM 1718 CB GLN B 18 15.006 -3.601 -2.013 1.00 0.00 C ATOM 1719 CG GLN B 18 15.704 -4.428 -3.080 1.00 0.00 C ATOM 1720 CD GLN B 18 14.729 -5.134 -4.001 1.00 0.00 C ATOM 1721 OE1 GLN B 18 15.070 -6.128 -4.643 1.00 0.00 O ATOM 1722 NE2 GLN B 18 13.506 -4.620 -4.074 1.00 0.00 N ATOM 0 H GLN B 18 16.475 -2.600 -3.734 1.00 0.00 H new ATOM 0 HA GLN B 18 14.666 -1.484 -1.865 1.00 0.00 H new ATOM 0 HB2 GLN B 18 15.137 -4.086 -1.046 1.00 0.00 H new ATOM 0 HB3 GLN B 18 13.936 -3.585 -2.220 1.00 0.00 H new ATOM 0 HG2 GLN B 18 16.352 -3.780 -3.671 1.00 0.00 H new ATOM 0 HG3 GLN B 18 16.345 -5.167 -2.600 1.00 0.00 H new ATOM 0 HE21 GLN B 18 13.266 -3.795 -3.524 1.00 0.00 H new ATOM 0 HE22 GLN B 18 12.807 -5.051 -4.680 1.00 0.00 H new ATOM 1731 N GLN B 19 17.667 -2.162 -0.798 1.00 0.00 N ATOM 1732 CA GLN B 19 18.572 -2.015 0.330 1.00 0.00 C ATOM 1733 C GLN B 19 18.803 -0.542 0.616 1.00 0.00 C ATOM 1734 O GLN B 19 18.748 -0.101 1.764 1.00 0.00 O ATOM 1735 CB GLN B 19 19.902 -2.713 0.045 1.00 0.00 C ATOM 1736 CG GLN B 19 19.798 -4.228 0.004 1.00 0.00 C ATOM 1737 CD GLN B 19 20.928 -4.910 0.751 1.00 0.00 C ATOM 1738 OE1 GLN B 19 21.468 -4.366 1.714 1.00 0.00 O ATOM 1739 NE2 GLN B 19 21.290 -6.109 0.310 1.00 0.00 N ATOM 0 H GLN B 19 18.123 -2.405 -1.678 1.00 0.00 H new ATOM 0 HA GLN B 19 18.120 -2.482 1.205 1.00 0.00 H new ATOM 0 HB2 GLN B 19 20.292 -2.358 -0.909 1.00 0.00 H new ATOM 0 HB3 GLN B 19 20.624 -2.427 0.810 1.00 0.00 H new ATOM 0 HG2 GLN B 19 18.845 -4.535 0.435 1.00 0.00 H new ATOM 0 HG3 GLN B 19 19.800 -4.561 -1.034 1.00 0.00 H new ATOM 0 HE21 GLN B 19 20.815 -6.522 -0.492 1.00 0.00 H new ATOM 0 HE22 GLN B 19 22.044 -6.617 0.773 1.00 0.00 H new ATOM 1748 N ASP B 20 19.040 0.219 -0.445 1.00 0.00 N ATOM 1749 CA ASP B 20 19.258 1.647 -0.312 1.00 0.00 C ATOM 1750 C ASP B 20 17.950 2.335 0.056 1.00 0.00 C ATOM 1751 O ASP B 20 17.942 3.380 0.707 1.00 0.00 O ATOM 1752 CB ASP B 20 19.819 2.231 -1.611 1.00 0.00 C ATOM 1753 CG ASP B 20 18.782 2.296 -2.715 1.00 0.00 C ATOM 1754 OD1 ASP B 20 17.657 2.766 -2.445 1.00 0.00 O ATOM 1755 OD2 ASP B 20 19.095 1.876 -3.848 1.00 0.00 O ATOM 0 H ASP B 20 19.085 -0.130 -1.402 1.00 0.00 H new ATOM 0 HA ASP B 20 19.987 1.818 0.480 1.00 0.00 H new ATOM 0 HB2 ASP B 20 20.203 3.233 -1.419 1.00 0.00 H new ATOM 0 HB3 ASP B 20 20.662 1.625 -1.944 1.00 0.00 H new ATOM 1760 N SER B 21 16.842 1.726 -0.357 1.00 0.00 N ATOM 1761 CA SER B 21 15.519 2.261 -0.065 1.00 0.00 C ATOM 1762 C SER B 21 15.221 2.145 1.423 1.00 0.00 C ATOM 1763 O SER B 21 14.724 3.085 2.043 1.00 0.00 O ATOM 1764 CB SER B 21 14.453 1.518 -0.874 1.00 0.00 C ATOM 1765 OG SER B 21 14.373 0.159 -0.487 1.00 0.00 O ATOM 0 H SER B 21 16.836 0.860 -0.896 1.00 0.00 H new ATOM 0 HA SER B 21 15.501 3.314 -0.347 1.00 0.00 H new ATOM 0 HB2 SER B 21 13.484 1.997 -0.731 1.00 0.00 H new ATOM 0 HB3 SER B 21 14.688 1.583 -1.936 1.00 0.00 H new ATOM 0 HG SER B 21 15.163 -0.077 0.043 1.00 0.00 H new ATOM 1771 N VAL B 22 15.540 0.987 1.996 1.00 0.00 N ATOM 1772 CA VAL B 22 15.316 0.757 3.416 1.00 0.00 C ATOM 1773 C VAL B 22 16.147 1.722 4.252 1.00 0.00 C ATOM 1774 O VAL B 22 15.638 2.350 5.180 1.00 0.00 O ATOM 1775 CB VAL B 22 15.662 -0.688 3.819 1.00 0.00 C ATOM 1776 CG1 VAL B 22 15.309 -0.934 5.277 1.00 0.00 C ATOM 1777 CG2 VAL B 22 14.946 -1.679 2.913 1.00 0.00 C ATOM 0 H VAL B 22 15.953 0.198 1.499 1.00 0.00 H new ATOM 0 HA VAL B 22 14.256 0.926 3.605 1.00 0.00 H new ATOM 0 HB VAL B 22 16.736 -0.833 3.701 1.00 0.00 H new ATOM 0 HG11 VAL B 22 15.560 -1.960 5.544 1.00 0.00 H new ATOM 0 HG12 VAL B 22 15.872 -0.246 5.909 1.00 0.00 H new ATOM 0 HG13 VAL B 22 14.241 -0.772 5.425 1.00 0.00 H new ATOM 0 HG21 VAL B 22 15.202 -2.696 3.212 1.00 0.00 H new ATOM 0 HG22 VAL B 22 13.869 -1.536 2.997 1.00 0.00 H new ATOM 0 HG23 VAL B 22 15.254 -1.516 1.880 1.00 0.00 H new ATOM 1787 N GLU B 23 17.425 1.846 3.910 1.00 0.00 N ATOM 1788 CA GLU B 23 18.317 2.747 4.625 1.00 0.00 C ATOM 1789 C GLU B 23 17.784 4.172 4.557 1.00 0.00 C ATOM 1790 O GLU B 23 17.910 4.941 5.510 1.00 0.00 O ATOM 1791 CB GLU B 23 19.728 2.678 4.040 1.00 0.00 C ATOM 1792 CG GLU B 23 20.416 1.343 4.277 1.00 0.00 C ATOM 1793 CD GLU B 23 21.390 1.386 5.437 1.00 0.00 C ATOM 1794 OE1 GLU B 23 20.930 1.427 6.598 1.00 0.00 O ATOM 1795 OE2 GLU B 23 22.614 1.381 5.185 1.00 0.00 O ATOM 0 H GLU B 23 17.864 1.335 3.144 1.00 0.00 H new ATOM 0 HA GLU B 23 18.362 2.438 5.669 1.00 0.00 H new ATOM 0 HB2 GLU B 23 19.678 2.867 2.968 1.00 0.00 H new ATOM 0 HB3 GLU B 23 20.333 3.473 4.476 1.00 0.00 H new ATOM 0 HG2 GLU B 23 19.662 0.579 4.469 1.00 0.00 H new ATOM 0 HG3 GLU B 23 20.947 1.047 3.372 1.00 0.00 H new ATOM 1802 N CYS B 24 17.172 4.512 3.424 1.00 0.00 N ATOM 1803 CA CYS B 24 16.600 5.839 3.237 1.00 0.00 C ATOM 1804 C CYS B 24 15.390 6.018 4.146 1.00 0.00 C ATOM 1805 O CYS B 24 15.173 7.092 4.715 1.00 0.00 O ATOM 1806 CB CYS B 24 16.193 6.043 1.776 1.00 0.00 C ATOM 1807 SG CYS B 24 17.277 7.161 0.856 1.00 0.00 S ATOM 0 H CYS B 24 17.061 3.887 2.625 1.00 0.00 H new ATOM 0 HA CYS B 24 17.353 6.583 3.496 1.00 0.00 H new ATOM 0 HB2 CYS B 24 16.179 5.075 1.276 1.00 0.00 H new ATOM 0 HB3 CYS B 24 15.176 6.433 1.745 1.00 0.00 H new ATOM 0 HG CYS B 24 17.457 8.252 1.540 1.00 0.00 H new ATOM 1813 N ALA B 25 14.622 4.944 4.307 1.00 0.00 N ATOM 1814 CA ALA B 25 13.458 4.969 5.172 1.00 0.00 C ATOM 1815 C ALA B 25 13.932 5.054 6.604 1.00 0.00 C ATOM 1816 O ALA B 25 13.291 5.658 7.464 1.00 0.00 O ATOM 1817 CB ALA B 25 12.601 3.731 4.954 1.00 0.00 C ATOM 0 H ALA B 25 14.789 4.049 3.848 1.00 0.00 H new ATOM 0 HA ALA B 25 12.839 5.836 4.939 1.00 0.00 H new ATOM 0 HB1 ALA B 25 11.733 3.769 5.612 1.00 0.00 H new ATOM 0 HB2 ALA B 25 12.269 3.697 3.917 1.00 0.00 H new ATOM 0 HB3 ALA B 25 13.187 2.839 5.177 1.00 0.00 H new ATOM 1823 N THR B 26 15.095 4.462 6.829 1.00 0.00 N ATOM 1824 CA THR B 26 15.725 4.469 8.130 1.00 0.00 C ATOM 1825 C THR B 26 16.236 5.867 8.439 1.00 0.00 C ATOM 1826 O THR B 26 16.075 6.371 9.551 1.00 0.00 O ATOM 1827 CB THR B 26 16.875 3.468 8.151 1.00 0.00 C ATOM 1828 OG1 THR B 26 16.449 2.203 7.675 1.00 0.00 O ATOM 1829 CG2 THR B 26 17.460 3.266 9.523 1.00 0.00 C ATOM 0 H THR B 26 15.624 3.965 6.112 1.00 0.00 H new ATOM 0 HA THR B 26 14.997 4.182 8.889 1.00 0.00 H new ATOM 0 HB THR B 26 17.642 3.894 7.504 1.00 0.00 H new ATOM 0 HG1 THR B 26 16.411 2.218 6.696 1.00 0.00 H new ATOM 0 HG21 THR B 26 18.273 2.542 9.469 1.00 0.00 H new ATOM 0 HG22 THR B 26 17.843 4.215 9.899 1.00 0.00 H new ATOM 0 HG23 THR B 26 16.688 2.894 10.197 1.00 0.00 H new ATOM 1837 N GLN B 27 16.835 6.500 7.431 1.00 0.00 N ATOM 1838 CA GLN B 27 17.348 7.852 7.584 1.00 0.00 C ATOM 1839 C GLN B 27 16.254 8.744 8.145 1.00 0.00 C ATOM 1840 O GLN B 27 16.472 9.502 9.091 1.00 0.00 O ATOM 1841 CB GLN B 27 17.839 8.399 6.241 1.00 0.00 C ATOM 1842 CG GLN B 27 19.353 8.431 6.113 1.00 0.00 C ATOM 1843 CD GLN B 27 19.834 9.481 5.129 1.00 0.00 C ATOM 1844 OE1 GLN B 27 19.213 10.532 4.973 1.00 0.00 O ATOM 1845 NE2 GLN B 27 20.946 9.201 4.460 1.00 0.00 N ATOM 0 H GLN B 27 16.974 6.096 6.505 1.00 0.00 H new ATOM 0 HA GLN B 27 18.193 7.835 8.273 1.00 0.00 H new ATOM 0 HB2 GLN B 27 17.428 7.788 5.437 1.00 0.00 H new ATOM 0 HB3 GLN B 27 17.450 9.408 6.105 1.00 0.00 H new ATOM 0 HG2 GLN B 27 19.792 8.627 7.091 1.00 0.00 H new ATOM 0 HG3 GLN B 27 19.708 7.451 5.795 1.00 0.00 H new ATOM 0 HE21 GLN B 27 21.429 8.317 4.621 1.00 0.00 H new ATOM 0 HE22 GLN B 27 21.317 9.870 3.785 1.00 0.00 H new ATOM 1854 N ALA B 28 15.065 8.626 7.564 1.00 0.00 N ATOM 1855 CA ALA B 28 13.918 9.401 8.016 1.00 0.00 C ATOM 1856 C ALA B 28 13.347 8.798 9.296 1.00 0.00 C ATOM 1857 O ALA B 28 12.634 9.459 10.049 1.00 0.00 O ATOM 1858 CB ALA B 28 12.857 9.465 6.928 1.00 0.00 C ATOM 0 H ALA B 28 14.872 8.002 6.781 1.00 0.00 H new ATOM 0 HA ALA B 28 14.245 10.419 8.231 1.00 0.00 H new ATOM 0 HB1 ALA B 28 12.007 10.048 7.283 1.00 0.00 H new ATOM 0 HB2 ALA B 28 13.275 9.937 6.039 1.00 0.00 H new ATOM 0 HB3 ALA B 28 12.527 8.456 6.681 1.00 0.00 H new ATOM 1864 N LEU B 29 13.673 7.534 9.536 1.00 0.00 N ATOM 1865 CA LEU B 29 13.206 6.833 10.726 1.00 0.00 C ATOM 1866 C LEU B 29 14.030 7.225 11.948 1.00 0.00 C ATOM 1867 O LEU B 29 13.562 7.129 13.083 1.00 0.00 O ATOM 1868 CB LEU B 29 13.286 5.326 10.515 1.00 0.00 C ATOM 1869 CG LEU B 29 12.126 4.738 9.721 1.00 0.00 C ATOM 1870 CD1 LEU B 29 12.599 3.558 8.897 1.00 0.00 C ATOM 1871 CD2 LEU B 29 10.998 4.325 10.652 1.00 0.00 C ATOM 0 H LEU B 29 14.261 6.972 8.920 1.00 0.00 H new ATOM 0 HA LEU B 29 12.169 7.118 10.900 1.00 0.00 H new ATOM 0 HB2 LEU B 29 14.218 5.093 10.000 1.00 0.00 H new ATOM 0 HB3 LEU B 29 13.329 4.837 11.488 1.00 0.00 H new ATOM 0 HG LEU B 29 11.745 5.502 9.043 1.00 0.00 H new ATOM 0 HD11 LEU B 29 11.760 3.147 8.335 1.00 0.00 H new ATOM 0 HD12 LEU B 29 13.375 3.885 8.205 1.00 0.00 H new ATOM 0 HD13 LEU B 29 13.003 2.791 9.558 1.00 0.00 H new ATOM 0 HD21 LEU B 29 10.178 3.907 10.067 1.00 0.00 H new ATOM 0 HD22 LEU B 29 11.362 3.575 11.354 1.00 0.00 H new ATOM 0 HD23 LEU B 29 10.644 5.196 11.203 1.00 0.00 H new ATOM 1883 N GLU B 30 15.263 7.657 11.704 1.00 0.00 N ATOM 1884 CA GLU B 30 16.166 8.056 12.779 1.00 0.00 C ATOM 1885 C GLU B 30 16.027 9.542 13.092 1.00 0.00 C ATOM 1886 O GLU B 30 16.082 9.950 14.252 1.00 0.00 O ATOM 1887 CB GLU B 30 17.612 7.739 12.395 1.00 0.00 C ATOM 1888 CG GLU B 30 18.041 8.363 11.076 1.00 0.00 C ATOM 1889 CD GLU B 30 19.485 8.827 11.094 1.00 0.00 C ATOM 1890 OE1 GLU B 30 19.832 9.654 11.963 1.00 0.00 O ATOM 1891 OE2 GLU B 30 20.268 8.363 10.239 1.00 0.00 O ATOM 0 H GLU B 30 15.661 7.740 10.769 1.00 0.00 H new ATOM 0 HA GLU B 30 15.897 7.492 13.672 1.00 0.00 H new ATOM 0 HB2 GLU B 30 18.275 8.090 13.186 1.00 0.00 H new ATOM 0 HB3 GLU B 30 17.734 6.658 12.333 1.00 0.00 H new ATOM 0 HG2 GLU B 30 17.906 7.637 10.274 1.00 0.00 H new ATOM 0 HG3 GLU B 30 17.393 9.211 10.851 1.00 0.00 H new ATOM 1898 N LYS B 31 15.846 10.345 12.051 1.00 0.00 N ATOM 1899 CA LYS B 31 15.698 11.786 12.214 1.00 0.00 C ATOM 1900 C LYS B 31 14.298 12.129 12.698 1.00 0.00 C ATOM 1901 O LYS B 31 14.104 13.085 13.450 1.00 0.00 O ATOM 1902 CB LYS B 31 15.975 12.499 10.891 1.00 0.00 C ATOM 1903 CG LYS B 31 17.221 12.001 10.180 1.00 0.00 C ATOM 1904 CD LYS B 31 18.462 12.723 10.671 1.00 0.00 C ATOM 1905 CE LYS B 31 19.468 12.932 9.550 1.00 0.00 C ATOM 1906 NZ LYS B 31 19.022 13.978 8.589 1.00 0.00 N ATOM 0 H LYS B 31 15.798 10.023 11.084 1.00 0.00 H new ATOM 0 HA LYS B 31 16.419 12.121 12.959 1.00 0.00 H new ATOM 0 HB2 LYS B 31 15.116 12.371 10.232 1.00 0.00 H new ATOM 0 HB3 LYS B 31 16.077 13.568 11.079 1.00 0.00 H new ATOM 0 HG2 LYS B 31 17.332 10.929 10.345 1.00 0.00 H new ATOM 0 HG3 LYS B 31 17.113 12.149 9.106 1.00 0.00 H new ATOM 0 HD2 LYS B 31 18.180 13.688 11.092 1.00 0.00 H new ATOM 0 HD3 LYS B 31 18.925 12.148 11.473 1.00 0.00 H new ATOM 0 HE2 LYS B 31 20.431 13.217 9.975 1.00 0.00 H new ATOM 0 HE3 LYS B 31 19.619 11.992 9.019 1.00 0.00 H new ATOM 0 HZ1 LYS B 31 19.825 14.271 7.997 1.00 0.00 H new ATOM 0 HZ2 LYS B 31 18.268 13.595 7.984 1.00 0.00 H new ATOM 0 HZ3 LYS B 31 18.661 14.800 9.114 1.00 0.00 H new ATOM 1920 N TYR B 32 13.324 11.343 12.259 1.00 0.00 N ATOM 1921 CA TYR B 32 11.938 11.561 12.642 1.00 0.00 C ATOM 1922 C TYR B 32 11.212 10.233 12.828 1.00 0.00 C ATOM 1923 O TYR B 32 11.496 9.255 12.135 1.00 0.00 O ATOM 1924 CB TYR B 32 11.224 12.408 11.587 1.00 0.00 C ATOM 1925 CG TYR B 32 12.154 13.025 10.563 1.00 0.00 C ATOM 1926 CD1 TYR B 32 12.894 12.227 9.699 1.00 0.00 C ATOM 1927 CD2 TYR B 32 12.289 14.403 10.458 1.00 0.00 C ATOM 1928 CE1 TYR B 32 13.739 12.783 8.759 1.00 0.00 C ATOM 1929 CE2 TYR B 32 13.133 14.967 9.521 1.00 0.00 C ATOM 1930 CZ TYR B 32 13.855 14.153 8.673 1.00 0.00 C ATOM 1931 OH TYR B 32 14.696 14.713 7.739 1.00 0.00 O ATOM 0 H TYR B 32 13.470 10.548 11.637 1.00 0.00 H new ATOM 0 HA TYR B 32 11.926 12.095 13.592 1.00 0.00 H new ATOM 0 HB2 TYR B 32 10.492 11.787 11.071 1.00 0.00 H new ATOM 0 HB3 TYR B 32 10.671 13.203 12.087 1.00 0.00 H new ATOM 0 HD1 TYR B 32 12.807 11.152 9.764 1.00 0.00 H new ATOM 0 HD2 TYR B 32 11.725 15.044 11.119 1.00 0.00 H new ATOM 0 HE1 TYR B 32 14.306 12.147 8.095 1.00 0.00 H new ATOM 0 HE2 TYR B 32 13.227 16.041 9.453 1.00 0.00 H new ATOM 0 HH TYR B 32 14.660 15.690 7.810 1.00 0.00 H new ATOM 1941 N ASN B 33 10.275 10.204 13.770 1.00 0.00 N ATOM 1942 CA ASN B 33 9.513 8.993 14.049 1.00 0.00 C ATOM 1943 C ASN B 33 8.044 9.171 13.681 1.00 0.00 C ATOM 1944 O ASN B 33 7.163 8.563 14.289 1.00 0.00 O ATOM 1945 CB ASN B 33 9.639 8.613 15.526 1.00 0.00 C ATOM 1946 CG ASN B 33 8.878 9.559 16.434 1.00 0.00 C ATOM 1947 OD1 ASN B 33 7.887 10.166 16.027 1.00 0.00 O ATOM 1948 ND2 ASN B 33 9.337 9.687 17.673 1.00 0.00 N ATOM 0 H ASN B 33 10.026 11.004 14.352 1.00 0.00 H new ATOM 0 HA ASN B 33 9.925 8.190 13.437 1.00 0.00 H new ATOM 0 HB2 ASN B 33 9.268 7.598 15.670 1.00 0.00 H new ATOM 0 HB3 ASN B 33 10.692 8.610 15.809 1.00 0.00 H new ATOM 0 HD21 ASN B 33 8.865 10.308 18.330 1.00 0.00 H new ATOM 0 HD22 ASN B 33 10.162 9.165 17.968 1.00 0.00 H new ATOM 1955 N ILE B 34 7.791 10.003 12.679 1.00 0.00 N ATOM 1956 CA ILE B 34 6.431 10.256 12.221 1.00 0.00 C ATOM 1957 C ILE B 34 6.179 9.575 10.882 1.00 0.00 C ATOM 1958 O ILE B 34 6.673 10.021 9.847 1.00 0.00 O ATOM 1959 CB ILE B 34 6.154 11.765 12.078 1.00 0.00 C ATOM 1960 CG1 ILE B 34 6.703 12.525 13.284 1.00 0.00 C ATOM 1961 CG2 ILE B 34 4.662 12.022 11.920 1.00 0.00 C ATOM 1962 CD1 ILE B 34 6.211 11.988 14.605 1.00 0.00 C ATOM 0 H ILE B 34 8.510 10.514 12.168 1.00 0.00 H new ATOM 0 HA ILE B 34 5.758 9.846 12.974 1.00 0.00 H new ATOM 0 HB ILE B 34 6.661 12.125 11.183 1.00 0.00 H new ATOM 0 HG12 ILE B 34 7.792 12.483 13.266 1.00 0.00 H new ATOM 0 HG13 ILE B 34 6.423 13.575 13.200 1.00 0.00 H new ATOM 0 HG21 ILE B 34 4.486 13.093 11.820 1.00 0.00 H new ATOM 0 HG22 ILE B 34 4.297 11.510 11.030 1.00 0.00 H new ATOM 0 HG23 ILE B 34 4.133 11.647 12.797 1.00 0.00 H new ATOM 0 HD11 ILE B 34 6.640 12.574 15.418 1.00 0.00 H new ATOM 0 HD12 ILE B 34 5.124 12.056 14.643 1.00 0.00 H new ATOM 0 HD13 ILE B 34 6.514 10.946 14.710 1.00 0.00 H new ATOM 1974 N GLU B 35 5.415 8.486 10.910 1.00 0.00 N ATOM 1975 CA GLU B 35 5.102 7.737 9.699 1.00 0.00 C ATOM 1976 C GLU B 35 5.087 8.653 8.478 1.00 0.00 C ATOM 1977 O GLU B 35 5.945 8.548 7.602 1.00 0.00 O ATOM 1978 CB GLU B 35 3.752 7.031 9.846 1.00 0.00 C ATOM 1979 CG GLU B 35 3.610 6.261 11.150 1.00 0.00 C ATOM 1980 CD GLU B 35 2.793 7.010 12.184 1.00 0.00 C ATOM 1981 OE1 GLU B 35 2.658 8.245 12.056 1.00 0.00 O ATOM 1982 OE2 GLU B 35 2.285 6.361 13.124 1.00 0.00 O ATOM 0 H GLU B 35 5.001 8.103 11.760 1.00 0.00 H new ATOM 0 HA GLU B 35 5.880 6.987 9.553 1.00 0.00 H new ATOM 0 HB2 GLU B 35 2.955 7.771 9.782 1.00 0.00 H new ATOM 0 HB3 GLU B 35 3.617 6.344 9.011 1.00 0.00 H new ATOM 0 HG2 GLU B 35 3.140 5.298 10.950 1.00 0.00 H new ATOM 0 HG3 GLU B 35 4.601 6.054 11.555 1.00 0.00 H new ATOM 1989 N LYS B 36 4.113 9.556 8.429 1.00 0.00 N ATOM 1990 CA LYS B 36 3.997 10.493 7.318 1.00 0.00 C ATOM 1991 C LYS B 36 5.314 11.232 7.095 1.00 0.00 C ATOM 1992 O LYS B 36 5.885 11.191 6.005 1.00 0.00 O ATOM 1993 CB LYS B 36 2.869 11.497 7.580 1.00 0.00 C ATOM 1994 CG LYS B 36 2.005 11.144 8.780 1.00 0.00 C ATOM 1995 CD LYS B 36 2.203 12.130 9.918 1.00 0.00 C ATOM 1996 CE LYS B 36 1.369 13.385 9.718 1.00 0.00 C ATOM 1997 NZ LYS B 36 1.748 14.110 8.474 1.00 0.00 N ATOM 0 H LYS B 36 3.394 9.659 9.145 1.00 0.00 H new ATOM 0 HA LYS B 36 3.761 9.925 6.418 1.00 0.00 H new ATOM 0 HB2 LYS B 36 3.302 12.485 7.733 1.00 0.00 H new ATOM 0 HB3 LYS B 36 2.237 11.560 6.694 1.00 0.00 H new ATOM 0 HG2 LYS B 36 0.956 11.134 8.484 1.00 0.00 H new ATOM 0 HG3 LYS B 36 2.249 10.138 9.122 1.00 0.00 H new ATOM 0 HD2 LYS B 36 1.931 11.658 10.862 1.00 0.00 H new ATOM 0 HD3 LYS B 36 3.257 12.399 9.988 1.00 0.00 H new ATOM 0 HE2 LYS B 36 0.313 13.117 9.675 1.00 0.00 H new ATOM 0 HE3 LYS B 36 1.495 14.045 10.576 1.00 0.00 H new ATOM 0 HZ1 LYS B 36 1.282 15.040 8.458 1.00 0.00 H new ATOM 0 HZ2 LYS B 36 2.780 14.239 8.448 1.00 0.00 H new ATOM 0 HZ3 LYS B 36 1.448 13.558 7.645 1.00 0.00 H new ATOM 2011 N ASP B 37 5.794 11.904 8.138 1.00 0.00 N ATOM 2012 CA ASP B 37 7.047 12.647 8.061 1.00 0.00 C ATOM 2013 C ASP B 37 8.127 11.815 7.379 1.00 0.00 C ATOM 2014 O ASP B 37 8.599 12.160 6.294 1.00 0.00 O ATOM 2015 CB ASP B 37 7.510 13.049 9.464 1.00 0.00 C ATOM 2016 CG ASP B 37 8.137 14.430 9.494 1.00 0.00 C ATOM 2017 OD1 ASP B 37 7.749 15.276 8.661 1.00 0.00 O ATOM 2018 OD2 ASP B 37 9.016 14.663 10.350 1.00 0.00 O ATOM 0 H ASP B 37 5.333 11.949 9.047 1.00 0.00 H new ATOM 0 HA ASP B 37 6.875 13.546 7.469 1.00 0.00 H new ATOM 0 HB2 ASP B 37 6.659 13.025 10.145 1.00 0.00 H new ATOM 0 HB3 ASP B 37 8.231 12.318 9.829 1.00 0.00 H new ATOM 2023 N ILE B 38 8.517 10.721 8.023 1.00 0.00 N ATOM 2024 CA ILE B 38 9.542 9.839 7.482 1.00 0.00 C ATOM 2025 C ILE B 38 9.327 9.596 5.992 1.00 0.00 C ATOM 2026 O ILE B 38 10.195 9.895 5.172 1.00 0.00 O ATOM 2027 CB ILE B 38 9.560 8.486 8.218 1.00 0.00 C ATOM 2028 CG1 ILE B 38 9.701 8.701 9.724 1.00 0.00 C ATOM 2029 CG2 ILE B 38 10.690 7.611 7.697 1.00 0.00 C ATOM 2030 CD1 ILE B 38 8.945 7.683 10.550 1.00 0.00 C ATOM 0 H ILE B 38 8.138 10.424 8.922 1.00 0.00 H new ATOM 0 HA ILE B 38 10.501 10.336 7.629 1.00 0.00 H new ATOM 0 HB ILE B 38 8.615 7.977 8.028 1.00 0.00 H new ATOM 0 HG12 ILE B 38 10.757 8.663 9.992 1.00 0.00 H new ATOM 0 HG13 ILE B 38 9.344 9.700 9.976 1.00 0.00 H new ATOM 0 HG21 ILE B 38 10.688 6.659 8.228 1.00 0.00 H new ATOM 0 HG22 ILE B 38 10.550 7.432 6.631 1.00 0.00 H new ATOM 0 HG23 ILE B 38 11.644 8.114 7.858 1.00 0.00 H new ATOM 0 HD11 ILE B 38 9.089 7.895 11.609 1.00 0.00 H new ATOM 0 HD12 ILE B 38 7.883 7.736 10.310 1.00 0.00 H new ATOM 0 HD13 ILE B 38 9.318 6.684 10.326 1.00 0.00 H new ATOM 2042 N ALA B 39 8.164 9.054 5.649 1.00 0.00 N ATOM 2043 CA ALA B 39 7.836 8.774 4.257 1.00 0.00 C ATOM 2044 C ALA B 39 8.185 9.961 3.365 1.00 0.00 C ATOM 2045 O ALA B 39 8.893 9.815 2.369 1.00 0.00 O ATOM 2046 CB ALA B 39 6.362 8.426 4.123 1.00 0.00 C ATOM 0 H ALA B 39 7.434 8.800 6.315 1.00 0.00 H new ATOM 0 HA ALA B 39 8.430 7.920 3.932 1.00 0.00 H new ATOM 0 HB1 ALA B 39 6.131 8.219 3.078 1.00 0.00 H new ATOM 0 HB2 ALA B 39 6.140 7.545 4.725 1.00 0.00 H new ATOM 0 HB3 ALA B 39 5.757 9.264 4.469 1.00 0.00 H new ATOM 2052 N ALA B 40 7.684 11.137 3.733 1.00 0.00 N ATOM 2053 CA ALA B 40 7.942 12.352 2.969 1.00 0.00 C ATOM 2054 C ALA B 40 9.425 12.489 2.647 1.00 0.00 C ATOM 2055 O ALA B 40 9.828 12.423 1.486 1.00 0.00 O ATOM 2056 CB ALA B 40 7.454 13.571 3.739 1.00 0.00 C ATOM 0 H ALA B 40 7.097 11.273 4.556 1.00 0.00 H new ATOM 0 HA ALA B 40 7.395 12.286 2.028 1.00 0.00 H new ATOM 0 HB1 ALA B 40 7.652 14.472 3.158 1.00 0.00 H new ATOM 0 HB2 ALA B 40 6.382 13.483 3.918 1.00 0.00 H new ATOM 0 HB3 ALA B 40 7.977 13.632 4.693 1.00 0.00 H new ATOM 2062 N HIS B 41 10.233 12.679 3.684 1.00 0.00 N ATOM 2063 CA HIS B 41 11.674 12.824 3.518 1.00 0.00 C ATOM 2064 C HIS B 41 12.223 11.762 2.573 1.00 0.00 C ATOM 2065 O HIS B 41 13.047 12.054 1.705 1.00 0.00 O ATOM 2066 CB HIS B 41 12.372 12.728 4.875 1.00 0.00 C ATOM 2067 CG HIS B 41 11.490 13.112 6.023 1.00 0.00 C ATOM 2068 ND1 HIS B 41 11.485 12.443 7.228 1.00 0.00 N ATOM 2069 CD2 HIS B 41 10.577 14.103 6.143 1.00 0.00 C ATOM 2070 CE1 HIS B 41 10.605 13.007 8.037 1.00 0.00 C ATOM 2071 NE2 HIS B 41 10.044 14.015 7.403 1.00 0.00 N ATOM 0 H HIS B 41 9.913 12.736 4.651 1.00 0.00 H new ATOM 0 HA HIS B 41 11.870 13.804 3.083 1.00 0.00 H new ATOM 0 HB2 HIS B 41 12.725 11.707 5.023 1.00 0.00 H new ATOM 0 HB3 HIS B 41 13.251 13.372 4.870 1.00 0.00 H new ATOM 0 HD2 HIS B 41 10.316 14.829 5.387 1.00 0.00 H new ATOM 0 HE1 HIS B 41 10.384 12.694 9.047 1.00 0.00 H new ATOM 0 HE2 HIS B 41 9.328 14.631 7.787 1.00 0.00 H new ATOM 2080 N ILE B 42 11.765 10.526 2.747 1.00 0.00 N ATOM 2081 CA ILE B 42 12.213 9.423 1.908 1.00 0.00 C ATOM 2082 C ILE B 42 12.001 9.737 0.432 1.00 0.00 C ATOM 2083 O ILE B 42 12.958 9.821 -0.337 1.00 0.00 O ATOM 2084 CB ILE B 42 11.478 8.113 2.256 1.00 0.00 C ATOM 2085 CG1 ILE B 42 11.697 7.755 3.727 1.00 0.00 C ATOM 2086 CG2 ILE B 42 11.952 6.985 1.352 1.00 0.00 C ATOM 2087 CD1 ILE B 42 10.959 6.506 4.164 1.00 0.00 C ATOM 0 H ILE B 42 11.085 10.265 3.461 1.00 0.00 H new ATOM 0 HA ILE B 42 13.278 9.292 2.100 1.00 0.00 H new ATOM 0 HB ILE B 42 10.410 8.257 2.094 1.00 0.00 H new ATOM 0 HG12 ILE B 42 12.764 7.617 3.904 1.00 0.00 H new ATOM 0 HG13 ILE B 42 11.377 8.592 4.347 1.00 0.00 H new ATOM 0 HG21 ILE B 42 11.425 6.066 1.609 1.00 0.00 H new ATOM 0 HG22 ILE B 42 11.748 7.242 0.312 1.00 0.00 H new ATOM 0 HG23 ILE B 42 13.024 6.838 1.486 1.00 0.00 H new ATOM 0 HD11 ILE B 42 11.161 6.314 5.218 1.00 0.00 H new ATOM 0 HD12 ILE B 42 9.888 6.647 4.020 1.00 0.00 H new ATOM 0 HD13 ILE B 42 11.296 5.657 3.569 1.00 0.00 H new ATOM 2099 N LYS B 43 10.743 9.913 0.044 1.00 0.00 N ATOM 2100 CA LYS B 43 10.408 10.224 -1.341 1.00 0.00 C ATOM 2101 C LYS B 43 11.247 11.392 -1.851 1.00 0.00 C ATOM 2102 O LYS B 43 11.657 11.415 -3.011 1.00 0.00 O ATOM 2103 CB LYS B 43 8.918 10.556 -1.467 1.00 0.00 C ATOM 2104 CG LYS B 43 8.568 11.316 -2.738 1.00 0.00 C ATOM 2105 CD LYS B 43 7.068 11.337 -2.982 1.00 0.00 C ATOM 2106 CE LYS B 43 6.718 12.169 -4.205 1.00 0.00 C ATOM 2107 NZ LYS B 43 5.918 13.372 -3.847 1.00 0.00 N ATOM 0 H LYS B 43 9.939 9.846 0.668 1.00 0.00 H new ATOM 0 HA LYS B 43 10.628 9.347 -1.949 1.00 0.00 H new ATOM 0 HB2 LYS B 43 8.344 9.630 -1.438 1.00 0.00 H new ATOM 0 HB3 LYS B 43 8.612 11.148 -0.604 1.00 0.00 H new ATOM 0 HG2 LYS B 43 8.940 12.338 -2.666 1.00 0.00 H new ATOM 0 HG3 LYS B 43 9.069 10.854 -3.589 1.00 0.00 H new ATOM 0 HD2 LYS B 43 6.705 10.318 -3.117 1.00 0.00 H new ATOM 0 HD3 LYS B 43 6.561 11.743 -2.107 1.00 0.00 H new ATOM 0 HE2 LYS B 43 7.634 12.479 -4.708 1.00 0.00 H new ATOM 0 HE3 LYS B 43 6.157 11.557 -4.912 1.00 0.00 H new ATOM 0 HZ1 LYS B 43 5.700 13.913 -4.708 1.00 0.00 H new ATOM 0 HZ2 LYS B 43 5.032 13.076 -3.390 1.00 0.00 H new ATOM 0 HZ3 LYS B 43 6.463 13.969 -3.192 1.00 0.00 H new ATOM 2121 N LYS B 44 11.493 12.361 -0.977 1.00 0.00 N ATOM 2122 CA LYS B 44 12.278 13.533 -1.339 1.00 0.00 C ATOM 2123 C LYS B 44 13.713 13.148 -1.681 1.00 0.00 C ATOM 2124 O LYS B 44 14.263 13.588 -2.691 1.00 0.00 O ATOM 2125 CB LYS B 44 12.269 14.551 -0.197 1.00 0.00 C ATOM 2126 CG LYS B 44 10.891 14.781 0.403 1.00 0.00 C ATOM 2127 CD LYS B 44 10.318 16.126 -0.014 1.00 0.00 C ATOM 2128 CE LYS B 44 10.807 17.246 0.890 1.00 0.00 C ATOM 2129 NZ LYS B 44 12.293 17.346 0.899 1.00 0.00 N ATOM 0 H LYS B 44 11.160 12.357 -0.013 1.00 0.00 H new ATOM 0 HA LYS B 44 11.824 13.982 -2.222 1.00 0.00 H new ATOM 0 HB2 LYS B 44 12.945 14.211 0.587 1.00 0.00 H new ATOM 0 HB3 LYS B 44 12.659 15.500 -0.565 1.00 0.00 H new ATOM 0 HG2 LYS B 44 10.218 13.984 0.087 1.00 0.00 H new ATOM 0 HG3 LYS B 44 10.954 14.733 1.490 1.00 0.00 H new ATOM 0 HD2 LYS B 44 10.601 16.339 -1.045 1.00 0.00 H new ATOM 0 HD3 LYS B 44 9.229 16.083 0.015 1.00 0.00 H new ATOM 0 HE2 LYS B 44 10.382 18.193 0.557 1.00 0.00 H new ATOM 0 HE3 LYS B 44 10.449 17.075 1.905 1.00 0.00 H new ATOM 0 HZ1 LYS B 44 12.580 18.201 1.416 1.00 0.00 H new ATOM 0 HZ2 LYS B 44 12.695 16.508 1.366 1.00 0.00 H new ATOM 0 HZ3 LYS B 44 12.643 17.399 -0.079 1.00 0.00 H new ATOM 2143 N GLU B 45 14.313 12.326 -0.830 1.00 0.00 N ATOM 2144 CA GLU B 45 15.686 11.883 -1.036 1.00 0.00 C ATOM 2145 C GLU B 45 15.770 10.869 -2.172 1.00 0.00 C ATOM 2146 O GLU B 45 16.793 10.765 -2.848 1.00 0.00 O ATOM 2147 CB GLU B 45 16.242 11.271 0.251 1.00 0.00 C ATOM 2148 CG GLU B 45 17.691 10.829 0.138 1.00 0.00 C ATOM 2149 CD GLU B 45 18.385 10.750 1.484 1.00 0.00 C ATOM 2150 OE1 GLU B 45 17.732 10.337 2.465 1.00 0.00 O ATOM 2151 OE2 GLU B 45 19.581 11.103 1.557 1.00 0.00 O ATOM 0 H GLU B 45 13.871 11.952 0.010 1.00 0.00 H new ATOM 0 HA GLU B 45 16.284 12.753 -1.308 1.00 0.00 H new ATOM 0 HB2 GLU B 45 16.155 12.000 1.057 1.00 0.00 H new ATOM 0 HB3 GLU B 45 15.630 10.413 0.529 1.00 0.00 H new ATOM 0 HG2 GLU B 45 17.732 9.853 -0.345 1.00 0.00 H new ATOM 0 HG3 GLU B 45 18.230 11.526 -0.504 1.00 0.00 H new ATOM 2158 N PHE B 46 14.690 10.123 -2.377 1.00 0.00 N ATOM 2159 CA PHE B 46 14.649 9.118 -3.433 1.00 0.00 C ATOM 2160 C PHE B 46 14.433 9.769 -4.795 1.00 0.00 C ATOM 2161 O PHE B 46 14.990 9.327 -5.800 1.00 0.00 O ATOM 2162 CB PHE B 46 13.545 8.099 -3.156 1.00 0.00 C ATOM 2163 CG PHE B 46 14.073 6.732 -2.833 1.00 0.00 C ATOM 2164 CD1 PHE B 46 14.586 5.920 -3.833 1.00 0.00 C ATOM 2165 CD2 PHE B 46 14.063 6.261 -1.531 1.00 0.00 C ATOM 2166 CE1 PHE B 46 15.078 4.664 -3.538 1.00 0.00 C ATOM 2167 CE2 PHE B 46 14.555 5.006 -1.229 1.00 0.00 C ATOM 2168 CZ PHE B 46 15.062 4.205 -2.234 1.00 0.00 C ATOM 0 H PHE B 46 13.834 10.195 -1.828 1.00 0.00 H new ATOM 0 HA PHE B 46 15.609 8.602 -3.447 1.00 0.00 H new ATOM 0 HB2 PHE B 46 12.934 8.451 -2.325 1.00 0.00 H new ATOM 0 HB3 PHE B 46 12.892 8.034 -4.027 1.00 0.00 H new ATOM 0 HD1 PHE B 46 14.601 6.274 -4.853 1.00 0.00 H new ATOM 0 HD2 PHE B 46 13.666 6.882 -0.742 1.00 0.00 H new ATOM 0 HE1 PHE B 46 15.475 4.041 -4.325 1.00 0.00 H new ATOM 0 HE2 PHE B 46 14.543 4.652 -0.209 1.00 0.00 H new ATOM 0 HZ PHE B 46 15.445 3.222 -2.001 1.00 0.00 H new ATOM 2178 N ASP B 47 13.632 10.826 -4.819 1.00 0.00 N ATOM 2179 CA ASP B 47 13.356 11.543 -6.057 1.00 0.00 C ATOM 2180 C ASP B 47 14.557 12.391 -6.453 1.00 0.00 C ATOM 2181 O ASP B 47 14.810 12.622 -7.635 1.00 0.00 O ATOM 2182 CB ASP B 47 12.120 12.429 -5.895 1.00 0.00 C ATOM 2183 CG ASP B 47 10.898 11.644 -5.460 1.00 0.00 C ATOM 2184 OD1 ASP B 47 11.060 10.480 -5.040 1.00 0.00 O ATOM 2185 OD2 ASP B 47 9.780 12.194 -5.537 1.00 0.00 O ATOM 0 H ASP B 47 13.163 11.206 -3.997 1.00 0.00 H new ATOM 0 HA ASP B 47 13.164 10.814 -6.844 1.00 0.00 H new ATOM 0 HB2 ASP B 47 12.328 13.208 -5.161 1.00 0.00 H new ATOM 0 HB3 ASP B 47 11.909 12.930 -6.840 1.00 0.00 H new ATOM 2190 N LYS B 48 15.297 12.849 -5.450 1.00 0.00 N ATOM 2191 CA LYS B 48 16.474 13.670 -5.682 1.00 0.00 C ATOM 2192 C LYS B 48 17.710 12.796 -5.900 1.00 0.00 C ATOM 2193 O LYS B 48 18.545 13.085 -6.757 1.00 0.00 O ATOM 2194 CB LYS B 48 16.678 14.633 -4.497 1.00 0.00 C ATOM 2195 CG LYS B 48 18.088 14.648 -3.917 1.00 0.00 C ATOM 2196 CD LYS B 48 19.050 15.413 -4.813 1.00 0.00 C ATOM 2197 CE LYS B 48 18.792 16.908 -4.753 1.00 0.00 C ATOM 2198 NZ LYS B 48 19.413 17.625 -5.900 1.00 0.00 N ATOM 0 H LYS B 48 15.100 12.664 -4.466 1.00 0.00 H new ATOM 0 HA LYS B 48 16.323 14.258 -6.587 1.00 0.00 H new ATOM 0 HB2 LYS B 48 16.423 15.642 -4.820 1.00 0.00 H new ATOM 0 HB3 LYS B 48 15.978 14.365 -3.705 1.00 0.00 H new ATOM 0 HG2 LYS B 48 18.071 15.104 -2.927 1.00 0.00 H new ATOM 0 HG3 LYS B 48 18.442 13.625 -3.791 1.00 0.00 H new ATOM 0 HD2 LYS B 48 20.076 15.207 -4.508 1.00 0.00 H new ATOM 0 HD3 LYS B 48 18.947 15.065 -5.841 1.00 0.00 H new ATOM 0 HE2 LYS B 48 17.717 17.091 -4.749 1.00 0.00 H new ATOM 0 HE3 LYS B 48 19.187 17.307 -3.819 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 19.214 18.643 -5.822 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 20.442 17.472 -5.889 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 19.018 17.262 -6.791 1.00 0.00 H new ATOM 2212 N LYS B 49 17.819 11.733 -5.112 1.00 0.00 N ATOM 2213 CA LYS B 49 18.953 10.823 -5.209 1.00 0.00 C ATOM 2214 C LYS B 49 18.819 9.903 -6.418 1.00 0.00 C ATOM 2215 O LYS B 49 19.817 9.435 -6.965 1.00 0.00 O ATOM 2216 CB LYS B 49 19.073 9.992 -3.930 1.00 0.00 C ATOM 2217 CG LYS B 49 20.509 9.683 -3.539 1.00 0.00 C ATOM 2218 CD LYS B 49 20.623 8.322 -2.873 1.00 0.00 C ATOM 2219 CE LYS B 49 20.259 8.391 -1.398 1.00 0.00 C ATOM 2220 NZ LYS B 49 21.270 7.708 -0.545 1.00 0.00 N ATOM 0 H LYS B 49 17.135 11.480 -4.398 1.00 0.00 H new ATOM 0 HA LYS B 49 19.856 11.421 -5.335 1.00 0.00 H new ATOM 0 HB2 LYS B 49 18.589 10.527 -3.112 1.00 0.00 H new ATOM 0 HB3 LYS B 49 18.532 9.055 -4.063 1.00 0.00 H new ATOM 0 HG2 LYS B 49 21.143 9.710 -4.426 1.00 0.00 H new ATOM 0 HG3 LYS B 49 20.877 10.453 -2.861 1.00 0.00 H new ATOM 0 HD2 LYS B 49 19.967 7.613 -3.378 1.00 0.00 H new ATOM 0 HD3 LYS B 49 21.641 7.947 -2.980 1.00 0.00 H new ATOM 0 HE2 LYS B 49 20.172 9.434 -1.094 1.00 0.00 H new ATOM 0 HE3 LYS B 49 19.283 7.931 -1.243 1.00 0.00 H new ATOM 0 HZ1 LYS B 49 20.986 7.777 0.453 1.00 0.00 H new ATOM 0 HZ2 LYS B 49 21.335 6.707 -0.818 1.00 0.00 H new ATOM 0 HZ3 LYS B 49 22.197 8.163 -0.673 1.00 0.00 H new ATOM 2234 N TYR B 50 17.582 9.642 -6.829 1.00 0.00 N ATOM 2235 CA TYR B 50 17.331 8.772 -7.971 1.00 0.00 C ATOM 2236 C TYR B 50 16.558 9.502 -9.066 1.00 0.00 C ATOM 2237 O TYR B 50 17.091 9.765 -10.144 1.00 0.00 O ATOM 2238 CB TYR B 50 16.550 7.530 -7.533 1.00 0.00 C ATOM 2239 CG TYR B 50 17.137 6.834 -6.324 1.00 0.00 C ATOM 2240 CD1 TYR B 50 16.945 7.341 -5.044 1.00 0.00 C ATOM 2241 CD2 TYR B 50 17.879 5.669 -6.464 1.00 0.00 C ATOM 2242 CE1 TYR B 50 17.476 6.706 -3.940 1.00 0.00 C ATOM 2243 CE2 TYR B 50 18.414 5.027 -5.363 1.00 0.00 C ATOM 2244 CZ TYR B 50 18.210 5.550 -4.103 1.00 0.00 C ATOM 2245 OH TYR B 50 18.740 4.915 -3.004 1.00 0.00 O ATOM 0 H TYR B 50 16.742 10.019 -6.390 1.00 0.00 H new ATOM 0 HA TYR B 50 18.298 8.470 -8.374 1.00 0.00 H new ATOM 0 HB2 TYR B 50 15.522 7.818 -7.311 1.00 0.00 H new ATOM 0 HB3 TYR B 50 16.511 6.825 -8.363 1.00 0.00 H new ATOM 0 HD1 TYR B 50 16.371 8.246 -4.912 1.00 0.00 H new ATOM 0 HD2 TYR B 50 18.041 5.258 -7.449 1.00 0.00 H new ATOM 0 HE1 TYR B 50 17.317 7.113 -2.952 1.00 0.00 H new ATOM 0 HE2 TYR B 50 18.988 4.121 -5.489 1.00 0.00 H new ATOM 0 HH TYR B 50 18.019 4.495 -2.489 1.00 0.00 H new ATOM 2255 N ASN B 51 15.297 9.815 -8.774 1.00 0.00 N ATOM 2256 CA ASN B 51 14.422 10.504 -9.716 1.00 0.00 C ATOM 2257 C ASN B 51 12.964 10.200 -9.381 1.00 0.00 C ATOM 2258 O ASN B 51 12.547 9.041 -9.394 1.00 0.00 O ATOM 2259 CB ASN B 51 14.718 10.076 -11.155 1.00 0.00 C ATOM 2260 CG ASN B 51 13.495 10.161 -12.047 1.00 0.00 C ATOM 2261 OD1 ASN B 51 13.064 11.250 -12.427 1.00 0.00 O ATOM 2262 ND2 ASN B 51 12.929 9.009 -12.386 1.00 0.00 N ATOM 0 H ASN B 51 14.856 9.598 -7.880 1.00 0.00 H new ATOM 0 HA ASN B 51 14.604 11.575 -9.631 1.00 0.00 H new ATOM 0 HB2 ASN B 51 15.507 10.707 -11.564 1.00 0.00 H new ATOM 0 HB3 ASN B 51 15.095 9.053 -11.157 1.00 0.00 H new ATOM 0 HD21 ASN B 51 12.103 9.003 -12.985 1.00 0.00 H new ATOM 0 HD22 ASN B 51 13.320 8.130 -12.048 1.00 0.00 H new ATOM 2269 N PRO B 52 12.167 11.231 -9.064 1.00 0.00 N ATOM 2270 CA PRO B 52 10.758 11.053 -8.714 1.00 0.00 C ATOM 2271 C PRO B 52 9.954 10.374 -9.829 1.00 0.00 C ATOM 2272 O PRO B 52 10.444 10.233 -10.950 1.00 0.00 O ATOM 2273 CB PRO B 52 10.251 12.480 -8.475 1.00 0.00 C ATOM 2274 CG PRO B 52 11.261 13.370 -9.115 1.00 0.00 C ATOM 2275 CD PRO B 52 12.571 12.645 -9.013 1.00 0.00 C ATOM 0 HA PRO B 52 10.642 10.402 -7.848 1.00 0.00 H new ATOM 0 HB2 PRO B 52 9.264 12.625 -8.915 1.00 0.00 H new ATOM 0 HB3 PRO B 52 10.160 12.691 -7.410 1.00 0.00 H new ATOM 0 HG2 PRO B 52 11.004 13.568 -10.156 1.00 0.00 H new ATOM 0 HG3 PRO B 52 11.308 14.335 -8.609 1.00 0.00 H new ATOM 0 HD2 PRO B 52 13.241 12.904 -9.833 1.00 0.00 H new ATOM 0 HD3 PRO B 52 13.094 12.883 -8.087 1.00 0.00 H new ATOM 2283 N THR B 53 8.718 9.947 -9.523 1.00 0.00 N ATOM 2284 CA THR B 53 8.133 10.113 -8.192 1.00 0.00 C ATOM 2285 C THR B 53 8.075 8.787 -7.446 1.00 0.00 C ATOM 2286 O THR B 53 7.654 7.769 -7.995 1.00 0.00 O ATOM 2287 CB THR B 53 6.735 10.720 -8.295 1.00 0.00 C ATOM 2288 OG1 THR B 53 6.239 11.057 -7.012 1.00 0.00 O ATOM 2289 CG2 THR B 53 5.734 9.796 -8.946 1.00 0.00 C ATOM 0 H THR B 53 8.103 9.480 -10.190 1.00 0.00 H new ATOM 0 HA THR B 53 8.773 10.792 -7.629 1.00 0.00 H new ATOM 0 HB THR B 53 6.848 11.607 -8.918 1.00 0.00 H new ATOM 0 HG1 THR B 53 6.178 12.032 -6.931 1.00 0.00 H new ATOM 0 HG21 THR B 53 4.761 10.286 -8.989 1.00 0.00 H new ATOM 0 HG22 THR B 53 6.064 9.556 -9.957 1.00 0.00 H new ATOM 0 HG23 THR B 53 5.653 8.879 -8.363 1.00 0.00 H new ATOM 2297 N TRP B 54 8.507 8.809 -6.191 1.00 0.00 N ATOM 2298 CA TRP B 54 8.511 7.610 -5.363 1.00 0.00 C ATOM 2299 C TRP B 54 7.367 7.626 -4.354 1.00 0.00 C ATOM 2300 O TRP B 54 7.384 8.394 -3.392 1.00 0.00 O ATOM 2301 CB TRP B 54 9.841 7.479 -4.619 1.00 0.00 C ATOM 2302 CG TRP B 54 11.021 7.324 -5.525 1.00 0.00 C ATOM 2303 CD1 TRP B 54 11.529 8.263 -6.375 1.00 0.00 C ATOM 2304 CD2 TRP B 54 11.842 6.161 -5.671 1.00 0.00 C ATOM 2305 NE1 TRP B 54 12.616 7.756 -7.041 1.00 0.00 N ATOM 2306 CE2 TRP B 54 12.830 6.465 -6.626 1.00 0.00 C ATOM 2307 CE3 TRP B 54 11.837 4.893 -5.086 1.00 0.00 C ATOM 2308 CZ2 TRP B 54 13.804 5.545 -7.009 1.00 0.00 C ATOM 2309 CZ3 TRP B 54 12.803 3.980 -5.465 1.00 0.00 C ATOM 2310 CH2 TRP B 54 13.775 4.310 -6.418 1.00 0.00 C ATOM 0 H TRP B 54 8.859 9.645 -5.724 1.00 0.00 H new ATOM 0 HA TRP B 54 8.377 6.755 -6.026 1.00 0.00 H new ATOM 0 HB2 TRP B 54 9.987 8.360 -3.994 1.00 0.00 H new ATOM 0 HB3 TRP B 54 9.791 6.619 -3.951 1.00 0.00 H new ATOM 0 HD1 TRP B 54 11.133 9.259 -6.504 1.00 0.00 H new ATOM 0 HE1 TRP B 54 13.174 8.257 -7.732 1.00 0.00 H new ATOM 0 HE3 TRP B 54 11.091 4.630 -4.350 1.00 0.00 H new ATOM 0 HZ2 TRP B 54 14.554 5.797 -7.744 1.00 0.00 H new ATOM 0 HZ3 TRP B 54 12.808 2.996 -5.019 1.00 0.00 H new ATOM 0 HH2 TRP B 54 14.517 3.575 -6.692 1.00 0.00 H new ATOM 2321 N HIS B 55 6.389 6.754 -4.564 1.00 0.00 N ATOM 2322 CA HIS B 55 5.254 6.648 -3.657 1.00 0.00 C ATOM 2323 C HIS B 55 5.637 5.773 -2.472 1.00 0.00 C ATOM 2324 O HIS B 55 5.588 4.546 -2.554 1.00 0.00 O ATOM 2325 CB HIS B 55 4.043 6.059 -4.384 1.00 0.00 C ATOM 2326 CG HIS B 55 3.756 6.721 -5.696 1.00 0.00 C ATOM 2327 ND1 HIS B 55 2.526 6.660 -6.317 1.00 0.00 N ATOM 2328 CD2 HIS B 55 4.548 7.463 -6.506 1.00 0.00 C ATOM 2329 CE1 HIS B 55 2.575 7.335 -7.452 1.00 0.00 C ATOM 2330 NE2 HIS B 55 3.790 7.832 -7.589 1.00 0.00 N ATOM 0 H HIS B 55 6.359 6.110 -5.354 1.00 0.00 H new ATOM 0 HA HIS B 55 4.986 7.642 -3.299 1.00 0.00 H new ATOM 0 HB2 HIS B 55 4.211 4.995 -4.552 1.00 0.00 H new ATOM 0 HB3 HIS B 55 3.166 6.146 -3.742 1.00 0.00 H new ATOM 0 HD1 HIS B 55 1.707 6.171 -5.957 1.00 0.00 H new ATOM 0 HD2 HIS B 55 5.583 7.717 -6.332 1.00 0.00 H new ATOM 0 HE1 HIS B 55 1.759 7.459 -8.149 1.00 0.00 H new ATOM 2339 N CYS B 56 6.057 6.408 -1.383 1.00 0.00 N ATOM 2340 CA CYS B 56 6.491 5.672 -0.202 1.00 0.00 C ATOM 2341 C CYS B 56 5.525 5.818 0.969 1.00 0.00 C ATOM 2342 O CYS B 56 5.096 6.920 1.310 1.00 0.00 O ATOM 2343 CB CYS B 56 7.883 6.143 0.223 1.00 0.00 C ATOM 2344 SG CYS B 56 7.992 7.919 0.549 1.00 0.00 S ATOM 0 H CYS B 56 6.106 7.423 -1.294 1.00 0.00 H new ATOM 0 HA CYS B 56 6.516 4.617 -0.475 1.00 0.00 H new ATOM 0 HB2 CYS B 56 8.180 5.601 1.120 1.00 0.00 H new ATOM 0 HB3 CYS B 56 8.597 5.883 -0.558 1.00 0.00 H new ATOM 0 HG CYS B 56 8.413 8.112 1.764 1.00 0.00 H new ATOM 2350 N ILE B 57 5.218 4.687 1.597 1.00 0.00 N ATOM 2351 CA ILE B 57 4.335 4.656 2.757 1.00 0.00 C ATOM 2352 C ILE B 57 5.038 3.968 3.919 1.00 0.00 C ATOM 2353 O ILE B 57 5.358 2.782 3.847 1.00 0.00 O ATOM 2354 CB ILE B 57 3.011 3.923 2.461 1.00 0.00 C ATOM 2355 CG1 ILE B 57 2.396 4.423 1.150 1.00 0.00 C ATOM 2356 CG2 ILE B 57 2.037 4.109 3.619 1.00 0.00 C ATOM 2357 CD1 ILE B 57 2.309 5.931 1.052 1.00 0.00 C ATOM 0 H ILE B 57 5.572 3.772 1.318 1.00 0.00 H new ATOM 0 HA ILE B 57 4.097 5.689 3.013 1.00 0.00 H new ATOM 0 HB ILE B 57 3.220 2.859 2.351 1.00 0.00 H new ATOM 0 HG12 ILE B 57 2.988 4.048 0.315 1.00 0.00 H new ATOM 0 HG13 ILE B 57 1.396 4.003 1.045 1.00 0.00 H new ATOM 0 HG21 ILE B 57 1.106 3.587 3.399 1.00 0.00 H new ATOM 0 HG22 ILE B 57 2.474 3.702 4.531 1.00 0.00 H new ATOM 0 HG23 ILE B 57 1.834 5.171 3.757 1.00 0.00 H new ATOM 0 HD11 ILE B 57 1.863 6.208 0.097 1.00 0.00 H new ATOM 0 HD12 ILE B 57 1.692 6.313 1.865 1.00 0.00 H new ATOM 0 HD13 ILE B 57 3.309 6.359 1.124 1.00 0.00 H new ATOM 2369 N VAL B 58 5.293 4.719 4.983 1.00 0.00 N ATOM 2370 CA VAL B 58 5.978 4.173 6.147 1.00 0.00 C ATOM 2371 C VAL B 58 5.093 4.201 7.385 1.00 0.00 C ATOM 2372 O VAL B 58 4.671 5.264 7.839 1.00 0.00 O ATOM 2373 CB VAL B 58 7.279 4.939 6.439 1.00 0.00 C ATOM 2374 CG1 VAL B 58 7.027 6.438 6.441 1.00 0.00 C ATOM 2375 CG2 VAL B 58 7.882 4.489 7.762 1.00 0.00 C ATOM 0 H VAL B 58 5.037 5.703 5.064 1.00 0.00 H new ATOM 0 HA VAL B 58 6.217 3.136 5.909 1.00 0.00 H new ATOM 0 HB VAL B 58 7.995 4.715 5.648 1.00 0.00 H new ATOM 0 HG11 VAL B 58 7.959 6.963 6.649 1.00 0.00 H new ATOM 0 HG12 VAL B 58 6.648 6.745 5.466 1.00 0.00 H new ATOM 0 HG13 VAL B 58 6.293 6.683 7.209 1.00 0.00 H new ATOM 0 HG21 VAL B 58 8.802 5.043 7.950 1.00 0.00 H new ATOM 0 HG22 VAL B 58 7.173 4.678 8.568 1.00 0.00 H new ATOM 0 HG23 VAL B 58 8.104 3.423 7.717 1.00 0.00 H new ATOM 2385 N GLY B 59 4.827 3.021 7.932 1.00 0.00 N ATOM 2386 CA GLY B 59 4.006 2.919 9.120 1.00 0.00 C ATOM 2387 C GLY B 59 4.577 1.932 10.115 1.00 0.00 C ATOM 2388 O GLY B 59 5.738 2.040 10.507 1.00 0.00 O ATOM 0 H GLY B 59 5.168 2.130 7.571 1.00 0.00 H new ATOM 0 HA2 GLY B 59 3.921 3.900 9.589 1.00 0.00 H new ATOM 0 HA3 GLY B 59 2.998 2.611 8.840 1.00 0.00 H new ATOM 2392 N ARG B 60 3.763 0.970 10.526 1.00 0.00 N ATOM 2393 CA ARG B 60 4.203 -0.031 11.481 1.00 0.00 C ATOM 2394 C ARG B 60 3.246 -1.220 11.525 1.00 0.00 C ATOM 2395 O ARG B 60 3.515 -2.218 12.193 1.00 0.00 O ATOM 2396 CB ARG B 60 4.321 0.599 12.859 1.00 0.00 C ATOM 2397 CG ARG B 60 3.251 1.638 13.148 1.00 0.00 C ATOM 2398 CD ARG B 60 3.802 2.788 13.976 1.00 0.00 C ATOM 2399 NE ARG B 60 4.068 2.391 15.357 1.00 0.00 N ATOM 2400 CZ ARG B 60 5.074 2.873 16.080 1.00 0.00 C ATOM 2401 NH1 ARG B 60 5.900 3.768 15.557 1.00 0.00 N ATOM 2402 NH2 ARG B 60 5.255 2.459 17.326 1.00 0.00 N ATOM 0 H ARG B 60 2.798 0.863 10.213 1.00 0.00 H new ATOM 0 HA ARG B 60 5.177 -0.403 11.164 1.00 0.00 H new ATOM 0 HB2 ARG B 60 4.266 -0.186 13.614 1.00 0.00 H new ATOM 0 HB3 ARG B 60 5.302 1.064 12.953 1.00 0.00 H new ATOM 0 HG2 ARG B 60 2.852 2.022 12.209 1.00 0.00 H new ATOM 0 HG3 ARG B 60 2.422 1.170 13.679 1.00 0.00 H new ATOM 0 HD2 ARG B 60 4.722 3.154 13.521 1.00 0.00 H new ATOM 0 HD3 ARG B 60 3.091 3.614 13.967 1.00 0.00 H new ATOM 0 HE ARG B 60 3.448 1.707 15.790 1.00 0.00 H new ATOM 0 HH11 ARG B 60 5.764 4.088 14.598 1.00 0.00 H new ATOM 0 HH12 ARG B 60 6.671 4.137 16.113 1.00 0.00 H new ATOM 0 HH21 ARG B 60 4.622 1.770 17.731 1.00 0.00 H new ATOM 0 HH22 ARG B 60 6.027 2.830 17.879 1.00 0.00 H new ATOM 2416 N ASN B 61 2.131 -1.110 10.810 1.00 0.00 N ATOM 2417 CA ASN B 61 1.143 -2.183 10.772 1.00 0.00 C ATOM 2418 C ASN B 61 -0.047 -1.802 9.898 1.00 0.00 C ATOM 2419 O ASN B 61 -1.190 -2.139 10.206 1.00 0.00 O ATOM 2420 CB ASN B 61 0.662 -2.518 12.185 1.00 0.00 C ATOM 2421 CG ASN B 61 -0.210 -3.757 12.218 1.00 0.00 C ATOM 2422 OD1 ASN B 61 -1.372 -3.702 12.625 1.00 0.00 O ATOM 2423 ND2 ASN B 61 0.345 -4.883 11.787 1.00 0.00 N ATOM 0 H ASN B 61 1.889 -0.292 10.251 1.00 0.00 H new ATOM 0 HA ASN B 61 1.622 -3.062 10.340 1.00 0.00 H new ATOM 0 HB2 ASN B 61 1.525 -2.666 12.834 1.00 0.00 H new ATOM 0 HB3 ASN B 61 0.103 -1.672 12.586 1.00 0.00 H new ATOM 0 HD21 ASN B 61 -0.194 -5.749 11.784 1.00 0.00 H new ATOM 0 HD22 ASN B 61 1.311 -4.882 11.459 1.00 0.00 H new ATOM 2430 N PHE B 62 0.230 -1.099 8.806 1.00 0.00 N ATOM 2431 CA PHE B 62 -0.815 -0.673 7.885 1.00 0.00 C ATOM 2432 C PHE B 62 -1.072 -1.737 6.822 1.00 0.00 C ATOM 2433 O PHE B 62 -0.428 -2.786 6.809 1.00 0.00 O ATOM 2434 CB PHE B 62 -0.423 0.645 7.216 1.00 0.00 C ATOM 2435 CG PHE B 62 0.856 0.556 6.434 1.00 0.00 C ATOM 2436 CD1 PHE B 62 2.054 0.281 7.072 1.00 0.00 C ATOM 2437 CD2 PHE B 62 0.859 0.745 5.061 1.00 0.00 C ATOM 2438 CE1 PHE B 62 3.232 0.196 6.355 1.00 0.00 C ATOM 2439 CE2 PHE B 62 2.034 0.660 4.339 1.00 0.00 C ATOM 2440 CZ PHE B 62 3.222 0.385 4.988 1.00 0.00 C ATOM 0 H PHE B 62 1.171 -0.812 8.537 1.00 0.00 H new ATOM 0 HA PHE B 62 -1.732 -0.527 8.456 1.00 0.00 H new ATOM 0 HB2 PHE B 62 -1.227 0.960 6.550 1.00 0.00 H new ATOM 0 HB3 PHE B 62 -0.321 1.416 7.980 1.00 0.00 H new ATOM 0 HD1 PHE B 62 2.068 0.131 8.141 1.00 0.00 H new ATOM 0 HD2 PHE B 62 -0.067 0.961 4.550 1.00 0.00 H new ATOM 0 HE1 PHE B 62 4.160 -0.018 6.864 1.00 0.00 H new ATOM 0 HE2 PHE B 62 2.024 0.808 3.269 1.00 0.00 H new ATOM 0 HZ PHE B 62 4.142 0.318 4.426 1.00 0.00 H new ATOM 2450 N GLY B 63 -2.012 -1.454 5.927 1.00 0.00 N ATOM 2451 CA GLY B 63 -2.337 -2.389 4.864 1.00 0.00 C ATOM 2452 C GLY B 63 -2.236 -1.748 3.494 1.00 0.00 C ATOM 2453 O GLY B 63 -3.249 -1.433 2.872 1.00 0.00 O ATOM 0 H GLY B 63 -2.556 -0.592 5.918 1.00 0.00 H new ATOM 0 HA2 GLY B 63 -1.663 -3.244 4.915 1.00 0.00 H new ATOM 0 HA3 GLY B 63 -3.347 -2.770 5.013 1.00 0.00 H new ATOM 2457 N SER B 64 -1.008 -1.545 3.032 1.00 0.00 N ATOM 2458 CA SER B 64 -0.771 -0.924 1.734 1.00 0.00 C ATOM 2459 C SER B 64 -1.149 -1.859 0.589 1.00 0.00 C ATOM 2460 O SER B 64 -0.811 -3.043 0.600 1.00 0.00 O ATOM 2461 CB SER B 64 0.695 -0.512 1.606 1.00 0.00 C ATOM 2462 OG SER B 64 1.556 -1.621 1.794 1.00 0.00 O ATOM 0 H SER B 64 -0.160 -1.802 3.537 1.00 0.00 H new ATOM 0 HA SER B 64 -1.403 -0.038 1.670 1.00 0.00 H new ATOM 0 HB2 SER B 64 0.869 -0.076 0.622 1.00 0.00 H new ATOM 0 HB3 SER B 64 0.925 0.259 2.341 1.00 0.00 H new ATOM 0 HG SER B 64 2.351 -1.337 2.291 1.00 0.00 H new ATOM 2468 N TYR B 65 -1.844 -1.310 -0.402 1.00 0.00 N ATOM 2469 CA TYR B 65 -2.266 -2.077 -1.565 1.00 0.00 C ATOM 2470 C TYR B 65 -2.275 -1.196 -2.810 1.00 0.00 C ATOM 2471 O TYR B 65 -3.336 -0.841 -3.328 1.00 0.00 O ATOM 2472 CB TYR B 65 -3.655 -2.677 -1.338 1.00 0.00 C ATOM 2473 CG TYR B 65 -3.958 -3.859 -2.229 1.00 0.00 C ATOM 2474 CD1 TYR B 65 -3.550 -5.140 -1.877 1.00 0.00 C ATOM 2475 CD2 TYR B 65 -4.649 -3.696 -3.422 1.00 0.00 C ATOM 2476 CE1 TYR B 65 -3.825 -6.224 -2.690 1.00 0.00 C ATOM 2477 CE2 TYR B 65 -4.928 -4.774 -4.239 1.00 0.00 C ATOM 2478 CZ TYR B 65 -4.514 -6.036 -3.869 1.00 0.00 C ATOM 2479 OH TYR B 65 -4.791 -7.113 -4.680 1.00 0.00 O ATOM 0 H TYR B 65 -2.128 -0.330 -0.421 1.00 0.00 H new ATOM 0 HA TYR B 65 -1.555 -2.889 -1.714 1.00 0.00 H new ATOM 0 HB2 TYR B 65 -3.742 -2.986 -0.296 1.00 0.00 H new ATOM 0 HB3 TYR B 65 -4.406 -1.905 -1.505 1.00 0.00 H new ATOM 0 HD1 TYR B 65 -3.010 -5.291 -0.954 1.00 0.00 H new ATOM 0 HD2 TYR B 65 -4.974 -2.709 -3.716 1.00 0.00 H new ATOM 0 HE1 TYR B 65 -3.501 -7.214 -2.403 1.00 0.00 H new ATOM 0 HE2 TYR B 65 -5.468 -4.629 -5.163 1.00 0.00 H new ATOM 0 HH TYR B 65 -5.284 -6.809 -5.471 1.00 0.00 H new ATOM 2489 N VAL B 66 -1.083 -0.840 -3.279 1.00 0.00 N ATOM 2490 CA VAL B 66 -0.944 0.004 -4.459 1.00 0.00 C ATOM 2491 C VAL B 66 -0.515 -0.814 -5.671 1.00 0.00 C ATOM 2492 O VAL B 66 -0.051 -1.947 -5.537 1.00 0.00 O ATOM 2493 CB VAL B 66 0.078 1.131 -4.222 1.00 0.00 C ATOM 2494 CG1 VAL B 66 -0.454 2.128 -3.204 1.00 0.00 C ATOM 2495 CG2 VAL B 66 1.412 0.557 -3.771 1.00 0.00 C ATOM 0 H VAL B 66 -0.198 -1.124 -2.858 1.00 0.00 H new ATOM 0 HA VAL B 66 -1.922 0.446 -4.652 1.00 0.00 H new ATOM 0 HB VAL B 66 0.236 1.657 -5.163 1.00 0.00 H new ATOM 0 HG11 VAL B 66 0.282 2.917 -3.049 1.00 0.00 H new ATOM 0 HG12 VAL B 66 -1.382 2.564 -3.573 1.00 0.00 H new ATOM 0 HG13 VAL B 66 -0.643 1.618 -2.260 1.00 0.00 H new ATOM 0 HG21 VAL B 66 2.121 1.369 -3.609 1.00 0.00 H new ATOM 0 HG22 VAL B 66 1.275 0.004 -2.842 1.00 0.00 H new ATOM 0 HG23 VAL B 66 1.798 -0.114 -4.539 1.00 0.00 H new ATOM 2505 N THR B 67 -0.678 -0.235 -6.857 1.00 0.00 N ATOM 2506 CA THR B 67 -0.312 -0.914 -8.095 1.00 0.00 C ATOM 2507 C THR B 67 1.008 -0.381 -8.646 1.00 0.00 C ATOM 2508 O THR B 67 1.059 0.706 -9.220 1.00 0.00 O ATOM 2509 CB THR B 67 -1.419 -0.742 -9.137 1.00 0.00 C ATOM 2510 OG1 THR B 67 -2.682 -1.068 -8.584 1.00 0.00 O ATOM 2511 CG2 THR B 67 -1.222 -1.599 -10.367 1.00 0.00 C ATOM 0 H THR B 67 -1.061 0.702 -6.986 1.00 0.00 H new ATOM 0 HA THR B 67 -0.187 -1.974 -7.874 1.00 0.00 H new ATOM 0 HB THR B 67 -1.376 0.306 -9.434 1.00 0.00 H new ATOM 0 HG1 THR B 67 -3.165 -0.244 -8.364 1.00 0.00 H new ATOM 0 HG21 THR B 67 -2.042 -1.428 -11.065 1.00 0.00 H new ATOM 0 HG22 THR B 67 -0.278 -1.337 -10.845 1.00 0.00 H new ATOM 0 HG23 THR B 67 -1.204 -2.650 -10.079 1.00 0.00 H new ATOM 2519 N HIS B 68 2.074 -1.157 -8.471 1.00 0.00 N ATOM 2520 CA HIS B 68 3.394 -0.764 -8.954 1.00 0.00 C ATOM 2521 C HIS B 68 3.455 -0.825 -10.477 1.00 0.00 C ATOM 2522 O HIS B 68 2.427 -0.777 -11.152 1.00 0.00 O ATOM 2523 CB HIS B 68 4.473 -1.666 -8.351 1.00 0.00 C ATOM 2524 CG HIS B 68 4.357 -3.100 -8.763 1.00 0.00 C ATOM 2525 ND1 HIS B 68 5.124 -4.174 -8.461 1.00 0.00 N flip ATOM 2526 CD2 HIS B 68 3.355 -3.568 -9.587 1.00 0.00 C flip ATOM 2527 CE1 HIS B 68 4.577 -5.258 -9.102 1.00 0.00 C flip ATOM 2528 NE2 HIS B 68 3.511 -4.867 -9.773 1.00 0.00 N flip ATOM 0 H HIS B 68 2.050 -2.061 -7.999 1.00 0.00 H new ATOM 0 HA HIS B 68 3.576 0.264 -8.641 1.00 0.00 H new ATOM 0 HB2 HIS B 68 5.453 -1.291 -8.645 1.00 0.00 H new ATOM 0 HB3 HIS B 68 4.420 -1.604 -7.264 1.00 0.00 H new ATOM 0 HD2 HIS B 68 2.566 -2.967 -10.014 1.00 0.00 H new ATOM 0 HE1 HIS B 68 4.958 -6.268 -9.063 1.00 0.00 H new ATOM 0 HE2 HIS B 68 2.909 -5.465 -10.339 1.00 0.00 H new ATOM 2537 N GLU B 69 4.667 -0.931 -11.014 1.00 0.00 N ATOM 2538 CA GLU B 69 4.861 -0.998 -12.458 1.00 0.00 C ATOM 2539 C GLU B 69 6.345 -1.050 -12.810 1.00 0.00 C ATOM 2540 O GLU B 69 6.919 -2.127 -12.965 1.00 0.00 O ATOM 2541 CB GLU B 69 4.206 0.207 -13.137 1.00 0.00 C ATOM 2542 CG GLU B 69 4.117 1.434 -12.243 1.00 0.00 C ATOM 2543 CD GLU B 69 2.805 2.177 -12.402 1.00 0.00 C ATOM 2544 OE1 GLU B 69 1.787 1.527 -12.717 1.00 0.00 O ATOM 2545 OE2 GLU B 69 2.796 3.412 -12.210 1.00 0.00 O ATOM 0 H GLU B 69 5.529 -0.972 -10.471 1.00 0.00 H new ATOM 0 HA GLU B 69 4.390 -1.912 -12.819 1.00 0.00 H new ATOM 0 HB2 GLU B 69 4.772 0.461 -14.033 1.00 0.00 H new ATOM 0 HB3 GLU B 69 3.203 -0.070 -13.461 1.00 0.00 H new ATOM 0 HG2 GLU B 69 4.235 1.130 -11.203 1.00 0.00 H new ATOM 0 HG3 GLU B 69 4.942 2.108 -12.474 1.00 0.00 H new ATOM 2552 N THR B 70 6.958 0.123 -12.937 1.00 0.00 N ATOM 2553 CA THR B 70 8.376 0.218 -13.274 1.00 0.00 C ATOM 2554 C THR B 70 9.184 -0.879 -12.585 1.00 0.00 C ATOM 2555 O THR B 70 9.228 -2.018 -13.051 1.00 0.00 O ATOM 2556 CB THR B 70 8.919 1.592 -12.876 1.00 0.00 C ATOM 2557 OG1 THR B 70 7.953 2.600 -13.111 1.00 0.00 O ATOM 2558 CG2 THR B 70 10.177 1.978 -13.623 1.00 0.00 C ATOM 0 H THR B 70 6.495 1.023 -12.812 1.00 0.00 H new ATOM 0 HA THR B 70 8.475 0.087 -14.352 1.00 0.00 H new ATOM 0 HB THR B 70 9.156 1.512 -11.815 1.00 0.00 H new ATOM 0 HG1 THR B 70 8.318 3.471 -12.849 1.00 0.00 H new ATOM 0 HG21 THR B 70 10.508 2.963 -13.293 1.00 0.00 H new ATOM 0 HG22 THR B 70 10.959 1.246 -13.422 1.00 0.00 H new ATOM 0 HG23 THR B 70 9.971 2.004 -14.693 1.00 0.00 H new ATOM 2566 N LYS B 71 9.826 -0.525 -11.476 1.00 0.00 N ATOM 2567 CA LYS B 71 10.637 -1.475 -10.724 1.00 0.00 C ATOM 2568 C LYS B 71 11.275 -0.806 -9.513 1.00 0.00 C ATOM 2569 O LYS B 71 12.459 -1.001 -9.234 1.00 0.00 O ATOM 2570 CB LYS B 71 11.723 -2.073 -11.622 1.00 0.00 C ATOM 2571 CG LYS B 71 12.260 -1.098 -12.659 1.00 0.00 C ATOM 2572 CD LYS B 71 13.043 -1.817 -13.746 1.00 0.00 C ATOM 2573 CE LYS B 71 12.167 -2.798 -14.510 1.00 0.00 C ATOM 2574 NZ LYS B 71 11.990 -4.077 -13.768 1.00 0.00 N ATOM 0 H LYS B 71 9.800 0.414 -11.078 1.00 0.00 H new ATOM 0 HA LYS B 71 9.984 -2.274 -10.373 1.00 0.00 H new ATOM 0 HB2 LYS B 71 12.548 -2.419 -10.999 1.00 0.00 H new ATOM 0 HB3 LYS B 71 11.320 -2.948 -12.132 1.00 0.00 H new ATOM 0 HG2 LYS B 71 11.432 -0.550 -13.108 1.00 0.00 H new ATOM 0 HG3 LYS B 71 12.902 -0.364 -12.172 1.00 0.00 H new ATOM 0 HD2 LYS B 71 13.461 -1.086 -14.438 1.00 0.00 H new ATOM 0 HD3 LYS B 71 13.883 -2.349 -13.299 1.00 0.00 H new ATOM 0 HE2 LYS B 71 11.192 -2.347 -14.694 1.00 0.00 H new ATOM 0 HE3 LYS B 71 12.613 -3.002 -15.483 1.00 0.00 H new ATOM 0 HZ1 LYS B 71 12.197 -4.877 -14.400 1.00 0.00 H new ATOM 0 HZ2 LYS B 71 12.640 -4.100 -12.956 1.00 0.00 H new ATOM 0 HZ3 LYS B 71 11.010 -4.149 -13.429 1.00 0.00 H new ATOM 2588 N HIS B 72 10.485 -0.015 -8.795 1.00 0.00 N ATOM 2589 CA HIS B 72 10.975 0.684 -7.613 1.00 0.00 C ATOM 2590 C HIS B 72 9.977 0.577 -6.466 1.00 0.00 C ATOM 2591 O HIS B 72 9.722 1.552 -5.759 1.00 0.00 O ATOM 2592 CB HIS B 72 11.240 2.154 -7.940 1.00 0.00 C ATOM 2593 CG HIS B 72 12.240 2.351 -9.037 1.00 0.00 C ATOM 2594 ND1 HIS B 72 11.967 3.069 -10.183 1.00 0.00 N ATOM 2595 CD2 HIS B 72 13.519 1.923 -9.159 1.00 0.00 C ATOM 2596 CE1 HIS B 72 13.034 3.073 -10.962 1.00 0.00 C ATOM 2597 NE2 HIS B 72 13.990 2.385 -10.365 1.00 0.00 N ATOM 0 H HIS B 72 9.503 0.158 -9.011 1.00 0.00 H new ATOM 0 HA HIS B 72 11.908 0.214 -7.303 1.00 0.00 H new ATOM 0 HB2 HIS B 72 10.301 2.629 -8.225 1.00 0.00 H new ATOM 0 HB3 HIS B 72 11.594 2.660 -7.042 1.00 0.00 H new ATOM 0 HD2 HIS B 72 14.067 1.329 -8.442 1.00 0.00 H new ATOM 0 HE1 HIS B 72 13.111 3.557 -11.924 1.00 0.00 H new ATOM 0 HE2 HIS B 72 14.925 2.223 -10.738 1.00 0.00 H new ATOM 2606 N PHE B 73 9.418 -0.615 -6.285 1.00 0.00 N ATOM 2607 CA PHE B 73 8.451 -0.852 -5.220 1.00 0.00 C ATOM 2608 C PHE B 73 9.023 -1.818 -4.187 1.00 0.00 C ATOM 2609 O PHE B 73 9.141 -3.015 -4.443 1.00 0.00 O ATOM 2610 CB PHE B 73 7.146 -1.408 -5.804 1.00 0.00 C ATOM 2611 CG PHE B 73 6.309 -2.164 -4.808 1.00 0.00 C ATOM 2612 CD1 PHE B 73 6.548 -3.505 -4.562 1.00 0.00 C ATOM 2613 CD2 PHE B 73 5.286 -1.531 -4.120 1.00 0.00 C ATOM 2614 CE1 PHE B 73 5.782 -4.203 -3.646 1.00 0.00 C ATOM 2615 CE2 PHE B 73 4.517 -2.224 -3.203 1.00 0.00 C ATOM 2616 CZ PHE B 73 4.766 -3.560 -2.967 1.00 0.00 C ATOM 0 H PHE B 73 9.618 -1.432 -6.862 1.00 0.00 H new ATOM 0 HA PHE B 73 8.238 0.096 -4.726 1.00 0.00 H new ATOM 0 HB2 PHE B 73 6.558 -0.583 -6.207 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.384 -2.067 -6.639 1.00 0.00 H new ATOM 0 HD1 PHE B 73 7.341 -4.012 -5.091 1.00 0.00 H new ATOM 0 HD2 PHE B 73 5.087 -0.485 -4.302 1.00 0.00 H new ATOM 0 HE1 PHE B 73 5.978 -5.249 -3.462 1.00 0.00 H new ATOM 0 HE2 PHE B 73 3.723 -1.720 -2.672 1.00 0.00 H new ATOM 0 HZ PHE B 73 4.166 -4.103 -2.251 1.00 0.00 H new ATOM 2626 N ILE B 74 9.380 -1.289 -3.022 1.00 0.00 N ATOM 2627 CA ILE B 74 9.942 -2.111 -1.961 1.00 0.00 C ATOM 2628 C ILE B 74 9.112 -2.026 -0.684 1.00 0.00 C ATOM 2629 O ILE B 74 8.570 -0.972 -0.349 1.00 0.00 O ATOM 2630 CB ILE B 74 11.388 -1.697 -1.633 1.00 0.00 C ATOM 2631 CG1 ILE B 74 12.062 -2.803 -0.800 1.00 0.00 C ATOM 2632 CG2 ILE B 74 11.389 -0.353 -0.912 1.00 0.00 C ATOM 2633 CD1 ILE B 74 13.201 -2.339 0.091 1.00 0.00 C ATOM 0 H ILE B 74 9.290 -0.300 -2.791 1.00 0.00 H new ATOM 0 HA ILE B 74 9.932 -3.136 -2.331 1.00 0.00 H new ATOM 0 HB ILE B 74 11.963 -1.575 -2.551 1.00 0.00 H new ATOM 0 HG12 ILE B 74 11.305 -3.278 -0.176 1.00 0.00 H new ATOM 0 HG13 ILE B 74 12.441 -3.567 -1.479 1.00 0.00 H new ATOM 0 HG21 ILE B 74 12.415 -0.064 -0.682 1.00 0.00 H new ATOM 0 HG22 ILE B 74 10.934 0.403 -1.551 1.00 0.00 H new ATOM 0 HG23 ILE B 74 10.819 -0.436 0.014 1.00 0.00 H new ATOM 0 HD11 ILE B 74 13.608 -3.191 0.635 1.00 0.00 H new ATOM 0 HD12 ILE B 74 13.984 -1.892 -0.522 1.00 0.00 H new ATOM 0 HD13 ILE B 74 12.830 -1.600 0.801 1.00 0.00 H new ATOM 2645 N TYR B 75 9.034 -3.142 0.030 1.00 0.00 N ATOM 2646 CA TYR B 75 8.291 -3.208 1.283 1.00 0.00 C ATOM 2647 C TYR B 75 9.122 -3.917 2.345 1.00 0.00 C ATOM 2648 O TYR B 75 9.713 -4.965 2.083 1.00 0.00 O ATOM 2649 CB TYR B 75 6.962 -3.939 1.082 1.00 0.00 C ATOM 2650 CG TYR B 75 5.891 -3.525 2.065 1.00 0.00 C ATOM 2651 CD1 TYR B 75 5.617 -2.184 2.299 1.00 0.00 C ATOM 2652 CD2 TYR B 75 5.153 -4.476 2.760 1.00 0.00 C ATOM 2653 CE1 TYR B 75 4.641 -1.802 3.199 1.00 0.00 C ATOM 2654 CE2 TYR B 75 4.175 -4.101 3.660 1.00 0.00 C ATOM 2655 CZ TYR B 75 3.922 -2.763 3.876 1.00 0.00 C ATOM 2656 OH TYR B 75 2.949 -2.386 4.771 1.00 0.00 O ATOM 0 H TYR B 75 9.479 -4.019 -0.239 1.00 0.00 H new ATOM 0 HA TYR B 75 8.080 -2.192 1.615 1.00 0.00 H new ATOM 0 HB2 TYR B 75 6.605 -3.755 0.069 1.00 0.00 H new ATOM 0 HB3 TYR B 75 7.130 -5.012 1.171 1.00 0.00 H new ATOM 0 HD1 TYR B 75 6.176 -1.427 1.769 1.00 0.00 H new ATOM 0 HD2 TYR B 75 5.348 -5.525 2.593 1.00 0.00 H new ATOM 0 HE1 TYR B 75 4.442 -0.755 3.371 1.00 0.00 H new ATOM 0 HE2 TYR B 75 3.611 -4.853 4.192 1.00 0.00 H new ATOM 0 HH TYR B 75 3.217 -1.554 5.215 1.00 0.00 H new ATOM 2666 N PHE B 76 9.181 -3.337 3.540 1.00 0.00 N ATOM 2667 CA PHE B 76 9.960 -3.924 4.624 1.00 0.00 C ATOM 2668 C PHE B 76 9.496 -3.418 5.986 1.00 0.00 C ATOM 2669 O PHE B 76 8.800 -2.407 6.082 1.00 0.00 O ATOM 2670 CB PHE B 76 11.442 -3.603 4.434 1.00 0.00 C ATOM 2671 CG PHE B 76 11.692 -2.199 3.960 1.00 0.00 C ATOM 2672 CD1 PHE B 76 11.324 -1.811 2.681 1.00 0.00 C ATOM 2673 CD2 PHE B 76 12.289 -1.267 4.793 1.00 0.00 C ATOM 2674 CE1 PHE B 76 11.547 -0.521 2.241 1.00 0.00 C ATOM 2675 CE2 PHE B 76 12.514 0.026 4.359 1.00 0.00 C ATOM 2676 CZ PHE B 76 12.142 0.400 3.082 1.00 0.00 C ATOM 0 H PHE B 76 8.703 -2.469 3.781 1.00 0.00 H new ATOM 0 HA PHE B 76 9.810 -5.003 4.595 1.00 0.00 H new ATOM 0 HB2 PHE B 76 11.964 -3.758 5.378 1.00 0.00 H new ATOM 0 HB3 PHE B 76 11.869 -4.303 3.715 1.00 0.00 H new ATOM 0 HD1 PHE B 76 10.857 -2.526 2.020 1.00 0.00 H new ATOM 0 HD2 PHE B 76 12.582 -1.554 5.792 1.00 0.00 H new ATOM 0 HE1 PHE B 76 11.257 -0.233 1.241 1.00 0.00 H new ATOM 0 HE2 PHE B 76 12.980 0.744 5.018 1.00 0.00 H new ATOM 0 HZ PHE B 76 12.316 1.410 2.742 1.00 0.00 H new ATOM 2686 N TYR B 77 9.896 -4.129 7.036 1.00 0.00 N ATOM 2687 CA TYR B 77 9.531 -3.758 8.399 1.00 0.00 C ATOM 2688 C TYR B 77 10.777 -3.505 9.242 1.00 0.00 C ATOM 2689 O TYR B 77 11.466 -4.442 9.647 1.00 0.00 O ATOM 2690 CB TYR B 77 8.684 -4.857 9.042 1.00 0.00 C ATOM 2691 CG TYR B 77 8.491 -4.679 10.532 1.00 0.00 C ATOM 2692 CD1 TYR B 77 9.480 -5.055 11.430 1.00 0.00 C ATOM 2693 CD2 TYR B 77 7.318 -4.132 11.039 1.00 0.00 C ATOM 2694 CE1 TYR B 77 9.308 -4.893 12.793 1.00 0.00 C ATOM 2695 CE2 TYR B 77 7.137 -3.966 12.399 1.00 0.00 C ATOM 2696 CZ TYR B 77 8.134 -4.348 13.271 1.00 0.00 C ATOM 2697 OH TYR B 77 7.958 -4.187 14.626 1.00 0.00 O ATOM 0 H TYR B 77 10.474 -4.967 6.969 1.00 0.00 H new ATOM 0 HA TYR B 77 8.947 -2.839 8.355 1.00 0.00 H new ATOM 0 HB2 TYR B 77 7.708 -4.882 8.558 1.00 0.00 H new ATOM 0 HB3 TYR B 77 9.156 -5.822 8.858 1.00 0.00 H new ATOM 0 HD1 TYR B 77 10.400 -5.482 11.058 1.00 0.00 H new ATOM 0 HD2 TYR B 77 6.535 -3.832 10.359 1.00 0.00 H new ATOM 0 HE1 TYR B 77 10.088 -5.191 13.478 1.00 0.00 H new ATOM 0 HE2 TYR B 77 6.219 -3.539 12.777 1.00 0.00 H new ATOM 0 HH TYR B 77 7.079 -3.789 14.797 1.00 0.00 H new ATOM 2707 N LEU B 78 11.057 -2.235 9.507 1.00 0.00 N ATOM 2708 CA LEU B 78 12.218 -1.860 10.305 1.00 0.00 C ATOM 2709 C LEU B 78 12.021 -2.265 11.763 1.00 0.00 C ATOM 2710 O LEU B 78 10.931 -2.679 12.157 1.00 0.00 O ATOM 2711 CB LEU B 78 12.466 -0.353 10.205 1.00 0.00 C ATOM 2712 CG LEU B 78 12.994 0.137 8.853 1.00 0.00 C ATOM 2713 CD1 LEU B 78 14.474 -0.181 8.710 1.00 0.00 C ATOM 2714 CD2 LEU B 78 12.204 -0.479 7.706 1.00 0.00 C ATOM 0 H LEU B 78 10.496 -1.448 9.181 1.00 0.00 H new ATOM 0 HA LEU B 78 13.089 -2.387 9.914 1.00 0.00 H new ATOM 0 HB2 LEU B 78 11.533 0.167 10.422 1.00 0.00 H new ATOM 0 HB3 LEU B 78 13.178 -0.067 10.979 1.00 0.00 H new ATOM 0 HG LEU B 78 12.867 1.219 8.812 1.00 0.00 H new ATOM 0 HD11 LEU B 78 14.831 0.175 7.743 1.00 0.00 H new ATOM 0 HD12 LEU B 78 15.031 0.313 9.506 1.00 0.00 H new ATOM 0 HD13 LEU B 78 14.623 -1.259 8.778 1.00 0.00 H new ATOM 0 HD21 LEU B 78 12.598 -0.116 6.757 1.00 0.00 H new ATOM 0 HD22 LEU B 78 12.293 -1.565 7.744 1.00 0.00 H new ATOM 0 HD23 LEU B 78 11.155 -0.198 7.795 1.00 0.00 H new ATOM 2726 N GLY B 79 13.084 -2.150 12.554 1.00 0.00 N ATOM 2727 CA GLY B 79 13.013 -2.512 13.961 1.00 0.00 C ATOM 2728 C GLY B 79 11.619 -2.360 14.540 1.00 0.00 C ATOM 2729 O GLY B 79 11.204 -3.151 15.387 1.00 0.00 O ATOM 0 H GLY B 79 13.996 -1.812 12.246 1.00 0.00 H new ATOM 0 HA2 GLY B 79 13.341 -3.544 14.082 1.00 0.00 H new ATOM 0 HA3 GLY B 79 13.706 -1.889 14.527 1.00 0.00 H new ATOM 2733 N GLN B 80 10.894 -1.345 14.083 1.00 0.00 N ATOM 2734 CA GLN B 80 9.538 -1.097 14.563 1.00 0.00 C ATOM 2735 C GLN B 80 8.760 -0.239 13.572 1.00 0.00 C ATOM 2736 O GLN B 80 8.058 0.695 13.962 1.00 0.00 O ATOM 2737 CB GLN B 80 9.571 -0.412 15.931 1.00 0.00 C ATOM 2738 CG GLN B 80 10.854 0.357 16.198 1.00 0.00 C ATOM 2739 CD GLN B 80 10.725 1.833 15.880 1.00 0.00 C ATOM 2740 OE1 GLN B 80 9.683 2.292 15.414 1.00 0.00 O ATOM 2741 NE2 GLN B 80 11.790 2.587 16.132 1.00 0.00 N ATOM 0 H GLN B 80 11.221 -0.681 13.382 1.00 0.00 H new ATOM 0 HA GLN B 80 9.034 -2.059 14.660 1.00 0.00 H new ATOM 0 HB2 GLN B 80 8.726 0.272 16.005 1.00 0.00 H new ATOM 0 HB3 GLN B 80 9.441 -1.165 16.708 1.00 0.00 H new ATOM 0 HG2 GLN B 80 11.134 0.238 17.245 1.00 0.00 H new ATOM 0 HG3 GLN B 80 11.660 -0.070 15.602 1.00 0.00 H new ATOM 0 HE21 GLN B 80 12.634 2.165 16.519 1.00 0.00 H new ATOM 0 HE22 GLN B 80 11.763 3.588 15.939 1.00 0.00 H new ATOM 2750 N VAL B 81 8.894 -0.557 12.289 1.00 0.00 N ATOM 2751 CA VAL B 81 8.208 0.189 11.242 1.00 0.00 C ATOM 2752 C VAL B 81 8.089 -0.635 9.964 1.00 0.00 C ATOM 2753 O VAL B 81 8.738 -1.672 9.819 1.00 0.00 O ATOM 2754 CB VAL B 81 8.946 1.505 10.932 1.00 0.00 C ATOM 2755 CG1 VAL B 81 8.382 2.168 9.685 1.00 0.00 C ATOM 2756 CG2 VAL B 81 8.868 2.445 12.125 1.00 0.00 C ATOM 0 H VAL B 81 9.471 -1.326 11.950 1.00 0.00 H new ATOM 0 HA VAL B 81 7.207 0.416 11.610 1.00 0.00 H new ATOM 0 HB VAL B 81 9.993 1.273 10.739 1.00 0.00 H new ATOM 0 HG11 VAL B 81 8.922 3.095 9.490 1.00 0.00 H new ATOM 0 HG12 VAL B 81 8.494 1.497 8.834 1.00 0.00 H new ATOM 0 HG13 VAL B 81 7.325 2.388 9.836 1.00 0.00 H new ATOM 0 HG21 VAL B 81 9.393 3.371 11.893 1.00 0.00 H new ATOM 0 HG22 VAL B 81 7.824 2.666 12.347 1.00 0.00 H new ATOM 0 HG23 VAL B 81 9.331 1.972 12.991 1.00 0.00 H new ATOM 2766 N ALA B 82 7.258 -0.166 9.039 1.00 0.00 N ATOM 2767 CA ALA B 82 7.053 -0.854 7.772 1.00 0.00 C ATOM 2768 C ALA B 82 6.935 0.146 6.629 1.00 0.00 C ATOM 2769 O ALA B 82 5.887 0.760 6.435 1.00 0.00 O ATOM 2770 CB ALA B 82 5.812 -1.731 7.838 1.00 0.00 C ATOM 0 H ALA B 82 6.715 0.691 9.145 1.00 0.00 H new ATOM 0 HA ALA B 82 7.919 -1.489 7.584 1.00 0.00 H new ATOM 0 HB1 ALA B 82 5.673 -2.238 6.883 1.00 0.00 H new ATOM 0 HB2 ALA B 82 5.932 -2.472 8.628 1.00 0.00 H new ATOM 0 HB3 ALA B 82 4.940 -1.112 8.050 1.00 0.00 H new ATOM 2776 N ILE B 83 8.018 0.309 5.880 1.00 0.00 N ATOM 2777 CA ILE B 83 8.038 1.242 4.760 1.00 0.00 C ATOM 2778 C ILE B 83 7.476 0.603 3.494 1.00 0.00 C ATOM 2779 O ILE B 83 7.579 -0.609 3.298 1.00 0.00 O ATOM 2780 CB ILE B 83 9.464 1.755 4.476 1.00 0.00 C ATOM 2781 CG1 ILE B 83 10.365 1.550 5.700 1.00 0.00 C ATOM 2782 CG2 ILE B 83 9.426 3.222 4.076 1.00 0.00 C ATOM 2783 CD1 ILE B 83 10.048 2.480 6.854 1.00 0.00 C ATOM 0 H ILE B 83 8.894 -0.192 6.027 1.00 0.00 H new ATOM 0 HA ILE B 83 7.408 2.085 5.045 1.00 0.00 H new ATOM 0 HB ILE B 83 9.881 1.182 3.648 1.00 0.00 H new ATOM 0 HG12 ILE B 83 10.271 0.519 6.040 1.00 0.00 H new ATOM 0 HG13 ILE B 83 11.404 1.695 5.403 1.00 0.00 H new ATOM 0 HG21 ILE B 83 10.439 3.572 3.878 1.00 0.00 H new ATOM 0 HG22 ILE B 83 8.820 3.339 3.177 1.00 0.00 H new ATOM 0 HG23 ILE B 83 8.991 3.809 4.885 1.00 0.00 H new ATOM 0 HD11 ILE B 83 10.726 2.276 7.683 1.00 0.00 H new ATOM 0 HD12 ILE B 83 10.170 3.514 6.532 1.00 0.00 H new ATOM 0 HD13 ILE B 83 9.020 2.320 7.178 1.00 0.00 H new ATOM 2795 N LEU B 84 6.879 1.430 2.639 1.00 0.00 N ATOM 2796 CA LEU B 84 6.296 0.954 1.390 1.00 0.00 C ATOM 2797 C LEU B 84 6.662 1.876 0.230 1.00 0.00 C ATOM 2798 O LEU B 84 5.897 2.772 -0.126 1.00 0.00 O ATOM 2799 CB LEU B 84 4.773 0.859 1.520 1.00 0.00 C ATOM 2800 CG LEU B 84 3.995 0.969 0.206 1.00 0.00 C ATOM 2801 CD1 LEU B 84 3.887 -0.392 -0.464 1.00 0.00 C ATOM 2802 CD2 LEU B 84 2.616 1.559 0.454 1.00 0.00 C ATOM 0 H LEU B 84 6.787 2.435 2.790 1.00 0.00 H new ATOM 0 HA LEU B 84 6.701 -0.037 1.183 1.00 0.00 H new ATOM 0 HB2 LEU B 84 4.524 -0.091 1.992 1.00 0.00 H new ATOM 0 HB3 LEU B 84 4.433 1.647 2.192 1.00 0.00 H new ATOM 0 HG LEU B 84 4.537 1.636 -0.464 1.00 0.00 H new ATOM 0 HD11 LEU B 84 3.331 -0.295 -1.397 1.00 0.00 H new ATOM 0 HD12 LEU B 84 4.886 -0.774 -0.675 1.00 0.00 H new ATOM 0 HD13 LEU B 84 3.367 -1.083 0.199 1.00 0.00 H new ATOM 0 HD21 LEU B 84 2.076 1.631 -0.490 1.00 0.00 H new ATOM 0 HD22 LEU B 84 2.064 0.917 1.140 1.00 0.00 H new ATOM 0 HD23 LEU B 84 2.718 2.553 0.890 1.00 0.00 H new ATOM 2814 N LEU B 85 7.830 1.648 -0.359 1.00 0.00 N ATOM 2815 CA LEU B 85 8.289 2.459 -1.481 1.00 0.00 C ATOM 2816 C LEU B 85 7.785 1.894 -2.804 1.00 0.00 C ATOM 2817 O LEU B 85 7.805 0.685 -3.023 1.00 0.00 O ATOM 2818 CB LEU B 85 9.816 2.530 -1.494 1.00 0.00 C ATOM 2819 CG LEU B 85 10.398 3.935 -1.346 1.00 0.00 C ATOM 2820 CD1 LEU B 85 10.388 4.365 0.113 1.00 0.00 C ATOM 2821 CD2 LEU B 85 11.810 3.987 -1.909 1.00 0.00 C ATOM 0 H LEU B 85 8.476 0.910 -0.079 1.00 0.00 H new ATOM 0 HA LEU B 85 7.885 3.464 -1.359 1.00 0.00 H new ATOM 0 HB2 LEU B 85 10.201 1.907 -0.687 1.00 0.00 H new ATOM 0 HB3 LEU B 85 10.177 2.100 -2.428 1.00 0.00 H new ATOM 0 HG LEU B 85 9.776 4.628 -1.912 1.00 0.00 H new ATOM 0 HD11 LEU B 85 10.806 5.368 0.200 1.00 0.00 H new ATOM 0 HD12 LEU B 85 9.364 4.365 0.485 1.00 0.00 H new ATOM 0 HD13 LEU B 85 10.987 3.670 0.701 1.00 0.00 H new ATOM 0 HD21 LEU B 85 12.210 4.995 -1.796 1.00 0.00 H new ATOM 0 HD22 LEU B 85 12.443 3.283 -1.369 1.00 0.00 H new ATOM 0 HD23 LEU B 85 11.790 3.721 -2.966 1.00 0.00 H new ATOM 2833 N PHE B 86 7.336 2.780 -3.686 1.00 0.00 N ATOM 2834 CA PHE B 86 6.832 2.366 -4.990 1.00 0.00 C ATOM 2835 C PHE B 86 6.573 3.579 -5.885 1.00 0.00 C ATOM 2836 O PHE B 86 5.829 4.486 -5.517 1.00 0.00 O ATOM 2837 CB PHE B 86 5.562 1.513 -4.822 1.00 0.00 C ATOM 2838 CG PHE B 86 4.287 2.174 -5.280 1.00 0.00 C ATOM 2839 CD1 PHE B 86 3.948 2.197 -6.622 1.00 0.00 C ATOM 2840 CD2 PHE B 86 3.430 2.766 -4.365 1.00 0.00 C ATOM 2841 CE1 PHE B 86 2.780 2.799 -7.047 1.00 0.00 C ATOM 2842 CE2 PHE B 86 2.259 3.370 -4.783 1.00 0.00 C ATOM 2843 CZ PHE B 86 1.933 3.386 -6.126 1.00 0.00 C ATOM 0 H PHE B 86 7.311 3.786 -3.523 1.00 0.00 H new ATOM 0 HA PHE B 86 7.591 1.755 -5.479 1.00 0.00 H new ATOM 0 HB2 PHE B 86 5.691 0.583 -5.376 1.00 0.00 H new ATOM 0 HB3 PHE B 86 5.458 1.246 -3.770 1.00 0.00 H new ATOM 0 HD1 PHE B 86 4.605 1.738 -7.346 1.00 0.00 H new ATOM 0 HD2 PHE B 86 3.680 2.755 -3.314 1.00 0.00 H new ATOM 0 HE1 PHE B 86 2.529 2.811 -8.097 1.00 0.00 H new ATOM 0 HE2 PHE B 86 1.600 3.829 -4.061 1.00 0.00 H new ATOM 0 HZ PHE B 86 1.018 3.856 -6.455 1.00 0.00 H new ATOM 2853 N LYS B 87 7.194 3.582 -7.061 1.00 0.00 N ATOM 2854 CA LYS B 87 7.035 4.676 -8.013 1.00 0.00 C ATOM 2855 C LYS B 87 5.975 4.338 -9.055 1.00 0.00 C ATOM 2856 O LYS B 87 5.784 3.174 -9.406 1.00 0.00 O ATOM 2857 CB LYS B 87 8.363 4.970 -8.709 1.00 0.00 C ATOM 2858 CG LYS B 87 9.523 5.173 -7.749 1.00 0.00 C ATOM 2859 CD LYS B 87 10.837 5.334 -8.494 1.00 0.00 C ATOM 2860 CE LYS B 87 10.982 6.732 -9.071 1.00 0.00 C ATOM 2861 NZ LYS B 87 11.212 6.706 -10.542 1.00 0.00 N ATOM 0 H LYS B 87 7.814 2.836 -7.378 1.00 0.00 H new ATOM 0 HA LYS B 87 6.714 5.560 -7.461 1.00 0.00 H new ATOM 0 HB2 LYS B 87 8.600 4.147 -9.383 1.00 0.00 H new ATOM 0 HB3 LYS B 87 8.251 5.863 -9.324 1.00 0.00 H new ATOM 0 HG2 LYS B 87 9.340 6.056 -7.136 1.00 0.00 H new ATOM 0 HG3 LYS B 87 9.589 4.322 -7.071 1.00 0.00 H new ATOM 0 HD2 LYS B 87 11.667 5.130 -7.818 1.00 0.00 H new ATOM 0 HD3 LYS B 87 10.893 4.600 -9.298 1.00 0.00 H new ATOM 0 HE2 LYS B 87 10.083 7.309 -8.855 1.00 0.00 H new ATOM 0 HE3 LYS B 87 11.813 7.242 -8.583 1.00 0.00 H new ATOM 0 HZ1 LYS B 87 11.390 7.672 -10.883 1.00 0.00 H new ATOM 0 HZ2 LYS B 87 12.035 6.107 -10.754 1.00 0.00 H new ATOM 0 HZ3 LYS B 87 10.372 6.320 -11.018 1.00 0.00 H new ATOM 2875 N SER B 88 5.293 5.364 -9.549 1.00 0.00 N ATOM 2876 CA SER B 88 4.256 5.175 -10.554 1.00 0.00 C ATOM 2877 C SER B 88 4.707 5.725 -11.896 1.00 0.00 C ATOM 2878 O SER B 88 3.894 6.012 -12.776 1.00 0.00 O ATOM 2879 CB SER B 88 2.966 5.856 -10.118 1.00 0.00 C ATOM 2880 OG SER B 88 2.023 4.908 -9.650 1.00 0.00 O ATOM 0 H SER B 88 5.440 6.334 -9.270 1.00 0.00 H new ATOM 0 HA SER B 88 4.072 4.106 -10.660 1.00 0.00 H new ATOM 0 HB2 SER B 88 3.181 6.579 -9.331 1.00 0.00 H new ATOM 0 HB3 SER B 88 2.543 6.412 -10.955 1.00 0.00 H new ATOM 0 HG SER B 88 1.125 5.300 -9.674 1.00 0.00 H new ATOM 2886 N GLY B 89 6.012 5.865 -12.037 1.00 0.00 N ATOM 2887 CA GLY B 89 6.584 6.379 -13.265 1.00 0.00 C ATOM 2888 C GLY B 89 7.203 7.751 -13.087 1.00 0.00 C ATOM 2889 O GLY B 89 6.535 8.752 -13.419 1.00 0.00 O ATOM 2890 OXT GLY B 89 8.357 7.824 -12.615 1.00 0.00 O ATOM 0 H GLY B 89 6.694 5.630 -11.316 1.00 0.00 H new ATOM 0 HA2 GLY B 89 7.343 5.686 -13.627 1.00 0.00 H new ATOM 0 HA3 GLY B 89 5.809 6.430 -14.030 1.00 0.00 H new TER 2894 GLY B 89