USER MOD reduce.3.24.130724 H: found=0, std=0, add=1816, rem=0, adj=71 USER MOD reduce.3.24.130724 removed 1828 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 NoAdj-H: A 63 ASP H : A 63 ASP N : A 115 CACA :(H bumps) USER MOD NoAdj-H: B 63 ASP H : B 63 ASP N : B 117 CACA :(H bumps) USER MOD Set 1.1: A 15 HIS : no HE2:sc= -2.04 K(o=-3.9,f=-8.8) USER MOD Set 1.2: A 18 SER OG : rot 180:sc= -0.641 USER MOD Set 1.3: B 85 HIS : no HD1:sc= -1.18 K(o=-3.9,f=-5.6) USER MOD Set 2.1: B 79 MET CE :methyl -159:sc= -0.171 (180deg=-1.38!) USER MOD Set 2.2: Y 112 THR OG1 : rot 180:sc=-0.000552 USER MOD Set 3.1: B 57 MET CE :methyl -117:sc= -3.84 (180deg=-8.23!) USER MOD Set 3.2: B 68 CYS SG : rot -160:sc= -0.867 USER MOD Set 4.1: B 41 SER OG : rot -109:sc= 0.0337 USER MOD Set 4.2: B 42 HIS : no HD1:sc= 0.0314 X(o=0.065,f=0) USER MOD Set 5.1: B 37 ASN :FLIP amide:sc= 0.441 F(o=-1.6,f=0.27) USER MOD Set 5.2: B 38 ASN :FLIP amide:sc= -0.167! C(o=-6.1!,f=0.27!) USER MOD Set 6.1: A 85 HIS : no HD1:sc= -1.47 K(o=-4.4,f=-6!) USER MOD Set 6.2: B 15 HIS : no HE2:sc= -2.35 K(o=-4.4,f=-9.2) USER MOD Set 6.3: B 18 SER OG : rot 180:sc= -0.585 USER MOD Set 7.1: A 79 MET CE :methyl -159:sc= -0.109 (180deg=-1.37!) USER MOD Set 7.2: X 112 THR OG1 : rot 180:sc= 0 USER MOD Set 8.1: A 57 MET CE :methyl -116:sc= -3.9 (180deg=-8.34!) USER MOD Set 8.2: A 68 CYS SG : rot -160:sc= -0.799 USER MOD Set 9.1: A 41 SER OG : rot -109:sc= 0.0384 USER MOD Set 9.2: A 42 HIS : no HD1:sc= 0.0357 X(o=0.074,f=0) USER MOD Set10.1: A 37 ASN :FLIP amide:sc= 0.53 F(o=-1.5,f=0.44) USER MOD Set10.2: A 38 ASN :FLIP amide:sc= -0.0928 F(o=-5.9!,f=0.44) USER MOD Set11.1: A 7 MET CE :methyl 168:sc= 0 (180deg=-0.144) USER MOD Set11.2: B 81 THR OG1 : rot 86:sc= 0.501 USER MOD Single : A 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 0 MET N :NH3+ 147:sc= -0.0867 (180deg=-0.746) USER MOD Single : A 1 SER OG : rot -49:sc= 0.0134 USER MOD Single : A 5 LYS NZ :NH3+ -133:sc= 0.0157 (180deg=0) USER MOD Single : A 16 GLN : amide:sc= -0.247 X(o=-0.25,f=-0.59) USER MOD Single : A 17 TYR OH : rot 15:sc= -0.616 USER MOD Single : A 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 25 HIS : no HD1:sc= -0.0765 X(o=-0.076,f=-0.076) USER MOD Single : A 26 LYS NZ :NH3+ 169:sc= 2.44 (180deg=2.01) USER MOD Single : A 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 29 LYS NZ :NH3+ -175:sc= 0 (180deg=-0.0152) USER MOD Single : A 30 SER OG : rot 180:sc= 0 USER MOD Single : A 33 LYS NZ :NH3+ -141:sc=-0.00588 (180deg=-0.387) USER MOD Single : A 48 LYS NZ :NH3+ 131:sc= -0.0326 (180deg=-0.41) USER MOD Single : A 50 GLN :FLIP amide:sc= -1.04 F(o=-3,f=-1) USER MOD Single : A 55 LYS NZ :NH3+ 154:sc= -0.215 (180deg=-0.945) USER MOD Single : A 59 THR OG1 : rot 180:sc= 0 USER MOD Single : A 71 GLN :FLIP amide:sc= -0.0339 F(o=-1.7!,f=-0.034) USER MOD Single : A 74 MET CE :methyl -110:sc= -1.02 (180deg=-4.56!) USER MOD Single : A 78 SER OG : rot -130:sc= -3.76! USER MOD Single : A 81 THR OG1 : rot 77:sc= 0.548 USER MOD Single : A 82 THR OG1 : rot -48:sc= 1.29 USER MOD Single : A 84 CYS SG : rot 59:sc= -0.163 USER MOD Single : A 90 HIS : no HD1:sc=-0.00107 X(o=-0.0011,f=-0.33) USER MOD Single : B 0 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : B 0 MET N :NH3+ 141:sc= -0.122 (180deg=-0.722) USER MOD Single : B 1 SER OG : rot -47:sc= 0.0137 USER MOD Single : B 5 LYS NZ :NH3+ -131:sc= 0.0171 (180deg=0) USER MOD Single : B 7 MET CE :methyl 168:sc= 0 (180deg=-0.136) USER MOD Single : B 16 GLN : amide:sc= -0.171 X(o=-0.17,f=-0.48) USER MOD Single : B 17 TYR OH : rot 0:sc= -0.565 USER MOD Single : B 24 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 25 HIS : no HD1:sc= -0.0397 X(o=-0.04,f=-0.041) USER MOD Single : B 26 LYS NZ :NH3+ 170:sc= 2.41 (180deg=2.01) USER MOD Single : B 28 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 29 LYS NZ :NH3+ -170:sc= 0 (180deg=-0.0779) USER MOD Single : B 30 SER OG : rot 180:sc= 0 USER MOD Single : B 33 LYS NZ :NH3+ -143:sc= -0.012 (180deg=-0.458) USER MOD Single : B 48 LYS NZ :NH3+ 160:sc= -0.053 (180deg=-0.486) USER MOD Single : B 50 GLN :FLIP amide:sc= -1.12 F(o=-2.9,f=-1.1) USER MOD Single : B 55 LYS NZ :NH3+ 137:sc= -0.144 (180deg=-0.906) USER MOD Single : B 59 THR OG1 : rot 180:sc= 0 USER MOD Single : B 71 GLN :FLIP amide:sc= -0.0384 F(o=-1.7!,f=-0.038) USER MOD Single : B 74 MET CE :methyl -108:sc= -1.16 (180deg=-4.62!) USER MOD Single : B 78 SER OG : rot -130:sc= -3.73! USER MOD Single : B 82 THR OG1 : rot -56:sc= 1.36 USER MOD Single : B 84 CYS SG : rot 61:sc= -0.062 USER MOD Single : B 90 HIS : no HD1:sc=-0.00149 X(o=-0.0015,f=-0.35) USER MOD Single : X 92 SER OG : rot 36:sc= 0.0178 USER MOD Single : X 93 HIS :FLIP no HD1:sc= -0.134 F(o=-1,f=-0.13) USER MOD Single : X 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 96 SER OG : rot 180:sc= 0 USER MOD Single : X 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 100 GLN : amide:sc= 0 K(o=0,f=-1.7!) USER MOD Single : X 101 SER OG : rot 180:sc= 0 USER MOD Single : X 102 THR OG1 : rot 180:sc= 0 USER MOD Single : X 103 SER OG : rot 180:sc= 0 USER MOD Single : X 105 HIS : no HD1:sc= -3.62 K(o=-3.6,f=-5.8!) USER MOD Single : X 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : X 109 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : X 111 LYS NZ :NH3+ 122:sc= -1.41! (180deg=-2.48!) USER MOD Single : Y 92 SER OG : rot 38:sc= 0.0156 USER MOD Single : Y 93 HIS :FLIP no HD1:sc= -0.0619 F(o=-1.1,f=-0.062) USER MOD Single : Y 95 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 96 SER OG : rot 180:sc= 0 USER MOD Single : Y 97 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 98 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 100 GLN : amide:sc= -0.0133 K(o=-0.013,f=-1.8!) USER MOD Single : Y 101 SER OG : rot 180:sc= 0 USER MOD Single : Y 102 THR OG1 : rot 180:sc= 0 USER MOD Single : Y 103 SER OG : rot 180:sc= 0 USER MOD Single : Y 105 HIS : no HD1:sc= -3.17 K(o=-3.2,f=-4.7!) USER MOD Single : Y 106 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 107 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : Y 109 MET CE :methyl -177:sc= 0 (180deg=-0.00657) USER MOD Single : Y 111 LYS NZ :NH3+ -131:sc= -1.23! (180deg=-2.31!) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 0 -1.958 -3.194 -12.498 1.00 0.00 N ATOM 2 CA MET A 0 -1.612 -2.503 -13.772 1.00 0.00 C ATOM 3 C MET A 0 -2.696 -1.478 -14.113 1.00 0.00 C ATOM 4 O MET A 0 -3.861 -1.674 -13.831 1.00 0.00 O ATOM 5 CB MET A 0 -1.512 -3.535 -14.900 1.00 0.00 C ATOM 6 CG MET A 0 -2.828 -4.310 -15.008 1.00 0.00 C ATOM 7 SD MET A 0 -2.687 -5.553 -16.317 1.00 0.00 S ATOM 8 CE MET A 0 -4.297 -6.339 -16.063 1.00 0.00 C ATOM 0 H1 MET A 0 -1.618 -4.176 -12.532 1.00 0.00 H new ATOM 0 H2 MET A 0 -1.508 -2.699 -11.701 1.00 0.00 H new ATOM 0 H3 MET A 0 -2.990 -3.189 -12.370 1.00 0.00 H new ATOM 0 HA MET A 0 -0.656 -1.992 -13.658 1.00 0.00 H new ATOM 0 HB2 MET A 0 -1.294 -3.036 -15.844 1.00 0.00 H new ATOM 0 HB3 MET A 0 -0.689 -4.222 -14.705 1.00 0.00 H new ATOM 0 HG2 MET A 0 -3.059 -4.791 -14.058 1.00 0.00 H new ATOM 0 HG3 MET A 0 -3.649 -3.627 -15.227 1.00 0.00 H new ATOM 0 HE1 MET A 0 -4.423 -7.151 -16.779 1.00 0.00 H new ATOM 0 HE2 MET A 0 -4.352 -6.737 -15.050 1.00 0.00 H new ATOM 0 HE3 MET A 0 -5.088 -5.603 -16.207 1.00 0.00 H new ATOM 20 N SER A 1 -2.320 -0.389 -14.726 1.00 0.00 N ATOM 21 CA SER A 1 -3.327 0.649 -15.098 1.00 0.00 C ATOM 22 C SER A 1 -4.001 1.215 -13.839 1.00 0.00 C ATOM 23 O SER A 1 -4.980 1.930 -13.920 1.00 0.00 O ATOM 24 CB SER A 1 -4.385 0.023 -16.015 1.00 0.00 C ATOM 25 OG SER A 1 -4.972 1.040 -16.815 1.00 0.00 O ATOM 0 H SER A 1 -1.358 -0.172 -14.986 1.00 0.00 H new ATOM 0 HA SER A 1 -2.824 1.463 -15.620 1.00 0.00 H new ATOM 0 HB2 SER A 1 -3.929 -0.737 -16.649 1.00 0.00 H new ATOM 0 HB3 SER A 1 -5.150 -0.475 -15.420 1.00 0.00 H new ATOM 0 HG SER A 1 -5.243 1.789 -16.245 1.00 0.00 H new ATOM 31 N GLU A 2 -3.481 0.916 -12.681 1.00 0.00 N ATOM 32 CA GLU A 2 -4.083 1.454 -11.425 1.00 0.00 C ATOM 33 C GLU A 2 -3.686 2.906 -11.275 1.00 0.00 C ATOM 34 O GLU A 2 -3.645 3.450 -10.189 1.00 0.00 O ATOM 35 CB GLU A 2 -3.578 0.654 -10.236 1.00 0.00 C ATOM 36 CG GLU A 2 -4.108 -0.760 -10.376 1.00 0.00 C ATOM 37 CD GLU A 2 -3.629 -1.614 -9.201 1.00 0.00 C ATOM 38 OE1 GLU A 2 -2.935 -1.080 -8.350 1.00 0.00 O ATOM 39 OE2 GLU A 2 -3.961 -2.787 -9.172 1.00 0.00 O ATOM 0 H GLU A 2 -2.663 0.321 -12.548 1.00 0.00 H new ATOM 0 HA GLU A 2 -5.169 1.375 -11.469 1.00 0.00 H new ATOM 0 HB2 GLU A 2 -2.488 0.654 -10.210 1.00 0.00 H new ATOM 0 HB3 GLU A 2 -3.919 1.100 -9.302 1.00 0.00 H new ATOM 0 HG2 GLU A 2 -5.197 -0.748 -10.408 1.00 0.00 H new ATOM 0 HG3 GLU A 2 -3.767 -1.194 -11.316 1.00 0.00 H new ATOM 46 N LEU A 3 -3.382 3.536 -12.362 1.00 0.00 N ATOM 47 CA LEU A 3 -2.975 4.950 -12.301 1.00 0.00 C ATOM 48 C LEU A 3 -4.109 5.767 -11.697 1.00 0.00 C ATOM 49 O LEU A 3 -3.881 6.752 -11.038 1.00 0.00 O ATOM 50 CB LEU A 3 -2.655 5.457 -13.711 1.00 0.00 C ATOM 51 CG LEU A 3 -2.225 6.929 -13.656 1.00 0.00 C ATOM 52 CD1 LEU A 3 -0.994 7.083 -12.742 1.00 0.00 C ATOM 53 CD2 LEU A 3 -1.876 7.395 -15.075 1.00 0.00 C ATOM 0 H LEU A 3 -3.399 3.128 -13.297 1.00 0.00 H new ATOM 0 HA LEU A 3 -2.084 5.052 -11.681 1.00 0.00 H new ATOM 0 HB2 LEU A 3 -1.861 4.854 -14.151 1.00 0.00 H new ATOM 0 HB3 LEU A 3 -3.530 5.349 -14.352 1.00 0.00 H new ATOM 0 HG LEU A 3 -3.038 7.534 -13.255 1.00 0.00 H new ATOM 0 HD11 LEU A 3 -0.695 8.131 -12.708 1.00 0.00 H new ATOM 0 HD12 LEU A 3 -1.243 6.744 -11.736 1.00 0.00 H new ATOM 0 HD13 LEU A 3 -0.172 6.484 -13.134 1.00 0.00 H new ATOM 0 HD21 LEU A 3 -1.569 8.440 -15.049 1.00 0.00 H new ATOM 0 HD22 LEU A 3 -1.061 6.787 -15.468 1.00 0.00 H new ATOM 0 HD23 LEU A 3 -2.750 7.289 -15.718 1.00 0.00 H new ATOM 65 N GLU A 4 -5.331 5.372 -11.920 1.00 0.00 N ATOM 66 CA GLU A 4 -6.469 6.158 -11.349 1.00 0.00 C ATOM 67 C GLU A 4 -6.424 6.093 -9.822 1.00 0.00 C ATOM 68 O GLU A 4 -6.716 7.054 -9.140 1.00 0.00 O ATOM 69 CB GLU A 4 -7.804 5.607 -11.870 1.00 0.00 C ATOM 70 CG GLU A 4 -7.987 4.149 -11.439 1.00 0.00 C ATOM 71 CD GLU A 4 -9.324 3.627 -11.971 1.00 0.00 C ATOM 72 OE1 GLU A 4 -10.105 4.434 -12.448 1.00 0.00 O ATOM 73 OE2 GLU A 4 -9.543 2.429 -11.895 1.00 0.00 O ATOM 0 H GLU A 4 -5.593 4.551 -12.465 1.00 0.00 H new ATOM 0 HA GLU A 4 -6.380 7.199 -11.661 1.00 0.00 H new ATOM 0 HB2 GLU A 4 -8.627 6.211 -11.489 1.00 0.00 H new ATOM 0 HB3 GLU A 4 -7.834 5.678 -12.957 1.00 0.00 H new ATOM 0 HG2 GLU A 4 -7.168 3.540 -11.821 1.00 0.00 H new ATOM 0 HG3 GLU A 4 -7.961 4.073 -10.352 1.00 0.00 H new ATOM 80 N LYS A 5 -6.058 4.968 -9.284 1.00 0.00 N ATOM 81 CA LYS A 5 -5.983 4.825 -7.802 1.00 0.00 C ATOM 82 C LYS A 5 -4.914 5.759 -7.244 1.00 0.00 C ATOM 83 O LYS A 5 -5.084 6.352 -6.200 1.00 0.00 O ATOM 84 CB LYS A 5 -5.612 3.377 -7.483 1.00 0.00 C ATOM 85 CG LYS A 5 -5.520 3.165 -5.968 1.00 0.00 C ATOM 86 CD LYS A 5 -5.146 1.704 -5.676 1.00 0.00 C ATOM 87 CE LYS A 5 -3.641 1.486 -5.897 1.00 0.00 C ATOM 88 NZ LYS A 5 -3.244 0.169 -5.323 1.00 0.00 N ATOM 0 H LYS A 5 -5.805 4.132 -9.810 1.00 0.00 H new ATOM 0 HA LYS A 5 -6.942 5.082 -7.352 1.00 0.00 H new ATOM 0 HB2 LYS A 5 -6.358 2.703 -7.905 1.00 0.00 H new ATOM 0 HB3 LYS A 5 -4.658 3.129 -7.949 1.00 0.00 H new ATOM 0 HG2 LYS A 5 -4.773 3.835 -5.541 1.00 0.00 H new ATOM 0 HG3 LYS A 5 -6.473 3.408 -5.498 1.00 0.00 H new ATOM 0 HD2 LYS A 5 -5.410 1.452 -4.649 1.00 0.00 H new ATOM 0 HD3 LYS A 5 -5.716 1.039 -6.324 1.00 0.00 H new ATOM 0 HE2 LYS A 5 -3.410 1.516 -6.962 1.00 0.00 H new ATOM 0 HE3 LYS A 5 -3.073 2.287 -5.425 1.00 0.00 H new ATOM 0 HZ1 LYS A 5 -2.382 0.285 -4.753 1.00 0.00 H new ATOM 0 HZ2 LYS A 5 -4.011 -0.193 -4.721 1.00 0.00 H new ATOM 0 HZ3 LYS A 5 -3.061 -0.505 -6.094 1.00 0.00 H new ATOM 102 N ALA A 6 -3.808 5.879 -7.916 1.00 0.00 N ATOM 103 CA ALA A 6 -2.727 6.764 -7.402 1.00 0.00 C ATOM 104 C ALA A 6 -3.163 8.226 -7.464 1.00 0.00 C ATOM 105 O ALA A 6 -2.883 9.003 -6.577 1.00 0.00 O ATOM 106 CB ALA A 6 -1.462 6.569 -8.241 1.00 0.00 C ATOM 0 H ALA A 6 -3.604 5.405 -8.796 1.00 0.00 H new ATOM 0 HA ALA A 6 -2.521 6.502 -6.364 1.00 0.00 H new ATOM 0 HB1 ALA A 6 -0.671 7.218 -7.864 1.00 0.00 H new ATOM 0 HB2 ALA A 6 -1.140 5.530 -8.177 1.00 0.00 H new ATOM 0 HB3 ALA A 6 -1.672 6.821 -9.280 1.00 0.00 H new ATOM 112 N MET A 7 -3.831 8.608 -8.510 1.00 0.00 N ATOM 113 CA MET A 7 -4.271 10.022 -8.640 1.00 0.00 C ATOM 114 C MET A 7 -5.220 10.378 -7.498 1.00 0.00 C ATOM 115 O MET A 7 -5.170 11.455 -6.934 1.00 0.00 O ATOM 116 CB MET A 7 -5.001 10.191 -9.975 1.00 0.00 C ATOM 117 CG MET A 7 -4.003 10.063 -11.126 1.00 0.00 C ATOM 118 SD MET A 7 -4.825 10.477 -12.682 1.00 0.00 S ATOM 119 CE MET A 7 -3.328 10.674 -13.677 1.00 0.00 C ATOM 0 H MET A 7 -4.093 8.000 -9.286 1.00 0.00 H new ATOM 0 HA MET A 7 -3.403 10.680 -8.600 1.00 0.00 H new ATOM 0 HB2 MET A 7 -5.782 9.437 -10.072 1.00 0.00 H new ATOM 0 HB3 MET A 7 -5.491 11.164 -10.012 1.00 0.00 H new ATOM 0 HG2 MET A 7 -3.155 10.728 -10.962 1.00 0.00 H new ATOM 0 HG3 MET A 7 -3.609 9.048 -11.169 1.00 0.00 H new ATOM 0 HE1 MET A 7 -3.597 10.725 -14.732 1.00 0.00 H new ATOM 0 HE2 MET A 7 -2.817 11.592 -13.388 1.00 0.00 H new ATOM 0 HE3 MET A 7 -2.667 9.824 -13.512 1.00 0.00 H new ATOM 129 N VAL A 8 -6.078 9.471 -7.157 1.00 0.00 N ATOM 130 CA VAL A 8 -7.045 9.717 -6.058 1.00 0.00 C ATOM 131 C VAL A 8 -6.282 9.850 -4.743 1.00 0.00 C ATOM 132 O VAL A 8 -6.612 10.655 -3.900 1.00 0.00 O ATOM 133 CB VAL A 8 -8.030 8.544 -5.983 1.00 0.00 C ATOM 134 CG1 VAL A 8 -8.878 8.644 -4.713 1.00 0.00 C ATOM 135 CG2 VAL A 8 -8.950 8.581 -7.206 1.00 0.00 C ATOM 0 H VAL A 8 -6.154 8.554 -7.598 1.00 0.00 H new ATOM 0 HA VAL A 8 -7.600 10.637 -6.244 1.00 0.00 H new ATOM 0 HB VAL A 8 -7.469 7.610 -5.963 1.00 0.00 H new ATOM 0 HG11 VAL A 8 -9.573 7.805 -4.672 1.00 0.00 H new ATOM 0 HG12 VAL A 8 -8.228 8.619 -3.838 1.00 0.00 H new ATOM 0 HG13 VAL A 8 -9.438 9.579 -4.722 1.00 0.00 H new ATOM 0 HG21 VAL A 8 -9.653 7.749 -7.158 1.00 0.00 H new ATOM 0 HG22 VAL A 8 -9.501 9.521 -7.218 1.00 0.00 H new ATOM 0 HG23 VAL A 8 -8.352 8.499 -8.114 1.00 0.00 H new ATOM 145 N ALA A 9 -5.284 9.037 -4.558 1.00 0.00 N ATOM 146 CA ALA A 9 -4.501 9.072 -3.286 1.00 0.00 C ATOM 147 C ALA A 9 -3.794 10.415 -3.094 1.00 0.00 C ATOM 148 O ALA A 9 -3.724 10.928 -1.995 1.00 0.00 O ATOM 149 CB ALA A 9 -3.458 7.966 -3.299 1.00 0.00 C ATOM 0 H ALA A 9 -4.971 8.342 -5.236 1.00 0.00 H new ATOM 0 HA ALA A 9 -5.201 8.930 -2.463 1.00 0.00 H new ATOM 0 HB1 ALA A 9 -2.888 7.993 -2.371 1.00 0.00 H new ATOM 0 HB2 ALA A 9 -3.954 7.000 -3.393 1.00 0.00 H new ATOM 0 HB3 ALA A 9 -2.784 8.111 -4.143 1.00 0.00 H new ATOM 155 N LEU A 10 -3.250 10.986 -4.132 1.00 0.00 N ATOM 156 CA LEU A 10 -2.537 12.283 -3.950 1.00 0.00 C ATOM 157 C LEU A 10 -3.534 13.293 -3.408 1.00 0.00 C ATOM 158 O LEU A 10 -3.224 14.101 -2.559 1.00 0.00 O ATOM 159 CB LEU A 10 -2.010 12.808 -5.293 1.00 0.00 C ATOM 160 CG LEU A 10 -1.029 11.817 -5.935 1.00 0.00 C ATOM 161 CD1 LEU A 10 -0.380 12.481 -7.157 1.00 0.00 C ATOM 162 CD2 LEU A 10 0.059 11.412 -4.931 1.00 0.00 C ATOM 0 H LEU A 10 -3.266 10.619 -5.084 1.00 0.00 H new ATOM 0 HA LEU A 10 -1.697 12.138 -3.271 1.00 0.00 H new ATOM 0 HB2 LEU A 10 -2.846 12.985 -5.970 1.00 0.00 H new ATOM 0 HB3 LEU A 10 -1.514 13.767 -5.141 1.00 0.00 H new ATOM 0 HG LEU A 10 -1.571 10.921 -6.239 1.00 0.00 H new ATOM 0 HD11 LEU A 10 0.319 11.785 -7.621 1.00 0.00 H new ATOM 0 HD12 LEU A 10 -1.152 12.753 -7.876 1.00 0.00 H new ATOM 0 HD13 LEU A 10 0.155 13.377 -6.843 1.00 0.00 H new ATOM 0 HD21 LEU A 10 0.746 10.709 -5.403 1.00 0.00 H new ATOM 0 HD22 LEU A 10 0.608 12.298 -4.613 1.00 0.00 H new ATOM 0 HD23 LEU A 10 -0.403 10.941 -4.064 1.00 0.00 H new ATOM 174 N ILE A 11 -4.727 13.252 -3.908 1.00 0.00 N ATOM 175 CA ILE A 11 -5.769 14.204 -3.451 1.00 0.00 C ATOM 176 C ILE A 11 -6.142 13.941 -1.978 1.00 0.00 C ATOM 177 O ILE A 11 -6.370 14.863 -1.223 1.00 0.00 O ATOM 178 CB ILE A 11 -6.993 14.058 -4.364 1.00 0.00 C ATOM 179 CG1 ILE A 11 -6.638 14.616 -5.751 1.00 0.00 C ATOM 180 CG2 ILE A 11 -8.177 14.838 -3.788 1.00 0.00 C ATOM 181 CD1 ILE A 11 -7.715 14.237 -6.773 1.00 0.00 C ATOM 0 H ILE A 11 -5.032 12.592 -4.623 1.00 0.00 H new ATOM 0 HA ILE A 11 -5.390 15.224 -3.509 1.00 0.00 H new ATOM 0 HB ILE A 11 -7.270 13.007 -4.439 1.00 0.00 H new ATOM 0 HG12 ILE A 11 -6.542 15.701 -5.700 1.00 0.00 H new ATOM 0 HG13 ILE A 11 -5.672 14.226 -6.070 1.00 0.00 H new ATOM 0 HG21 ILE A 11 -9.040 14.727 -4.445 1.00 0.00 H new ATOM 0 HG22 ILE A 11 -8.421 14.451 -2.799 1.00 0.00 H new ATOM 0 HG23 ILE A 11 -7.914 15.893 -3.710 1.00 0.00 H new ATOM 0 HD11 ILE A 11 -7.448 14.640 -7.750 1.00 0.00 H new ATOM 0 HD12 ILE A 11 -7.790 13.151 -6.837 1.00 0.00 H new ATOM 0 HD13 ILE A 11 -8.674 14.649 -6.460 1.00 0.00 H new ATOM 193 N ASP A 12 -6.239 12.701 -1.569 1.00 0.00 N ATOM 194 CA ASP A 12 -6.634 12.409 -0.152 1.00 0.00 C ATOM 195 C ASP A 12 -5.631 13.011 0.846 1.00 0.00 C ATOM 196 O ASP A 12 -6.008 13.624 1.825 1.00 0.00 O ATOM 197 CB ASP A 12 -6.690 10.891 0.047 1.00 0.00 C ATOM 198 CG ASP A 12 -7.167 10.561 1.467 1.00 0.00 C ATOM 199 OD1 ASP A 12 -6.909 11.348 2.362 1.00 0.00 O ATOM 200 OD2 ASP A 12 -7.779 9.519 1.634 1.00 0.00 O ATOM 0 H ASP A 12 -6.063 11.881 -2.149 1.00 0.00 H new ATOM 0 HA ASP A 12 -7.610 12.858 0.032 1.00 0.00 H new ATOM 0 HB2 ASP A 12 -7.365 10.446 -0.684 1.00 0.00 H new ATOM 0 HB3 ASP A 12 -5.704 10.458 -0.123 1.00 0.00 H new ATOM 205 N VAL A 13 -4.365 12.807 0.623 1.00 0.00 N ATOM 206 CA VAL A 13 -3.328 13.326 1.575 1.00 0.00 C ATOM 207 C VAL A 13 -3.242 14.863 1.505 1.00 0.00 C ATOM 208 O VAL A 13 -3.079 15.542 2.510 1.00 0.00 O ATOM 209 CB VAL A 13 -1.966 12.646 1.231 1.00 0.00 C ATOM 210 CG1 VAL A 13 -0.912 13.664 0.763 1.00 0.00 C ATOM 211 CG2 VAL A 13 -1.420 11.903 2.461 1.00 0.00 C ATOM 0 H VAL A 13 -3.995 12.301 -0.181 1.00 0.00 H new ATOM 0 HA VAL A 13 -3.599 13.080 2.602 1.00 0.00 H new ATOM 0 HB VAL A 13 -2.157 11.947 0.416 1.00 0.00 H new ATOM 0 HG11 VAL A 13 0.019 13.145 0.535 1.00 0.00 H new ATOM 0 HG12 VAL A 13 -1.271 14.175 -0.131 1.00 0.00 H new ATOM 0 HG13 VAL A 13 -0.736 14.395 1.553 1.00 0.00 H new ATOM 0 HG21 VAL A 13 -0.470 11.432 2.210 1.00 0.00 H new ATOM 0 HG22 VAL A 13 -1.270 12.610 3.277 1.00 0.00 H new ATOM 0 HG23 VAL A 13 -2.133 11.139 2.770 1.00 0.00 H new ATOM 221 N PHE A 14 -3.330 15.412 0.331 1.00 0.00 N ATOM 222 CA PHE A 14 -3.225 16.887 0.191 1.00 0.00 C ATOM 223 C PHE A 14 -4.329 17.547 1.004 1.00 0.00 C ATOM 224 O PHE A 14 -4.123 18.565 1.616 1.00 0.00 O ATOM 225 CB PHE A 14 -3.372 17.284 -1.281 1.00 0.00 C ATOM 226 CG PHE A 14 -3.264 18.787 -1.413 1.00 0.00 C ATOM 227 CD1 PHE A 14 -4.412 19.584 -1.314 1.00 0.00 C ATOM 228 CD2 PHE A 14 -2.016 19.384 -1.628 1.00 0.00 C ATOM 229 CE1 PHE A 14 -4.311 20.975 -1.431 1.00 0.00 C ATOM 230 CE2 PHE A 14 -1.916 20.776 -1.744 1.00 0.00 C ATOM 231 CZ PHE A 14 -3.063 21.571 -1.645 1.00 0.00 C ATOM 0 H PHE A 14 -3.471 14.902 -0.541 1.00 0.00 H new ATOM 0 HA PHE A 14 -2.251 17.215 0.554 1.00 0.00 H new ATOM 0 HB2 PHE A 14 -2.599 16.800 -1.878 1.00 0.00 H new ATOM 0 HB3 PHE A 14 -4.333 16.943 -1.666 1.00 0.00 H new ATOM 0 HD1 PHE A 14 -5.375 19.125 -1.147 1.00 0.00 H new ATOM 0 HD2 PHE A 14 -1.130 18.771 -1.704 1.00 0.00 H new ATOM 0 HE1 PHE A 14 -5.197 21.589 -1.356 1.00 0.00 H new ATOM 0 HE2 PHE A 14 -0.953 21.236 -1.910 1.00 0.00 H new ATOM 0 HZ PHE A 14 -2.985 22.645 -1.734 1.00 0.00 H new ATOM 241 N HIS A 15 -5.502 16.989 1.005 1.00 0.00 N ATOM 242 CA HIS A 15 -6.611 17.609 1.779 1.00 0.00 C ATOM 243 C HIS A 15 -6.342 17.497 3.283 1.00 0.00 C ATOM 244 O HIS A 15 -6.851 18.276 4.063 1.00 0.00 O ATOM 245 CB HIS A 15 -7.925 16.904 1.446 1.00 0.00 C ATOM 246 CG HIS A 15 -8.333 17.248 0.041 1.00 0.00 C ATOM 247 ND1 HIS A 15 -8.079 18.494 -0.516 1.00 0.00 N ATOM 248 CD2 HIS A 15 -8.988 16.529 -0.927 1.00 0.00 C ATOM 249 CE1 HIS A 15 -8.576 18.486 -1.767 1.00 0.00 C ATOM 250 NE2 HIS A 15 -9.140 17.314 -2.064 1.00 0.00 N ATOM 0 H HIS A 15 -5.743 16.133 0.506 1.00 0.00 H new ATOM 0 HA HIS A 15 -6.679 18.663 1.509 1.00 0.00 H new ATOM 0 HB2 HIS A 15 -7.808 15.825 1.549 1.00 0.00 H new ATOM 0 HB3 HIS A 15 -8.702 17.209 2.147 1.00 0.00 H new ATOM 0 HD1 HIS A 15 -7.603 19.273 -0.061 1.00 0.00 H new ATOM 0 HD2 HIS A 15 -9.332 15.511 -0.822 1.00 0.00 H new ATOM 0 HE1 HIS A 15 -8.525 19.324 -2.446 1.00 0.00 H new ATOM 259 N GLN A 16 -5.564 16.540 3.711 1.00 0.00 N ATOM 260 CA GLN A 16 -5.306 16.418 5.173 1.00 0.00 C ATOM 261 C GLN A 16 -4.628 17.689 5.697 1.00 0.00 C ATOM 262 O GLN A 16 -4.944 18.168 6.768 1.00 0.00 O ATOM 263 CB GLN A 16 -4.394 15.216 5.442 1.00 0.00 C ATOM 264 CG GLN A 16 -5.152 13.911 5.177 1.00 0.00 C ATOM 265 CD GLN A 16 -6.270 13.741 6.209 1.00 0.00 C ATOM 266 OE1 GLN A 16 -6.050 13.901 7.393 1.00 0.00 O ATOM 267 NE2 GLN A 16 -7.468 13.415 5.807 1.00 0.00 N ATOM 0 H GLN A 16 -5.102 15.847 3.122 1.00 0.00 H new ATOM 0 HA GLN A 16 -6.258 16.278 5.684 1.00 0.00 H new ATOM 0 HB2 GLN A 16 -3.512 15.269 4.804 1.00 0.00 H new ATOM 0 HB3 GLN A 16 -4.044 15.239 6.474 1.00 0.00 H new ATOM 0 HG2 GLN A 16 -5.572 13.922 4.171 1.00 0.00 H new ATOM 0 HG3 GLN A 16 -4.467 13.065 5.227 1.00 0.00 H new ATOM 0 HE21 GLN A 16 -7.653 13.281 4.813 1.00 0.00 H new ATOM 0 HE22 GLN A 16 -8.219 13.295 6.487 1.00 0.00 H new ATOM 276 N TYR A 17 -3.685 18.235 4.967 1.00 0.00 N ATOM 277 CA TYR A 17 -2.981 19.471 5.460 1.00 0.00 C ATOM 278 C TYR A 17 -3.650 20.756 4.946 1.00 0.00 C ATOM 279 O TYR A 17 -3.735 21.741 5.650 1.00 0.00 O ATOM 280 CB TYR A 17 -1.524 19.430 4.992 1.00 0.00 C ATOM 281 CG TYR A 17 -0.772 18.431 5.834 1.00 0.00 C ATOM 282 CD1 TYR A 17 -0.819 17.073 5.510 1.00 0.00 C ATOM 283 CD2 TYR A 17 -0.040 18.864 6.945 1.00 0.00 C ATOM 284 CE1 TYR A 17 -0.138 16.143 6.297 1.00 0.00 C ATOM 285 CE2 TYR A 17 0.648 17.937 7.735 1.00 0.00 C ATOM 286 CZ TYR A 17 0.599 16.572 7.411 1.00 0.00 C ATOM 287 OH TYR A 17 1.269 15.652 8.190 1.00 0.00 O ATOM 0 H TYR A 17 -3.372 17.887 4.061 1.00 0.00 H new ATOM 0 HA TYR A 17 -3.036 19.484 6.549 1.00 0.00 H new ATOM 0 HB2 TYR A 17 -1.473 19.151 3.940 1.00 0.00 H new ATOM 0 HB3 TYR A 17 -1.071 20.417 5.082 1.00 0.00 H new ATOM 0 HD1 TYR A 17 -1.383 16.743 4.650 1.00 0.00 H new ATOM 0 HD2 TYR A 17 -0.006 19.915 7.193 1.00 0.00 H new ATOM 0 HE1 TYR A 17 -0.178 15.093 6.048 1.00 0.00 H new ATOM 0 HE2 TYR A 17 1.215 18.270 8.592 1.00 0.00 H new ATOM 0 HH TYR A 17 1.330 14.800 7.710 1.00 0.00 H new ATOM 297 N SER A 18 -4.097 20.769 3.727 1.00 0.00 N ATOM 298 CA SER A 18 -4.726 22.007 3.177 1.00 0.00 C ATOM 299 C SER A 18 -5.958 22.391 4.003 1.00 0.00 C ATOM 300 O SER A 18 -6.200 23.552 4.268 1.00 0.00 O ATOM 301 CB SER A 18 -5.148 21.757 1.730 1.00 0.00 C ATOM 302 OG SER A 18 -6.332 20.969 1.717 1.00 0.00 O ATOM 0 H SER A 18 -4.057 19.979 3.083 1.00 0.00 H new ATOM 0 HA SER A 18 -4.003 22.821 3.221 1.00 0.00 H new ATOM 0 HB2 SER A 18 -5.322 22.705 1.221 1.00 0.00 H new ATOM 0 HB3 SER A 18 -4.351 21.246 1.189 1.00 0.00 H new ATOM 0 HG SER A 18 -6.607 20.807 0.790 1.00 0.00 H new ATOM 308 N GLY A 19 -6.738 21.429 4.406 1.00 0.00 N ATOM 309 CA GLY A 19 -7.957 21.741 5.210 1.00 0.00 C ATOM 310 C GLY A 19 -7.575 21.930 6.677 1.00 0.00 C ATOM 311 O GLY A 19 -8.358 22.404 7.476 1.00 0.00 O ATOM 0 H GLY A 19 -6.586 20.439 4.215 1.00 0.00 H new ATOM 0 HA2 GLY A 19 -8.433 22.645 4.829 1.00 0.00 H new ATOM 0 HA3 GLY A 19 -8.683 20.934 5.115 1.00 0.00 H new ATOM 315 N ARG A 20 -6.377 21.563 7.041 1.00 0.00 N ATOM 316 CA ARG A 20 -5.952 21.726 8.459 1.00 0.00 C ATOM 317 C ARG A 20 -6.026 23.206 8.837 1.00 0.00 C ATOM 318 O ARG A 20 -6.540 23.569 9.876 1.00 0.00 O ATOM 319 CB ARG A 20 -4.510 21.235 8.610 1.00 0.00 C ATOM 320 CG ARG A 20 -4.054 21.384 10.062 1.00 0.00 C ATOM 321 CD ARG A 20 -2.616 20.888 10.183 1.00 0.00 C ATOM 322 NE ARG A 20 -2.154 21.043 11.591 1.00 0.00 N ATOM 323 CZ ARG A 20 -1.075 20.431 11.998 1.00 0.00 C ATOM 324 NH1 ARG A 20 -0.422 19.647 11.184 1.00 0.00 N ATOM 325 NH2 ARG A 20 -0.654 20.600 13.221 1.00 0.00 N ATOM 0 H ARG A 20 -5.676 21.159 6.420 1.00 0.00 H new ATOM 0 HA ARG A 20 -6.606 21.148 9.111 1.00 0.00 H new ATOM 0 HB2 ARG A 20 -4.439 20.191 8.304 1.00 0.00 H new ATOM 0 HB3 ARG A 20 -3.853 21.805 7.954 1.00 0.00 H new ATOM 0 HG2 ARG A 20 -4.120 22.427 10.373 1.00 0.00 H new ATOM 0 HG3 ARG A 20 -4.706 20.813 10.722 1.00 0.00 H new ATOM 0 HD2 ARG A 20 -2.554 19.842 9.882 1.00 0.00 H new ATOM 0 HD3 ARG A 20 -1.968 21.452 9.512 1.00 0.00 H new ATOM 0 HE ARG A 20 -2.682 21.628 12.238 1.00 0.00 H new ATOM 0 HH11 ARG A 20 -0.755 19.512 10.229 1.00 0.00 H new ATOM 0 HH12 ARG A 20 0.421 19.169 11.503 1.00 0.00 H new ATOM 0 HH21 ARG A 20 -1.168 21.209 13.858 1.00 0.00 H new ATOM 0 HH22 ARG A 20 0.189 20.123 13.541 1.00 0.00 H new ATOM 339 N GLU A 21 -5.504 24.064 7.999 1.00 0.00 N ATOM 340 CA GLU A 21 -5.531 25.527 8.304 1.00 0.00 C ATOM 341 C GLU A 21 -6.842 26.136 7.799 1.00 0.00 C ATOM 342 O GLU A 21 -7.738 26.421 8.568 1.00 0.00 O ATOM 343 CB GLU A 21 -4.347 26.209 7.608 1.00 0.00 C ATOM 344 CG GLU A 21 -4.295 27.696 7.984 1.00 0.00 C ATOM 345 CD GLU A 21 -3.992 27.840 9.477 1.00 0.00 C ATOM 346 OE1 GLU A 21 -3.556 26.868 10.070 1.00 0.00 O ATOM 347 OE2 GLU A 21 -4.198 28.923 10.000 1.00 0.00 O ATOM 0 H GLU A 21 -5.060 23.815 7.115 1.00 0.00 H new ATOM 0 HA GLU A 21 -5.459 25.676 9.381 1.00 0.00 H new ATOM 0 HB2 GLU A 21 -3.416 25.721 7.896 1.00 0.00 H new ATOM 0 HB3 GLU A 21 -4.441 26.103 6.527 1.00 0.00 H new ATOM 0 HG2 GLU A 21 -3.529 28.203 7.397 1.00 0.00 H new ATOM 0 HG3 GLU A 21 -5.246 28.174 7.748 1.00 0.00 H new ATOM 354 N GLY A 22 -6.966 26.344 6.514 1.00 0.00 N ATOM 355 CA GLY A 22 -8.226 26.942 5.988 1.00 0.00 C ATOM 356 C GLY A 22 -8.153 27.101 4.467 1.00 0.00 C ATOM 357 O GLY A 22 -9.163 27.096 3.792 1.00 0.00 O ATOM 0 H GLY A 22 -6.257 26.128 5.813 1.00 0.00 H new ATOM 0 HA2 GLY A 22 -9.073 26.309 6.253 1.00 0.00 H new ATOM 0 HA3 GLY A 22 -8.396 27.913 6.453 1.00 0.00 H new ATOM 361 N ASP A 23 -6.978 27.251 3.911 1.00 0.00 N ATOM 362 CA ASP A 23 -6.883 27.417 2.432 1.00 0.00 C ATOM 363 C ASP A 23 -6.922 26.040 1.762 1.00 0.00 C ATOM 364 O ASP A 23 -5.903 25.457 1.458 1.00 0.00 O ATOM 365 CB ASP A 23 -5.569 28.118 2.085 1.00 0.00 C ATOM 366 CG ASP A 23 -5.613 29.566 2.579 1.00 0.00 C ATOM 367 OD1 ASP A 23 -6.706 30.070 2.779 1.00 0.00 O ATOM 368 OD2 ASP A 23 -4.553 30.145 2.751 1.00 0.00 O ATOM 0 H ASP A 23 -6.090 27.266 4.412 1.00 0.00 H new ATOM 0 HA ASP A 23 -7.720 28.017 2.076 1.00 0.00 H new ATOM 0 HB2 ASP A 23 -4.732 27.592 2.544 1.00 0.00 H new ATOM 0 HB3 ASP A 23 -5.407 28.096 1.007 1.00 0.00 H new ATOM 373 N LYS A 24 -8.093 25.510 1.536 1.00 0.00 N ATOM 374 CA LYS A 24 -8.189 24.172 0.886 1.00 0.00 C ATOM 375 C LYS A 24 -7.766 24.266 -0.584 1.00 0.00 C ATOM 376 O LYS A 24 -7.113 23.387 -1.111 1.00 0.00 O ATOM 377 CB LYS A 24 -9.633 23.674 0.957 1.00 0.00 C ATOM 378 CG LYS A 24 -9.988 23.324 2.404 1.00 0.00 C ATOM 379 CD LYS A 24 -11.494 23.064 2.515 1.00 0.00 C ATOM 380 CE LYS A 24 -11.869 21.810 1.718 1.00 0.00 C ATOM 381 NZ LYS A 24 -13.211 21.330 2.151 1.00 0.00 N ATOM 0 H LYS A 24 -8.985 25.944 1.773 1.00 0.00 H new ATOM 0 HA LYS A 24 -7.528 23.479 1.407 1.00 0.00 H new ATOM 0 HB2 LYS A 24 -10.311 24.440 0.581 1.00 0.00 H new ATOM 0 HB3 LYS A 24 -9.758 22.798 0.320 1.00 0.00 H new ATOM 0 HG2 LYS A 24 -9.432 22.442 2.722 1.00 0.00 H new ATOM 0 HG3 LYS A 24 -9.700 24.139 3.067 1.00 0.00 H new ATOM 0 HD2 LYS A 24 -11.773 22.937 3.561 1.00 0.00 H new ATOM 0 HD3 LYS A 24 -12.049 23.924 2.139 1.00 0.00 H new ATOM 0 HE2 LYS A 24 -11.877 22.033 0.651 1.00 0.00 H new ATOM 0 HE3 LYS A 24 -11.124 21.030 1.875 1.00 0.00 H new ATOM 0 HZ1 LYS A 24 -13.466 20.479 1.611 1.00 0.00 H new ATOM 0 HZ2 LYS A 24 -13.187 21.102 3.165 1.00 0.00 H new ATOM 0 HZ3 LYS A 24 -13.918 22.074 1.980 1.00 0.00 H new ATOM 395 N HIS A 25 -8.153 25.318 -1.254 1.00 0.00 N ATOM 396 CA HIS A 25 -7.800 25.464 -2.697 1.00 0.00 C ATOM 397 C HIS A 25 -6.362 25.968 -2.861 1.00 0.00 C ATOM 398 O HIS A 25 -5.773 25.832 -3.916 1.00 0.00 O ATOM 399 CB HIS A 25 -8.759 26.463 -3.348 1.00 0.00 C ATOM 400 CG HIS A 25 -8.516 26.501 -4.831 1.00 0.00 C ATOM 401 ND1 HIS A 25 -8.891 25.460 -5.669 1.00 0.00 N ATOM 402 CD2 HIS A 25 -7.938 27.446 -5.643 1.00 0.00 C ATOM 403 CE1 HIS A 25 -8.538 25.801 -6.923 1.00 0.00 C ATOM 404 NE2 HIS A 25 -7.955 27.000 -6.959 1.00 0.00 N ATOM 0 H HIS A 25 -8.700 26.085 -0.863 1.00 0.00 H new ATOM 0 HA HIS A 25 -7.883 24.489 -3.176 1.00 0.00 H new ATOM 0 HB2 HIS A 25 -9.791 26.177 -3.145 1.00 0.00 H new ATOM 0 HB3 HIS A 25 -8.613 27.455 -2.920 1.00 0.00 H new ATOM 0 HD2 HIS A 25 -7.533 28.390 -5.310 1.00 0.00 H new ATOM 0 HE1 HIS A 25 -8.706 25.181 -7.791 1.00 0.00 H new ATOM 0 HE2 HIS A 25 -7.597 27.487 -7.780 1.00 0.00 H new ATOM 413 N LYS A 26 -5.797 26.568 -1.840 1.00 0.00 N ATOM 414 CA LYS A 26 -4.402 27.106 -1.946 1.00 0.00 C ATOM 415 C LYS A 26 -3.576 26.655 -0.741 1.00 0.00 C ATOM 416 O LYS A 26 -4.101 26.351 0.307 1.00 0.00 O ATOM 417 CB LYS A 26 -4.469 28.630 -1.991 1.00 0.00 C ATOM 418 CG LYS A 26 -3.093 29.194 -2.340 1.00 0.00 C ATOM 419 CD LYS A 26 -3.182 30.723 -2.524 1.00 0.00 C ATOM 420 CE LYS A 26 -2.113 31.187 -3.513 1.00 0.00 C ATOM 421 NZ LYS A 26 -1.964 32.667 -3.426 1.00 0.00 N ATOM 0 H LYS A 26 -6.244 26.709 -0.934 1.00 0.00 H new ATOM 0 HA LYS A 26 -3.927 26.729 -2.852 1.00 0.00 H new ATOM 0 HB2 LYS A 26 -5.203 28.950 -2.731 1.00 0.00 H new ATOM 0 HB3 LYS A 26 -4.798 29.018 -1.027 1.00 0.00 H new ATOM 0 HG2 LYS A 26 -2.382 28.955 -1.549 1.00 0.00 H new ATOM 0 HG3 LYS A 26 -2.722 28.730 -3.254 1.00 0.00 H new ATOM 0 HD2 LYS A 26 -4.172 30.998 -2.888 1.00 0.00 H new ATOM 0 HD3 LYS A 26 -3.045 31.223 -1.565 1.00 0.00 H new ATOM 0 HE2 LYS A 26 -1.162 30.702 -3.292 1.00 0.00 H new ATOM 0 HE3 LYS A 26 -2.390 30.898 -4.527 1.00 0.00 H new ATOM 0 HZ1 LYS A 26 -1.118 32.962 -3.954 1.00 0.00 H new ATOM 0 HZ2 LYS A 26 -2.804 33.125 -3.833 1.00 0.00 H new ATOM 0 HZ3 LYS A 26 -1.865 32.948 -2.430 1.00 0.00 H new ATOM 435 N LEU A 27 -2.281 26.581 -0.902 1.00 0.00 N ATOM 436 CA LEU A 27 -1.389 26.120 0.209 1.00 0.00 C ATOM 437 C LEU A 27 -0.301 27.177 0.458 1.00 0.00 C ATOM 438 O LEU A 27 0.233 27.738 -0.473 1.00 0.00 O ATOM 439 CB LEU A 27 -0.748 24.802 -0.238 1.00 0.00 C ATOM 440 CG LEU A 27 -0.144 24.049 0.958 1.00 0.00 C ATOM 441 CD1 LEU A 27 -1.250 23.377 1.795 1.00 0.00 C ATOM 442 CD2 LEU A 27 0.807 22.972 0.428 1.00 0.00 C ATOM 0 H LEU A 27 -1.795 26.823 -1.766 1.00 0.00 H new ATOM 0 HA LEU A 27 -1.951 25.977 1.132 1.00 0.00 H new ATOM 0 HB2 LEU A 27 -1.496 24.177 -0.726 1.00 0.00 H new ATOM 0 HB3 LEU A 27 0.029 25.003 -0.975 1.00 0.00 H new ATOM 0 HG LEU A 27 0.390 24.757 1.592 1.00 0.00 H new ATOM 0 HD11 LEU A 27 -0.800 22.850 2.636 1.00 0.00 H new ATOM 0 HD12 LEU A 27 -1.936 24.137 2.168 1.00 0.00 H new ATOM 0 HD13 LEU A 27 -1.797 22.668 1.173 1.00 0.00 H new ATOM 0 HD21 LEU A 27 1.244 22.428 1.266 1.00 0.00 H new ATOM 0 HD22 LEU A 27 0.254 22.279 -0.206 1.00 0.00 H new ATOM 0 HD23 LEU A 27 1.600 23.441 -0.154 1.00 0.00 H new ATOM 454 N LYS A 28 0.034 27.456 1.702 1.00 0.00 N ATOM 455 CA LYS A 28 1.093 28.476 2.001 1.00 0.00 C ATOM 456 C LYS A 28 2.349 27.767 2.516 1.00 0.00 C ATOM 457 O LYS A 28 2.267 26.728 3.140 1.00 0.00 O ATOM 458 CB LYS A 28 0.567 29.460 3.056 1.00 0.00 C ATOM 459 CG LYS A 28 1.675 30.454 3.454 1.00 0.00 C ATOM 460 CD LYS A 28 1.051 31.743 4.006 1.00 0.00 C ATOM 461 CE LYS A 28 0.269 31.435 5.283 1.00 0.00 C ATOM 462 NZ LYS A 28 -0.059 32.710 5.982 1.00 0.00 N ATOM 0 H LYS A 28 -0.383 27.018 2.523 1.00 0.00 H new ATOM 0 HA LYS A 28 1.344 29.028 1.095 1.00 0.00 H new ATOM 0 HB2 LYS A 28 -0.293 30.001 2.662 1.00 0.00 H new ATOM 0 HB3 LYS A 28 0.225 28.914 3.935 1.00 0.00 H new ATOM 0 HG2 LYS A 28 2.325 30.005 4.205 1.00 0.00 H new ATOM 0 HG3 LYS A 28 2.297 30.683 2.589 1.00 0.00 H new ATOM 0 HD2 LYS A 28 1.831 32.475 4.214 1.00 0.00 H new ATOM 0 HD3 LYS A 28 0.389 32.185 3.261 1.00 0.00 H new ATOM 0 HE2 LYS A 28 -0.646 30.894 5.041 1.00 0.00 H new ATOM 0 HE3 LYS A 28 0.857 30.790 5.936 1.00 0.00 H new ATOM 0 HZ1 LYS A 28 -0.591 32.502 6.851 1.00 0.00 H new ATOM 0 HZ2 LYS A 28 0.821 33.209 6.225 1.00 0.00 H new ATOM 0 HZ3 LYS A 28 -0.636 33.310 5.358 1.00 0.00 H new ATOM 476 N LYS A 29 3.515 28.312 2.247 1.00 0.00 N ATOM 477 CA LYS A 29 4.779 27.658 2.713 1.00 0.00 C ATOM 478 C LYS A 29 4.618 27.179 4.149 1.00 0.00 C ATOM 479 O LYS A 29 5.300 26.281 4.596 1.00 0.00 O ATOM 480 CB LYS A 29 5.943 28.653 2.662 1.00 0.00 C ATOM 481 CG LYS A 29 5.656 29.863 3.558 1.00 0.00 C ATOM 482 CD LYS A 29 6.818 30.854 3.449 1.00 0.00 C ATOM 483 CE LYS A 29 6.600 32.014 4.422 1.00 0.00 C ATOM 484 NZ LYS A 29 5.556 32.928 3.880 1.00 0.00 N ATOM 0 H LYS A 29 3.644 29.179 1.726 1.00 0.00 H new ATOM 0 HA LYS A 29 4.987 26.813 2.057 1.00 0.00 H new ATOM 0 HB2 LYS A 29 6.862 28.164 2.985 1.00 0.00 H new ATOM 0 HB3 LYS A 29 6.102 28.983 1.635 1.00 0.00 H new ATOM 0 HG2 LYS A 29 4.724 30.342 3.257 1.00 0.00 H new ATOM 0 HG3 LYS A 29 5.530 29.543 4.592 1.00 0.00 H new ATOM 0 HD2 LYS A 29 7.759 30.352 3.672 1.00 0.00 H new ATOM 0 HD3 LYS A 29 6.892 31.231 2.429 1.00 0.00 H new ATOM 0 HE2 LYS A 29 6.294 31.633 5.396 1.00 0.00 H new ATOM 0 HE3 LYS A 29 7.533 32.558 4.571 1.00 0.00 H new ATOM 0 HZ1 LYS A 29 5.468 33.760 4.498 1.00 0.00 H new ATOM 0 HZ2 LYS A 29 5.826 33.235 2.924 1.00 0.00 H new ATOM 0 HZ3 LYS A 29 4.645 32.429 3.839 1.00 0.00 H new ATOM 498 N SER A 30 3.726 27.779 4.875 1.00 0.00 N ATOM 499 CA SER A 30 3.526 27.356 6.292 1.00 0.00 C ATOM 500 C SER A 30 2.798 26.016 6.313 1.00 0.00 C ATOM 501 O SER A 30 3.233 25.066 6.934 1.00 0.00 O ATOM 502 CB SER A 30 2.698 28.404 7.035 1.00 0.00 C ATOM 503 OG SER A 30 2.680 28.091 8.421 1.00 0.00 O ATOM 0 H SER A 30 3.127 28.540 4.556 1.00 0.00 H new ATOM 0 HA SER A 30 4.494 27.257 6.784 1.00 0.00 H new ATOM 0 HB2 SER A 30 3.122 29.396 6.880 1.00 0.00 H new ATOM 0 HB3 SER A 30 1.681 28.427 6.642 1.00 0.00 H new ATOM 0 HG SER A 30 2.151 28.762 8.901 1.00 0.00 H new ATOM 509 N GLU A 31 1.701 25.929 5.619 1.00 0.00 N ATOM 510 CA GLU A 31 0.947 24.651 5.570 1.00 0.00 C ATOM 511 C GLU A 31 1.827 23.591 4.915 1.00 0.00 C ATOM 512 O GLU A 31 1.840 22.446 5.312 1.00 0.00 O ATOM 513 CB GLU A 31 -0.329 24.841 4.748 1.00 0.00 C ATOM 514 CG GLU A 31 -1.306 25.730 5.520 1.00 0.00 C ATOM 515 CD GLU A 31 -2.502 26.070 4.628 1.00 0.00 C ATOM 516 OE1 GLU A 31 -3.391 25.241 4.522 1.00 0.00 O ATOM 517 OE2 GLU A 31 -2.508 27.153 4.067 1.00 0.00 O ATOM 0 H GLU A 31 1.293 26.693 5.081 1.00 0.00 H new ATOM 0 HA GLU A 31 0.676 24.338 6.578 1.00 0.00 H new ATOM 0 HB2 GLU A 31 -0.090 25.295 3.786 1.00 0.00 H new ATOM 0 HB3 GLU A 31 -0.787 23.874 4.540 1.00 0.00 H new ATOM 0 HG2 GLU A 31 -1.645 25.219 6.421 1.00 0.00 H new ATOM 0 HG3 GLU A 31 -0.807 26.644 5.841 1.00 0.00 H new ATOM 524 N LEU A 32 2.553 23.973 3.901 1.00 0.00 N ATOM 525 CA LEU A 32 3.433 23.004 3.191 1.00 0.00 C ATOM 526 C LEU A 32 4.463 22.419 4.151 1.00 0.00 C ATOM 527 O LEU A 32 4.759 21.253 4.095 1.00 0.00 O ATOM 528 CB LEU A 32 4.150 23.719 2.039 1.00 0.00 C ATOM 529 CG LEU A 32 5.102 22.758 1.307 1.00 0.00 C ATOM 530 CD1 LEU A 32 4.341 21.526 0.799 1.00 0.00 C ATOM 531 CD2 LEU A 32 5.727 23.496 0.117 1.00 0.00 C ATOM 0 H LEU A 32 2.574 24.923 3.531 1.00 0.00 H new ATOM 0 HA LEU A 32 2.822 22.192 2.797 1.00 0.00 H new ATOM 0 HB2 LEU A 32 3.416 24.115 1.338 1.00 0.00 H new ATOM 0 HB3 LEU A 32 4.711 24.569 2.426 1.00 0.00 H new ATOM 0 HG LEU A 32 5.877 22.426 1.998 1.00 0.00 H new ATOM 0 HD11 LEU A 32 5.032 20.858 0.284 1.00 0.00 H new ATOM 0 HD12 LEU A 32 3.892 21.002 1.643 1.00 0.00 H new ATOM 0 HD13 LEU A 32 3.558 21.841 0.109 1.00 0.00 H new ATOM 0 HD21 LEU A 32 6.405 22.826 -0.411 1.00 0.00 H new ATOM 0 HD22 LEU A 32 4.940 23.825 -0.561 1.00 0.00 H new ATOM 0 HD23 LEU A 32 6.281 24.363 0.477 1.00 0.00 H new ATOM 543 N LYS A 33 5.021 23.207 5.024 1.00 0.00 N ATOM 544 CA LYS A 33 6.033 22.643 5.968 1.00 0.00 C ATOM 545 C LYS A 33 5.390 21.542 6.812 1.00 0.00 C ATOM 546 O LYS A 33 5.994 20.525 7.093 1.00 0.00 O ATOM 547 CB LYS A 33 6.566 23.739 6.895 1.00 0.00 C ATOM 548 CG LYS A 33 7.688 23.161 7.768 1.00 0.00 C ATOM 549 CD LYS A 33 8.230 24.245 8.698 1.00 0.00 C ATOM 550 CE LYS A 33 9.441 23.704 9.461 1.00 0.00 C ATOM 551 NZ LYS A 33 10.083 24.809 10.227 1.00 0.00 N ATOM 0 H LYS A 33 4.827 24.203 5.128 1.00 0.00 H new ATOM 0 HA LYS A 33 6.859 22.232 5.388 1.00 0.00 H new ATOM 0 HB2 LYS A 33 6.941 24.577 6.308 1.00 0.00 H new ATOM 0 HB3 LYS A 33 5.762 24.124 7.523 1.00 0.00 H new ATOM 0 HG2 LYS A 33 7.311 22.322 8.353 1.00 0.00 H new ATOM 0 HG3 LYS A 33 8.489 22.775 7.138 1.00 0.00 H new ATOM 0 HD2 LYS A 33 8.514 25.125 8.121 1.00 0.00 H new ATOM 0 HD3 LYS A 33 7.456 24.559 9.398 1.00 0.00 H new ATOM 0 HE2 LYS A 33 9.131 22.910 10.140 1.00 0.00 H new ATOM 0 HE3 LYS A 33 10.157 23.267 8.765 1.00 0.00 H new ATOM 0 HZ1 LYS A 33 11.117 24.705 10.185 1.00 0.00 H new ATOM 0 HZ2 LYS A 33 9.810 25.723 9.813 1.00 0.00 H new ATOM 0 HZ3 LYS A 33 9.771 24.771 11.218 1.00 0.00 H new ATOM 565 N GLU A 34 4.173 21.745 7.232 1.00 0.00 N ATOM 566 CA GLU A 34 3.488 20.730 8.070 1.00 0.00 C ATOM 567 C GLU A 34 3.286 19.460 7.252 1.00 0.00 C ATOM 568 O GLU A 34 3.433 18.367 7.740 1.00 0.00 O ATOM 569 CB GLU A 34 2.145 21.293 8.534 1.00 0.00 C ATOM 570 CG GLU A 34 2.397 22.439 9.517 1.00 0.00 C ATOM 571 CD GLU A 34 1.064 23.059 9.938 1.00 0.00 C ATOM 572 OE1 GLU A 34 0.053 22.688 9.364 1.00 0.00 O ATOM 573 OE2 GLU A 34 1.077 23.898 10.824 1.00 0.00 O ATOM 0 H GLU A 34 3.621 22.578 7.027 1.00 0.00 H new ATOM 0 HA GLU A 34 4.091 20.490 8.946 1.00 0.00 H new ATOM 0 HB2 GLU A 34 1.571 21.650 7.679 1.00 0.00 H new ATOM 0 HB3 GLU A 34 1.554 20.511 9.011 1.00 0.00 H new ATOM 0 HG2 GLU A 34 2.930 22.069 10.393 1.00 0.00 H new ATOM 0 HG3 GLU A 34 3.031 23.195 9.054 1.00 0.00 H new ATOM 580 N LEU A 35 2.952 19.596 6.008 1.00 0.00 N ATOM 581 CA LEU A 35 2.767 18.392 5.161 1.00 0.00 C ATOM 582 C LEU A 35 4.082 17.621 5.100 1.00 0.00 C ATOM 583 O LEU A 35 4.132 16.432 5.302 1.00 0.00 O ATOM 584 CB LEU A 35 2.360 18.837 3.751 1.00 0.00 C ATOM 585 CG LEU A 35 2.212 17.611 2.824 1.00 0.00 C ATOM 586 CD1 LEU A 35 1.344 17.997 1.619 1.00 0.00 C ATOM 587 CD2 LEU A 35 3.598 17.103 2.335 1.00 0.00 C ATOM 0 H LEU A 35 2.798 20.488 5.538 1.00 0.00 H new ATOM 0 HA LEU A 35 1.991 17.751 5.579 1.00 0.00 H new ATOM 0 HB2 LEU A 35 1.419 19.386 3.793 1.00 0.00 H new ATOM 0 HB3 LEU A 35 3.109 19.519 3.347 1.00 0.00 H new ATOM 0 HG LEU A 35 1.739 16.804 3.384 1.00 0.00 H new ATOM 0 HD11 LEU A 35 1.234 17.136 0.959 1.00 0.00 H new ATOM 0 HD12 LEU A 35 0.361 18.316 1.966 1.00 0.00 H new ATOM 0 HD13 LEU A 35 1.819 18.813 1.075 1.00 0.00 H new ATOM 0 HD21 LEU A 35 3.460 16.239 1.684 1.00 0.00 H new ATOM 0 HD22 LEU A 35 4.102 17.896 1.783 1.00 0.00 H new ATOM 0 HD23 LEU A 35 4.204 16.817 3.194 1.00 0.00 H new ATOM 599 N ILE A 36 5.145 18.301 4.802 1.00 0.00 N ATOM 600 CA ILE A 36 6.468 17.633 4.685 1.00 0.00 C ATOM 601 C ILE A 36 7.001 17.206 6.058 1.00 0.00 C ATOM 602 O ILE A 36 7.477 16.101 6.231 1.00 0.00 O ATOM 603 CB ILE A 36 7.450 18.624 4.048 1.00 0.00 C ATOM 604 CG1 ILE A 36 6.900 19.093 2.699 1.00 0.00 C ATOM 605 CG2 ILE A 36 8.806 17.953 3.819 1.00 0.00 C ATOM 606 CD1 ILE A 36 7.848 20.130 2.091 1.00 0.00 C ATOM 0 H ILE A 36 5.157 19.307 4.631 1.00 0.00 H new ATOM 0 HA ILE A 36 6.361 16.738 4.073 1.00 0.00 H new ATOM 0 HB ILE A 36 7.574 19.473 4.720 1.00 0.00 H new ATOM 0 HG12 ILE A 36 6.792 18.244 2.024 1.00 0.00 H new ATOM 0 HG13 ILE A 36 5.908 19.525 2.830 1.00 0.00 H new ATOM 0 HG21 ILE A 36 9.494 18.667 3.366 1.00 0.00 H new ATOM 0 HG22 ILE A 36 9.210 17.615 4.773 1.00 0.00 H new ATOM 0 HG23 ILE A 36 8.681 17.098 3.154 1.00 0.00 H new ATOM 0 HD11 ILE A 36 7.455 20.463 1.130 1.00 0.00 H new ATOM 0 HD12 ILE A 36 7.933 20.983 2.764 1.00 0.00 H new ATOM 0 HD13 ILE A 36 8.831 19.683 1.945 1.00 0.00 H new ATOM 618 N ASN A 37 6.975 18.086 7.018 1.00 0.00 N ATOM 619 CA ASN A 37 7.537 17.743 8.358 1.00 0.00 C ATOM 620 C ASN A 37 6.766 16.611 9.051 1.00 0.00 C ATOM 621 O ASN A 37 7.344 15.769 9.710 1.00 0.00 O ATOM 622 CB ASN A 37 7.494 18.990 9.243 1.00 0.00 C ATOM 623 CG ASN A 37 8.062 18.661 10.625 1.00 0.00 C ATOM 624 OD1 ASN A 37 9.338 18.813 10.849 1.00 0.00 O flip ATOM 625 ND2 ASN A 37 7.334 18.261 11.512 1.00 0.00 N flip ATOM 0 H ASN A 37 6.590 19.027 6.936 1.00 0.00 H new ATOM 0 HA ASN A 37 8.560 17.396 8.209 1.00 0.00 H new ATOM 0 HB2 ASN A 37 8.070 19.793 8.784 1.00 0.00 H new ATOM 0 HB3 ASN A 37 6.468 19.346 9.336 1.00 0.00 H new ATOM 0 HD21 ASN A 37 6.336 18.142 11.338 1.00 0.00 H new ATOM 0 HD22 ASN A 37 7.721 18.044 12.431 1.00 0.00 H new ATOM 632 N ASN A 38 5.470 16.618 8.955 1.00 0.00 N ATOM 633 CA ASN A 38 4.641 15.583 9.658 1.00 0.00 C ATOM 634 C ASN A 38 4.203 14.437 8.735 1.00 0.00 C ATOM 635 O ASN A 38 4.072 13.310 9.172 1.00 0.00 O ATOM 636 CB ASN A 38 3.393 16.262 10.223 1.00 0.00 C ATOM 637 CG ASN A 38 3.799 17.237 11.329 1.00 0.00 C ATOM 638 OD1 ASN A 38 5.045 17.286 11.712 1.00 0.00 O flip ATOM 639 ND2 ASN A 38 2.975 17.965 11.847 1.00 0.00 N flip ATOM 0 H ASN A 38 4.936 17.300 8.416 1.00 0.00 H new ATOM 0 HA ASN A 38 5.258 15.148 10.444 1.00 0.00 H new ATOM 0 HB2 ASN A 38 2.865 16.793 9.431 1.00 0.00 H new ATOM 0 HB3 ASN A 38 2.706 15.513 10.618 1.00 0.00 H new ATOM 0 HD21 ASN A 38 2.001 17.927 11.548 1.00 0.00 H new ATOM 0 HD22 ASN A 38 3.258 18.614 12.581 1.00 0.00 H new ATOM 646 N GLU A 39 3.933 14.696 7.483 1.00 0.00 N ATOM 647 CA GLU A 39 3.462 13.584 6.597 1.00 0.00 C ATOM 648 C GLU A 39 4.656 12.748 6.129 1.00 0.00 C ATOM 649 O GLU A 39 4.491 11.702 5.535 1.00 0.00 O ATOM 650 CB GLU A 39 2.718 14.163 5.375 1.00 0.00 C ATOM 651 CG GLU A 39 1.743 13.126 4.814 1.00 0.00 C ATOM 652 CD GLU A 39 1.042 13.706 3.585 1.00 0.00 C ATOM 653 OE1 GLU A 39 0.276 14.641 3.751 1.00 0.00 O ATOM 654 OE2 GLU A 39 1.285 13.208 2.498 1.00 0.00 O ATOM 0 H GLU A 39 4.015 15.611 7.039 1.00 0.00 H new ATOM 0 HA GLU A 39 2.780 12.947 7.161 1.00 0.00 H new ATOM 0 HB2 GLU A 39 2.177 15.064 5.662 1.00 0.00 H new ATOM 0 HB3 GLU A 39 3.435 14.453 4.607 1.00 0.00 H new ATOM 0 HG2 GLU A 39 2.278 12.215 4.546 1.00 0.00 H new ATOM 0 HG3 GLU A 39 1.008 12.853 5.571 1.00 0.00 H new ATOM 661 N LEU A 40 5.860 13.200 6.385 1.00 0.00 N ATOM 662 CA LEU A 40 7.066 12.428 5.943 1.00 0.00 C ATOM 663 C LEU A 40 8.148 12.515 7.026 1.00 0.00 C ATOM 664 O LEU A 40 9.287 12.838 6.751 1.00 0.00 O ATOM 665 CB LEU A 40 7.614 13.017 4.624 1.00 0.00 C ATOM 666 CG LEU A 40 6.469 13.473 3.695 1.00 0.00 C ATOM 667 CD1 LEU A 40 7.066 14.273 2.531 1.00 0.00 C ATOM 668 CD2 LEU A 40 5.678 12.256 3.145 1.00 0.00 C ATOM 0 H LEU A 40 6.060 14.069 6.880 1.00 0.00 H new ATOM 0 HA LEU A 40 6.787 11.387 5.782 1.00 0.00 H new ATOM 0 HB2 LEU A 40 8.265 13.863 4.844 1.00 0.00 H new ATOM 0 HB3 LEU A 40 8.223 12.270 4.115 1.00 0.00 H new ATOM 0 HG LEU A 40 5.777 14.094 4.264 1.00 0.00 H new ATOM 0 HD11 LEU A 40 6.266 14.601 1.867 1.00 0.00 H new ATOM 0 HD12 LEU A 40 7.594 15.143 2.921 1.00 0.00 H new ATOM 0 HD13 LEU A 40 7.763 13.644 1.977 1.00 0.00 H new ATOM 0 HD21 LEU A 40 4.877 12.607 2.494 1.00 0.00 H new ATOM 0 HD22 LEU A 40 6.350 11.611 2.579 1.00 0.00 H new ATOM 0 HD23 LEU A 40 5.250 11.695 3.976 1.00 0.00 H new ATOM 680 N SER A 41 7.804 12.236 8.252 1.00 0.00 N ATOM 681 CA SER A 41 8.817 12.314 9.343 1.00 0.00 C ATOM 682 C SER A 41 9.972 11.345 9.066 1.00 0.00 C ATOM 683 O SER A 41 11.125 11.680 9.256 1.00 0.00 O ATOM 684 CB SER A 41 8.159 11.950 10.674 1.00 0.00 C ATOM 685 OG SER A 41 9.118 12.061 11.718 1.00 0.00 O ATOM 0 H SER A 41 6.868 11.958 8.546 1.00 0.00 H new ATOM 0 HA SER A 41 9.209 13.330 9.389 1.00 0.00 H new ATOM 0 HB2 SER A 41 7.315 12.611 10.868 1.00 0.00 H new ATOM 0 HB3 SER A 41 7.765 10.934 10.633 1.00 0.00 H new ATOM 0 HG SER A 41 9.349 11.167 12.046 1.00 0.00 H new ATOM 691 N HIS A 42 9.675 10.142 8.626 1.00 0.00 N ATOM 692 CA HIS A 42 10.758 9.139 8.344 1.00 0.00 C ATOM 693 C HIS A 42 10.722 8.725 6.871 1.00 0.00 C ATOM 694 O HIS A 42 11.719 8.317 6.308 1.00 0.00 O ATOM 695 CB HIS A 42 10.529 7.902 9.214 1.00 0.00 C ATOM 696 CG HIS A 42 10.480 8.311 10.659 1.00 0.00 C ATOM 697 ND1 HIS A 42 11.628 8.577 11.393 1.00 0.00 N ATOM 698 CD2 HIS A 42 9.429 8.512 11.520 1.00 0.00 C ATOM 699 CE1 HIS A 42 11.243 8.921 12.637 1.00 0.00 C ATOM 700 NE2 HIS A 42 9.916 8.896 12.764 1.00 0.00 N ATOM 0 H HIS A 42 8.727 9.810 8.449 1.00 0.00 H new ATOM 0 HA HIS A 42 11.727 9.585 8.567 1.00 0.00 H new ATOM 0 HB2 HIS A 42 9.597 7.412 8.931 1.00 0.00 H new ATOM 0 HB3 HIS A 42 11.330 7.179 9.056 1.00 0.00 H new ATOM 0 HD2 HIS A 42 8.386 8.390 11.269 1.00 0.00 H new ATOM 0 HE1 HIS A 42 11.924 9.184 13.433 1.00 0.00 H new ATOM 0 HE2 HIS A 42 9.372 9.113 13.599 1.00 0.00 H new ATOM 709 N PHE A 43 9.584 8.817 6.243 1.00 0.00 N ATOM 710 CA PHE A 43 9.490 8.419 4.810 1.00 0.00 C ATOM 711 C PHE A 43 10.407 9.300 3.957 1.00 0.00 C ATOM 712 O PHE A 43 11.053 8.829 3.042 1.00 0.00 O ATOM 713 CB PHE A 43 8.037 8.546 4.333 1.00 0.00 C ATOM 714 CG PHE A 43 7.929 8.142 2.873 1.00 0.00 C ATOM 715 CD1 PHE A 43 8.328 6.861 2.457 1.00 0.00 C ATOM 716 CD2 PHE A 43 7.436 9.056 1.928 1.00 0.00 C ATOM 717 CE1 PHE A 43 8.233 6.501 1.107 1.00 0.00 C ATOM 718 CE2 PHE A 43 7.345 8.693 0.581 1.00 0.00 C ATOM 719 CZ PHE A 43 7.744 7.417 0.170 1.00 0.00 C ATOM 0 H PHE A 43 8.715 9.150 6.659 1.00 0.00 H new ATOM 0 HA PHE A 43 9.809 7.382 4.705 1.00 0.00 H new ATOM 0 HB2 PHE A 43 7.390 7.915 4.942 1.00 0.00 H new ATOM 0 HB3 PHE A 43 7.693 9.572 4.461 1.00 0.00 H new ATOM 0 HD1 PHE A 43 8.708 6.153 3.179 1.00 0.00 H new ATOM 0 HD2 PHE A 43 7.126 10.042 2.242 1.00 0.00 H new ATOM 0 HE1 PHE A 43 8.538 5.515 0.789 1.00 0.00 H new ATOM 0 HE2 PHE A 43 6.966 9.399 -0.143 1.00 0.00 H new ATOM 0 HZ PHE A 43 7.674 7.139 -0.871 1.00 0.00 H new ATOM 729 N LEU A 44 10.469 10.576 4.248 1.00 0.00 N ATOM 730 CA LEU A 44 11.343 11.502 3.458 1.00 0.00 C ATOM 731 C LEU A 44 12.158 12.344 4.438 1.00 0.00 C ATOM 732 O LEU A 44 11.809 12.465 5.596 1.00 0.00 O ATOM 733 CB LEU A 44 10.466 12.417 2.585 1.00 0.00 C ATOM 734 CG LEU A 44 11.281 12.958 1.389 1.00 0.00 C ATOM 735 CD1 LEU A 44 11.271 11.941 0.238 1.00 0.00 C ATOM 736 CD2 LEU A 44 10.661 14.268 0.891 1.00 0.00 C ATOM 0 H LEU A 44 9.948 11.020 5.004 1.00 0.00 H new ATOM 0 HA LEU A 44 12.010 10.934 2.810 1.00 0.00 H new ATOM 0 HB2 LEU A 44 9.599 11.864 2.223 1.00 0.00 H new ATOM 0 HB3 LEU A 44 10.088 13.247 3.182 1.00 0.00 H new ATOM 0 HG LEU A 44 12.306 13.130 1.717 1.00 0.00 H new ATOM 0 HD11 LEU A 44 11.848 12.333 -0.599 1.00 0.00 H new ATOM 0 HD12 LEU A 44 11.713 11.004 0.577 1.00 0.00 H new ATOM 0 HD13 LEU A 44 10.244 11.763 -0.081 1.00 0.00 H new ATOM 0 HD21 LEU A 44 11.239 14.646 0.048 1.00 0.00 H new ATOM 0 HD22 LEU A 44 9.633 14.087 0.575 1.00 0.00 H new ATOM 0 HD23 LEU A 44 10.669 15.003 1.695 1.00 0.00 H new ATOM 748 N GLU A 45 13.244 12.921 4.004 1.00 0.00 N ATOM 749 CA GLU A 45 14.048 13.731 4.954 1.00 0.00 C ATOM 750 C GLU A 45 13.145 14.784 5.597 1.00 0.00 C ATOM 751 O GLU A 45 12.662 15.696 4.959 1.00 0.00 O ATOM 752 CB GLU A 45 15.221 14.402 4.224 1.00 0.00 C ATOM 753 CG GLU A 45 14.719 15.528 3.308 1.00 0.00 C ATOM 754 CD GLU A 45 15.767 15.819 2.228 1.00 0.00 C ATOM 755 OE1 GLU A 45 16.891 16.128 2.588 1.00 0.00 O ATOM 756 OE2 GLU A 45 15.427 15.724 1.060 1.00 0.00 O ATOM 0 H GLU A 45 13.603 12.868 3.051 1.00 0.00 H new ATOM 0 HA GLU A 45 14.459 13.084 5.729 1.00 0.00 H new ATOM 0 HB2 GLU A 45 15.925 14.805 4.951 1.00 0.00 H new ATOM 0 HB3 GLU A 45 15.761 13.661 3.635 1.00 0.00 H new ATOM 0 HG2 GLU A 45 13.775 15.240 2.845 1.00 0.00 H new ATOM 0 HG3 GLU A 45 14.526 16.427 3.893 1.00 0.00 H new ATOM 763 N GLU A 46 12.910 14.641 6.866 1.00 0.00 N ATOM 764 CA GLU A 46 12.041 15.604 7.592 1.00 0.00 C ATOM 765 C GLU A 46 12.683 16.994 7.546 1.00 0.00 C ATOM 766 O GLU A 46 13.888 17.125 7.539 1.00 0.00 O ATOM 767 CB GLU A 46 11.915 15.142 9.047 1.00 0.00 C ATOM 768 CG GLU A 46 10.967 16.064 9.813 1.00 0.00 C ATOM 769 CD GLU A 46 10.856 15.585 11.261 1.00 0.00 C ATOM 770 OE1 GLU A 46 11.433 14.555 11.570 1.00 0.00 O ATOM 771 OE2 GLU A 46 10.192 16.253 12.037 1.00 0.00 O ATOM 0 H GLU A 46 13.288 13.888 7.441 1.00 0.00 H new ATOM 0 HA GLU A 46 11.055 15.649 7.130 1.00 0.00 H new ATOM 0 HB2 GLU A 46 11.544 14.118 9.080 1.00 0.00 H new ATOM 0 HB3 GLU A 46 12.896 15.141 9.522 1.00 0.00 H new ATOM 0 HG2 GLU A 46 11.336 17.089 9.784 1.00 0.00 H new ATOM 0 HG3 GLU A 46 9.984 16.066 9.342 1.00 0.00 H new ATOM 778 N ILE A 47 11.895 18.036 7.509 1.00 0.00 N ATOM 779 CA ILE A 47 12.482 19.410 7.467 1.00 0.00 C ATOM 780 C ILE A 47 12.732 19.876 8.901 1.00 0.00 C ATOM 781 O ILE A 47 11.907 19.689 9.774 1.00 0.00 O ATOM 782 CB ILE A 47 11.515 20.387 6.776 1.00 0.00 C ATOM 783 CG1 ILE A 47 11.097 19.834 5.394 1.00 0.00 C ATOM 784 CG2 ILE A 47 12.189 21.769 6.622 1.00 0.00 C ATOM 785 CD1 ILE A 47 12.173 20.114 4.334 1.00 0.00 C ATOM 0 H ILE A 47 10.876 17.997 7.506 1.00 0.00 H new ATOM 0 HA ILE A 47 13.415 19.387 6.904 1.00 0.00 H new ATOM 0 HB ILE A 47 10.621 20.498 7.389 1.00 0.00 H new ATOM 0 HG12 ILE A 47 10.925 18.760 5.466 1.00 0.00 H new ATOM 0 HG13 ILE A 47 10.155 20.288 5.088 1.00 0.00 H new ATOM 0 HG21 ILE A 47 11.500 22.457 6.132 1.00 0.00 H new ATOM 0 HG22 ILE A 47 12.452 22.157 7.606 1.00 0.00 H new ATOM 0 HG23 ILE A 47 13.091 21.669 6.019 1.00 0.00 H new ATOM 0 HD11 ILE A 47 11.850 19.713 3.373 1.00 0.00 H new ATOM 0 HD12 ILE A 47 12.326 21.190 4.246 1.00 0.00 H new ATOM 0 HD13 ILE A 47 13.108 19.638 4.630 1.00 0.00 H new ATOM 797 N LYS A 48 13.874 20.459 9.155 1.00 0.00 N ATOM 798 CA LYS A 48 14.206 20.918 10.540 1.00 0.00 C ATOM 799 C LYS A 48 14.131 22.445 10.621 1.00 0.00 C ATOM 800 O LYS A 48 14.079 23.009 11.696 1.00 0.00 O ATOM 801 CB LYS A 48 15.638 20.472 10.885 1.00 0.00 C ATOM 802 CG LYS A 48 15.899 19.047 10.371 1.00 0.00 C ATOM 803 CD LYS A 48 15.013 18.039 11.103 1.00 0.00 C ATOM 804 CE LYS A 48 15.258 16.655 10.512 1.00 0.00 C ATOM 805 NZ LYS A 48 16.653 16.223 10.809 1.00 0.00 N ATOM 0 H LYS A 48 14.597 20.639 8.459 1.00 0.00 H new ATOM 0 HA LYS A 48 13.493 20.485 11.241 1.00 0.00 H new ATOM 0 HB2 LYS A 48 16.356 21.162 10.442 1.00 0.00 H new ATOM 0 HB3 LYS A 48 15.786 20.508 11.964 1.00 0.00 H new ATOM 0 HG2 LYS A 48 15.704 19.000 9.300 1.00 0.00 H new ATOM 0 HG3 LYS A 48 16.948 18.789 10.516 1.00 0.00 H new ATOM 0 HD2 LYS A 48 15.240 18.040 12.169 1.00 0.00 H new ATOM 0 HD3 LYS A 48 13.963 18.314 11.000 1.00 0.00 H new ATOM 0 HE2 LYS A 48 14.549 15.940 10.929 1.00 0.00 H new ATOM 0 HE3 LYS A 48 15.095 16.675 9.435 1.00 0.00 H new ATOM 0 HZ1 LYS A 48 16.642 15.259 11.199 1.00 0.00 H new ATOM 0 HZ2 LYS A 48 17.214 16.237 9.934 1.00 0.00 H new ATOM 0 HZ3 LYS A 48 17.077 16.872 11.502 1.00 0.00 H new ATOM 819 N GLU A 49 14.155 23.122 9.501 1.00 0.00 N ATOM 820 CA GLU A 49 14.117 24.616 9.526 1.00 0.00 C ATOM 821 C GLU A 49 13.221 25.151 8.398 1.00 0.00 C ATOM 822 O GLU A 49 13.189 24.625 7.303 1.00 0.00 O ATOM 823 CB GLU A 49 15.544 25.134 9.355 1.00 0.00 C ATOM 824 CG GLU A 49 15.585 26.643 9.613 1.00 0.00 C ATOM 825 CD GLU A 49 15.401 26.913 11.108 1.00 0.00 C ATOM 826 OE1 GLU A 49 15.625 26.001 11.887 1.00 0.00 O ATOM 827 OE2 GLU A 49 15.040 28.027 11.449 1.00 0.00 O ATOM 0 H GLU A 49 14.199 22.705 8.571 1.00 0.00 H new ATOM 0 HA GLU A 49 13.703 24.959 10.474 1.00 0.00 H new ATOM 0 HB2 GLU A 49 16.212 24.620 10.046 1.00 0.00 H new ATOM 0 HB3 GLU A 49 15.900 24.919 8.348 1.00 0.00 H new ATOM 0 HG2 GLU A 49 16.535 27.055 9.273 1.00 0.00 H new ATOM 0 HG3 GLU A 49 14.800 27.141 9.044 1.00 0.00 H new ATOM 834 N GLN A 50 12.494 26.201 8.676 1.00 0.00 N ATOM 835 CA GLN A 50 11.583 26.813 7.659 1.00 0.00 C ATOM 836 C GLN A 50 12.386 27.299 6.444 1.00 0.00 C ATOM 837 O GLN A 50 11.865 27.395 5.356 1.00 0.00 O ATOM 838 CB GLN A 50 10.863 28.007 8.300 1.00 0.00 C ATOM 839 CG GLN A 50 9.759 28.536 7.372 1.00 0.00 C ATOM 840 CD GLN A 50 8.538 27.616 7.440 1.00 0.00 C ATOM 841 OE1 GLN A 50 8.205 26.911 6.394 1.00 0.00 O flip ATOM 842 NE2 GLN A 50 7.877 27.541 8.457 1.00 0.00 N flip ATOM 0 H GLN A 50 12.492 26.670 9.582 1.00 0.00 H new ATOM 0 HA GLN A 50 10.862 26.067 7.326 1.00 0.00 H new ATOM 0 HB2 GLN A 50 10.430 27.708 9.255 1.00 0.00 H new ATOM 0 HB3 GLN A 50 11.580 28.801 8.510 1.00 0.00 H new ATOM 0 HG2 GLN A 50 9.480 29.548 7.665 1.00 0.00 H new ATOM 0 HG3 GLN A 50 10.128 28.591 6.348 1.00 0.00 H new ATOM 0 HE21 GLN A 50 8.136 28.092 9.276 1.00 0.00 H new ATOM 0 HE22 GLN A 50 7.063 26.927 8.492 1.00 0.00 H new ATOM 851 N GLU A 51 13.636 27.632 6.621 1.00 0.00 N ATOM 852 CA GLU A 51 14.441 28.143 5.468 1.00 0.00 C ATOM 853 C GLU A 51 14.503 27.093 4.361 1.00 0.00 C ATOM 854 O GLU A 51 14.462 27.423 3.198 1.00 0.00 O ATOM 855 CB GLU A 51 15.862 28.491 5.937 1.00 0.00 C ATOM 856 CG GLU A 51 16.648 27.210 6.220 1.00 0.00 C ATOM 857 CD GLU A 51 17.929 27.550 6.983 1.00 0.00 C ATOM 858 OE1 GLU A 51 18.394 28.671 6.853 1.00 0.00 O ATOM 859 OE2 GLU A 51 18.425 26.684 7.686 1.00 0.00 O ATOM 0 H GLU A 51 14.135 27.574 7.509 1.00 0.00 H new ATOM 0 HA GLU A 51 13.963 29.041 5.076 1.00 0.00 H new ATOM 0 HB2 GLU A 51 16.372 29.079 5.174 1.00 0.00 H new ATOM 0 HB3 GLU A 51 15.817 29.106 6.836 1.00 0.00 H new ATOM 0 HG2 GLU A 51 16.039 26.519 6.803 1.00 0.00 H new ATOM 0 HG3 GLU A 51 16.893 26.708 5.284 1.00 0.00 H new ATOM 866 N VAL A 52 14.593 25.839 4.697 1.00 0.00 N ATOM 867 CA VAL A 52 14.641 24.805 3.630 1.00 0.00 C ATOM 868 C VAL A 52 13.369 24.909 2.817 1.00 0.00 C ATOM 869 O VAL A 52 13.377 24.795 1.614 1.00 0.00 O ATOM 870 CB VAL A 52 14.731 23.422 4.263 1.00 0.00 C ATOM 871 CG1 VAL A 52 14.705 22.355 3.170 1.00 0.00 C ATOM 872 CG2 VAL A 52 16.029 23.317 5.062 1.00 0.00 C ATOM 0 H VAL A 52 14.635 25.488 5.654 1.00 0.00 H new ATOM 0 HA VAL A 52 15.512 24.958 2.992 1.00 0.00 H new ATOM 0 HB VAL A 52 13.883 23.268 4.930 1.00 0.00 H new ATOM 0 HG11 VAL A 52 14.769 21.367 3.625 1.00 0.00 H new ATOM 0 HG12 VAL A 52 13.776 22.435 2.606 1.00 0.00 H new ATOM 0 HG13 VAL A 52 15.551 22.501 2.499 1.00 0.00 H new ATOM 0 HG21 VAL A 52 16.097 22.329 5.517 1.00 0.00 H new ATOM 0 HG22 VAL A 52 16.879 23.470 4.397 1.00 0.00 H new ATOM 0 HG23 VAL A 52 16.038 24.077 5.843 1.00 0.00 H new ATOM 882 N VAL A 53 12.280 25.131 3.475 1.00 0.00 N ATOM 883 CA VAL A 53 10.990 25.261 2.764 1.00 0.00 C ATOM 884 C VAL A 53 11.044 26.482 1.853 1.00 0.00 C ATOM 885 O VAL A 53 10.517 26.469 0.770 1.00 0.00 O ATOM 886 CB VAL A 53 9.884 25.414 3.797 1.00 0.00 C ATOM 887 CG1 VAL A 53 8.524 25.419 3.111 1.00 0.00 C ATOM 888 CG2 VAL A 53 9.959 24.244 4.765 1.00 0.00 C ATOM 0 H VAL A 53 12.226 25.230 4.489 1.00 0.00 H new ATOM 0 HA VAL A 53 10.794 24.379 2.154 1.00 0.00 H new ATOM 0 HB VAL A 53 10.010 26.355 4.332 1.00 0.00 H new ATOM 0 HG11 VAL A 53 7.739 25.529 3.860 1.00 0.00 H new ATOM 0 HG12 VAL A 53 8.474 26.251 2.408 1.00 0.00 H new ATOM 0 HG13 VAL A 53 8.384 24.481 2.574 1.00 0.00 H new ATOM 0 HG21 VAL A 53 9.172 24.339 5.513 1.00 0.00 H new ATOM 0 HG22 VAL A 53 9.829 23.310 4.218 1.00 0.00 H new ATOM 0 HG23 VAL A 53 10.930 24.242 5.259 1.00 0.00 H new ATOM 898 N ASP A 54 11.672 27.535 2.298 1.00 0.00 N ATOM 899 CA ASP A 54 11.778 28.770 1.469 1.00 0.00 C ATOM 900 C ASP A 54 12.527 28.457 0.172 1.00 0.00 C ATOM 901 O ASP A 54 12.201 28.940 -0.892 1.00 0.00 O ATOM 902 CB ASP A 54 12.530 29.849 2.251 1.00 0.00 C ATOM 903 CG ASP A 54 12.638 31.116 1.401 1.00 0.00 C ATOM 904 OD1 ASP A 54 13.371 31.092 0.426 1.00 0.00 O ATOM 905 OD2 ASP A 54 11.985 32.090 1.739 1.00 0.00 O ATOM 0 H ASP A 54 12.122 27.593 3.212 1.00 0.00 H new ATOM 0 HA ASP A 54 10.778 29.130 1.228 1.00 0.00 H new ATOM 0 HB2 ASP A 54 12.008 30.067 3.183 1.00 0.00 H new ATOM 0 HB3 ASP A 54 13.525 29.492 2.518 1.00 0.00 H new ATOM 910 N LYS A 55 13.540 27.656 0.264 1.00 0.00 N ATOM 911 CA LYS A 55 14.328 27.297 -0.947 1.00 0.00 C ATOM 912 C LYS A 55 13.432 26.472 -1.861 1.00 0.00 C ATOM 913 O LYS A 55 13.414 26.628 -3.071 1.00 0.00 O ATOM 914 CB LYS A 55 15.549 26.471 -0.532 1.00 0.00 C ATOM 915 CG LYS A 55 16.490 26.311 -1.726 1.00 0.00 C ATOM 916 CD LYS A 55 17.709 25.486 -1.312 1.00 0.00 C ATOM 917 CE LYS A 55 18.717 25.454 -2.463 1.00 0.00 C ATOM 918 NZ LYS A 55 19.136 26.846 -2.793 1.00 0.00 N ATOM 0 H LYS A 55 13.863 27.228 1.132 1.00 0.00 H new ATOM 0 HA LYS A 55 14.670 28.194 -1.464 1.00 0.00 H new ATOM 0 HB2 LYS A 55 16.069 26.961 0.291 1.00 0.00 H new ATOM 0 HB3 LYS A 55 15.233 25.492 -0.171 1.00 0.00 H new ATOM 0 HG2 LYS A 55 15.969 25.821 -2.549 1.00 0.00 H new ATOM 0 HG3 LYS A 55 16.806 27.290 -2.086 1.00 0.00 H new ATOM 0 HD2 LYS A 55 18.169 25.918 -0.423 1.00 0.00 H new ATOM 0 HD3 LYS A 55 17.404 24.472 -1.053 1.00 0.00 H new ATOM 0 HE2 LYS A 55 19.586 24.858 -2.184 1.00 0.00 H new ATOM 0 HE3 LYS A 55 18.272 24.979 -3.338 1.00 0.00 H new ATOM 0 HZ1 LYS A 55 20.084 26.831 -3.221 1.00 0.00 H new ATOM 0 HZ2 LYS A 55 18.460 27.262 -3.464 1.00 0.00 H new ATOM 0 HZ3 LYS A 55 19.157 27.417 -1.924 1.00 0.00 H new ATOM 932 N VAL A 56 12.666 25.608 -1.268 1.00 0.00 N ATOM 933 CA VAL A 56 11.733 24.764 -2.050 1.00 0.00 C ATOM 934 C VAL A 56 10.677 25.674 -2.666 1.00 0.00 C ATOM 935 O VAL A 56 10.133 25.398 -3.717 1.00 0.00 O ATOM 936 CB VAL A 56 11.081 23.737 -1.120 1.00 0.00 C ATOM 937 CG1 VAL A 56 9.926 23.036 -1.836 1.00 0.00 C ATOM 938 CG2 VAL A 56 12.127 22.697 -0.717 1.00 0.00 C ATOM 0 H VAL A 56 12.647 25.449 -0.261 1.00 0.00 H new ATOM 0 HA VAL A 56 12.261 24.228 -2.839 1.00 0.00 H new ATOM 0 HB VAL A 56 10.695 24.246 -0.237 1.00 0.00 H new ATOM 0 HG11 VAL A 56 9.470 22.308 -1.165 1.00 0.00 H new ATOM 0 HG12 VAL A 56 9.180 23.774 -2.132 1.00 0.00 H new ATOM 0 HG13 VAL A 56 10.303 22.526 -2.722 1.00 0.00 H new ATOM 0 HG21 VAL A 56 11.672 21.961 -0.054 1.00 0.00 H new ATOM 0 HG22 VAL A 56 12.506 22.197 -1.609 1.00 0.00 H new ATOM 0 HG23 VAL A 56 12.950 23.190 -0.200 1.00 0.00 H new ATOM 948 N MET A 57 10.395 26.769 -2.016 1.00 0.00 N ATOM 949 CA MET A 57 9.382 27.716 -2.559 1.00 0.00 C ATOM 950 C MET A 57 9.938 28.333 -3.840 1.00 0.00 C ATOM 951 O MET A 57 9.226 28.565 -4.782 1.00 0.00 O ATOM 952 CB MET A 57 9.065 28.821 -1.521 1.00 0.00 C ATOM 953 CG MET A 57 7.853 28.441 -0.616 1.00 0.00 C ATOM 954 SD MET A 57 6.535 29.687 -0.844 1.00 0.00 S ATOM 955 CE MET A 57 5.048 28.639 -0.844 1.00 0.00 C ATOM 0 H MET A 57 10.822 27.049 -1.133 1.00 0.00 H new ATOM 0 HA MET A 57 8.455 27.184 -2.775 1.00 0.00 H new ATOM 0 HB2 MET A 57 9.942 28.996 -0.898 1.00 0.00 H new ATOM 0 HB3 MET A 57 8.851 29.755 -2.040 1.00 0.00 H new ATOM 0 HG2 MET A 57 7.484 27.449 -0.876 1.00 0.00 H new ATOM 0 HG3 MET A 57 8.160 28.403 0.429 1.00 0.00 H new ATOM 0 HE1 MET A 57 4.561 28.698 -1.817 1.00 0.00 H new ATOM 0 HE2 MET A 57 5.331 27.606 -0.642 1.00 0.00 H new ATOM 0 HE3 MET A 57 4.360 28.984 -0.072 1.00 0.00 H new ATOM 965 N GLU A 58 11.208 28.580 -3.907 1.00 0.00 N ATOM 966 CA GLU A 58 11.754 29.163 -5.160 1.00 0.00 C ATOM 967 C GLU A 58 11.334 28.244 -6.296 1.00 0.00 C ATOM 968 O GLU A 58 11.004 28.670 -7.385 1.00 0.00 O ATOM 969 CB GLU A 58 13.280 29.200 -5.090 1.00 0.00 C ATOM 970 CG GLU A 58 13.711 30.008 -3.872 1.00 0.00 C ATOM 971 CD GLU A 58 13.237 31.455 -4.020 1.00 0.00 C ATOM 972 OE1 GLU A 58 13.624 32.088 -4.989 1.00 0.00 O ATOM 973 OE2 GLU A 58 12.497 31.906 -3.161 1.00 0.00 O ATOM 0 H GLU A 58 11.885 28.408 -3.164 1.00 0.00 H new ATOM 0 HA GLU A 58 11.384 30.177 -5.308 1.00 0.00 H new ATOM 0 HB2 GLU A 58 13.677 28.187 -5.027 1.00 0.00 H new ATOM 0 HB3 GLU A 58 13.686 29.646 -5.998 1.00 0.00 H new ATOM 0 HG2 GLU A 58 13.293 29.569 -2.966 1.00 0.00 H new ATOM 0 HG3 GLU A 58 14.796 29.979 -3.769 1.00 0.00 H new ATOM 980 N THR A 59 11.350 26.973 -6.026 1.00 0.00 N ATOM 981 CA THR A 59 10.962 25.974 -7.052 1.00 0.00 C ATOM 982 C THR A 59 9.434 25.834 -7.167 1.00 0.00 C ATOM 983 O THR A 59 8.890 25.817 -8.254 1.00 0.00 O ATOM 984 CB THR A 59 11.558 24.628 -6.653 1.00 0.00 C ATOM 985 OG1 THR A 59 12.903 24.814 -6.238 1.00 0.00 O ATOM 986 CG2 THR A 59 11.522 23.678 -7.841 1.00 0.00 C ATOM 0 H THR A 59 11.619 26.579 -5.125 1.00 0.00 H new ATOM 0 HA THR A 59 11.338 26.305 -8.020 1.00 0.00 H new ATOM 0 HB THR A 59 10.977 24.203 -5.835 1.00 0.00 H new ATOM 0 HG1 THR A 59 13.288 23.951 -5.979 1.00 0.00 H new ATOM 0 HG21 THR A 59 11.949 22.718 -7.552 1.00 0.00 H new ATOM 0 HG22 THR A 59 10.490 23.535 -8.161 1.00 0.00 H new ATOM 0 HG23 THR A 59 12.102 24.100 -8.662 1.00 0.00 H new ATOM 994 N LEU A 60 8.740 25.688 -6.066 1.00 0.00 N ATOM 995 CA LEU A 60 7.256 25.498 -6.134 1.00 0.00 C ATOM 996 C LEU A 60 6.529 26.837 -6.104 1.00 0.00 C ATOM 997 O LEU A 60 5.356 26.911 -6.404 1.00 0.00 O ATOM 998 CB LEU A 60 6.790 24.661 -4.942 1.00 0.00 C ATOM 999 CG LEU A 60 7.636 23.390 -4.825 1.00 0.00 C ATOM 1000 CD1 LEU A 60 7.039 22.495 -3.737 1.00 0.00 C ATOM 1001 CD2 LEU A 60 7.648 22.636 -6.163 1.00 0.00 C ATOM 0 H LEU A 60 9.134 25.692 -5.125 1.00 0.00 H new ATOM 0 HA LEU A 60 7.024 24.990 -7.070 1.00 0.00 H new ATOM 0 HB2 LEU A 60 6.869 25.245 -4.025 1.00 0.00 H new ATOM 0 HB3 LEU A 60 5.739 24.397 -5.062 1.00 0.00 H new ATOM 0 HG LEU A 60 8.660 23.659 -4.566 1.00 0.00 H new ATOM 0 HD11 LEU A 60 7.635 21.587 -3.646 1.00 0.00 H new ATOM 0 HD12 LEU A 60 7.041 23.028 -2.786 1.00 0.00 H new ATOM 0 HD13 LEU A 60 6.015 22.232 -4.003 1.00 0.00 H new ATOM 0 HD21 LEU A 60 8.253 21.734 -6.067 1.00 0.00 H new ATOM 0 HD22 LEU A 60 6.629 22.362 -6.435 1.00 0.00 H new ATOM 0 HD23 LEU A 60 8.071 23.276 -6.937 1.00 0.00 H new ATOM 1013 N ASP A 61 7.196 27.898 -5.758 1.00 0.00 N ATOM 1014 CA ASP A 61 6.493 29.212 -5.737 1.00 0.00 C ATOM 1015 C ASP A 61 6.452 29.723 -7.163 1.00 0.00 C ATOM 1016 O ASP A 61 6.989 30.762 -7.494 1.00 0.00 O ATOM 1017 CB ASP A 61 7.219 30.216 -4.840 1.00 0.00 C ATOM 1018 CG ASP A 61 6.305 31.415 -4.582 1.00 0.00 C ATOM 1019 OD1 ASP A 61 5.276 31.501 -5.235 1.00 0.00 O ATOM 1020 OD2 ASP A 61 6.650 32.226 -3.739 1.00 0.00 O ATOM 0 H ASP A 61 8.181 27.917 -5.493 1.00 0.00 H new ATOM 0 HA ASP A 61 5.488 29.090 -5.334 1.00 0.00 H new ATOM 0 HB2 ASP A 61 7.495 29.745 -3.897 1.00 0.00 H new ATOM 0 HB3 ASP A 61 8.143 30.544 -5.315 1.00 0.00 H new ATOM 1025 N GLU A 62 5.822 28.972 -8.010 1.00 0.00 N ATOM 1026 CA GLU A 62 5.730 29.356 -9.438 1.00 0.00 C ATOM 1027 C GLU A 62 5.039 30.714 -9.535 1.00 0.00 C ATOM 1028 O GLU A 62 5.421 31.564 -10.315 1.00 0.00 O ATOM 1029 CB GLU A 62 4.905 28.305 -10.174 1.00 0.00 C ATOM 1030 CG GLU A 62 5.503 26.918 -9.914 1.00 0.00 C ATOM 1031 CD GLU A 62 4.721 25.869 -10.707 1.00 0.00 C ATOM 1032 OE1 GLU A 62 3.682 26.215 -11.244 1.00 0.00 O ATOM 1033 OE2 GLU A 62 5.176 24.739 -10.765 1.00 0.00 O ATOM 0 H GLU A 62 5.360 28.095 -7.771 1.00 0.00 H new ATOM 0 HA GLU A 62 6.723 29.419 -9.883 1.00 0.00 H new ATOM 0 HB2 GLU A 62 3.869 28.336 -9.835 1.00 0.00 H new ATOM 0 HB3 GLU A 62 4.897 28.516 -11.243 1.00 0.00 H new ATOM 0 HG2 GLU A 62 6.553 26.902 -10.206 1.00 0.00 H new ATOM 0 HG3 GLU A 62 5.465 26.688 -8.849 1.00 0.00 H new ATOM 1040 N ASP A 63 4.032 30.926 -8.739 1.00 0.00 N ATOM 1041 CA ASP A 63 3.322 32.232 -8.770 1.00 0.00 C ATOM 1042 C ASP A 63 4.197 33.282 -8.080 1.00 0.00 C ATOM 1043 O ASP A 63 3.941 34.468 -8.157 1.00 0.00 O ATOM 1044 CB ASP A 63 1.994 32.100 -8.022 1.00 0.00 C ATOM 1045 CG ASP A 63 1.111 31.075 -8.733 1.00 0.00 C ATOM 1046 OD1 ASP A 63 0.912 31.220 -9.928 1.00 0.00 O ATOM 1047 OD2 ASP A 63 0.657 30.156 -8.072 1.00 0.00 O ATOM 0 HA ASP A 63 3.128 32.531 -9.800 1.00 0.00 H new ATOM 0 HB2 ASP A 63 2.173 31.790 -6.992 1.00 0.00 H new ATOM 0 HB3 ASP A 63 1.489 33.065 -7.981 1.00 0.00 H new ATOM 1052 N GLY A 64 5.237 32.851 -7.416 1.00 0.00 N ATOM 1053 CA GLY A 64 6.144 33.819 -6.729 1.00 0.00 C ATOM 1054 C GLY A 64 5.365 34.608 -5.673 1.00 0.00 C ATOM 1055 O GLY A 64 5.666 35.755 -5.406 1.00 0.00 O ATOM 0 H GLY A 64 5.498 31.870 -7.319 1.00 0.00 H new ATOM 0 HA2 GLY A 64 6.970 33.285 -6.260 1.00 0.00 H new ATOM 0 HA3 GLY A 64 6.579 34.503 -7.458 1.00 0.00 H new ATOM 1059 N ASP A 65 4.361 34.010 -5.074 1.00 0.00 N ATOM 1060 CA ASP A 65 3.552 34.730 -4.037 1.00 0.00 C ATOM 1061 C ASP A 65 3.868 34.180 -2.647 1.00 0.00 C ATOM 1062 O ASP A 65 3.227 34.527 -1.675 1.00 0.00 O ATOM 1063 CB ASP A 65 2.066 34.531 -4.340 1.00 0.00 C ATOM 1064 CG ASP A 65 1.758 33.036 -4.434 1.00 0.00 C ATOM 1065 OD1 ASP A 65 2.697 32.260 -4.491 1.00 0.00 O ATOM 1066 OD2 ASP A 65 0.587 32.692 -4.450 1.00 0.00 O ATOM 0 H ASP A 65 4.066 33.051 -5.259 1.00 0.00 H new ATOM 0 HA ASP A 65 3.798 35.792 -4.059 1.00 0.00 H new ATOM 0 HB2 ASP A 65 1.460 34.989 -3.558 1.00 0.00 H new ATOM 0 HB3 ASP A 65 1.806 35.026 -5.276 1.00 0.00 H new ATOM 1071 N GLY A 66 4.835 33.315 -2.540 1.00 0.00 N ATOM 1072 CA GLY A 66 5.163 32.739 -1.207 1.00 0.00 C ATOM 1073 C GLY A 66 4.123 31.667 -0.882 1.00 0.00 C ATOM 1074 O GLY A 66 4.054 31.154 0.217 1.00 0.00 O ATOM 0 H GLY A 66 5.411 32.982 -3.314 1.00 0.00 H new ATOM 0 HA2 GLY A 66 6.164 32.308 -1.215 1.00 0.00 H new ATOM 0 HA3 GLY A 66 5.158 33.518 -0.444 1.00 0.00 H new ATOM 1078 N GLU A 67 3.308 31.339 -1.848 1.00 0.00 N ATOM 1079 CA GLU A 67 2.244 30.314 -1.656 1.00 0.00 C ATOM 1080 C GLU A 67 2.154 29.447 -2.919 1.00 0.00 C ATOM 1081 O GLU A 67 2.210 29.951 -4.024 1.00 0.00 O ATOM 1082 CB GLU A 67 0.906 31.031 -1.441 1.00 0.00 C ATOM 1083 CG GLU A 67 0.984 31.913 -0.193 1.00 0.00 C ATOM 1084 CD GLU A 67 -0.353 32.626 0.019 1.00 0.00 C ATOM 1085 OE1 GLU A 67 -1.190 32.552 -0.866 1.00 0.00 O ATOM 1086 OE2 GLU A 67 -0.520 33.231 1.066 1.00 0.00 O ATOM 0 H GLU A 67 3.337 31.748 -2.782 1.00 0.00 H new ATOM 0 HA GLU A 67 2.474 29.687 -0.795 1.00 0.00 H new ATOM 0 HB2 GLU A 67 0.665 31.639 -2.313 1.00 0.00 H new ATOM 0 HB3 GLU A 67 0.105 30.300 -1.331 1.00 0.00 H new ATOM 0 HG2 GLU A 67 1.225 31.305 0.679 1.00 0.00 H new ATOM 0 HG3 GLU A 67 1.784 32.645 -0.303 1.00 0.00 H new ATOM 1093 N CYS A 68 2.000 28.150 -2.767 1.00 0.00 N ATOM 1094 CA CYS A 68 1.887 27.240 -3.957 1.00 0.00 C ATOM 1095 C CYS A 68 0.468 26.661 -3.996 1.00 0.00 C ATOM 1096 O CYS A 68 -0.041 26.161 -3.013 1.00 0.00 O ATOM 1097 CB CYS A 68 2.935 26.100 -3.865 1.00 0.00 C ATOM 1098 SG CYS A 68 3.606 26.019 -2.185 1.00 0.00 S ATOM 0 H CYS A 68 1.947 27.679 -1.864 1.00 0.00 H new ATOM 0 HA CYS A 68 2.080 27.801 -4.871 1.00 0.00 H new ATOM 0 HB2 CYS A 68 2.475 25.148 -4.129 1.00 0.00 H new ATOM 0 HB3 CYS A 68 3.739 26.274 -4.580 1.00 0.00 H new ATOM 0 HG CYS A 68 4.741 25.386 -2.201 1.00 0.00 H new ATOM 1104 N ASP A 69 -0.165 26.733 -5.129 1.00 0.00 N ATOM 1105 CA ASP A 69 -1.547 26.202 -5.263 1.00 0.00 C ATOM 1106 C ASP A 69 -1.507 24.677 -5.203 1.00 0.00 C ATOM 1107 O ASP A 69 -0.484 24.068 -5.449 1.00 0.00 O ATOM 1108 CB ASP A 69 -2.118 26.629 -6.619 1.00 0.00 C ATOM 1109 CG ASP A 69 -2.374 28.137 -6.625 1.00 0.00 C ATOM 1110 OD1 ASP A 69 -2.472 28.706 -5.554 1.00 0.00 O ATOM 1111 OD2 ASP A 69 -2.466 28.697 -7.705 1.00 0.00 O ATOM 0 H ASP A 69 0.221 27.143 -5.980 1.00 0.00 H new ATOM 0 HA ASP A 69 -2.169 26.589 -4.456 1.00 0.00 H new ATOM 0 HB2 ASP A 69 -1.422 26.366 -7.415 1.00 0.00 H new ATOM 0 HB3 ASP A 69 -3.046 26.093 -6.818 1.00 0.00 H new ATOM 1116 N PHE A 70 -2.616 24.047 -4.905 1.00 0.00 N ATOM 1117 CA PHE A 70 -2.647 22.564 -4.863 1.00 0.00 C ATOM 1118 C PHE A 70 -1.973 22.046 -6.137 1.00 0.00 C ATOM 1119 O PHE A 70 -1.264 21.066 -6.122 1.00 0.00 O ATOM 1120 CB PHE A 70 -4.116 22.122 -4.782 1.00 0.00 C ATOM 1121 CG PHE A 70 -4.283 20.689 -5.236 1.00 0.00 C ATOM 1122 CD1 PHE A 70 -3.405 19.697 -4.786 1.00 0.00 C ATOM 1123 CD2 PHE A 70 -5.327 20.357 -6.106 1.00 0.00 C ATOM 1124 CE1 PHE A 70 -3.571 18.375 -5.209 1.00 0.00 C ATOM 1125 CE2 PHE A 70 -5.493 19.038 -6.528 1.00 0.00 C ATOM 1126 CZ PHE A 70 -4.616 18.044 -6.080 1.00 0.00 C ATOM 0 H PHE A 70 -3.502 24.504 -4.689 1.00 0.00 H new ATOM 0 HA PHE A 70 -2.117 22.164 -3.999 1.00 0.00 H new ATOM 0 HB2 PHE A 70 -4.473 22.225 -3.757 1.00 0.00 H new ATOM 0 HB3 PHE A 70 -4.730 22.776 -5.401 1.00 0.00 H new ATOM 0 HD1 PHE A 70 -2.600 19.952 -4.113 1.00 0.00 H new ATOM 0 HD2 PHE A 70 -6.005 21.123 -6.451 1.00 0.00 H new ATOM 0 HE1 PHE A 70 -2.893 17.609 -4.864 1.00 0.00 H new ATOM 0 HE2 PHE A 70 -6.299 18.784 -7.201 1.00 0.00 H new ATOM 0 HZ PHE A 70 -4.745 17.022 -6.406 1.00 0.00 H new ATOM 1136 N GLN A 71 -2.176 22.730 -7.230 1.00 0.00 N ATOM 1137 CA GLN A 71 -1.529 22.328 -8.511 1.00 0.00 C ATOM 1138 C GLN A 71 -0.001 22.356 -8.355 1.00 0.00 C ATOM 1139 O GLN A 71 0.691 21.432 -8.726 1.00 0.00 O ATOM 1140 CB GLN A 71 -1.959 23.318 -9.607 1.00 0.00 C ATOM 1141 CG GLN A 71 -1.055 23.180 -10.839 1.00 0.00 C ATOM 1142 CD GLN A 71 -1.643 23.971 -12.012 1.00 0.00 C ATOM 1143 OE1 GLN A 71 -2.848 24.466 -11.921 1.00 0.00 O flip ATOM 1144 NE2 GLN A 71 -0.995 24.144 -13.026 1.00 0.00 N flip ATOM 0 H GLN A 71 -2.768 23.558 -7.290 1.00 0.00 H new ATOM 0 HA GLN A 71 -1.834 21.317 -8.781 1.00 0.00 H new ATOM 0 HB2 GLN A 71 -2.996 23.132 -9.887 1.00 0.00 H new ATOM 0 HB3 GLN A 71 -1.910 24.337 -9.224 1.00 0.00 H new ATOM 0 HG2 GLN A 71 -0.054 23.545 -10.609 1.00 0.00 H new ATOM 0 HG3 GLN A 71 -0.956 22.129 -11.112 1.00 0.00 H new ATOM 0 HE21 GLN A 71 -0.053 23.759 -13.101 1.00 0.00 H new ATOM 0 HE22 GLN A 71 -1.393 24.674 -13.801 1.00 0.00 H new ATOM 1153 N GLU A 72 0.529 23.426 -7.836 1.00 0.00 N ATOM 1154 CA GLU A 72 2.007 23.533 -7.682 1.00 0.00 C ATOM 1155 C GLU A 72 2.539 22.411 -6.783 1.00 0.00 C ATOM 1156 O GLU A 72 3.579 21.831 -7.046 1.00 0.00 O ATOM 1157 CB GLU A 72 2.336 24.903 -7.086 1.00 0.00 C ATOM 1158 CG GLU A 72 2.087 25.984 -8.141 1.00 0.00 C ATOM 1159 CD GLU A 72 2.343 27.369 -7.540 1.00 0.00 C ATOM 1160 OE1 GLU A 72 3.488 27.787 -7.532 1.00 0.00 O ATOM 1161 OE2 GLU A 72 1.388 27.991 -7.105 1.00 0.00 O ATOM 0 H GLU A 72 0.001 24.235 -7.510 1.00 0.00 H new ATOM 0 HA GLU A 72 2.487 23.431 -8.655 1.00 0.00 H new ATOM 0 HB2 GLU A 72 1.719 25.088 -6.206 1.00 0.00 H new ATOM 0 HB3 GLU A 72 3.375 24.930 -6.758 1.00 0.00 H new ATOM 0 HG2 GLU A 72 2.740 25.824 -8.999 1.00 0.00 H new ATOM 0 HG3 GLU A 72 1.061 25.920 -8.505 1.00 0.00 H new ATOM 1168 N PHE A 73 1.837 22.087 -5.737 1.00 0.00 N ATOM 1169 CA PHE A 73 2.307 20.994 -4.841 1.00 0.00 C ATOM 1170 C PHE A 73 2.237 19.661 -5.586 1.00 0.00 C ATOM 1171 O PHE A 73 3.017 18.764 -5.342 1.00 0.00 O ATOM 1172 CB PHE A 73 1.430 20.927 -3.584 1.00 0.00 C ATOM 1173 CG PHE A 73 1.772 19.676 -2.805 1.00 0.00 C ATOM 1174 CD1 PHE A 73 2.782 19.704 -1.839 1.00 0.00 C ATOM 1175 CD2 PHE A 73 1.084 18.484 -3.064 1.00 0.00 C ATOM 1176 CE1 PHE A 73 3.106 18.540 -1.131 1.00 0.00 C ATOM 1177 CE2 PHE A 73 1.405 17.321 -2.355 1.00 0.00 C ATOM 1178 CZ PHE A 73 2.417 17.349 -1.389 1.00 0.00 C ATOM 0 H PHE A 73 0.960 22.529 -5.462 1.00 0.00 H new ATOM 0 HA PHE A 73 3.336 21.195 -4.544 1.00 0.00 H new ATOM 0 HB2 PHE A 73 1.591 21.810 -2.966 1.00 0.00 H new ATOM 0 HB3 PHE A 73 0.376 20.920 -3.861 1.00 0.00 H new ATOM 0 HD1 PHE A 73 3.312 20.623 -1.639 1.00 0.00 H new ATOM 0 HD2 PHE A 73 0.305 18.462 -3.812 1.00 0.00 H new ATOM 0 HE1 PHE A 73 3.887 18.561 -0.386 1.00 0.00 H new ATOM 0 HE2 PHE A 73 0.872 16.403 -2.553 1.00 0.00 H new ATOM 0 HZ PHE A 73 2.667 16.452 -0.842 1.00 0.00 H new ATOM 1188 N MET A 74 1.298 19.520 -6.477 1.00 0.00 N ATOM 1189 CA MET A 74 1.164 18.239 -7.218 1.00 0.00 C ATOM 1190 C MET A 74 2.451 17.963 -7.991 1.00 0.00 C ATOM 1191 O MET A 74 2.871 16.832 -8.134 1.00 0.00 O ATOM 1192 CB MET A 74 -0.017 18.309 -8.199 1.00 0.00 C ATOM 1193 CG MET A 74 -1.368 18.324 -7.434 1.00 0.00 C ATOM 1194 SD MET A 74 -2.462 17.030 -8.084 1.00 0.00 S ATOM 1195 CE MET A 74 -1.430 15.605 -7.646 1.00 0.00 C ATOM 0 H MET A 74 0.617 20.238 -6.724 1.00 0.00 H new ATOM 0 HA MET A 74 0.982 17.436 -6.504 1.00 0.00 H new ATOM 0 HB2 MET A 74 0.068 19.205 -8.814 1.00 0.00 H new ATOM 0 HB3 MET A 74 0.014 17.454 -8.875 1.00 0.00 H new ATOM 0 HG2 MET A 74 -1.195 18.165 -6.370 1.00 0.00 H new ATOM 0 HG3 MET A 74 -1.843 19.300 -7.537 1.00 0.00 H new ATOM 0 HE1 MET A 74 -1.021 15.160 -8.553 1.00 0.00 H new ATOM 0 HE2 MET A 74 -0.613 15.931 -7.002 1.00 0.00 H new ATOM 0 HE3 MET A 74 -2.034 14.866 -7.120 1.00 0.00 H new ATOM 1205 N ALA A 75 3.074 18.980 -8.512 1.00 0.00 N ATOM 1206 CA ALA A 75 4.323 18.747 -9.288 1.00 0.00 C ATOM 1207 C ALA A 75 5.464 18.314 -8.357 1.00 0.00 C ATOM 1208 O ALA A 75 6.320 17.539 -8.729 1.00 0.00 O ATOM 1209 CB ALA A 75 4.707 20.023 -10.044 1.00 0.00 C ATOM 0 H ALA A 75 2.778 19.953 -8.436 1.00 0.00 H new ATOM 0 HA ALA A 75 4.147 17.946 -10.006 1.00 0.00 H new ATOM 0 HB1 ALA A 75 5.622 19.849 -10.611 1.00 0.00 H new ATOM 0 HB2 ALA A 75 3.903 20.297 -10.727 1.00 0.00 H new ATOM 0 HB3 ALA A 75 4.870 20.832 -9.332 1.00 0.00 H new ATOM 1215 N PHE A 76 5.481 18.797 -7.152 1.00 0.00 N ATOM 1216 CA PHE A 76 6.563 18.397 -6.199 1.00 0.00 C ATOM 1217 C PHE A 76 6.526 16.887 -5.988 1.00 0.00 C ATOM 1218 O PHE A 76 7.540 16.230 -5.908 1.00 0.00 O ATOM 1219 CB PHE A 76 6.330 19.118 -4.870 1.00 0.00 C ATOM 1220 CG PHE A 76 7.384 18.723 -3.860 1.00 0.00 C ATOM 1221 CD1 PHE A 76 8.691 19.210 -3.979 1.00 0.00 C ATOM 1222 CD2 PHE A 76 7.047 17.880 -2.792 1.00 0.00 C ATOM 1223 CE1 PHE A 76 9.660 18.853 -3.032 1.00 0.00 C ATOM 1224 CE2 PHE A 76 8.015 17.522 -1.848 1.00 0.00 C ATOM 1225 CZ PHE A 76 9.321 18.009 -1.967 1.00 0.00 C ATOM 0 H PHE A 76 4.795 19.453 -6.779 1.00 0.00 H new ATOM 0 HA PHE A 76 7.539 18.670 -6.601 1.00 0.00 H new ATOM 0 HB2 PHE A 76 6.354 20.197 -5.026 1.00 0.00 H new ATOM 0 HB3 PHE A 76 5.340 18.873 -4.486 1.00 0.00 H new ATOM 0 HD1 PHE A 76 8.952 19.861 -4.800 1.00 0.00 H new ATOM 0 HD2 PHE A 76 6.038 17.506 -2.698 1.00 0.00 H new ATOM 0 HE1 PHE A 76 10.668 19.229 -3.123 1.00 0.00 H new ATOM 0 HE2 PHE A 76 7.754 16.870 -1.028 1.00 0.00 H new ATOM 0 HZ PHE A 76 10.068 17.734 -1.237 1.00 0.00 H new ATOM 1235 N VAL A 77 5.357 16.350 -5.894 1.00 0.00 N ATOM 1236 CA VAL A 77 5.197 14.883 -5.683 1.00 0.00 C ATOM 1237 C VAL A 77 5.767 14.134 -6.881 1.00 0.00 C ATOM 1238 O VAL A 77 6.311 13.063 -6.757 1.00 0.00 O ATOM 1239 CB VAL A 77 3.697 14.536 -5.542 1.00 0.00 C ATOM 1240 CG1 VAL A 77 3.516 13.388 -4.550 1.00 0.00 C ATOM 1241 CG2 VAL A 77 2.931 15.762 -5.053 1.00 0.00 C ATOM 0 H VAL A 77 4.481 16.869 -5.955 1.00 0.00 H new ATOM 0 HA VAL A 77 5.727 14.592 -4.776 1.00 0.00 H new ATOM 0 HB VAL A 77 3.310 14.230 -6.514 1.00 0.00 H new ATOM 0 HG11 VAL A 77 2.456 13.151 -4.457 1.00 0.00 H new ATOM 0 HG12 VAL A 77 4.054 12.510 -4.907 1.00 0.00 H new ATOM 0 HG13 VAL A 77 3.908 13.683 -3.577 1.00 0.00 H new ATOM 0 HG21 VAL A 77 1.874 15.515 -4.954 1.00 0.00 H new ATOM 0 HG22 VAL A 77 3.323 16.073 -4.085 1.00 0.00 H new ATOM 0 HG23 VAL A 77 3.048 16.574 -5.770 1.00 0.00 H new ATOM 1251 N SER A 78 5.597 14.679 -8.043 1.00 0.00 N ATOM 1252 CA SER A 78 6.083 13.996 -9.265 1.00 0.00 C ATOM 1253 C SER A 78 7.600 13.824 -9.218 1.00 0.00 C ATOM 1254 O SER A 78 8.122 12.794 -9.599 1.00 0.00 O ATOM 1255 CB SER A 78 5.697 14.828 -10.491 1.00 0.00 C ATOM 1256 OG SER A 78 6.556 14.502 -11.573 1.00 0.00 O ATOM 0 H SER A 78 5.138 15.576 -8.202 1.00 0.00 H new ATOM 0 HA SER A 78 5.626 13.009 -9.326 1.00 0.00 H new ATOM 0 HB2 SER A 78 4.660 14.633 -10.764 1.00 0.00 H new ATOM 0 HB3 SER A 78 5.772 15.891 -10.261 1.00 0.00 H new ATOM 0 HG SER A 78 6.916 15.325 -11.964 1.00 0.00 H new ATOM 1262 N MET A 79 8.327 14.817 -8.778 1.00 0.00 N ATOM 1263 CA MET A 79 9.814 14.658 -8.757 1.00 0.00 C ATOM 1264 C MET A 79 10.262 13.758 -7.610 1.00 0.00 C ATOM 1265 O MET A 79 11.157 12.951 -7.758 1.00 0.00 O ATOM 1266 CB MET A 79 10.506 16.009 -8.586 1.00 0.00 C ATOM 1267 CG MET A 79 10.150 16.959 -9.734 1.00 0.00 C ATOM 1268 SD MET A 79 11.477 18.179 -9.934 1.00 0.00 S ATOM 1269 CE MET A 79 11.709 18.597 -8.186 1.00 0.00 C ATOM 0 H MET A 79 7.969 15.710 -8.440 1.00 0.00 H new ATOM 0 HA MET A 79 10.092 14.209 -9.710 1.00 0.00 H new ATOM 0 HB2 MET A 79 10.211 16.455 -7.636 1.00 0.00 H new ATOM 0 HB3 MET A 79 11.586 15.866 -8.549 1.00 0.00 H new ATOM 0 HG2 MET A 79 10.015 16.397 -10.658 1.00 0.00 H new ATOM 0 HG3 MET A 79 9.206 17.462 -9.526 1.00 0.00 H new ATOM 0 HE1 MET A 79 12.196 19.569 -8.106 1.00 0.00 H new ATOM 0 HE2 MET A 79 10.740 18.635 -7.689 1.00 0.00 H new ATOM 0 HE3 MET A 79 12.331 17.839 -7.710 1.00 0.00 H new ATOM 1279 N VAL A 80 9.680 13.911 -6.458 1.00 0.00 N ATOM 1280 CA VAL A 80 10.122 13.078 -5.300 1.00 0.00 C ATOM 1281 C VAL A 80 9.843 11.601 -5.584 1.00 0.00 C ATOM 1282 O VAL A 80 10.608 10.730 -5.222 1.00 0.00 O ATOM 1283 CB VAL A 80 9.394 13.495 -4.021 1.00 0.00 C ATOM 1284 CG1 VAL A 80 10.010 12.740 -2.840 1.00 0.00 C ATOM 1285 CG2 VAL A 80 9.534 15.009 -3.793 1.00 0.00 C ATOM 0 H VAL A 80 8.925 14.568 -6.264 1.00 0.00 H new ATOM 0 HA VAL A 80 11.192 13.230 -5.160 1.00 0.00 H new ATOM 0 HB VAL A 80 8.335 13.256 -4.112 1.00 0.00 H new ATOM 0 HG11 VAL A 80 9.501 13.027 -1.920 1.00 0.00 H new ATOM 0 HG12 VAL A 80 9.899 11.667 -2.997 1.00 0.00 H new ATOM 0 HG13 VAL A 80 11.069 12.988 -2.762 1.00 0.00 H new ATOM 0 HG21 VAL A 80 9.010 15.289 -2.879 1.00 0.00 H new ATOM 0 HG22 VAL A 80 10.589 15.267 -3.701 1.00 0.00 H new ATOM 0 HG23 VAL A 80 9.102 15.546 -4.638 1.00 0.00 H new ATOM 1295 N THR A 81 8.748 11.318 -6.226 1.00 0.00 N ATOM 1296 CA THR A 81 8.399 9.903 -6.538 1.00 0.00 C ATOM 1297 C THR A 81 9.494 9.307 -7.395 1.00 0.00 C ATOM 1298 O THR A 81 9.882 8.165 -7.247 1.00 0.00 O ATOM 1299 CB THR A 81 7.095 9.850 -7.333 1.00 0.00 C ATOM 1300 OG1 THR A 81 6.050 10.429 -6.572 1.00 0.00 O ATOM 1301 CG2 THR A 81 6.756 8.391 -7.671 1.00 0.00 C ATOM 0 H THR A 81 8.073 12.010 -6.552 1.00 0.00 H new ATOM 0 HA THR A 81 8.288 9.350 -5.606 1.00 0.00 H new ATOM 0 HB THR A 81 7.211 10.411 -8.260 1.00 0.00 H new ATOM 0 HG1 THR A 81 6.125 11.406 -6.603 1.00 0.00 H new ATOM 0 HG21 THR A 81 5.826 8.356 -8.238 1.00 0.00 H new ATOM 0 HG22 THR A 81 7.560 7.959 -8.266 1.00 0.00 H new ATOM 0 HG23 THR A 81 6.641 7.821 -6.749 1.00 0.00 H new ATOM 1309 N THR A 82 9.980 10.083 -8.302 1.00 0.00 N ATOM 1310 CA THR A 82 11.040 9.606 -9.205 1.00 0.00 C ATOM 1311 C THR A 82 12.221 9.122 -8.357 1.00 0.00 C ATOM 1312 O THR A 82 12.843 8.119 -8.651 1.00 0.00 O ATOM 1313 CB THR A 82 11.451 10.771 -10.101 1.00 0.00 C ATOM 1314 OG1 THR A 82 10.281 11.429 -10.567 1.00 0.00 O ATOM 1315 CG2 THR A 82 12.236 10.248 -11.297 1.00 0.00 C ATOM 0 H THR A 82 9.682 11.046 -8.459 1.00 0.00 H new ATOM 0 HA THR A 82 10.697 8.779 -9.827 1.00 0.00 H new ATOM 0 HB THR A 82 12.073 11.464 -9.534 1.00 0.00 H new ATOM 0 HG1 THR A 82 9.643 10.764 -10.902 1.00 0.00 H new ATOM 0 HG21 THR A 82 12.528 11.083 -11.934 1.00 0.00 H new ATOM 0 HG22 THR A 82 13.129 9.729 -10.948 1.00 0.00 H new ATOM 0 HG23 THR A 82 11.614 9.557 -11.866 1.00 0.00 H new ATOM 1323 N ALA A 83 12.515 9.813 -7.288 1.00 0.00 N ATOM 1324 CA ALA A 83 13.632 9.382 -6.399 1.00 0.00 C ATOM 1325 C ALA A 83 13.333 7.976 -5.863 1.00 0.00 C ATOM 1326 O ALA A 83 14.213 7.148 -5.732 1.00 0.00 O ATOM 1327 CB ALA A 83 13.760 10.361 -5.228 1.00 0.00 C ATOM 0 H ALA A 83 12.028 10.659 -6.992 1.00 0.00 H new ATOM 0 HA ALA A 83 14.566 9.369 -6.961 1.00 0.00 H new ATOM 0 HB1 ALA A 83 14.576 10.046 -4.578 1.00 0.00 H new ATOM 0 HB2 ALA A 83 13.966 11.361 -5.610 1.00 0.00 H new ATOM 0 HB3 ALA A 83 12.829 10.374 -4.661 1.00 0.00 H new ATOM 1333 N CYS A 84 12.093 7.709 -5.546 1.00 0.00 N ATOM 1334 CA CYS A 84 11.719 6.367 -5.008 1.00 0.00 C ATOM 1335 C CYS A 84 12.068 5.288 -6.032 1.00 0.00 C ATOM 1336 O CYS A 84 12.471 4.196 -5.682 1.00 0.00 O ATOM 1337 CB CYS A 84 10.214 6.325 -4.740 1.00 0.00 C ATOM 1338 SG CYS A 84 9.725 7.791 -3.800 1.00 0.00 S ATOM 0 H CYS A 84 11.319 8.367 -5.637 1.00 0.00 H new ATOM 0 HA CYS A 84 12.266 6.188 -4.082 1.00 0.00 H new ATOM 0 HB2 CYS A 84 9.667 6.286 -5.682 1.00 0.00 H new ATOM 0 HB3 CYS A 84 9.958 5.422 -4.185 1.00 0.00 H new ATOM 0 HG CYS A 84 10.037 8.860 -4.470 1.00 0.00 H new ATOM 1344 N HIS A 85 11.916 5.577 -7.295 1.00 0.00 N ATOM 1345 CA HIS A 85 12.241 4.556 -8.327 1.00 0.00 C ATOM 1346 C HIS A 85 13.711 4.172 -8.194 1.00 0.00 C ATOM 1347 O HIS A 85 14.071 3.015 -8.279 1.00 0.00 O ATOM 1348 CB HIS A 85 11.991 5.147 -9.714 1.00 0.00 C ATOM 1349 CG HIS A 85 12.421 4.166 -10.769 1.00 0.00 C ATOM 1350 ND1 HIS A 85 13.259 4.528 -11.814 1.00 0.00 N ATOM 1351 CD2 HIS A 85 12.146 2.833 -10.952 1.00 0.00 C ATOM 1352 CE1 HIS A 85 13.458 3.434 -12.573 1.00 0.00 C ATOM 1353 NE2 HIS A 85 12.803 2.377 -12.090 1.00 0.00 N ATOM 0 H HIS A 85 11.583 6.471 -7.655 1.00 0.00 H new ATOM 0 HA HIS A 85 11.616 3.674 -8.191 1.00 0.00 H new ATOM 0 HB2 HIS A 85 10.934 5.384 -9.834 1.00 0.00 H new ATOM 0 HB3 HIS A 85 12.542 6.081 -9.826 1.00 0.00 H new ATOM 0 HD2 HIS A 85 11.517 2.232 -10.312 1.00 0.00 H new ATOM 0 HE1 HIS A 85 14.071 3.415 -13.462 1.00 0.00 H new ATOM 0 HE2 HIS A 85 12.787 1.432 -12.475 1.00 0.00 H new ATOM 1362 N GLU A 86 14.560 5.128 -7.957 1.00 0.00 N ATOM 1363 CA GLU A 86 15.999 4.806 -7.786 1.00 0.00 C ATOM 1364 C GLU A 86 16.141 3.863 -6.587 1.00 0.00 C ATOM 1365 O GLU A 86 16.917 2.929 -6.601 1.00 0.00 O ATOM 1366 CB GLU A 86 16.793 6.098 -7.548 1.00 0.00 C ATOM 1367 CG GLU A 86 18.285 5.783 -7.389 1.00 0.00 C ATOM 1368 CD GLU A 86 18.825 5.154 -8.677 1.00 0.00 C ATOM 1369 OE1 GLU A 86 18.198 5.330 -9.709 1.00 0.00 O ATOM 1370 OE2 GLU A 86 19.856 4.507 -8.609 1.00 0.00 O ATOM 0 H GLU A 86 14.320 6.116 -7.874 1.00 0.00 H new ATOM 0 HA GLU A 86 16.390 4.324 -8.682 1.00 0.00 H new ATOM 0 HB2 GLU A 86 16.646 6.783 -8.383 1.00 0.00 H new ATOM 0 HB3 GLU A 86 16.423 6.601 -6.655 1.00 0.00 H new ATOM 0 HG2 GLU A 86 18.836 6.695 -7.161 1.00 0.00 H new ATOM 0 HG3 GLU A 86 18.435 5.102 -6.551 1.00 0.00 H new ATOM 1377 N PHE A 87 15.389 4.111 -5.547 1.00 0.00 N ATOM 1378 CA PHE A 87 15.461 3.242 -4.337 1.00 0.00 C ATOM 1379 C PHE A 87 14.680 1.949 -4.567 1.00 0.00 C ATOM 1380 O PHE A 87 15.155 0.865 -4.289 1.00 0.00 O ATOM 1381 CB PHE A 87 14.860 3.983 -3.141 1.00 0.00 C ATOM 1382 CG PHE A 87 14.925 3.101 -1.916 1.00 0.00 C ATOM 1383 CD1 PHE A 87 13.862 2.240 -1.619 1.00 0.00 C ATOM 1384 CD2 PHE A 87 16.046 3.143 -1.077 1.00 0.00 C ATOM 1385 CE1 PHE A 87 13.918 1.422 -0.484 1.00 0.00 C ATOM 1386 CE2 PHE A 87 16.102 2.324 0.058 1.00 0.00 C ATOM 1387 CZ PHE A 87 15.038 1.464 0.354 1.00 0.00 C ATOM 0 H PHE A 87 14.725 4.882 -5.484 1.00 0.00 H new ATOM 0 HA PHE A 87 16.505 3.000 -4.140 1.00 0.00 H new ATOM 0 HB2 PHE A 87 15.404 4.910 -2.963 1.00 0.00 H new ATOM 0 HB3 PHE A 87 13.826 4.256 -3.351 1.00 0.00 H new ATOM 0 HD1 PHE A 87 12.998 2.207 -2.266 1.00 0.00 H new ATOM 0 HD2 PHE A 87 16.867 3.807 -1.305 1.00 0.00 H new ATOM 0 HE1 PHE A 87 13.097 0.759 -0.255 1.00 0.00 H new ATOM 0 HE2 PHE A 87 16.966 2.356 0.705 1.00 0.00 H new ATOM 0 HZ PHE A 87 15.081 0.833 1.229 1.00 0.00 H new ATOM 1397 N PHE A 88 13.475 2.056 -5.064 1.00 0.00 N ATOM 1398 CA PHE A 88 12.644 0.841 -5.305 1.00 0.00 C ATOM 1399 C PHE A 88 12.806 0.404 -6.764 1.00 0.00 C ATOM 1400 O PHE A 88 11.898 0.509 -7.564 1.00 0.00 O ATOM 1401 CB PHE A 88 11.172 1.172 -4.986 1.00 0.00 C ATOM 1402 CG PHE A 88 10.231 0.148 -5.599 1.00 0.00 C ATOM 1403 CD1 PHE A 88 10.498 -1.224 -5.480 1.00 0.00 C ATOM 1404 CD2 PHE A 88 9.091 0.579 -6.295 1.00 0.00 C ATOM 1405 CE1 PHE A 88 9.627 -2.159 -6.052 1.00 0.00 C ATOM 1406 CE2 PHE A 88 8.224 -0.359 -6.868 1.00 0.00 C ATOM 1407 CZ PHE A 88 8.492 -1.727 -6.747 1.00 0.00 C ATOM 0 H PHE A 88 13.029 2.939 -5.314 1.00 0.00 H new ATOM 0 HA PHE A 88 12.965 0.022 -4.662 1.00 0.00 H new ATOM 0 HB2 PHE A 88 11.029 1.200 -3.906 1.00 0.00 H new ATOM 0 HB3 PHE A 88 10.930 2.165 -5.365 1.00 0.00 H new ATOM 0 HD1 PHE A 88 11.376 -1.559 -4.947 1.00 0.00 H new ATOM 0 HD2 PHE A 88 8.883 1.635 -6.389 1.00 0.00 H new ATOM 0 HE1 PHE A 88 9.831 -3.215 -5.957 1.00 0.00 H new ATOM 0 HE2 PHE A 88 7.347 -0.026 -7.404 1.00 0.00 H new ATOM 0 HZ PHE A 88 7.823 -2.450 -7.190 1.00 0.00 H new ATOM 1417 N GLU A 89 13.959 -0.095 -7.110 1.00 0.00 N ATOM 1418 CA GLU A 89 14.181 -0.550 -8.509 1.00 0.00 C ATOM 1419 C GLU A 89 13.563 -1.933 -8.683 1.00 0.00 C ATOM 1420 O GLU A 89 14.105 -2.929 -8.247 1.00 0.00 O ATOM 1421 CB GLU A 89 15.682 -0.640 -8.792 1.00 0.00 C ATOM 1422 CG GLU A 89 16.275 0.765 -8.893 1.00 0.00 C ATOM 1423 CD GLU A 89 15.776 1.438 -10.173 1.00 0.00 C ATOM 1424 OE1 GLU A 89 15.274 0.732 -11.032 1.00 0.00 O ATOM 1425 OE2 GLU A 89 15.904 2.646 -10.272 1.00 0.00 O ATOM 0 H GLU A 89 14.757 -0.207 -6.484 1.00 0.00 H new ATOM 0 HA GLU A 89 13.723 0.159 -9.198 1.00 0.00 H new ATOM 0 HB2 GLU A 89 16.178 -1.198 -7.998 1.00 0.00 H new ATOM 0 HB3 GLU A 89 15.854 -1.185 -9.720 1.00 0.00 H new ATOM 0 HG2 GLU A 89 15.988 1.356 -8.023 1.00 0.00 H new ATOM 0 HG3 GLU A 89 17.364 0.712 -8.898 1.00 0.00 H new ATOM 1432 N HIS A 90 12.431 -1.999 -9.317 1.00 0.00 N ATOM 1433 CA HIS A 90 11.772 -3.321 -9.523 1.00 0.00 C ATOM 1434 C HIS A 90 12.426 -4.044 -10.701 1.00 0.00 C ATOM 1435 O HIS A 90 12.107 -3.799 -11.847 1.00 0.00 O ATOM 1436 CB HIS A 90 10.286 -3.121 -9.826 1.00 0.00 C ATOM 1437 CG HIS A 90 9.627 -4.467 -9.956 1.00 0.00 C ATOM 1438 ND1 HIS A 90 9.441 -5.087 -11.185 1.00 0.00 N ATOM 1439 CD2 HIS A 90 9.120 -5.334 -9.019 1.00 0.00 C ATOM 1440 CE1 HIS A 90 8.847 -6.274 -10.955 1.00 0.00 C ATOM 1441 NE2 HIS A 90 8.631 -6.470 -9.654 1.00 0.00 N ATOM 0 H HIS A 90 11.931 -1.198 -9.703 1.00 0.00 H new ATOM 0 HA HIS A 90 11.883 -3.915 -8.616 1.00 0.00 H new ATOM 0 HB2 HIS A 90 9.814 -2.546 -9.030 1.00 0.00 H new ATOM 0 HB3 HIS A 90 10.163 -2.551 -10.747 1.00 0.00 H new ATOM 0 HD2 HIS A 90 9.104 -5.160 -7.953 1.00 0.00 H new ATOM 0 HE1 HIS A 90 8.579 -6.979 -11.728 1.00 0.00 H new ATOM 0 HE2 HIS A 90 8.198 -7.283 -9.216 1.00 0.00 H new ATOM 1450 N GLU A 91 13.332 -4.940 -10.427 1.00 0.00 N ATOM 1451 CA GLU A 91 13.998 -5.687 -11.531 1.00 0.00 C ATOM 1452 CB GLU A 91 15.265 -6.366 -11.006 1.00 0.00 C ATOM 1453 CG GLU A 91 16.323 -5.308 -10.691 1.00 0.00 C ATOM 1454 CD GLU A 91 17.531 -5.976 -10.032 1.00 0.00 C ATOM 1455 OE1 GLU A 91 17.492 -7.183 -9.857 1.00 0.00 O ATOM 1456 OE2 GLU A 91 18.472 -5.270 -9.711 1.00 0.00 O ATOM 0 H GLU A 91 13.640 -5.188 -9.487 1.00 0.00 H new ATOM 0 HB2 GLU A 91 15.036 -6.943 -10.110 1.00 0.00 H new ATOM 0 HB3 GLU A 91 15.647 -7.067 -11.748 1.00 0.00 H new ATOM 0 HG2 GLU A 91 16.629 -4.800 -11.606 1.00 0.00 H new ATOM 0 HG3 GLU A 91 15.907 -4.549 -10.029 1.00 0.00 H new TER 1463 GLU A 91 ATOM 1464 N MET B 0 -4.553 8.124 5.502 1.00 0.00 N ATOM 1465 CA MET B 0 -3.833 9.414 5.693 1.00 0.00 C ATOM 1466 C MET B 0 -2.323 9.181 5.601 1.00 0.00 C ATOM 1467 O MET B 0 -1.818 8.149 5.997 1.00 0.00 O ATOM 1468 CB MET B 0 -4.180 9.996 7.067 1.00 0.00 C ATOM 1469 CG MET B 0 -3.809 8.993 8.164 1.00 0.00 C ATOM 1470 SD MET B 0 -4.267 9.674 9.778 1.00 0.00 S ATOM 1471 CE MET B 0 -3.881 8.207 10.765 1.00 0.00 C ATOM 0 H1 MET B 0 -5.366 8.081 6.149 1.00 0.00 H new ATOM 0 H2 MET B 0 -4.888 8.056 4.520 1.00 0.00 H new ATOM 0 H3 MET B 0 -3.908 7.333 5.703 1.00 0.00 H new ATOM 0 HA MET B 0 -4.137 10.115 4.915 1.00 0.00 H new ATOM 0 HB2 MET B 0 -3.644 10.932 7.221 1.00 0.00 H new ATOM 0 HB3 MET B 0 -5.244 10.226 7.117 1.00 0.00 H new ATOM 0 HG2 MET B 0 -4.323 8.047 7.997 1.00 0.00 H new ATOM 0 HG3 MET B 0 -2.740 8.784 8.135 1.00 0.00 H new ATOM 0 HE1 MET B 0 -4.094 8.409 11.815 1.00 0.00 H new ATOM 0 HE2 MET B 0 -4.491 7.369 10.426 1.00 0.00 H new ATOM 0 HE3 MET B 0 -2.826 7.958 10.650 1.00 0.00 H new ATOM 1483 N SER B 1 -1.598 10.137 5.087 1.00 0.00 N ATOM 1484 CA SER B 1 -0.117 9.980 4.976 1.00 0.00 C ATOM 1485 C SER B 1 0.229 8.797 4.058 1.00 0.00 C ATOM 1486 O SER B 1 1.366 8.377 3.978 1.00 0.00 O ATOM 1487 CB SER B 1 0.473 9.742 6.371 1.00 0.00 C ATOM 1488 OG SER B 1 1.834 10.153 6.380 1.00 0.00 O ATOM 0 H SER B 1 -1.967 11.022 4.738 1.00 0.00 H new ATOM 0 HA SER B 1 0.306 10.889 4.547 1.00 0.00 H new ATOM 0 HB2 SER B 1 -0.092 10.299 7.118 1.00 0.00 H new ATOM 0 HB3 SER B 1 0.398 8.687 6.636 1.00 0.00 H new ATOM 0 HG SER B 1 2.290 9.790 5.592 1.00 0.00 H new ATOM 1494 N GLU B 2 -0.734 8.270 3.354 1.00 0.00 N ATOM 1495 CA GLU B 2 -0.452 7.131 2.430 1.00 0.00 C ATOM 1496 C GLU B 2 0.220 7.666 1.185 1.00 0.00 C ATOM 1497 O GLU B 2 0.157 7.081 0.122 1.00 0.00 O ATOM 1498 CB GLU B 2 -1.755 6.442 2.058 1.00 0.00 C ATOM 1499 CG GLU B 2 -2.326 5.827 3.321 1.00 0.00 C ATOM 1500 CD GLU B 2 -3.644 5.116 3.004 1.00 0.00 C ATOM 1501 OE1 GLU B 2 -4.038 5.130 1.849 1.00 0.00 O ATOM 1502 OE2 GLU B 2 -4.237 4.574 3.921 1.00 0.00 O ATOM 0 H GLU B 2 -1.706 8.578 3.377 1.00 0.00 H new ATOM 0 HA GLU B 2 0.203 6.409 2.919 1.00 0.00 H new ATOM 0 HB2 GLU B 2 -2.457 7.157 1.629 1.00 0.00 H new ATOM 0 HB3 GLU B 2 -1.581 5.675 1.304 1.00 0.00 H new ATOM 0 HG2 GLU B 2 -1.614 5.119 3.745 1.00 0.00 H new ATOM 0 HG3 GLU B 2 -2.491 6.601 4.070 1.00 0.00 H new ATOM 1509 N LEU B 3 0.857 8.784 1.309 1.00 0.00 N ATOM 1510 CA LEU B 3 1.530 9.377 0.140 1.00 0.00 C ATOM 1511 C LEU B 3 2.577 8.400 -0.376 1.00 0.00 C ATOM 1512 O LEU B 3 2.853 8.348 -1.550 1.00 0.00 O ATOM 1513 CB LEU B 3 2.195 10.698 0.539 1.00 0.00 C ATOM 1514 CG LEU B 3 2.897 11.320 -0.674 1.00 0.00 C ATOM 1515 CD1 LEU B 3 1.882 11.545 -1.811 1.00 0.00 C ATOM 1516 CD2 LEU B 3 3.512 12.662 -0.255 1.00 0.00 C ATOM 0 H LEU B 3 0.940 9.315 2.176 1.00 0.00 H new ATOM 0 HA LEU B 3 0.800 9.577 -0.644 1.00 0.00 H new ATOM 0 HB2 LEU B 3 1.447 11.388 0.930 1.00 0.00 H new ATOM 0 HB3 LEU B 3 2.916 10.525 1.338 1.00 0.00 H new ATOM 0 HG LEU B 3 3.678 10.649 -1.030 1.00 0.00 H new ATOM 0 HD11 LEU B 3 2.389 11.987 -2.669 1.00 0.00 H new ATOM 0 HD12 LEU B 3 1.443 10.590 -2.101 1.00 0.00 H new ATOM 0 HD13 LEU B 3 1.095 12.217 -1.469 1.00 0.00 H new ATOM 0 HD21 LEU B 3 4.015 13.115 -1.110 1.00 0.00 H new ATOM 0 HD22 LEU B 3 2.725 13.328 0.098 1.00 0.00 H new ATOM 0 HD23 LEU B 3 4.234 12.497 0.545 1.00 0.00 H new ATOM 1528 N GLU B 4 3.172 7.631 0.491 1.00 0.00 N ATOM 1529 CA GLU B 4 4.213 6.667 0.021 1.00 0.00 C ATOM 1530 C GLU B 4 3.574 5.623 -0.894 1.00 0.00 C ATOM 1531 O GLU B 4 4.155 5.202 -1.873 1.00 0.00 O ATOM 1532 CB GLU B 4 4.884 5.993 1.227 1.00 0.00 C ATOM 1533 CG GLU B 4 3.860 5.179 2.024 1.00 0.00 C ATOM 1534 CD GLU B 4 4.556 4.523 3.220 1.00 0.00 C ATOM 1535 OE1 GLU B 4 5.775 4.537 3.251 1.00 0.00 O ATOM 1536 OE2 GLU B 4 3.857 4.019 4.083 1.00 0.00 O ATOM 0 H GLU B 4 2.988 7.625 1.494 1.00 0.00 H new ATOM 0 HA GLU B 4 4.976 7.204 -0.543 1.00 0.00 H new ATOM 0 HB2 GLU B 4 5.689 5.342 0.886 1.00 0.00 H new ATOM 0 HB3 GLU B 4 5.336 6.749 1.869 1.00 0.00 H new ATOM 0 HG2 GLU B 4 3.053 5.825 2.368 1.00 0.00 H new ATOM 0 HG3 GLU B 4 3.409 4.417 1.388 1.00 0.00 H new ATOM 1543 N LYS B 5 2.383 5.210 -0.585 1.00 0.00 N ATOM 1544 CA LYS B 5 1.688 4.198 -1.431 1.00 0.00 C ATOM 1545 C LYS B 5 1.432 4.771 -2.821 1.00 0.00 C ATOM 1546 O LYS B 5 1.553 4.086 -3.814 1.00 0.00 O ATOM 1547 CB LYS B 5 0.355 3.858 -0.766 1.00 0.00 C ATOM 1548 CG LYS B 5 -0.410 2.818 -1.591 1.00 0.00 C ATOM 1549 CD LYS B 5 -1.744 2.496 -0.901 1.00 0.00 C ATOM 1550 CE LYS B 5 -2.772 3.602 -1.188 1.00 0.00 C ATOM 1551 NZ LYS B 5 -4.124 3.141 -0.765 1.00 0.00 N ATOM 0 H LYS B 5 1.852 5.531 0.225 1.00 0.00 H new ATOM 0 HA LYS B 5 2.305 3.304 -1.529 1.00 0.00 H new ATOM 0 HB2 LYS B 5 0.531 3.475 0.239 1.00 0.00 H new ATOM 0 HB3 LYS B 5 -0.246 4.761 -0.662 1.00 0.00 H new ATOM 0 HG2 LYS B 5 -0.591 3.198 -2.597 1.00 0.00 H new ATOM 0 HG3 LYS B 5 0.186 1.911 -1.695 1.00 0.00 H new ATOM 0 HD2 LYS B 5 -2.123 1.537 -1.255 1.00 0.00 H new ATOM 0 HD3 LYS B 5 -1.592 2.401 0.174 1.00 0.00 H new ATOM 0 HE2 LYS B 5 -2.502 4.513 -0.653 1.00 0.00 H new ATOM 0 HE3 LYS B 5 -2.774 3.845 -2.251 1.00 0.00 H new ATOM 0 HZ1 LYS B 5 -4.805 3.312 -1.532 1.00 0.00 H new ATOM 0 HZ2 LYS B 5 -4.093 2.124 -0.550 1.00 0.00 H new ATOM 0 HZ3 LYS B 5 -4.420 3.665 0.083 1.00 0.00 H new ATOM 1565 N ALA B 6 1.059 6.014 -2.901 1.00 0.00 N ATOM 1566 CA ALA B 6 0.777 6.614 -4.233 1.00 0.00 C ATOM 1567 C ALA B 6 2.066 6.735 -5.045 1.00 0.00 C ATOM 1568 O ALA B 6 2.081 6.510 -6.236 1.00 0.00 O ATOM 1569 CB ALA B 6 0.152 7.999 -4.048 1.00 0.00 C ATOM 0 H ALA B 6 0.937 6.640 -2.105 1.00 0.00 H new ATOM 0 HA ALA B 6 0.083 5.969 -4.772 1.00 0.00 H new ATOM 0 HB1 ALA B 6 -0.054 8.438 -5.024 1.00 0.00 H new ATOM 0 HB2 ALA B 6 -0.778 7.906 -3.488 1.00 0.00 H new ATOM 0 HB3 ALA B 6 0.843 8.640 -3.501 1.00 0.00 H new ATOM 1575 N MET B 7 3.140 7.105 -4.415 1.00 0.00 N ATOM 1576 CA MET B 7 4.421 7.258 -5.152 1.00 0.00 C ATOM 1577 C MET B 7 4.841 5.917 -5.748 1.00 0.00 C ATOM 1578 O MET B 7 5.324 5.835 -6.861 1.00 0.00 O ATOM 1579 CB MET B 7 5.501 7.738 -4.180 1.00 0.00 C ATOM 1580 CG MET B 7 5.200 9.172 -3.744 1.00 0.00 C ATOM 1581 SD MET B 7 6.582 9.801 -2.762 1.00 0.00 S ATOM 1582 CE MET B 7 6.136 11.551 -2.842 1.00 0.00 C ATOM 0 H MET B 7 3.187 7.309 -3.417 1.00 0.00 H new ATOM 0 HA MET B 7 4.292 7.983 -5.956 1.00 0.00 H new ATOM 0 HB2 MET B 7 5.538 7.083 -3.310 1.00 0.00 H new ATOM 0 HB3 MET B 7 6.480 7.690 -4.656 1.00 0.00 H new ATOM 0 HG2 MET B 7 5.042 9.804 -4.618 1.00 0.00 H new ATOM 0 HG3 MET B 7 4.281 9.201 -3.159 1.00 0.00 H new ATOM 0 HE1 MET B 7 6.735 12.112 -2.125 1.00 0.00 H new ATOM 0 HE2 MET B 7 6.325 11.929 -3.847 1.00 0.00 H new ATOM 0 HE3 MET B 7 5.079 11.668 -2.603 1.00 0.00 H new ATOM 1592 N VAL B 8 4.651 4.872 -5.010 1.00 0.00 N ATOM 1593 CA VAL B 8 5.024 3.521 -5.500 1.00 0.00 C ATOM 1594 C VAL B 8 4.139 3.159 -6.689 1.00 0.00 C ATOM 1595 O VAL B 8 4.579 2.558 -7.644 1.00 0.00 O ATOM 1596 CB VAL B 8 4.830 2.504 -4.367 1.00 0.00 C ATOM 1597 CG1 VAL B 8 4.965 1.079 -4.908 1.00 0.00 C ATOM 1598 CG2 VAL B 8 5.892 2.734 -3.288 1.00 0.00 C ATOM 0 H VAL B 8 4.247 4.893 -4.073 1.00 0.00 H new ATOM 0 HA VAL B 8 6.067 3.510 -5.815 1.00 0.00 H new ATOM 0 HB VAL B 8 3.834 2.634 -3.943 1.00 0.00 H new ATOM 0 HG11 VAL B 8 4.825 0.366 -4.095 1.00 0.00 H new ATOM 0 HG12 VAL B 8 4.209 0.908 -5.674 1.00 0.00 H new ATOM 0 HG13 VAL B 8 5.957 0.946 -5.340 1.00 0.00 H new ATOM 0 HG21 VAL B 8 5.755 2.012 -2.483 1.00 0.00 H new ATOM 0 HG22 VAL B 8 6.884 2.610 -3.722 1.00 0.00 H new ATOM 0 HG23 VAL B 8 5.794 3.744 -2.890 1.00 0.00 H new ATOM 1608 N ALA B 9 2.886 3.498 -6.611 1.00 0.00 N ATOM 1609 CA ALA B 9 1.938 3.155 -7.714 1.00 0.00 C ATOM 1610 C ALA B 9 2.324 3.842 -9.025 1.00 0.00 C ATOM 1611 O ALA B 9 2.217 3.260 -10.086 1.00 0.00 O ATOM 1612 CB ALA B 9 0.532 3.587 -7.328 1.00 0.00 C ATOM 0 H ALA B 9 2.471 4.001 -5.827 1.00 0.00 H new ATOM 0 HA ALA B 9 1.980 2.076 -7.865 1.00 0.00 H new ATOM 0 HB1 ALA B 9 -0.159 3.337 -8.133 1.00 0.00 H new ATOM 0 HB2 ALA B 9 0.230 3.071 -6.417 1.00 0.00 H new ATOM 0 HB3 ALA B 9 0.516 4.663 -7.158 1.00 0.00 H new ATOM 1618 N LEU B 10 2.749 5.073 -8.981 1.00 0.00 N ATOM 1619 CA LEU B 10 3.105 5.758 -10.257 1.00 0.00 C ATOM 1620 C LEU B 10 4.219 4.966 -10.919 1.00 0.00 C ATOM 1621 O LEU B 10 4.254 4.795 -12.119 1.00 0.00 O ATOM 1622 CB LEU B 10 3.626 7.176 -9.987 1.00 0.00 C ATOM 1623 CG LEU B 10 2.575 8.035 -9.270 1.00 0.00 C ATOM 1624 CD1 LEU B 10 3.071 9.486 -9.224 1.00 0.00 C ATOM 1625 CD2 LEU B 10 1.232 7.972 -10.013 1.00 0.00 C ATOM 0 H LEU B 10 2.865 5.628 -8.133 1.00 0.00 H new ATOM 0 HA LEU B 10 2.219 5.818 -10.889 1.00 0.00 H new ATOM 0 HB2 LEU B 10 4.530 7.123 -9.380 1.00 0.00 H new ATOM 0 HB3 LEU B 10 3.902 7.649 -10.929 1.00 0.00 H new ATOM 0 HG LEU B 10 2.428 7.656 -8.259 1.00 0.00 H new ATOM 0 HD11 LEU B 10 2.333 10.107 -8.717 1.00 0.00 H new ATOM 0 HD12 LEU B 10 4.016 9.530 -8.683 1.00 0.00 H new ATOM 0 HD13 LEU B 10 3.217 9.853 -10.240 1.00 0.00 H new ATOM 0 HD21 LEU B 10 0.498 8.586 -9.491 1.00 0.00 H new ATOM 0 HD22 LEU B 10 1.361 8.345 -11.029 1.00 0.00 H new ATOM 0 HD23 LEU B 10 0.883 6.940 -10.047 1.00 0.00 H new ATOM 1637 N ILE B 11 5.137 4.496 -10.136 1.00 0.00 N ATOM 1638 CA ILE B 11 6.274 3.719 -10.688 1.00 0.00 C ATOM 1639 C ILE B 11 5.790 2.380 -11.278 1.00 0.00 C ATOM 1640 O ILE B 11 6.278 1.940 -12.298 1.00 0.00 O ATOM 1641 CB ILE B 11 7.295 3.487 -9.567 1.00 0.00 C ATOM 1642 CG1 ILE B 11 7.953 4.833 -9.223 1.00 0.00 C ATOM 1643 CG2 ILE B 11 8.361 2.496 -10.036 1.00 0.00 C ATOM 1644 CD1 ILE B 11 8.790 4.714 -7.944 1.00 0.00 C ATOM 0 H ILE B 11 5.151 4.617 -9.123 1.00 0.00 H new ATOM 0 HA ILE B 11 6.741 4.278 -11.499 1.00 0.00 H new ATOM 0 HB ILE B 11 6.798 3.078 -8.687 1.00 0.00 H new ATOM 0 HG12 ILE B 11 8.586 5.156 -10.049 1.00 0.00 H new ATOM 0 HG13 ILE B 11 7.186 5.596 -9.092 1.00 0.00 H new ATOM 0 HG21 ILE B 11 9.084 2.334 -9.237 1.00 0.00 H new ATOM 0 HG22 ILE B 11 7.888 1.549 -10.295 1.00 0.00 H new ATOM 0 HG23 ILE B 11 8.872 2.898 -10.911 1.00 0.00 H new ATOM 0 HD11 ILE B 11 9.247 5.677 -7.718 1.00 0.00 H new ATOM 0 HD12 ILE B 11 8.148 4.413 -7.116 1.00 0.00 H new ATOM 0 HD13 ILE B 11 9.570 3.967 -8.088 1.00 0.00 H new ATOM 1656 N ASP B 12 4.861 1.714 -10.638 1.00 0.00 N ATOM 1657 CA ASP B 12 4.389 0.393 -11.167 1.00 0.00 C ATOM 1658 C ASP B 12 3.784 0.534 -12.573 1.00 0.00 C ATOM 1659 O ASP B 12 4.072 -0.241 -13.463 1.00 0.00 O ATOM 1660 CB ASP B 12 3.328 -0.173 -10.216 1.00 0.00 C ATOM 1661 CG ASP B 12 2.878 -1.560 -10.690 1.00 0.00 C ATOM 1662 OD1 ASP B 12 2.911 -1.803 -11.885 1.00 0.00 O ATOM 1663 OD2 ASP B 12 2.503 -2.356 -9.845 1.00 0.00 O ATOM 0 H ASP B 12 4.410 2.024 -9.777 1.00 0.00 H new ATOM 0 HA ASP B 12 5.246 -0.278 -11.232 1.00 0.00 H new ATOM 0 HB2 ASP B 12 3.733 -0.239 -9.206 1.00 0.00 H new ATOM 0 HB3 ASP B 12 2.472 0.500 -10.173 1.00 0.00 H new ATOM 1668 N VAL B 13 2.923 1.492 -12.766 1.00 0.00 N ATOM 1669 CA VAL B 13 2.260 1.666 -14.100 1.00 0.00 C ATOM 1670 C VAL B 13 3.270 2.164 -15.152 1.00 0.00 C ATOM 1671 O VAL B 13 3.251 1.751 -16.304 1.00 0.00 O ATOM 1672 CB VAL B 13 1.061 2.651 -13.926 1.00 0.00 C ATOM 1673 CG1 VAL B 13 1.250 3.944 -14.738 1.00 0.00 C ATOM 1674 CG2 VAL B 13 -0.246 1.979 -14.372 1.00 0.00 C ATOM 0 H VAL B 13 2.644 2.169 -12.056 1.00 0.00 H new ATOM 0 HA VAL B 13 1.884 0.710 -14.463 1.00 0.00 H new ATOM 0 HB VAL B 13 1.016 2.910 -12.868 1.00 0.00 H new ATOM 0 HG11 VAL B 13 0.391 4.598 -14.586 1.00 0.00 H new ATOM 0 HG12 VAL B 13 2.156 4.452 -14.408 1.00 0.00 H new ATOM 0 HG13 VAL B 13 1.336 3.699 -15.797 1.00 0.00 H new ATOM 0 HG21 VAL B 13 -1.075 2.676 -14.246 1.00 0.00 H new ATOM 0 HG22 VAL B 13 -0.169 1.693 -15.421 1.00 0.00 H new ATOM 0 HG23 VAL B 13 -0.424 1.091 -13.766 1.00 0.00 H new ATOM 1684 N PHE B 14 4.134 3.057 -14.773 1.00 0.00 N ATOM 1685 CA PHE B 14 5.116 3.600 -15.746 1.00 0.00 C ATOM 1686 C PHE B 14 5.964 2.460 -16.292 1.00 0.00 C ATOM 1687 O PHE B 14 6.295 2.435 -17.452 1.00 0.00 O ATOM 1688 CB PHE B 14 6.025 4.622 -15.056 1.00 0.00 C ATOM 1689 CG PHE B 14 7.022 5.169 -16.054 1.00 0.00 C ATOM 1690 CD1 PHE B 14 8.256 4.531 -16.235 1.00 0.00 C ATOM 1691 CD2 PHE B 14 6.711 6.311 -16.802 1.00 0.00 C ATOM 1692 CE1 PHE B 14 9.176 5.035 -17.162 1.00 0.00 C ATOM 1693 CE2 PHE B 14 7.631 6.814 -17.730 1.00 0.00 C ATOM 1694 CZ PHE B 14 8.863 6.176 -17.910 1.00 0.00 C ATOM 0 H PHE B 14 4.203 3.436 -13.829 1.00 0.00 H new ATOM 0 HA PHE B 14 4.582 4.088 -16.561 1.00 0.00 H new ATOM 0 HB2 PHE B 14 5.427 5.434 -14.641 1.00 0.00 H new ATOM 0 HB3 PHE B 14 6.549 4.154 -14.223 1.00 0.00 H new ATOM 0 HD1 PHE B 14 8.498 3.650 -15.659 1.00 0.00 H new ATOM 0 HD2 PHE B 14 5.760 6.804 -16.663 1.00 0.00 H new ATOM 0 HE1 PHE B 14 10.128 4.543 -17.300 1.00 0.00 H new ATOM 0 HE2 PHE B 14 7.390 7.695 -18.307 1.00 0.00 H new ATOM 0 HZ PHE B 14 9.572 6.564 -18.626 1.00 0.00 H new ATOM 1704 N HIS B 15 6.332 1.524 -15.469 1.00 0.00 N ATOM 1705 CA HIS B 15 7.169 0.398 -15.963 1.00 0.00 C ATOM 1706 C HIS B 15 6.364 -0.490 -16.916 1.00 0.00 C ATOM 1707 O HIS B 15 6.924 -1.177 -17.745 1.00 0.00 O ATOM 1708 CB HIS B 15 7.656 -0.439 -14.780 1.00 0.00 C ATOM 1709 CG HIS B 15 8.669 0.346 -13.996 1.00 0.00 C ATOM 1710 ND1 HIS B 15 9.557 1.221 -14.607 1.00 0.00 N ATOM 1711 CD2 HIS B 15 8.958 0.393 -12.655 1.00 0.00 C ATOM 1712 CE1 HIS B 15 10.331 1.752 -13.643 1.00 0.00 C ATOM 1713 NE2 HIS B 15 10.006 1.280 -12.438 1.00 0.00 N ATOM 0 H HIS B 15 6.091 1.488 -14.478 1.00 0.00 H new ATOM 0 HA HIS B 15 8.024 0.809 -16.500 1.00 0.00 H new ATOM 0 HB2 HIS B 15 6.815 -0.709 -14.141 1.00 0.00 H new ATOM 0 HB3 HIS B 15 8.097 -1.370 -15.136 1.00 0.00 H new ATOM 0 HD1 HIS B 15 9.613 1.424 -15.605 1.00 0.00 H new ATOM 0 HD2 HIS B 15 8.450 -0.172 -11.887 1.00 0.00 H new ATOM 0 HE1 HIS B 15 11.117 2.471 -13.822 1.00 0.00 H new ATOM 1722 N GLN B 16 5.062 -0.504 -16.811 1.00 0.00 N ATOM 1723 CA GLN B 16 4.272 -1.373 -17.726 1.00 0.00 C ATOM 1724 C GLN B 16 4.507 -0.955 -19.182 1.00 0.00 C ATOM 1725 O GLN B 16 4.633 -1.788 -20.058 1.00 0.00 O ATOM 1726 CB GLN B 16 2.780 -1.252 -17.400 1.00 0.00 C ATOM 1727 CG GLN B 16 2.483 -1.914 -16.051 1.00 0.00 C ATOM 1728 CD GLN B 16 2.697 -3.426 -16.157 1.00 0.00 C ATOM 1729 OE1 GLN B 16 2.221 -4.056 -17.080 1.00 0.00 O ATOM 1730 NE2 GLN B 16 3.394 -4.040 -15.240 1.00 0.00 N ATOM 0 H GLN B 16 4.519 0.041 -16.141 1.00 0.00 H new ATOM 0 HA GLN B 16 4.592 -2.406 -17.591 1.00 0.00 H new ATOM 0 HB2 GLN B 16 2.490 -0.202 -17.371 1.00 0.00 H new ATOM 0 HB3 GLN B 16 2.189 -1.724 -18.184 1.00 0.00 H new ATOM 0 HG2 GLN B 16 3.133 -1.499 -15.281 1.00 0.00 H new ATOM 0 HG3 GLN B 16 1.457 -1.703 -15.750 1.00 0.00 H new ATOM 0 HE21 GLN B 16 3.794 -3.512 -14.465 1.00 0.00 H new ATOM 0 HE22 GLN B 16 3.539 -5.048 -15.299 1.00 0.00 H new ATOM 1739 N TYR B 17 4.547 0.326 -19.461 1.00 0.00 N ATOM 1740 CA TYR B 17 4.752 0.775 -20.884 1.00 0.00 C ATOM 1741 C TYR B 17 6.237 1.006 -21.203 1.00 0.00 C ATOM 1742 O TYR B 17 6.696 0.710 -22.287 1.00 0.00 O ATOM 1743 CB TYR B 17 3.971 2.072 -21.109 1.00 0.00 C ATOM 1744 CG TYR B 17 2.505 1.742 -21.219 1.00 0.00 C ATOM 1745 CD1 TYR B 17 1.739 1.589 -20.061 1.00 0.00 C ATOM 1746 CD2 TYR B 17 1.919 1.575 -22.478 1.00 0.00 C ATOM 1747 CE1 TYR B 17 0.384 1.267 -20.158 1.00 0.00 C ATOM 1748 CE2 TYR B 17 0.562 1.256 -22.582 1.00 0.00 C ATOM 1749 CZ TYR B 17 -0.209 1.101 -21.419 1.00 0.00 C ATOM 1750 OH TYR B 17 -1.547 0.779 -21.516 1.00 0.00 O ATOM 0 H TYR B 17 4.448 1.076 -18.777 1.00 0.00 H new ATOM 0 HA TYR B 17 4.392 -0.011 -21.547 1.00 0.00 H new ATOM 0 HB2 TYR B 17 4.142 2.763 -20.284 1.00 0.00 H new ATOM 0 HB3 TYR B 17 4.316 2.568 -22.017 1.00 0.00 H new ATOM 0 HD1 TYR B 17 2.195 1.720 -19.091 1.00 0.00 H new ATOM 0 HD2 TYR B 17 2.516 1.693 -23.371 1.00 0.00 H new ATOM 0 HE1 TYR B 17 -0.208 1.146 -19.263 1.00 0.00 H new ATOM 0 HE2 TYR B 17 0.108 1.129 -23.554 1.00 0.00 H new ATOM 0 HH TYR B 17 -1.931 0.703 -20.618 1.00 0.00 H new ATOM 1760 N SER B 18 6.983 1.554 -20.293 1.00 0.00 N ATOM 1761 CA SER B 18 8.424 1.824 -20.574 1.00 0.00 C ATOM 1762 C SER B 18 9.160 0.519 -20.889 1.00 0.00 C ATOM 1763 O SER B 18 10.003 0.467 -21.763 1.00 0.00 O ATOM 1764 CB SER B 18 9.062 2.480 -19.350 1.00 0.00 C ATOM 1765 OG SER B 18 9.286 1.492 -18.352 1.00 0.00 O ATOM 0 H SER B 18 6.662 1.829 -19.365 1.00 0.00 H new ATOM 0 HA SER B 18 8.498 2.488 -21.435 1.00 0.00 H new ATOM 0 HB2 SER B 18 10.004 2.954 -19.626 1.00 0.00 H new ATOM 0 HB3 SER B 18 8.412 3.264 -18.963 1.00 0.00 H new ATOM 0 HG SER B 18 9.696 1.909 -17.566 1.00 0.00 H new ATOM 1771 N GLY B 19 8.854 -0.532 -20.182 1.00 0.00 N ATOM 1772 CA GLY B 19 9.542 -1.832 -20.438 1.00 0.00 C ATOM 1773 C GLY B 19 8.883 -2.542 -21.620 1.00 0.00 C ATOM 1774 O GLY B 19 9.407 -3.501 -22.150 1.00 0.00 O ATOM 0 H GLY B 19 8.157 -0.549 -19.437 1.00 0.00 H new ATOM 0 HA2 GLY B 19 10.598 -1.660 -20.648 1.00 0.00 H new ATOM 0 HA3 GLY B 19 9.492 -2.462 -19.550 1.00 0.00 H new ATOM 1778 N ARG B 20 7.739 -2.079 -22.040 1.00 0.00 N ATOM 1779 CA ARG B 20 7.052 -2.731 -23.188 1.00 0.00 C ATOM 1780 C ARG B 20 7.960 -2.664 -24.418 1.00 0.00 C ATOM 1781 O ARG B 20 8.145 -3.638 -25.121 1.00 0.00 O ATOM 1782 CB ARG B 20 5.749 -1.986 -23.482 1.00 0.00 C ATOM 1783 CG ARG B 20 5.017 -2.648 -24.651 1.00 0.00 C ATOM 1784 CD ARG B 20 3.724 -1.886 -24.922 1.00 0.00 C ATOM 1785 NE ARG B 20 3.008 -2.514 -26.068 1.00 0.00 N ATOM 1786 CZ ARG B 20 1.759 -2.221 -26.301 1.00 0.00 C ATOM 1787 NH1 ARG B 20 1.116 -1.412 -25.503 1.00 0.00 N ATOM 1788 NH2 ARG B 20 1.148 -2.742 -27.330 1.00 0.00 N ATOM 0 H ARG B 20 7.251 -1.278 -21.638 1.00 0.00 H new ATOM 0 HA ARG B 20 6.834 -3.771 -22.947 1.00 0.00 H new ATOM 0 HB2 ARG B 20 5.113 -1.987 -22.597 1.00 0.00 H new ATOM 0 HB3 ARG B 20 5.963 -0.944 -23.720 1.00 0.00 H new ATOM 0 HG2 ARG B 20 5.648 -2.647 -25.540 1.00 0.00 H new ATOM 0 HG3 ARG B 20 4.798 -3.690 -24.417 1.00 0.00 H new ATOM 0 HD2 ARG B 20 3.091 -1.895 -24.035 1.00 0.00 H new ATOM 0 HD3 ARG B 20 3.944 -0.842 -25.145 1.00 0.00 H new ATOM 0 HE ARG B 20 3.496 -3.175 -26.672 1.00 0.00 H new ATOM 0 HH11 ARG B 20 1.591 -1.008 -24.696 1.00 0.00 H new ATOM 0 HH12 ARG B 20 0.139 -1.184 -25.687 1.00 0.00 H new ATOM 0 HH21 ARG B 20 1.648 -3.378 -27.951 1.00 0.00 H new ATOM 0 HH22 ARG B 20 0.171 -2.513 -27.513 1.00 0.00 H new ATOM 1802 N GLU B 21 8.520 -1.514 -24.687 1.00 0.00 N ATOM 1803 CA GLU B 21 9.413 -1.370 -25.877 1.00 0.00 C ATOM 1804 C GLU B 21 10.845 -1.751 -25.495 1.00 0.00 C ATOM 1805 O GLU B 21 11.321 -2.817 -25.832 1.00 0.00 O ATOM 1806 CB GLU B 21 9.383 0.085 -26.360 1.00 0.00 C ATOM 1807 CG GLU B 21 10.214 0.234 -27.642 1.00 0.00 C ATOM 1808 CD GLU B 21 9.560 -0.557 -28.777 1.00 0.00 C ATOM 1809 OE1 GLU B 21 8.404 -0.920 -28.633 1.00 0.00 O ATOM 1810 OE2 GLU B 21 10.226 -0.783 -29.774 1.00 0.00 O ATOM 0 H GLU B 21 8.398 -0.666 -24.133 1.00 0.00 H new ATOM 0 HA GLU B 21 9.066 -2.028 -26.674 1.00 0.00 H new ATOM 0 HB2 GLU B 21 8.354 0.393 -26.547 1.00 0.00 H new ATOM 0 HB3 GLU B 21 9.777 0.742 -25.584 1.00 0.00 H new ATOM 0 HG2 GLU B 21 10.291 1.286 -27.917 1.00 0.00 H new ATOM 0 HG3 GLU B 21 11.229 -0.126 -27.473 1.00 0.00 H new ATOM 1817 N GLY B 22 11.542 -0.892 -24.798 1.00 0.00 N ATOM 1818 CA GLY B 22 12.942 -1.227 -24.414 1.00 0.00 C ATOM 1819 C GLY B 22 13.569 -0.083 -23.612 1.00 0.00 C ATOM 1820 O GLY B 22 14.460 -0.297 -22.815 1.00 0.00 O ATOM 0 H GLY B 22 11.206 0.017 -24.482 1.00 0.00 H new ATOM 0 HA2 GLY B 22 12.953 -2.142 -23.822 1.00 0.00 H new ATOM 0 HA3 GLY B 22 13.534 -1.419 -25.309 1.00 0.00 H new ATOM 1824 N ASP B 23 13.127 1.133 -23.811 1.00 0.00 N ATOM 1825 CA ASP B 23 13.729 2.264 -23.049 1.00 0.00 C ATOM 1826 C ASP B 23 13.074 2.350 -21.666 1.00 0.00 C ATOM 1827 O ASP B 23 12.145 3.100 -21.454 1.00 0.00 O ATOM 1828 CB ASP B 23 13.492 3.568 -23.812 1.00 0.00 C ATOM 1829 CG ASP B 23 14.318 3.567 -25.099 1.00 0.00 C ATOM 1830 OD1 ASP B 23 15.283 2.824 -25.160 1.00 0.00 O ATOM 1831 OD2 ASP B 23 13.970 4.309 -26.003 1.00 0.00 O ATOM 0 H ASP B 23 12.384 1.388 -24.461 1.00 0.00 H new ATOM 0 HA ASP B 23 14.800 2.101 -22.932 1.00 0.00 H new ATOM 0 HB2 ASP B 23 12.433 3.676 -24.048 1.00 0.00 H new ATOM 0 HB3 ASP B 23 13.769 4.420 -23.191 1.00 0.00 H new ATOM 1836 N LYS B 24 13.545 1.581 -20.723 1.00 0.00 N ATOM 1837 CA LYS B 24 12.944 1.625 -19.359 1.00 0.00 C ATOM 1838 C LYS B 24 13.285 2.953 -18.673 1.00 0.00 C ATOM 1839 O LYS B 24 12.471 3.533 -17.983 1.00 0.00 O ATOM 1840 CB LYS B 24 13.495 0.471 -18.519 1.00 0.00 C ATOM 1841 CG LYS B 24 12.940 -0.857 -19.041 1.00 0.00 C ATOM 1842 CD LYS B 24 13.674 -2.024 -18.372 1.00 0.00 C ATOM 1843 CE LYS B 24 13.395 -2.023 -16.866 1.00 0.00 C ATOM 1844 NZ LYS B 24 13.740 -3.355 -16.296 1.00 0.00 N ATOM 0 H LYS B 24 14.318 0.925 -20.837 1.00 0.00 H new ATOM 0 HA LYS B 24 11.861 1.534 -19.449 1.00 0.00 H new ATOM 0 HB2 LYS B 24 14.584 0.464 -18.563 1.00 0.00 H new ATOM 0 HB3 LYS B 24 13.219 0.606 -17.473 1.00 0.00 H new ATOM 0 HG2 LYS B 24 11.872 -0.921 -18.835 1.00 0.00 H new ATOM 0 HG3 LYS B 24 13.060 -0.912 -20.123 1.00 0.00 H new ATOM 0 HD2 LYS B 24 13.349 -2.968 -18.810 1.00 0.00 H new ATOM 0 HD3 LYS B 24 14.746 -1.941 -18.552 1.00 0.00 H new ATOM 0 HE2 LYS B 24 13.980 -1.244 -16.377 1.00 0.00 H new ATOM 0 HE3 LYS B 24 12.345 -1.797 -16.680 1.00 0.00 H new ATOM 0 HZ1 LYS B 24 13.551 -3.355 -15.273 1.00 0.00 H new ATOM 0 HZ2 LYS B 24 13.163 -4.089 -16.755 1.00 0.00 H new ATOM 0 HZ3 LYS B 24 14.747 -3.553 -16.461 1.00 0.00 H new ATOM 1858 N HIS B 25 14.491 3.424 -18.841 1.00 0.00 N ATOM 1859 CA HIS B 25 14.901 4.699 -18.181 1.00 0.00 C ATOM 1860 C HIS B 25 14.387 5.912 -18.965 1.00 0.00 C ATOM 1861 O HIS B 25 14.313 7.005 -18.439 1.00 0.00 O ATOM 1862 CB HIS B 25 16.428 4.759 -18.115 1.00 0.00 C ATOM 1863 CG HIS B 25 16.850 5.959 -17.312 1.00 0.00 C ATOM 1864 ND1 HIS B 25 16.698 6.018 -15.933 1.00 0.00 N ATOM 1865 CD2 HIS B 25 17.419 7.154 -17.679 1.00 0.00 C ATOM 1866 CE1 HIS B 25 17.168 7.212 -15.525 1.00 0.00 C ATOM 1867 NE2 HIS B 25 17.618 7.938 -16.549 1.00 0.00 N ATOM 0 H HIS B 25 15.213 2.980 -19.409 1.00 0.00 H new ATOM 0 HA HIS B 25 14.473 4.725 -17.179 1.00 0.00 H new ATOM 0 HB2 HIS B 25 16.819 3.849 -17.660 1.00 0.00 H new ATOM 0 HB3 HIS B 25 16.844 4.817 -19.121 1.00 0.00 H new ATOM 0 HD2 HIS B 25 17.672 7.440 -18.689 1.00 0.00 H new ATOM 0 HE1 HIS B 25 17.179 7.541 -14.496 1.00 0.00 H new ATOM 0 HE2 HIS B 25 18.023 8.873 -16.511 1.00 0.00 H new ATOM 1876 N LYS B 26 14.053 5.739 -20.222 1.00 0.00 N ATOM 1877 CA LYS B 26 13.569 6.891 -21.050 1.00 0.00 C ATOM 1878 C LYS B 26 12.291 6.499 -21.791 1.00 0.00 C ATOM 1879 O LYS B 26 12.030 5.342 -22.030 1.00 0.00 O ATOM 1880 CB LYS B 26 14.658 7.263 -22.052 1.00 0.00 C ATOM 1881 CG LYS B 26 14.295 8.578 -22.742 1.00 0.00 C ATOM 1882 CD LYS B 26 15.457 9.037 -23.648 1.00 0.00 C ATOM 1883 CE LYS B 26 15.455 10.562 -23.758 1.00 0.00 C ATOM 1884 NZ LYS B 26 16.314 10.982 -24.901 1.00 0.00 N ATOM 0 H LYS B 26 14.095 4.846 -20.713 1.00 0.00 H new ATOM 0 HA LYS B 26 13.350 7.744 -20.407 1.00 0.00 H new ATOM 0 HB2 LYS B 26 15.617 7.361 -21.542 1.00 0.00 H new ATOM 0 HB3 LYS B 26 14.770 6.471 -22.793 1.00 0.00 H new ATOM 0 HG2 LYS B 26 13.390 8.449 -23.335 1.00 0.00 H new ATOM 0 HG3 LYS B 26 14.081 9.343 -21.996 1.00 0.00 H new ATOM 0 HD2 LYS B 26 16.407 8.694 -23.239 1.00 0.00 H new ATOM 0 HD3 LYS B 26 15.357 8.591 -24.638 1.00 0.00 H new ATOM 0 HE2 LYS B 26 14.437 10.925 -23.902 1.00 0.00 H new ATOM 0 HE3 LYS B 26 15.823 11.004 -22.832 1.00 0.00 H new ATOM 0 HZ1 LYS B 26 16.180 11.997 -25.081 1.00 0.00 H new ATOM 0 HZ2 LYS B 26 17.312 10.800 -24.671 1.00 0.00 H new ATOM 0 HZ3 LYS B 26 16.051 10.442 -25.750 1.00 0.00 H new ATOM 1898 N LEU B 27 11.477 7.464 -22.127 1.00 0.00 N ATOM 1899 CA LEU B 27 10.186 7.177 -22.828 1.00 0.00 C ATOM 1900 C LEU B 27 10.111 8.012 -24.116 1.00 0.00 C ATOM 1901 O LEU B 27 10.494 9.161 -24.127 1.00 0.00 O ATOM 1902 CB LEU B 27 9.054 7.573 -21.875 1.00 0.00 C ATOM 1903 CG LEU B 27 7.713 6.973 -22.327 1.00 0.00 C ATOM 1904 CD1 LEU B 27 7.636 5.477 -21.969 1.00 0.00 C ATOM 1905 CD2 LEU B 27 6.579 7.711 -21.611 1.00 0.00 C ATOM 0 H LEU B 27 11.652 8.452 -21.944 1.00 0.00 H new ATOM 0 HA LEU B 27 10.107 6.123 -23.096 1.00 0.00 H new ATOM 0 HB2 LEU B 27 9.287 7.231 -20.867 1.00 0.00 H new ATOM 0 HB3 LEU B 27 8.974 8.659 -21.833 1.00 0.00 H new ATOM 0 HG LEU B 27 7.624 7.080 -23.408 1.00 0.00 H new ATOM 0 HD11 LEU B 27 6.679 5.073 -22.298 1.00 0.00 H new ATOM 0 HD12 LEU B 27 8.446 4.942 -22.465 1.00 0.00 H new ATOM 0 HD13 LEU B 27 7.729 5.356 -20.890 1.00 0.00 H new ATOM 0 HD21 LEU B 27 5.621 7.295 -21.922 1.00 0.00 H new ATOM 0 HD22 LEU B 27 6.692 7.594 -20.533 1.00 0.00 H new ATOM 0 HD23 LEU B 27 6.616 8.770 -21.867 1.00 0.00 H new ATOM 1917 N LYS B 28 9.627 7.447 -25.205 1.00 0.00 N ATOM 1918 CA LYS B 28 9.530 8.215 -26.491 1.00 0.00 C ATOM 1919 C LYS B 28 8.060 8.525 -26.789 1.00 0.00 C ATOM 1920 O LYS B 28 7.178 7.771 -26.429 1.00 0.00 O ATOM 1921 CB LYS B 28 10.137 7.380 -27.628 1.00 0.00 C ATOM 1922 CG LYS B 28 9.959 8.105 -28.975 1.00 0.00 C ATOM 1923 CD LYS B 28 11.022 7.628 -29.973 1.00 0.00 C ATOM 1924 CE LYS B 28 10.827 6.139 -30.262 1.00 0.00 C ATOM 1925 NZ LYS B 28 11.652 5.749 -31.441 1.00 0.00 N ATOM 0 H LYS B 28 9.295 6.484 -25.255 1.00 0.00 H new ATOM 0 HA LYS B 28 10.079 9.152 -26.405 1.00 0.00 H new ATOM 0 HB2 LYS B 28 11.196 7.208 -27.437 1.00 0.00 H new ATOM 0 HB3 LYS B 28 9.657 6.402 -27.667 1.00 0.00 H new ATOM 0 HG2 LYS B 28 8.963 7.912 -29.372 1.00 0.00 H new ATOM 0 HG3 LYS B 28 10.041 9.182 -28.831 1.00 0.00 H new ATOM 0 HD2 LYS B 28 10.949 8.200 -30.898 1.00 0.00 H new ATOM 0 HD3 LYS B 28 12.019 7.802 -29.568 1.00 0.00 H new ATOM 0 HE2 LYS B 28 11.114 5.548 -29.392 1.00 0.00 H new ATOM 0 HE3 LYS B 28 9.775 5.930 -30.456 1.00 0.00 H new ATOM 0 HZ1 LYS B 28 11.520 4.736 -31.638 1.00 0.00 H new ATOM 0 HZ2 LYS B 28 11.358 6.304 -32.270 1.00 0.00 H new ATOM 0 HZ3 LYS B 28 12.655 5.934 -31.239 1.00 0.00 H new ATOM 1939 N LYS B 29 7.786 9.638 -27.433 1.00 0.00 N ATOM 1940 CA LYS B 29 6.368 10.001 -27.742 1.00 0.00 C ATOM 1941 C LYS B 29 5.614 8.776 -28.240 1.00 0.00 C ATOM 1942 O LYS B 29 4.407 8.697 -28.150 1.00 0.00 O ATOM 1943 CB LYS B 29 6.322 11.077 -28.834 1.00 0.00 C ATOM 1944 CG LYS B 29 6.996 10.575 -30.117 1.00 0.00 C ATOM 1945 CD LYS B 29 6.931 11.676 -31.180 1.00 0.00 C ATOM 1946 CE LYS B 29 7.526 11.165 -32.494 1.00 0.00 C ATOM 1947 NZ LYS B 29 9.006 11.057 -32.363 1.00 0.00 N ATOM 0 H LYS B 29 8.484 10.308 -27.756 1.00 0.00 H new ATOM 0 HA LYS B 29 5.905 10.380 -26.831 1.00 0.00 H new ATOM 0 HB2 LYS B 29 5.287 11.347 -29.043 1.00 0.00 H new ATOM 0 HB3 LYS B 29 6.822 11.980 -28.484 1.00 0.00 H new ATOM 0 HG2 LYS B 29 8.033 10.306 -29.917 1.00 0.00 H new ATOM 0 HG3 LYS B 29 6.497 9.675 -30.477 1.00 0.00 H new ATOM 0 HD2 LYS B 29 5.897 11.984 -31.334 1.00 0.00 H new ATOM 0 HD3 LYS B 29 7.479 12.555 -30.840 1.00 0.00 H new ATOM 0 HE2 LYS B 29 7.101 10.193 -32.744 1.00 0.00 H new ATOM 0 HE3 LYS B 29 7.271 11.843 -33.308 1.00 0.00 H new ATOM 0 HZ1 LYS B 29 9.425 10.875 -33.297 1.00 0.00 H new ATOM 0 HZ2 LYS B 29 9.386 11.946 -31.980 1.00 0.00 H new ATOM 0 HZ3 LYS B 29 9.241 10.274 -31.720 1.00 0.00 H new ATOM 1961 N SER B 30 6.318 7.825 -28.772 1.00 0.00 N ATOM 1962 CA SER B 30 5.634 6.601 -29.282 1.00 0.00 C ATOM 1963 C SER B 30 5.183 5.753 -28.096 1.00 0.00 C ATOM 1964 O SER B 30 4.034 5.373 -27.987 1.00 0.00 O ATOM 1965 CB SER B 30 6.594 5.797 -30.160 1.00 0.00 C ATOM 1966 OG SER B 30 5.881 4.737 -30.784 1.00 0.00 O ATOM 0 H SER B 30 7.332 7.836 -28.878 1.00 0.00 H new ATOM 0 HA SER B 30 4.768 6.887 -29.879 1.00 0.00 H new ATOM 0 HB2 SER B 30 7.043 6.443 -30.915 1.00 0.00 H new ATOM 0 HB3 SER B 30 7.409 5.397 -29.557 1.00 0.00 H new ATOM 0 HG SER B 30 6.492 4.220 -31.349 1.00 0.00 H new ATOM 1972 N GLU B 31 6.080 5.474 -27.195 1.00 0.00 N ATOM 1973 CA GLU B 31 5.713 4.674 -25.999 1.00 0.00 C ATOM 1974 C GLU B 31 4.679 5.450 -25.190 1.00 0.00 C ATOM 1975 O GLU B 31 3.749 4.891 -24.650 1.00 0.00 O ATOM 1976 CB GLU B 31 6.958 4.428 -25.144 1.00 0.00 C ATOM 1977 CG GLU B 31 7.892 3.459 -25.870 1.00 0.00 C ATOM 1978 CD GLU B 31 9.215 3.357 -25.109 1.00 0.00 C ATOM 1979 OE1 GLU B 31 9.262 2.617 -24.139 1.00 0.00 O ATOM 1980 OE2 GLU B 31 10.159 4.018 -25.508 1.00 0.00 O ATOM 0 H GLU B 31 7.056 5.768 -27.237 1.00 0.00 H new ATOM 0 HA GLU B 31 5.299 3.714 -26.306 1.00 0.00 H new ATOM 0 HB2 GLU B 31 7.472 5.370 -24.952 1.00 0.00 H new ATOM 0 HB3 GLU B 31 6.672 4.017 -24.176 1.00 0.00 H new ATOM 0 HG2 GLU B 31 7.427 2.476 -25.945 1.00 0.00 H new ATOM 0 HG3 GLU B 31 8.072 3.805 -26.888 1.00 0.00 H new ATOM 1987 N LEU B 32 4.850 6.739 -25.098 1.00 0.00 N ATOM 1988 CA LEU B 32 3.898 7.576 -24.318 1.00 0.00 C ATOM 1989 C LEU B 32 2.491 7.457 -24.892 1.00 0.00 C ATOM 1990 O LEU B 32 1.535 7.397 -24.161 1.00 0.00 O ATOM 1991 CB LEU B 32 4.355 9.038 -24.365 1.00 0.00 C ATOM 1992 CG LEU B 32 3.371 9.943 -23.605 1.00 0.00 C ATOM 1993 CD1 LEU B 32 3.208 9.465 -22.155 1.00 0.00 C ATOM 1994 CD2 LEU B 32 3.917 11.375 -23.610 1.00 0.00 C ATOM 0 H LEU B 32 5.616 7.253 -25.534 1.00 0.00 H new ATOM 0 HA LEU B 32 3.882 7.228 -23.285 1.00 0.00 H new ATOM 0 HB2 LEU B 32 5.350 9.127 -23.928 1.00 0.00 H new ATOM 0 HB3 LEU B 32 4.432 9.366 -25.401 1.00 0.00 H new ATOM 0 HG LEU B 32 2.397 9.905 -24.094 1.00 0.00 H new ATOM 0 HD11 LEU B 32 2.508 10.118 -21.633 1.00 0.00 H new ATOM 0 HD12 LEU B 32 2.826 8.444 -22.149 1.00 0.00 H new ATOM 0 HD13 LEU B 32 4.174 9.493 -21.652 1.00 0.00 H new ATOM 0 HD21 LEU B 32 3.229 12.029 -23.074 1.00 0.00 H new ATOM 0 HD22 LEU B 32 4.891 11.395 -23.121 1.00 0.00 H new ATOM 0 HD23 LEU B 32 4.020 11.722 -24.638 1.00 0.00 H new ATOM 2006 N LYS B 33 2.343 7.430 -26.185 1.00 0.00 N ATOM 2007 CA LYS B 33 0.967 7.315 -26.757 1.00 0.00 C ATOM 2008 C LYS B 33 0.320 6.014 -26.277 1.00 0.00 C ATOM 2009 O LYS B 33 -0.856 5.968 -25.973 1.00 0.00 O ATOM 2010 CB LYS B 33 1.025 7.310 -28.286 1.00 0.00 C ATOM 2011 CG LYS B 33 -0.403 7.318 -28.846 1.00 0.00 C ATOM 2012 CD LYS B 33 -0.359 7.314 -30.374 1.00 0.00 C ATOM 2013 CE LYS B 33 -1.778 7.463 -30.926 1.00 0.00 C ATOM 2014 NZ LYS B 33 -1.720 7.661 -32.402 1.00 0.00 N ATOM 0 H LYS B 33 3.101 7.482 -26.866 1.00 0.00 H new ATOM 0 HA LYS B 33 0.378 8.169 -26.424 1.00 0.00 H new ATOM 0 HB2 LYS B 33 1.573 8.181 -28.644 1.00 0.00 H new ATOM 0 HB3 LYS B 33 1.562 6.429 -28.638 1.00 0.00 H new ATOM 0 HG2 LYS B 33 -0.950 6.446 -28.486 1.00 0.00 H new ATOM 0 HG3 LYS B 33 -0.938 8.199 -28.491 1.00 0.00 H new ATOM 0 HD2 LYS B 33 0.269 8.129 -30.732 1.00 0.00 H new ATOM 0 HD3 LYS B 33 0.087 6.386 -30.733 1.00 0.00 H new ATOM 0 HE2 LYS B 33 -2.366 6.576 -30.690 1.00 0.00 H new ATOM 0 HE3 LYS B 33 -2.276 8.310 -30.454 1.00 0.00 H new ATOM 0 HZ1 LYS B 33 -2.457 8.335 -32.691 1.00 0.00 H new ATOM 0 HZ2 LYS B 33 -0.786 8.035 -32.666 1.00 0.00 H new ATOM 0 HZ3 LYS B 33 -1.876 6.751 -32.881 1.00 0.00 H new ATOM 2028 N GLU B 34 1.076 4.954 -26.223 1.00 0.00 N ATOM 2029 CA GLU B 34 0.514 3.653 -25.785 1.00 0.00 C ATOM 2030 C GLU B 34 0.088 3.759 -24.325 1.00 0.00 C ATOM 2031 O GLU B 34 -0.926 3.243 -23.926 1.00 0.00 O ATOM 2032 CB GLU B 34 1.576 2.566 -25.959 1.00 0.00 C ATOM 2033 CG GLU B 34 1.835 2.355 -27.454 1.00 0.00 C ATOM 2034 CD GLU B 34 2.940 1.315 -27.643 1.00 0.00 C ATOM 2035 OE1 GLU B 34 3.543 0.934 -26.654 1.00 0.00 O ATOM 2036 OE2 GLU B 34 3.169 0.924 -28.776 1.00 0.00 O ATOM 0 H GLU B 34 2.066 4.936 -26.466 1.00 0.00 H new ATOM 0 HA GLU B 34 -0.357 3.394 -26.387 1.00 0.00 H new ATOM 0 HB2 GLU B 34 2.498 2.856 -25.455 1.00 0.00 H new ATOM 0 HB3 GLU B 34 1.241 1.636 -25.500 1.00 0.00 H new ATOM 0 HG2 GLU B 34 0.922 2.023 -27.948 1.00 0.00 H new ATOM 0 HG3 GLU B 34 2.125 3.297 -27.919 1.00 0.00 H new ATOM 2043 N LEU B 35 0.855 4.429 -23.523 1.00 0.00 N ATOM 2044 CA LEU B 35 0.473 4.584 -22.098 1.00 0.00 C ATOM 2045 C LEU B 35 -0.863 5.319 -22.018 1.00 0.00 C ATOM 2046 O LEU B 35 -1.774 4.909 -21.340 1.00 0.00 O ATOM 2047 CB LEU B 35 1.559 5.393 -21.378 1.00 0.00 C ATOM 2048 CG LEU B 35 1.161 5.633 -19.906 1.00 0.00 C ATOM 2049 CD1 LEU B 35 2.420 5.973 -19.096 1.00 0.00 C ATOM 2050 CD2 LEU B 35 0.126 6.788 -19.783 1.00 0.00 C ATOM 0 H LEU B 35 1.731 4.877 -23.791 1.00 0.00 H new ATOM 0 HA LEU B 35 0.375 3.607 -21.624 1.00 0.00 H new ATOM 0 HB2 LEU B 35 2.509 4.860 -21.423 1.00 0.00 H new ATOM 0 HB3 LEU B 35 1.705 6.348 -21.883 1.00 0.00 H new ATOM 0 HG LEU B 35 0.698 4.726 -19.517 1.00 0.00 H new ATOM 0 HD11 LEU B 35 2.147 6.144 -18.055 1.00 0.00 H new ATOM 0 HD12 LEU B 35 3.125 5.144 -19.155 1.00 0.00 H new ATOM 0 HD13 LEU B 35 2.882 6.873 -19.503 1.00 0.00 H new ATOM 0 HD21 LEU B 35 -0.135 6.933 -18.735 1.00 0.00 H new ATOM 0 HD22 LEU B 35 0.557 7.707 -20.180 1.00 0.00 H new ATOM 0 HD23 LEU B 35 -0.771 6.534 -20.348 1.00 0.00 H new ATOM 2062 N ILE B 36 -0.968 6.417 -22.699 1.00 0.00 N ATOM 2063 CA ILE B 36 -2.219 7.221 -22.659 1.00 0.00 C ATOM 2064 C ILE B 36 -3.356 6.521 -23.412 1.00 0.00 C ATOM 2065 O ILE B 36 -4.470 6.441 -22.933 1.00 0.00 O ATOM 2066 CB ILE B 36 -1.938 8.576 -23.321 1.00 0.00 C ATOM 2067 CG1 ILE B 36 -0.765 9.259 -22.611 1.00 0.00 C ATOM 2068 CG2 ILE B 36 -3.167 9.481 -23.221 1.00 0.00 C ATOM 2069 CD1 ILE B 36 -0.449 10.587 -23.305 1.00 0.00 C ATOM 0 H ILE B 36 -0.231 6.800 -23.291 1.00 0.00 H new ATOM 0 HA ILE B 36 -2.528 7.345 -21.621 1.00 0.00 H new ATOM 0 HB ILE B 36 -1.697 8.407 -24.370 1.00 0.00 H new ATOM 0 HG12 ILE B 36 -1.012 9.434 -21.564 1.00 0.00 H new ATOM 0 HG13 ILE B 36 0.111 8.611 -22.628 1.00 0.00 H new ATOM 0 HG21 ILE B 36 -2.953 10.439 -23.695 1.00 0.00 H new ATOM 0 HG22 ILE B 36 -4.010 9.007 -23.725 1.00 0.00 H new ATOM 0 HG23 ILE B 36 -3.415 9.643 -22.172 1.00 0.00 H new ATOM 0 HD11 ILE B 36 0.386 11.072 -22.799 1.00 0.00 H new ATOM 0 HD12 ILE B 36 -0.183 10.400 -24.345 1.00 0.00 H new ATOM 0 HD13 ILE B 36 -1.324 11.236 -23.265 1.00 0.00 H new ATOM 2081 N ASN B 37 -3.101 6.062 -24.604 1.00 0.00 N ATOM 2082 CA ASN B 37 -4.188 5.426 -25.406 1.00 0.00 C ATOM 2083 C ASN B 37 -4.720 4.138 -24.764 1.00 0.00 C ATOM 2084 O ASN B 37 -5.902 3.858 -24.804 1.00 0.00 O ATOM 2085 CB ASN B 37 -3.645 5.102 -26.799 1.00 0.00 C ATOM 2086 CG ASN B 37 -4.741 4.444 -27.638 1.00 0.00 C ATOM 2087 OD1 ASN B 37 -5.534 5.188 -28.358 1.00 0.00 O flip ATOM 2088 ND2 ASN B 37 -4.876 3.237 -27.639 1.00 0.00 N flip ATOM 0 H ASN B 37 -2.189 6.098 -25.060 1.00 0.00 H new ATOM 0 HA ASN B 37 -5.018 6.131 -25.457 1.00 0.00 H new ATOM 0 HB2 ASN B 37 -3.298 6.013 -27.286 1.00 0.00 H new ATOM 0 HB3 ASN B 37 -2.785 4.437 -26.719 1.00 0.00 H new ATOM 0 HD21 ASN B 37 -4.256 2.654 -27.076 1.00 0.00 H new ATOM 0 HD22 ASN B 37 -5.609 2.806 -28.203 1.00 0.00 H new ATOM 2095 N ASN B 38 -3.855 3.331 -24.227 1.00 0.00 N ATOM 2096 CA ASN B 38 -4.288 2.020 -23.637 1.00 0.00 C ATOM 2097 C ASN B 38 -4.440 2.071 -22.110 1.00 0.00 C ATOM 2098 O ASN B 38 -5.280 1.392 -21.553 1.00 0.00 O ATOM 2099 CB ASN B 38 -3.244 0.960 -23.992 1.00 0.00 C ATOM 2100 CG ASN B 38 -3.256 0.718 -25.501 1.00 0.00 C ATOM 2101 OD1 ASN B 38 -4.157 1.310 -26.237 1.00 0.00 O flip ATOM 2102 ND2 ASN B 38 -2.434 -0.012 -26.018 1.00 0.00 N flip ATOM 0 H ASN B 38 -2.854 3.517 -24.167 1.00 0.00 H new ATOM 0 HA ASN B 38 -5.267 1.780 -24.052 1.00 0.00 H new ATOM 0 HB2 ASN B 38 -2.254 1.288 -23.673 1.00 0.00 H new ATOM 0 HB3 ASN B 38 -3.458 0.032 -23.462 1.00 0.00 H new ATOM 0 HD21 ASN B 38 -1.730 -0.475 -25.443 1.00 0.00 H new ATOM 0 HD22 ASN B 38 -2.448 -0.162 -27.027 1.00 0.00 H new ATOM 2109 N GLU B 39 -3.629 2.824 -21.414 1.00 0.00 N ATOM 2110 CA GLU B 39 -3.751 2.836 -19.921 1.00 0.00 C ATOM 2111 C GLU B 39 -4.904 3.752 -19.500 1.00 0.00 C ATOM 2112 O GLU B 39 -5.286 3.782 -18.348 1.00 0.00 O ATOM 2113 CB GLU B 39 -2.433 3.329 -19.288 1.00 0.00 C ATOM 2114 CG GLU B 39 -2.303 2.791 -17.862 1.00 0.00 C ATOM 2115 CD GLU B 39 -1.008 3.319 -17.242 1.00 0.00 C ATOM 2116 OE1 GLU B 39 0.051 2.927 -17.705 1.00 0.00 O ATOM 2117 OE2 GLU B 39 -1.096 4.108 -16.316 1.00 0.00 O ATOM 0 H GLU B 39 -2.900 3.422 -21.803 1.00 0.00 H new ATOM 0 HA GLU B 39 -3.955 1.823 -19.574 1.00 0.00 H new ATOM 0 HB2 GLU B 39 -1.586 2.998 -19.889 1.00 0.00 H new ATOM 0 HB3 GLU B 39 -2.410 4.419 -19.278 1.00 0.00 H new ATOM 0 HG2 GLU B 39 -3.160 3.101 -17.264 1.00 0.00 H new ATOM 0 HG3 GLU B 39 -2.298 1.701 -17.871 1.00 0.00 H new ATOM 2124 N LEU B 40 -5.457 4.504 -20.419 1.00 0.00 N ATOM 2125 CA LEU B 40 -6.582 5.427 -20.062 1.00 0.00 C ATOM 2126 C LEU B 40 -7.616 5.428 -21.196 1.00 0.00 C ATOM 2127 O LEU B 40 -8.021 6.469 -21.674 1.00 0.00 O ATOM 2128 CB LEU B 40 -6.044 6.861 -19.861 1.00 0.00 C ATOM 2129 CG LEU B 40 -4.661 6.851 -19.175 1.00 0.00 C ATOM 2130 CD1 LEU B 40 -4.072 8.266 -19.237 1.00 0.00 C ATOM 2131 CD2 LEU B 40 -4.774 6.395 -17.696 1.00 0.00 C ATOM 0 H LEU B 40 -5.179 4.520 -21.400 1.00 0.00 H new ATOM 0 HA LEU B 40 -7.046 5.085 -19.137 1.00 0.00 H new ATOM 0 HB2 LEU B 40 -5.970 7.362 -20.826 1.00 0.00 H new ATOM 0 HB3 LEU B 40 -6.748 7.434 -19.257 1.00 0.00 H new ATOM 0 HG LEU B 40 -4.012 6.146 -19.695 1.00 0.00 H new ATOM 0 HD11 LEU B 40 -3.094 8.274 -18.756 1.00 0.00 H new ATOM 0 HD12 LEU B 40 -3.967 8.571 -20.278 1.00 0.00 H new ATOM 0 HD13 LEU B 40 -4.736 8.959 -18.721 1.00 0.00 H new ATOM 0 HD21 LEU B 40 -3.785 6.397 -17.238 1.00 0.00 H new ATOM 0 HD22 LEU B 40 -5.427 7.079 -17.153 1.00 0.00 H new ATOM 0 HD23 LEU B 40 -5.190 5.388 -17.656 1.00 0.00 H new ATOM 2143 N SER B 41 -8.040 4.275 -21.635 1.00 0.00 N ATOM 2144 CA SER B 41 -9.038 4.224 -22.742 1.00 0.00 C ATOM 2145 C SER B 41 -10.326 4.947 -22.331 1.00 0.00 C ATOM 2146 O SER B 41 -10.905 5.677 -23.111 1.00 0.00 O ATOM 2147 CB SER B 41 -9.357 2.765 -23.072 1.00 0.00 C ATOM 2148 OG SER B 41 -10.281 2.719 -24.152 1.00 0.00 O ATOM 0 H SER B 41 -7.740 3.368 -21.277 1.00 0.00 H new ATOM 0 HA SER B 41 -8.619 4.718 -23.619 1.00 0.00 H new ATOM 0 HB2 SER B 41 -8.444 2.232 -23.337 1.00 0.00 H new ATOM 0 HB3 SER B 41 -9.776 2.266 -22.198 1.00 0.00 H new ATOM 0 HG SER B 41 -11.154 2.420 -23.823 1.00 0.00 H new ATOM 2154 N HIS B 42 -10.786 4.744 -21.116 1.00 0.00 N ATOM 2155 CA HIS B 42 -12.048 5.414 -20.651 1.00 0.00 C ATOM 2156 C HIS B 42 -11.757 6.304 -19.441 1.00 0.00 C ATOM 2157 O HIS B 42 -12.457 7.264 -19.184 1.00 0.00 O ATOM 2158 CB HIS B 42 -13.062 4.342 -20.248 1.00 0.00 C ATOM 2159 CG HIS B 42 -13.292 3.413 -21.408 1.00 0.00 C ATOM 2160 ND1 HIS B 42 -14.111 3.751 -22.476 1.00 0.00 N ATOM 2161 CD2 HIS B 42 -12.812 2.157 -21.685 1.00 0.00 C ATOM 2162 CE1 HIS B 42 -14.097 2.719 -23.340 1.00 0.00 C ATOM 2163 NE2 HIS B 42 -13.322 1.725 -22.903 1.00 0.00 N ATOM 0 H HIS B 42 -10.341 4.141 -20.424 1.00 0.00 H new ATOM 0 HA HIS B 42 -12.446 6.027 -21.459 1.00 0.00 H new ATOM 0 HB2 HIS B 42 -12.695 3.783 -19.387 1.00 0.00 H new ATOM 0 HB3 HIS B 42 -14.001 4.808 -19.949 1.00 0.00 H new ATOM 0 HD2 HIS B 42 -12.142 1.592 -21.054 1.00 0.00 H new ATOM 0 HE1 HIS B 42 -14.645 2.698 -24.271 1.00 0.00 H new ATOM 0 HE2 HIS B 42 -13.142 0.834 -23.366 1.00 0.00 H new ATOM 2172 N PHE B 43 -10.738 5.992 -18.691 1.00 0.00 N ATOM 2173 CA PHE B 43 -10.415 6.819 -17.495 1.00 0.00 C ATOM 2174 C PHE B 43 -10.085 8.254 -17.919 1.00 0.00 C ATOM 2175 O PHE B 43 -10.475 9.203 -17.268 1.00 0.00 O ATOM 2176 CB PHE B 43 -9.228 6.200 -16.743 1.00 0.00 C ATOM 2177 CG PHE B 43 -8.889 7.038 -15.522 1.00 0.00 C ATOM 2178 CD1 PHE B 43 -9.855 7.274 -14.531 1.00 0.00 C ATOM 2179 CD2 PHE B 43 -7.605 7.589 -15.385 1.00 0.00 C ATOM 2180 CE1 PHE B 43 -9.537 8.055 -13.413 1.00 0.00 C ATOM 2181 CE2 PHE B 43 -7.293 8.371 -14.268 1.00 0.00 C ATOM 2182 CZ PHE B 43 -8.258 8.604 -13.283 1.00 0.00 C ATOM 0 H PHE B 43 -10.115 5.201 -18.854 1.00 0.00 H new ATOM 0 HA PHE B 43 -11.281 6.844 -16.833 1.00 0.00 H new ATOM 0 HB2 PHE B 43 -9.471 5.182 -16.439 1.00 0.00 H new ATOM 0 HB3 PHE B 43 -8.362 6.137 -17.402 1.00 0.00 H new ATOM 0 HD1 PHE B 43 -10.844 6.853 -14.631 1.00 0.00 H new ATOM 0 HD2 PHE B 43 -6.857 7.409 -16.143 1.00 0.00 H new ATOM 0 HE1 PHE B 43 -10.281 8.233 -12.650 1.00 0.00 H new ATOM 0 HE2 PHE B 43 -6.305 8.796 -14.166 1.00 0.00 H new ATOM 0 HZ PHE B 43 -8.015 9.208 -12.422 1.00 0.00 H new ATOM 2192 N LEU B 44 -9.371 8.419 -19.005 1.00 0.00 N ATOM 2193 CA LEU B 44 -9.008 9.793 -19.482 1.00 0.00 C ATOM 2194 C LEU B 44 -9.321 9.881 -20.975 1.00 0.00 C ATOM 2195 O LEU B 44 -9.448 8.875 -21.645 1.00 0.00 O ATOM 2196 CB LEU B 44 -7.507 10.041 -19.247 1.00 0.00 C ATOM 2197 CG LEU B 44 -7.219 11.557 -19.181 1.00 0.00 C ATOM 2198 CD1 LEU B 44 -7.470 12.082 -17.760 1.00 0.00 C ATOM 2199 CD2 LEU B 44 -5.755 11.823 -19.551 1.00 0.00 C ATOM 0 H LEU B 44 -9.021 7.657 -19.586 1.00 0.00 H new ATOM 0 HA LEU B 44 -9.577 10.545 -18.936 1.00 0.00 H new ATOM 0 HB2 LEU B 44 -7.193 9.563 -18.319 1.00 0.00 H new ATOM 0 HB3 LEU B 44 -6.926 9.588 -20.051 1.00 0.00 H new ATOM 0 HG LEU B 44 -7.880 12.066 -19.882 1.00 0.00 H new ATOM 0 HD11 LEU B 44 -7.264 13.152 -17.726 1.00 0.00 H new ATOM 0 HD12 LEU B 44 -8.509 11.904 -17.485 1.00 0.00 H new ATOM 0 HD13 LEU B 44 -6.815 11.564 -17.060 1.00 0.00 H new ATOM 0 HD21 LEU B 44 -5.556 12.894 -19.503 1.00 0.00 H new ATOM 0 HD22 LEU B 44 -5.102 11.301 -18.851 1.00 0.00 H new ATOM 0 HD23 LEU B 44 -5.564 11.463 -20.562 1.00 0.00 H new ATOM 2211 N GLU B 45 -9.460 11.061 -21.510 1.00 0.00 N ATOM 2212 CA GLU B 45 -9.777 11.154 -22.957 1.00 0.00 C ATOM 2213 C GLU B 45 -8.731 10.369 -23.747 1.00 0.00 C ATOM 2214 O GLU B 45 -7.569 10.718 -23.803 1.00 0.00 O ATOM 2215 CB GLU B 45 -9.802 12.623 -23.405 1.00 0.00 C ATOM 2216 CG GLU B 45 -8.381 13.205 -23.442 1.00 0.00 C ATOM 2217 CD GLU B 45 -8.449 14.735 -23.363 1.00 0.00 C ATOM 2218 OE1 GLU B 45 -9.087 15.325 -24.220 1.00 0.00 O ATOM 2219 OE2 GLU B 45 -7.866 15.288 -22.445 1.00 0.00 O ATOM 0 H GLU B 45 -9.369 11.949 -21.017 1.00 0.00 H new ATOM 0 HA GLU B 45 -10.763 10.729 -23.143 1.00 0.00 H new ATOM 0 HB2 GLU B 45 -10.257 12.699 -24.393 1.00 0.00 H new ATOM 0 HB3 GLU B 45 -10.421 13.206 -22.723 1.00 0.00 H new ATOM 0 HG2 GLU B 45 -7.795 12.814 -22.610 1.00 0.00 H new ATOM 0 HG3 GLU B 45 -7.876 12.900 -24.359 1.00 0.00 H new ATOM 2226 N GLU B 46 -9.149 9.295 -24.346 1.00 0.00 N ATOM 2227 CA GLU B 46 -8.216 8.451 -25.138 1.00 0.00 C ATOM 2228 C GLU B 46 -7.666 9.270 -26.310 1.00 0.00 C ATOM 2229 O GLU B 46 -8.342 10.119 -26.849 1.00 0.00 O ATOM 2230 CB GLU B 46 -8.990 7.243 -25.675 1.00 0.00 C ATOM 2231 CG GLU B 46 -8.046 6.301 -26.421 1.00 0.00 C ATOM 2232 CD GLU B 46 -8.838 5.103 -26.948 1.00 0.00 C ATOM 2233 OE1 GLU B 46 -10.016 5.017 -26.643 1.00 0.00 O ATOM 2234 OE2 GLU B 46 -8.253 4.289 -27.644 1.00 0.00 O ATOM 0 H GLU B 46 -10.112 8.960 -24.321 1.00 0.00 H new ATOM 0 HA GLU B 46 -7.388 8.115 -24.514 1.00 0.00 H new ATOM 0 HB2 GLU B 46 -9.469 6.713 -24.851 1.00 0.00 H new ATOM 0 HB3 GLU B 46 -9.784 7.578 -26.343 1.00 0.00 H new ATOM 0 HG2 GLU B 46 -7.567 6.827 -27.247 1.00 0.00 H new ATOM 0 HG3 GLU B 46 -7.252 5.962 -25.756 1.00 0.00 H new ATOM 2241 N ILE B 47 -6.444 9.031 -26.711 1.00 0.00 N ATOM 2242 CA ILE B 47 -5.873 9.806 -27.854 1.00 0.00 C ATOM 2243 C ILE B 47 -6.253 9.101 -29.157 1.00 0.00 C ATOM 2244 O ILE B 47 -6.182 7.892 -29.260 1.00 0.00 O ATOM 2245 CB ILE B 47 -4.341 9.878 -27.745 1.00 0.00 C ATOM 2246 CG1 ILE B 47 -3.931 10.415 -26.353 1.00 0.00 C ATOM 2247 CG2 ILE B 47 -3.776 10.783 -28.865 1.00 0.00 C ATOM 2248 CD1 ILE B 47 -4.054 11.945 -26.282 1.00 0.00 C ATOM 0 H ILE B 47 -5.820 8.337 -26.300 1.00 0.00 H new ATOM 0 HA ILE B 47 -6.271 10.821 -27.836 1.00 0.00 H new ATOM 0 HB ILE B 47 -3.927 8.877 -27.863 1.00 0.00 H new ATOM 0 HG12 ILE B 47 -4.561 9.962 -25.587 1.00 0.00 H new ATOM 0 HG13 ILE B 47 -2.904 10.121 -26.136 1.00 0.00 H new ATOM 0 HG21 ILE B 47 -2.690 10.830 -28.782 1.00 0.00 H new ATOM 0 HG22 ILE B 47 -4.048 10.372 -29.837 1.00 0.00 H new ATOM 0 HG23 ILE B 47 -4.191 11.786 -28.766 1.00 0.00 H new ATOM 0 HD11 ILE B 47 -3.758 12.288 -25.291 1.00 0.00 H new ATOM 0 HD12 ILE B 47 -3.404 12.397 -27.031 1.00 0.00 H new ATOM 0 HD13 ILE B 47 -5.087 12.236 -26.474 1.00 0.00 H new ATOM 2260 N LYS B 48 -6.679 9.845 -30.144 1.00 0.00 N ATOM 2261 CA LYS B 48 -7.097 9.228 -31.442 1.00 0.00 C ATOM 2262 C LYS B 48 -6.047 9.509 -32.520 1.00 0.00 C ATOM 2263 O LYS B 48 -6.033 8.873 -33.555 1.00 0.00 O ATOM 2264 CB LYS B 48 -8.437 9.844 -31.881 1.00 0.00 C ATOM 2265 CG LYS B 48 -9.376 10.010 -30.677 1.00 0.00 C ATOM 2266 CD LYS B 48 -9.769 8.646 -30.108 1.00 0.00 C ATOM 2267 CE LYS B 48 -10.643 8.863 -28.877 1.00 0.00 C ATOM 2268 NZ LYS B 48 -11.926 9.504 -29.282 1.00 0.00 N ATOM 0 H LYS B 48 -6.757 10.861 -30.108 1.00 0.00 H new ATOM 0 HA LYS B 48 -7.199 8.151 -31.310 1.00 0.00 H new ATOM 0 HB2 LYS B 48 -8.262 10.813 -32.349 1.00 0.00 H new ATOM 0 HB3 LYS B 48 -8.907 9.208 -32.631 1.00 0.00 H new ATOM 0 HG2 LYS B 48 -8.886 10.604 -29.906 1.00 0.00 H new ATOM 0 HG3 LYS B 48 -10.270 10.555 -30.979 1.00 0.00 H new ATOM 0 HD2 LYS B 48 -10.308 8.065 -30.857 1.00 0.00 H new ATOM 0 HD3 LYS B 48 -8.878 8.076 -29.843 1.00 0.00 H new ATOM 0 HE2 LYS B 48 -10.840 7.910 -28.386 1.00 0.00 H new ATOM 0 HE3 LYS B 48 -10.122 9.492 -28.155 1.00 0.00 H new ATOM 0 HZ1 LYS B 48 -12.640 9.349 -28.542 1.00 0.00 H new ATOM 0 HZ2 LYS B 48 -11.778 10.525 -29.412 1.00 0.00 H new ATOM 0 HZ3 LYS B 48 -12.256 9.086 -30.175 1.00 0.00 H new ATOM 2282 N GLU B 49 -5.188 10.473 -32.305 1.00 0.00 N ATOM 2283 CA GLU B 49 -4.163 10.809 -33.339 1.00 0.00 C ATOM 2284 C GLU B 49 -2.812 11.122 -32.677 1.00 0.00 C ATOM 2285 O GLU B 49 -2.742 11.722 -31.623 1.00 0.00 O ATOM 2286 CB GLU B 49 -4.658 12.022 -34.126 1.00 0.00 C ATOM 2287 CG GLU B 49 -3.759 12.258 -35.342 1.00 0.00 C ATOM 2288 CD GLU B 49 -4.015 11.169 -36.387 1.00 0.00 C ATOM 2289 OE1 GLU B 49 -5.064 10.549 -36.324 1.00 0.00 O ATOM 2290 OE2 GLU B 49 -3.158 10.974 -37.232 1.00 0.00 O ATOM 0 H GLU B 49 -5.152 11.041 -31.459 1.00 0.00 H new ATOM 0 HA GLU B 49 -4.019 9.960 -34.007 1.00 0.00 H new ATOM 0 HB2 GLU B 49 -5.686 11.861 -34.449 1.00 0.00 H new ATOM 0 HB3 GLU B 49 -4.659 12.905 -33.487 1.00 0.00 H new ATOM 0 HG2 GLU B 49 -3.958 13.241 -35.769 1.00 0.00 H new ATOM 0 HG3 GLU B 49 -2.712 12.248 -35.040 1.00 0.00 H new ATOM 2297 N GLN B 50 -1.744 10.708 -33.305 1.00 0.00 N ATOM 2298 CA GLN B 50 -0.373 10.953 -32.759 1.00 0.00 C ATOM 2299 C GLN B 50 -0.104 12.460 -32.643 1.00 0.00 C ATOM 2300 O GLN B 50 0.697 12.887 -31.843 1.00 0.00 O ATOM 2301 CB GLN B 50 0.655 10.326 -33.711 1.00 0.00 C ATOM 2302 CG GLN B 50 2.059 10.359 -33.090 1.00 0.00 C ATOM 2303 CD GLN B 50 2.189 9.254 -32.039 1.00 0.00 C ATOM 2304 OE1 GLN B 50 2.320 9.575 -30.781 1.00 0.00 O flip ATOM 2305 NE2 GLN B 50 2.177 8.085 -32.369 1.00 0.00 N flip ATOM 0 H GLN B 50 -1.762 10.201 -34.190 1.00 0.00 H new ATOM 0 HA GLN B 50 -0.295 10.507 -31.768 1.00 0.00 H new ATOM 0 HB2 GLN B 50 0.373 9.296 -33.932 1.00 0.00 H new ATOM 0 HB3 GLN B 50 0.658 10.866 -34.658 1.00 0.00 H new ATOM 0 HG2 GLN B 50 2.813 10.225 -33.866 1.00 0.00 H new ATOM 0 HG3 GLN B 50 2.241 11.331 -32.633 1.00 0.00 H new ATOM 0 HE21 GLN B 50 2.075 7.834 -33.352 1.00 0.00 H new ATOM 0 HE22 GLN B 50 2.269 7.355 -31.663 1.00 0.00 H new ATOM 2314 N GLU B 51 -0.740 13.267 -33.449 1.00 0.00 N ATOM 2315 CA GLU B 51 -0.478 14.739 -33.390 1.00 0.00 C ATOM 2316 C GLU B 51 -0.816 15.279 -32.002 1.00 0.00 C ATOM 2317 O GLU B 51 -0.135 16.141 -31.495 1.00 0.00 O ATOM 2318 CB GLU B 51 -1.321 15.462 -34.451 1.00 0.00 C ATOM 2319 CG GLU B 51 -2.792 15.473 -34.032 1.00 0.00 C ATOM 2320 CD GLU B 51 -3.662 15.894 -35.218 1.00 0.00 C ATOM 2321 OE1 GLU B 51 -3.151 16.580 -36.088 1.00 0.00 O ATOM 2322 OE2 GLU B 51 -4.824 15.522 -35.237 1.00 0.00 O ATOM 0 H GLU B 51 -1.427 12.975 -34.144 1.00 0.00 H new ATOM 0 HA GLU B 51 0.579 14.917 -33.590 1.00 0.00 H new ATOM 0 HB2 GLU B 51 -0.963 16.484 -34.578 1.00 0.00 H new ATOM 0 HB3 GLU B 51 -1.213 14.964 -35.415 1.00 0.00 H new ATOM 0 HG2 GLU B 51 -3.089 14.484 -33.684 1.00 0.00 H new ATOM 0 HG3 GLU B 51 -2.938 16.161 -33.199 1.00 0.00 H new ATOM 2329 N VAL B 52 -1.846 14.787 -31.376 1.00 0.00 N ATOM 2330 CA VAL B 52 -2.178 15.295 -30.020 1.00 0.00 C ATOM 2331 C VAL B 52 -0.997 15.027 -29.114 1.00 0.00 C ATOM 2332 O VAL B 52 -0.634 15.836 -28.293 1.00 0.00 O ATOM 2333 CB VAL B 52 -3.404 14.561 -29.489 1.00 0.00 C ATOM 2334 CG1 VAL B 52 -3.706 15.021 -28.064 1.00 0.00 C ATOM 2335 CG2 VAL B 52 -4.600 14.858 -30.390 1.00 0.00 C ATOM 0 H VAL B 52 -2.466 14.063 -31.740 1.00 0.00 H new ATOM 0 HA VAL B 52 -2.392 16.363 -30.057 1.00 0.00 H new ATOM 0 HB VAL B 52 -3.210 13.488 -29.483 1.00 0.00 H new ATOM 0 HG11 VAL B 52 -4.583 14.493 -27.689 1.00 0.00 H new ATOM 0 HG12 VAL B 52 -2.851 14.805 -27.423 1.00 0.00 H new ATOM 0 HG13 VAL B 52 -3.899 16.094 -28.061 1.00 0.00 H new ATOM 0 HG21 VAL B 52 -5.479 14.334 -30.013 1.00 0.00 H new ATOM 0 HG22 VAL B 52 -4.792 15.931 -30.397 1.00 0.00 H new ATOM 0 HG23 VAL B 52 -4.384 14.521 -31.404 1.00 0.00 H new ATOM 2345 N VAL B 53 -0.398 13.893 -29.268 1.00 0.00 N ATOM 2346 CA VAL B 53 0.772 13.547 -28.437 1.00 0.00 C ATOM 2347 C VAL B 53 1.903 14.523 -28.736 1.00 0.00 C ATOM 2348 O VAL B 53 2.634 14.912 -27.860 1.00 0.00 O ATOM 2349 CB VAL B 53 1.195 12.126 -28.769 1.00 0.00 C ATOM 2350 CG1 VAL B 53 2.323 11.692 -27.845 1.00 0.00 C ATOM 2351 CG2 VAL B 53 0.000 11.205 -28.580 1.00 0.00 C ATOM 0 H VAL B 53 -0.673 13.180 -29.944 1.00 0.00 H new ATOM 0 HA VAL B 53 0.525 13.612 -27.377 1.00 0.00 H new ATOM 0 HB VAL B 53 1.545 12.078 -29.800 1.00 0.00 H new ATOM 0 HG11 VAL B 53 2.621 10.672 -28.089 1.00 0.00 H new ATOM 0 HG12 VAL B 53 3.175 12.360 -27.973 1.00 0.00 H new ATOM 0 HG13 VAL B 53 1.982 11.733 -26.811 1.00 0.00 H new ATOM 0 HG21 VAL B 53 0.289 10.181 -28.815 1.00 0.00 H new ATOM 0 HG22 VAL B 53 -0.340 11.258 -27.546 1.00 0.00 H new ATOM 0 HG23 VAL B 53 -0.807 11.515 -29.244 1.00 0.00 H new ATOM 2361 N ASP B 54 2.049 14.910 -29.973 1.00 0.00 N ATOM 2362 CA ASP B 54 3.125 15.868 -30.354 1.00 0.00 C ATOM 2363 C ASP B 54 2.919 17.193 -29.616 1.00 0.00 C ATOM 2364 O ASP B 54 3.848 17.832 -29.169 1.00 0.00 O ATOM 2365 CB ASP B 54 3.085 16.108 -31.865 1.00 0.00 C ATOM 2366 CG ASP B 54 4.189 17.092 -32.256 1.00 0.00 C ATOM 2367 OD1 ASP B 54 4.068 18.256 -31.911 1.00 0.00 O ATOM 2368 OD2 ASP B 54 5.137 16.665 -32.895 1.00 0.00 O ATOM 0 H ASP B 54 1.461 14.599 -30.746 1.00 0.00 H new ATOM 0 HA ASP B 54 4.094 15.451 -30.080 1.00 0.00 H new ATOM 0 HB2 ASP B 54 3.218 15.166 -32.397 1.00 0.00 H new ATOM 0 HB3 ASP B 54 2.112 16.503 -32.155 1.00 0.00 H new ATOM 2373 N LYS B 55 1.700 17.610 -29.498 1.00 0.00 N ATOM 2374 CA LYS B 55 1.405 18.889 -28.796 1.00 0.00 C ATOM 2375 C LYS B 55 1.755 18.706 -27.325 1.00 0.00 C ATOM 2376 O LYS B 55 2.323 19.571 -26.677 1.00 0.00 O ATOM 2377 CB LYS B 55 -0.083 19.216 -28.944 1.00 0.00 C ATOM 2378 CG LYS B 55 -0.349 20.634 -28.443 1.00 0.00 C ATOM 2379 CD LYS B 55 -1.836 20.960 -28.592 1.00 0.00 C ATOM 2380 CE LYS B 55 -2.075 22.424 -28.218 1.00 0.00 C ATOM 2381 NZ LYS B 55 -1.300 23.303 -29.139 1.00 0.00 N ATOM 0 H LYS B 55 0.883 17.119 -29.860 1.00 0.00 H new ATOM 0 HA LYS B 55 1.986 19.707 -29.221 1.00 0.00 H new ATOM 0 HB2 LYS B 55 -0.383 19.126 -29.988 1.00 0.00 H new ATOM 0 HB3 LYS B 55 -0.681 18.502 -28.378 1.00 0.00 H new ATOM 0 HG2 LYS B 55 -0.049 20.724 -27.399 1.00 0.00 H new ATOM 0 HG3 LYS B 55 0.249 21.349 -29.009 1.00 0.00 H new ATOM 0 HD2 LYS B 55 -2.159 20.778 -29.617 1.00 0.00 H new ATOM 0 HD3 LYS B 55 -2.429 20.308 -27.951 1.00 0.00 H new ATOM 0 HE2 LYS B 55 -3.138 22.658 -28.282 1.00 0.00 H new ATOM 0 HE3 LYS B 55 -1.771 22.602 -27.186 1.00 0.00 H new ATOM 0 HZ1 LYS B 55 -1.891 24.108 -29.430 1.00 0.00 H new ATOM 0 HZ2 LYS B 55 -0.451 23.655 -28.651 1.00 0.00 H new ATOM 0 HZ3 LYS B 55 -1.016 22.761 -29.980 1.00 0.00 H new ATOM 2395 N VAL B 56 1.438 17.559 -26.809 1.00 0.00 N ATOM 2396 CA VAL B 56 1.752 17.256 -25.392 1.00 0.00 C ATOM 2397 C VAL B 56 3.269 17.203 -25.246 1.00 0.00 C ATOM 2398 O VAL B 56 3.819 17.495 -24.203 1.00 0.00 O ATOM 2399 CB VAL B 56 1.127 15.909 -25.013 1.00 0.00 C ATOM 2400 CG1 VAL B 56 1.662 15.442 -23.658 1.00 0.00 C ATOM 2401 CG2 VAL B 56 -0.391 16.072 -24.923 1.00 0.00 C ATOM 0 H VAL B 56 0.968 16.808 -27.315 1.00 0.00 H new ATOM 0 HA VAL B 56 1.347 18.022 -24.731 1.00 0.00 H new ATOM 0 HB VAL B 56 1.383 15.169 -25.771 1.00 0.00 H new ATOM 0 HG11 VAL B 56 1.211 14.484 -23.399 1.00 0.00 H new ATOM 0 HG12 VAL B 56 2.745 15.330 -23.713 1.00 0.00 H new ATOM 0 HG13 VAL B 56 1.412 16.179 -22.895 1.00 0.00 H new ATOM 0 HG21 VAL B 56 -0.844 15.118 -24.654 1.00 0.00 H new ATOM 0 HG22 VAL B 56 -0.633 16.816 -24.164 1.00 0.00 H new ATOM 0 HG23 VAL B 56 -0.780 16.399 -25.887 1.00 0.00 H new ATOM 2411 N MET B 57 3.947 16.840 -26.300 1.00 0.00 N ATOM 2412 CA MET B 57 5.434 16.775 -26.241 1.00 0.00 C ATOM 2413 C MET B 57 5.974 18.194 -26.083 1.00 0.00 C ATOM 2414 O MET B 57 6.934 18.425 -25.395 1.00 0.00 O ATOM 2415 CB MET B 57 5.996 16.124 -27.529 1.00 0.00 C ATOM 2416 CG MET B 57 6.176 14.582 -27.371 1.00 0.00 C ATOM 2417 SD MET B 57 7.943 14.169 -27.591 1.00 0.00 S ATOM 2418 CE MET B 57 8.169 12.886 -26.320 1.00 0.00 C ATOM 0 H MET B 57 3.536 16.586 -27.198 1.00 0.00 H new ATOM 0 HA MET B 57 5.745 16.164 -25.393 1.00 0.00 H new ATOM 0 HB2 MET B 57 5.323 16.327 -28.362 1.00 0.00 H new ATOM 0 HB3 MET B 57 6.956 16.578 -27.776 1.00 0.00 H new ATOM 0 HG2 MET B 57 5.833 14.261 -26.387 1.00 0.00 H new ATOM 0 HG3 MET B 57 5.571 14.054 -28.108 1.00 0.00 H new ATOM 0 HE1 MET B 57 8.889 13.232 -25.578 1.00 0.00 H new ATOM 0 HE2 MET B 57 7.215 12.684 -25.833 1.00 0.00 H new ATOM 0 HE3 MET B 57 8.539 11.973 -26.786 1.00 0.00 H new ATOM 2428 N GLU B 58 5.358 19.161 -26.686 1.00 0.00 N ATOM 2429 CA GLU B 58 5.869 20.546 -26.518 1.00 0.00 C ATOM 2430 C GLU B 58 5.937 20.813 -25.022 1.00 0.00 C ATOM 2431 O GLU B 58 6.840 21.453 -24.519 1.00 0.00 O ATOM 2432 CB GLU B 58 4.895 21.535 -27.155 1.00 0.00 C ATOM 2433 CG GLU B 58 4.717 21.190 -28.628 1.00 0.00 C ATOM 2434 CD GLU B 58 6.054 21.339 -29.358 1.00 0.00 C ATOM 2435 OE1 GLU B 58 6.596 22.431 -29.342 1.00 0.00 O ATOM 2436 OE2 GLU B 58 6.510 20.359 -29.924 1.00 0.00 O ATOM 0 H GLU B 58 4.535 19.060 -27.280 1.00 0.00 H new ATOM 0 HA GLU B 58 6.845 20.660 -26.990 1.00 0.00 H new ATOM 0 HB2 GLU B 58 3.934 21.498 -26.642 1.00 0.00 H new ATOM 0 HB3 GLU B 58 5.272 22.552 -27.051 1.00 0.00 H new ATOM 0 HG2 GLU B 58 4.348 20.170 -28.730 1.00 0.00 H new ATOM 0 HG3 GLU B 58 3.971 21.846 -29.077 1.00 0.00 H new ATOM 2443 N THR B 59 4.967 20.314 -24.316 1.00 0.00 N ATOM 2444 CA THR B 59 4.920 20.507 -22.847 1.00 0.00 C ATOM 2445 C THR B 59 5.840 19.520 -22.108 1.00 0.00 C ATOM 2446 O THR B 59 6.579 19.901 -21.221 1.00 0.00 O ATOM 2447 CB THR B 59 3.482 20.290 -22.385 1.00 0.00 C ATOM 2448 OG1 THR B 59 2.597 20.957 -23.274 1.00 0.00 O ATOM 2449 CG2 THR B 59 3.304 20.847 -20.981 1.00 0.00 C ATOM 0 H THR B 59 4.193 19.772 -24.702 1.00 0.00 H new ATOM 0 HA THR B 59 5.265 21.515 -22.618 1.00 0.00 H new ATOM 0 HB THR B 59 3.261 19.223 -22.379 1.00 0.00 H new ATOM 0 HG1 THR B 59 1.672 20.818 -22.981 1.00 0.00 H new ATOM 0 HG21 THR B 59 2.276 20.690 -20.655 1.00 0.00 H new ATOM 0 HG22 THR B 59 3.983 20.336 -20.298 1.00 0.00 H new ATOM 0 HG23 THR B 59 3.525 21.914 -20.982 1.00 0.00 H new ATOM 2457 N LEU B 60 5.775 18.251 -22.429 1.00 0.00 N ATOM 2458 CA LEU B 60 6.618 17.249 -21.701 1.00 0.00 C ATOM 2459 C LEU B 60 7.973 17.079 -22.375 1.00 0.00 C ATOM 2460 O LEU B 60 8.882 16.512 -21.804 1.00 0.00 O ATOM 2461 CB LEU B 60 5.907 15.895 -21.682 1.00 0.00 C ATOM 2462 CG LEU B 60 4.464 16.060 -21.197 1.00 0.00 C ATOM 2463 CD1 LEU B 60 3.837 14.674 -21.031 1.00 0.00 C ATOM 2464 CD2 LEU B 60 4.441 16.801 -19.853 1.00 0.00 C ATOM 0 H LEU B 60 5.178 17.866 -23.160 1.00 0.00 H new ATOM 0 HA LEU B 60 6.771 17.613 -20.685 1.00 0.00 H new ATOM 0 HB2 LEU B 60 5.915 15.458 -22.681 1.00 0.00 H new ATOM 0 HB3 LEU B 60 6.441 15.205 -21.028 1.00 0.00 H new ATOM 0 HG LEU B 60 3.898 16.640 -21.926 1.00 0.00 H new ATOM 0 HD11 LEU B 60 2.808 14.779 -20.686 1.00 0.00 H new ATOM 0 HD12 LEU B 60 3.847 14.153 -21.988 1.00 0.00 H new ATOM 0 HD13 LEU B 60 4.408 14.101 -20.300 1.00 0.00 H new ATOM 0 HD21 LEU B 60 3.410 16.913 -19.517 1.00 0.00 H new ATOM 0 HD22 LEU B 60 5.004 16.231 -19.114 1.00 0.00 H new ATOM 0 HD23 LEU B 60 4.893 17.786 -19.973 1.00 0.00 H new ATOM 2476 N ASP B 61 8.137 17.560 -23.572 1.00 0.00 N ATOM 2477 CA ASP B 61 9.465 17.406 -24.232 1.00 0.00 C ATOM 2478 C ASP B 61 10.367 18.497 -23.688 1.00 0.00 C ATOM 2479 O ASP B 61 10.850 19.352 -24.403 1.00 0.00 O ATOM 2480 CB ASP B 61 9.348 17.529 -25.752 1.00 0.00 C ATOM 2481 CG ASP B 61 10.644 17.039 -26.399 1.00 0.00 C ATOM 2482 OD1 ASP B 61 11.599 16.816 -25.670 1.00 0.00 O ATOM 2483 OD2 ASP B 61 10.661 16.897 -27.610 1.00 0.00 O ATOM 0 H ASP B 61 7.424 18.046 -24.117 1.00 0.00 H new ATOM 0 HA ASP B 61 9.873 16.417 -24.021 1.00 0.00 H new ATOM 0 HB2 ASP B 61 8.503 16.942 -26.112 1.00 0.00 H new ATOM 0 HB3 ASP B 61 9.158 18.565 -26.031 1.00 0.00 H new ATOM 2488 N GLU B 62 10.574 18.467 -22.410 1.00 0.00 N ATOM 2489 CA GLU B 62 11.423 19.491 -21.758 1.00 0.00 C ATOM 2490 C GLU B 62 12.817 19.438 -22.378 1.00 0.00 C ATOM 2491 O GLU B 62 13.439 20.452 -22.625 1.00 0.00 O ATOM 2492 CB GLU B 62 11.510 19.174 -20.268 1.00 0.00 C ATOM 2493 CG GLU B 62 10.095 19.045 -19.694 1.00 0.00 C ATOM 2494 CD GLU B 62 10.178 18.796 -18.187 1.00 0.00 C ATOM 2495 OE1 GLU B 62 11.272 18.552 -17.706 1.00 0.00 O ATOM 2496 OE2 GLU B 62 9.145 18.856 -17.539 1.00 0.00 O ATOM 0 H GLU B 62 10.186 17.766 -21.779 1.00 0.00 H new ATOM 0 HA GLU B 62 11.000 20.486 -21.897 1.00 0.00 H new ATOM 0 HB2 GLU B 62 12.063 18.248 -20.113 1.00 0.00 H new ATOM 0 HB3 GLU B 62 12.055 19.962 -19.748 1.00 0.00 H new ATOM 0 HG2 GLU B 62 9.526 19.953 -19.893 1.00 0.00 H new ATOM 0 HG3 GLU B 62 9.567 18.225 -20.181 1.00 0.00 H new ATOM 2503 N ASP B 63 13.304 18.261 -22.642 1.00 0.00 N ATOM 2504 CA ASP B 63 14.651 18.136 -23.260 1.00 0.00 C ATOM 2505 C ASP B 63 14.548 18.515 -24.739 1.00 0.00 C ATOM 2506 O ASP B 63 15.540 18.697 -25.417 1.00 0.00 O ATOM 2507 CB ASP B 63 15.129 16.688 -23.133 1.00 0.00 C ATOM 2508 CG ASP B 63 15.263 16.324 -21.654 1.00 0.00 C ATOM 2509 OD1 ASP B 63 15.934 17.054 -20.943 1.00 0.00 O ATOM 2510 OD2 ASP B 63 14.683 15.328 -21.256 1.00 0.00 O ATOM 0 HA ASP B 63 15.359 18.795 -22.758 1.00 0.00 H new ATOM 0 HB2 ASP B 63 14.423 16.016 -23.621 1.00 0.00 H new ATOM 0 HB3 ASP B 63 16.087 16.564 -23.637 1.00 0.00 H new ATOM 2515 N GLY B 64 13.347 18.648 -25.239 1.00 0.00 N ATOM 2516 CA GLY B 64 13.168 19.031 -26.673 1.00 0.00 C ATOM 2517 C GLY B 64 13.806 17.975 -27.580 1.00 0.00 C ATOM 2518 O GLY B 64 14.292 18.286 -28.650 1.00 0.00 O ATOM 0 H GLY B 64 12.482 18.508 -24.717 1.00 0.00 H new ATOM 0 HA2 GLY B 64 12.107 19.127 -26.903 1.00 0.00 H new ATOM 0 HA3 GLY B 64 13.623 20.004 -26.858 1.00 0.00 H new ATOM 2522 N ASP B 65 13.818 16.731 -27.162 1.00 0.00 N ATOM 2523 CA ASP B 65 14.436 15.650 -27.998 1.00 0.00 C ATOM 2524 C ASP B 65 13.348 14.760 -28.596 1.00 0.00 C ATOM 2525 O ASP B 65 13.629 13.743 -29.198 1.00 0.00 O ATOM 2526 CB ASP B 65 15.360 14.808 -27.117 1.00 0.00 C ATOM 2527 CG ASP B 65 14.580 14.284 -25.911 1.00 0.00 C ATOM 2528 OD1 ASP B 65 13.479 14.761 -25.689 1.00 0.00 O ATOM 2529 OD2 ASP B 65 15.096 13.415 -25.228 1.00 0.00 O ATOM 0 H ASP B 65 13.425 16.416 -26.275 1.00 0.00 H new ATOM 0 HA ASP B 65 15.005 16.102 -28.810 1.00 0.00 H new ATOM 0 HB2 ASP B 65 15.766 13.975 -27.690 1.00 0.00 H new ATOM 0 HB3 ASP B 65 16.207 15.408 -26.783 1.00 0.00 H new ATOM 2534 N GLY B 66 12.108 15.118 -28.424 1.00 0.00 N ATOM 2535 CA GLY B 66 11.015 14.270 -28.973 1.00 0.00 C ATOM 2536 C GLY B 66 10.832 13.070 -28.045 1.00 0.00 C ATOM 2537 O GLY B 66 10.124 12.130 -28.346 1.00 0.00 O ATOM 0 H GLY B 66 11.804 15.957 -27.930 1.00 0.00 H new ATOM 0 HA2 GLY B 66 10.089 14.841 -29.043 1.00 0.00 H new ATOM 0 HA3 GLY B 66 11.262 13.937 -29.981 1.00 0.00 H new ATOM 2541 N GLU B 67 11.488 13.106 -26.916 1.00 0.00 N ATOM 2542 CA GLU B 67 11.402 11.994 -25.928 1.00 0.00 C ATOM 2543 C GLU B 67 11.341 12.587 -24.515 1.00 0.00 C ATOM 2544 O GLU B 67 12.057 13.518 -24.200 1.00 0.00 O ATOM 2545 CB GLU B 67 12.658 11.124 -26.056 1.00 0.00 C ATOM 2546 CG GLU B 67 12.741 10.538 -27.467 1.00 0.00 C ATOM 2547 CD GLU B 67 13.994 9.670 -27.593 1.00 0.00 C ATOM 2548 OE1 GLU B 67 14.806 9.699 -26.683 1.00 0.00 O ATOM 2549 OE2 GLU B 67 14.117 8.986 -28.596 1.00 0.00 O ATOM 0 H GLU B 67 12.093 13.877 -26.632 1.00 0.00 H new ATOM 0 HA GLU B 67 10.512 11.393 -26.114 1.00 0.00 H new ATOM 0 HB2 GLU B 67 13.547 11.719 -25.847 1.00 0.00 H new ATOM 0 HB3 GLU B 67 12.632 10.321 -25.320 1.00 0.00 H new ATOM 0 HG2 GLU B 67 11.852 9.943 -27.677 1.00 0.00 H new ATOM 0 HG3 GLU B 67 12.768 11.341 -28.204 1.00 0.00 H new ATOM 2556 N CYS B 68 10.506 12.046 -23.656 1.00 0.00 N ATOM 2557 CA CYS B 68 10.403 12.562 -22.248 1.00 0.00 C ATOM 2558 C CYS B 68 10.928 11.482 -21.294 1.00 0.00 C ATOM 2559 O CYS B 68 10.549 10.331 -21.365 1.00 0.00 O ATOM 2560 CB CYS B 68 8.932 12.914 -21.910 1.00 0.00 C ATOM 2561 SG CYS B 68 7.827 12.186 -23.147 1.00 0.00 S ATOM 0 H CYS B 68 9.887 11.264 -23.870 1.00 0.00 H new ATOM 0 HA CYS B 68 10.998 13.469 -22.141 1.00 0.00 H new ATOM 0 HB2 CYS B 68 8.678 12.541 -20.918 1.00 0.00 H new ATOM 0 HB3 CYS B 68 8.804 13.996 -21.886 1.00 0.00 H new ATOM 0 HG CYS B 68 6.683 12.803 -23.123 1.00 0.00 H new ATOM 2567 N ASP B 69 11.802 11.858 -20.408 1.00 0.00 N ATOM 2568 CA ASP B 69 12.372 10.883 -19.441 1.00 0.00 C ATOM 2569 C ASP B 69 11.292 10.481 -18.438 1.00 0.00 C ATOM 2570 O ASP B 69 10.322 11.188 -18.248 1.00 0.00 O ATOM 2571 CB ASP B 69 13.528 11.545 -18.685 1.00 0.00 C ATOM 2572 CG ASP B 69 14.712 11.760 -19.628 1.00 0.00 C ATOM 2573 OD1 ASP B 69 14.762 11.097 -20.648 1.00 0.00 O ATOM 2574 OD2 ASP B 69 15.551 12.589 -19.314 1.00 0.00 O ATOM 0 H ASP B 69 12.151 12.812 -20.311 1.00 0.00 H new ATOM 0 HA ASP B 69 12.730 10.003 -19.974 1.00 0.00 H new ATOM 0 HB2 ASP B 69 13.204 12.500 -18.271 1.00 0.00 H new ATOM 0 HB3 ASP B 69 13.830 10.920 -17.845 1.00 0.00 H new ATOM 2579 N PHE B 70 11.460 9.366 -17.773 1.00 0.00 N ATOM 2580 CA PHE B 70 10.462 8.939 -16.762 1.00 0.00 C ATOM 2581 C PHE B 70 10.157 10.144 -15.868 1.00 0.00 C ATOM 2582 O PHE B 70 9.039 10.362 -15.463 1.00 0.00 O ATOM 2583 CB PHE B 70 11.068 7.780 -15.958 1.00 0.00 C ATOM 2584 CG PHE B 70 10.374 7.615 -14.625 1.00 0.00 C ATOM 2585 CD1 PHE B 70 8.977 7.644 -14.545 1.00 0.00 C ATOM 2586 CD2 PHE B 70 11.137 7.427 -13.468 1.00 0.00 C ATOM 2587 CE1 PHE B 70 8.347 7.486 -13.307 1.00 0.00 C ATOM 2588 CE2 PHE B 70 10.508 7.270 -12.234 1.00 0.00 C ATOM 2589 CZ PHE B 70 9.112 7.299 -12.150 1.00 0.00 C ATOM 0 H PHE B 70 12.252 8.734 -17.892 1.00 0.00 H new ATOM 0 HA PHE B 70 9.533 8.597 -17.218 1.00 0.00 H new ATOM 0 HB2 PHE B 70 10.986 6.856 -16.530 1.00 0.00 H new ATOM 0 HB3 PHE B 70 12.131 7.962 -15.797 1.00 0.00 H new ATOM 0 HD1 PHE B 70 8.387 7.788 -15.438 1.00 0.00 H new ATOM 0 HD2 PHE B 70 12.215 7.403 -13.531 1.00 0.00 H new ATOM 0 HE1 PHE B 70 7.269 7.508 -13.243 1.00 0.00 H new ATOM 0 HE2 PHE B 70 11.099 7.126 -11.342 1.00 0.00 H new ATOM 0 HZ PHE B 70 8.625 7.177 -11.194 1.00 0.00 H new ATOM 2599 N GLN B 71 11.155 10.937 -15.589 1.00 0.00 N ATOM 2600 CA GLN B 71 10.948 12.158 -14.761 1.00 0.00 C ATOM 2601 C GLN B 71 9.937 13.088 -15.447 1.00 0.00 C ATOM 2602 O GLN B 71 9.010 13.578 -14.837 1.00 0.00 O ATOM 2603 CB GLN B 71 12.299 12.878 -14.605 1.00 0.00 C ATOM 2604 CG GLN B 71 12.088 14.307 -14.087 1.00 0.00 C ATOM 2605 CD GLN B 71 13.433 14.923 -13.689 1.00 0.00 C ATOM 2606 OE1 GLN B 71 14.500 14.172 -13.637 1.00 0.00 O flip ATOM 2607 NE2 GLN B 71 13.514 16.107 -13.424 1.00 0.00 N flip ATOM 0 H GLN B 71 12.114 10.789 -15.903 1.00 0.00 H new ATOM 0 HA GLN B 71 10.558 11.882 -13.781 1.00 0.00 H new ATOM 0 HB2 GLN B 71 12.935 12.325 -13.915 1.00 0.00 H new ATOM 0 HB3 GLN B 71 12.817 12.905 -15.564 1.00 0.00 H new ATOM 0 HG2 GLN B 71 11.613 14.915 -14.857 1.00 0.00 H new ATOM 0 HG3 GLN B 71 11.415 14.296 -13.229 1.00 0.00 H new ATOM 0 HE21 GLN B 71 12.683 16.697 -13.464 1.00 0.00 H new ATOM 0 HE22 GLN B 71 14.413 16.511 -13.162 1.00 0.00 H new ATOM 2616 N GLU B 72 10.131 13.356 -16.706 1.00 0.00 N ATOM 2617 CA GLU B 72 9.207 14.274 -17.429 1.00 0.00 C ATOM 2618 C GLU B 72 7.775 13.726 -17.407 1.00 0.00 C ATOM 2619 O GLU B 72 6.819 14.462 -17.233 1.00 0.00 O ATOM 2620 CB GLU B 72 9.704 14.432 -18.867 1.00 0.00 C ATOM 2621 CG GLU B 72 10.981 15.277 -18.870 1.00 0.00 C ATOM 2622 CD GLU B 72 11.532 15.386 -20.294 1.00 0.00 C ATOM 2623 OE1 GLU B 72 11.083 16.260 -21.016 1.00 0.00 O ATOM 2624 OE2 GLU B 72 12.398 14.598 -20.636 1.00 0.00 O ATOM 0 H GLU B 72 10.893 12.978 -17.269 1.00 0.00 H new ATOM 0 HA GLU B 72 9.194 15.246 -16.937 1.00 0.00 H new ATOM 0 HB2 GLU B 72 9.900 13.454 -19.306 1.00 0.00 H new ATOM 0 HB3 GLU B 72 8.938 14.908 -19.479 1.00 0.00 H new ATOM 0 HG2 GLU B 72 10.770 16.271 -18.475 1.00 0.00 H new ATOM 0 HG3 GLU B 72 11.727 14.826 -18.216 1.00 0.00 H new ATOM 2631 N PHE B 73 7.613 12.444 -17.566 1.00 0.00 N ATOM 2632 CA PHE B 73 6.242 11.864 -17.540 1.00 0.00 C ATOM 2633 C PHE B 73 5.663 11.992 -16.132 1.00 0.00 C ATOM 2634 O PHE B 73 4.469 12.121 -15.953 1.00 0.00 O ATOM 2635 CB PHE B 73 6.285 10.384 -17.945 1.00 0.00 C ATOM 2636 CG PHE B 73 4.932 9.757 -17.688 1.00 0.00 C ATOM 2637 CD1 PHE B 73 3.949 9.779 -18.681 1.00 0.00 C ATOM 2638 CD2 PHE B 73 4.662 9.165 -16.447 1.00 0.00 C ATOM 2639 CE1 PHE B 73 2.693 9.211 -18.436 1.00 0.00 C ATOM 2640 CE2 PHE B 73 3.407 8.595 -16.202 1.00 0.00 C ATOM 2641 CZ PHE B 73 2.422 8.618 -17.196 1.00 0.00 C ATOM 0 H PHE B 73 8.368 11.774 -17.712 1.00 0.00 H new ATOM 0 HA PHE B 73 5.613 12.406 -18.247 1.00 0.00 H new ATOM 0 HB2 PHE B 73 6.548 10.291 -18.999 1.00 0.00 H new ATOM 0 HB3 PHE B 73 7.055 9.862 -17.377 1.00 0.00 H new ATOM 0 HD1 PHE B 73 4.158 10.234 -19.638 1.00 0.00 H new ATOM 0 HD2 PHE B 73 5.422 9.148 -15.680 1.00 0.00 H new ATOM 0 HE1 PHE B 73 1.933 9.230 -19.203 1.00 0.00 H new ATOM 0 HE2 PHE B 73 3.199 8.138 -15.246 1.00 0.00 H new ATOM 0 HZ PHE B 73 1.454 8.179 -17.007 1.00 0.00 H new ATOM 2651 N MET B 74 6.496 11.941 -15.132 1.00 0.00 N ATOM 2652 CA MET B 74 5.991 12.039 -13.739 1.00 0.00 C ATOM 2653 C MET B 74 5.272 13.371 -13.552 1.00 0.00 C ATOM 2654 O MET B 74 4.292 13.464 -12.839 1.00 0.00 O ATOM 2655 CB MET B 74 7.154 11.938 -12.738 1.00 0.00 C ATOM 2656 CG MET B 74 7.740 10.501 -12.716 1.00 0.00 C ATOM 2657 SD MET B 74 7.790 9.878 -11.011 1.00 0.00 S ATOM 2658 CE MET B 74 6.005 9.922 -10.689 1.00 0.00 C ATOM 0 H MET B 74 7.507 11.835 -15.221 1.00 0.00 H new ATOM 0 HA MET B 74 5.299 11.217 -13.557 1.00 0.00 H new ATOM 0 HB2 MET B 74 7.934 12.650 -13.008 1.00 0.00 H new ATOM 0 HB3 MET B 74 6.806 12.209 -11.741 1.00 0.00 H new ATOM 0 HG2 MET B 74 7.132 9.842 -13.335 1.00 0.00 H new ATOM 0 HG3 MET B 74 8.744 10.502 -13.141 1.00 0.00 H new ATOM 0 HE1 MET B 74 5.780 10.735 -9.999 1.00 0.00 H new ATOM 0 HE2 MET B 74 5.470 10.082 -11.625 1.00 0.00 H new ATOM 0 HE3 MET B 74 5.691 8.975 -10.249 1.00 0.00 H new ATOM 2668 N ALA B 75 5.756 14.414 -14.164 1.00 0.00 N ATOM 2669 CA ALA B 75 5.089 15.733 -13.988 1.00 0.00 C ATOM 2670 C ALA B 75 3.726 15.747 -14.691 1.00 0.00 C ATOM 2671 O ALA B 75 2.795 16.384 -14.245 1.00 0.00 O ATOM 2672 CB ALA B 75 5.984 16.846 -14.542 1.00 0.00 C ATOM 0 H ALA B 75 6.575 14.412 -14.772 1.00 0.00 H new ATOM 0 HA ALA B 75 4.926 15.904 -12.924 1.00 0.00 H new ATOM 0 HB1 ALA B 75 5.491 17.809 -14.410 1.00 0.00 H new ATOM 0 HB2 ALA B 75 6.934 16.849 -14.008 1.00 0.00 H new ATOM 0 HB3 ALA B 75 6.165 16.673 -15.603 1.00 0.00 H new ATOM 2678 N PHE B 76 3.594 15.048 -15.777 1.00 0.00 N ATOM 2679 CA PHE B 76 2.281 15.018 -16.495 1.00 0.00 C ATOM 2680 C PHE B 76 1.206 14.460 -15.567 1.00 0.00 C ATOM 2681 O PHE B 76 0.088 14.922 -15.539 1.00 0.00 O ATOM 2682 CB PHE B 76 2.423 14.127 -17.731 1.00 0.00 C ATOM 2683 CG PHE B 76 1.110 14.036 -18.474 1.00 0.00 C ATOM 2684 CD1 PHE B 76 0.649 15.124 -19.224 1.00 0.00 C ATOM 2685 CD2 PHE B 76 0.361 12.852 -18.426 1.00 0.00 C ATOM 2686 CE1 PHE B 76 -0.561 15.028 -19.924 1.00 0.00 C ATOM 2687 CE2 PHE B 76 -0.848 12.758 -19.123 1.00 0.00 C ATOM 2688 CZ PHE B 76 -1.309 13.846 -19.873 1.00 0.00 C ATOM 0 H PHE B 76 4.335 14.493 -16.205 1.00 0.00 H new ATOM 0 HA PHE B 76 1.993 16.024 -16.799 1.00 0.00 H new ATOM 0 HB2 PHE B 76 3.193 14.529 -18.390 1.00 0.00 H new ATOM 0 HB3 PHE B 76 2.748 13.130 -17.432 1.00 0.00 H new ATOM 0 HD1 PHE B 76 1.225 16.037 -19.263 1.00 0.00 H new ATOM 0 HD2 PHE B 76 0.718 12.011 -17.850 1.00 0.00 H new ATOM 0 HE1 PHE B 76 -0.917 15.867 -20.504 1.00 0.00 H new ATOM 0 HE2 PHE B 76 -1.426 11.846 -19.082 1.00 0.00 H new ATOM 0 HZ PHE B 76 -2.242 13.774 -20.412 1.00 0.00 H new ATOM 2698 N VAL B 77 1.552 13.469 -14.819 1.00 0.00 N ATOM 2699 CA VAL B 77 0.585 12.840 -13.873 1.00 0.00 C ATOM 2700 C VAL B 77 0.160 13.865 -12.829 1.00 0.00 C ATOM 2701 O VAL B 77 -0.956 13.872 -12.367 1.00 0.00 O ATOM 2702 CB VAL B 77 1.255 11.647 -13.159 1.00 0.00 C ATOM 2703 CG1 VAL B 77 0.230 10.546 -12.897 1.00 0.00 C ATOM 2704 CG2 VAL B 77 2.383 11.099 -14.028 1.00 0.00 C ATOM 0 H VAL B 77 2.483 13.051 -14.815 1.00 0.00 H new ATOM 0 HA VAL B 77 -0.285 12.492 -14.430 1.00 0.00 H new ATOM 0 HB VAL B 77 1.660 11.987 -12.206 1.00 0.00 H new ATOM 0 HG11 VAL B 77 0.715 9.710 -12.393 1.00 0.00 H new ATOM 0 HG12 VAL B 77 -0.569 10.936 -12.267 1.00 0.00 H new ATOM 0 HG13 VAL B 77 -0.188 10.205 -13.844 1.00 0.00 H new ATOM 0 HG21 VAL B 77 2.855 10.257 -13.523 1.00 0.00 H new ATOM 0 HG22 VAL B 77 1.978 10.768 -14.984 1.00 0.00 H new ATOM 0 HG23 VAL B 77 3.123 11.881 -14.199 1.00 0.00 H new ATOM 2714 N SER B 78 1.069 14.694 -12.423 1.00 0.00 N ATOM 2715 CA SER B 78 0.750 15.693 -11.376 1.00 0.00 C ATOM 2716 C SER B 78 -0.348 16.641 -11.853 1.00 0.00 C ATOM 2717 O SER B 78 -1.236 16.994 -11.099 1.00 0.00 O ATOM 2718 CB SER B 78 2.013 16.493 -11.045 1.00 0.00 C ATOM 2719 OG SER B 78 1.648 17.741 -10.474 1.00 0.00 O ATOM 0 H SER B 78 2.027 14.724 -12.773 1.00 0.00 H new ATOM 0 HA SER B 78 0.394 15.173 -10.486 1.00 0.00 H new ATOM 0 HB2 SER B 78 2.639 15.933 -10.351 1.00 0.00 H new ATOM 0 HB3 SER B 78 2.602 16.653 -11.948 1.00 0.00 H new ATOM 0 HG SER B 78 2.124 18.463 -10.935 1.00 0.00 H new ATOM 2725 N MET B 79 -0.304 17.081 -13.083 1.00 0.00 N ATOM 2726 CA MET B 79 -1.366 18.029 -13.540 1.00 0.00 C ATOM 2727 C MET B 79 -2.685 17.306 -13.796 1.00 0.00 C ATOM 2728 O MET B 79 -3.746 17.808 -13.480 1.00 0.00 O ATOM 2729 CB MET B 79 -0.959 18.726 -14.835 1.00 0.00 C ATOM 2730 CG MET B 79 0.333 19.526 -14.646 1.00 0.00 C ATOM 2731 SD MET B 79 0.394 20.860 -15.873 1.00 0.00 S ATOM 2732 CE MET B 79 -0.109 19.896 -17.325 1.00 0.00 C ATOM 0 H MET B 79 0.402 16.834 -13.777 1.00 0.00 H new ATOM 0 HA MET B 79 -1.492 18.760 -12.742 1.00 0.00 H new ATOM 0 HB2 MET B 79 -0.820 17.985 -15.623 1.00 0.00 H new ATOM 0 HB3 MET B 79 -1.758 19.391 -15.161 1.00 0.00 H new ATOM 0 HG2 MET B 79 0.374 19.940 -13.639 1.00 0.00 H new ATOM 0 HG3 MET B 79 1.199 18.873 -14.758 1.00 0.00 H new ATOM 0 HE1 MET B 79 0.214 20.408 -18.231 1.00 0.00 H new ATOM 0 HE2 MET B 79 0.351 18.909 -17.283 1.00 0.00 H new ATOM 0 HE3 MET B 79 -1.194 19.791 -17.334 1.00 0.00 H new ATOM 2742 N VAL B 80 -2.639 16.155 -14.396 1.00 0.00 N ATOM 2743 CA VAL B 80 -3.915 15.441 -14.700 1.00 0.00 C ATOM 2744 C VAL B 80 -4.626 15.072 -13.397 1.00 0.00 C ATOM 2745 O VAL B 80 -5.837 15.115 -13.303 1.00 0.00 O ATOM 2746 CB VAL B 80 -3.649 14.175 -15.517 1.00 0.00 C ATOM 2747 CG1 VAL B 80 -4.992 13.595 -15.970 1.00 0.00 C ATOM 2748 CG2 VAL B 80 -2.795 14.507 -16.753 1.00 0.00 C ATOM 0 H VAL B 80 -1.786 15.678 -14.688 1.00 0.00 H new ATOM 0 HA VAL B 80 -4.549 16.106 -15.287 1.00 0.00 H new ATOM 0 HB VAL B 80 -3.110 13.453 -14.903 1.00 0.00 H new ATOM 0 HG11 VAL B 80 -4.819 12.691 -16.554 1.00 0.00 H new ATOM 0 HG12 VAL B 80 -5.597 13.352 -15.096 1.00 0.00 H new ATOM 0 HG13 VAL B 80 -5.517 14.328 -16.582 1.00 0.00 H new ATOM 0 HG21 VAL B 80 -2.614 13.597 -17.325 1.00 0.00 H new ATOM 0 HG22 VAL B 80 -3.323 15.228 -17.377 1.00 0.00 H new ATOM 0 HG23 VAL B 80 -1.843 14.931 -16.434 1.00 0.00 H new ATOM 2758 N THR B 81 -3.881 14.707 -12.396 1.00 0.00 N ATOM 2759 CA THR B 81 -4.500 14.327 -11.095 1.00 0.00 C ATOM 2760 C THR B 81 -5.283 15.509 -10.562 1.00 0.00 C ATOM 2761 O THR B 81 -6.357 15.376 -10.010 1.00 0.00 O ATOM 2762 CB THR B 81 -3.411 13.986 -10.079 1.00 0.00 C ATOM 2763 OG1 THR B 81 -2.636 12.902 -10.558 1.00 0.00 O ATOM 2764 CG2 THR B 81 -4.059 13.620 -8.736 1.00 0.00 C ATOM 0 H THR B 81 -2.863 14.654 -12.421 1.00 0.00 H new ATOM 0 HA THR B 81 -5.149 13.465 -11.248 1.00 0.00 H new ATOM 0 HB THR B 81 -2.761 14.850 -9.937 1.00 0.00 H new ATOM 0 HG1 THR B 81 -1.920 13.241 -11.135 1.00 0.00 H new ATOM 0 HG21 THR B 81 -3.282 13.377 -8.011 1.00 0.00 H new ATOM 0 HG22 THR B 81 -4.643 14.465 -8.372 1.00 0.00 H new ATOM 0 HG23 THR B 81 -4.713 12.758 -8.870 1.00 0.00 H new ATOM 2772 N THR B 82 -4.730 16.665 -10.719 1.00 0.00 N ATOM 2773 CA THR B 82 -5.394 17.885 -10.227 1.00 0.00 C ATOM 2774 C THR B 82 -6.788 17.967 -10.857 1.00 0.00 C ATOM 2775 O THR B 82 -7.752 18.332 -10.213 1.00 0.00 O ATOM 2776 CB THR B 82 -4.537 19.083 -10.634 1.00 0.00 C ATOM 2777 OG1 THR B 82 -3.172 18.784 -10.371 1.00 0.00 O ATOM 2778 CG2 THR B 82 -4.940 20.307 -9.820 1.00 0.00 C ATOM 0 H THR B 82 -3.831 16.819 -11.175 1.00 0.00 H new ATOM 0 HA THR B 82 -5.503 17.875 -9.142 1.00 0.00 H new ATOM 0 HB THR B 82 -4.682 19.289 -11.695 1.00 0.00 H new ATOM 0 HG1 THR B 82 -3.066 18.544 -9.427 1.00 0.00 H new ATOM 0 HG21 THR B 82 -4.326 21.158 -10.114 1.00 0.00 H new ATOM 0 HG22 THR B 82 -5.990 20.536 -10.003 1.00 0.00 H new ATOM 0 HG23 THR B 82 -4.793 20.103 -8.759 1.00 0.00 H new ATOM 2786 N ALA B 83 -6.905 17.603 -12.106 1.00 0.00 N ATOM 2787 CA ALA B 83 -8.239 17.628 -12.773 1.00 0.00 C ATOM 2788 C ALA B 83 -9.196 16.695 -12.022 1.00 0.00 C ATOM 2789 O ALA B 83 -10.364 16.987 -11.856 1.00 0.00 O ATOM 2790 CB ALA B 83 -8.097 17.154 -14.221 1.00 0.00 C ATOM 0 H ALA B 83 -6.133 17.289 -12.694 1.00 0.00 H new ATOM 0 HA ALA B 83 -8.633 18.644 -12.763 1.00 0.00 H new ATOM 0 HB1 ALA B 83 -9.072 17.173 -14.707 1.00 0.00 H new ATOM 0 HB2 ALA B 83 -7.413 17.814 -14.754 1.00 0.00 H new ATOM 0 HB3 ALA B 83 -7.704 16.137 -14.234 1.00 0.00 H new ATOM 2796 N CYS B 84 -8.706 15.569 -11.573 1.00 0.00 N ATOM 2797 CA CYS B 84 -9.575 14.602 -10.839 1.00 0.00 C ATOM 2798 C CYS B 84 -10.146 15.271 -9.588 1.00 0.00 C ATOM 2799 O CYS B 84 -11.270 15.022 -9.200 1.00 0.00 O ATOM 2800 CB CYS B 84 -8.745 13.389 -10.415 1.00 0.00 C ATOM 2801 SG CYS B 84 -7.790 12.785 -11.829 1.00 0.00 S ATOM 0 H CYS B 84 -7.735 15.276 -11.684 1.00 0.00 H new ATOM 0 HA CYS B 84 -10.388 14.286 -11.492 1.00 0.00 H new ATOM 0 HB2 CYS B 84 -8.075 13.661 -9.600 1.00 0.00 H new ATOM 0 HB3 CYS B 84 -9.398 12.601 -10.041 1.00 0.00 H new ATOM 0 HG CYS B 84 -6.986 13.720 -12.240 1.00 0.00 H new ATOM 2807 N HIS B 85 -9.385 16.118 -8.951 1.00 0.00 N ATOM 2808 CA HIS B 85 -9.898 16.792 -7.727 1.00 0.00 C ATOM 2809 C HIS B 85 -11.144 17.593 -8.091 1.00 0.00 C ATOM 2810 O HIS B 85 -12.124 17.597 -7.374 1.00 0.00 O ATOM 2811 CB HIS B 85 -8.825 17.739 -7.187 1.00 0.00 C ATOM 2812 CG HIS B 85 -9.370 18.506 -6.015 1.00 0.00 C ATOM 2813 ND1 HIS B 85 -9.268 19.888 -5.928 1.00 0.00 N ATOM 2814 CD2 HIS B 85 -10.030 18.106 -4.879 1.00 0.00 C ATOM 2815 CE1 HIS B 85 -9.853 20.267 -4.777 1.00 0.00 C ATOM 2816 NE2 HIS B 85 -10.332 19.220 -4.103 1.00 0.00 N ATOM 0 H HIS B 85 -8.435 16.371 -9.224 1.00 0.00 H new ATOM 0 HA HIS B 85 -10.144 16.050 -6.967 1.00 0.00 H new ATOM 0 HB2 HIS B 85 -7.944 17.172 -6.885 1.00 0.00 H new ATOM 0 HB3 HIS B 85 -8.508 18.428 -7.969 1.00 0.00 H new ATOM 0 HD2 HIS B 85 -10.276 17.085 -4.627 1.00 0.00 H new ATOM 0 HE1 HIS B 85 -9.926 21.291 -4.441 1.00 0.00 H new ATOM 0 HE2 HIS B 85 -10.818 19.234 -3.206 1.00 0.00 H new ATOM 2825 N GLU B 86 -11.126 18.247 -9.214 1.00 0.00 N ATOM 2826 CA GLU B 86 -12.323 19.017 -9.637 1.00 0.00 C ATOM 2827 C GLU B 86 -13.495 18.042 -9.779 1.00 0.00 C ATOM 2828 O GLU B 86 -14.616 18.339 -9.419 1.00 0.00 O ATOM 2829 CB GLU B 86 -12.040 19.717 -10.973 1.00 0.00 C ATOM 2830 CG GLU B 86 -13.262 20.533 -11.414 1.00 0.00 C ATOM 2831 CD GLU B 86 -13.554 21.629 -10.385 1.00 0.00 C ATOM 2832 OE1 GLU B 86 -12.654 21.966 -9.633 1.00 0.00 O ATOM 2833 OE2 GLU B 86 -14.674 22.112 -10.367 1.00 0.00 O ATOM 0 H GLU B 86 -10.335 18.282 -9.857 1.00 0.00 H new ATOM 0 HA GLU B 86 -12.568 19.779 -8.897 1.00 0.00 H new ATOM 0 HB2 GLU B 86 -11.174 20.371 -10.873 1.00 0.00 H new ATOM 0 HB3 GLU B 86 -11.794 18.977 -11.734 1.00 0.00 H new ATOM 0 HG2 GLU B 86 -13.079 20.979 -12.392 1.00 0.00 H new ATOM 0 HG3 GLU B 86 -14.128 19.880 -11.519 1.00 0.00 H new ATOM 2840 N PHE B 87 -13.235 16.878 -10.312 1.00 0.00 N ATOM 2841 CA PHE B 87 -14.319 15.869 -10.488 1.00 0.00 C ATOM 2842 C PHE B 87 -14.611 15.171 -9.161 1.00 0.00 C ATOM 2843 O PHE B 87 -15.749 15.023 -8.761 1.00 0.00 O ATOM 2844 CB PHE B 87 -13.880 14.825 -11.518 1.00 0.00 C ATOM 2845 CG PHE B 87 -14.973 13.796 -11.688 1.00 0.00 C ATOM 2846 CD1 PHE B 87 -14.986 12.652 -10.881 1.00 0.00 C ATOM 2847 CD2 PHE B 87 -15.969 13.982 -12.654 1.00 0.00 C ATOM 2848 CE1 PHE B 87 -15.996 11.695 -11.038 1.00 0.00 C ATOM 2849 CE2 PHE B 87 -16.980 13.025 -12.811 1.00 0.00 C ATOM 2850 CZ PHE B 87 -16.993 11.882 -12.003 1.00 0.00 C ATOM 0 H PHE B 87 -12.314 16.582 -10.634 1.00 0.00 H new ATOM 0 HA PHE B 87 -15.221 16.376 -10.832 1.00 0.00 H new ATOM 0 HB2 PHE B 87 -13.668 15.307 -12.472 1.00 0.00 H new ATOM 0 HB3 PHE B 87 -12.959 14.342 -11.193 1.00 0.00 H new ATOM 0 HD1 PHE B 87 -14.217 12.508 -10.137 1.00 0.00 H new ATOM 0 HD2 PHE B 87 -15.958 14.863 -13.278 1.00 0.00 H new ATOM 0 HE1 PHE B 87 -16.006 10.813 -10.415 1.00 0.00 H new ATOM 0 HE2 PHE B 87 -17.749 13.169 -13.555 1.00 0.00 H new ATOM 0 HZ PHE B 87 -17.772 11.144 -12.124 1.00 0.00 H new ATOM 2860 N PHE B 88 -13.587 14.729 -8.478 1.00 0.00 N ATOM 2861 CA PHE B 88 -13.790 14.025 -7.178 1.00 0.00 C ATOM 2862 C PHE B 88 -13.646 15.034 -6.035 1.00 0.00 C ATOM 2863 O PHE B 88 -12.698 15.003 -5.276 1.00 0.00 O ATOM 2864 CB PHE B 88 -12.748 12.895 -7.055 1.00 0.00 C ATOM 2865 CG PHE B 88 -12.612 12.425 -5.617 1.00 0.00 C ATOM 2866 CD1 PHE B 88 -13.754 12.170 -4.842 1.00 0.00 C ATOM 2867 CD2 PHE B 88 -11.337 12.250 -5.058 1.00 0.00 C ATOM 2868 CE1 PHE B 88 -13.619 11.742 -3.516 1.00 0.00 C ATOM 2869 CE2 PHE B 88 -11.206 11.823 -3.731 1.00 0.00 C ATOM 2870 CZ PHE B 88 -12.346 11.569 -2.961 1.00 0.00 C ATOM 0 H PHE B 88 -12.614 14.826 -8.767 1.00 0.00 H new ATOM 0 HA PHE B 88 -14.787 13.587 -7.128 1.00 0.00 H new ATOM 0 HB2 PHE B 88 -13.040 12.057 -7.688 1.00 0.00 H new ATOM 0 HB3 PHE B 88 -11.782 13.247 -7.418 1.00 0.00 H new ATOM 0 HD1 PHE B 88 -14.737 12.304 -5.269 1.00 0.00 H new ATOM 0 HD2 PHE B 88 -10.456 12.445 -5.652 1.00 0.00 H new ATOM 0 HE1 PHE B 88 -14.498 11.545 -2.921 1.00 0.00 H new ATOM 0 HE2 PHE B 88 -10.224 11.690 -3.302 1.00 0.00 H new ATOM 0 HZ PHE B 88 -12.244 11.239 -1.938 1.00 0.00 H new ATOM 2880 N GLU B 89 -14.590 15.924 -5.906 1.00 0.00 N ATOM 2881 CA GLU B 89 -14.518 16.927 -4.810 1.00 0.00 C ATOM 2882 C GLU B 89 -14.994 16.279 -3.515 1.00 0.00 C ATOM 2883 O GLU B 89 -16.174 16.089 -3.297 1.00 0.00 O ATOM 2884 CB GLU B 89 -15.428 18.116 -5.132 1.00 0.00 C ATOM 2885 CG GLU B 89 -14.819 18.945 -6.262 1.00 0.00 C ATOM 2886 CD GLU B 89 -13.571 19.665 -5.749 1.00 0.00 C ATOM 2887 OE1 GLU B 89 -13.411 19.743 -4.542 1.00 0.00 O ATOM 2888 OE2 GLU B 89 -12.795 20.124 -6.571 1.00 0.00 O ATOM 0 H GLU B 89 -15.407 15.999 -6.512 1.00 0.00 H new ATOM 0 HA GLU B 89 -13.490 17.275 -4.705 1.00 0.00 H new ATOM 0 HB2 GLU B 89 -16.417 17.760 -5.422 1.00 0.00 H new ATOM 0 HB3 GLU B 89 -15.560 18.735 -4.245 1.00 0.00 H new ATOM 0 HG2 GLU B 89 -14.561 18.300 -7.102 1.00 0.00 H new ATOM 0 HG3 GLU B 89 -15.546 19.670 -6.628 1.00 0.00 H new ATOM 2895 N HIS B 90 -14.083 15.937 -2.654 1.00 0.00 N ATOM 2896 CA HIS B 90 -14.480 15.299 -1.367 1.00 0.00 C ATOM 2897 C HIS B 90 -14.947 16.372 -0.382 1.00 0.00 C ATOM 2898 O HIS B 90 -14.152 17.013 0.277 1.00 0.00 O ATOM 2899 CB HIS B 90 -13.288 14.554 -0.764 1.00 0.00 C ATOM 2900 CG HIS B 90 -13.729 13.857 0.494 1.00 0.00 C ATOM 2901 ND1 HIS B 90 -13.581 14.429 1.751 1.00 0.00 N ATOM 2902 CD2 HIS B 90 -14.333 12.642 0.705 1.00 0.00 C ATOM 2903 CE1 HIS B 90 -14.088 13.566 2.652 1.00 0.00 C ATOM 2904 NE2 HIS B 90 -14.557 12.464 2.065 1.00 0.00 N ATOM 0 H HIS B 90 -13.080 16.070 -2.783 1.00 0.00 H new ATOM 0 HA HIS B 90 -15.290 14.596 -1.558 1.00 0.00 H new ATOM 0 HB2 HIS B 90 -12.897 13.829 -1.478 1.00 0.00 H new ATOM 0 HB3 HIS B 90 -12.480 15.252 -0.544 1.00 0.00 H new ATOM 0 HD2 HIS B 90 -14.594 11.934 -0.067 1.00 0.00 H new ATOM 0 HE1 HIS B 90 -14.112 13.744 3.717 1.00 0.00 H new ATOM 0 HE2 HIS B 90 -14.989 11.659 2.519 1.00 0.00 H new ATOM 2913 N GLU B 91 -16.231 16.565 -0.269 1.00 0.00 N ATOM 2914 CA GLU B 91 -16.750 17.589 0.683 1.00 0.00 C ATOM 2915 CB GLU B 91 -18.211 17.907 0.356 1.00 0.00 C ATOM 2916 CG GLU B 91 -18.287 18.675 -0.965 1.00 0.00 C ATOM 2917 CD GLU B 91 -19.752 18.858 -1.365 1.00 0.00 C ATOM 2918 OE1 GLU B 91 -20.608 18.400 -0.626 1.00 0.00 O ATOM 2919 OE2 GLU B 91 -19.993 19.450 -2.404 1.00 0.00 O ATOM 0 H GLU B 91 -16.944 16.059 -0.794 1.00 0.00 H new ATOM 0 HB2 GLU B 91 -18.787 16.984 0.285 1.00 0.00 H new ATOM 0 HB3 GLU B 91 -18.653 18.498 1.158 1.00 0.00 H new ATOM 0 HG2 GLU B 91 -17.803 19.646 -0.862 1.00 0.00 H new ATOM 0 HG3 GLU B 91 -17.751 18.133 -1.744 1.00 0.00 H new TER 2926 GLU B 91 ATOM 2927 N SER X 92 32.017 22.459 16.394 1.00 0.00 N ATOM 2928 CA SER X 92 32.648 21.109 16.377 1.00 0.00 C ATOM 2929 C SER X 92 34.162 21.254 16.534 1.00 0.00 C ATOM 2930 O SER X 92 34.669 22.324 16.807 1.00 0.00 O ATOM 2931 CB SER X 92 32.337 20.418 15.050 1.00 0.00 C ATOM 2932 OG SER X 92 30.952 20.102 14.998 1.00 0.00 O ATOM 0 HA SER X 92 32.252 20.512 17.198 1.00 0.00 H new ATOM 0 HB2 SER X 92 32.605 21.068 14.217 1.00 0.00 H new ATOM 0 HB3 SER X 92 32.933 19.511 14.951 1.00 0.00 H new ATOM 0 HG SER X 92 30.438 20.813 15.435 1.00 0.00 H new ATOM 2940 N HIS X 93 34.891 20.184 16.365 1.00 0.00 N ATOM 2941 CA HIS X 93 36.372 20.263 16.505 1.00 0.00 C ATOM 2942 C HIS X 93 36.956 21.056 15.333 1.00 0.00 C ATOM 2943 O HIS X 93 38.042 21.594 15.418 1.00 0.00 O ATOM 2944 CB HIS X 93 36.960 18.852 16.508 1.00 0.00 C ATOM 2945 CG HIS X 93 36.472 18.101 15.300 1.00 0.00 C ATOM 2946 ND1 HIS X 93 35.334 17.366 15.073 1.00 0.00 N flip ATOM 2947 CD2 HIS X 93 37.200 18.049 14.119 1.00 0.00 C flip ATOM 2948 CE1 HIS X 93 35.357 16.867 13.776 1.00 0.00 C flip ATOM 2949 NE2 HIS X 93 36.499 17.305 13.243 1.00 0.00 N flip ATOM 0 H HIS X 93 34.525 19.260 16.136 1.00 0.00 H new ATOM 0 HA HIS X 93 36.621 20.763 17.441 1.00 0.00 H new ATOM 0 HB2 HIS X 93 38.049 18.901 16.503 1.00 0.00 H new ATOM 0 HB3 HIS X 93 36.668 18.327 17.418 1.00 0.00 H new ATOM 0 HD2 HIS X 93 38.155 18.520 13.936 1.00 0.00 H new ATOM 0 HE1 HIS X 93 34.607 16.253 13.299 1.00 0.00 H new ATOM 0 HE2 HIS X 93 36.803 17.102 12.291 1.00 0.00 H new ATOM 2958 N LEU X 94 36.244 21.137 14.240 1.00 0.00 N ATOM 2959 CA LEU X 94 36.764 21.901 13.069 1.00 0.00 C ATOM 2960 C LEU X 94 36.472 23.387 13.282 1.00 0.00 C ATOM 2961 O LEU X 94 35.357 23.775 13.570 1.00 0.00 O ATOM 2962 CB LEU X 94 36.067 21.413 11.791 1.00 0.00 C ATOM 2963 CG LEU X 94 36.605 22.166 10.562 1.00 0.00 C ATOM 2964 CD1 LEU X 94 38.091 21.833 10.341 1.00 0.00 C ATOM 2965 CD2 LEU X 94 35.795 21.746 9.329 1.00 0.00 C ATOM 0 H LEU X 94 35.328 20.709 14.108 1.00 0.00 H new ATOM 0 HA LEU X 94 37.839 21.748 12.970 1.00 0.00 H new ATOM 0 HB2 LEU X 94 36.229 20.342 11.668 1.00 0.00 H new ATOM 0 HB3 LEU X 94 34.991 21.565 11.876 1.00 0.00 H new ATOM 0 HG LEU X 94 36.509 23.239 10.725 1.00 0.00 H new ATOM 0 HD11 LEU X 94 38.459 22.372 9.468 1.00 0.00 H new ATOM 0 HD12 LEU X 94 38.665 22.129 11.219 1.00 0.00 H new ATOM 0 HD13 LEU X 94 38.203 20.761 10.179 1.00 0.00 H new ATOM 0 HD21 LEU X 94 36.168 22.274 8.451 1.00 0.00 H new ATOM 0 HD22 LEU X 94 35.896 20.672 9.176 1.00 0.00 H new ATOM 0 HD23 LEU X 94 34.745 21.994 9.482 1.00 0.00 H new ATOM 2977 N LYS X 95 37.465 24.221 13.150 1.00 0.00 N ATOM 2978 CA LYS X 95 37.244 25.680 13.353 1.00 0.00 C ATOM 2979 C LYS X 95 36.214 26.195 12.344 1.00 0.00 C ATOM 2980 O LYS X 95 35.368 27.004 12.667 1.00 0.00 O ATOM 2981 CB LYS X 95 38.565 26.423 13.157 1.00 0.00 C ATOM 2982 CG LYS X 95 39.507 26.099 14.322 1.00 0.00 C ATOM 2983 CD LYS X 95 40.841 26.838 14.141 1.00 0.00 C ATOM 2984 CE LYS X 95 41.712 26.132 13.094 1.00 0.00 C ATOM 2985 NZ LYS X 95 43.098 26.675 13.159 1.00 0.00 N ATOM 0 H LYS X 95 38.420 23.956 12.910 1.00 0.00 H new ATOM 0 HA LYS X 95 36.872 25.852 14.363 1.00 0.00 H new ATOM 0 HB2 LYS X 95 39.023 26.131 12.212 1.00 0.00 H new ATOM 0 HB3 LYS X 95 38.387 27.497 13.106 1.00 0.00 H new ATOM 0 HG2 LYS X 95 39.045 26.391 15.265 1.00 0.00 H new ATOM 0 HG3 LYS X 95 39.681 25.024 14.371 1.00 0.00 H new ATOM 0 HD2 LYS X 95 40.654 27.867 13.833 1.00 0.00 H new ATOM 0 HD3 LYS X 95 41.371 26.882 15.093 1.00 0.00 H new ATOM 0 HE2 LYS X 95 41.721 25.057 13.277 1.00 0.00 H new ATOM 0 HE3 LYS X 95 41.297 26.282 12.098 1.00 0.00 H new ATOM 0 HZ1 LYS X 95 43.691 26.198 12.450 1.00 0.00 H new ATOM 0 HZ2 LYS X 95 43.080 27.697 12.965 1.00 0.00 H new ATOM 0 HZ3 LYS X 95 43.491 26.510 14.107 1.00 0.00 H new ATOM 2999 N SER X 96 36.277 25.734 11.123 1.00 0.00 N ATOM 3000 CA SER X 96 35.299 26.203 10.098 1.00 0.00 C ATOM 3001 C SER X 96 34.005 25.397 10.221 1.00 0.00 C ATOM 3002 O SER X 96 34.026 24.192 10.381 1.00 0.00 O ATOM 3003 CB SER X 96 35.887 26.012 8.699 1.00 0.00 C ATOM 3004 OG SER X 96 34.873 26.241 7.729 1.00 0.00 O ATOM 0 H SER X 96 36.962 25.055 10.792 1.00 0.00 H new ATOM 0 HA SER X 96 35.087 27.260 10.259 1.00 0.00 H new ATOM 0 HB2 SER X 96 36.717 26.701 8.544 1.00 0.00 H new ATOM 0 HB3 SER X 96 36.286 25.003 8.594 1.00 0.00 H new ATOM 0 HG SER X 96 35.246 26.121 6.831 1.00 0.00 H new ATOM 3010 N LYS X 97 32.877 26.052 10.146 1.00 0.00 N ATOM 3011 CA LYS X 97 31.577 25.326 10.258 1.00 0.00 C ATOM 3012 C LYS X 97 31.113 24.914 8.860 1.00 0.00 C ATOM 3013 O LYS X 97 30.823 25.745 8.022 1.00 0.00 O ATOM 3014 CB LYS X 97 30.538 26.259 10.879 1.00 0.00 C ATOM 3015 CG LYS X 97 29.261 25.476 11.192 1.00 0.00 C ATOM 3016 CD LYS X 97 28.317 26.341 12.035 1.00 0.00 C ATOM 3017 CE LYS X 97 27.926 27.601 11.255 1.00 0.00 C ATOM 3018 NZ LYS X 97 26.708 28.206 11.864 1.00 0.00 N ATOM 0 H LYS X 97 32.799 27.060 10.012 1.00 0.00 H new ATOM 0 HA LYS X 97 31.698 24.440 10.882 1.00 0.00 H new ATOM 0 HB2 LYS X 97 30.935 26.705 11.791 1.00 0.00 H new ATOM 0 HB3 LYS X 97 30.315 27.078 10.195 1.00 0.00 H new ATOM 0 HG2 LYS X 97 28.768 25.180 10.266 1.00 0.00 H new ATOM 0 HG3 LYS X 97 29.507 24.560 11.729 1.00 0.00 H new ATOM 0 HD2 LYS X 97 27.424 25.772 12.295 1.00 0.00 H new ATOM 0 HD3 LYS X 97 28.802 26.618 12.971 1.00 0.00 H new ATOM 0 HE2 LYS X 97 28.746 28.319 11.268 1.00 0.00 H new ATOM 0 HE3 LYS X 97 27.737 27.351 10.211 1.00 0.00 H new ATOM 0 HZ1 LYS X 97 26.443 29.061 11.334 1.00 0.00 H new ATOM 0 HZ2 LYS X 97 25.926 27.521 11.830 1.00 0.00 H new ATOM 0 HZ3 LYS X 97 26.904 28.459 12.854 1.00 0.00 H new ATOM 3032 N LYS X 98 31.044 23.635 8.598 1.00 0.00 N ATOM 3033 CA LYS X 98 30.603 23.163 7.250 1.00 0.00 C ATOM 3034 C LYS X 98 29.904 21.809 7.395 1.00 0.00 C ATOM 3035 O LYS X 98 30.065 21.120 8.383 1.00 0.00 O ATOM 3036 CB LYS X 98 31.822 22.997 6.335 1.00 0.00 C ATOM 3037 CG LYS X 98 32.424 24.368 6.008 1.00 0.00 C ATOM 3038 CD LYS X 98 33.582 24.201 5.016 1.00 0.00 C ATOM 3039 CE LYS X 98 34.731 23.419 5.665 1.00 0.00 C ATOM 3040 NZ LYS X 98 36.001 23.725 4.948 1.00 0.00 N ATOM 0 H LYS X 98 31.274 22.894 9.261 1.00 0.00 H new ATOM 0 HA LYS X 98 29.919 23.894 6.818 1.00 0.00 H new ATOM 0 HB2 LYS X 98 32.569 22.370 6.821 1.00 0.00 H new ATOM 0 HB3 LYS X 98 31.530 22.490 5.415 1.00 0.00 H new ATOM 0 HG2 LYS X 98 31.660 25.019 5.584 1.00 0.00 H new ATOM 0 HG3 LYS X 98 32.780 24.846 6.920 1.00 0.00 H new ATOM 0 HD2 LYS X 98 33.234 23.677 4.126 1.00 0.00 H new ATOM 0 HD3 LYS X 98 33.936 25.180 4.692 1.00 0.00 H new ATOM 0 HE2 LYS X 98 34.820 23.688 6.718 1.00 0.00 H new ATOM 0 HE3 LYS X 98 34.526 22.349 5.625 1.00 0.00 H new ATOM 0 HZ1 LYS X 98 36.783 23.196 5.385 1.00 0.00 H new ATOM 0 HZ2 LYS X 98 35.911 23.448 3.950 1.00 0.00 H new ATOM 0 HZ3 LYS X 98 36.196 24.745 5.008 1.00 0.00 H new ATOM 3054 N GLY X 99 29.137 21.415 6.413 1.00 0.00 N ATOM 3055 CA GLY X 99 28.439 20.096 6.489 1.00 0.00 C ATOM 3056 C GLY X 99 27.081 20.253 7.175 1.00 0.00 C ATOM 3057 O GLY X 99 26.684 19.430 7.976 1.00 0.00 O ATOM 0 H GLY X 99 28.963 21.949 5.561 1.00 0.00 H new ATOM 0 HA2 GLY X 99 28.303 19.691 5.486 1.00 0.00 H new ATOM 0 HA3 GLY X 99 29.052 19.383 7.040 1.00 0.00 H new ATOM 3061 N GLN X 100 26.358 21.293 6.862 1.00 0.00 N ATOM 3062 CA GLN X 100 25.023 21.482 7.495 1.00 0.00 C ATOM 3063 C GLN X 100 24.100 20.347 7.048 1.00 0.00 C ATOM 3064 O GLN X 100 24.117 19.937 5.904 1.00 0.00 O ATOM 3065 CB GLN X 100 24.429 22.823 7.054 1.00 0.00 C ATOM 3066 CG GLN X 100 25.219 23.966 7.693 1.00 0.00 C ATOM 3067 CD GLN X 100 24.745 25.300 7.113 1.00 0.00 C ATOM 3068 OE1 GLN X 100 24.147 25.338 6.056 1.00 0.00 O ATOM 3069 NE2 GLN X 100 24.992 26.404 7.763 1.00 0.00 N ATOM 0 H GLN X 100 26.633 22.017 6.198 1.00 0.00 H new ATOM 0 HA GLN X 100 25.126 21.475 8.580 1.00 0.00 H new ATOM 0 HB2 GLN X 100 24.461 22.907 5.968 1.00 0.00 H new ATOM 0 HB3 GLN X 100 23.381 22.883 7.347 1.00 0.00 H new ATOM 0 HG2 GLN X 100 25.081 23.958 8.774 1.00 0.00 H new ATOM 0 HG3 GLN X 100 26.285 23.834 7.507 1.00 0.00 H new ATOM 0 HE21 GLN X 100 25.494 26.372 8.650 1.00 0.00 H new ATOM 0 HE22 GLN X 100 24.683 27.299 7.384 1.00 0.00 H new ATOM 3078 N SER X 101 23.295 19.832 7.937 1.00 0.00 N ATOM 3079 CA SER X 101 22.379 18.723 7.550 1.00 0.00 C ATOM 3080 C SER X 101 21.604 19.125 6.297 1.00 0.00 C ATOM 3081 O SER X 101 21.155 18.288 5.539 1.00 0.00 O ATOM 3082 CB SER X 101 21.397 18.437 8.684 1.00 0.00 C ATOM 3083 OG SER X 101 22.111 17.943 9.810 1.00 0.00 O ATOM 0 H SER X 101 23.232 20.130 8.910 1.00 0.00 H new ATOM 0 HA SER X 101 22.965 17.826 7.351 1.00 0.00 H new ATOM 0 HB2 SER X 101 20.857 19.346 8.951 1.00 0.00 H new ATOM 0 HB3 SER X 101 20.654 17.708 8.362 1.00 0.00 H new ATOM 0 HG SER X 101 21.484 17.760 10.540 1.00 0.00 H new ATOM 3089 N THR X 102 21.440 20.400 6.072 1.00 0.00 N ATOM 3090 CA THR X 102 20.690 20.846 4.866 1.00 0.00 C ATOM 3091 C THR X 102 21.247 20.131 3.637 1.00 0.00 C ATOM 3092 O THR X 102 20.545 19.892 2.676 1.00 0.00 O ATOM 3093 CB THR X 102 20.833 22.358 4.684 1.00 0.00 C ATOM 3094 OG1 THR X 102 20.429 23.019 5.875 1.00 0.00 O ATOM 3095 CG2 THR X 102 19.954 22.820 3.516 1.00 0.00 C ATOM 0 H THR X 102 21.792 21.149 6.669 1.00 0.00 H new ATOM 0 HA THR X 102 19.635 20.604 4.991 1.00 0.00 H new ATOM 0 HB THR X 102 21.874 22.601 4.470 1.00 0.00 H new ATOM 0 HG1 THR X 102 20.522 23.988 5.759 1.00 0.00 H new ATOM 0 HG21 THR X 102 20.057 23.897 3.387 1.00 0.00 H new ATOM 0 HG22 THR X 102 20.267 22.314 2.603 1.00 0.00 H new ATOM 0 HG23 THR X 102 18.912 22.577 3.726 1.00 0.00 H new ATOM 3103 N SER X 103 22.502 19.773 3.663 1.00 0.00 N ATOM 3104 CA SER X 103 23.090 19.058 2.497 1.00 0.00 C ATOM 3105 C SER X 103 22.167 17.893 2.137 1.00 0.00 C ATOM 3106 O SER X 103 22.067 17.489 0.998 1.00 0.00 O ATOM 3107 CB SER X 103 24.478 18.530 2.863 1.00 0.00 C ATOM 3108 OG SER X 103 25.037 17.861 1.739 1.00 0.00 O ATOM 0 H SER X 103 23.142 19.944 4.438 1.00 0.00 H new ATOM 0 HA SER X 103 23.188 19.734 1.648 1.00 0.00 H new ATOM 0 HB2 SER X 103 25.124 19.353 3.169 1.00 0.00 H new ATOM 0 HB3 SER X 103 24.409 17.847 3.710 1.00 0.00 H new ATOM 0 HG SER X 103 25.927 17.522 1.969 1.00 0.00 H new ATOM 3114 N ARG X 104 21.475 17.365 3.108 1.00 0.00 N ATOM 3115 CA ARG X 104 20.539 16.244 2.829 1.00 0.00 C ATOM 3116 C ARG X 104 19.495 16.741 1.826 1.00 0.00 C ATOM 3117 O ARG X 104 19.103 16.049 0.901 1.00 0.00 O ATOM 3118 CB ARG X 104 19.834 15.866 4.132 1.00 0.00 C ATOM 3119 CG ARG X 104 20.830 15.201 5.080 1.00 0.00 C ATOM 3120 CD ARG X 104 20.188 15.054 6.459 1.00 0.00 C ATOM 3121 NE ARG X 104 21.116 14.320 7.364 1.00 0.00 N ATOM 3122 CZ ARG X 104 20.936 14.355 8.655 1.00 0.00 C ATOM 3123 NH1 ARG X 104 19.956 15.054 9.161 1.00 0.00 N ATOM 3124 NH2 ARG X 104 21.739 13.694 9.443 1.00 0.00 N ATOM 0 H ARG X 104 21.518 17.663 4.083 1.00 0.00 H new ATOM 0 HA ARG X 104 21.072 15.381 2.430 1.00 0.00 H new ATOM 0 HB2 ARG X 104 19.410 16.755 4.599 1.00 0.00 H new ATOM 0 HB3 ARG X 104 19.005 15.189 3.926 1.00 0.00 H new ATOM 0 HG2 ARG X 104 21.121 14.224 4.695 1.00 0.00 H new ATOM 0 HG3 ARG X 104 21.739 15.799 5.150 1.00 0.00 H new ATOM 0 HD2 ARG X 104 19.961 16.037 6.873 1.00 0.00 H new ATOM 0 HD3 ARG X 104 19.243 14.517 6.376 1.00 0.00 H new ATOM 0 HE ARG X 104 21.894 13.789 6.973 1.00 0.00 H new ATOM 0 HH11 ARG X 104 19.330 15.574 8.546 1.00 0.00 H new ATOM 0 HH12 ARG X 104 19.817 15.080 10.171 1.00 0.00 H new ATOM 0 HH21 ARG X 104 22.507 13.150 9.049 1.00 0.00 H new ATOM 0 HH22 ARG X 104 21.599 13.721 10.453 1.00 0.00 H new ATOM 3138 N HIS X 105 19.058 17.956 2.001 1.00 0.00 N ATOM 3139 CA HIS X 105 18.056 18.538 1.074 1.00 0.00 C ATOM 3140 C HIS X 105 18.696 18.703 -0.302 1.00 0.00 C ATOM 3141 O HIS X 105 18.051 18.557 -1.318 1.00 0.00 O ATOM 3142 CB HIS X 105 17.584 19.887 1.616 1.00 0.00 C ATOM 3143 CG HIS X 105 16.792 19.643 2.871 1.00 0.00 C ATOM 3144 ND1 HIS X 105 17.197 20.123 4.110 1.00 0.00 N ATOM 3145 CD2 HIS X 105 15.634 18.942 3.101 1.00 0.00 C ATOM 3146 CE1 HIS X 105 16.297 19.705 5.021 1.00 0.00 C ATOM 3147 NE2 HIS X 105 15.327 18.983 4.456 1.00 0.00 N ATOM 0 H HIS X 105 19.357 18.575 2.755 1.00 0.00 H new ATOM 0 HA HIS X 105 17.192 17.880 0.988 1.00 0.00 H new ATOM 0 HB2 HIS X 105 18.438 20.531 1.826 1.00 0.00 H new ATOM 0 HB3 HIS X 105 16.972 20.400 0.875 1.00 0.00 H new ATOM 0 HD2 HIS X 105 15.051 18.436 2.345 1.00 0.00 H new ATOM 0 HE1 HIS X 105 16.353 19.926 6.077 1.00 0.00 H new ATOM 0 HE2 HIS X 105 14.528 18.552 4.921 1.00 0.00 H new ATOM 3156 N LYS X 106 19.969 18.989 -0.343 1.00 0.00 N ATOM 3157 CA LYS X 106 20.651 19.144 -1.656 1.00 0.00 C ATOM 3158 C LYS X 106 20.501 17.835 -2.425 1.00 0.00 C ATOM 3159 O LYS X 106 20.394 17.815 -3.633 1.00 0.00 O ATOM 3160 CB LYS X 106 22.137 19.438 -1.448 1.00 0.00 C ATOM 3161 CG LYS X 106 22.792 19.699 -2.803 1.00 0.00 C ATOM 3162 CD LYS X 106 24.277 19.993 -2.607 1.00 0.00 C ATOM 3163 CE LYS X 106 24.905 20.325 -3.959 1.00 0.00 C ATOM 3164 NZ LYS X 106 26.390 20.314 -3.836 1.00 0.00 N ATOM 0 H LYS X 106 20.564 19.121 0.475 1.00 0.00 H new ATOM 0 HA LYS X 106 20.205 19.971 -2.209 1.00 0.00 H new ATOM 0 HB2 LYS X 106 22.261 20.304 -0.798 1.00 0.00 H new ATOM 0 HB3 LYS X 106 22.621 18.596 -0.953 1.00 0.00 H new ATOM 0 HG2 LYS X 106 22.665 18.833 -3.452 1.00 0.00 H new ATOM 0 HG3 LYS X 106 22.307 20.541 -3.297 1.00 0.00 H new ATOM 0 HD2 LYS X 106 24.407 20.827 -1.917 1.00 0.00 H new ATOM 0 HD3 LYS X 106 24.775 19.131 -2.163 1.00 0.00 H new ATOM 0 HE2 LYS X 106 24.587 19.599 -4.707 1.00 0.00 H new ATOM 0 HE3 LYS X 106 24.565 21.303 -4.299 1.00 0.00 H new ATOM 0 HZ1 LYS X 106 26.816 20.540 -4.757 1.00 0.00 H new ATOM 0 HZ2 LYS X 106 26.685 21.023 -3.134 1.00 0.00 H new ATOM 0 HZ3 LYS X 106 26.706 19.372 -3.530 1.00 0.00 H new ATOM 3178 N LYS X 107 20.476 16.737 -1.731 1.00 0.00 N ATOM 3179 CA LYS X 107 20.312 15.440 -2.428 1.00 0.00 C ATOM 3180 C LYS X 107 18.979 15.489 -3.172 1.00 0.00 C ATOM 3181 O LYS X 107 18.861 15.018 -4.283 1.00 0.00 O ATOM 3182 CB LYS X 107 20.307 14.300 -1.406 1.00 0.00 C ATOM 3183 CG LYS X 107 20.197 12.956 -2.131 1.00 0.00 C ATOM 3184 CD LYS X 107 20.446 11.807 -1.144 1.00 0.00 C ATOM 3185 CE LYS X 107 19.269 11.683 -0.170 1.00 0.00 C ATOM 3186 NZ LYS X 107 19.377 10.401 0.581 1.00 0.00 N ATOM 0 H LYS X 107 20.562 16.682 -0.716 1.00 0.00 H new ATOM 0 HA LYS X 107 21.132 15.265 -3.125 1.00 0.00 H new ATOM 0 HB2 LYS X 107 21.219 14.329 -0.810 1.00 0.00 H new ATOM 0 HB3 LYS X 107 19.472 14.421 -0.716 1.00 0.00 H new ATOM 0 HG2 LYS X 107 19.208 12.854 -2.579 1.00 0.00 H new ATOM 0 HG3 LYS X 107 20.921 12.912 -2.944 1.00 0.00 H new ATOM 0 HD2 LYS X 107 20.577 10.872 -1.688 1.00 0.00 H new ATOM 0 HD3 LYS X 107 21.368 11.986 -0.591 1.00 0.00 H new ATOM 0 HE2 LYS X 107 19.267 12.524 0.524 1.00 0.00 H new ATOM 0 HE3 LYS X 107 18.326 11.718 -0.716 1.00 0.00 H new ATOM 0 HZ1 LYS X 107 18.578 10.317 1.242 1.00 0.00 H new ATOM 0 HZ2 LYS X 107 19.358 9.604 -0.087 1.00 0.00 H new ATOM 0 HZ3 LYS X 107 20.270 10.385 1.114 1.00 0.00 H new ATOM 3200 N LEU X 108 17.977 16.073 -2.566 1.00 0.00 N ATOM 3201 CA LEU X 108 16.647 16.177 -3.242 1.00 0.00 C ATOM 3202 C LEU X 108 16.749 17.101 -4.471 1.00 0.00 C ATOM 3203 O LEU X 108 16.007 16.962 -5.428 1.00 0.00 O ATOM 3204 CB LEU X 108 15.609 16.729 -2.256 1.00 0.00 C ATOM 3205 CG LEU X 108 14.255 16.931 -2.955 1.00 0.00 C ATOM 3206 CD1 LEU X 108 13.773 15.609 -3.566 1.00 0.00 C ATOM 3207 CD2 LEU X 108 13.233 17.418 -1.923 1.00 0.00 C ATOM 0 H LEU X 108 18.021 16.482 -1.633 1.00 0.00 H new ATOM 0 HA LEU X 108 16.336 15.186 -3.573 1.00 0.00 H new ATOM 0 HB2 LEU X 108 15.493 16.041 -1.418 1.00 0.00 H new ATOM 0 HB3 LEU X 108 15.957 17.676 -1.845 1.00 0.00 H new ATOM 0 HG LEU X 108 14.365 17.667 -3.751 1.00 0.00 H new ATOM 0 HD11 LEU X 108 12.813 15.764 -4.058 1.00 0.00 H new ATOM 0 HD12 LEU X 108 14.503 15.258 -4.296 1.00 0.00 H new ATOM 0 HD13 LEU X 108 13.660 14.864 -2.778 1.00 0.00 H new ATOM 0 HD21 LEU X 108 12.268 17.565 -2.408 1.00 0.00 H new ATOM 0 HD22 LEU X 108 13.132 16.675 -1.132 1.00 0.00 H new ATOM 0 HD23 LEU X 108 13.571 18.361 -1.494 1.00 0.00 H new ATOM 3219 N MET X 109 17.651 18.045 -4.460 1.00 0.00 N ATOM 3220 CA MET X 109 17.783 18.963 -5.632 1.00 0.00 C ATOM 3221 C MET X 109 18.217 18.172 -6.877 1.00 0.00 C ATOM 3222 O MET X 109 17.989 18.591 -7.990 1.00 0.00 O ATOM 3223 CB MET X 109 18.810 20.070 -5.335 1.00 0.00 C ATOM 3224 CG MET X 109 18.162 21.174 -4.492 1.00 0.00 C ATOM 3225 SD MET X 109 17.302 20.440 -3.081 1.00 0.00 S ATOM 3226 CE MET X 109 16.176 21.820 -2.763 1.00 0.00 C ATOM 0 H MET X 109 18.301 18.221 -3.694 1.00 0.00 H new ATOM 0 HA MET X 109 16.813 19.424 -5.820 1.00 0.00 H new ATOM 0 HB2 MET X 109 19.665 19.651 -4.805 1.00 0.00 H new ATOM 0 HB3 MET X 109 19.187 20.488 -6.269 1.00 0.00 H new ATOM 0 HG2 MET X 109 18.923 21.872 -4.143 1.00 0.00 H new ATOM 0 HG3 MET X 109 17.461 21.745 -5.101 1.00 0.00 H new ATOM 0 HE1 MET X 109 15.537 21.580 -1.914 1.00 0.00 H new ATOM 0 HE2 MET X 109 16.754 22.717 -2.540 1.00 0.00 H new ATOM 0 HE3 MET X 109 15.558 21.996 -3.644 1.00 0.00 H new ATOM 3236 N PHE X 110 18.861 17.047 -6.710 1.00 0.00 N ATOM 3237 CA PHE X 110 19.320 16.275 -7.900 1.00 0.00 C ATOM 3238 C PHE X 110 18.196 16.178 -8.940 1.00 0.00 C ATOM 3239 O PHE X 110 18.439 16.267 -10.127 1.00 0.00 O ATOM 3240 CB PHE X 110 19.802 14.874 -7.462 1.00 0.00 C ATOM 3241 CG PHE X 110 18.643 13.906 -7.257 1.00 0.00 C ATOM 3242 CD1 PHE X 110 17.510 14.289 -6.527 1.00 0.00 C ATOM 3243 CD2 PHE X 110 18.716 12.611 -7.789 1.00 0.00 C ATOM 3244 CE1 PHE X 110 16.459 13.390 -6.336 1.00 0.00 C ATOM 3245 CE2 PHE X 110 17.661 11.711 -7.594 1.00 0.00 C ATOM 3246 CZ PHE X 110 16.531 12.105 -6.869 1.00 0.00 C ATOM 0 H PHE X 110 19.088 16.632 -5.806 1.00 0.00 H new ATOM 0 HA PHE X 110 20.158 16.795 -8.365 1.00 0.00 H new ATOM 0 HB2 PHE X 110 20.480 14.473 -8.215 1.00 0.00 H new ATOM 0 HB3 PHE X 110 20.370 14.960 -6.536 1.00 0.00 H new ATOM 0 HD1 PHE X 110 17.449 15.284 -6.110 1.00 0.00 H new ATOM 0 HD2 PHE X 110 19.587 12.307 -8.350 1.00 0.00 H new ATOM 0 HE1 PHE X 110 15.588 13.692 -5.773 1.00 0.00 H new ATOM 0 HE2 PHE X 110 17.720 10.713 -8.003 1.00 0.00 H new ATOM 0 HZ PHE X 110 15.715 11.413 -6.723 1.00 0.00 H new ATOM 3256 N LYS X 111 16.970 16.010 -8.521 1.00 0.00 N ATOM 3257 CA LYS X 111 15.854 15.925 -9.511 1.00 0.00 C ATOM 3258 C LYS X 111 15.471 17.329 -9.985 1.00 0.00 C ATOM 3259 O LYS X 111 15.176 17.538 -11.145 1.00 0.00 O ATOM 3260 CB LYS X 111 14.640 15.213 -8.865 1.00 0.00 C ATOM 3261 CG LYS X 111 13.974 14.229 -9.861 1.00 0.00 C ATOM 3262 CD LYS X 111 14.557 12.817 -9.685 1.00 0.00 C ATOM 3263 CE LYS X 111 16.057 12.816 -9.993 1.00 0.00 C ATOM 3264 NZ LYS X 111 16.557 11.413 -9.977 1.00 0.00 N ATOM 0 H LYS X 111 16.693 15.928 -7.543 1.00 0.00 H new ATOM 0 HA LYS X 111 16.177 15.347 -10.377 1.00 0.00 H new ATOM 0 HB2 LYS X 111 14.963 14.672 -7.976 1.00 0.00 H new ATOM 0 HB3 LYS X 111 13.911 15.955 -8.539 1.00 0.00 H new ATOM 0 HG2 LYS X 111 12.897 14.208 -9.697 1.00 0.00 H new ATOM 0 HG3 LYS X 111 14.134 14.571 -10.883 1.00 0.00 H new ATOM 0 HD2 LYS X 111 14.389 12.472 -8.665 1.00 0.00 H new ATOM 0 HD3 LYS X 111 14.043 12.120 -10.346 1.00 0.00 H new ATOM 0 HE2 LYS X 111 16.241 13.270 -10.967 1.00 0.00 H new ATOM 0 HE3 LYS X 111 16.593 13.414 -9.256 1.00 0.00 H new ATOM 0 HZ1 LYS X 111 16.985 11.186 -10.897 1.00 0.00 H new ATOM 0 HZ2 LYS X 111 17.271 11.307 -9.228 1.00 0.00 H new ATOM 0 HZ3 LYS X 111 15.765 10.764 -9.795 1.00 0.00 H new ATOM 3278 N THR X 112 15.461 18.293 -9.109 1.00 0.00 N ATOM 3279 CA THR X 112 15.089 19.665 -9.549 1.00 0.00 C ATOM 3280 C THR X 112 15.970 20.055 -10.747 1.00 0.00 C ATOM 3281 O THR X 112 15.563 20.796 -11.620 1.00 0.00 O ATOM 3282 CB THR X 112 15.250 20.647 -8.367 1.00 0.00 C ATOM 3283 OG1 THR X 112 14.191 21.592 -8.401 1.00 0.00 O ATOM 3284 CG2 THR X 112 16.593 21.388 -8.424 1.00 0.00 C ATOM 0 H THR X 112 15.691 18.193 -8.120 1.00 0.00 H new ATOM 0 HA THR X 112 14.047 19.702 -9.865 1.00 0.00 H new ATOM 0 HB THR X 112 15.222 20.072 -7.441 1.00 0.00 H new ATOM 0 HG1 THR X 112 14.286 22.217 -7.652 1.00 0.00 H new ATOM 0 HG21 THR X 112 16.669 22.069 -7.576 1.00 0.00 H new ATOM 0 HG22 THR X 112 17.409 20.666 -8.384 1.00 0.00 H new ATOM 0 HG23 THR X 112 16.656 21.956 -9.352 1.00 0.00 H new ATOM 3292 N GLU X 113 17.173 19.546 -10.794 1.00 0.00 N ATOM 3293 CA GLU X 113 18.082 19.866 -11.930 1.00 0.00 C ATOM 3294 CB GLU X 113 17.588 19.144 -13.186 1.00 0.00 C ATOM 3295 CG GLU X 113 17.811 17.637 -13.031 1.00 0.00 C ATOM 3296 CD GLU X 113 17.317 16.915 -14.286 1.00 0.00 C ATOM 3297 OE1 GLU X 113 16.677 17.558 -15.102 1.00 0.00 O ATOM 3298 OE2 GLU X 113 17.585 15.731 -14.408 1.00 0.00 O ATOM 0 H GLU X 113 17.565 18.920 -10.091 1.00 0.00 H new ATOM 0 HB2 GLU X 113 16.530 19.351 -13.345 1.00 0.00 H new ATOM 0 HB3 GLU X 113 18.120 19.513 -14.063 1.00 0.00 H new ATOM 0 HG2 GLU X 113 18.869 17.430 -12.873 1.00 0.00 H new ATOM 0 HG3 GLU X 113 17.279 17.268 -12.154 1.00 0.00 H new TER 3305 GLU X 113 ATOM 3306 N SER Y 92 -19.385 18.087 -43.019 1.00 0.00 N ATOM 3307 CA SER Y 92 -20.699 18.196 -42.324 1.00 0.00 C ATOM 3308 C SER Y 92 -21.600 19.169 -43.087 1.00 0.00 C ATOM 3309 O SER Y 92 -21.283 19.595 -44.180 1.00 0.00 O ATOM 3310 CB SER Y 92 -20.482 18.711 -40.901 1.00 0.00 C ATOM 3311 OG SER Y 92 -19.818 17.713 -40.137 1.00 0.00 O ATOM 0 HA SER Y 92 -21.173 17.215 -42.287 1.00 0.00 H new ATOM 0 HB2 SER Y 92 -19.889 19.626 -40.919 1.00 0.00 H new ATOM 0 HB3 SER Y 92 -21.439 18.960 -40.442 1.00 0.00 H new ATOM 0 HG SER Y 92 -19.152 17.262 -40.697 1.00 0.00 H new ATOM 3319 N HIS Y 93 -22.722 19.523 -42.522 1.00 0.00 N ATOM 3320 CA HIS Y 93 -23.640 20.467 -43.219 1.00 0.00 C ATOM 3321 C HIS Y 93 -23.013 21.863 -43.247 1.00 0.00 C ATOM 3322 O HIS Y 93 -23.347 22.686 -44.076 1.00 0.00 O ATOM 3323 CB HIS Y 93 -24.976 20.524 -42.475 1.00 0.00 C ATOM 3324 CG HIS Y 93 -24.729 20.826 -41.022 1.00 0.00 C ATOM 3325 ND1 HIS Y 93 -24.441 20.015 -39.952 1.00 0.00 N flip ATOM 3326 CD2 HIS Y 93 -24.769 22.119 -40.518 1.00 0.00 C flip ATOM 3327 CE1 HIS Y 93 -24.306 20.790 -38.806 1.00 0.00 C flip ATOM 3328 NE2 HIS Y 93 -24.513 22.048 -39.199 1.00 0.00 N flip ATOM 0 H HIS Y 93 -23.042 19.200 -41.609 1.00 0.00 H new ATOM 0 HA HIS Y 93 -23.807 20.123 -44.240 1.00 0.00 H new ATOM 0 HB2 HIS Y 93 -25.616 21.290 -42.913 1.00 0.00 H new ATOM 0 HB3 HIS Y 93 -25.501 19.574 -42.576 1.00 0.00 H new ATOM 0 HD2 HIS Y 93 -24.969 23.018 -41.082 1.00 0.00 H new ATOM 0 HE1 HIS Y 93 -24.081 20.446 -37.807 1.00 0.00 H new ATOM 0 HE2 HIS Y 93 -24.481 22.856 -38.577 1.00 0.00 H new ATOM 3337 N LEU Y 94 -22.103 22.137 -42.349 1.00 0.00 N ATOM 3338 CA LEU Y 94 -21.456 23.481 -42.333 1.00 0.00 C ATOM 3339 C LEU Y 94 -20.334 23.499 -43.374 1.00 0.00 C ATOM 3340 O LEU Y 94 -19.486 22.630 -43.401 1.00 0.00 O ATOM 3341 CB LEU Y 94 -20.878 23.752 -40.937 1.00 0.00 C ATOM 3342 CG LEU Y 94 -20.212 25.137 -40.886 1.00 0.00 C ATOM 3343 CD1 LEU Y 94 -21.262 26.240 -41.108 1.00 0.00 C ATOM 3344 CD2 LEU Y 94 -19.553 25.323 -39.515 1.00 0.00 C ATOM 0 H LEU Y 94 -21.781 21.490 -41.629 1.00 0.00 H new ATOM 0 HA LEU Y 94 -22.188 24.253 -42.570 1.00 0.00 H new ATOM 0 HB2 LEU Y 94 -21.672 23.697 -40.192 1.00 0.00 H new ATOM 0 HB3 LEU Y 94 -20.149 22.982 -40.684 1.00 0.00 H new ATOM 0 HG LEU Y 94 -19.460 25.206 -41.672 1.00 0.00 H new ATOM 0 HD11 LEU Y 94 -20.778 27.216 -41.070 1.00 0.00 H new ATOM 0 HD12 LEU Y 94 -21.731 26.105 -42.083 1.00 0.00 H new ATOM 0 HD13 LEU Y 94 -22.022 26.181 -40.329 1.00 0.00 H new ATOM 0 HD21 LEU Y 94 -19.078 26.303 -39.470 1.00 0.00 H new ATOM 0 HD22 LEU Y 94 -20.310 25.250 -38.734 1.00 0.00 H new ATOM 0 HD23 LEU Y 94 -18.801 24.548 -39.364 1.00 0.00 H new ATOM 3356 N LYS Y 95 -20.326 24.479 -44.234 1.00 0.00 N ATOM 3357 CA LYS Y 95 -19.264 24.547 -45.276 1.00 0.00 C ATOM 3358 C LYS Y 95 -17.888 24.651 -44.612 1.00 0.00 C ATOM 3359 O LYS Y 95 -16.931 24.047 -45.052 1.00 0.00 O ATOM 3360 CB LYS Y 95 -19.500 25.775 -46.157 1.00 0.00 C ATOM 3361 CG LYS Y 95 -20.749 25.548 -47.016 1.00 0.00 C ATOM 3362 CD LYS Y 95 -21.005 26.769 -47.911 1.00 0.00 C ATOM 3363 CE LYS Y 95 -21.592 27.927 -47.092 1.00 0.00 C ATOM 3364 NZ LYS Y 95 -22.134 28.960 -48.020 1.00 0.00 N ATOM 0 H LYS Y 95 -21.009 25.236 -44.260 1.00 0.00 H new ATOM 0 HA LYS Y 95 -19.298 23.644 -45.886 1.00 0.00 H new ATOM 0 HB2 LYS Y 95 -19.627 26.663 -45.537 1.00 0.00 H new ATOM 0 HB3 LYS Y 95 -18.633 25.952 -46.794 1.00 0.00 H new ATOM 0 HG2 LYS Y 95 -20.619 24.658 -47.631 1.00 0.00 H new ATOM 0 HG3 LYS Y 95 -21.613 25.370 -46.375 1.00 0.00 H new ATOM 0 HD2 LYS Y 95 -20.073 27.084 -48.380 1.00 0.00 H new ATOM 0 HD3 LYS Y 95 -21.691 26.500 -48.714 1.00 0.00 H new ATOM 0 HE2 LYS Y 95 -22.382 27.560 -46.436 1.00 0.00 H new ATOM 0 HE3 LYS Y 95 -20.824 28.362 -46.453 1.00 0.00 H new ATOM 0 HZ1 LYS Y 95 -22.533 29.747 -47.469 1.00 0.00 H new ATOM 0 HZ2 LYS Y 95 -21.369 29.316 -48.628 1.00 0.00 H new ATOM 0 HZ3 LYS Y 95 -22.879 28.539 -48.611 1.00 0.00 H new ATOM 3378 N SER Y 96 -17.779 25.412 -43.555 1.00 0.00 N ATOM 3379 CA SER Y 96 -16.461 25.550 -42.869 1.00 0.00 C ATOM 3380 C SER Y 96 -16.262 24.377 -41.910 1.00 0.00 C ATOM 3381 O SER Y 96 -17.164 23.984 -41.198 1.00 0.00 O ATOM 3382 CB SER Y 96 -16.425 26.862 -42.084 1.00 0.00 C ATOM 3383 OG SER Y 96 -15.266 26.883 -41.261 1.00 0.00 O ATOM 0 H SER Y 96 -18.544 25.943 -43.138 1.00 0.00 H new ATOM 0 HA SER Y 96 -15.664 25.552 -43.613 1.00 0.00 H new ATOM 0 HB2 SER Y 96 -16.414 27.709 -42.769 1.00 0.00 H new ATOM 0 HB3 SER Y 96 -17.322 26.958 -41.472 1.00 0.00 H new ATOM 0 HG SER Y 96 -15.238 27.723 -40.757 1.00 0.00 H new ATOM 3389 N LYS Y 97 -15.084 23.813 -41.886 1.00 0.00 N ATOM 3390 CA LYS Y 97 -14.821 22.662 -40.974 1.00 0.00 C ATOM 3391 C LYS Y 97 -14.282 23.189 -39.644 1.00 0.00 C ATOM 3392 O LYS Y 97 -13.211 23.759 -39.579 1.00 0.00 O ATOM 3393 CB LYS Y 97 -13.776 21.751 -41.618 1.00 0.00 C ATOM 3394 CG LYS Y 97 -13.631 20.468 -40.797 1.00 0.00 C ATOM 3395 CD LYS Y 97 -12.777 19.455 -41.569 1.00 0.00 C ATOM 3396 CE LYS Y 97 -11.363 20.009 -41.771 1.00 0.00 C ATOM 3397 NZ LYS Y 97 -10.444 18.898 -42.146 1.00 0.00 N ATOM 0 H LYS Y 97 -14.291 24.100 -42.460 1.00 0.00 H new ATOM 0 HA LYS Y 97 -15.742 22.105 -40.800 1.00 0.00 H new ATOM 0 HB2 LYS Y 97 -14.071 21.509 -42.639 1.00 0.00 H new ATOM 0 HB3 LYS Y 97 -12.817 22.266 -41.677 1.00 0.00 H new ATOM 0 HG2 LYS Y 97 -13.168 20.690 -39.835 1.00 0.00 H new ATOM 0 HG3 LYS Y 97 -14.614 20.045 -40.588 1.00 0.00 H new ATOM 0 HD2 LYS Y 97 -12.733 18.513 -41.023 1.00 0.00 H new ATOM 0 HD3 LYS Y 97 -13.235 19.242 -42.535 1.00 0.00 H new ATOM 0 HE2 LYS Y 97 -11.367 20.771 -42.551 1.00 0.00 H new ATOM 0 HE3 LYS Y 97 -11.015 20.490 -40.857 1.00 0.00 H new ATOM 0 HZ1 LYS Y 97 -9.484 19.273 -42.283 1.00 0.00 H new ATOM 0 HZ2 LYS Y 97 -10.432 18.186 -41.388 1.00 0.00 H new ATOM 0 HZ3 LYS Y 97 -10.773 18.458 -43.029 1.00 0.00 H new ATOM 3411 N LYS Y 98 -15.020 23.009 -38.580 1.00 0.00 N ATOM 3412 CA LYS Y 98 -14.559 23.504 -37.248 1.00 0.00 C ATOM 3413 C LYS Y 98 -15.112 22.591 -36.152 1.00 0.00 C ATOM 3414 O LYS Y 98 -16.060 21.861 -36.360 1.00 0.00 O ATOM 3415 CB LYS Y 98 -15.074 24.929 -37.015 1.00 0.00 C ATOM 3416 CG LYS Y 98 -14.398 25.898 -37.990 1.00 0.00 C ATOM 3417 CD LYS Y 98 -14.841 27.334 -37.684 1.00 0.00 C ATOM 3418 CE LYS Y 98 -16.340 27.501 -37.973 1.00 0.00 C ATOM 3419 NZ LYS Y 98 -16.640 28.942 -38.203 1.00 0.00 N ATOM 0 H LYS Y 98 -15.925 22.539 -38.576 1.00 0.00 H new ATOM 0 HA LYS Y 98 -13.469 23.502 -37.223 1.00 0.00 H new ATOM 0 HB2 LYS Y 98 -16.155 24.960 -37.150 1.00 0.00 H new ATOM 0 HB3 LYS Y 98 -14.872 25.234 -35.988 1.00 0.00 H new ATOM 0 HG2 LYS Y 98 -13.314 25.816 -37.906 1.00 0.00 H new ATOM 0 HG3 LYS Y 98 -14.659 25.638 -39.016 1.00 0.00 H new ATOM 0 HD2 LYS Y 98 -14.636 27.571 -36.640 1.00 0.00 H new ATOM 0 HD3 LYS Y 98 -14.267 28.036 -38.288 1.00 0.00 H new ATOM 0 HE2 LYS Y 98 -16.621 26.915 -38.848 1.00 0.00 H new ATOM 0 HE3 LYS Y 98 -16.928 27.125 -37.136 1.00 0.00 H new ATOM 0 HZ1 LYS Y 98 -17.655 29.058 -38.399 1.00 0.00 H new ATOM 0 HZ2 LYS Y 98 -16.386 29.489 -37.356 1.00 0.00 H new ATOM 0 HZ3 LYS Y 98 -16.089 29.286 -39.015 1.00 0.00 H new ATOM 3433 N GLY Y 99 -14.534 22.633 -34.981 1.00 0.00 N ATOM 3434 CA GLY Y 99 -15.036 21.775 -33.865 1.00 0.00 C ATOM 3435 C GLY Y 99 -14.344 20.411 -33.893 1.00 0.00 C ATOM 3436 O GLY Y 99 -14.966 19.388 -33.683 1.00 0.00 O ATOM 0 H GLY Y 99 -13.736 23.224 -34.748 1.00 0.00 H new ATOM 0 HA2 GLY Y 99 -14.851 22.265 -32.909 1.00 0.00 H new ATOM 0 HA3 GLY Y 99 -16.115 21.645 -33.954 1.00 0.00 H new ATOM 3440 N GLN Y 100 -13.063 20.383 -34.137 1.00 0.00 N ATOM 3441 CA GLN Y 100 -12.344 19.078 -34.161 1.00 0.00 C ATOM 3442 C GLN Y 100 -12.383 18.467 -32.759 1.00 0.00 C ATOM 3443 O GLN Y 100 -12.242 19.157 -31.769 1.00 0.00 O ATOM 3444 CB GLN Y 100 -10.887 19.298 -34.581 1.00 0.00 C ATOM 3445 CG GLN Y 100 -10.835 19.686 -36.060 1.00 0.00 C ATOM 3446 CD GLN Y 100 -9.406 20.086 -36.433 1.00 0.00 C ATOM 3447 OE1 GLN Y 100 -8.608 20.403 -35.574 1.00 0.00 O ATOM 3448 NE2 GLN Y 100 -9.048 20.087 -37.688 1.00 0.00 N ATOM 0 H GLN Y 100 -12.485 21.203 -34.320 1.00 0.00 H new ATOM 0 HA GLN Y 100 -12.823 18.407 -34.874 1.00 0.00 H new ATOM 0 HB2 GLN Y 100 -10.436 20.082 -33.972 1.00 0.00 H new ATOM 0 HB3 GLN Y 100 -10.308 18.390 -34.412 1.00 0.00 H new ATOM 0 HG2 GLN Y 100 -11.163 18.850 -36.678 1.00 0.00 H new ATOM 0 HG3 GLN Y 100 -11.518 20.513 -36.254 1.00 0.00 H new ATOM 0 HE21 GLN Y 100 -9.718 19.821 -38.410 1.00 0.00 H new ATOM 0 HE22 GLN Y 100 -8.098 20.354 -37.947 1.00 0.00 H new ATOM 3457 N SER Y 101 -12.573 17.181 -32.663 1.00 0.00 N ATOM 3458 CA SER Y 101 -12.621 16.537 -31.320 1.00 0.00 C ATOM 3459 C SER Y 101 -11.390 16.955 -30.519 1.00 0.00 C ATOM 3460 O SER Y 101 -11.400 16.956 -29.304 1.00 0.00 O ATOM 3461 CB SER Y 101 -12.638 15.018 -31.471 1.00 0.00 C ATOM 3462 OG SER Y 101 -13.856 14.621 -32.087 1.00 0.00 O ATOM 0 H SER Y 101 -12.697 16.549 -33.454 1.00 0.00 H new ATOM 0 HA SER Y 101 -13.525 16.853 -30.800 1.00 0.00 H new ATOM 0 HB2 SER Y 101 -11.790 14.691 -32.072 1.00 0.00 H new ATOM 0 HB3 SER Y 101 -12.539 14.543 -30.495 1.00 0.00 H new ATOM 0 HG SER Y 101 -13.869 13.646 -32.187 1.00 0.00 H new ATOM 3468 N THR Y 102 -10.327 17.309 -31.188 1.00 0.00 N ATOM 3469 CA THR Y 102 -9.097 17.725 -30.459 1.00 0.00 C ATOM 3470 C THR Y 102 -9.467 18.770 -29.410 1.00 0.00 C ATOM 3471 O THR Y 102 -8.832 18.881 -28.381 1.00 0.00 O ATOM 3472 CB THR Y 102 -8.086 18.323 -31.436 1.00 0.00 C ATOM 3473 OG1 THR Y 102 -7.830 17.395 -32.480 1.00 0.00 O ATOM 3474 CG2 THR Y 102 -6.789 18.626 -30.686 1.00 0.00 C ATOM 0 H THR Y 102 -10.258 17.328 -32.205 1.00 0.00 H new ATOM 0 HA THR Y 102 -8.653 16.855 -29.976 1.00 0.00 H new ATOM 0 HB THR Y 102 -8.485 19.242 -31.865 1.00 0.00 H new ATOM 0 HG1 THR Y 102 -7.183 17.779 -33.108 1.00 0.00 H new ATOM 0 HG21 THR Y 102 -6.061 19.053 -31.376 1.00 0.00 H new ATOM 0 HG22 THR Y 102 -6.990 19.337 -29.884 1.00 0.00 H new ATOM 0 HG23 THR Y 102 -6.390 17.704 -30.262 1.00 0.00 H new ATOM 3482 N SER Y 103 -10.501 19.530 -29.651 1.00 0.00 N ATOM 3483 CA SER Y 103 -10.914 20.554 -28.651 1.00 0.00 C ATOM 3484 C SER Y 103 -11.006 19.876 -27.284 1.00 0.00 C ATOM 3485 O SER Y 103 -10.790 20.484 -26.257 1.00 0.00 O ATOM 3486 CB SER Y 103 -12.275 21.134 -29.039 1.00 0.00 C ATOM 3487 OG SER Y 103 -12.655 22.118 -28.086 1.00 0.00 O ATOM 0 H SER Y 103 -11.075 19.486 -30.493 1.00 0.00 H new ATOM 0 HA SER Y 103 -10.187 21.366 -28.618 1.00 0.00 H new ATOM 0 HB2 SER Y 103 -12.225 21.575 -30.034 1.00 0.00 H new ATOM 0 HB3 SER Y 103 -13.023 20.342 -29.079 1.00 0.00 H new ATOM 0 HG SER Y 103 -13.526 22.493 -28.333 1.00 0.00 H new ATOM 3493 N ARG Y 104 -11.309 18.608 -27.270 1.00 0.00 N ATOM 3494 CA ARG Y 104 -11.393 17.876 -25.979 1.00 0.00 C ATOM 3495 C ARG Y 104 -10.025 17.962 -25.298 1.00 0.00 C ATOM 3496 O ARG Y 104 -9.907 18.155 -24.099 1.00 0.00 O ATOM 3497 CB ARG Y 104 -11.709 16.410 -26.273 1.00 0.00 C ATOM 3498 CG ARG Y 104 -13.142 16.287 -26.788 1.00 0.00 C ATOM 3499 CD ARG Y 104 -13.368 14.870 -27.313 1.00 0.00 C ATOM 3500 NE ARG Y 104 -14.792 14.712 -27.719 1.00 0.00 N ATOM 3501 CZ ARG Y 104 -15.149 13.713 -28.481 1.00 0.00 C ATOM 3502 NH1 ARG Y 104 -14.254 12.866 -28.911 1.00 0.00 N ATOM 3503 NH2 ARG Y 104 -16.401 13.567 -28.818 1.00 0.00 N ATOM 0 H ARG Y 104 -11.502 18.047 -28.100 1.00 0.00 H new ATOM 0 HA ARG Y 104 -12.165 18.303 -25.339 1.00 0.00 H new ATOM 0 HB2 ARG Y 104 -11.011 16.019 -27.013 1.00 0.00 H new ATOM 0 HB3 ARG Y 104 -11.584 15.813 -25.370 1.00 0.00 H new ATOM 0 HG2 ARG Y 104 -13.849 16.508 -25.988 1.00 0.00 H new ATOM 0 HG3 ARG Y 104 -13.320 17.014 -27.581 1.00 0.00 H new ATOM 0 HD2 ARG Y 104 -12.713 14.677 -28.163 1.00 0.00 H new ATOM 0 HD3 ARG Y 104 -13.115 14.141 -26.543 1.00 0.00 H new ATOM 0 HE ARG Y 104 -15.490 15.385 -27.402 1.00 0.00 H new ATOM 0 HH11 ARG Y 104 -13.274 12.984 -28.652 1.00 0.00 H new ATOM 0 HH12 ARG Y 104 -14.534 12.086 -29.506 1.00 0.00 H new ATOM 0 HH21 ARG Y 104 -17.099 14.232 -28.486 1.00 0.00 H new ATOM 0 HH22 ARG Y 104 -16.681 12.787 -29.413 1.00 0.00 H new ATOM 3517 N HIS Y 105 -8.985 17.837 -26.075 1.00 0.00 N ATOM 3518 CA HIS Y 105 -7.613 17.921 -25.516 1.00 0.00 C ATOM 3519 C HIS Y 105 -7.374 19.341 -25.009 1.00 0.00 C ATOM 3520 O HIS Y 105 -6.687 19.553 -24.033 1.00 0.00 O ATOM 3521 CB HIS Y 105 -6.600 17.558 -26.600 1.00 0.00 C ATOM 3522 CG HIS Y 105 -6.754 16.098 -26.924 1.00 0.00 C ATOM 3523 ND1 HIS Y 105 -7.132 15.653 -28.183 1.00 0.00 N ATOM 3524 CD2 HIS Y 105 -6.617 14.970 -26.152 1.00 0.00 C ATOM 3525 CE1 HIS Y 105 -7.209 14.310 -28.132 1.00 0.00 C ATOM 3526 NE2 HIS Y 105 -6.906 13.846 -26.918 1.00 0.00 N ATOM 0 H HIS Y 105 -9.031 17.679 -27.082 1.00 0.00 H new ATOM 0 HA HIS Y 105 -7.498 17.222 -24.687 1.00 0.00 H new ATOM 0 HB2 HIS Y 105 -6.765 18.164 -27.491 1.00 0.00 H new ATOM 0 HB3 HIS Y 105 -5.586 17.765 -26.257 1.00 0.00 H new ATOM 0 HD2 HIS Y 105 -6.329 14.958 -25.111 1.00 0.00 H new ATOM 0 HE1 HIS Y 105 -7.482 13.685 -28.970 1.00 0.00 H new ATOM 0 HE2 HIS Y 105 -6.890 12.872 -26.616 1.00 0.00 H new ATOM 3535 N LYS Y 106 -7.952 20.316 -25.657 1.00 0.00 N ATOM 3536 CA LYS Y 106 -7.767 21.719 -25.198 1.00 0.00 C ATOM 3537 C LYS Y 106 -8.283 21.818 -23.766 1.00 0.00 C ATOM 3538 O LYS Y 106 -7.774 22.565 -22.956 1.00 0.00 O ATOM 3539 CB LYS Y 106 -8.556 22.676 -26.092 1.00 0.00 C ATOM 3540 CG LYS Y 106 -8.271 24.115 -25.662 1.00 0.00 C ATOM 3541 CD LYS Y 106 -9.054 25.080 -26.549 1.00 0.00 C ATOM 3542 CE LYS Y 106 -8.741 26.513 -26.126 1.00 0.00 C ATOM 3543 NZ LYS Y 106 -9.696 27.446 -26.787 1.00 0.00 N ATOM 0 H LYS Y 106 -8.542 20.201 -26.481 1.00 0.00 H new ATOM 0 HA LYS Y 106 -6.713 21.991 -25.247 1.00 0.00 H new ATOM 0 HB2 LYS Y 106 -8.275 22.533 -27.135 1.00 0.00 H new ATOM 0 HB3 LYS Y 106 -9.623 22.466 -26.018 1.00 0.00 H new ATOM 0 HG2 LYS Y 106 -8.552 24.256 -24.618 1.00 0.00 H new ATOM 0 HG3 LYS Y 106 -7.203 24.322 -25.736 1.00 0.00 H new ATOM 0 HD2 LYS Y 106 -8.787 24.930 -27.595 1.00 0.00 H new ATOM 0 HD3 LYS Y 106 -10.123 24.887 -26.462 1.00 0.00 H new ATOM 0 HE2 LYS Y 106 -8.814 26.608 -25.043 1.00 0.00 H new ATOM 0 HE3 LYS Y 106 -7.717 26.769 -26.400 1.00 0.00 H new ATOM 0 HZ1 LYS Y 106 -9.483 28.422 -26.499 1.00 0.00 H new ATOM 0 HZ2 LYS Y 106 -9.605 27.362 -27.820 1.00 0.00 H new ATOM 0 HZ3 LYS Y 106 -10.668 27.206 -26.504 1.00 0.00 H new ATOM 3557 N LYS Y 107 -9.282 21.055 -23.439 1.00 0.00 N ATOM 3558 CA LYS Y 107 -9.807 21.097 -22.054 1.00 0.00 C ATOM 3559 C LYS Y 107 -8.663 20.700 -21.122 1.00 0.00 C ATOM 3560 O LYS Y 107 -8.490 21.264 -20.063 1.00 0.00 O ATOM 3561 CB LYS Y 107 -10.970 20.113 -21.913 1.00 0.00 C ATOM 3562 CG LYS Y 107 -11.568 20.219 -20.507 1.00 0.00 C ATOM 3563 CD LYS Y 107 -12.881 19.428 -20.437 1.00 0.00 C ATOM 3564 CE LYS Y 107 -12.597 17.924 -20.502 1.00 0.00 C ATOM 3565 NZ LYS Y 107 -13.832 17.170 -20.144 1.00 0.00 N ATOM 0 H LYS Y 107 -9.756 20.407 -24.068 1.00 0.00 H new ATOM 0 HA LYS Y 107 -10.174 22.093 -21.805 1.00 0.00 H new ATOM 0 HB2 LYS Y 107 -11.734 20.328 -22.661 1.00 0.00 H new ATOM 0 HB3 LYS Y 107 -10.623 19.096 -22.095 1.00 0.00 H new ATOM 0 HG2 LYS Y 107 -10.861 19.834 -19.772 1.00 0.00 H new ATOM 0 HG3 LYS Y 107 -11.749 21.264 -20.257 1.00 0.00 H new ATOM 0 HD2 LYS Y 107 -13.409 19.666 -19.513 1.00 0.00 H new ATOM 0 HD3 LYS Y 107 -13.533 19.718 -21.261 1.00 0.00 H new ATOM 0 HE2 LYS Y 107 -12.267 17.648 -21.504 1.00 0.00 H new ATOM 0 HE3 LYS Y 107 -11.789 17.666 -19.818 1.00 0.00 H new ATOM 0 HZ1 LYS Y 107 -13.640 16.149 -20.188 1.00 0.00 H new ATOM 0 HZ2 LYS Y 107 -14.128 17.426 -19.180 1.00 0.00 H new ATOM 0 HZ3 LYS Y 107 -14.591 17.409 -20.814 1.00 0.00 H new ATOM 3579 N LEU Y 108 -7.870 19.738 -21.523 1.00 0.00 N ATOM 3580 CA LEU Y 108 -6.715 19.308 -20.673 1.00 0.00 C ATOM 3581 C LEU Y 108 -5.679 20.445 -20.575 1.00 0.00 C ATOM 3582 O LEU Y 108 -4.952 20.553 -19.603 1.00 0.00 O ATOM 3583 CB LEU Y 108 -6.061 18.061 -21.283 1.00 0.00 C ATOM 3584 CG LEU Y 108 -4.828 17.643 -20.463 1.00 0.00 C ATOM 3585 CD1 LEU Y 108 -5.222 17.389 -19.000 1.00 0.00 C ATOM 3586 CD2 LEU Y 108 -4.247 16.358 -21.065 1.00 0.00 C ATOM 0 H LEU Y 108 -7.972 19.231 -22.402 1.00 0.00 H new ATOM 0 HA LEU Y 108 -7.078 19.072 -19.672 1.00 0.00 H new ATOM 0 HB2 LEU Y 108 -6.781 17.243 -21.311 1.00 0.00 H new ATOM 0 HB3 LEU Y 108 -5.768 18.264 -22.313 1.00 0.00 H new ATOM 0 HG LEU Y 108 -4.087 18.442 -20.492 1.00 0.00 H new ATOM 0 HD11 LEU Y 108 -4.340 17.094 -18.432 1.00 0.00 H new ATOM 0 HD12 LEU Y 108 -5.641 18.300 -18.573 1.00 0.00 H new ATOM 0 HD13 LEU Y 108 -5.965 16.593 -18.956 1.00 0.00 H new ATOM 0 HD21 LEU Y 108 -3.372 16.051 -20.492 1.00 0.00 H new ATOM 0 HD22 LEU Y 108 -4.998 15.569 -21.031 1.00 0.00 H new ATOM 0 HD23 LEU Y 108 -3.958 16.540 -22.100 1.00 0.00 H new ATOM 3598 N MET Y 109 -5.595 21.289 -21.567 1.00 0.00 N ATOM 3599 CA MET Y 109 -4.603 22.406 -21.511 1.00 0.00 C ATOM 3600 C MET Y 109 -4.942 23.358 -20.353 1.00 0.00 C ATOM 3601 O MET Y 109 -4.091 24.064 -19.860 1.00 0.00 O ATOM 3602 CB MET Y 109 -4.597 23.184 -22.839 1.00 0.00 C ATOM 3603 CG MET Y 109 -3.759 22.436 -23.882 1.00 0.00 C ATOM 3604 SD MET Y 109 -4.257 20.698 -23.934 1.00 0.00 S ATOM 3605 CE MET Y 109 -2.740 20.053 -24.681 1.00 0.00 C ATOM 0 H MET Y 109 -6.167 21.256 -22.411 1.00 0.00 H new ATOM 0 HA MET Y 109 -3.613 21.981 -21.346 1.00 0.00 H new ATOM 0 HB2 MET Y 109 -5.617 23.308 -23.202 1.00 0.00 H new ATOM 0 HB3 MET Y 109 -4.190 24.183 -22.683 1.00 0.00 H new ATOM 0 HG2 MET Y 109 -3.892 22.892 -24.863 1.00 0.00 H new ATOM 0 HG3 MET Y 109 -2.700 22.513 -23.635 1.00 0.00 H new ATOM 0 HE1 MET Y 109 -2.848 18.983 -24.857 1.00 0.00 H new ATOM 0 HE2 MET Y 109 -2.557 20.560 -25.628 1.00 0.00 H new ATOM 0 HE3 MET Y 109 -1.900 20.227 -24.008 1.00 0.00 H new ATOM 3615 N PHE Y 110 -6.176 23.410 -19.929 1.00 0.00 N ATOM 3616 CA PHE Y 110 -6.541 24.347 -18.829 1.00 0.00 C ATOM 3617 C PHE Y 110 -5.516 24.258 -17.690 1.00 0.00 C ATOM 3618 O PHE Y 110 -5.158 25.256 -17.097 1.00 0.00 O ATOM 3619 CB PHE Y 110 -7.967 24.034 -18.328 1.00 0.00 C ATOM 3620 CG PHE Y 110 -7.991 22.859 -17.358 1.00 0.00 C ATOM 3621 CD1 PHE Y 110 -7.307 21.671 -17.651 1.00 0.00 C ATOM 3622 CD2 PHE Y 110 -8.722 22.957 -16.165 1.00 0.00 C ATOM 3623 CE1 PHE Y 110 -7.348 20.597 -16.761 1.00 0.00 C ATOM 3624 CE2 PHE Y 110 -8.762 21.877 -15.275 1.00 0.00 C ATOM 3625 CZ PHE Y 110 -8.071 20.697 -15.575 1.00 0.00 C ATOM 0 H PHE Y 110 -6.944 22.847 -20.295 1.00 0.00 H new ATOM 0 HA PHE Y 110 -6.528 25.369 -19.207 1.00 0.00 H new ATOM 0 HB2 PHE Y 110 -8.380 24.916 -17.838 1.00 0.00 H new ATOM 0 HB3 PHE Y 110 -8.609 23.813 -19.180 1.00 0.00 H new ATOM 0 HD1 PHE Y 110 -6.746 21.587 -18.570 1.00 0.00 H new ATOM 0 HD2 PHE Y 110 -9.255 23.867 -15.933 1.00 0.00 H new ATOM 0 HE1 PHE Y 110 -6.817 19.685 -16.993 1.00 0.00 H new ATOM 0 HE2 PHE Y 110 -9.326 21.954 -14.357 1.00 0.00 H new ATOM 0 HZ PHE Y 110 -8.099 19.865 -14.887 1.00 0.00 H new ATOM 3635 N LYS Y 111 -5.030 23.086 -17.379 1.00 0.00 N ATOM 3636 CA LYS Y 111 -4.021 22.971 -16.283 1.00 0.00 C ATOM 3637 C LYS Y 111 -2.637 23.370 -16.800 1.00 0.00 C ATOM 3638 O LYS Y 111 -1.863 23.991 -16.098 1.00 0.00 O ATOM 3639 CB LYS Y 111 -4.003 21.519 -15.744 1.00 0.00 C ATOM 3640 CG LYS Y 111 -3.888 21.497 -14.198 1.00 0.00 C ATOM 3641 CD LYS Y 111 -5.287 21.428 -13.563 1.00 0.00 C ATOM 3642 CE LYS Y 111 -6.098 22.676 -13.926 1.00 0.00 C ATOM 3643 NZ LYS Y 111 -7.378 22.664 -13.165 1.00 0.00 N ATOM 0 H LYS Y 111 -5.285 22.208 -17.832 1.00 0.00 H new ATOM 0 HA LYS Y 111 -4.291 23.645 -15.470 1.00 0.00 H new ATOM 0 HB2 LYS Y 111 -4.913 21.003 -16.051 1.00 0.00 H new ATOM 0 HB3 LYS Y 111 -3.165 20.976 -16.182 1.00 0.00 H new ATOM 0 HG2 LYS Y 111 -3.294 20.639 -13.882 1.00 0.00 H new ATOM 0 HG3 LYS Y 111 -3.367 22.390 -13.852 1.00 0.00 H new ATOM 0 HD2 LYS Y 111 -5.807 20.535 -13.909 1.00 0.00 H new ATOM 0 HD3 LYS Y 111 -5.198 21.346 -12.480 1.00 0.00 H new ATOM 0 HE2 LYS Y 111 -5.529 23.576 -13.691 1.00 0.00 H new ATOM 0 HE3 LYS Y 111 -6.298 22.696 -14.997 1.00 0.00 H new ATOM 0 HZ1 LYS Y 111 -8.170 22.846 -13.814 1.00 0.00 H new ATOM 0 HZ2 LYS Y 111 -7.506 21.735 -12.715 1.00 0.00 H new ATOM 0 HZ3 LYS Y 111 -7.354 23.403 -12.433 1.00 0.00 H new ATOM 3657 N THR Y 112 -2.310 23.022 -18.011 1.00 0.00 N ATOM 3658 CA THR Y 112 -0.967 23.393 -18.528 1.00 0.00 C ATOM 3659 C THR Y 112 -0.789 24.912 -18.380 1.00 0.00 C ATOM 3660 O THR Y 112 0.305 25.406 -18.191 1.00 0.00 O ATOM 3661 CB THR Y 112 -0.841 22.933 -19.999 1.00 0.00 C ATOM 3662 OG1 THR Y 112 0.481 22.468 -20.229 1.00 0.00 O ATOM 3663 CG2 THR Y 112 -1.158 24.070 -20.983 1.00 0.00 C ATOM 0 H THR Y 112 -2.905 22.504 -18.657 1.00 0.00 H new ATOM 0 HA THR Y 112 -0.177 22.900 -17.961 1.00 0.00 H new ATOM 0 HB THR Y 112 -1.564 22.135 -20.166 1.00 0.00 H new ATOM 0 HG1 THR Y 112 0.567 22.173 -21.160 1.00 0.00 H new ATOM 0 HG21 THR Y 112 -1.058 23.705 -22.005 1.00 0.00 H new ATOM 0 HG22 THR Y 112 -2.178 24.418 -20.820 1.00 0.00 H new ATOM 0 HG23 THR Y 112 -0.463 24.894 -20.822 1.00 0.00 H new ATOM 3671 N GLU Y 113 -1.866 25.647 -18.451 1.00 0.00 N ATOM 3672 CA GLU Y 113 -1.778 27.126 -18.300 1.00 0.00 C ATOM 3673 CB GLU Y 113 -1.491 27.466 -16.834 1.00 0.00 C ATOM 3674 CG GLU Y 113 -2.719 27.135 -15.980 1.00 0.00 C ATOM 3675 CD GLU Y 113 -2.432 27.474 -14.517 1.00 0.00 C ATOM 3676 OE1 GLU Y 113 -1.286 27.756 -14.209 1.00 0.00 O ATOM 3677 OE2 GLU Y 113 -3.364 27.448 -13.730 1.00 0.00 O ATOM 0 H GLU Y 113 -2.806 25.284 -18.608 1.00 0.00 H new ATOM 0 HB2 GLU Y 113 -0.628 26.902 -16.482 1.00 0.00 H new ATOM 0 HB3 GLU Y 113 -1.242 28.523 -16.737 1.00 0.00 H new ATOM 0 HG2 GLU Y 113 -3.582 27.700 -16.332 1.00 0.00 H new ATOM 0 HG3 GLU Y 113 -2.968 26.078 -16.077 1.00 0.00 H new TER 3684 GLU Y 113 HETATM 3685 CA CA A 114 -4.420 24.515 2.406 1.00 0.00 CA HETATM 3686 CA CA A 115 3.014 30.191 -6.413 1.00 0.00 CA HETATM 3687 CA CA B 116 10.219 3.214 -22.209 1.00 0.00 CA HETATM 3688 CA CA B 117 12.620 15.743 -23.214 1.00 0.00 CA