USER MOD reduce.3.24.130724 H: found=0, std=0, add=1166, rem=0, adj=42 USER MOD reduce.3.24.130724 removed 972 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 115 SER OG : rot 177:sc= 1.73 USER MOD Set 1.2: A 118 THR OG1 : rot 180:sc= 0 USER MOD Set 1.3: A 120 HIS : no HE2:sc= -1.9 K(o=-0.17,f=-0.71) USER MOD Set 2.1: A 74 TYR OH : rot 180:sc= 0 USER MOD Set 2.2: A 101 GLN : amide:sc= -0.0666 X(o=-0.067,f=-0.06) USER MOD Set 3.1: A 39 SER OG : rot 180:sc= 0.379 USER MOD Set 3.2: A 68 GLN : amide:sc= 0.208 X(o=0.59,f=0.18) USER MOD Set 4.1: A 57 GLN : amide:sc= 0.566 K(o=1.4,f=-3) USER MOD Set 4.2: A 93 THR OG1 : rot 176:sc= 0.868 USER MOD Set 5.1: A 17 THR OG1 : rot 180:sc= 0.469 USER MOD Set 5.2: A 114 THR OG1 : rot -127:sc= 0.512 USER MOD Single : A 1 GLY N :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 2 MET CE :methyl 180:sc= 0 (180deg=0) USER MOD Single : A 4 LYS NZ :NH3+ 162:sc= -0.034 (180deg=-0.286) USER MOD Single : A 5 LYS NZ :NH3+ -173:sc= 0.778 (180deg=0.737) USER MOD Single : A 6 THR OG1 : rot 180:sc= -0.0166 USER MOD Single : A 10 TYR OH : rot 180:sc= 0 USER MOD Single : A 11 TYR OH : rot -112:sc= 0.666 USER MOD Single : A 12 SER OG : rot 34:sc= 0.214 USER MOD Single : A 14 SER OG : rot 68:sc= 0.7 USER MOD Single : A 18 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 19 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 20 MET CE :methyl 171:sc=-0.00321 (180deg=-0.153) USER MOD Single : A 23 LYS NZ :NH3+ -171:sc= 0 (180deg=-0.0558) USER MOD Single : A 25 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 26 SER OG : rot 180:sc= 0 USER MOD Single : A 29 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 31 SER OG : rot 170:sc= 0 USER MOD Single : A 34 LYS NZ :NH3+ -154:sc= 1.04 (180deg=0.62) USER MOD Single : A 37 LYS NZ :NH3+ -131:sc= 0.168 (180deg=0) USER MOD Single : A 42 THR OG1 : rot 99:sc= 0.995 USER MOD Single : A 47 MET CE :methyl 171:sc= 0 (180deg=-0.0177) USER MOD Single : A 48 TYR OH : rot -89:sc= 1.21 USER MOD Single : A 49 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 50 THR OG1 : rot -154:sc= 0.507 USER MOD Single : A 51 SER OG : rot 180:sc= 0 USER MOD Single : A 59 GLN :FLIP amide:sc= -2.33! C(o=-7!,f=-2.3!) USER MOD Single : A 61 ASN : amide:sc= -0.146 K(o=-0.15,f=-8.2!) USER MOD Single : A 62 LYS NZ :NH3+ -171:sc= 1.2 (180deg=1.02) USER MOD Single : A 71 ASN : amide:sc= 0 X(o=0,f=-0.27) USER MOD Single : A 75 ASN : amide:sc= -0.312 X(o=-0.31,f=-0.011) USER MOD Single : A 76 ASN : amide:sc= 0 X(o=0,f=-0.42) USER MOD Single : A 77 TYR OH : rot 15:sc= 1.26 USER MOD Single : A 84 SER OG : rot 59:sc= 1.38 USER MOD Single : A 88 SER OG : rot 180:sc= 0 USER MOD Single : A 90 TYR OH : rot 180:sc= 0 USER MOD Single : A 96 LYS NZ :NH3+ 167:sc= 0 (180deg=-0.0819) USER MOD Single : A 97 THR OG1 : rot -93:sc= 1.48 USER MOD Single : A 102 MET CE :methyl -129:sc= -0.0123 (180deg=-0.994) USER MOD Single : A 103 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 104 ASN : amide:sc=-0.00213 X(o=-0.0021,f=-0.072) USER MOD Single : A 105 TYR OH : rot 142:sc= 1.16 USER MOD Single : A 111 SER OG : rot 178:sc= 0.655 USER MOD Single : A 119 ASN : amide:sc= -0.283 X(o=-0.28,f=-0.31) USER MOD Single : A 121 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 123 TYR OH : rot 130:sc= -0.364 USER MOD Single : A 125 SER OG : rot 180:sc= 0 USER MOD Single : A 126 HIS : no HD1:sc= -11.4! C(o=-11!,f=-13!) USER MOD Single : A 128 ASN : amide:sc= -0.0158 X(o=-0.016,f=-0.2) USER MOD Single : A 135 ASN : amide:sc=-0.000607 X(o=-0.00061,f=-0.031) USER MOD Single : A 144 SER OG : rot 180:sc= 0 USER MOD Single : A 148 LYS NZ :NH3+ -163:sc= 0 (180deg=-0.301) USER MOD Single : A 150 SER OG : rot 180:sc= 0 USER MOD Single : A 151 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 1 N GLY A 1 -9.157 -22.241 -2.555 1.00 21.41 N ATOM 2 CA GLY A 1 -8.428 -22.916 -3.641 1.00 72.41 C ATOM 3 C GLY A 1 -6.988 -22.442 -3.699 1.00 24.00 C ATOM 4 O GLY A 1 -6.092 -23.108 -3.176 1.00 22.12 O ATOM 0 H1 GLY A 1 -10.140 -22.580 -2.533 1.00 21.41 H new ATOM 0 H2 GLY A 1 -8.698 -22.451 -1.646 1.00 21.41 H new ATOM 0 H3 GLY A 1 -9.149 -21.214 -2.717 1.00 21.41 H new ATOM 0 HA2 GLY A 1 -8.455 -23.995 -3.487 1.00 72.41 H new ATOM 0 HA3 GLY A 1 -8.920 -22.717 -4.593 1.00 72.41 H new ATOM 8 N MET A 2 -6.751 -21.285 -4.319 1.00 13.54 N ATOM 9 CA MET A 2 -5.491 -20.560 -4.300 1.00 35.22 C ATOM 10 C MET A 2 -5.857 -19.096 -4.034 1.00 20.41 C ATOM 11 O MET A 2 -5.925 -18.288 -4.959 1.00 0.21 O ATOM 12 CB MET A 2 -4.712 -20.745 -5.619 1.00 13.43 C ATOM 13 CG MET A 2 -3.986 -22.083 -5.799 1.00 44.11 C ATOM 14 SD MET A 2 -4.969 -23.478 -6.414 1.00 72.03 S ATOM 15 CE MET A 2 -3.603 -24.554 -6.941 1.00 75.14 C ATOM 0 H MET A 2 -7.467 -20.812 -4.871 1.00 13.54 H new ATOM 0 HA MET A 2 -4.821 -20.935 -3.526 1.00 35.22 H new ATOM 0 HB2 MET A 2 -5.409 -20.620 -6.448 1.00 13.43 H new ATOM 0 HB3 MET A 2 -3.977 -19.944 -5.697 1.00 13.43 H new ATOM 0 HG2 MET A 2 -3.153 -21.927 -6.485 1.00 44.11 H new ATOM 0 HG3 MET A 2 -3.558 -22.368 -4.838 1.00 44.11 H new ATOM 0 HE1 MET A 2 -4.007 -25.478 -7.355 1.00 75.14 H new ATOM 0 HE2 MET A 2 -3.011 -24.044 -7.701 1.00 75.14 H new ATOM 0 HE3 MET A 2 -2.971 -24.786 -6.084 1.00 75.14 H new ATOM 23 N ALA A 3 -6.110 -18.755 -2.770 1.00 2.40 N ATOM 24 CA ALA A 3 -6.556 -17.439 -2.318 1.00 13.20 C ATOM 25 C ALA A 3 -5.507 -16.909 -1.340 1.00 44.32 C ATOM 26 O ALA A 3 -5.755 -16.866 -0.137 1.00 0.21 O ATOM 27 CB ALA A 3 -7.955 -17.554 -1.686 1.00 1.53 C ATOM 0 H ALA A 3 -6.005 -19.417 -2.001 1.00 2.40 H new ATOM 0 HA ALA A 3 -6.648 -16.736 -3.146 1.00 13.20 H new ATOM 0 HB1 ALA A 3 -8.284 -16.571 -1.350 1.00 1.53 H new ATOM 0 HB2 ALA A 3 -8.658 -17.939 -2.425 1.00 1.53 H new ATOM 0 HB3 ALA A 3 -7.915 -18.234 -0.835 1.00 1.53 H new ATOM 33 N LYS A 4 -4.318 -16.585 -1.863 1.00 62.43 N ATOM 34 CA LYS A 4 -3.131 -16.207 -1.080 1.00 15.43 C ATOM 35 C LYS A 4 -2.063 -15.434 -1.865 1.00 2.52 C ATOM 36 O LYS A 4 -0.872 -15.567 -1.588 1.00 61.23 O ATOM 37 CB LYS A 4 -2.565 -17.427 -0.334 1.00 61.04 C ATOM 38 CG LYS A 4 -1.778 -18.491 -1.118 1.00 0.32 C ATOM 39 CD LYS A 4 -2.490 -19.106 -2.326 1.00 41.41 C ATOM 40 CE LYS A 4 -2.304 -18.345 -3.643 1.00 33.11 C ATOM 41 NZ LYS A 4 -0.902 -18.323 -4.085 1.00 35.22 N ATOM 0 H LYS A 4 -4.149 -16.578 -2.869 1.00 62.43 H new ATOM 0 HA LYS A 4 -3.472 -15.483 -0.340 1.00 15.43 H new ATOM 0 HB2 LYS A 4 -1.914 -17.054 0.456 1.00 61.04 H new ATOM 0 HB3 LYS A 4 -3.401 -17.930 0.152 1.00 61.04 H new ATOM 0 HG2 LYS A 4 -0.846 -18.043 -1.462 1.00 0.32 H new ATOM 0 HG3 LYS A 4 -1.512 -19.295 -0.432 1.00 0.32 H new ATOM 0 HD2 LYS A 4 -2.131 -20.127 -2.460 1.00 41.41 H new ATOM 0 HD3 LYS A 4 -3.556 -19.169 -2.107 1.00 41.41 H new ATOM 0 HE2 LYS A 4 -2.918 -18.807 -4.416 1.00 33.11 H new ATOM 0 HE3 LYS A 4 -2.660 -17.322 -3.522 1.00 33.11 H new ATOM 0 HZ1 LYS A 4 -0.860 -18.079 -5.095 1.00 35.22 H new ATOM 0 HZ2 LYS A 4 -0.376 -17.614 -3.536 1.00 35.22 H new ATOM 0 HZ3 LYS A 4 -0.477 -19.260 -3.937 1.00 35.22 H new ATOM 51 N LYS A 5 -2.443 -14.713 -2.925 1.00 20.12 N ATOM 52 CA LYS A 5 -1.507 -13.827 -3.647 1.00 23.32 C ATOM 53 C LYS A 5 -0.974 -12.745 -2.703 1.00 73.15 C ATOM 54 O LYS A 5 -1.445 -12.594 -1.572 1.00 55.11 O ATOM 55 CB LYS A 5 -2.223 -13.191 -4.858 1.00 1.11 C ATOM 56 CG LYS A 5 -2.278 -14.059 -6.119 1.00 15.40 C ATOM 57 CD LYS A 5 -0.958 -14.108 -6.917 1.00 71.04 C ATOM 58 CE LYS A 5 -1.123 -14.428 -8.414 1.00 41.11 C ATOM 59 NZ LYS A 5 -1.759 -13.344 -9.208 1.00 4.14 N ATOM 0 H LYS A 5 -3.389 -14.721 -3.306 1.00 20.12 H new ATOM 0 HA LYS A 5 -0.662 -14.412 -4.009 1.00 23.32 H new ATOM 0 HB2 LYS A 5 -3.243 -12.940 -4.565 1.00 1.11 H new ATOM 0 HB3 LYS A 5 -1.723 -12.254 -5.104 1.00 1.11 H new ATOM 0 HG2 LYS A 5 -2.554 -15.074 -5.835 1.00 15.40 H new ATOM 0 HG3 LYS A 5 -3.068 -13.684 -6.770 1.00 15.40 H new ATOM 0 HD2 LYS A 5 -0.454 -13.147 -6.818 1.00 71.04 H new ATOM 0 HD3 LYS A 5 -0.306 -14.858 -6.469 1.00 71.04 H new ATOM 0 HE2 LYS A 5 -0.142 -14.644 -8.837 1.00 41.11 H new ATOM 0 HE3 LYS A 5 -1.720 -15.334 -8.516 1.00 41.11 H new ATOM 0 HZ1 LYS A 5 -1.941 -13.682 -10.174 1.00 4.14 H new ATOM 0 HZ2 LYS A 5 -2.658 -13.069 -8.763 1.00 4.14 H new ATOM 0 HZ3 LYS A 5 -1.124 -12.521 -9.243 1.00 4.14 H new ATOM 69 N THR A 6 -0.072 -11.899 -3.195 1.00 1.50 N ATOM 70 CA THR A 6 0.396 -10.719 -2.474 1.00 72.10 C ATOM 71 C THR A 6 0.632 -9.592 -3.479 1.00 13.44 C ATOM 72 O THR A 6 1.613 -9.594 -4.221 1.00 44.52 O ATOM 73 CB THR A 6 1.626 -11.088 -1.636 1.00 55.32 C ATOM 74 OG1 THR A 6 1.384 -12.220 -0.821 1.00 12.21 O ATOM 75 CG2 THR A 6 2.109 -9.911 -0.792 1.00 3.31 C ATOM 0 H THR A 6 0.358 -12.015 -4.113 1.00 1.50 H new ATOM 0 HA THR A 6 -0.348 -10.354 -1.766 1.00 72.10 H new ATOM 0 HB THR A 6 2.419 -11.344 -2.339 1.00 55.32 H new ATOM 0 HG1 THR A 6 2.189 -12.428 -0.302 1.00 12.21 H new ATOM 0 HG21 THR A 6 2.982 -10.213 -0.213 1.00 3.31 H new ATOM 0 HG22 THR A 6 2.376 -9.080 -1.445 1.00 3.31 H new ATOM 0 HG23 THR A 6 1.314 -9.599 -0.115 1.00 3.31 H new ATOM 83 N LEU A 7 -0.345 -8.708 -3.660 1.00 13.22 N ATOM 84 CA LEU A 7 -0.243 -7.645 -4.649 1.00 32.01 C ATOM 85 C LEU A 7 0.611 -6.538 -4.058 1.00 12.34 C ATOM 86 O LEU A 7 0.257 -5.970 -3.023 1.00 15.54 O ATOM 87 CB LEU A 7 -1.628 -7.128 -5.014 1.00 14.52 C ATOM 88 CG LEU A 7 -1.643 -6.053 -6.115 1.00 40.23 C ATOM 89 CD1 LEU A 7 -0.999 -6.514 -7.430 1.00 62.43 C ATOM 90 CD2 LEU A 7 -3.095 -5.650 -6.389 1.00 74.02 C ATOM 0 H LEU A 7 -1.218 -8.709 -3.132 1.00 13.22 H new ATOM 0 HA LEU A 7 0.217 -8.018 -5.564 1.00 32.01 H new ATOM 0 HB2 LEU A 7 -2.241 -7.969 -5.338 1.00 14.52 H new ATOM 0 HB3 LEU A 7 -2.096 -6.718 -4.119 1.00 14.52 H new ATOM 0 HG LEU A 7 -1.051 -5.214 -5.750 1.00 40.23 H new ATOM 0 HD11 LEU A 7 -1.045 -5.706 -8.160 1.00 62.43 H new ATOM 0 HD12 LEU A 7 0.042 -6.782 -7.251 1.00 62.43 H new ATOM 0 HD13 LEU A 7 -1.536 -7.381 -7.814 1.00 62.43 H new ATOM 0 HD21 LEU A 7 -3.120 -4.888 -7.168 1.00 74.02 H new ATOM 0 HD22 LEU A 7 -3.659 -6.523 -6.717 1.00 74.02 H new ATOM 0 HD23 LEU A 7 -3.540 -5.252 -5.477 1.00 74.02 H new ATOM 101 N ILE A 8 1.741 -6.258 -4.688 1.00 23.21 N ATOM 102 CA ILE A 8 2.591 -5.147 -4.282 1.00 71.12 C ATOM 103 C ILE A 8 2.182 -3.939 -5.131 1.00 42.52 C ATOM 104 O ILE A 8 2.116 -4.049 -6.357 1.00 41.20 O ATOM 105 CB ILE A 8 4.064 -5.565 -4.442 1.00 62.01 C ATOM 106 CG1 ILE A 8 4.402 -6.729 -3.472 1.00 35.32 C ATOM 107 CG2 ILE A 8 5.004 -4.367 -4.214 1.00 11.51 C ATOM 108 CD1 ILE A 8 5.423 -7.720 -4.043 1.00 2.42 C ATOM 0 H ILE A 8 2.093 -6.787 -5.486 1.00 23.21 H new ATOM 0 HA ILE A 8 2.472 -4.872 -3.234 1.00 71.12 H new ATOM 0 HB ILE A 8 4.214 -5.914 -5.464 1.00 62.01 H new ATOM 0 HG12 ILE A 8 4.790 -6.315 -2.541 1.00 35.32 H new ATOM 0 HG13 ILE A 8 3.485 -7.265 -3.226 1.00 35.32 H new ATOM 0 HG21 ILE A 8 6.039 -4.689 -4.333 1.00 11.51 H new ATOM 0 HG22 ILE A 8 4.781 -3.586 -4.941 1.00 11.51 H new ATOM 0 HG23 ILE A 8 4.859 -3.977 -3.207 1.00 11.51 H new ATOM 0 HD11 ILE A 8 5.613 -8.507 -3.314 1.00 2.42 H new ATOM 0 HD12 ILE A 8 5.029 -8.161 -4.959 1.00 2.42 H new ATOM 0 HD13 ILE A 8 6.354 -7.197 -4.263 1.00 2.42 H new ATOM 119 N LEU A 9 1.910 -2.800 -4.480 1.00 75.13 N ATOM 120 CA LEU A 9 1.525 -1.528 -5.088 1.00 4.14 C ATOM 121 C LEU A 9 2.363 -0.411 -4.466 1.00 32.11 C ATOM 122 O LEU A 9 1.910 0.282 -3.562 1.00 13.25 O ATOM 123 CB LEU A 9 0.029 -1.239 -4.845 1.00 51.33 C ATOM 124 CG LEU A 9 -0.956 -2.263 -5.422 1.00 75.03 C ATOM 125 CD1 LEU A 9 -2.376 -1.950 -4.955 1.00 15.54 C ATOM 126 CD2 LEU A 9 -0.910 -2.303 -6.954 1.00 22.40 C ATOM 0 H LEU A 9 1.956 -2.743 -3.463 1.00 75.13 H new ATOM 0 HA LEU A 9 1.698 -1.580 -6.163 1.00 4.14 H new ATOM 0 HB2 LEU A 9 -0.137 -1.170 -3.770 1.00 51.33 H new ATOM 0 HB3 LEU A 9 -0.205 -0.262 -5.267 1.00 51.33 H new ATOM 0 HG LEU A 9 -0.657 -3.245 -5.054 1.00 75.03 H new ATOM 0 HD11 LEU A 9 -3.066 -2.684 -5.371 1.00 15.54 H new ATOM 0 HD12 LEU A 9 -2.418 -1.989 -3.867 1.00 15.54 H new ATOM 0 HD13 LEU A 9 -2.659 -0.953 -5.293 1.00 15.54 H new ATOM 0 HD21 LEU A 9 -1.623 -3.042 -7.320 1.00 22.40 H new ATOM 0 HD22 LEU A 9 -1.168 -1.321 -7.352 1.00 22.40 H new ATOM 0 HD23 LEU A 9 0.094 -2.575 -7.281 1.00 22.40 H new ATOM 137 N TYR A 10 3.613 -0.234 -4.888 1.00 33.33 N ATOM 138 CA TYR A 10 4.474 0.795 -4.295 1.00 1.13 C ATOM 139 C TYR A 10 4.574 1.993 -5.248 1.00 11.55 C ATOM 140 O TYR A 10 4.792 1.822 -6.451 1.00 71.02 O ATOM 141 CB TYR A 10 5.851 0.228 -3.904 1.00 33.43 C ATOM 142 CG TYR A 10 5.993 -0.549 -2.589 1.00 72.44 C ATOM 143 CD1 TYR A 10 4.892 -1.178 -1.978 1.00 0.35 C ATOM 144 CD2 TYR A 10 7.251 -0.634 -1.945 1.00 24.21 C ATOM 145 CE1 TYR A 10 5.034 -1.837 -0.746 1.00 4.33 C ATOM 146 CE2 TYR A 10 7.402 -1.303 -0.718 1.00 4.52 C ATOM 147 CZ TYR A 10 6.286 -1.906 -0.107 1.00 32.45 C ATOM 148 OH TYR A 10 6.410 -2.592 1.066 1.00 13.53 O ATOM 0 H TYR A 10 4.051 -0.781 -5.629 1.00 33.33 H new ATOM 0 HA TYR A 10 4.025 1.143 -3.365 1.00 1.13 H new ATOM 0 HB2 TYR A 10 6.177 -0.429 -4.710 1.00 33.43 H new ATOM 0 HB3 TYR A 10 6.552 1.062 -3.870 1.00 33.43 H new ATOM 0 HD1 TYR A 10 3.927 -1.154 -2.462 1.00 0.35 H new ATOM 0 HD2 TYR A 10 8.113 -0.175 -2.406 1.00 24.21 H new ATOM 0 HE1 TYR A 10 4.173 -2.296 -0.284 1.00 4.33 H new ATOM 0 HE2 TYR A 10 8.372 -1.354 -0.245 1.00 4.52 H new ATOM 0 HH TYR A 10 7.338 -2.544 1.376 1.00 13.53 H new ATOM 157 N TYR A 11 4.427 3.215 -4.723 1.00 21.15 N ATOM 158 CA TYR A 11 4.781 4.447 -5.419 1.00 71.31 C ATOM 159 C TYR A 11 6.276 4.679 -5.204 1.00 74.42 C ATOM 160 O TYR A 11 6.689 5.050 -4.103 1.00 4.25 O ATOM 161 CB TYR A 11 3.956 5.651 -4.935 1.00 42.53 C ATOM 162 CG TYR A 11 4.329 7.008 -5.536 1.00 53.32 C ATOM 163 CD1 TYR A 11 4.853 7.129 -6.844 1.00 3.32 C ATOM 164 CD2 TYR A 11 4.125 8.178 -4.778 1.00 51.51 C ATOM 165 CE1 TYR A 11 5.150 8.391 -7.392 1.00 40.10 C ATOM 166 CE2 TYR A 11 4.425 9.441 -5.317 1.00 14.43 C ATOM 167 CZ TYR A 11 4.925 9.558 -6.631 1.00 35.35 C ATOM 168 OH TYR A 11 5.172 10.799 -7.127 1.00 31.42 O ATOM 0 H TYR A 11 4.052 3.373 -3.788 1.00 21.15 H new ATOM 0 HA TYR A 11 4.554 4.344 -6.480 1.00 71.31 H new ATOM 0 HB2 TYR A 11 2.906 5.457 -5.152 1.00 42.53 H new ATOM 0 HB3 TYR A 11 4.050 5.718 -3.851 1.00 42.53 H new ATOM 0 HD1 TYR A 11 5.028 6.240 -7.431 1.00 3.32 H new ATOM 0 HD2 TYR A 11 3.735 8.104 -3.774 1.00 51.51 H new ATOM 0 HE1 TYR A 11 5.549 8.466 -8.393 1.00 40.10 H new ATOM 0 HE2 TYR A 11 4.272 10.328 -4.721 1.00 14.43 H new ATOM 0 HH TYR A 11 5.933 11.195 -6.653 1.00 31.42 H new ATOM 177 N SER A 12 7.107 4.422 -6.215 1.00 20.42 N ATOM 178 CA SER A 12 8.501 4.839 -6.187 1.00 71.42 C ATOM 179 C SER A 12 8.543 6.366 -6.234 1.00 43.40 C ATOM 180 O SER A 12 8.219 6.945 -7.272 1.00 14.31 O ATOM 181 CB SER A 12 9.284 4.166 -7.323 1.00 2.11 C ATOM 182 OG SER A 12 8.818 4.429 -8.632 1.00 14.12 O ATOM 0 H SER A 12 6.834 3.926 -7.063 1.00 20.42 H new ATOM 0 HA SER A 12 8.991 4.520 -5.267 1.00 71.42 H new ATOM 0 HB2 SER A 12 10.325 4.482 -7.258 1.00 2.11 H new ATOM 0 HB3 SER A 12 9.267 3.088 -7.161 1.00 2.11 H new ATOM 0 HG SER A 12 8.467 5.343 -8.677 1.00 14.12 H new ATOM 187 N TRP A 13 8.897 7.025 -5.125 1.00 40.23 N ATOM 188 CA TRP A 13 9.031 8.476 -5.138 1.00 11.14 C ATOM 189 C TRP A 13 10.356 8.851 -5.812 1.00 34.53 C ATOM 190 O TRP A 13 10.444 8.897 -7.035 1.00 3.32 O ATOM 191 CB TRP A 13 8.895 9.026 -3.728 1.00 51.33 C ATOM 192 CG TRP A 13 9.106 10.508 -3.578 1.00 35.35 C ATOM 193 CD1 TRP A 13 9.786 11.111 -2.574 1.00 1.11 C ATOM 194 CD2 TRP A 13 8.692 11.587 -4.472 1.00 73.30 C ATOM 195 NE1 TRP A 13 9.814 12.474 -2.783 1.00 42.32 N ATOM 196 CE2 TRP A 13 9.218 12.813 -3.973 1.00 1.12 C ATOM 197 CE3 TRP A 13 7.979 11.657 -5.687 1.00 60.21 C ATOM 198 CZ2 TRP A 13 9.096 14.018 -4.676 1.00 54.13 C ATOM 199 CZ3 TRP A 13 7.827 12.865 -6.383 1.00 44.40 C ATOM 200 CH2 TRP A 13 8.397 14.047 -5.890 1.00 74.02 C ATOM 0 H TRP A 13 9.091 6.583 -4.227 1.00 40.23 H new ATOM 0 HA TRP A 13 8.231 8.932 -5.721 1.00 11.14 H new ATOM 0 HB2 TRP A 13 7.900 8.781 -3.358 1.00 51.33 H new ATOM 0 HB3 TRP A 13 9.610 8.510 -3.087 1.00 51.33 H new ATOM 0 HD1 TRP A 13 10.238 10.601 -1.736 1.00 1.11 H new ATOM 0 HE1 TRP A 13 10.226 13.146 -2.135 1.00 42.32 H new ATOM 0 HE3 TRP A 13 7.539 10.758 -6.092 1.00 60.21 H new ATOM 0 HZ2 TRP A 13 9.539 14.922 -4.284 1.00 54.13 H new ATOM 0 HZ3 TRP A 13 7.266 12.885 -7.306 1.00 44.40 H new ATOM 0 HH2 TRP A 13 8.298 14.971 -6.441 1.00 74.02 H new ATOM 210 N SER A 14 11.443 8.899 -5.038 1.00 20.01 N ATOM 211 CA SER A 14 12.780 9.227 -5.523 1.00 71.12 C ATOM 212 C SER A 14 13.616 7.953 -5.690 1.00 24.31 C ATOM 213 O SER A 14 14.785 7.891 -5.306 1.00 53.22 O ATOM 214 CB SER A 14 13.430 10.226 -4.564 1.00 4.53 C ATOM 215 OG SER A 14 12.553 11.256 -4.153 1.00 63.10 O ATOM 0 H SER A 14 11.415 8.707 -4.037 1.00 20.01 H new ATOM 0 HA SER A 14 12.717 9.693 -6.506 1.00 71.12 H new ATOM 0 HB2 SER A 14 13.791 9.693 -3.685 1.00 4.53 H new ATOM 0 HB3 SER A 14 14.300 10.670 -5.047 1.00 4.53 H new ATOM 0 HG SER A 14 11.844 10.878 -3.592 1.00 63.10 H new ATOM 220 N GLY A 15 12.984 6.872 -6.149 1.00 15.23 N ATOM 221 CA GLY A 15 13.605 5.561 -6.313 1.00 35.41 C ATOM 222 C GLY A 15 13.732 4.767 -5.013 1.00 73.43 C ATOM 223 O GLY A 15 13.946 3.561 -5.052 1.00 14.45 O ATOM 0 H GLY A 15 12.002 6.886 -6.423 1.00 15.23 H new ATOM 0 HA2 GLY A 15 13.020 4.980 -7.026 1.00 35.41 H new ATOM 0 HA3 GLY A 15 14.597 5.692 -6.746 1.00 35.41 H new ATOM 227 N GLU A 16 13.545 5.393 -3.854 1.00 35.14 N ATOM 228 CA GLU A 16 13.874 4.780 -2.564 1.00 0.11 C ATOM 229 C GLU A 16 12.821 3.707 -2.259 1.00 33.25 C ATOM 230 O GLU A 16 13.130 2.536 -2.036 1.00 20.34 O ATOM 231 CB GLU A 16 13.985 5.864 -1.473 1.00 11.41 C ATOM 232 CG GLU A 16 14.815 7.075 -1.941 1.00 13.53 C ATOM 233 CD GLU A 16 15.061 8.107 -0.844 1.00 40.52 C ATOM 234 OE1 GLU A 16 15.858 7.827 0.070 1.00 3.23 O ATOM 235 OE2 GLU A 16 14.452 9.207 -0.935 1.00 74.02 O ATOM 0 H GLU A 16 13.163 6.336 -3.779 1.00 35.14 H new ATOM 0 HA GLU A 16 14.847 4.291 -2.594 1.00 0.11 H new ATOM 0 HB2 GLU A 16 12.986 6.197 -1.191 1.00 11.41 H new ATOM 0 HB3 GLU A 16 14.442 5.435 -0.581 1.00 11.41 H new ATOM 0 HG2 GLU A 16 15.775 6.723 -2.319 1.00 13.53 H new ATOM 0 HG3 GLU A 16 14.302 7.557 -2.773 1.00 13.53 H new ATOM 240 N THR A 17 11.546 4.076 -2.390 1.00 51.44 N ATOM 241 CA THR A 17 10.436 3.131 -2.368 1.00 41.24 C ATOM 242 C THR A 17 10.420 2.207 -3.610 1.00 35.41 C ATOM 243 O THR A 17 9.735 1.189 -3.575 1.00 21.22 O ATOM 244 CB THR A 17 9.132 3.926 -2.144 1.00 42.41 C ATOM 245 OG1 THR A 17 9.240 4.685 -0.959 1.00 64.01 O ATOM 246 CG2 THR A 17 7.883 3.067 -1.982 1.00 52.10 C ATOM 0 H THR A 17 11.256 5.046 -2.515 1.00 51.44 H new ATOM 0 HA THR A 17 10.552 2.433 -1.539 1.00 41.24 H new ATOM 0 HB THR A 17 9.018 4.533 -3.042 1.00 42.41 H new ATOM 0 HG1 THR A 17 8.413 5.191 -0.818 1.00 64.01 H new ATOM 0 HG21 THR A 17 7.016 3.710 -1.829 1.00 52.10 H new ATOM 0 HG22 THR A 17 7.736 2.466 -2.880 1.00 52.10 H new ATOM 0 HG23 THR A 17 8.003 2.409 -1.121 1.00 52.10 H new ATOM 254 N LYS A 18 11.190 2.471 -4.683 1.00 21.43 N ATOM 255 CA LYS A 18 11.405 1.451 -5.725 1.00 53.40 C ATOM 256 C LYS A 18 12.246 0.338 -5.118 1.00 64.11 C ATOM 257 O LYS A 18 11.895 -0.835 -5.197 1.00 40.30 O ATOM 258 CB LYS A 18 12.131 1.999 -6.974 1.00 75.23 C ATOM 259 CG LYS A 18 11.876 1.147 -8.229 1.00 15.02 C ATOM 260 CD LYS A 18 12.978 1.344 -9.285 1.00 0.11 C ATOM 261 CE LYS A 18 14.169 0.402 -9.039 1.00 35.41 C ATOM 262 NZ LYS A 18 15.382 0.843 -9.760 1.00 52.12 N ATOM 0 H LYS A 18 11.663 3.359 -4.849 1.00 21.43 H new ATOM 0 HA LYS A 18 10.428 1.100 -6.057 1.00 53.40 H new ATOM 0 HB2 LYS A 18 11.803 3.021 -7.161 1.00 75.23 H new ATOM 0 HB3 LYS A 18 13.203 2.039 -6.778 1.00 75.23 H new ATOM 0 HG2 LYS A 18 11.824 0.095 -7.950 1.00 15.02 H new ATOM 0 HG3 LYS A 18 10.910 1.411 -8.658 1.00 15.02 H new ATOM 0 HD2 LYS A 18 12.568 1.162 -10.278 1.00 0.11 H new ATOM 0 HD3 LYS A 18 13.321 2.378 -9.266 1.00 0.11 H new ATOM 0 HE2 LYS A 18 14.379 0.355 -7.971 1.00 35.41 H new ATOM 0 HE3 LYS A 18 13.905 -0.607 -9.357 1.00 35.41 H new ATOM 0 HZ1 LYS A 18 16.160 0.181 -9.567 1.00 52.12 H new ATOM 0 HZ2 LYS A 18 15.190 0.864 -10.782 1.00 52.12 H new ATOM 0 HZ3 LYS A 18 15.650 1.795 -9.439 1.00 52.12 H new ATOM 272 N LYS A 19 13.381 0.729 -4.532 1.00 13.15 N ATOM 273 CA LYS A 19 14.422 -0.160 -4.049 1.00 61.12 C ATOM 274 C LYS A 19 13.824 -1.222 -3.138 1.00 72.30 C ATOM 275 O LYS A 19 14.066 -2.407 -3.366 1.00 61.31 O ATOM 276 CB LYS A 19 15.535 0.690 -3.391 1.00 55.02 C ATOM 277 CG LYS A 19 16.913 0.446 -4.025 1.00 54.20 C ATOM 278 CD LYS A 19 17.698 -0.622 -3.261 1.00 53.23 C ATOM 279 CE LYS A 19 18.904 -1.137 -4.051 1.00 3.22 C ATOM 280 NZ LYS A 19 18.541 -2.093 -5.120 1.00 24.22 N ATOM 0 H LYS A 19 13.601 1.713 -4.379 1.00 13.15 H new ATOM 0 HA LYS A 19 14.885 -0.710 -4.868 1.00 61.12 H new ATOM 0 HB2 LYS A 19 15.280 1.746 -3.478 1.00 55.02 H new ATOM 0 HB3 LYS A 19 15.582 0.460 -2.327 1.00 55.02 H new ATOM 0 HG2 LYS A 19 16.788 0.135 -5.062 1.00 54.20 H new ATOM 0 HG3 LYS A 19 17.480 1.377 -4.037 1.00 54.20 H new ATOM 0 HD2 LYS A 19 18.039 -0.209 -2.312 1.00 53.23 H new ATOM 0 HD3 LYS A 19 17.037 -1.457 -3.027 1.00 53.23 H new ATOM 0 HE2 LYS A 19 19.428 -0.290 -4.494 1.00 3.22 H new ATOM 0 HE3 LYS A 19 19.600 -1.618 -3.364 1.00 3.22 H new ATOM 0 HZ1 LYS A 19 19.401 -2.403 -5.616 1.00 24.22 H new ATOM 0 HZ2 LYS A 19 18.067 -2.918 -4.701 1.00 24.22 H new ATOM 0 HZ3 LYS A 19 17.900 -1.631 -5.796 1.00 24.22 H new ATOM 290 N MET A 20 13.008 -0.839 -2.156 1.00 61.00 N ATOM 291 CA MET A 20 12.473 -1.836 -1.237 1.00 54.33 C ATOM 292 C MET A 20 11.500 -2.834 -1.879 1.00 64.31 C ATOM 293 O MET A 20 11.379 -3.950 -1.389 1.00 15.55 O ATOM 294 CB MET A 20 11.817 -1.117 -0.052 1.00 24.11 C ATOM 295 CG MET A 20 12.150 -1.857 1.239 1.00 23.14 C ATOM 296 SD MET A 20 13.924 -2.027 1.605 1.00 42.30 S ATOM 297 CE MET A 20 14.412 -0.298 1.729 1.00 44.31 C ATOM 0 H MET A 20 12.712 0.121 -1.981 1.00 61.00 H new ATOM 0 HA MET A 20 13.314 -2.444 -0.903 1.00 54.33 H new ATOM 0 HB2 MET A 20 12.172 -0.088 0.004 1.00 24.11 H new ATOM 0 HB3 MET A 20 10.737 -1.075 -0.191 1.00 24.11 H new ATOM 0 HG2 MET A 20 11.673 -1.337 2.070 1.00 23.14 H new ATOM 0 HG3 MET A 20 11.709 -2.853 1.191 1.00 23.14 H new ATOM 0 HE1 MET A 20 15.433 -0.234 2.106 1.00 44.31 H new ATOM 0 HE2 MET A 20 14.359 0.167 0.744 1.00 44.31 H new ATOM 0 HE3 MET A 20 13.740 0.222 2.412 1.00 44.31 H new ATOM 305 N ALA A 21 10.827 -2.474 -2.973 1.00 3.45 N ATOM 306 CA ALA A 21 9.814 -3.335 -3.577 1.00 2.54 C ATOM 307 C ALA A 21 10.489 -4.561 -4.188 1.00 54.11 C ATOM 308 O ALA A 21 9.983 -5.681 -4.130 1.00 12.25 O ATOM 309 CB ALA A 21 9.035 -2.559 -4.647 1.00 55.20 C ATOM 0 H ALA A 21 10.967 -1.588 -3.459 1.00 3.45 H new ATOM 0 HA ALA A 21 9.111 -3.663 -2.811 1.00 2.54 H new ATOM 0 HB1 ALA A 21 8.282 -3.209 -5.092 1.00 55.20 H new ATOM 0 HB2 ALA A 21 8.547 -1.699 -4.189 1.00 55.20 H new ATOM 0 HB3 ALA A 21 9.722 -2.217 -5.421 1.00 55.20 H new ATOM 315 N GLU A 22 11.664 -4.346 -4.781 1.00 3.15 N ATOM 316 CA GLU A 22 12.348 -5.386 -5.525 1.00 60.54 C ATOM 317 C GLU A 22 12.832 -6.502 -4.590 1.00 24.52 C ATOM 318 O GLU A 22 12.815 -7.679 -4.951 1.00 0.12 O ATOM 319 CB GLU A 22 13.543 -4.808 -6.287 1.00 73.32 C ATOM 320 CG GLU A 22 13.234 -3.588 -7.170 1.00 3.02 C ATOM 321 CD GLU A 22 14.533 -2.904 -7.589 1.00 33.52 C ATOM 322 OE1 GLU A 22 15.311 -2.464 -6.714 1.00 51.04 O ATOM 323 OE2 GLU A 22 14.852 -2.848 -8.803 1.00 3.32 O ATOM 0 H GLU A 22 12.158 -3.454 -4.756 1.00 3.15 H new ATOM 0 HA GLU A 22 11.636 -5.805 -6.237 1.00 60.54 H new ATOM 0 HB2 GLU A 22 14.311 -4.528 -5.566 1.00 73.32 H new ATOM 0 HB3 GLU A 22 13.966 -5.592 -6.915 1.00 73.32 H new ATOM 0 HG2 GLU A 22 12.676 -3.900 -8.053 1.00 3.02 H new ATOM 0 HG3 GLU A 22 12.603 -2.886 -6.626 1.00 3.02 H new ATOM 328 N LYS A 23 13.299 -6.142 -3.386 1.00 22.43 N ATOM 329 CA LYS A 23 13.700 -7.125 -2.385 1.00 21.24 C ATOM 330 C LYS A 23 12.464 -7.825 -1.846 1.00 15.14 C ATOM 331 O LYS A 23 12.432 -9.052 -1.873 1.00 3.55 O ATOM 332 CB LYS A 23 14.561 -6.506 -1.281 1.00 12.22 C ATOM 333 CG LYS A 23 14.812 -7.578 -0.201 1.00 52.23 C ATOM 334 CD LYS A 23 15.898 -7.204 0.808 1.00 23.35 C ATOM 335 CE LYS A 23 17.314 -7.509 0.322 1.00 11.33 C ATOM 336 NZ LYS A 23 17.596 -8.958 0.312 1.00 21.44 N ATOM 0 H LYS A 23 13.406 -5.173 -3.087 1.00 22.43 H new ATOM 0 HA LYS A 23 14.337 -7.873 -2.857 1.00 21.24 H new ATOM 0 HB2 LYS A 23 15.507 -6.152 -1.691 1.00 12.22 H new ATOM 0 HB3 LYS A 23 14.058 -5.641 -0.848 1.00 12.22 H new ATOM 0 HG2 LYS A 23 13.881 -7.763 0.335 1.00 52.23 H new ATOM 0 HG3 LYS A 23 15.090 -8.512 -0.689 1.00 52.23 H new ATOM 0 HD2 LYS A 23 15.821 -6.141 1.034 1.00 23.35 H new ATOM 0 HD3 LYS A 23 15.718 -7.742 1.739 1.00 23.35 H new ATOM 0 HE2 LYS A 23 17.447 -7.107 -0.682 1.00 11.33 H new ATOM 0 HE3 LYS A 23 18.035 -7.004 0.965 1.00 11.33 H new ATOM 0 HZ1 LYS A 23 18.607 -9.114 0.124 1.00 21.44 H new ATOM 0 HZ2 LYS A 23 17.349 -9.366 1.236 1.00 21.44 H new ATOM 0 HZ3 LYS A 23 17.031 -9.416 -0.431 1.00 21.44 H new ATOM 346 N ILE A 24 11.456 -7.091 -1.375 1.00 72.30 N ATOM 347 CA ILE A 24 10.313 -7.706 -0.709 1.00 15.24 C ATOM 348 C ILE A 24 9.604 -8.676 -1.669 1.00 0.55 C ATOM 349 O ILE A 24 9.228 -9.764 -1.241 1.00 2.25 O ATOM 350 CB ILE A 24 9.395 -6.623 -0.094 1.00 11.43 C ATOM 351 CG1 ILE A 24 10.149 -5.814 0.983 1.00 62.42 C ATOM 352 CG2 ILE A 24 8.129 -7.278 0.496 1.00 11.44 C ATOM 353 CD1 ILE A 24 9.397 -4.580 1.498 1.00 3.52 C ATOM 0 H ILE A 24 11.409 -6.074 -1.443 1.00 72.30 H new ATOM 0 HA ILE A 24 10.647 -8.311 0.134 1.00 15.24 H new ATOM 0 HB ILE A 24 9.094 -5.931 -0.881 1.00 11.43 H new ATOM 0 HG12 ILE A 24 10.365 -6.470 1.826 1.00 62.42 H new ATOM 0 HG13 ILE A 24 11.108 -5.495 0.574 1.00 62.42 H new ATOM 0 HG21 ILE A 24 7.488 -6.509 0.927 1.00 11.44 H new ATOM 0 HG22 ILE A 24 7.588 -7.800 -0.293 1.00 11.44 H new ATOM 0 HG23 ILE A 24 8.415 -7.988 1.272 1.00 11.44 H new ATOM 0 HD11 ILE A 24 10.001 -4.074 2.251 1.00 3.52 H new ATOM 0 HD12 ILE A 24 9.204 -3.899 0.669 1.00 3.52 H new ATOM 0 HD13 ILE A 24 8.450 -4.889 1.941 1.00 3.52 H new ATOM 364 N ASN A 25 9.499 -8.357 -2.967 1.00 61.41 N ATOM 365 CA ASN A 25 8.982 -9.281 -3.981 1.00 53.22 C ATOM 366 C ASN A 25 9.701 -10.639 -3.946 1.00 41.03 C ATOM 367 O ASN A 25 9.047 -11.676 -4.007 1.00 53.30 O ATOM 368 CB ASN A 25 9.090 -8.642 -5.377 1.00 14.14 C ATOM 369 CG ASN A 25 8.571 -9.531 -6.506 1.00 1.41 C ATOM 370 OD1 ASN A 25 9.278 -9.796 -7.478 1.00 1.04 O ATOM 371 ND2 ASN A 25 7.324 -9.966 -6.448 1.00 74.50 N ATOM 0 H ASN A 25 9.771 -7.448 -3.342 1.00 61.41 H new ATOM 0 HA ASN A 25 7.933 -9.472 -3.754 1.00 53.22 H new ATOM 0 HB2 ASN A 25 8.534 -7.705 -5.381 1.00 14.14 H new ATOM 0 HB3 ASN A 25 10.133 -8.394 -5.573 1.00 14.14 H new ATOM 0 HD21 ASN A 25 6.943 -10.525 -7.211 1.00 74.50 H new ATOM 0 HD22 ASN A 25 6.743 -9.743 -5.640 1.00 74.50 H new ATOM 377 N SER A 26 11.025 -10.639 -3.810 1.00 72.12 N ATOM 378 CA SER A 26 11.869 -11.829 -3.746 1.00 52.20 C ATOM 379 C SER A 26 11.516 -12.724 -2.547 1.00 75.31 C ATOM 380 O SER A 26 11.526 -13.950 -2.679 1.00 52.30 O ATOM 381 CB SER A 26 13.336 -11.369 -3.688 1.00 34.13 C ATOM 382 OG SER A 26 14.253 -12.359 -4.121 1.00 35.21 O ATOM 0 H SER A 26 11.561 -9.774 -3.738 1.00 72.12 H new ATOM 0 HA SER A 26 11.702 -12.439 -4.634 1.00 52.20 H new ATOM 0 HB2 SER A 26 13.455 -10.479 -4.306 1.00 34.13 H new ATOM 0 HB3 SER A 26 13.579 -11.082 -2.665 1.00 34.13 H new ATOM 0 HG SER A 26 15.166 -12.007 -4.063 1.00 35.21 H new ATOM 387 N GLU A 27 11.199 -12.134 -1.392 1.00 75.30 N ATOM 388 CA GLU A 27 11.003 -12.840 -0.121 1.00 24.24 C ATOM 389 C GLU A 27 9.633 -13.523 0.003 1.00 4.22 C ATOM 390 O GLU A 27 9.374 -14.241 0.978 1.00 44.14 O ATOM 391 CB GLU A 27 11.224 -11.840 1.033 1.00 75.11 C ATOM 392 CG GLU A 27 12.621 -11.965 1.649 1.00 21.45 C ATOM 393 CD GLU A 27 12.760 -13.201 2.546 1.00 35.15 C ATOM 394 OE1 GLU A 27 12.786 -14.343 2.036 1.00 32.01 O ATOM 395 OE2 GLU A 27 12.943 -13.040 3.775 1.00 73.33 O ATOM 0 H GLU A 27 11.068 -11.126 -1.312 1.00 75.30 H new ATOM 0 HA GLU A 27 11.731 -13.650 -0.076 1.00 24.24 H new ATOM 0 HB2 GLU A 27 11.082 -10.824 0.663 1.00 75.11 H new ATOM 0 HB3 GLU A 27 10.472 -12.007 1.805 1.00 75.11 H new ATOM 0 HG2 GLU A 27 13.363 -12.014 0.852 1.00 21.45 H new ATOM 0 HG3 GLU A 27 12.838 -11.070 2.233 1.00 21.45 H new ATOM 400 N ILE A 28 8.753 -13.315 -0.973 1.00 14.53 N ATOM 401 CA ILE A 28 7.385 -13.816 -0.996 1.00 64.30 C ATOM 402 C ILE A 28 7.344 -14.982 -2.000 1.00 40.44 C ATOM 403 O ILE A 28 8.276 -15.184 -2.790 1.00 0.23 O ATOM 404 CB ILE A 28 6.446 -12.616 -1.300 1.00 71.22 C ATOM 405 CG1 ILE A 28 6.536 -11.536 -0.187 1.00 75.41 C ATOM 406 CG2 ILE A 28 4.970 -13.030 -1.414 1.00 35.13 C ATOM 407 CD1 ILE A 28 6.005 -10.162 -0.615 1.00 21.04 C ATOM 0 H ILE A 28 8.985 -12.770 -1.803 1.00 14.53 H new ATOM 0 HA ILE A 28 7.034 -14.224 -0.048 1.00 64.30 H new ATOM 0 HB ILE A 28 6.786 -12.220 -2.257 1.00 71.22 H new ATOM 0 HG12 ILE A 28 5.976 -11.877 0.684 1.00 75.41 H new ATOM 0 HG13 ILE A 28 7.576 -11.433 0.123 1.00 75.41 H new ATOM 0 HG21 ILE A 28 4.361 -12.151 -1.627 1.00 35.13 H new ATOM 0 HG22 ILE A 28 4.857 -13.754 -2.221 1.00 35.13 H new ATOM 0 HG23 ILE A 28 4.644 -13.478 -0.475 1.00 35.13 H new ATOM 0 HD11 ILE A 28 6.101 -9.461 0.214 1.00 21.04 H new ATOM 0 HD12 ILE A 28 6.581 -9.798 -1.466 1.00 21.04 H new ATOM 0 HD13 ILE A 28 4.956 -10.249 -0.897 1.00 21.04 H new ATOM 418 N LYS A 29 6.276 -15.786 -1.976 1.00 74.12 N ATOM 419 CA LYS A 29 5.960 -16.755 -3.032 1.00 32.31 C ATOM 420 C LYS A 29 5.685 -16.034 -4.357 1.00 62.22 C ATOM 421 O LYS A 29 6.011 -14.863 -4.502 1.00 20.55 O ATOM 422 CB LYS A 29 4.780 -17.636 -2.586 1.00 43.44 C ATOM 423 CG LYS A 29 4.973 -19.091 -3.039 1.00 74.33 C ATOM 424 CD LYS A 29 3.664 -19.830 -3.348 1.00 51.12 C ATOM 425 CE LYS A 29 3.113 -19.395 -4.715 1.00 20.03 C ATOM 426 NZ LYS A 29 2.200 -20.387 -5.316 1.00 23.32 N ATOM 0 H LYS A 29 5.598 -15.783 -1.214 1.00 74.12 H new ATOM 0 HA LYS A 29 6.816 -17.408 -3.202 1.00 32.31 H new ATOM 0 HB2 LYS A 29 4.685 -17.599 -1.501 1.00 43.44 H new ATOM 0 HB3 LYS A 29 3.852 -17.243 -3.001 1.00 43.44 H new ATOM 0 HG2 LYS A 29 5.603 -19.103 -3.928 1.00 74.33 H new ATOM 0 HG3 LYS A 29 5.510 -19.634 -2.261 1.00 74.33 H new ATOM 0 HD2 LYS A 29 3.837 -20.906 -3.344 1.00 51.12 H new ATOM 0 HD3 LYS A 29 2.929 -19.622 -2.570 1.00 51.12 H new ATOM 0 HE2 LYS A 29 2.586 -18.447 -4.602 1.00 20.03 H new ATOM 0 HE3 LYS A 29 3.946 -19.218 -5.396 1.00 20.03 H new ATOM 0 HZ1 LYS A 29 1.863 -20.036 -6.235 1.00 23.32 H new ATOM 0 HZ2 LYS A 29 2.705 -21.286 -5.453 1.00 23.32 H new ATOM 0 HZ3 LYS A 29 1.388 -20.539 -4.684 1.00 23.32 H new ATOM 436 N ASP A 30 5.089 -16.720 -5.333 1.00 61.22 N ATOM 437 CA ASP A 30 4.599 -16.263 -6.630 1.00 13.03 C ATOM 438 C ASP A 30 3.456 -15.283 -6.398 1.00 13.24 C ATOM 439 O ASP A 30 2.260 -15.579 -6.480 1.00 15.20 O ATOM 440 CB ASP A 30 4.180 -17.421 -7.555 1.00 11.24 C ATOM 441 CG ASP A 30 3.319 -16.965 -8.748 1.00 40.11 C ATOM 442 OD1 ASP A 30 3.555 -15.881 -9.326 1.00 64.43 O ATOM 443 OD2 ASP A 30 2.346 -17.696 -9.064 1.00 20.14 O ATOM 0 H ASP A 30 4.920 -17.719 -5.219 1.00 61.22 H new ATOM 0 HA ASP A 30 5.414 -15.763 -7.153 1.00 13.03 H new ATOM 0 HB2 ASP A 30 5.074 -17.919 -7.930 1.00 11.24 H new ATOM 0 HB3 ASP A 30 3.624 -18.158 -6.975 1.00 11.24 H new ATOM 447 N SER A 31 3.909 -14.118 -6.000 1.00 20.12 N ATOM 448 CA SER A 31 3.193 -12.876 -5.872 1.00 13.34 C ATOM 449 C SER A 31 3.508 -11.964 -7.058 1.00 31.15 C ATOM 450 O SER A 31 4.128 -12.395 -8.033 1.00 1.12 O ATOM 451 CB SER A 31 3.479 -12.272 -4.503 1.00 13.32 C ATOM 452 OG SER A 31 4.665 -11.505 -4.402 1.00 15.15 O ATOM 0 H SER A 31 4.887 -14.008 -5.731 1.00 20.12 H new ATOM 0 HA SER A 31 2.115 -13.033 -5.913 1.00 13.34 H new ATOM 0 HB2 SER A 31 2.636 -11.641 -4.222 1.00 13.32 H new ATOM 0 HB3 SER A 31 3.529 -13.080 -3.774 1.00 13.32 H new ATOM 0 HG SER A 31 4.677 -11.033 -3.543 1.00 15.15 H new ATOM 457 N GLU A 32 3.033 -10.720 -7.007 1.00 62.54 N ATOM 458 CA GLU A 32 2.925 -9.841 -8.155 1.00 64.33 C ATOM 459 C GLU A 32 3.284 -8.440 -7.733 1.00 35.41 C ATOM 460 O GLU A 32 3.043 -8.026 -6.597 1.00 51.02 O ATOM 461 CB GLU A 32 1.484 -9.859 -8.659 1.00 71.52 C ATOM 462 CG GLU A 32 1.325 -9.673 -10.163 1.00 54.13 C ATOM 463 CD GLU A 32 -0.077 -10.064 -10.671 1.00 54.21 C ATOM 464 OE1 GLU A 32 -0.845 -10.776 -9.969 1.00 60.11 O ATOM 465 OE2 GLU A 32 -0.398 -9.655 -11.814 1.00 31.40 O ATOM 0 H GLU A 32 2.706 -10.291 -6.141 1.00 62.54 H new ATOM 0 HA GLU A 32 3.598 -10.173 -8.946 1.00 64.33 H new ATOM 0 HB2 GLU A 32 1.028 -10.807 -8.375 1.00 71.52 H new ATOM 0 HB3 GLU A 32 0.927 -9.072 -8.150 1.00 71.52 H new ATOM 0 HG2 GLU A 32 1.521 -8.631 -10.418 1.00 54.13 H new ATOM 0 HG3 GLU A 32 2.074 -10.274 -10.679 1.00 54.13 H new ATOM 470 N LEU A 33 3.793 -7.719 -8.708 1.00 12.24 N ATOM 471 CA LEU A 33 4.479 -6.456 -8.543 1.00 41.30 C ATOM 472 C LEU A 33 3.894 -5.505 -9.566 1.00 11.01 C ATOM 473 O LEU A 33 4.108 -5.675 -10.765 1.00 11.21 O ATOM 474 CB LEU A 33 5.994 -6.688 -8.696 1.00 2.12 C ATOM 475 CG LEU A 33 6.890 -5.448 -8.565 1.00 43.40 C ATOM 476 CD1 LEU A 33 6.746 -4.805 -7.184 1.00 4.34 C ATOM 477 CD2 LEU A 33 8.353 -5.872 -8.770 1.00 33.52 C ATOM 0 H LEU A 33 3.737 -8.011 -9.684 1.00 12.24 H new ATOM 0 HA LEU A 33 4.342 -6.016 -7.555 1.00 41.30 H new ATOM 0 HB2 LEU A 33 6.306 -7.416 -7.947 1.00 2.12 H new ATOM 0 HB3 LEU A 33 6.174 -7.138 -9.672 1.00 2.12 H new ATOM 0 HG LEU A 33 6.588 -4.719 -9.317 1.00 43.40 H new ATOM 0 HD11 LEU A 33 7.392 -3.930 -7.121 1.00 4.34 H new ATOM 0 HD12 LEU A 33 5.710 -4.503 -7.029 1.00 4.34 H new ATOM 0 HD13 LEU A 33 7.033 -5.524 -6.416 1.00 4.34 H new ATOM 0 HD21 LEU A 33 9.001 -5.000 -8.679 1.00 33.52 H new ATOM 0 HD22 LEU A 33 8.628 -6.608 -8.014 1.00 33.52 H new ATOM 0 HD23 LEU A 33 8.470 -6.309 -9.762 1.00 33.52 H new ATOM 488 N LYS A 34 3.109 -4.537 -9.094 1.00 23.41 N ATOM 489 CA LYS A 34 2.761 -3.371 -9.888 1.00 44.22 C ATOM 490 C LYS A 34 3.366 -2.165 -9.169 1.00 14.11 C ATOM 491 O LYS A 34 3.888 -2.265 -8.053 1.00 40.24 O ATOM 492 CB LYS A 34 1.242 -3.216 -10.091 1.00 15.43 C ATOM 493 CG LYS A 34 0.390 -4.486 -10.265 1.00 14.23 C ATOM 494 CD LYS A 34 0.608 -5.304 -11.549 1.00 21.10 C ATOM 495 CE LYS A 34 -0.738 -5.868 -12.051 1.00 52.42 C ATOM 496 NZ LYS A 34 -0.593 -7.045 -12.947 1.00 34.42 N ATOM 0 H LYS A 34 2.702 -4.543 -8.159 1.00 23.41 H new ATOM 0 HA LYS A 34 3.161 -3.470 -10.897 1.00 44.22 H new ATOM 0 HB2 LYS A 34 0.848 -2.667 -9.236 1.00 15.43 H new ATOM 0 HB3 LYS A 34 1.087 -2.590 -10.970 1.00 15.43 H new ATOM 0 HG2 LYS A 34 0.577 -5.139 -9.412 1.00 14.23 H new ATOM 0 HG3 LYS A 34 -0.660 -4.198 -10.222 1.00 14.23 H new ATOM 0 HD2 LYS A 34 1.058 -4.676 -12.318 1.00 21.10 H new ATOM 0 HD3 LYS A 34 1.304 -6.120 -11.356 1.00 21.10 H new ATOM 0 HE2 LYS A 34 -1.348 -6.149 -11.192 1.00 52.42 H new ATOM 0 HE3 LYS A 34 -1.276 -5.082 -12.581 1.00 52.42 H new ATOM 0 HZ1 LYS A 34 -1.418 -7.105 -13.578 1.00 34.42 H new ATOM 0 HZ2 LYS A 34 0.271 -6.944 -13.516 1.00 34.42 H new ATOM 0 HZ3 LYS A 34 -0.531 -7.911 -12.375 1.00 34.42 H new ATOM 506 N GLU A 35 3.252 -0.992 -9.771 1.00 74.11 N ATOM 507 CA GLU A 35 3.696 0.258 -9.184 1.00 33.23 C ATOM 508 C GLU A 35 2.631 1.306 -9.447 1.00 41.42 C ATOM 509 O GLU A 35 1.841 1.180 -10.388 1.00 60.24 O ATOM 510 CB GLU A 35 5.073 0.653 -9.748 1.00 74.21 C ATOM 511 CG GLU A 35 5.106 0.951 -11.259 1.00 13.35 C ATOM 512 CD GLU A 35 4.849 -0.285 -12.129 1.00 55.11 C ATOM 513 OE1 GLU A 35 5.768 -1.123 -12.259 1.00 22.43 O ATOM 514 OE2 GLU A 35 3.732 -0.412 -12.694 1.00 74.51 O ATOM 0 H GLU A 35 2.841 -0.882 -10.698 1.00 74.11 H new ATOM 0 HA GLU A 35 3.826 0.160 -8.106 1.00 33.23 H new ATOM 0 HB2 GLU A 35 5.427 1.534 -9.213 1.00 74.21 H new ATOM 0 HB3 GLU A 35 5.778 -0.152 -9.538 1.00 74.21 H new ATOM 0 HG2 GLU A 35 4.358 1.710 -11.489 1.00 13.35 H new ATOM 0 HG3 GLU A 35 6.077 1.373 -11.518 1.00 13.35 H new ATOM 519 N VAL A 36 2.625 2.367 -8.648 1.00 44.34 N ATOM 520 CA VAL A 36 1.638 3.438 -8.749 1.00 31.51 C ATOM 521 C VAL A 36 2.382 4.743 -9.036 1.00 51.31 C ATOM 522 O VAL A 36 3.589 4.836 -8.785 1.00 1.23 O ATOM 523 CB VAL A 36 0.765 3.477 -7.474 1.00 72.34 C ATOM 524 CG1 VAL A 36 -0.500 4.325 -7.710 1.00 12.43 C ATOM 525 CG2 VAL A 36 0.347 2.069 -7.008 1.00 55.24 C ATOM 0 H VAL A 36 3.310 2.510 -7.906 1.00 44.34 H new ATOM 0 HA VAL A 36 0.942 3.269 -9.571 1.00 31.51 H new ATOM 0 HB VAL A 36 1.376 3.927 -6.692 1.00 72.34 H new ATOM 0 HG11 VAL A 36 -1.102 4.341 -6.802 1.00 12.43 H new ATOM 0 HG12 VAL A 36 -0.212 5.343 -7.972 1.00 12.43 H new ATOM 0 HG13 VAL A 36 -1.082 3.892 -8.523 1.00 12.43 H new ATOM 0 HG21 VAL A 36 -0.265 2.150 -6.109 1.00 55.24 H new ATOM 0 HG22 VAL A 36 -0.227 1.581 -7.795 1.00 55.24 H new ATOM 0 HG23 VAL A 36 1.237 1.479 -6.789 1.00 55.24 H new ATOM 535 N LYS A 37 1.678 5.740 -9.573 1.00 34.25 N ATOM 536 CA LYS A 37 2.195 7.052 -9.927 1.00 3.41 C ATOM 537 C LYS A 37 1.073 8.073 -9.795 1.00 20.45 C ATOM 538 O LYS A 37 -0.101 7.701 -9.900 1.00 2.32 O ATOM 539 CB LYS A 37 2.770 7.010 -11.351 1.00 62.20 C ATOM 540 CG LYS A 37 1.757 6.694 -12.466 1.00 33.14 C ATOM 541 CD LYS A 37 2.513 6.298 -13.741 1.00 31.21 C ATOM 542 CE LYS A 37 1.672 5.810 -14.932 1.00 54.42 C ATOM 543 NZ LYS A 37 1.431 4.347 -14.921 1.00 72.50 N ATOM 0 H LYS A 37 0.684 5.645 -9.781 1.00 34.25 H new ATOM 0 HA LYS A 37 3.003 7.344 -9.256 1.00 3.41 H new ATOM 0 HB2 LYS A 37 3.232 7.974 -11.566 1.00 62.20 H new ATOM 0 HB3 LYS A 37 3.563 6.263 -11.382 1.00 62.20 H new ATOM 0 HG2 LYS A 37 1.097 5.884 -12.155 1.00 33.14 H new ATOM 0 HG3 LYS A 37 1.127 7.563 -12.658 1.00 33.14 H new ATOM 0 HD2 LYS A 37 3.096 7.158 -14.069 1.00 31.21 H new ATOM 0 HD3 LYS A 37 3.222 5.511 -13.483 1.00 31.21 H new ATOM 0 HE2 LYS A 37 0.713 6.329 -14.928 1.00 54.42 H new ATOM 0 HE3 LYS A 37 2.177 6.081 -15.859 1.00 54.42 H new ATOM 0 HZ1 LYS A 37 1.654 3.951 -15.856 1.00 72.50 H new ATOM 0 HZ2 LYS A 37 2.036 3.901 -14.203 1.00 72.50 H new ATOM 0 HZ3 LYS A 37 0.433 4.161 -14.696 1.00 72.50 H new ATOM 553 N VAL A 38 1.443 9.333 -9.607 1.00 63.53 N ATOM 554 CA VAL A 38 0.559 10.498 -9.652 1.00 31.44 C ATOM 555 C VAL A 38 0.956 11.349 -10.867 1.00 23.44 C ATOM 556 O VAL A 38 1.948 11.046 -11.538 1.00 3.02 O ATOM 557 CB VAL A 38 0.586 11.276 -8.311 1.00 22.24 C ATOM 558 CG1 VAL A 38 0.083 10.409 -7.142 1.00 13.15 C ATOM 559 CG2 VAL A 38 1.974 11.826 -7.940 1.00 21.21 C ATOM 0 H VAL A 38 2.411 9.586 -9.410 1.00 63.53 H new ATOM 0 HA VAL A 38 -0.480 10.192 -9.775 1.00 31.44 H new ATOM 0 HB VAL A 38 -0.082 12.122 -8.473 1.00 22.24 H new ATOM 0 HG11 VAL A 38 0.116 10.988 -6.219 1.00 13.15 H new ATOM 0 HG12 VAL A 38 -0.943 10.095 -7.337 1.00 13.15 H new ATOM 0 HG13 VAL A 38 0.719 9.529 -7.042 1.00 13.15 H new ATOM 0 HG21 VAL A 38 1.913 12.358 -6.990 1.00 21.21 H new ATOM 0 HG22 VAL A 38 2.680 11.001 -7.849 1.00 21.21 H new ATOM 0 HG23 VAL A 38 2.314 12.510 -8.717 1.00 21.21 H new ATOM 569 N SER A 39 0.205 12.411 -11.156 1.00 43.32 N ATOM 570 CA SER A 39 0.531 13.374 -12.179 1.00 53.30 C ATOM 571 C SER A 39 1.742 14.210 -11.751 1.00 62.11 C ATOM 572 O SER A 39 2.285 14.049 -10.652 1.00 22.13 O ATOM 573 CB SER A 39 -0.728 14.205 -12.419 1.00 51.43 C ATOM 574 OG SER A 39 -1.346 13.813 -13.634 1.00 34.32 O ATOM 0 H SER A 39 -0.665 12.621 -10.667 1.00 43.32 H new ATOM 0 HA SER A 39 0.824 12.899 -13.115 1.00 53.30 H new ATOM 0 HB2 SER A 39 -1.423 14.074 -11.590 1.00 51.43 H new ATOM 0 HB3 SER A 39 -0.473 15.264 -12.457 1.00 51.43 H new ATOM 0 HG SER A 39 -2.153 14.350 -13.779 1.00 34.32 H new ATOM 579 N GLU A 40 2.202 15.088 -12.635 1.00 23.55 N ATOM 580 CA GLU A 40 3.537 15.652 -12.560 1.00 54.22 C ATOM 581 C GLU A 40 3.502 17.109 -12.120 1.00 41.02 C ATOM 582 O GLU A 40 2.694 17.911 -12.586 1.00 54.12 O ATOM 583 CB GLU A 40 4.294 15.383 -13.858 1.00 60.50 C ATOM 584 CG GLU A 40 3.735 16.066 -15.100 1.00 13.32 C ATOM 585 CD GLU A 40 4.360 15.407 -16.327 1.00 34.14 C ATOM 586 OE1 GLU A 40 5.605 15.300 -16.390 1.00 3.44 O ATOM 587 OE2 GLU A 40 3.632 14.806 -17.155 1.00 33.42 O ATOM 0 H GLU A 40 1.654 15.428 -13.426 1.00 23.55 H new ATOM 0 HA GLU A 40 4.108 15.151 -11.778 1.00 54.22 H new ATOM 0 HB2 GLU A 40 5.329 15.699 -13.726 1.00 60.50 H new ATOM 0 HB3 GLU A 40 4.309 14.307 -14.033 1.00 60.50 H new ATOM 0 HG2 GLU A 40 2.649 15.972 -15.129 1.00 13.32 H new ATOM 0 HG3 GLU A 40 3.963 17.132 -15.083 1.00 13.32 H new ATOM 592 N GLY A 41 4.382 17.429 -11.178 1.00 61.13 N ATOM 593 CA GLY A 41 4.364 18.680 -10.443 1.00 42.20 C ATOM 594 C GLY A 41 3.204 18.760 -9.454 1.00 53.40 C ATOM 595 O GLY A 41 2.804 19.868 -9.104 1.00 32.13 O ATOM 0 H GLY A 41 5.143 16.809 -10.901 1.00 61.13 H new ATOM 0 HA2 GLY A 41 5.305 18.795 -9.905 1.00 42.20 H new ATOM 0 HA3 GLY A 41 4.296 19.510 -11.146 1.00 42.20 H new ATOM 599 N THR A 42 2.639 17.632 -9.013 1.00 55.40 N ATOM 600 CA THR A 42 1.570 17.608 -8.023 1.00 44.50 C ATOM 601 C THR A 42 2.016 18.293 -6.723 1.00 31.01 C ATOM 602 O THR A 42 1.259 19.091 -6.172 1.00 14.55 O ATOM 603 CB THR A 42 1.114 16.153 -7.820 1.00 54.12 C ATOM 604 OG1 THR A 42 0.668 15.611 -9.055 1.00 33.32 O ATOM 605 CG2 THR A 42 -0.050 16.010 -6.844 1.00 15.33 C ATOM 0 H THR A 42 2.916 16.706 -9.338 1.00 55.40 H new ATOM 0 HA THR A 42 0.711 18.179 -8.376 1.00 44.50 H new ATOM 0 HB THR A 42 1.982 15.630 -7.418 1.00 54.12 H new ATOM 0 HG1 THR A 42 1.386 15.078 -9.457 1.00 33.32 H new ATOM 0 HG21 THR A 42 -0.318 14.958 -6.750 1.00 15.33 H new ATOM 0 HG22 THR A 42 0.243 16.399 -5.869 1.00 15.33 H new ATOM 0 HG23 THR A 42 -0.907 16.571 -7.215 1.00 15.33 H new ATOM 613 N PHE A 43 3.246 18.031 -6.272 1.00 74.42 N ATOM 614 CA PHE A 43 3.881 18.689 -5.132 1.00 22.43 C ATOM 615 C PHE A 43 5.146 19.423 -5.598 1.00 15.54 C ATOM 616 O PHE A 43 5.266 19.746 -6.784 1.00 41.10 O ATOM 617 CB PHE A 43 4.077 17.686 -3.981 1.00 61.42 C ATOM 618 CG PHE A 43 2.810 17.489 -3.175 1.00 52.10 C ATOM 619 CD1 PHE A 43 1.858 16.529 -3.562 1.00 35.25 C ATOM 620 CD2 PHE A 43 2.547 18.326 -2.073 1.00 54.21 C ATOM 621 CE1 PHE A 43 0.655 16.396 -2.845 1.00 1.11 C ATOM 622 CE2 PHE A 43 1.345 18.192 -1.359 1.00 71.02 C ATOM 623 CZ PHE A 43 0.400 17.225 -1.740 1.00 1.52 C ATOM 0 H PHE A 43 3.846 17.330 -6.707 1.00 74.42 H new ATOM 0 HA PHE A 43 3.238 19.464 -4.715 1.00 22.43 H new ATOM 0 HB2 PHE A 43 4.400 16.728 -4.387 1.00 61.42 H new ATOM 0 HB3 PHE A 43 4.872 18.039 -3.325 1.00 61.42 H new ATOM 0 HD1 PHE A 43 2.051 15.892 -4.412 1.00 35.25 H new ATOM 0 HD2 PHE A 43 3.270 19.071 -1.777 1.00 54.21 H new ATOM 0 HE1 PHE A 43 -0.073 15.656 -3.144 1.00 1.11 H new ATOM 0 HE2 PHE A 43 1.147 18.835 -0.514 1.00 71.02 H new ATOM 0 HZ PHE A 43 -0.520 17.119 -1.185 1.00 1.52 H new ATOM 632 N ASP A 44 6.014 19.812 -4.664 1.00 44.41 N ATOM 633 CA ASP A 44 7.262 20.523 -4.916 1.00 0.43 C ATOM 634 C ASP A 44 8.280 20.095 -3.841 1.00 53.11 C ATOM 635 O ASP A 44 7.918 19.348 -2.928 1.00 63.02 O ATOM 636 CB ASP A 44 6.993 22.035 -4.894 1.00 3.23 C ATOM 637 CG ASP A 44 8.173 22.779 -5.498 1.00 43.34 C ATOM 638 OD1 ASP A 44 8.321 22.835 -6.740 1.00 11.55 O ATOM 639 OD2 ASP A 44 9.045 23.228 -4.730 1.00 33.01 O ATOM 0 H ASP A 44 5.858 19.632 -3.672 1.00 44.41 H new ATOM 0 HA ASP A 44 7.672 20.280 -5.896 1.00 0.43 H new ATOM 0 HB2 ASP A 44 6.085 22.260 -5.454 1.00 3.23 H new ATOM 0 HB3 ASP A 44 6.827 22.369 -3.870 1.00 3.23 H new ATOM 643 N ALA A 45 9.527 20.573 -3.899 1.00 31.13 N ATOM 644 CA ALA A 45 10.594 20.258 -2.944 1.00 15.53 C ATOM 645 C ALA A 45 10.757 21.334 -1.862 1.00 32.25 C ATOM 646 O ALA A 45 11.779 21.363 -1.170 1.00 74.31 O ATOM 647 CB ALA A 45 11.901 20.039 -3.717 1.00 40.51 C ATOM 0 H ALA A 45 9.831 21.210 -4.635 1.00 31.13 H new ATOM 0 HA ALA A 45 10.322 19.346 -2.413 1.00 15.53 H new ATOM 0 HB1 ALA A 45 12.703 19.804 -3.017 1.00 40.51 H new ATOM 0 HB2 ALA A 45 11.776 19.212 -4.416 1.00 40.51 H new ATOM 0 HB3 ALA A 45 12.154 20.945 -4.268 1.00 40.51 H new ATOM 653 N ASP A 46 9.791 22.241 -1.736 1.00 12.12 N ATOM 654 CA ASP A 46 9.848 23.400 -0.862 1.00 40.50 C ATOM 655 C ASP A 46 9.603 23.021 0.616 1.00 21.24 C ATOM 656 O ASP A 46 9.527 21.835 0.963 1.00 63.01 O ATOM 657 CB ASP A 46 8.811 24.386 -1.395 1.00 11.41 C ATOM 658 CG ASP A 46 9.110 25.809 -0.962 1.00 34.21 C ATOM 659 OD1 ASP A 46 9.875 26.507 -1.666 1.00 15.22 O ATOM 660 OD2 ASP A 46 8.559 26.181 0.093 1.00 62.34 O ATOM 0 H ASP A 46 8.918 22.183 -2.260 1.00 12.12 H new ATOM 0 HA ASP A 46 10.841 23.850 -0.868 1.00 40.50 H new ATOM 0 HB2 ASP A 46 8.787 24.335 -2.484 1.00 11.41 H new ATOM 0 HB3 ASP A 46 7.821 24.099 -1.041 1.00 11.41 H new ATOM 664 N MET A 47 9.464 24.017 1.494 1.00 11.44 N ATOM 665 CA MET A 47 9.252 23.900 2.936 1.00 63.13 C ATOM 666 C MET A 47 8.078 24.743 3.450 1.00 34.34 C ATOM 667 O MET A 47 7.568 24.479 4.538 1.00 22.42 O ATOM 668 CB MET A 47 10.540 24.304 3.656 1.00 4.12 C ATOM 669 CG MET A 47 11.069 25.696 3.269 1.00 1.35 C ATOM 670 SD MET A 47 12.060 26.518 4.545 1.00 14.33 S ATOM 671 CE MET A 47 10.735 27.158 5.604 1.00 33.23 C ATOM 0 H MET A 47 9.499 24.991 1.195 1.00 11.44 H new ATOM 0 HA MET A 47 8.995 22.862 3.146 1.00 63.13 H new ATOM 0 HB2 MET A 47 10.364 24.281 4.732 1.00 4.12 H new ATOM 0 HB3 MET A 47 11.310 23.563 3.443 1.00 4.12 H new ATOM 0 HG2 MET A 47 11.672 25.601 2.366 1.00 1.35 H new ATOM 0 HG3 MET A 47 10.221 26.335 3.020 1.00 1.35 H new ATOM 0 HE1 MET A 47 11.164 27.555 6.524 1.00 33.23 H new ATOM 0 HE2 MET A 47 10.202 27.951 5.080 1.00 33.23 H new ATOM 0 HE3 MET A 47 10.041 26.353 5.845 1.00 33.23 H new ATOM 679 N TYR A 48 7.634 25.750 2.698 1.00 21.31 N ATOM 680 CA TYR A 48 6.401 26.485 2.927 1.00 32.02 C ATOM 681 C TYR A 48 5.372 26.104 1.860 1.00 64.32 C ATOM 682 O TYR A 48 4.249 25.762 2.225 1.00 53.32 O ATOM 683 CB TYR A 48 6.675 27.998 3.010 1.00 2.35 C ATOM 684 CG TYR A 48 7.570 28.588 1.937 1.00 34.15 C ATOM 685 CD1 TYR A 48 7.056 28.933 0.671 1.00 64.44 C ATOM 686 CD2 TYR A 48 8.949 28.690 2.186 1.00 4.34 C ATOM 687 CE1 TYR A 48 7.942 29.225 -0.383 1.00 21.12 C ATOM 688 CE2 TYR A 48 9.840 28.966 1.143 1.00 42.53 C ATOM 689 CZ TYR A 48 9.337 29.173 -0.161 1.00 72.43 C ATOM 690 OH TYR A 48 10.192 29.154 -1.214 1.00 41.51 O ATOM 0 H TYR A 48 8.147 26.085 1.882 1.00 21.31 H new ATOM 0 HA TYR A 48 5.975 26.210 3.892 1.00 32.02 H new ATOM 0 HB2 TYR A 48 5.718 28.519 2.979 1.00 2.35 H new ATOM 0 HB3 TYR A 48 7.123 28.210 3.981 1.00 2.35 H new ATOM 0 HD1 TYR A 48 5.989 28.973 0.510 1.00 64.44 H new ATOM 0 HD2 TYR A 48 9.324 28.554 3.190 1.00 4.34 H new ATOM 0 HE1 TYR A 48 7.558 29.488 -1.357 1.00 21.12 H new ATOM 0 HE2 TYR A 48 10.902 29.020 1.333 1.00 42.53 H new ATOM 0 HH TYR A 48 10.349 28.227 -1.492 1.00 41.51 H new ATOM 699 N LYS A 49 5.737 26.078 0.567 1.00 52.22 N ATOM 700 CA LYS A 49 4.785 25.824 -0.524 1.00 72.11 C ATOM 701 C LYS A 49 4.124 24.466 -0.323 1.00 61.24 C ATOM 702 O LYS A 49 2.907 24.341 -0.349 1.00 55.52 O ATOM 703 CB LYS A 49 5.506 25.912 -1.879 1.00 72.13 C ATOM 704 CG LYS A 49 4.607 25.711 -3.104 1.00 61.33 C ATOM 705 CD LYS A 49 3.651 26.878 -3.361 1.00 15.55 C ATOM 706 CE LYS A 49 3.142 26.820 -4.807 1.00 15.54 C ATOM 707 NZ LYS A 49 2.201 27.915 -5.102 1.00 12.55 N ATOM 0 H LYS A 49 6.695 26.232 0.251 1.00 52.22 H new ATOM 0 HA LYS A 49 4.002 26.582 -0.516 1.00 72.11 H new ATOM 0 HB2 LYS A 49 5.986 26.887 -1.956 1.00 72.13 H new ATOM 0 HB3 LYS A 49 6.298 25.164 -1.902 1.00 72.13 H new ATOM 0 HG2 LYS A 49 5.234 25.565 -3.984 1.00 61.33 H new ATOM 0 HG3 LYS A 49 4.026 24.798 -2.972 1.00 61.33 H new ATOM 0 HD2 LYS A 49 2.811 26.832 -2.668 1.00 15.55 H new ATOM 0 HD3 LYS A 49 4.161 27.825 -3.182 1.00 15.55 H new ATOM 0 HE2 LYS A 49 3.988 26.874 -5.492 1.00 15.54 H new ATOM 0 HE3 LYS A 49 2.651 25.862 -4.981 1.00 15.54 H new ATOM 0 HZ1 LYS A 49 1.880 27.841 -6.088 1.00 12.55 H new ATOM 0 HZ2 LYS A 49 1.381 27.849 -4.465 1.00 12.55 H new ATOM 0 HZ3 LYS A 49 2.677 28.829 -4.961 1.00 12.55 H new ATOM 717 N THR A 50 4.937 23.444 -0.104 1.00 71.23 N ATOM 718 CA THR A 50 4.514 22.067 0.085 1.00 23.41 C ATOM 719 C THR A 50 3.658 21.872 1.333 1.00 20.12 C ATOM 720 O THR A 50 2.766 21.020 1.341 1.00 22.15 O ATOM 721 CB THR A 50 5.782 21.230 0.208 1.00 40.53 C ATOM 722 OG1 THR A 50 6.672 21.832 1.139 1.00 55.22 O ATOM 723 CG2 THR A 50 6.509 21.167 -1.122 1.00 35.12 C ATOM 0 H THR A 50 5.949 23.557 -0.051 1.00 71.23 H new ATOM 0 HA THR A 50 3.895 21.769 -0.761 1.00 23.41 H new ATOM 0 HB THR A 50 5.489 20.232 0.532 1.00 40.53 H new ATOM 0 HG1 THR A 50 7.592 21.569 0.929 1.00 55.22 H new ATOM 0 HG21 THR A 50 7.412 20.565 -1.015 1.00 35.12 H new ATOM 0 HG22 THR A 50 5.859 20.715 -1.871 1.00 35.12 H new ATOM 0 HG23 THR A 50 6.780 22.175 -1.437 1.00 35.12 H new ATOM 731 N SER A 51 3.947 22.637 2.386 1.00 0.14 N ATOM 732 CA SER A 51 3.197 22.623 3.625 1.00 32.42 C ATOM 733 C SER A 51 1.769 23.079 3.318 1.00 14.52 C ATOM 734 O SER A 51 0.807 22.413 3.711 1.00 3.43 O ATOM 735 CB SER A 51 3.923 23.529 4.636 1.00 3.24 C ATOM 736 OG SER A 51 3.799 23.045 5.958 1.00 21.02 O ATOM 0 H SER A 51 4.727 23.295 2.393 1.00 0.14 H new ATOM 0 HA SER A 51 3.135 21.629 4.068 1.00 32.42 H new ATOM 0 HB2 SER A 51 4.978 23.597 4.371 1.00 3.24 H new ATOM 0 HB3 SER A 51 3.515 24.538 4.579 1.00 3.24 H new ATOM 0 HG SER A 51 4.273 23.644 6.572 1.00 21.02 H new ATOM 741 N ASP A 52 1.651 24.177 2.565 1.00 11.25 N ATOM 742 CA ASP A 52 0.385 24.791 2.195 1.00 3.52 C ATOM 743 C ASP A 52 -0.419 23.909 1.245 1.00 74.14 C ATOM 744 O ASP A 52 -1.616 23.747 1.453 1.00 42.53 O ATOM 745 CB ASP A 52 0.616 26.184 1.590 1.00 24.23 C ATOM 746 CG ASP A 52 -0.660 27.015 1.712 1.00 72.01 C ATOM 747 OD1 ASP A 52 -1.065 27.269 2.871 1.00 53.32 O ATOM 748 OD2 ASP A 52 -1.259 27.423 0.697 1.00 75.23 O ATOM 0 H ASP A 52 2.460 24.672 2.189 1.00 11.25 H new ATOM 0 HA ASP A 52 -0.204 24.903 3.105 1.00 3.52 H new ATOM 0 HB2 ASP A 52 1.437 26.683 2.104 1.00 24.23 H new ATOM 0 HB3 ASP A 52 0.904 26.093 0.543 1.00 24.23 H new ATOM 752 N ILE A 53 0.223 23.282 0.249 1.00 1.52 N ATOM 753 CA ILE A 53 -0.467 22.367 -0.662 1.00 41.24 C ATOM 754 C ILE A 53 -1.041 21.196 0.140 1.00 13.23 C ATOM 755 O ILE A 53 -2.216 20.872 -0.001 1.00 51.41 O ATOM 756 CB ILE A 53 0.452 21.862 -1.812 1.00 33.45 C ATOM 757 CG1 ILE A 53 1.022 22.985 -2.710 1.00 1.51 C ATOM 758 CG2 ILE A 53 -0.342 20.899 -2.724 1.00 40.22 C ATOM 759 CD1 ILE A 53 2.308 22.556 -3.438 1.00 75.03 C ATOM 0 H ILE A 53 1.218 23.394 0.057 1.00 1.52 H new ATOM 0 HA ILE A 53 -1.278 22.915 -1.142 1.00 41.24 H new ATOM 0 HB ILE A 53 1.292 21.374 -1.319 1.00 33.45 H new ATOM 0 HG12 ILE A 53 0.271 23.276 -3.445 1.00 1.51 H new ATOM 0 HG13 ILE A 53 1.229 23.865 -2.100 1.00 1.51 H new ATOM 0 HG21 ILE A 53 0.303 20.546 -3.529 1.00 40.22 H new ATOM 0 HG22 ILE A 53 -0.691 20.048 -2.139 1.00 40.22 H new ATOM 0 HG23 ILE A 53 -1.198 21.423 -3.148 1.00 40.22 H new ATOM 0 HD11 ILE A 53 2.668 23.379 -4.055 1.00 75.03 H new ATOM 0 HD12 ILE A 53 3.070 22.291 -2.705 1.00 75.03 H new ATOM 0 HD13 ILE A 53 2.098 21.693 -4.070 1.00 75.03 H new ATOM 770 N ALA A 54 -0.235 20.544 0.989 1.00 62.24 N ATOM 771 CA ALA A 54 -0.731 19.380 1.717 1.00 13.12 C ATOM 772 C ALA A 54 -1.884 19.782 2.639 1.00 40.52 C ATOM 773 O ALA A 54 -2.837 19.021 2.797 1.00 32.02 O ATOM 774 CB ALA A 54 0.400 18.720 2.507 1.00 63.13 C ATOM 0 H ALA A 54 0.734 20.796 1.182 1.00 62.24 H new ATOM 0 HA ALA A 54 -1.108 18.652 0.999 1.00 13.12 H new ATOM 0 HB1 ALA A 54 0.012 17.854 3.043 1.00 63.13 H new ATOM 0 HB2 ALA A 54 1.185 18.400 1.821 1.00 63.13 H new ATOM 0 HB3 ALA A 54 0.811 19.435 3.220 1.00 63.13 H new ATOM 780 N LEU A 55 -1.801 20.981 3.224 1.00 40.40 N ATOM 781 CA LEU A 55 -2.852 21.560 4.044 1.00 63.24 C ATOM 782 C LEU A 55 -4.130 21.750 3.219 1.00 35.13 C ATOM 783 O LEU A 55 -5.214 21.418 3.703 1.00 61.03 O ATOM 784 CB LEU A 55 -2.321 22.869 4.662 1.00 4.55 C ATOM 785 CG LEU A 55 -3.222 23.582 5.672 1.00 12.31 C ATOM 786 CD1 LEU A 55 -4.342 24.348 4.955 1.00 31.35 C ATOM 787 CD2 LEU A 55 -3.700 22.611 6.762 1.00 21.11 C ATOM 0 H LEU A 55 -0.982 21.583 3.135 1.00 40.40 H new ATOM 0 HA LEU A 55 -3.124 20.891 4.861 1.00 63.24 H new ATOM 0 HB2 LEU A 55 -1.372 22.651 5.151 1.00 4.55 H new ATOM 0 HB3 LEU A 55 -2.108 23.564 3.850 1.00 4.55 H new ATOM 0 HG LEU A 55 -2.648 24.342 6.202 1.00 12.31 H new ATOM 0 HD11 LEU A 55 -4.971 24.848 5.692 1.00 31.35 H new ATOM 0 HD12 LEU A 55 -3.905 25.091 4.288 1.00 31.35 H new ATOM 0 HD13 LEU A 55 -4.947 23.650 4.375 1.00 31.35 H new ATOM 0 HD21 LEU A 55 -4.339 23.142 7.468 1.00 21.11 H new ATOM 0 HD22 LEU A 55 -4.263 21.798 6.304 1.00 21.11 H new ATOM 0 HD23 LEU A 55 -2.838 22.203 7.289 1.00 21.11 H new ATOM 798 N ASP A 56 -4.013 22.255 1.987 1.00 13.51 N ATOM 799 CA ASP A 56 -5.135 22.522 1.084 1.00 35.15 C ATOM 800 C ASP A 56 -5.937 21.250 0.777 1.00 0.31 C ATOM 801 O ASP A 56 -7.172 21.285 0.694 1.00 72.22 O ATOM 802 CB ASP A 56 -4.667 23.280 -0.181 1.00 43.43 C ATOM 803 CG ASP A 56 -4.212 22.545 -1.450 1.00 73.11 C ATOM 804 OD1 ASP A 56 -4.776 21.520 -1.889 1.00 21.01 O ATOM 805 OD2 ASP A 56 -3.346 23.137 -2.125 1.00 44.31 O ATOM 0 H ASP A 56 -3.109 22.496 1.580 1.00 13.51 H new ATOM 0 HA ASP A 56 -5.831 23.187 1.596 1.00 35.15 H new ATOM 0 HB2 ASP A 56 -5.486 23.936 -0.475 1.00 43.43 H new ATOM 0 HB3 ASP A 56 -3.840 23.920 0.125 1.00 43.43 H new ATOM 809 N GLN A 57 -5.256 20.104 0.709 1.00 71.04 N ATOM 810 CA GLN A 57 -5.874 18.802 0.476 1.00 63.31 C ATOM 811 C GLN A 57 -6.389 18.161 1.775 1.00 43.50 C ATOM 812 O GLN A 57 -6.943 17.059 1.729 1.00 12.31 O ATOM 813 CB GLN A 57 -4.892 17.877 -0.255 1.00 71.23 C ATOM 814 CG GLN A 57 -4.422 18.488 -1.582 1.00 32.11 C ATOM 815 CD GLN A 57 -3.794 17.458 -2.504 1.00 34.43 C ATOM 816 OE1 GLN A 57 -2.977 16.644 -2.082 1.00 33.35 O ATOM 817 NE2 GLN A 57 -4.164 17.431 -3.773 1.00 11.35 N ATOM 0 H GLN A 57 -4.243 20.057 0.816 1.00 71.04 H new ATOM 0 HA GLN A 57 -6.748 18.956 -0.157 1.00 63.31 H new ATOM 0 HB2 GLN A 57 -4.030 17.684 0.383 1.00 71.23 H new ATOM 0 HB3 GLN A 57 -5.369 16.916 -0.445 1.00 71.23 H new ATOM 0 HG2 GLN A 57 -5.270 18.953 -2.085 1.00 32.11 H new ATOM 0 HG3 GLN A 57 -3.699 19.278 -1.379 1.00 32.11 H new ATOM 0 HE21 GLN A 57 -4.843 18.108 -4.121 1.00 11.35 H new ATOM 0 HE22 GLN A 57 -3.771 16.733 -4.404 1.00 11.35 H new ATOM 824 N ILE A 58 -6.232 18.818 2.929 1.00 40.53 N ATOM 825 CA ILE A 58 -6.714 18.357 4.228 1.00 24.02 C ATOM 826 C ILE A 58 -7.944 19.184 4.613 1.00 64.30 C ATOM 827 O ILE A 58 -9.027 18.610 4.722 1.00 43.54 O ATOM 828 CB ILE A 58 -5.568 18.388 5.274 1.00 31.22 C ATOM 829 CG1 ILE A 58 -4.538 17.268 4.983 1.00 32.45 C ATOM 830 CG2 ILE A 58 -6.093 18.297 6.719 1.00 41.40 C ATOM 831 CD1 ILE A 58 -3.168 17.532 5.630 1.00 32.33 C ATOM 0 H ILE A 58 -5.749 19.715 2.982 1.00 40.53 H new ATOM 0 HA ILE A 58 -7.030 17.315 4.185 1.00 24.02 H new ATOM 0 HB ILE A 58 -5.069 19.353 5.182 1.00 31.22 H new ATOM 0 HG12 ILE A 58 -4.929 16.318 5.347 1.00 32.45 H new ATOM 0 HG13 ILE A 58 -4.412 17.168 3.905 1.00 32.45 H new ATOM 0 HG21 ILE A 58 -5.253 18.323 7.413 1.00 41.40 H new ATOM 0 HG22 ILE A 58 -6.755 19.139 6.919 1.00 41.40 H new ATOM 0 HG23 ILE A 58 -6.643 17.365 6.848 1.00 41.40 H new ATOM 0 HD11 ILE A 58 -2.489 16.714 5.391 1.00 32.33 H new ATOM 0 HD12 ILE A 58 -2.759 18.467 5.247 1.00 32.33 H new ATOM 0 HD13 ILE A 58 -3.284 17.603 6.711 1.00 32.33 H new ATOM 842 N GLN A 59 -7.798 20.501 4.817 1.00 21.32 N ATOM 843 CA GLN A 59 -8.802 21.363 5.456 1.00 62.10 C ATOM 844 C GLN A 59 -10.019 21.686 4.564 1.00 55.12 C ATOM 845 O GLN A 59 -10.748 22.647 4.830 1.00 3.55 O ATOM 846 CB GLN A 59 -8.135 22.636 6.021 1.00 40.14 C ATOM 847 CG GLN A 59 -7.484 22.408 7.392 1.00 75.01 C ATOM 848 CD GLN A 59 -7.044 23.722 8.034 1.00 12.15 C ATOM 849 OE1 GLN A 59 -6.235 24.493 7.337 1.00 12.11 O flip ATOM 850 NE2 GLN A 59 -7.440 24.078 9.141 1.00 43.13 N flip ATOM 0 H GLN A 59 -6.959 21.008 4.536 1.00 21.32 H new ATOM 0 HA GLN A 59 -9.220 20.791 6.284 1.00 62.10 H new ATOM 0 HB2 GLN A 59 -7.379 22.987 5.319 1.00 40.14 H new ATOM 0 HB3 GLN A 59 -8.882 23.425 6.105 1.00 40.14 H new ATOM 0 HG2 GLN A 59 -8.189 21.900 8.050 1.00 75.01 H new ATOM 0 HG3 GLN A 59 -6.622 21.751 7.281 1.00 75.01 H new ATOM 0 HE21 GLN A 59 -8.066 23.477 9.676 1.00 43.13 H new ATOM 0 HE22 GLN A 59 -7.142 24.975 9.525 1.00 43.13 H new ATOM 857 N GLY A 60 -10.276 20.890 3.524 1.00 40.20 N ATOM 858 CA GLY A 60 -11.471 20.963 2.694 1.00 20.01 C ATOM 859 C GLY A 60 -11.366 21.987 1.568 1.00 1.54 C ATOM 860 O GLY A 60 -12.269 22.066 0.735 1.00 3.34 O ATOM 0 H GLY A 60 -9.634 20.154 3.230 1.00 40.20 H new ATOM 0 HA2 GLY A 60 -11.666 19.980 2.264 1.00 20.01 H new ATOM 0 HA3 GLY A 60 -12.326 21.212 3.323 1.00 20.01 H new ATOM 864 N ASN A 61 -10.263 22.733 1.516 1.00 31.02 N ATOM 865 CA ASN A 61 -9.989 23.809 0.575 1.00 73.42 C ATOM 866 C ASN A 61 -10.105 23.272 -0.849 1.00 13.14 C ATOM 867 O ASN A 61 -10.841 23.823 -1.669 1.00 33.42 O ATOM 868 CB ASN A 61 -8.576 24.424 0.763 1.00 52.40 C ATOM 869 CG ASN A 61 -7.989 24.428 2.172 1.00 32.24 C ATOM 870 OD1 ASN A 61 -8.022 23.434 2.889 1.00 2.42 O ATOM 871 ND2 ASN A 61 -7.343 25.501 2.572 1.00 40.44 N ATOM 0 H ASN A 61 -9.494 22.591 2.170 1.00 31.02 H new ATOM 0 HA ASN A 61 -10.720 24.596 0.762 1.00 73.42 H new ATOM 0 HB2 ASN A 61 -7.886 23.886 0.113 1.00 52.40 H new ATOM 0 HB3 ASN A 61 -8.608 25.455 0.410 1.00 52.40 H new ATOM 0 HD21 ASN A 61 -6.871 25.505 3.476 1.00 40.44 H new ATOM 0 HD22 ASN A 61 -7.314 26.330 1.978 1.00 40.44 H new ATOM 877 N LYS A 62 -9.355 22.207 -1.142 1.00 15.40 N ATOM 878 CA LYS A 62 -9.024 21.787 -2.494 1.00 75.24 C ATOM 879 C LYS A 62 -9.216 20.283 -2.662 1.00 52.41 C ATOM 880 O LYS A 62 -9.259 19.532 -1.685 1.00 33.34 O ATOM 881 CB LYS A 62 -7.573 22.226 -2.788 1.00 61.00 C ATOM 882 CG LYS A 62 -7.475 23.422 -3.747 1.00 2.23 C ATOM 883 CD LYS A 62 -7.738 23.065 -5.216 1.00 75.44 C ATOM 884 CE LYS A 62 -6.571 22.274 -5.822 1.00 75.14 C ATOM 885 NZ LYS A 62 -6.795 21.955 -7.247 1.00 12.12 N ATOM 0 H LYS A 62 -8.955 21.603 -0.425 1.00 15.40 H new ATOM 0 HA LYS A 62 -9.694 22.259 -3.213 1.00 75.24 H new ATOM 0 HB2 LYS A 62 -7.083 22.483 -1.849 1.00 61.00 H new ATOM 0 HB3 LYS A 62 -7.027 21.384 -3.213 1.00 61.00 H new ATOM 0 HG2 LYS A 62 -8.189 24.184 -3.435 1.00 2.23 H new ATOM 0 HG3 LYS A 62 -6.481 23.862 -3.663 1.00 2.23 H new ATOM 0 HD2 LYS A 62 -8.654 22.478 -5.290 1.00 75.44 H new ATOM 0 HD3 LYS A 62 -7.897 23.978 -5.790 1.00 75.44 H new ATOM 0 HE2 LYS A 62 -5.652 22.851 -5.720 1.00 75.14 H new ATOM 0 HE3 LYS A 62 -6.431 21.349 -5.262 1.00 75.14 H new ATOM 0 HZ1 LYS A 62 -6.061 21.295 -7.574 1.00 12.12 H new ATOM 0 HZ2 LYS A 62 -7.731 21.517 -7.362 1.00 12.12 H new ATOM 0 HZ3 LYS A 62 -6.751 22.829 -7.809 1.00 12.12 H new ATOM 895 N ASP A 63 -9.355 19.869 -3.916 1.00 41.14 N ATOM 896 CA ASP A 63 -9.446 18.484 -4.366 1.00 71.25 C ATOM 897 C ASP A 63 -8.157 17.705 -4.068 1.00 73.31 C ATOM 898 O ASP A 63 -7.169 18.256 -3.583 1.00 60.04 O ATOM 899 CB ASP A 63 -9.793 18.461 -5.866 1.00 14.42 C ATOM 900 CG ASP A 63 -8.840 19.312 -6.703 1.00 53.11 C ATOM 901 OD1 ASP A 63 -7.760 18.841 -7.114 1.00 55.43 O ATOM 902 OD2 ASP A 63 -9.146 20.507 -6.919 1.00 20.01 O ATOM 0 H ASP A 63 -9.410 20.529 -4.692 1.00 41.14 H new ATOM 0 HA ASP A 63 -10.240 17.983 -3.812 1.00 71.25 H new ATOM 0 HB2 ASP A 63 -9.766 17.432 -6.225 1.00 14.42 H new ATOM 0 HB3 ASP A 63 -10.812 18.821 -6.005 1.00 14.42 H new ATOM 906 N PHE A 64 -8.183 16.391 -4.312 1.00 54.25 N ATOM 907 CA PHE A 64 -7.096 15.459 -4.009 1.00 3.44 C ATOM 908 C PHE A 64 -6.327 15.097 -5.285 1.00 4.51 C ATOM 909 O PHE A 64 -6.845 15.336 -6.383 1.00 43.51 O ATOM 910 CB PHE A 64 -7.689 14.237 -3.288 1.00 61.42 C ATOM 911 CG PHE A 64 -8.804 13.488 -3.994 1.00 1.52 C ATOM 912 CD1 PHE A 64 -8.587 12.856 -5.235 1.00 11.51 C ATOM 913 CD2 PHE A 64 -10.060 13.370 -3.370 1.00 31.14 C ATOM 914 CE1 PHE A 64 -9.614 12.124 -5.851 1.00 53.11 C ATOM 915 CE2 PHE A 64 -11.080 12.624 -3.980 1.00 62.44 C ATOM 916 CZ PHE A 64 -10.860 12.011 -5.222 1.00 55.22 C ATOM 0 H PHE A 64 -8.988 15.933 -4.740 1.00 54.25 H new ATOM 0 HA PHE A 64 -6.365 15.918 -3.344 1.00 3.44 H new ATOM 0 HB2 PHE A 64 -6.879 13.533 -3.094 1.00 61.42 H new ATOM 0 HB3 PHE A 64 -8.064 14.566 -2.319 1.00 61.42 H new ATOM 0 HD1 PHE A 64 -7.623 12.936 -5.716 1.00 11.51 H new ATOM 0 HD2 PHE A 64 -10.239 13.854 -2.421 1.00 31.14 H new ATOM 0 HE1 PHE A 64 -9.444 11.650 -6.806 1.00 53.11 H new ATOM 0 HE2 PHE A 64 -12.038 12.522 -3.491 1.00 62.44 H new ATOM 0 HZ PHE A 64 -11.653 11.451 -5.694 1.00 55.22 H new ATOM 925 N PRO A 65 -5.118 14.504 -5.193 1.00 42.30 N ATOM 926 CA PRO A 65 -4.368 14.142 -6.374 1.00 51.44 C ATOM 927 C PRO A 65 -4.828 12.776 -6.876 1.00 20.12 C ATOM 928 O PRO A 65 -5.006 11.809 -6.121 1.00 52.54 O ATOM 929 CB PRO A 65 -2.911 14.145 -5.938 1.00 44.44 C ATOM 930 CG PRO A 65 -2.989 13.629 -4.509 1.00 54.32 C ATOM 931 CD PRO A 65 -4.369 14.085 -4.011 1.00 60.03 C ATOM 0 HA PRO A 65 -4.516 14.831 -7.205 1.00 51.44 H new ATOM 0 HB2 PRO A 65 -2.298 13.501 -6.568 1.00 44.44 H new ATOM 0 HB3 PRO A 65 -2.476 15.143 -5.985 1.00 44.44 H new ATOM 0 HG2 PRO A 65 -2.893 12.544 -4.473 1.00 54.32 H new ATOM 0 HG3 PRO A 65 -2.189 14.041 -3.894 1.00 54.32 H new ATOM 0 HD2 PRO A 65 -4.882 13.274 -3.494 1.00 60.03 H new ATOM 0 HD3 PRO A 65 -4.273 14.906 -3.301 1.00 60.03 H new ATOM 936 N GLU A 66 -5.030 12.715 -8.177 1.00 73.12 N ATOM 937 CA GLU A 66 -5.367 11.512 -8.901 1.00 34.20 C ATOM 938 C GLU A 66 -4.127 10.626 -9.038 1.00 72.21 C ATOM 939 O GLU A 66 -2.991 11.048 -8.797 1.00 31.35 O ATOM 940 CB GLU A 66 -5.902 11.937 -10.269 1.00 62.14 C ATOM 941 CG GLU A 66 -7.275 12.611 -10.160 1.00 24.33 C ATOM 942 CD GLU A 66 -8.359 11.678 -10.686 1.00 21.10 C ATOM 943 OE1 GLU A 66 -8.611 10.637 -10.031 1.00 51.24 O ATOM 944 OE2 GLU A 66 -8.911 11.958 -11.769 1.00 61.41 O ATOM 0 H GLU A 66 -4.961 13.535 -8.779 1.00 73.12 H new ATOM 0 HA GLU A 66 -6.124 10.931 -8.374 1.00 34.20 H new ATOM 0 HB2 GLU A 66 -5.197 12.623 -10.738 1.00 62.14 H new ATOM 0 HB3 GLU A 66 -5.976 11.064 -10.917 1.00 62.14 H new ATOM 0 HG2 GLU A 66 -7.480 12.870 -9.121 1.00 24.33 H new ATOM 0 HG3 GLU A 66 -7.278 13.542 -10.728 1.00 24.33 H new ATOM 949 N ILE A 67 -4.358 9.392 -9.474 1.00 34.14 N ATOM 950 CA ILE A 67 -3.323 8.456 -9.890 1.00 62.11 C ATOM 951 C ILE A 67 -3.482 8.223 -11.397 1.00 33.34 C ATOM 952 O ILE A 67 -4.460 8.680 -11.996 1.00 13.20 O ATOM 953 CB ILE A 67 -3.380 7.167 -9.034 1.00 42.11 C ATOM 954 CG1 ILE A 67 -4.713 6.402 -9.209 1.00 15.11 C ATOM 955 CG2 ILE A 67 -3.101 7.504 -7.554 1.00 62.21 C ATOM 956 CD1 ILE A 67 -4.805 5.132 -8.355 1.00 52.32 C ATOM 0 H ILE A 67 -5.299 9.006 -9.549 1.00 34.14 H new ATOM 0 HA ILE A 67 -2.324 8.857 -9.720 1.00 62.11 H new ATOM 0 HB ILE A 67 -2.600 6.493 -9.389 1.00 42.11 H new ATOM 0 HG12 ILE A 67 -5.540 7.064 -8.951 1.00 15.11 H new ATOM 0 HG13 ILE A 67 -4.834 6.134 -10.259 1.00 15.11 H new ATOM 0 HG21 ILE A 67 -3.143 6.592 -6.959 1.00 62.21 H new ATOM 0 HG22 ILE A 67 -2.111 7.951 -7.463 1.00 62.21 H new ATOM 0 HG23 ILE A 67 -3.852 8.207 -7.193 1.00 62.21 H new ATOM 0 HD11 ILE A 67 -5.765 4.646 -8.528 1.00 52.32 H new ATOM 0 HD12 ILE A 67 -3.999 4.451 -8.628 1.00 52.32 H new ATOM 0 HD13 ILE A 67 -4.716 5.395 -7.301 1.00 52.32 H new ATOM 967 N GLN A 68 -2.530 7.520 -12.009 1.00 33.53 N ATOM 968 CA GLN A 68 -2.552 7.129 -13.414 1.00 60.43 C ATOM 969 C GLN A 68 -2.307 5.616 -13.496 1.00 63.44 C ATOM 970 O GLN A 68 -1.464 5.131 -14.256 1.00 52.31 O ATOM 971 CB GLN A 68 -1.489 7.915 -14.189 1.00 4.32 C ATOM 972 CG GLN A 68 -1.505 9.443 -14.030 1.00 71.42 C ATOM 973 CD GLN A 68 -0.334 10.097 -14.777 1.00 14.22 C ATOM 974 OE1 GLN A 68 0.574 9.421 -15.257 1.00 62.12 O ATOM 975 NE2 GLN A 68 -0.309 11.414 -14.893 1.00 21.22 N ATOM 0 H GLN A 68 -1.694 7.197 -11.522 1.00 33.53 H new ATOM 0 HA GLN A 68 -3.518 7.357 -13.864 1.00 60.43 H new ATOM 0 HB2 GLN A 68 -0.508 7.552 -13.883 1.00 4.32 H new ATOM 0 HB3 GLN A 68 -1.599 7.682 -15.248 1.00 4.32 H new ATOM 0 HG2 GLN A 68 -2.447 9.840 -14.409 1.00 71.42 H new ATOM 0 HG3 GLN A 68 -1.453 9.701 -12.972 1.00 71.42 H new ATOM 0 HE21 GLN A 68 -1.062 11.975 -14.495 1.00 21.22 H new ATOM 0 HE22 GLN A 68 0.463 11.868 -15.380 1.00 21.22 H new ATOM 982 N LEU A 69 -2.964 4.868 -12.615 1.00 43.44 N ATOM 983 CA LEU A 69 -2.866 3.410 -12.552 1.00 54.42 C ATOM 984 C LEU A 69 -3.848 2.785 -13.552 1.00 15.02 C ATOM 985 O LEU A 69 -4.753 3.471 -14.043 1.00 72.13 O ATOM 986 CB LEU A 69 -3.198 2.938 -11.124 1.00 21.13 C ATOM 987 CG LEU A 69 -2.201 1.932 -10.521 1.00 15.02 C ATOM 988 CD1 LEU A 69 -2.678 1.618 -9.100 1.00 2.11 C ATOM 989 CD2 LEU A 69 -2.045 0.624 -11.307 1.00 41.43 C ATOM 0 H LEU A 69 -3.590 5.262 -11.913 1.00 43.44 H new ATOM 0 HA LEU A 69 -1.853 3.099 -12.807 1.00 54.42 H new ATOM 0 HB2 LEU A 69 -3.249 3.810 -10.472 1.00 21.13 H new ATOM 0 HB3 LEU A 69 -4.189 2.485 -11.129 1.00 21.13 H new ATOM 0 HG LEU A 69 -1.215 2.397 -10.548 1.00 15.02 H new ATOM 0 HD11 LEU A 69 -1.996 0.906 -8.636 1.00 2.11 H new ATOM 0 HD12 LEU A 69 -2.699 2.536 -8.512 1.00 2.11 H new ATOM 0 HD13 LEU A 69 -3.679 1.189 -9.139 1.00 2.11 H new ATOM 0 HD21 LEU A 69 -1.322 -0.019 -10.804 1.00 41.43 H new ATOM 0 HD22 LEU A 69 -3.007 0.115 -11.361 1.00 41.43 H new ATOM 0 HD23 LEU A 69 -1.694 0.845 -12.315 1.00 41.43 H new ATOM 1000 N ASP A 70 -3.716 1.482 -13.806 1.00 34.21 N ATOM 1001 CA ASP A 70 -4.713 0.714 -14.551 1.00 71.45 C ATOM 1002 C ASP A 70 -5.859 0.267 -13.648 1.00 44.25 C ATOM 1003 O ASP A 70 -5.721 0.301 -12.419 1.00 43.45 O ATOM 1004 CB ASP A 70 -4.117 -0.521 -15.252 1.00 72.51 C ATOM 1005 CG ASP A 70 -4.492 -0.428 -16.729 1.00 14.40 C ATOM 1006 OD1 ASP A 70 -5.697 -0.247 -17.012 1.00 3.23 O ATOM 1007 OD2 ASP A 70 -3.585 -0.437 -17.592 1.00 33.11 O ATOM 0 H ASP A 70 -2.914 0.930 -13.501 1.00 34.21 H new ATOM 0 HA ASP A 70 -5.090 1.390 -15.318 1.00 71.45 H new ATOM 0 HB2 ASP A 70 -3.034 -0.546 -15.131 1.00 72.51 H new ATOM 0 HB3 ASP A 70 -4.508 -1.439 -14.813 1.00 72.51 H new ATOM 1011 N ASN A 71 -6.972 -0.177 -14.240 1.00 24.31 N ATOM 1012 CA ASN A 71 -8.058 -0.791 -13.478 1.00 34.34 C ATOM 1013 C ASN A 71 -7.742 -2.272 -13.291 1.00 75.54 C ATOM 1014 O ASN A 71 -7.557 -3.025 -14.252 1.00 23.24 O ATOM 1015 CB ASN A 71 -9.427 -0.640 -14.137 1.00 53.45 C ATOM 1016 CG ASN A 71 -10.487 -1.145 -13.166 1.00 14.22 C ATOM 1017 OD1 ASN A 71 -10.799 -2.330 -13.125 1.00 52.12 O ATOM 1018 ND2 ASN A 71 -11.020 -0.282 -12.322 1.00 34.12 N ATOM 0 H ASN A 71 -7.142 -0.122 -15.244 1.00 24.31 H new ATOM 0 HA ASN A 71 -8.119 -0.271 -12.522 1.00 34.34 H new ATOM 0 HB2 ASN A 71 -9.612 0.404 -14.391 1.00 53.45 H new ATOM 0 HB3 ASN A 71 -9.464 -1.206 -15.067 1.00 53.45 H new ATOM 0 HD21 ASN A 71 -11.697 -0.599 -11.628 1.00 34.12 H new ATOM 0 HD22 ASN A 71 -10.755 0.702 -12.363 1.00 34.12 H new ATOM 1024 N ILE A 72 -7.637 -2.676 -12.035 1.00 14.01 N ATOM 1025 CA ILE A 72 -7.178 -3.984 -11.595 1.00 3.12 C ATOM 1026 C ILE A 72 -8.171 -4.473 -10.550 1.00 31.41 C ATOM 1027 O ILE A 72 -8.498 -3.738 -9.616 1.00 15.52 O ATOM 1028 CB ILE A 72 -5.718 -3.882 -11.093 1.00 15.02 C ATOM 1029 CG1 ILE A 72 -4.786 -3.626 -12.305 1.00 63.35 C ATOM 1030 CG2 ILE A 72 -5.291 -5.166 -10.353 1.00 1.40 C ATOM 1031 CD1 ILE A 72 -3.329 -3.300 -11.970 1.00 33.32 C ATOM 0 H ILE A 72 -7.883 -2.068 -11.254 1.00 14.01 H new ATOM 0 HA ILE A 72 -7.150 -4.717 -12.401 1.00 3.12 H new ATOM 0 HB ILE A 72 -5.644 -3.055 -10.387 1.00 15.02 H new ATOM 0 HG12 ILE A 72 -4.803 -4.508 -12.945 1.00 63.35 H new ATOM 0 HG13 ILE A 72 -5.198 -2.802 -12.888 1.00 63.35 H new ATOM 0 HG21 ILE A 72 -4.261 -5.064 -10.012 1.00 1.40 H new ATOM 0 HG22 ILE A 72 -5.943 -5.325 -9.494 1.00 1.40 H new ATOM 0 HG23 ILE A 72 -5.367 -6.018 -11.029 1.00 1.40 H new ATOM 0 HD11 ILE A 72 -2.771 -3.140 -12.892 1.00 33.32 H new ATOM 0 HD12 ILE A 72 -3.289 -2.397 -11.360 1.00 33.32 H new ATOM 0 HD13 ILE A 72 -2.888 -4.130 -11.418 1.00 33.32 H new ATOM 1042 N ASP A 73 -8.643 -5.706 -10.719 1.00 62.42 N ATOM 1043 CA ASP A 73 -9.552 -6.375 -9.804 1.00 31.04 C ATOM 1044 C ASP A 73 -8.762 -6.805 -8.580 1.00 55.35 C ATOM 1045 O ASP A 73 -8.057 -7.819 -8.605 1.00 35.22 O ATOM 1046 CB ASP A 73 -10.216 -7.607 -10.443 1.00 4.51 C ATOM 1047 CG ASP A 73 -11.540 -7.305 -11.135 1.00 60.12 C ATOM 1048 OD1 ASP A 73 -12.322 -6.461 -10.653 1.00 63.21 O ATOM 1049 OD2 ASP A 73 -11.786 -7.951 -12.182 1.00 44.43 O ATOM 0 H ASP A 73 -8.393 -6.281 -11.523 1.00 62.42 H new ATOM 0 HA ASP A 73 -10.348 -5.680 -9.537 1.00 31.04 H new ATOM 0 HB2 ASP A 73 -9.529 -8.043 -11.169 1.00 4.51 H new ATOM 0 HB3 ASP A 73 -10.384 -8.359 -9.672 1.00 4.51 H new ATOM 1053 N TYR A 74 -8.862 -6.027 -7.509 1.00 55.54 N ATOM 1054 CA TYR A 74 -8.182 -6.291 -6.255 1.00 2.31 C ATOM 1055 C TYR A 74 -8.847 -7.401 -5.446 1.00 21.33 C ATOM 1056 O TYR A 74 -8.227 -7.932 -4.531 1.00 53.11 O ATOM 1057 CB TYR A 74 -8.128 -5.006 -5.432 1.00 2.21 C ATOM 1058 CG TYR A 74 -7.507 -3.827 -6.157 1.00 43.14 C ATOM 1059 CD1 TYR A 74 -6.260 -3.978 -6.784 1.00 24.20 C ATOM 1060 CD2 TYR A 74 -8.140 -2.569 -6.164 1.00 35.30 C ATOM 1061 CE1 TYR A 74 -5.658 -2.891 -7.426 1.00 74.12 C ATOM 1062 CE2 TYR A 74 -7.534 -1.461 -6.782 1.00 20.20 C ATOM 1063 CZ TYR A 74 -6.289 -1.628 -7.433 1.00 54.11 C ATOM 1064 OH TYR A 74 -5.736 -0.594 -8.116 1.00 44.51 O ATOM 0 H TYR A 74 -9.430 -5.180 -7.491 1.00 55.54 H new ATOM 0 HA TYR A 74 -7.175 -6.634 -6.492 1.00 2.31 H new ATOM 0 HB2 TYR A 74 -9.141 -4.739 -5.129 1.00 2.21 H new ATOM 0 HB3 TYR A 74 -7.562 -5.196 -4.520 1.00 2.21 H new ATOM 0 HD1 TYR A 74 -5.764 -4.937 -6.771 1.00 24.20 H new ATOM 0 HD2 TYR A 74 -9.103 -2.454 -5.689 1.00 35.30 H new ATOM 0 HE1 TYR A 74 -4.706 -3.018 -7.919 1.00 74.12 H new ATOM 0 HE2 TYR A 74 -8.013 -0.493 -6.760 1.00 20.20 H new ATOM 0 HH TYR A 74 -6.299 0.202 -8.017 1.00 44.51 H new ATOM 1073 N ASN A 75 -10.079 -7.807 -5.775 1.00 35.40 N ATOM 1074 CA ASN A 75 -10.788 -8.810 -4.973 1.00 15.44 C ATOM 1075 C ASN A 75 -10.135 -10.198 -5.052 1.00 31.03 C ATOM 1076 O ASN A 75 -10.492 -11.089 -4.291 1.00 31.42 O ATOM 1077 CB ASN A 75 -12.273 -8.899 -5.365 1.00 52.12 C ATOM 1078 CG ASN A 75 -13.139 -9.109 -4.126 1.00 33.04 C ATOM 1079 OD1 ASN A 75 -13.517 -10.225 -3.780 1.00 3.54 O ATOM 1080 ND2 ASN A 75 -13.463 -8.039 -3.419 1.00 24.34 N ATOM 0 H ASN A 75 -10.600 -7.461 -6.581 1.00 35.40 H new ATOM 0 HA ASN A 75 -10.719 -8.473 -3.939 1.00 15.44 H new ATOM 0 HB2 ASN A 75 -12.576 -7.986 -5.877 1.00 52.12 H new ATOM 0 HB3 ASN A 75 -12.422 -9.722 -6.064 1.00 52.12 H new ATOM 0 HD21 ASN A 75 -14.032 -8.136 -2.578 1.00 24.34 H new ATOM 0 HD22 ASN A 75 -13.144 -7.116 -3.715 1.00 24.34 H new ATOM 1086 N ASN A 76 -9.182 -10.394 -5.967 1.00 34.02 N ATOM 1087 CA ASN A 76 -8.464 -11.650 -6.168 1.00 42.42 C ATOM 1088 C ASN A 76 -7.260 -11.792 -5.234 1.00 75.43 C ATOM 1089 O ASN A 76 -6.519 -12.772 -5.353 1.00 11.40 O ATOM 1090 CB ASN A 76 -7.997 -11.731 -7.634 1.00 23.20 C ATOM 1091 CG ASN A 76 -9.152 -11.605 -8.612 1.00 62.04 C ATOM 1092 OD1 ASN A 76 -10.257 -12.063 -8.336 1.00 15.42 O ATOM 1093 ND2 ASN A 76 -8.941 -11.019 -9.774 1.00 35.14 N ATOM 0 H ASN A 76 -8.881 -9.659 -6.607 1.00 34.02 H new ATOM 0 HA ASN A 76 -9.148 -12.466 -5.935 1.00 42.42 H new ATOM 0 HB2 ASN A 76 -7.272 -10.940 -7.827 1.00 23.20 H new ATOM 0 HB3 ASN A 76 -7.486 -12.679 -7.799 1.00 23.20 H new ATOM 0 HD21 ASN A 76 -9.699 -10.943 -10.452 1.00 35.14 H new ATOM 0 HD22 ASN A 76 -8.020 -10.641 -9.995 1.00 35.14 H new ATOM 1099 N TYR A 77 -7.014 -10.815 -4.359 1.00 20.30 N ATOM 1100 CA TYR A 77 -5.733 -10.606 -3.710 1.00 21.14 C ATOM 1101 C TYR A 77 -5.928 -10.628 -2.191 1.00 73.34 C ATOM 1102 O TYR A 77 -6.596 -9.769 -1.628 1.00 61.24 O ATOM 1103 CB TYR A 77 -5.113 -9.315 -4.268 1.00 64.24 C ATOM 1104 CG TYR A 77 -4.647 -9.457 -5.712 1.00 43.41 C ATOM 1105 CD1 TYR A 77 -3.383 -10.009 -5.992 1.00 74.14 C ATOM 1106 CD2 TYR A 77 -5.467 -9.053 -6.780 1.00 63.05 C ATOM 1107 CE1 TYR A 77 -2.899 -10.084 -7.310 1.00 55.44 C ATOM 1108 CE2 TYR A 77 -5.006 -9.152 -8.105 1.00 62.44 C ATOM 1109 CZ TYR A 77 -3.705 -9.636 -8.378 1.00 43.33 C ATOM 1110 OH TYR A 77 -3.267 -9.723 -9.663 1.00 62.51 O ATOM 0 H TYR A 77 -7.721 -10.135 -4.080 1.00 20.30 H new ATOM 0 HA TYR A 77 -5.022 -11.405 -3.923 1.00 21.14 H new ATOM 0 HB2 TYR A 77 -5.845 -8.510 -4.205 1.00 64.24 H new ATOM 0 HB3 TYR A 77 -4.267 -9.026 -3.645 1.00 64.24 H new ATOM 0 HD1 TYR A 77 -2.775 -10.381 -5.181 1.00 74.14 H new ATOM 0 HD2 TYR A 77 -6.455 -8.665 -6.582 1.00 63.05 H new ATOM 0 HE1 TYR A 77 -1.914 -10.483 -7.504 1.00 55.44 H new ATOM 0 HE2 TYR A 77 -5.650 -8.856 -8.920 1.00 62.44 H new ATOM 0 HH TYR A 77 -2.495 -10.325 -9.705 1.00 62.51 H new ATOM 1119 N ASP A 78 -5.375 -11.666 -1.556 1.00 41.21 N ATOM 1120 CA ASP A 78 -5.443 -11.966 -0.119 1.00 51.31 C ATOM 1121 C ASP A 78 -4.717 -10.936 0.745 1.00 62.41 C ATOM 1122 O ASP A 78 -5.138 -10.616 1.854 1.00 74.03 O ATOM 1123 CB ASP A 78 -4.771 -13.325 0.113 1.00 40.32 C ATOM 1124 CG ASP A 78 -4.726 -13.720 1.587 1.00 1.30 C ATOM 1125 OD1 ASP A 78 -5.821 -13.947 2.146 1.00 62.31 O ATOM 1126 OD2 ASP A 78 -3.608 -13.916 2.117 1.00 53.22 O ATOM 0 H ASP A 78 -4.833 -12.365 -2.063 1.00 41.21 H new ATOM 0 HA ASP A 78 -6.495 -11.957 0.167 1.00 51.31 H new ATOM 0 HB2 ASP A 78 -5.308 -14.091 -0.447 1.00 40.32 H new ATOM 0 HB3 ASP A 78 -3.755 -13.295 -0.281 1.00 40.32 H new ATOM 1130 N LEU A 79 -3.615 -10.393 0.241 1.00 15.11 N ATOM 1131 CA LEU A 79 -2.697 -9.525 0.967 1.00 74.15 C ATOM 1132 C LEU A 79 -2.224 -8.439 0.013 1.00 41.22 C ATOM 1133 O LEU A 79 -1.873 -8.754 -1.128 1.00 4.44 O ATOM 1134 CB LEU A 79 -1.531 -10.369 1.496 1.00 0.45 C ATOM 1135 CG LEU A 79 -0.405 -9.536 2.128 1.00 35.32 C ATOM 1136 CD1 LEU A 79 -0.844 -8.817 3.407 1.00 13.43 C ATOM 1137 CD2 LEU A 79 0.784 -10.445 2.424 1.00 11.23 C ATOM 0 H LEU A 79 -3.325 -10.552 -0.724 1.00 15.11 H new ATOM 0 HA LEU A 79 -3.180 -9.052 1.822 1.00 74.15 H new ATOM 0 HB2 LEU A 79 -1.910 -11.073 2.237 1.00 0.45 H new ATOM 0 HB3 LEU A 79 -1.119 -10.959 0.677 1.00 0.45 H new ATOM 0 HG LEU A 79 -0.127 -8.762 1.413 1.00 35.32 H new ATOM 0 HD11 LEU A 79 -0.007 -8.245 3.808 1.00 13.43 H new ATOM 0 HD12 LEU A 79 -1.669 -8.142 3.180 1.00 13.43 H new ATOM 0 HD13 LEU A 79 -1.168 -9.551 4.144 1.00 13.43 H new ATOM 0 HD21 LEU A 79 1.587 -9.860 2.873 1.00 11.23 H new ATOM 0 HD22 LEU A 79 0.478 -11.231 3.115 1.00 11.23 H new ATOM 0 HD23 LEU A 79 1.138 -10.895 1.496 1.00 11.23 H new ATOM 1148 N ILE A 80 -2.210 -7.177 0.432 1.00 64.30 N ATOM 1149 CA ILE A 80 -1.871 -6.067 -0.452 1.00 43.14 C ATOM 1150 C ILE A 80 -0.989 -5.098 0.337 1.00 61.43 C ATOM 1151 O ILE A 80 -1.412 -4.529 1.343 1.00 11.44 O ATOM 1152 CB ILE A 80 -3.145 -5.441 -1.078 1.00 44.34 C ATOM 1153 CG1 ILE A 80 -4.007 -6.505 -1.806 1.00 52.25 C ATOM 1154 CG2 ILE A 80 -2.749 -4.301 -2.037 1.00 55.53 C ATOM 1155 CD1 ILE A 80 -5.268 -5.953 -2.455 1.00 11.24 C ATOM 0 H ILE A 80 -2.432 -6.896 1.387 1.00 64.30 H new ATOM 0 HA ILE A 80 -1.297 -6.400 -1.317 1.00 43.14 H new ATOM 0 HB ILE A 80 -3.756 -5.032 -0.273 1.00 44.34 H new ATOM 0 HG12 ILE A 80 -3.399 -6.986 -2.572 1.00 52.25 H new ATOM 0 HG13 ILE A 80 -4.289 -7.278 -1.091 1.00 52.25 H new ATOM 0 HG21 ILE A 80 -3.647 -3.865 -2.474 1.00 55.53 H new ATOM 0 HG22 ILE A 80 -2.204 -3.534 -1.486 1.00 55.53 H new ATOM 0 HG23 ILE A 80 -2.115 -4.697 -2.830 1.00 55.53 H new ATOM 0 HD11 ILE A 80 -5.811 -6.763 -2.941 1.00 11.24 H new ATOM 0 HD12 ILE A 80 -5.900 -5.498 -1.693 1.00 11.24 H new ATOM 0 HD13 ILE A 80 -4.997 -5.202 -3.197 1.00 11.24 H new ATOM 1166 N LEU A 81 0.275 -4.967 -0.071 1.00 51.54 N ATOM 1167 CA LEU A 81 1.259 -4.090 0.546 1.00 23.12 C ATOM 1168 C LEU A 81 1.408 -2.860 -0.337 1.00 13.13 C ATOM 1169 O LEU A 81 1.561 -2.992 -1.556 1.00 72.11 O ATOM 1170 CB LEU A 81 2.616 -4.801 0.677 1.00 72.13 C ATOM 1171 CG LEU A 81 2.733 -5.649 1.951 1.00 15.45 C ATOM 1172 CD1 LEU A 81 1.866 -6.905 1.937 1.00 51.41 C ATOM 1173 CD2 LEU A 81 4.187 -6.071 2.196 1.00 2.35 C ATOM 0 H LEU A 81 0.649 -5.487 -0.865 1.00 51.54 H new ATOM 0 HA LEU A 81 0.928 -3.811 1.546 1.00 23.12 H new ATOM 0 HB2 LEU A 81 2.770 -5.440 -0.193 1.00 72.13 H new ATOM 0 HB3 LEU A 81 3.412 -4.056 0.670 1.00 72.13 H new ATOM 0 HG LEU A 81 2.374 -5.005 2.754 1.00 15.45 H new ATOM 0 HD11 LEU A 81 2.003 -7.452 2.870 1.00 51.41 H new ATOM 0 HD12 LEU A 81 0.818 -6.623 1.832 1.00 51.41 H new ATOM 0 HD13 LEU A 81 2.157 -7.539 1.099 1.00 51.41 H new ATOM 0 HD21 LEU A 81 4.244 -6.671 3.104 1.00 2.35 H new ATOM 0 HD22 LEU A 81 4.543 -6.659 1.350 1.00 2.35 H new ATOM 0 HD23 LEU A 81 4.810 -5.183 2.308 1.00 2.35 H new ATOM 1184 N ILE A 82 1.402 -1.674 0.275 1.00 0.44 N ATOM 1185 CA ILE A 82 1.443 -0.405 -0.441 1.00 1.25 C ATOM 1186 C ILE A 82 2.627 0.430 0.048 1.00 35.34 C ATOM 1187 O ILE A 82 2.986 0.348 1.221 1.00 33.02 O ATOM 1188 CB ILE A 82 0.090 0.334 -0.306 1.00 71.40 C ATOM 1189 CG1 ILE A 82 -1.112 -0.530 -0.765 1.00 42.20 C ATOM 1190 CG2 ILE A 82 0.097 1.645 -1.109 1.00 0.31 C ATOM 1191 CD1 ILE A 82 -1.831 -1.200 0.415 1.00 62.43 C ATOM 0 H ILE A 82 1.368 -1.570 1.289 1.00 0.44 H new ATOM 0 HA ILE A 82 1.595 -0.586 -1.505 1.00 1.25 H new ATOM 0 HB ILE A 82 -0.031 0.548 0.756 1.00 71.40 H new ATOM 0 HG12 ILE A 82 -1.819 0.095 -1.311 1.00 42.20 H new ATOM 0 HG13 ILE A 82 -0.763 -1.296 -1.457 1.00 42.20 H new ATOM 0 HG21 ILE A 82 -0.865 2.145 -0.998 1.00 0.31 H new ATOM 0 HG22 ILE A 82 0.889 2.295 -0.737 1.00 0.31 H new ATOM 0 HG23 ILE A 82 0.272 1.426 -2.162 1.00 0.31 H new ATOM 0 HD11 ILE A 82 -2.666 -1.794 0.043 1.00 62.43 H new ATOM 0 HD12 ILE A 82 -1.133 -1.847 0.946 1.00 62.43 H new ATOM 0 HD13 ILE A 82 -2.205 -0.435 1.095 1.00 62.43 H new ATOM 1202 N GLY A 83 3.211 1.260 -0.823 1.00 75.02 N ATOM 1203 CA GLY A 83 4.311 2.163 -0.490 1.00 13.31 C ATOM 1204 C GLY A 83 4.038 3.584 -0.982 1.00 3.14 C ATOM 1205 O GLY A 83 3.411 3.750 -2.033 1.00 60.01 O ATOM 0 H GLY A 83 2.924 1.322 -1.800 1.00 75.02 H new ATOM 0 HA2 GLY A 83 4.461 2.173 0.590 1.00 13.31 H new ATOM 0 HA3 GLY A 83 5.234 1.793 -0.936 1.00 13.31 H new ATOM 1209 N SER A 84 4.526 4.607 -0.270 1.00 22.33 N ATOM 1210 CA SER A 84 4.462 6.015 -0.670 1.00 13.13 C ATOM 1211 C SER A 84 5.498 6.869 0.103 1.00 21.34 C ATOM 1212 O SER A 84 6.018 6.409 1.121 1.00 41.42 O ATOM 1213 CB SER A 84 3.033 6.528 -0.491 1.00 21.25 C ATOM 1214 OG SER A 84 2.381 6.194 0.711 1.00 15.41 O ATOM 0 H SER A 84 4.990 4.472 0.628 1.00 22.33 H new ATOM 0 HA SER A 84 4.726 6.103 -1.724 1.00 13.13 H new ATOM 0 HB2 SER A 84 3.050 7.614 -0.577 1.00 21.25 H new ATOM 0 HB3 SER A 84 2.432 6.152 -1.319 1.00 21.25 H new ATOM 0 HG SER A 84 2.898 6.537 1.470 1.00 15.41 H new ATOM 1219 N PRO A 85 5.823 8.101 -0.344 1.00 40.14 N ATOM 1220 CA PRO A 85 6.810 8.970 0.309 1.00 14.32 C ATOM 1221 C PRO A 85 6.240 9.741 1.516 1.00 53.10 C ATOM 1222 O PRO A 85 5.020 9.793 1.701 1.00 61.32 O ATOM 1223 CB PRO A 85 7.247 9.918 -0.812 1.00 21.33 C ATOM 1224 CG PRO A 85 6.014 10.083 -1.680 1.00 3.11 C ATOM 1225 CD PRO A 85 5.422 8.675 -1.626 1.00 23.02 C ATOM 0 HA PRO A 85 7.633 8.397 0.737 1.00 14.32 H new ATOM 0 HB2 PRO A 85 7.581 10.876 -0.413 1.00 21.33 H new ATOM 0 HB3 PRO A 85 8.079 9.502 -1.381 1.00 21.33 H new ATOM 0 HG2 PRO A 85 5.329 10.833 -1.284 1.00 3.11 H new ATOM 0 HG3 PRO A 85 6.264 10.385 -2.697 1.00 3.11 H new ATOM 0 HD2 PRO A 85 4.336 8.708 -1.713 1.00 23.02 H new ATOM 0 HD3 PRO A 85 5.790 8.068 -2.454 1.00 23.02 H new ATOM 1230 N VAL A 86 7.095 10.401 2.308 1.00 40.22 N ATOM 1231 CA VAL A 86 6.722 11.239 3.454 1.00 43.20 C ATOM 1232 C VAL A 86 7.256 12.670 3.281 1.00 44.40 C ATOM 1233 O VAL A 86 8.463 12.910 3.328 1.00 33.13 O ATOM 1234 CB VAL A 86 7.215 10.607 4.772 1.00 44.10 C ATOM 1235 CG1 VAL A 86 6.893 11.488 5.986 1.00 31.23 C ATOM 1236 CG2 VAL A 86 6.563 9.247 5.012 1.00 42.42 C ATOM 0 H VAL A 86 8.104 10.364 2.162 1.00 40.22 H new ATOM 0 HA VAL A 86 5.635 11.298 3.500 1.00 43.20 H new ATOM 0 HB VAL A 86 8.295 10.502 4.666 1.00 44.10 H new ATOM 0 HG11 VAL A 86 7.258 11.005 6.893 1.00 31.23 H new ATOM 0 HG12 VAL A 86 7.378 12.457 5.871 1.00 31.23 H new ATOM 0 HG13 VAL A 86 5.814 11.628 6.058 1.00 31.23 H new ATOM 0 HG21 VAL A 86 6.931 8.827 5.948 1.00 42.42 H new ATOM 0 HG22 VAL A 86 5.481 9.367 5.068 1.00 42.42 H new ATOM 0 HG23 VAL A 86 6.811 8.575 4.191 1.00 42.42 H new ATOM 1246 N TRP A 87 6.340 13.632 3.149 1.00 43.10 N ATOM 1247 CA TRP A 87 6.624 15.064 3.181 1.00 51.44 C ATOM 1248 C TRP A 87 6.694 15.589 4.622 1.00 4.34 C ATOM 1249 O TRP A 87 6.758 14.816 5.587 1.00 71.34 O ATOM 1250 CB TRP A 87 5.567 15.804 2.348 1.00 22.24 C ATOM 1251 CG TRP A 87 6.095 16.383 1.073 1.00 60.01 C ATOM 1252 CD1 TRP A 87 6.570 17.634 0.863 1.00 24.23 C ATOM 1253 CD2 TRP A 87 6.204 15.692 -0.200 1.00 54.54 C ATOM 1254 NE1 TRP A 87 6.972 17.751 -0.458 1.00 64.14 N ATOM 1255 CE2 TRP A 87 6.728 16.595 -1.164 1.00 51.33 C ATOM 1256 CE3 TRP A 87 5.874 14.394 -0.635 1.00 32.02 C ATOM 1257 CZ2 TRP A 87 6.887 16.238 -2.507 1.00 51.30 C ATOM 1258 CZ3 TRP A 87 5.993 14.038 -1.989 1.00 0.32 C ATOM 1259 CH2 TRP A 87 6.488 14.959 -2.925 1.00 62.13 C ATOM 0 H TRP A 87 5.350 13.427 3.013 1.00 43.10 H new ATOM 0 HA TRP A 87 7.605 15.248 2.742 1.00 51.44 H new ATOM 0 HB2 TRP A 87 4.756 15.115 2.114 1.00 22.24 H new ATOM 0 HB3 TRP A 87 5.140 16.606 2.950 1.00 22.24 H new ATOM 0 HD1 TRP A 87 6.626 18.415 1.606 1.00 24.23 H new ATOM 0 HE1 TRP A 87 7.396 18.589 -0.857 1.00 64.14 H new ATOM 0 HE3 TRP A 87 5.525 13.664 0.080 1.00 32.02 H new ATOM 0 HZ2 TRP A 87 7.311 16.937 -3.213 1.00 51.30 H new ATOM 0 HZ3 TRP A 87 5.702 13.049 -2.311 1.00 0.32 H new ATOM 0 HH2 TRP A 87 6.562 14.684 -3.967 1.00 62.13 H new ATOM 1269 N SER A 88 6.709 16.916 4.773 1.00 11.23 N ATOM 1270 CA SER A 88 6.709 17.684 6.008 1.00 3.12 C ATOM 1271 C SER A 88 5.460 17.433 6.864 1.00 3.22 C ATOM 1272 O SER A 88 4.517 18.223 6.881 1.00 55.33 O ATOM 1273 CB SER A 88 6.848 19.164 5.647 1.00 61.11 C ATOM 1274 OG SER A 88 7.985 19.377 4.824 1.00 1.12 O ATOM 0 H SER A 88 6.723 17.529 3.958 1.00 11.23 H new ATOM 0 HA SER A 88 7.550 17.363 6.622 1.00 3.12 H new ATOM 0 HB2 SER A 88 5.950 19.503 5.130 1.00 61.11 H new ATOM 0 HB3 SER A 88 6.935 19.758 6.557 1.00 61.11 H new ATOM 0 HG SER A 88 8.055 20.329 4.603 1.00 1.12 H new ATOM 1279 N GLY A 89 5.480 16.318 7.586 1.00 13.14 N ATOM 1280 CA GLY A 89 4.473 15.864 8.530 1.00 63.41 C ATOM 1281 C GLY A 89 3.550 14.825 7.927 1.00 44.54 C ATOM 1282 O GLY A 89 3.132 13.935 8.670 1.00 64.24 O ATOM 0 H GLY A 89 6.258 15.662 7.520 1.00 13.14 H new ATOM 0 HA2 GLY A 89 4.964 15.445 9.409 1.00 63.41 H new ATOM 0 HA3 GLY A 89 3.885 16.717 8.869 1.00 63.41 H new ATOM 1286 N TYR A 90 3.280 14.845 6.614 1.00 15.23 N ATOM 1287 CA TYR A 90 2.236 14.003 6.034 1.00 74.23 C ATOM 1288 C TYR A 90 2.705 13.497 4.663 1.00 60.02 C ATOM 1289 O TYR A 90 3.589 14.120 4.071 1.00 63.34 O ATOM 1290 CB TYR A 90 0.938 14.842 5.924 1.00 33.33 C ATOM 1291 CG TYR A 90 0.706 15.819 7.074 1.00 35.43 C ATOM 1292 CD1 TYR A 90 0.256 15.362 8.327 1.00 43.14 C ATOM 1293 CD2 TYR A 90 1.055 17.175 6.931 1.00 2.15 C ATOM 1294 CE1 TYR A 90 0.146 16.233 9.424 1.00 4.53 C ATOM 1295 CE2 TYR A 90 0.964 18.052 8.028 1.00 53.44 C ATOM 1296 CZ TYR A 90 0.506 17.589 9.279 1.00 62.11 C ATOM 1297 OH TYR A 90 0.450 18.427 10.349 1.00 40.22 O ATOM 0 H TYR A 90 3.770 15.434 5.940 1.00 15.23 H new ATOM 0 HA TYR A 90 2.035 13.134 6.660 1.00 74.23 H new ATOM 0 HB2 TYR A 90 0.963 15.402 4.989 1.00 33.33 H new ATOM 0 HB3 TYR A 90 0.087 14.163 5.866 1.00 33.33 H new ATOM 0 HD1 TYR A 90 -0.010 14.322 8.447 1.00 43.14 H new ATOM 0 HD2 TYR A 90 1.394 17.544 5.975 1.00 2.15 H new ATOM 0 HE1 TYR A 90 -0.213 15.866 10.374 1.00 4.53 H new ATOM 0 HE2 TYR A 90 1.247 19.088 7.911 1.00 53.44 H new ATOM 0 HH TYR A 90 0.732 19.325 10.076 1.00 40.22 H new ATOM 1306 N PRO A 91 2.173 12.388 4.126 1.00 72.11 N ATOM 1307 CA PRO A 91 2.382 12.018 2.737 1.00 55.42 C ATOM 1308 C PRO A 91 1.876 13.111 1.790 1.00 41.14 C ATOM 1309 O PRO A 91 0.956 13.853 2.130 1.00 1.25 O ATOM 1310 CB PRO A 91 1.643 10.683 2.536 1.00 23.14 C ATOM 1311 CG PRO A 91 0.901 10.368 3.831 1.00 13.21 C ATOM 1312 CD PRO A 91 1.286 11.467 4.798 1.00 34.42 C ATOM 0 HA PRO A 91 3.441 11.906 2.507 1.00 55.42 H new ATOM 0 HB2 PRO A 91 0.945 10.753 1.702 1.00 23.14 H new ATOM 0 HB3 PRO A 91 2.348 9.887 2.295 1.00 23.14 H new ATOM 0 HG2 PRO A 91 -0.177 10.347 3.670 1.00 13.21 H new ATOM 0 HG3 PRO A 91 1.185 9.389 4.217 1.00 13.21 H new ATOM 0 HD2 PRO A 91 0.396 11.989 5.150 1.00 34.42 H new ATOM 0 HD3 PRO A 91 1.775 11.044 5.675 1.00 34.42 H new ATOM 1317 N ALA A 92 2.392 13.123 0.558 1.00 33.05 N ATOM 1318 CA ALA A 92 1.786 13.786 -0.594 1.00 42.32 C ATOM 1319 C ALA A 92 0.596 12.953 -1.080 1.00 12.25 C ATOM 1320 O ALA A 92 0.599 12.463 -2.212 1.00 44.54 O ATOM 1321 CB ALA A 92 2.833 13.972 -1.689 1.00 41.14 C ATOM 0 H ALA A 92 3.270 12.657 0.330 1.00 33.05 H new ATOM 0 HA ALA A 92 1.420 14.775 -0.316 1.00 42.32 H new ATOM 0 HB1 ALA A 92 2.378 14.467 -2.547 1.00 41.14 H new ATOM 0 HB2 ALA A 92 3.652 14.583 -1.310 1.00 41.14 H new ATOM 0 HB3 ALA A 92 3.218 12.999 -1.993 1.00 41.14 H new ATOM 1327 N THR A 93 -0.303 12.613 -0.153 1.00 2.33 N ATOM 1328 CA THR A 93 -1.685 12.184 -0.370 1.00 72.41 C ATOM 1329 C THR A 93 -1.853 11.183 -1.549 1.00 24.01 C ATOM 1330 O THR A 93 -2.780 11.350 -2.340 1.00 60.32 O ATOM 1331 CB THR A 93 -2.522 13.489 -0.513 1.00 20.22 C ATOM 1332 OG1 THR A 93 -1.864 14.381 -1.392 1.00 33.42 O ATOM 1333 CG2 THR A 93 -2.651 14.243 0.820 1.00 71.22 C ATOM 0 H THR A 93 -0.066 12.632 0.839 1.00 2.33 H new ATOM 0 HA THR A 93 -2.045 11.596 0.475 1.00 72.41 H new ATOM 0 HB THR A 93 -3.505 13.186 -0.874 1.00 20.22 H new ATOM 0 HG1 THR A 93 -2.426 15.170 -1.538 1.00 33.42 H new ATOM 0 HG21 THR A 93 -3.243 15.146 0.671 1.00 71.22 H new ATOM 0 HG22 THR A 93 -3.142 13.604 1.553 1.00 71.22 H new ATOM 0 HG23 THR A 93 -1.659 14.514 1.182 1.00 71.22 H new ATOM 1341 N PRO A 94 -1.109 10.056 -1.660 1.00 24.25 N ATOM 1342 CA PRO A 94 -1.063 9.282 -2.913 1.00 73.44 C ATOM 1343 C PRO A 94 -1.828 7.961 -2.831 1.00 72.23 C ATOM 1344 O PRO A 94 -2.044 7.296 -3.844 1.00 34.25 O ATOM 1345 CB PRO A 94 0.429 9.010 -3.118 1.00 13.42 C ATOM 1346 CG PRO A 94 0.858 8.706 -1.692 1.00 43.13 C ATOM 1347 CD PRO A 94 0.014 9.635 -0.827 1.00 43.30 C ATOM 0 HA PRO A 94 -1.533 9.830 -3.730 1.00 73.44 H new ATOM 0 HB2 PRO A 94 0.608 8.172 -3.792 1.00 13.42 H new ATOM 0 HB3 PRO A 94 0.953 9.871 -3.533 1.00 13.42 H new ATOM 0 HG2 PRO A 94 0.681 7.661 -1.440 1.00 43.13 H new ATOM 0 HG3 PRO A 94 1.923 8.892 -1.551 1.00 43.13 H new ATOM 0 HD2 PRO A 94 -0.336 9.122 0.069 1.00 43.30 H new ATOM 0 HD3 PRO A 94 0.597 10.494 -0.495 1.00 43.30 H new ATOM 1352 N ILE A 95 -2.206 7.555 -1.620 1.00 40.54 N ATOM 1353 CA ILE A 95 -3.010 6.381 -1.345 1.00 23.35 C ATOM 1354 C ILE A 95 -4.398 6.898 -0.933 1.00 4.44 C ATOM 1355 O ILE A 95 -5.120 6.199 -0.249 1.00 41.34 O ATOM 1356 CB ILE A 95 -2.329 5.492 -0.262 1.00 54.33 C ATOM 1357 CG1 ILE A 95 -0.787 5.344 -0.349 1.00 40.14 C ATOM 1358 CG2 ILE A 95 -2.935 4.074 -0.180 1.00 3.23 C ATOM 1359 CD1 ILE A 95 -0.210 4.945 -1.719 1.00 23.03 C ATOM 0 H ILE A 95 -1.946 8.061 -0.773 1.00 40.54 H new ATOM 0 HA ILE A 95 -3.110 5.733 -2.216 1.00 23.35 H new ATOM 0 HB ILE A 95 -2.541 6.065 0.641 1.00 54.33 H new ATOM 0 HG12 ILE A 95 -0.336 6.291 -0.052 1.00 40.14 H new ATOM 0 HG13 ILE A 95 -0.474 4.599 0.383 1.00 40.14 H new ATOM 0 HG21 ILE A 95 -2.420 3.502 0.592 1.00 3.23 H new ATOM 0 HG22 ILE A 95 -3.994 4.145 0.067 1.00 3.23 H new ATOM 0 HG23 ILE A 95 -2.819 3.573 -1.141 1.00 3.23 H new ATOM 0 HD11 ILE A 95 0.876 4.874 -1.650 1.00 23.03 H new ATOM 0 HD12 ILE A 95 -0.618 3.980 -2.019 1.00 23.03 H new ATOM 0 HD13 ILE A 95 -0.478 5.698 -2.460 1.00 23.03 H new ATOM 1370 N LYS A 96 -4.779 8.142 -1.257 1.00 1.15 N ATOM 1371 CA LYS A 96 -6.101 8.666 -0.934 1.00 73.13 C ATOM 1372 C LYS A 96 -7.043 8.131 -2.006 1.00 64.03 C ATOM 1373 O LYS A 96 -7.844 7.246 -1.727 1.00 15.43 O ATOM 1374 CB LYS A 96 -6.018 10.197 -0.789 1.00 32.14 C ATOM 1375 CG LYS A 96 -7.344 10.930 -0.556 1.00 1.14 C ATOM 1376 CD LYS A 96 -8.104 10.466 0.702 1.00 41.51 C ATOM 1377 CE LYS A 96 -8.779 11.605 1.489 1.00 23.23 C ATOM 1378 NZ LYS A 96 -9.571 12.517 0.639 1.00 61.03 N ATOM 0 H LYS A 96 -4.179 8.805 -1.747 1.00 1.15 H new ATOM 0 HA LYS A 96 -6.497 8.338 0.027 1.00 73.13 H new ATOM 0 HB2 LYS A 96 -5.350 10.426 0.041 1.00 32.14 H new ATOM 0 HB3 LYS A 96 -5.557 10.602 -1.690 1.00 32.14 H new ATOM 0 HG2 LYS A 96 -7.147 11.999 -0.475 1.00 1.14 H new ATOM 0 HG3 LYS A 96 -7.984 10.788 -1.427 1.00 1.14 H new ATOM 0 HD2 LYS A 96 -8.865 9.743 0.407 1.00 41.51 H new ATOM 0 HD3 LYS A 96 -7.409 9.946 1.361 1.00 41.51 H new ATOM 0 HE2 LYS A 96 -9.429 11.175 2.251 1.00 23.23 H new ATOM 0 HE3 LYS A 96 -8.013 12.180 2.010 1.00 23.23 H new ATOM 0 HZ1 LYS A 96 -10.170 13.119 1.240 1.00 61.03 H new ATOM 0 HZ2 LYS A 96 -8.930 13.115 0.079 1.00 61.03 H new ATOM 0 HZ3 LYS A 96 -10.172 11.960 -0.001 1.00 61.03 H new ATOM 1388 N THR A 97 -6.841 8.547 -3.251 1.00 53.25 N ATOM 1389 CA THR A 97 -7.661 8.134 -4.382 1.00 13.42 C ATOM 1390 C THR A 97 -7.628 6.613 -4.568 1.00 43.44 C ATOM 1391 O THR A 97 -8.665 5.999 -4.809 1.00 22.30 O ATOM 1392 CB THR A 97 -7.188 8.912 -5.620 1.00 33.24 C ATOM 1393 OG1 THR A 97 -7.067 10.272 -5.254 1.00 34.34 O ATOM 1394 CG2 THR A 97 -8.167 8.793 -6.784 1.00 12.51 C ATOM 0 H THR A 97 -6.092 9.190 -3.506 1.00 53.25 H new ATOM 0 HA THR A 97 -8.710 8.372 -4.205 1.00 13.42 H new ATOM 0 HB THR A 97 -6.237 8.496 -5.952 1.00 33.24 H new ATOM 0 HG1 THR A 97 -7.900 10.743 -5.467 1.00 34.34 H new ATOM 0 HG21 THR A 97 -7.790 9.359 -7.636 1.00 12.51 H new ATOM 0 HG22 THR A 97 -8.274 7.745 -7.064 1.00 12.51 H new ATOM 0 HG23 THR A 97 -9.137 9.190 -6.485 1.00 12.51 H new ATOM 1402 N LEU A 98 -6.458 5.981 -4.409 1.00 4.22 N ATOM 1403 CA LEU A 98 -6.332 4.529 -4.514 1.00 11.14 C ATOM 1404 C LEU A 98 -7.220 3.825 -3.484 1.00 20.30 C ATOM 1405 O LEU A 98 -7.861 2.848 -3.851 1.00 22.32 O ATOM 1406 CB LEU A 98 -4.854 4.125 -4.342 1.00 74.45 C ATOM 1407 CG LEU A 98 -4.569 2.620 -4.547 1.00 14.54 C ATOM 1408 CD1 LEU A 98 -4.790 2.175 -5.996 1.00 15.44 C ATOM 1409 CD2 LEU A 98 -3.114 2.313 -4.169 1.00 0.31 C ATOM 0 H LEU A 98 -5.581 6.461 -4.206 1.00 4.22 H new ATOM 0 HA LEU A 98 -6.670 4.215 -5.502 1.00 11.14 H new ATOM 0 HB2 LEU A 98 -4.251 4.695 -5.049 1.00 74.45 H new ATOM 0 HB3 LEU A 98 -4.527 4.410 -3.342 1.00 74.45 H new ATOM 0 HG LEU A 98 -5.266 2.076 -3.909 1.00 14.54 H new ATOM 0 HD11 LEU A 98 -4.576 1.110 -6.086 1.00 15.44 H new ATOM 0 HD12 LEU A 98 -5.825 2.363 -6.280 1.00 15.44 H new ATOM 0 HD13 LEU A 98 -4.126 2.735 -6.654 1.00 15.44 H new ATOM 0 HD21 LEU A 98 -2.917 1.251 -4.315 1.00 0.31 H new ATOM 0 HD22 LEU A 98 -2.443 2.897 -4.800 1.00 0.31 H new ATOM 0 HD23 LEU A 98 -2.947 2.573 -3.124 1.00 0.31 H new ATOM 1420 N LEU A 99 -7.291 4.289 -2.227 1.00 35.32 N ATOM 1421 CA LEU A 99 -8.043 3.598 -1.183 1.00 32.00 C ATOM 1422 C LEU A 99 -9.513 3.461 -1.589 1.00 60.12 C ATOM 1423 O LEU A 99 -10.093 2.384 -1.452 1.00 72.32 O ATOM 1424 CB LEU A 99 -7.778 4.230 0.191 1.00 74.31 C ATOM 1425 CG LEU A 99 -8.803 5.277 0.669 1.00 35.33 C ATOM 1426 CD1 LEU A 99 -9.789 4.518 1.550 1.00 35.10 C ATOM 1427 CD2 LEU A 99 -8.191 6.456 1.428 1.00 53.11 C ATOM 0 H LEU A 99 -6.832 5.144 -1.914 1.00 35.32 H new ATOM 0 HA LEU A 99 -7.691 2.572 -1.073 1.00 32.00 H new ATOM 0 HB2 LEU A 99 -7.733 3.432 0.932 1.00 74.31 H new ATOM 0 HB3 LEU A 99 -6.795 4.699 0.168 1.00 74.31 H new ATOM 0 HG LEU A 99 -9.277 5.738 -0.197 1.00 35.33 H new ATOM 0 HD11 LEU A 99 -10.547 5.206 1.924 1.00 35.10 H new ATOM 0 HD12 LEU A 99 -10.269 3.732 0.966 1.00 35.10 H new ATOM 0 HD13 LEU A 99 -9.257 4.072 2.391 1.00 35.10 H new ATOM 0 HD21 LEU A 99 -8.981 7.145 1.728 1.00 53.11 H new ATOM 0 HD22 LEU A 99 -7.674 6.089 2.314 1.00 53.11 H new ATOM 0 HD23 LEU A 99 -7.482 6.975 0.783 1.00 53.11 H new ATOM 1438 N ASP A 100 -10.083 4.503 -2.192 1.00 72.45 N ATOM 1439 CA ASP A 100 -11.480 4.545 -2.605 1.00 53.14 C ATOM 1440 C ASP A 100 -11.750 3.491 -3.684 1.00 43.22 C ATOM 1441 O ASP A 100 -12.844 2.930 -3.727 1.00 3.43 O ATOM 1442 CB ASP A 100 -11.790 5.960 -3.114 1.00 60.43 C ATOM 1443 CG ASP A 100 -13.275 6.222 -3.365 1.00 44.54 C ATOM 1444 OD1 ASP A 100 -14.106 5.993 -2.459 1.00 23.13 O ATOM 1445 OD2 ASP A 100 -13.620 6.782 -4.433 1.00 22.20 O ATOM 0 H ASP A 100 -9.573 5.359 -2.411 1.00 72.45 H new ATOM 0 HA ASP A 100 -12.131 4.315 -1.761 1.00 53.14 H new ATOM 0 HB2 ASP A 100 -11.422 6.685 -2.388 1.00 60.43 H new ATOM 0 HB3 ASP A 100 -11.241 6.130 -4.040 1.00 60.43 H new ATOM 1449 N GLN A 101 -10.754 3.156 -4.518 1.00 12.34 N ATOM 1450 CA GLN A 101 -10.848 2.115 -5.541 1.00 44.13 C ATOM 1451 C GLN A 101 -10.433 0.719 -5.052 1.00 55.44 C ATOM 1452 O GLN A 101 -10.565 -0.232 -5.830 1.00 21.03 O ATOM 1453 CB GLN A 101 -10.169 2.534 -6.858 1.00 33.22 C ATOM 1454 CG GLN A 101 -8.733 2.990 -6.759 1.00 41.22 C ATOM 1455 CD GLN A 101 -8.119 3.185 -8.143 1.00 35.14 C ATOM 1456 OE1 GLN A 101 -7.371 2.336 -8.618 1.00 12.40 O ATOM 1457 NE2 GLN A 101 -8.420 4.278 -8.829 1.00 43.11 N ATOM 0 H GLN A 101 -9.843 3.614 -4.496 1.00 12.34 H new ATOM 0 HA GLN A 101 -11.910 2.012 -5.764 1.00 44.13 H new ATOM 0 HB2 GLN A 101 -10.213 1.691 -7.548 1.00 33.22 H new ATOM 0 HB3 GLN A 101 -10.753 3.340 -7.302 1.00 33.22 H new ATOM 0 HG2 GLN A 101 -8.683 3.925 -6.201 1.00 41.22 H new ATOM 0 HG3 GLN A 101 -8.153 2.255 -6.201 1.00 41.22 H new ATOM 0 HE21 GLN A 101 -9.043 4.978 -8.426 1.00 43.11 H new ATOM 0 HE22 GLN A 101 -8.029 4.419 -9.760 1.00 43.11 H new ATOM 1464 N MET A 102 -10.003 0.537 -3.793 1.00 53.45 N ATOM 1465 CA MET A 102 -9.583 -0.769 -3.251 1.00 33.11 C ATOM 1466 C MET A 102 -10.335 -1.227 -1.992 1.00 64.32 C ATOM 1467 O MET A 102 -10.338 -2.424 -1.710 1.00 40.14 O ATOM 1468 CB MET A 102 -8.050 -0.837 -3.067 1.00 1.50 C ATOM 1469 CG MET A 102 -7.454 0.300 -2.251 1.00 35.02 C ATOM 1470 SD MET A 102 -6.317 -0.071 -0.891 1.00 1.10 S ATOM 1471 CE MET A 102 -4.948 -0.846 -1.784 1.00 64.45 C ATOM 0 H MET A 102 -9.936 1.297 -3.116 1.00 53.45 H new ATOM 0 HA MET A 102 -9.873 -1.493 -4.012 1.00 33.11 H new ATOM 0 HB2 MET A 102 -7.798 -1.782 -2.586 1.00 1.50 H new ATOM 0 HB3 MET A 102 -7.580 -0.845 -4.051 1.00 1.50 H new ATOM 0 HG2 MET A 102 -6.929 0.958 -2.944 1.00 35.02 H new ATOM 0 HG3 MET A 102 -8.284 0.872 -1.835 1.00 35.02 H new ATOM 0 HE1 MET A 102 -4.699 -1.797 -1.314 1.00 64.45 H new ATOM 0 HE2 MET A 102 -5.241 -1.019 -2.820 1.00 64.45 H new ATOM 0 HE3 MET A 102 -4.078 -0.189 -1.758 1.00 64.45 H new ATOM 1479 N LYS A 103 -11.051 -0.349 -1.288 1.00 74.23 N ATOM 1480 CA LYS A 103 -11.695 -0.606 0.010 1.00 22.21 C ATOM 1481 C LYS A 103 -12.658 -1.798 0.094 1.00 2.53 C ATOM 1482 O LYS A 103 -12.852 -2.350 1.170 1.00 4.24 O ATOM 1483 CB LYS A 103 -12.325 0.714 0.462 1.00 2.14 C ATOM 1484 CG LYS A 103 -13.658 1.033 -0.233 1.00 51.24 C ATOM 1485 CD LYS A 103 -14.815 0.631 0.690 1.00 22.01 C ATOM 1486 CE LYS A 103 -15.303 1.891 1.416 1.00 63.24 C ATOM 1487 NZ LYS A 103 -16.403 2.557 0.679 1.00 22.41 N ATOM 0 H LYS A 103 -11.207 0.604 -1.618 1.00 74.23 H new ATOM 0 HA LYS A 103 -10.918 -0.942 0.697 1.00 22.21 H new ATOM 0 HB2 LYS A 103 -12.487 0.679 1.539 1.00 2.14 H new ATOM 0 HB3 LYS A 103 -11.623 1.526 0.271 1.00 2.14 H new ATOM 0 HG2 LYS A 103 -13.715 2.096 -0.466 1.00 51.24 H new ATOM 0 HG3 LYS A 103 -13.727 0.495 -1.178 1.00 51.24 H new ATOM 0 HD2 LYS A 103 -15.626 0.186 0.113 1.00 22.01 H new ATOM 0 HD3 LYS A 103 -14.486 -0.119 1.409 1.00 22.01 H new ATOM 0 HE2 LYS A 103 -15.644 1.625 2.417 1.00 63.24 H new ATOM 0 HE3 LYS A 103 -14.472 2.586 1.536 1.00 63.24 H new ATOM 0 HZ1 LYS A 103 -16.707 3.404 1.200 1.00 22.41 H new ATOM 0 HZ2 LYS A 103 -16.070 2.833 -0.267 1.00 22.41 H new ATOM 0 HZ3 LYS A 103 -17.205 1.902 0.586 1.00 22.41 H new ATOM 1497 N ASN A 104 -13.278 -2.193 -1.015 1.00 60.24 N ATOM 1498 CA ASN A 104 -14.341 -3.221 -1.082 1.00 53.23 C ATOM 1499 C ASN A 104 -13.806 -4.665 -1.099 1.00 1.54 C ATOM 1500 O ASN A 104 -14.536 -5.611 -1.394 1.00 53.51 O ATOM 1501 CB ASN A 104 -15.222 -3.020 -2.327 1.00 23.12 C ATOM 1502 CG ASN A 104 -15.702 -1.593 -2.484 1.00 44.25 C ATOM 1503 OD1 ASN A 104 -16.684 -1.166 -1.887 1.00 15.50 O ATOM 1504 ND2 ASN A 104 -14.977 -0.807 -3.258 1.00 63.05 N ATOM 0 H ASN A 104 -13.054 -1.799 -1.929 1.00 60.24 H new ATOM 0 HA ASN A 104 -14.922 -3.088 -0.169 1.00 53.23 H new ATOM 0 HB2 ASN A 104 -14.659 -3.309 -3.215 1.00 23.12 H new ATOM 0 HB3 ASN A 104 -16.085 -3.684 -2.267 1.00 23.12 H new ATOM 0 HD21 ASN A 104 -15.230 0.175 -3.368 1.00 63.05 H new ATOM 0 HD22 ASN A 104 -14.164 -1.182 -3.746 1.00 63.05 H new ATOM 1510 N TYR A 105 -12.505 -4.835 -0.899 1.00 71.05 N ATOM 1511 CA TYR A 105 -11.797 -6.110 -0.879 1.00 44.43 C ATOM 1512 C TYR A 105 -12.136 -6.967 0.355 1.00 0.20 C ATOM 1513 O TYR A 105 -12.992 -6.604 1.161 1.00 22.24 O ATOM 1514 CB TYR A 105 -10.300 -5.791 -0.941 1.00 2.10 C ATOM 1515 CG TYR A 105 -9.654 -5.531 0.405 1.00 4.40 C ATOM 1516 CD1 TYR A 105 -10.297 -4.737 1.382 1.00 40.54 C ATOM 1517 CD2 TYR A 105 -8.471 -6.217 0.731 1.00 31.00 C ATOM 1518 CE1 TYR A 105 -9.785 -4.646 2.679 1.00 2.44 C ATOM 1519 CE2 TYR A 105 -7.943 -6.100 2.020 1.00 33.11 C ATOM 1520 CZ TYR A 105 -8.588 -5.313 2.988 1.00 23.21 C ATOM 1521 OH TYR A 105 -8.038 -5.191 4.213 1.00 1.22 O ATOM 0 H TYR A 105 -11.881 -4.044 -0.738 1.00 71.05 H new ATOM 0 HA TYR A 105 -12.108 -6.711 -1.733 1.00 44.43 H new ATOM 0 HB2 TYR A 105 -9.784 -6.622 -1.422 1.00 2.10 H new ATOM 0 HB3 TYR A 105 -10.154 -4.916 -1.574 1.00 2.10 H new ATOM 0 HD1 TYR A 105 -11.194 -4.195 1.123 1.00 40.54 H new ATOM 0 HD2 TYR A 105 -7.975 -6.829 -0.008 1.00 31.00 H new ATOM 0 HE1 TYR A 105 -10.302 -4.071 3.433 1.00 2.44 H new ATOM 0 HE2 TYR A 105 -7.031 -6.620 2.274 1.00 33.11 H new ATOM 0 HH TYR A 105 -7.661 -6.052 4.489 1.00 1.22 H new ATOM 1530 N ARG A 106 -11.413 -8.082 0.520 1.00 32.13 N ATOM 1531 CA ARG A 106 -11.232 -8.833 1.762 1.00 75.44 C ATOM 1532 C ARG A 106 -9.768 -9.254 1.812 1.00 43.52 C ATOM 1533 O ARG A 106 -9.237 -9.627 0.761 1.00 51.15 O ATOM 1534 CB ARG A 106 -12.120 -10.072 1.773 1.00 31.33 C ATOM 1535 CG ARG A 106 -13.587 -9.657 1.721 1.00 74.34 C ATOM 1536 CD ARG A 106 -14.490 -10.854 1.992 1.00 62.32 C ATOM 1537 NE ARG A 106 -15.531 -10.924 0.958 1.00 62.04 N ATOM 1538 CZ ARG A 106 -15.350 -11.331 -0.301 1.00 75.42 C ATOM 1539 NH1 ARG A 106 -14.270 -12.031 -0.632 1.00 60.21 N ATOM 1540 NH2 ARG A 106 -16.250 -11.025 -1.226 1.00 0.42 N ATOM 0 H ARG A 106 -10.910 -8.507 -0.259 1.00 32.13 H new ATOM 0 HA ARG A 106 -11.502 -8.221 2.622 1.00 75.44 H new ATOM 0 HB2 ARG A 106 -11.882 -10.709 0.921 1.00 31.33 H new ATOM 0 HB3 ARG A 106 -11.930 -10.659 2.672 1.00 31.33 H new ATOM 0 HG2 ARG A 106 -13.777 -8.877 2.458 1.00 74.34 H new ATOM 0 HG3 ARG A 106 -13.817 -9.234 0.743 1.00 74.34 H new ATOM 0 HD2 ARG A 106 -13.903 -11.773 1.996 1.00 62.32 H new ATOM 0 HD3 ARG A 106 -14.946 -10.763 2.978 1.00 62.32 H new ATOM 0 HE ARG A 106 -16.473 -10.637 1.224 1.00 62.04 H new ATOM 0 HH11 ARG A 106 -13.574 -12.260 0.077 1.00 60.21 H new ATOM 0 HH12 ARG A 106 -14.137 -12.339 -1.595 1.00 60.21 H new ATOM 0 HH21 ARG A 106 -17.075 -10.481 -0.974 1.00 0.42 H new ATOM 0 HH22 ARG A 106 -16.117 -11.333 -2.189 1.00 0.42 H new ATOM 1551 N GLY A 107 -9.138 -9.219 2.984 1.00 64.43 N ATOM 1552 CA GLY A 107 -7.742 -9.609 3.150 1.00 12.51 C ATOM 1553 C GLY A 107 -6.995 -8.700 4.122 1.00 12.11 C ATOM 1554 O GLY A 107 -7.593 -7.840 4.779 1.00 64.25 O ATOM 0 H GLY A 107 -9.585 -8.917 3.850 1.00 64.43 H new ATOM 0 HA2 GLY A 107 -7.695 -10.637 3.509 1.00 12.51 H new ATOM 0 HA3 GLY A 107 -7.244 -9.587 2.181 1.00 12.51 H new ATOM 1558 N GLU A 108 -5.680 -8.855 4.224 1.00 24.42 N ATOM 1559 CA GLU A 108 -4.836 -8.012 5.075 1.00 40.53 C ATOM 1560 C GLU A 108 -4.125 -6.957 4.227 1.00 41.54 C ATOM 1561 O GLU A 108 -3.927 -7.147 3.023 1.00 14.52 O ATOM 1562 CB GLU A 108 -3.857 -8.886 5.866 1.00 21.41 C ATOM 1563 CG GLU A 108 -4.620 -9.795 6.853 1.00 40.54 C ATOM 1564 CD GLU A 108 -3.905 -10.010 8.191 1.00 72.20 C ATOM 1565 OE1 GLU A 108 -2.719 -10.408 8.191 1.00 54.54 O ATOM 1566 OE2 GLU A 108 -4.522 -9.732 9.246 1.00 35.03 O ATOM 0 H GLU A 108 -5.162 -9.573 3.717 1.00 24.42 H new ATOM 0 HA GLU A 108 -5.453 -7.479 5.799 1.00 40.53 H new ATOM 0 HB2 GLU A 108 -3.269 -9.496 5.180 1.00 21.41 H new ATOM 0 HB3 GLU A 108 -3.156 -8.255 6.412 1.00 21.41 H new ATOM 0 HG2 GLU A 108 -5.602 -9.361 7.044 1.00 40.54 H new ATOM 0 HG3 GLU A 108 -4.786 -10.764 6.383 1.00 40.54 H new ATOM 1571 N VAL A 109 -3.768 -5.826 4.832 1.00 4.43 N ATOM 1572 CA VAL A 109 -3.175 -4.678 4.155 1.00 15.44 C ATOM 1573 C VAL A 109 -2.097 -4.100 5.061 1.00 64.44 C ATOM 1574 O VAL A 109 -2.320 -3.949 6.261 1.00 53.54 O ATOM 1575 CB VAL A 109 -4.290 -3.659 3.817 1.00 21.45 C ATOM 1576 CG1 VAL A 109 -3.756 -2.268 3.442 1.00 0.15 C ATOM 1577 CG2 VAL A 109 -5.119 -4.157 2.630 1.00 24.01 C ATOM 0 H VAL A 109 -3.887 -5.680 5.834 1.00 4.43 H new ATOM 0 HA VAL A 109 -2.706 -4.959 3.212 1.00 15.44 H new ATOM 0 HB VAL A 109 -4.887 -3.570 4.725 1.00 21.45 H new ATOM 0 HG11 VAL A 109 -4.592 -1.606 3.218 1.00 0.15 H new ATOM 0 HG12 VAL A 109 -3.184 -1.861 4.276 1.00 0.15 H new ATOM 0 HG13 VAL A 109 -3.112 -2.349 2.566 1.00 0.15 H new ATOM 0 HG21 VAL A 109 -5.900 -3.432 2.402 1.00 24.01 H new ATOM 0 HG22 VAL A 109 -4.473 -4.280 1.761 1.00 24.01 H new ATOM 0 HG23 VAL A 109 -5.575 -5.115 2.881 1.00 24.01 H new ATOM 1587 N ALA A 110 -0.940 -3.729 4.510 1.00 75.32 N ATOM 1588 CA ALA A 110 0.101 -3.020 5.248 1.00 52.40 C ATOM 1589 C ALA A 110 0.637 -1.864 4.408 1.00 51.20 C ATOM 1590 O ALA A 110 0.413 -1.802 3.194 1.00 34.14 O ATOM 1591 CB ALA A 110 1.210 -3.985 5.673 1.00 35.45 C ATOM 0 H ALA A 110 -0.700 -3.914 3.536 1.00 75.32 H new ATOM 0 HA ALA A 110 -0.324 -2.600 6.160 1.00 52.40 H new ATOM 0 HB1 ALA A 110 1.977 -3.439 6.222 1.00 35.45 H new ATOM 0 HB2 ALA A 110 0.791 -4.762 6.312 1.00 35.45 H new ATOM 0 HB3 ALA A 110 1.653 -4.442 4.788 1.00 35.45 H new ATOM 1597 N SER A 111 1.336 -0.929 5.054 1.00 24.25 N ATOM 1598 CA SER A 111 1.761 0.305 4.413 1.00 51.32 C ATOM 1599 C SER A 111 3.203 0.650 4.770 1.00 2.53 C ATOM 1600 O SER A 111 3.612 0.649 5.930 1.00 52.10 O ATOM 1601 CB SER A 111 0.798 1.444 4.773 1.00 15.35 C ATOM 1602 OG SER A 111 0.532 2.226 3.620 1.00 35.15 O ATOM 0 H SER A 111 1.619 -1.010 6.030 1.00 24.25 H new ATOM 0 HA SER A 111 1.731 0.163 3.333 1.00 51.32 H new ATOM 0 HB2 SER A 111 -0.131 1.036 5.170 1.00 15.35 H new ATOM 0 HB3 SER A 111 1.232 2.067 5.555 1.00 15.35 H new ATOM 0 HG SER A 111 -0.109 2.932 3.845 1.00 35.15 H new ATOM 1607 N PHE A 112 3.965 1.000 3.749 1.00 14.15 N ATOM 1608 CA PHE A 112 5.384 1.255 3.798 1.00 34.43 C ATOM 1609 C PHE A 112 5.624 2.716 3.437 1.00 15.35 C ATOM 1610 O PHE A 112 4.916 3.281 2.598 1.00 44.54 O ATOM 1611 CB PHE A 112 6.018 0.300 2.786 1.00 31.34 C ATOM 1612 CG PHE A 112 7.475 0.542 2.515 1.00 72.24 C ATOM 1613 CD1 PHE A 112 7.873 1.425 1.494 1.00 13.32 C ATOM 1614 CD2 PHE A 112 8.435 -0.125 3.285 1.00 32.03 C ATOM 1615 CE1 PHE A 112 9.238 1.644 1.253 1.00 3.42 C ATOM 1616 CE2 PHE A 112 9.793 0.085 3.026 1.00 12.25 C ATOM 1617 CZ PHE A 112 10.202 0.979 2.025 1.00 32.03 C ATOM 0 H PHE A 112 3.582 1.119 2.811 1.00 14.15 H new ATOM 0 HA PHE A 112 5.819 1.089 4.784 1.00 34.43 H new ATOM 0 HB2 PHE A 112 5.895 -0.721 3.146 1.00 31.34 H new ATOM 0 HB3 PHE A 112 5.471 0.375 1.846 1.00 31.34 H new ATOM 0 HD1 PHE A 112 7.130 1.933 0.897 1.00 13.32 H new ATOM 0 HD2 PHE A 112 8.129 -0.797 4.073 1.00 32.03 H new ATOM 0 HE1 PHE A 112 9.546 2.325 0.473 1.00 3.42 H new ATOM 0 HE2 PHE A 112 10.535 -0.447 3.603 1.00 12.25 H new ATOM 0 HZ PHE A 112 11.253 1.154 1.850 1.00 32.03 H new ATOM 1626 N PHE A 113 6.631 3.317 4.060 1.00 42.21 N ATOM 1627 CA PHE A 113 7.047 4.694 3.840 1.00 13.45 C ATOM 1628 C PHE A 113 8.572 4.780 3.980 1.00 52.53 C ATOM 1629 O PHE A 113 9.205 3.803 4.370 1.00 53.44 O ATOM 1630 CB PHE A 113 6.319 5.618 4.832 1.00 2.53 C ATOM 1631 CG PHE A 113 4.806 5.696 4.646 1.00 24.11 C ATOM 1632 CD1 PHE A 113 3.943 4.743 5.231 1.00 33.31 C ATOM 1633 CD2 PHE A 113 4.252 6.709 3.840 1.00 4.25 C ATOM 1634 CE1 PHE A 113 2.562 4.783 4.978 1.00 51.34 C ATOM 1635 CE2 PHE A 113 2.870 6.749 3.592 1.00 71.23 C ATOM 1636 CZ PHE A 113 2.028 5.762 4.129 1.00 43.50 C ATOM 0 H PHE A 113 7.201 2.839 4.758 1.00 42.21 H new ATOM 0 HA PHE A 113 6.781 5.022 2.835 1.00 13.45 H new ATOM 0 HB2 PHE A 113 6.529 5.276 5.845 1.00 2.53 H new ATOM 0 HB3 PHE A 113 6.734 6.622 4.742 1.00 2.53 H new ATOM 0 HD1 PHE A 113 4.348 3.978 5.877 1.00 33.31 H new ATOM 0 HD2 PHE A 113 4.895 7.462 3.409 1.00 4.25 H new ATOM 0 HE1 PHE A 113 1.909 4.057 5.439 1.00 51.34 H new ATOM 0 HE2 PHE A 113 2.454 7.541 2.987 1.00 71.23 H new ATOM 0 HZ PHE A 113 0.975 5.757 3.889 1.00 43.50 H new ATOM 1645 N THR A 114 9.183 5.924 3.665 1.00 64.33 N ATOM 1646 CA THR A 114 10.640 6.101 3.686 1.00 64.02 C ATOM 1647 C THR A 114 11.015 7.545 4.076 1.00 43.34 C ATOM 1648 O THR A 114 11.615 8.274 3.283 1.00 64.44 O ATOM 1649 CB THR A 114 11.246 5.687 2.320 1.00 4.15 C ATOM 1650 OG1 THR A 114 10.403 6.075 1.245 1.00 55.43 O ATOM 1651 CG2 THR A 114 11.493 4.183 2.179 1.00 33.13 C ATOM 0 H THR A 114 8.676 6.764 3.385 1.00 64.33 H new ATOM 0 HA THR A 114 11.066 5.449 4.449 1.00 64.02 H new ATOM 0 HB THR A 114 12.206 6.203 2.283 1.00 4.15 H new ATOM 0 HG1 THR A 114 10.215 5.297 0.679 1.00 55.43 H new ATOM 0 HG21 THR A 114 11.917 3.974 1.197 1.00 33.13 H new ATOM 0 HG22 THR A 114 12.188 3.854 2.952 1.00 33.13 H new ATOM 0 HG23 THR A 114 10.550 3.648 2.288 1.00 33.13 H new ATOM 1659 N SER A 115 10.644 7.998 5.281 1.00 31.44 N ATOM 1660 CA SER A 115 11.122 9.299 5.767 1.00 52.51 C ATOM 1661 C SER A 115 12.577 9.200 6.233 1.00 14.35 C ATOM 1662 O SER A 115 13.100 8.109 6.485 1.00 44.23 O ATOM 1663 CB SER A 115 10.187 9.956 6.799 1.00 55.13 C ATOM 1664 OG SER A 115 10.689 9.960 8.121 1.00 15.43 O ATOM 0 H SER A 115 10.030 7.497 5.923 1.00 31.44 H new ATOM 0 HA SER A 115 11.099 9.987 4.922 1.00 52.51 H new ATOM 0 HB2 SER A 115 9.993 10.984 6.493 1.00 55.13 H new ATOM 0 HB3 SER A 115 9.230 9.435 6.788 1.00 55.13 H new ATOM 0 HG SER A 115 10.064 10.436 8.707 1.00 15.43 H new ATOM 1669 N ALA A 116 13.186 10.365 6.448 1.00 72.21 N ATOM 1670 CA ALA A 116 14.531 10.581 6.948 1.00 31.03 C ATOM 1671 C ALA A 116 14.521 10.545 8.478 1.00 35.24 C ATOM 1672 O ALA A 116 15.107 11.407 9.141 1.00 74.43 O ATOM 1673 CB ALA A 116 15.021 11.929 6.412 1.00 34.35 C ATOM 0 H ALA A 116 12.709 11.247 6.261 1.00 72.21 H new ATOM 0 HA ALA A 116 15.210 9.798 6.610 1.00 31.03 H new ATOM 0 HB1 ALA A 116 16.032 12.118 6.773 1.00 34.35 H new ATOM 0 HB2 ALA A 116 15.022 11.908 5.322 1.00 34.35 H new ATOM 0 HB3 ALA A 116 14.358 12.721 6.759 1.00 34.35 H new ATOM 1679 N GLY A 117 13.778 9.606 9.068 1.00 51.31 N ATOM 1680 CA GLY A 117 13.718 9.462 10.510 1.00 35.21 C ATOM 1681 C GLY A 117 13.019 10.644 11.175 1.00 54.51 C ATOM 1682 O GLY A 117 13.411 11.098 12.260 1.00 35.15 O ATOM 0 H GLY A 117 13.208 8.932 8.557 1.00 51.31 H new ATOM 0 HA2 GLY A 117 13.191 8.542 10.761 1.00 35.21 H new ATOM 0 HA3 GLY A 117 14.729 9.369 10.907 1.00 35.21 H new ATOM 1686 N THR A 118 12.001 11.176 10.510 1.00 15.32 N ATOM 1687 CA THR A 118 11.326 12.414 10.858 1.00 73.44 C ATOM 1688 C THR A 118 9.814 12.230 10.718 1.00 35.22 C ATOM 1689 O THR A 118 9.338 11.438 9.900 1.00 22.34 O ATOM 1690 CB THR A 118 11.882 13.549 9.973 1.00 34.24 C ATOM 1691 OG1 THR A 118 12.232 13.091 8.678 1.00 0.31 O ATOM 1692 CG2 THR A 118 13.128 14.177 10.603 1.00 23.43 C ATOM 0 H THR A 118 11.609 10.735 9.678 1.00 15.32 H new ATOM 0 HA THR A 118 11.514 12.686 11.897 1.00 73.44 H new ATOM 0 HB THR A 118 11.084 14.287 9.892 1.00 34.24 H new ATOM 0 HG1 THR A 118 12.578 13.840 8.149 1.00 0.31 H new ATOM 0 HG21 THR A 118 13.499 14.974 9.959 1.00 23.43 H new ATOM 0 HG22 THR A 118 12.874 14.589 11.580 1.00 23.43 H new ATOM 0 HG23 THR A 118 13.900 13.416 10.720 1.00 23.43 H new ATOM 1700 N ASN A 119 9.053 12.968 11.534 1.00 53.22 N ATOM 1701 CA ASN A 119 7.587 13.011 11.601 1.00 11.31 C ATOM 1702 C ASN A 119 6.913 11.638 11.726 1.00 74.11 C ATOM 1703 O ASN A 119 5.705 11.512 11.526 1.00 40.20 O ATOM 1704 CB ASN A 119 7.024 13.819 10.421 1.00 34.42 C ATOM 1705 CG ASN A 119 7.439 15.284 10.473 1.00 52.24 C ATOM 1706 OD1 ASN A 119 7.255 15.963 11.478 1.00 41.42 O ATOM 1707 ND2 ASN A 119 8.034 15.808 9.420 1.00 73.23 N ATOM 0 H ASN A 119 9.477 13.598 12.215 1.00 53.22 H new ATOM 0 HA ASN A 119 7.341 13.519 12.534 1.00 11.31 H new ATOM 0 HB2 ASN A 119 7.368 13.379 9.485 1.00 34.42 H new ATOM 0 HB3 ASN A 119 5.936 13.752 10.424 1.00 34.42 H new ATOM 0 HD21 ASN A 119 8.343 16.780 9.440 1.00 73.23 H new ATOM 0 HD22 ASN A 119 8.186 15.241 8.586 1.00 73.23 H new ATOM 1713 N HIS A 120 7.656 10.587 12.068 1.00 31.22 N ATOM 1714 CA HIS A 120 7.213 9.221 11.879 1.00 2.45 C ATOM 1715 C HIS A 120 6.116 8.807 12.878 1.00 40.14 C ATOM 1716 O HIS A 120 5.465 7.782 12.698 1.00 51.20 O ATOM 1717 CB HIS A 120 8.406 8.246 11.854 1.00 2.55 C ATOM 1718 CG HIS A 120 8.965 7.893 10.486 1.00 32.02 C ATOM 1719 ND1 HIS A 120 10.149 7.221 10.277 1.00 14.25 N ATOM 1720 CD2 HIS A 120 8.353 8.004 9.260 1.00 22.23 C ATOM 1721 CE1 HIS A 120 10.247 6.945 8.967 1.00 4.55 C ATOM 1722 NE2 HIS A 120 9.158 7.371 8.312 1.00 60.02 N ATOM 0 H HIS A 120 8.584 10.667 12.485 1.00 31.22 H new ATOM 0 HA HIS A 120 6.740 9.168 10.898 1.00 2.45 H new ATOM 0 HB2 HIS A 120 9.211 8.676 12.451 1.00 2.55 H new ATOM 0 HB3 HIS A 120 8.102 7.323 12.347 1.00 2.55 H new ATOM 0 HD1 HIS A 120 10.833 6.976 10.993 1.00 14.25 H new ATOM 0 HD2 HIS A 120 7.412 8.496 9.064 1.00 22.23 H new ATOM 0 HE1 HIS A 120 11.087 6.448 8.505 1.00 4.55 H new ATOM 1729 N LYS A 121 5.837 9.588 13.922 1.00 52.14 N ATOM 1730 CA LYS A 121 4.669 9.387 14.760 1.00 12.43 C ATOM 1731 C LYS A 121 3.384 9.794 14.048 1.00 0.21 C ATOM 1732 O LYS A 121 2.361 9.145 14.267 1.00 0.31 O ATOM 1733 CB LYS A 121 4.840 10.281 15.992 1.00 34.43 C ATOM 1734 CG LYS A 121 5.400 9.567 17.227 1.00 54.54 C ATOM 1735 CD LYS A 121 5.455 10.528 18.423 1.00 20.02 C ATOM 1736 CE LYS A 121 4.052 10.981 18.840 1.00 55.31 C ATOM 1737 NZ LYS A 121 4.051 11.899 19.990 1.00 31.25 N ATOM 0 H LYS A 121 6.419 10.376 14.205 1.00 52.14 H new ATOM 0 HA LYS A 121 4.591 8.331 15.016 1.00 12.43 H new ATOM 0 HB2 LYS A 121 5.502 11.108 15.735 1.00 34.43 H new ATOM 0 HB3 LYS A 121 3.873 10.715 16.247 1.00 34.43 H new ATOM 0 HG2 LYS A 121 4.776 8.707 17.472 1.00 54.54 H new ATOM 0 HG3 LYS A 121 6.398 9.186 17.013 1.00 54.54 H new ATOM 0 HD2 LYS A 121 5.946 10.038 19.264 1.00 20.02 H new ATOM 0 HD3 LYS A 121 6.059 11.398 18.165 1.00 20.02 H new ATOM 0 HE2 LYS A 121 3.570 11.470 17.994 1.00 55.31 H new ATOM 0 HE3 LYS A 121 3.453 10.104 19.084 1.00 55.31 H new ATOM 0 HZ1 LYS A 121 3.073 12.166 20.220 1.00 31.25 H new ATOM 0 HZ2 LYS A 121 4.483 11.428 20.810 1.00 31.25 H new ATOM 0 HZ3 LYS A 121 4.597 12.752 19.754 1.00 31.25 H new ATOM 1747 N ALA A 122 3.437 10.849 13.229 1.00 42.40 N ATOM 1748 CA ALA A 122 2.283 11.438 12.579 1.00 40.44 C ATOM 1749 C ALA A 122 1.754 10.373 11.656 1.00 72.30 C ATOM 1750 O ALA A 122 0.659 9.904 11.886 1.00 21.43 O ATOM 1751 CB ALA A 122 2.581 12.755 11.820 1.00 3.45 C ATOM 0 H ALA A 122 4.311 11.323 13.000 1.00 42.40 H new ATOM 0 HA ALA A 122 1.553 11.740 13.330 1.00 40.44 H new ATOM 0 HB1 ALA A 122 1.664 13.127 11.364 1.00 3.45 H new ATOM 0 HB2 ALA A 122 2.967 13.498 12.518 1.00 3.45 H new ATOM 0 HB3 ALA A 122 3.322 12.568 11.043 1.00 3.45 H new ATOM 1757 N TYR A 123 2.506 9.994 10.622 1.00 43.54 N ATOM 1758 CA TYR A 123 2.016 9.168 9.518 1.00 55.40 C ATOM 1759 C TYR A 123 1.266 7.932 10.042 1.00 43.11 C ATOM 1760 O TYR A 123 0.146 7.671 9.619 1.00 53.14 O ATOM 1761 CB TYR A 123 3.220 8.773 8.635 1.00 64.02 C ATOM 1762 CG TYR A 123 3.910 7.442 8.859 1.00 14.52 C ATOM 1763 CD1 TYR A 123 3.533 6.254 8.207 1.00 24.14 C ATOM 1764 CD2 TYR A 123 5.008 7.426 9.718 1.00 61.21 C ATOM 1765 CE1 TYR A 123 4.311 5.095 8.374 1.00 22.21 C ATOM 1766 CE2 TYR A 123 5.805 6.284 9.876 1.00 11.33 C ATOM 1767 CZ TYR A 123 5.477 5.121 9.165 1.00 73.23 C ATOM 1768 OH TYR A 123 6.296 4.042 9.231 1.00 21.44 O ATOM 0 H TYR A 123 3.487 10.256 10.527 1.00 43.54 H new ATOM 0 HA TYR A 123 1.301 9.733 8.920 1.00 55.40 H new ATOM 0 HB2 TYR A 123 2.885 8.796 7.598 1.00 64.02 H new ATOM 0 HB3 TYR A 123 3.974 9.553 8.744 1.00 64.02 H new ATOM 0 HD1 TYR A 123 2.652 6.232 7.583 1.00 24.14 H new ATOM 0 HD2 TYR A 123 5.251 8.318 10.277 1.00 61.21 H new ATOM 0 HE1 TYR A 123 4.012 4.176 7.892 1.00 22.21 H new ATOM 0 HE2 TYR A 123 6.660 6.300 10.536 1.00 11.33 H new ATOM 0 HH TYR A 123 7.220 4.322 9.065 1.00 21.44 H new ATOM 1777 N VAL A 124 1.824 7.227 11.034 1.00 13.22 N ATOM 1778 CA VAL A 124 1.254 5.989 11.570 1.00 41.51 C ATOM 1779 C VAL A 124 -0.162 6.214 12.118 1.00 53.11 C ATOM 1780 O VAL A 124 -0.965 5.281 12.135 1.00 33.45 O ATOM 1781 CB VAL A 124 2.190 5.464 12.674 1.00 22.32 C ATOM 1782 CG1 VAL A 124 1.651 4.238 13.424 1.00 44.53 C ATOM 1783 CG2 VAL A 124 3.573 5.132 12.107 1.00 31.24 C ATOM 0 H VAL A 124 2.693 7.505 11.490 1.00 13.22 H new ATOM 0 HA VAL A 124 1.170 5.254 10.770 1.00 41.51 H new ATOM 0 HB VAL A 124 2.257 6.278 13.396 1.00 22.32 H new ATOM 0 HG11 VAL A 124 2.370 3.931 14.184 1.00 44.53 H new ATOM 0 HG12 VAL A 124 0.704 4.491 13.901 1.00 44.53 H new ATOM 0 HG13 VAL A 124 1.496 3.420 12.720 1.00 44.53 H new ATOM 0 HG21 VAL A 124 4.215 4.763 12.907 1.00 31.24 H new ATOM 0 HG22 VAL A 124 3.476 4.366 11.337 1.00 31.24 H new ATOM 0 HG23 VAL A 124 4.013 6.030 11.673 1.00 31.24 H new ATOM 1793 N SER A 125 -0.471 7.421 12.591 1.00 53.34 N ATOM 1794 CA SER A 125 -1.793 7.755 13.098 1.00 4.54 C ATOM 1795 C SER A 125 -2.603 8.554 12.078 1.00 55.20 C ATOM 1796 O SER A 125 -3.778 8.283 11.857 1.00 44.24 O ATOM 1797 CB SER A 125 -1.572 8.593 14.363 1.00 24.35 C ATOM 1798 OG SER A 125 -1.249 7.756 15.464 1.00 72.12 O ATOM 0 H SER A 125 0.193 8.194 12.632 1.00 53.34 H new ATOM 0 HA SER A 125 -2.359 6.846 13.305 1.00 4.54 H new ATOM 0 HB2 SER A 125 -0.768 9.310 14.196 1.00 24.35 H new ATOM 0 HB3 SER A 125 -2.470 9.168 14.587 1.00 24.35 H new ATOM 0 HG SER A 125 -1.109 8.306 16.263 1.00 72.12 H new ATOM 1803 N HIS A 126 -1.990 9.547 11.459 1.00 3.33 N ATOM 1804 CA HIS A 126 -2.665 10.602 10.745 1.00 53.23 C ATOM 1805 C HIS A 126 -3.172 10.027 9.415 1.00 4.53 C ATOM 1806 O HIS A 126 -4.344 10.189 9.090 1.00 32.13 O ATOM 1807 CB HIS A 126 -1.716 11.816 10.686 1.00 52.51 C ATOM 1808 CG HIS A 126 -0.930 11.953 9.455 1.00 24.25 C ATOM 1809 ND1 HIS A 126 0.409 11.883 9.291 1.00 75.21 N ATOM 1810 CD2 HIS A 126 -1.512 12.147 8.248 1.00 24.14 C ATOM 1811 CE1 HIS A 126 0.612 11.804 7.977 1.00 23.31 C ATOM 1812 NE2 HIS A 126 -0.524 11.987 7.291 1.00 60.22 N ATOM 0 H HIS A 126 -0.974 9.639 11.442 1.00 3.33 H new ATOM 0 HA HIS A 126 -3.563 10.982 11.233 1.00 53.23 H new ATOM 0 HB2 HIS A 126 -2.307 12.722 10.820 1.00 52.51 H new ATOM 0 HB3 HIS A 126 -1.028 11.757 11.529 1.00 52.51 H new ATOM 0 HD2 HIS A 126 -2.550 12.382 8.066 1.00 24.14 H new ATOM 0 HE1 HIS A 126 1.573 11.616 7.521 1.00 23.31 H new ATOM 0 HE2 HIS A 126 -0.637 12.005 6.277 1.00 60.22 H new ATOM 1819 N PHE A 127 -2.342 9.309 8.654 1.00 13.33 N ATOM 1820 CA PHE A 127 -2.764 8.582 7.459 1.00 24.43 C ATOM 1821 C PHE A 127 -3.808 7.510 7.767 1.00 20.34 C ATOM 1822 O PHE A 127 -4.579 7.172 6.880 1.00 40.53 O ATOM 1823 CB PHE A 127 -1.513 8.049 6.754 1.00 71.23 C ATOM 1824 CG PHE A 127 -1.650 6.811 5.894 1.00 32.31 C ATOM 1825 CD1 PHE A 127 -1.464 5.548 6.494 1.00 24.21 C ATOM 1826 CD2 PHE A 127 -1.891 6.900 4.513 1.00 23.31 C ATOM 1827 CE1 PHE A 127 -1.539 4.378 5.722 1.00 42.51 C ATOM 1828 CE2 PHE A 127 -1.954 5.727 3.745 1.00 14.54 C ATOM 1829 CZ PHE A 127 -1.789 4.468 4.345 1.00 0.52 C ATOM 0 H PHE A 127 -1.346 9.217 8.855 1.00 13.33 H new ATOM 0 HA PHE A 127 -3.280 9.257 6.776 1.00 24.43 H new ATOM 0 HB2 PHE A 127 -1.118 8.848 6.127 1.00 71.23 H new ATOM 0 HB3 PHE A 127 -0.763 7.843 7.517 1.00 71.23 H new ATOM 0 HD1 PHE A 127 -1.263 5.481 7.553 1.00 24.21 H new ATOM 0 HD2 PHE A 127 -2.027 7.864 4.046 1.00 23.31 H new ATOM 0 HE1 PHE A 127 -1.405 3.412 6.187 1.00 42.51 H new ATOM 0 HE2 PHE A 127 -2.131 5.793 2.682 1.00 14.54 H new ATOM 0 HZ PHE A 127 -1.855 3.571 3.747 1.00 0.52 H new ATOM 1838 N ASN A 128 -3.917 7.047 9.014 1.00 53.41 N ATOM 1839 CA ASN A 128 -4.960 6.107 9.420 1.00 22.14 C ATOM 1840 C ASN A 128 -6.362 6.739 9.369 1.00 51.20 C ATOM 1841 O ASN A 128 -7.352 6.015 9.406 1.00 64.00 O ATOM 1842 CB ASN A 128 -4.646 5.561 10.826 1.00 74.10 C ATOM 1843 CG ASN A 128 -4.632 4.044 10.904 1.00 1.44 C ATOM 1844 OD1 ASN A 128 -5.396 3.354 10.231 1.00 11.34 O ATOM 1845 ND2 ASN A 128 -3.721 3.496 11.690 1.00 24.02 N ATOM 0 H ASN A 128 -3.285 7.314 9.769 1.00 53.41 H new ATOM 0 HA ASN A 128 -4.967 5.281 8.709 1.00 22.14 H new ATOM 0 HB2 ASN A 128 -3.676 5.941 11.145 1.00 74.10 H new ATOM 0 HB3 ASN A 128 -5.386 5.945 11.529 1.00 74.10 H new ATOM 0 HD21 ASN A 128 -3.641 2.481 11.747 1.00 24.02 H new ATOM 0 HD22 ASN A 128 -3.098 4.088 12.239 1.00 24.02 H new ATOM 1851 N GLU A 129 -6.472 8.072 9.290 1.00 11.13 N ATOM 1852 CA GLU A 129 -7.719 8.800 9.007 1.00 22.45 C ATOM 1853 C GLU A 129 -7.980 9.000 7.502 1.00 51.20 C ATOM 1854 O GLU A 129 -9.086 9.370 7.108 1.00 33.21 O ATOM 1855 CB GLU A 129 -7.673 10.168 9.717 1.00 3.44 C ATOM 1856 CG GLU A 129 -8.283 10.129 11.129 1.00 63.02 C ATOM 1857 CD GLU A 129 -9.349 11.205 11.325 1.00 32.12 C ATOM 1858 OE1 GLU A 129 -8.979 12.378 11.542 1.00 42.33 O ATOM 1859 OE2 GLU A 129 -10.554 10.869 11.253 1.00 13.24 O ATOM 0 H GLU A 129 -5.674 8.692 9.425 1.00 11.13 H new ATOM 0 HA GLU A 129 -8.542 8.193 9.384 1.00 22.45 H new ATOM 0 HB2 GLU A 129 -6.638 10.503 9.783 1.00 3.44 H new ATOM 0 HB3 GLU A 129 -8.208 10.902 9.115 1.00 3.44 H new ATOM 0 HG2 GLU A 129 -8.723 9.147 11.306 1.00 63.02 H new ATOM 0 HG3 GLU A 129 -7.493 10.263 11.868 1.00 63.02 H new ATOM 1864 N TRP A 130 -6.981 8.751 6.654 1.00 54.30 N ATOM 1865 CA TRP A 130 -6.974 9.032 5.216 1.00 44.53 C ATOM 1866 C TRP A 130 -6.609 7.789 4.395 1.00 61.21 C ATOM 1867 O TRP A 130 -6.107 7.902 3.274 1.00 21.04 O ATOM 1868 CB TRP A 130 -6.000 10.174 4.933 1.00 21.35 C ATOM 1869 CG TRP A 130 -6.146 11.409 5.765 1.00 40.42 C ATOM 1870 CD1 TRP A 130 -5.227 11.853 6.646 1.00 11.33 C ATOM 1871 CD2 TRP A 130 -7.225 12.394 5.797 1.00 44.14 C ATOM 1872 NE1 TRP A 130 -5.612 13.072 7.150 1.00 75.31 N ATOM 1873 CE2 TRP A 130 -6.796 13.492 6.598 1.00 20.24 C ATOM 1874 CE3 TRP A 130 -8.489 12.512 5.181 1.00 24.42 C ATOM 1875 CZ2 TRP A 130 -7.523 14.682 6.700 1.00 54.13 C ATOM 1876 CZ3 TRP A 130 -9.261 13.681 5.320 1.00 11.13 C ATOM 1877 CH2 TRP A 130 -8.766 14.777 6.051 1.00 75.44 C ATOM 0 H TRP A 130 -6.109 8.325 6.968 1.00 54.30 H new ATOM 0 HA TRP A 130 -7.980 9.326 4.915 1.00 44.53 H new ATOM 0 HB2 TRP A 130 -4.986 9.795 5.063 1.00 21.35 H new ATOM 0 HB3 TRP A 130 -6.103 10.456 3.885 1.00 21.35 H new ATOM 0 HD1 TRP A 130 -4.322 11.328 6.916 1.00 11.33 H new ATOM 0 HE1 TRP A 130 -5.084 13.598 7.846 1.00 75.31 H new ATOM 0 HE3 TRP A 130 -8.871 11.691 4.592 1.00 24.42 H new ATOM 0 HZ2 TRP A 130 -7.136 15.515 7.268 1.00 54.13 H new ATOM 0 HZ3 TRP A 130 -10.238 13.737 4.863 1.00 11.13 H new ATOM 0 HH2 TRP A 130 -9.340 15.690 6.113 1.00 75.44 H new ATOM 1887 N ALA A 131 -6.812 6.616 4.989 1.00 71.14 N ATOM 1888 CA ALA A 131 -6.654 5.279 4.433 1.00 72.42 C ATOM 1889 C ALA A 131 -7.647 4.326 5.103 1.00 74.11 C ATOM 1890 O ALA A 131 -7.453 3.106 5.085 1.00 4.24 O ATOM 1891 CB ALA A 131 -5.228 4.800 4.672 1.00 11.51 C ATOM 0 H ALA A 131 -7.119 6.576 5.961 1.00 71.14 H new ATOM 0 HA ALA A 131 -6.851 5.300 3.361 1.00 72.42 H new ATOM 0 HB1 ALA A 131 -5.106 3.799 4.257 1.00 11.51 H new ATOM 0 HB2 ALA A 131 -4.529 5.482 4.187 1.00 11.51 H new ATOM 0 HB3 ALA A 131 -5.027 4.776 5.743 1.00 11.51 H new ATOM 1897 N ASP A 132 -8.639 4.889 5.794 1.00 63.05 N ATOM 1898 CA ASP A 132 -9.564 4.169 6.632 1.00 14.42 C ATOM 1899 C ASP A 132 -10.493 3.366 5.725 1.00 75.13 C ATOM 1900 O ASP A 132 -10.821 3.786 4.610 1.00 0.33 O ATOM 1901 CB ASP A 132 -10.334 5.163 7.522 1.00 12.50 C ATOM 1902 CG ASP A 132 -10.855 4.511 8.803 1.00 11.50 C ATOM 1903 OD1 ASP A 132 -10.960 3.268 8.839 1.00 1.51 O ATOM 1904 OD2 ASP A 132 -11.098 5.241 9.795 1.00 40.42 O ATOM 0 H ASP A 132 -8.816 5.893 5.777 1.00 63.05 H new ATOM 0 HA ASP A 132 -9.045 3.480 7.298 1.00 14.42 H new ATOM 0 HB2 ASP A 132 -9.681 5.997 7.781 1.00 12.50 H new ATOM 0 HB3 ASP A 132 -11.172 5.576 6.961 1.00 12.50 H new ATOM 1908 N GLY A 133 -10.926 2.211 6.205 1.00 73.02 N ATOM 1909 CA GLY A 133 -11.823 1.290 5.509 1.00 33.04 C ATOM 1910 C GLY A 133 -11.142 0.027 4.981 1.00 54.11 C ATOM 1911 O GLY A 133 -11.755 -0.715 4.214 1.00 44.42 O ATOM 0 H GLY A 133 -10.653 1.872 7.128 1.00 73.02 H new ATOM 0 HA2 GLY A 133 -12.625 1.000 6.188 1.00 33.04 H new ATOM 0 HA3 GLY A 133 -12.287 1.815 4.674 1.00 33.04 H new ATOM 1915 N LEU A 134 -9.877 -0.205 5.338 1.00 72.12 N ATOM 1916 CA LEU A 134 -9.067 -1.353 4.961 1.00 20.11 C ATOM 1917 C LEU A 134 -8.412 -1.902 6.223 1.00 24.03 C ATOM 1918 O LEU A 134 -8.037 -1.126 7.105 1.00 34.34 O ATOM 1919 CB LEU A 134 -8.019 -0.877 3.946 1.00 2.41 C ATOM 1920 CG LEU A 134 -8.651 -0.729 2.545 1.00 55.54 C ATOM 1921 CD1 LEU A 134 -8.404 0.654 1.933 1.00 55.15 C ATOM 1922 CD2 LEU A 134 -8.125 -1.845 1.651 1.00 55.44 C ATOM 0 H LEU A 134 -9.365 0.446 5.934 1.00 72.12 H new ATOM 0 HA LEU A 134 -9.662 -2.144 4.505 1.00 20.11 H new ATOM 0 HB2 LEU A 134 -7.602 0.078 4.266 1.00 2.41 H new ATOM 0 HB3 LEU A 134 -7.194 -1.588 3.906 1.00 2.41 H new ATOM 0 HG LEU A 134 -9.733 -0.817 2.638 1.00 55.54 H new ATOM 0 HD11 LEU A 134 -8.869 0.705 0.949 1.00 55.15 H new ATOM 0 HD12 LEU A 134 -8.835 1.420 2.578 1.00 55.15 H new ATOM 0 HD13 LEU A 134 -7.331 0.823 1.837 1.00 55.15 H new ATOM 0 HD21 LEU A 134 -8.564 -1.753 0.657 1.00 55.44 H new ATOM 0 HD22 LEU A 134 -7.040 -1.771 1.577 1.00 55.44 H new ATOM 0 HD23 LEU A 134 -8.395 -2.811 2.078 1.00 55.44 H new ATOM 1933 N ASN A 135 -8.287 -3.224 6.327 1.00 24.24 N ATOM 1934 CA ASN A 135 -7.755 -3.936 7.488 1.00 2.52 C ATOM 1935 C ASN A 135 -6.235 -3.826 7.533 1.00 2.10 C ATOM 1936 O ASN A 135 -5.508 -4.698 7.051 1.00 60.05 O ATOM 1937 CB ASN A 135 -8.206 -5.394 7.442 1.00 2.22 C ATOM 1938 CG ASN A 135 -7.617 -6.230 8.567 1.00 73.03 C ATOM 1939 OD1 ASN A 135 -7.564 -5.819 9.722 1.00 53.11 O ATOM 1940 ND2 ASN A 135 -7.148 -7.418 8.232 1.00 51.24 N ATOM 0 H ASN A 135 -8.565 -3.854 5.574 1.00 24.24 H new ATOM 0 HA ASN A 135 -8.143 -3.482 8.400 1.00 2.52 H new ATOM 0 HB2 ASN A 135 -9.294 -5.435 7.497 1.00 2.22 H new ATOM 0 HB3 ASN A 135 -7.919 -5.828 6.484 1.00 2.22 H new ATOM 0 HD21 ASN A 135 -6.729 -8.019 8.941 1.00 51.24 H new ATOM 0 HD22 ASN A 135 -7.205 -7.734 7.264 1.00 51.24 H new ATOM 1946 N VAL A 136 -5.765 -2.711 8.082 1.00 74.00 N ATOM 1947 CA VAL A 136 -4.354 -2.440 8.291 1.00 62.10 C ATOM 1948 C VAL A 136 -3.837 -3.406 9.359 1.00 0.21 C ATOM 1949 O VAL A 136 -4.443 -3.546 10.425 1.00 52.30 O ATOM 1950 CB VAL A 136 -4.162 -0.955 8.662 1.00 23.11 C ATOM 1951 CG1 VAL A 136 -2.697 -0.618 8.971 1.00 1.41 C ATOM 1952 CG2 VAL A 136 -4.618 -0.063 7.495 1.00 75.22 C ATOM 0 H VAL A 136 -6.372 -1.955 8.400 1.00 74.00 H new ATOM 0 HA VAL A 136 -3.772 -2.605 7.384 1.00 62.10 H new ATOM 0 HB VAL A 136 -4.759 -0.772 9.555 1.00 23.11 H new ATOM 0 HG11 VAL A 136 -2.613 0.438 9.227 1.00 1.41 H new ATOM 0 HG12 VAL A 136 -2.354 -1.223 9.810 1.00 1.41 H new ATOM 0 HG13 VAL A 136 -2.083 -0.830 8.096 1.00 1.41 H new ATOM 0 HG21 VAL A 136 -4.480 0.985 7.762 1.00 75.22 H new ATOM 0 HG22 VAL A 136 -4.026 -0.292 6.609 1.00 75.22 H new ATOM 0 HG23 VAL A 136 -5.671 -0.248 7.285 1.00 75.22 H new ATOM 1962 N ILE A 137 -2.714 -4.066 9.089 1.00 3.31 N ATOM 1963 CA ILE A 137 -2.038 -4.960 10.029 1.00 4.42 C ATOM 1964 C ILE A 137 -0.833 -4.288 10.679 1.00 72.43 C ATOM 1965 O ILE A 137 -0.402 -4.699 11.753 1.00 41.43 O ATOM 1966 CB ILE A 137 -1.660 -6.277 9.332 1.00 14.42 C ATOM 1967 CG1 ILE A 137 -0.585 -6.111 8.244 1.00 31.03 C ATOM 1968 CG2 ILE A 137 -2.917 -6.869 8.692 1.00 23.45 C ATOM 1969 CD1 ILE A 137 -0.185 -7.398 7.527 1.00 71.30 C ATOM 0 H ILE A 137 -2.237 -3.993 8.191 1.00 3.31 H new ATOM 0 HA ILE A 137 -2.730 -5.195 10.837 1.00 4.42 H new ATOM 0 HB ILE A 137 -1.241 -6.933 10.095 1.00 14.42 H new ATOM 0 HG12 ILE A 137 -0.947 -5.398 7.503 1.00 31.03 H new ATOM 0 HG13 ILE A 137 0.305 -5.675 8.698 1.00 31.03 H new ATOM 0 HG21 ILE A 137 -2.665 -7.805 8.193 1.00 23.45 H new ATOM 0 HG22 ILE A 137 -3.663 -7.059 9.464 1.00 23.45 H new ATOM 0 HG23 ILE A 137 -3.320 -6.166 7.963 1.00 23.45 H new ATOM 0 HD11 ILE A 137 0.577 -7.176 6.780 1.00 71.30 H new ATOM 0 HD12 ILE A 137 0.213 -8.109 8.251 1.00 71.30 H new ATOM 0 HD13 ILE A 137 -1.059 -7.828 7.038 1.00 71.30 H new ATOM 1980 N GLY A 138 -0.294 -3.255 10.041 1.00 44.50 N ATOM 1981 CA GLY A 138 0.861 -2.516 10.483 1.00 3.52 C ATOM 1982 C GLY A 138 1.288 -1.579 9.372 1.00 44.44 C ATOM 1983 O GLY A 138 1.028 -1.845 8.196 1.00 63.03 O ATOM 0 H GLY A 138 -0.675 -2.902 9.163 1.00 44.50 H new ATOM 0 HA2 GLY A 138 0.626 -1.951 11.385 1.00 3.52 H new ATOM 0 HA3 GLY A 138 1.673 -3.198 10.736 1.00 3.52 H new ATOM 1987 N VAL A 139 1.948 -0.477 9.710 1.00 24.23 N ATOM 1988 CA VAL A 139 2.606 0.388 8.799 1.00 11.12 C ATOM 1989 C VAL A 139 4.006 0.658 9.353 1.00 53.50 C ATOM 1990 O VAL A 139 4.179 0.790 10.571 1.00 2.33 O ATOM 1991 CB VAL A 139 1.744 1.634 8.581 1.00 1.25 C ATOM 1992 CG1 VAL A 139 0.249 1.365 8.338 1.00 22.32 C ATOM 1993 CG2 VAL A 139 1.909 2.779 9.571 1.00 31.22 C ATOM 0 H VAL A 139 2.030 -0.167 10.678 1.00 24.23 H new ATOM 0 HA VAL A 139 2.735 -0.049 7.809 1.00 11.12 H new ATOM 0 HB VAL A 139 2.186 1.982 7.647 1.00 1.25 H new ATOM 0 HG11 VAL A 139 -0.273 2.311 8.195 1.00 22.32 H new ATOM 0 HG12 VAL A 139 0.130 0.748 7.448 1.00 22.32 H new ATOM 0 HG13 VAL A 139 -0.172 0.845 9.199 1.00 22.32 H new ATOM 0 HG21 VAL A 139 1.240 3.595 9.298 1.00 31.22 H new ATOM 0 HG22 VAL A 139 1.666 2.430 10.575 1.00 31.22 H new ATOM 0 HG23 VAL A 139 2.940 3.133 9.550 1.00 31.22 H new ATOM 2003 N ALA A 140 5.013 0.719 8.483 1.00 12.21 N ATOM 2004 CA ALA A 140 6.410 0.856 8.878 1.00 11.53 C ATOM 2005 C ALA A 140 7.193 1.643 7.835 1.00 74.21 C ATOM 2006 O ALA A 140 6.606 2.250 6.936 1.00 64.21 O ATOM 2007 CB ALA A 140 7.023 -0.522 9.147 1.00 22.13 C ATOM 0 H ALA A 140 4.878 0.674 7.473 1.00 12.21 H new ATOM 0 HA ALA A 140 6.462 1.424 9.807 1.00 11.53 H new ATOM 0 HB1 ALA A 140 8.066 -0.405 9.441 1.00 22.13 H new ATOM 0 HB2 ALA A 140 6.473 -1.015 9.949 1.00 22.13 H new ATOM 0 HB3 ALA A 140 6.967 -1.128 8.243 1.00 22.13 H new ATOM 2013 N ARG A 141 8.506 1.727 8.017 1.00 41.51 N ATOM 2014 CA ARG A 141 9.458 2.073 6.988 1.00 74.30 C ATOM 2015 C ARG A 141 10.482 0.959 6.958 1.00 22.33 C ATOM 2016 O ARG A 141 10.649 0.270 7.969 1.00 14.55 O ATOM 2017 CB ARG A 141 10.125 3.438 7.236 1.00 60.10 C ATOM 2018 CG ARG A 141 11.102 3.518 8.423 1.00 4.54 C ATOM 2019 CD ARG A 141 10.421 3.646 9.792 1.00 72.31 C ATOM 2020 NE ARG A 141 10.288 2.348 10.476 1.00 60.11 N ATOM 2021 CZ ARG A 141 9.267 1.939 11.231 1.00 75.00 C ATOM 2022 NH1 ARG A 141 8.176 2.686 11.365 1.00 24.45 N ATOM 2023 NH2 ARG A 141 9.333 0.752 11.815 1.00 73.04 N ATOM 0 H ARG A 141 8.944 1.548 8.920 1.00 41.51 H new ATOM 0 HA ARG A 141 8.951 2.173 6.028 1.00 74.30 H new ATOM 0 HB2 ARG A 141 10.662 3.725 6.332 1.00 60.10 H new ATOM 0 HB3 ARG A 141 9.340 4.179 7.389 1.00 60.10 H new ATOM 0 HG2 ARG A 141 11.729 2.626 8.424 1.00 4.54 H new ATOM 0 HG3 ARG A 141 11.763 4.372 8.278 1.00 4.54 H new ATOM 0 HD2 ARG A 141 10.997 4.327 10.419 1.00 72.31 H new ATOM 0 HD3 ARG A 141 9.433 4.089 9.664 1.00 72.31 H new ATOM 0 HE ARG A 141 11.060 1.691 10.360 1.00 60.11 H new ATOM 0 HH11 ARG A 141 8.112 3.585 10.887 1.00 24.45 H new ATOM 0 HH12 ARG A 141 7.403 2.360 11.946 1.00 24.45 H new ATOM 0 HH21 ARG A 141 10.157 0.164 11.684 1.00 73.04 H new ATOM 0 HH22 ARG A 141 8.560 0.425 12.395 1.00 73.04 H new ATOM 2034 N ASP A 142 11.193 0.883 5.842 1.00 72.14 N ATOM 2035 CA ASP A 142 12.242 -0.093 5.585 1.00 33.42 C ATOM 2036 C ASP A 142 11.720 -1.524 5.822 1.00 63.34 C ATOM 2037 O ASP A 142 10.508 -1.763 5.798 1.00 73.01 O ATOM 2038 CB ASP A 142 13.534 0.315 6.317 1.00 35.13 C ATOM 2039 CG ASP A 142 14.091 1.639 5.780 1.00 12.25 C ATOM 2040 OD1 ASP A 142 14.235 1.743 4.542 1.00 14.25 O ATOM 2041 OD2 ASP A 142 14.404 2.559 6.573 1.00 22.01 O ATOM 0 H ASP A 142 11.049 1.524 5.061 1.00 72.14 H new ATOM 0 HA ASP A 142 12.529 -0.102 4.534 1.00 33.42 H new ATOM 0 HB2 ASP A 142 13.334 0.410 7.384 1.00 35.13 H new ATOM 0 HB3 ASP A 142 14.282 -0.469 6.201 1.00 35.13 H new ATOM 2045 N ASP A 143 12.606 -2.517 5.877 1.00 21.44 N ATOM 2046 CA ASP A 143 12.268 -3.908 5.531 1.00 23.12 C ATOM 2047 C ASP A 143 12.310 -4.937 6.667 1.00 71.32 C ATOM 2048 O ASP A 143 12.314 -6.149 6.416 1.00 54.21 O ATOM 2049 CB ASP A 143 13.053 -4.353 4.300 1.00 64.44 C ATOM 2050 CG ASP A 143 14.578 -4.441 4.445 1.00 21.43 C ATOM 2051 OD1 ASP A 143 15.090 -4.460 5.594 1.00 44.34 O ATOM 2052 OD2 ASP A 143 15.276 -4.406 3.408 1.00 0.52 O ATOM 0 H ASP A 143 13.577 -2.387 6.161 1.00 21.44 H new ATOM 0 HA ASP A 143 11.204 -3.883 5.297 1.00 23.12 H new ATOM 0 HB2 ASP A 143 12.684 -5.333 3.998 1.00 64.44 H new ATOM 0 HB3 ASP A 143 12.829 -3.663 3.487 1.00 64.44 H new ATOM 2056 N SER A 144 12.272 -4.503 7.928 1.00 71.43 N ATOM 2057 CA SER A 144 12.195 -5.391 9.061 1.00 31.13 C ATOM 2058 C SER A 144 10.816 -6.060 9.234 1.00 15.34 C ATOM 2059 O SER A 144 10.763 -7.153 9.802 1.00 34.23 O ATOM 2060 CB SER A 144 12.615 -4.559 10.268 1.00 55.34 C ATOM 2061 OG SER A 144 13.984 -4.791 10.543 1.00 44.43 O ATOM 0 H SER A 144 12.295 -3.515 8.181 1.00 71.43 H new ATOM 0 HA SER A 144 12.858 -6.245 8.923 1.00 31.13 H new ATOM 0 HB2 SER A 144 12.446 -3.500 10.071 1.00 55.34 H new ATOM 0 HB3 SER A 144 12.008 -4.822 11.135 1.00 55.34 H new ATOM 0 HG SER A 144 14.257 -4.256 11.317 1.00 44.43 H new ATOM 2066 N GLU A 145 9.717 -5.541 8.671 1.00 72.42 N ATOM 2067 CA GLU A 145 8.376 -6.042 8.993 1.00 3.25 C ATOM 2068 C GLU A 145 7.884 -7.137 8.030 1.00 62.01 C ATOM 2069 O GLU A 145 6.787 -7.651 8.202 1.00 33.23 O ATOM 2070 CB GLU A 145 7.342 -4.920 9.084 1.00 33.32 C ATOM 2071 CG GLU A 145 7.539 -3.897 10.209 1.00 35.03 C ATOM 2072 CD GLU A 145 8.612 -4.147 11.275 1.00 43.33 C ATOM 2073 OE1 GLU A 145 9.785 -3.799 11.031 1.00 33.25 O ATOM 2074 OE2 GLU A 145 8.268 -4.477 12.438 1.00 2.43 O ATOM 0 H GLU A 145 9.730 -4.778 7.994 1.00 72.42 H new ATOM 0 HA GLU A 145 8.479 -6.498 9.978 1.00 3.25 H new ATOM 0 HB2 GLU A 145 7.335 -4.385 8.134 1.00 33.32 H new ATOM 0 HB3 GLU A 145 6.357 -5.372 9.203 1.00 33.32 H new ATOM 0 HG2 GLU A 145 7.759 -2.937 9.743 1.00 35.03 H new ATOM 0 HG3 GLU A 145 6.585 -3.790 10.725 1.00 35.03 H new ATOM 2079 N VAL A 146 8.645 -7.523 7.006 1.00 15.22 N ATOM 2080 CA VAL A 146 8.120 -8.393 5.946 1.00 35.33 C ATOM 2081 C VAL A 146 7.579 -9.713 6.500 1.00 32.32 C ATOM 2082 O VAL A 146 6.514 -10.169 6.087 1.00 54.12 O ATOM 2083 CB VAL A 146 9.209 -8.623 4.876 1.00 44.41 C ATOM 2084 CG1 VAL A 146 8.705 -9.461 3.693 1.00 2.33 C ATOM 2085 CG2 VAL A 146 9.753 -7.293 4.330 1.00 75.30 C ATOM 0 H VAL A 146 9.621 -7.251 6.885 1.00 15.22 H new ATOM 0 HA VAL A 146 7.272 -7.892 5.479 1.00 35.33 H new ATOM 0 HB VAL A 146 10.004 -9.171 5.382 1.00 44.41 H new ATOM 0 HG11 VAL A 146 9.511 -9.592 2.971 1.00 2.33 H new ATOM 0 HG12 VAL A 146 8.377 -10.437 4.052 1.00 2.33 H new ATOM 0 HG13 VAL A 146 7.869 -8.950 3.215 1.00 2.33 H new ATOM 0 HG21 VAL A 146 10.517 -7.493 3.579 1.00 75.30 H new ATOM 0 HG22 VAL A 146 8.940 -6.726 3.877 1.00 75.30 H new ATOM 0 HG23 VAL A 146 10.188 -6.716 5.146 1.00 75.30 H new ATOM 2095 N ASP A 147 8.268 -10.267 7.494 1.00 73.34 N ATOM 2096 CA ASP A 147 7.883 -11.514 8.146 1.00 41.41 C ATOM 2097 C ASP A 147 6.488 -11.416 8.775 1.00 54.20 C ATOM 2098 O ASP A 147 5.735 -12.387 8.712 1.00 23.32 O ATOM 2099 CB ASP A 147 8.935 -11.866 9.200 1.00 55.10 C ATOM 2100 CG ASP A 147 8.420 -12.900 10.204 1.00 3.33 C ATOM 2101 OD1 ASP A 147 8.463 -14.107 9.903 1.00 14.25 O ATOM 2102 OD2 ASP A 147 8.023 -12.463 11.313 1.00 12.24 O ATOM 0 H ASP A 147 9.121 -9.856 7.874 1.00 73.34 H new ATOM 0 HA ASP A 147 7.835 -12.305 7.397 1.00 41.41 H new ATOM 0 HB2 ASP A 147 9.827 -12.253 8.707 1.00 55.10 H new ATOM 0 HB3 ASP A 147 9.232 -10.962 9.731 1.00 55.10 H new ATOM 2106 N LYS A 148 6.101 -10.257 9.322 1.00 20.32 N ATOM 2107 CA LYS A 148 4.810 -10.112 10.016 1.00 35.11 C ATOM 2108 C LYS A 148 3.710 -9.700 9.062 1.00 23.02 C ATOM 2109 O LYS A 148 2.541 -9.797 9.436 1.00 11.52 O ATOM 2110 CB LYS A 148 4.892 -9.102 11.185 1.00 33.13 C ATOM 2111 CG LYS A 148 5.364 -7.708 10.746 1.00 61.24 C ATOM 2112 CD LYS A 148 4.873 -6.520 11.571 1.00 74.21 C ATOM 2113 CE LYS A 148 5.672 -6.271 12.843 1.00 22.33 C ATOM 2114 NZ LYS A 148 5.528 -7.334 13.855 1.00 44.50 N ATOM 0 H LYS A 148 6.661 -9.405 9.299 1.00 20.32 H new ATOM 0 HA LYS A 148 4.570 -11.093 10.426 1.00 35.11 H new ATOM 0 HB2 LYS A 148 3.911 -9.016 11.652 1.00 33.13 H new ATOM 0 HB3 LYS A 148 5.574 -9.488 11.943 1.00 33.13 H new ATOM 0 HG2 LYS A 148 6.454 -7.700 10.756 1.00 61.24 H new ATOM 0 HG3 LYS A 148 5.053 -7.555 9.712 1.00 61.24 H new ATOM 0 HD2 LYS A 148 4.907 -5.623 10.952 1.00 74.21 H new ATOM 0 HD3 LYS A 148 3.829 -6.684 11.837 1.00 74.21 H new ATOM 0 HE2 LYS A 148 6.726 -6.169 12.585 1.00 22.33 H new ATOM 0 HE3 LYS A 148 5.357 -5.323 13.279 1.00 22.33 H new ATOM 0 HZ1 LYS A 148 5.848 -6.980 14.779 1.00 44.50 H new ATOM 0 HZ2 LYS A 148 4.530 -7.618 13.920 1.00 44.50 H new ATOM 0 HZ3 LYS A 148 6.104 -8.155 13.580 1.00 44.50 H new ATOM 2124 N TRP A 149 4.050 -9.195 7.879 1.00 13.53 N ATOM 2125 CA TRP A 149 3.057 -8.754 6.927 1.00 15.43 C ATOM 2126 C TRP A 149 2.646 -9.859 5.966 1.00 13.35 C ATOM 2127 O TRP A 149 1.840 -9.580 5.090 1.00 60.00 O ATOM 2128 CB TRP A 149 3.543 -7.491 6.217 1.00 53.33 C ATOM 2129 CG TRP A 149 3.675 -6.270 7.093 1.00 22.44 C ATOM 2130 CD1 TRP A 149 3.206 -6.103 8.357 1.00 53.12 C ATOM 2131 CD2 TRP A 149 4.301 -5.002 6.753 1.00 35.45 C ATOM 2132 NE1 TRP A 149 3.531 -4.844 8.824 1.00 1.21 N ATOM 2133 CE2 TRP A 149 4.138 -4.093 7.841 1.00 41.24 C ATOM 2134 CE3 TRP A 149 4.978 -4.531 5.612 1.00 41.44 C ATOM 2135 CZ2 TRP A 149 4.578 -2.762 7.772 1.00 34.02 C ATOM 2136 CZ3 TRP A 149 5.413 -3.194 5.522 1.00 22.15 C ATOM 2137 CH2 TRP A 149 5.197 -2.306 6.593 1.00 24.24 C ATOM 0 H TRP A 149 5.014 -9.084 7.564 1.00 13.53 H new ATOM 0 HA TRP A 149 2.146 -8.500 7.469 1.00 15.43 H new ATOM 0 HB2 TRP A 149 4.512 -7.699 5.763 1.00 53.33 H new ATOM 0 HB3 TRP A 149 2.853 -7.262 5.405 1.00 53.33 H new ATOM 0 HD1 TRP A 149 2.658 -6.847 8.916 1.00 53.12 H new ATOM 0 HE1 TRP A 149 3.346 -4.514 9.771 1.00 1.21 H new ATOM 0 HE3 TRP A 149 5.167 -5.207 4.791 1.00 41.44 H new ATOM 0 HZ2 TRP A 149 4.443 -2.097 8.612 1.00 34.02 H new ATOM 0 HZ3 TRP A 149 5.913 -2.849 4.629 1.00 22.15 H new ATOM 0 HH2 TRP A 149 5.506 -1.275 6.510 1.00 24.24 H new ATOM 2147 N SER A 150 3.166 -11.083 6.106 1.00 22.15 N ATOM 2148 CA SER A 150 2.804 -12.209 5.257 1.00 72.03 C ATOM 2149 C SER A 150 2.554 -13.436 6.137 1.00 74.34 C ATOM 2150 O SER A 150 3.228 -14.462 6.013 1.00 20.11 O ATOM 2151 CB SER A 150 3.885 -12.375 4.179 1.00 73.13 C ATOM 2152 OG SER A 150 3.460 -13.225 3.129 1.00 31.03 O ATOM 0 H SER A 150 3.856 -11.316 6.820 1.00 22.15 H new ATOM 0 HA SER A 150 1.871 -12.048 4.718 1.00 72.03 H new ATOM 0 HB2 SER A 150 4.144 -11.398 3.772 1.00 73.13 H new ATOM 0 HB3 SER A 150 4.789 -12.782 4.632 1.00 73.13 H new ATOM 0 HG SER A 150 4.174 -13.304 2.463 1.00 31.03 H new ATOM 2157 N LYS A 151 1.618 -13.315 7.077 1.00 32.35 N ATOM 2158 CA LYS A 151 1.207 -14.372 7.998 1.00 15.32 C ATOM 2159 C LYS A 151 -0.259 -14.694 7.786 1.00 55.31 C ATOM 2160 O LYS A 151 -0.627 -15.877 7.984 1.00 14.23 O ATOM 2161 CB LYS A 151 1.538 -13.952 9.425 1.00 11.43 C ATOM 2162 CG LYS A 151 3.055 -14.050 9.598 1.00 72.20 C ATOM 2163 CD LYS A 151 3.508 -13.542 10.955 1.00 34.02 C ATOM 2164 CE LYS A 151 3.162 -14.532 12.061 1.00 21.23 C ATOM 2165 NZ LYS A 151 3.598 -14.029 13.372 1.00 74.44 N ATOM 0 H LYS A 151 1.106 -12.445 7.223 1.00 32.35 H new ATOM 0 HA LYS A 151 1.756 -15.293 7.803 1.00 15.32 H new ATOM 0 HB2 LYS A 151 1.196 -12.934 9.613 1.00 11.43 H new ATOM 0 HB3 LYS A 151 1.029 -14.597 10.141 1.00 11.43 H new ATOM 0 HG2 LYS A 151 3.367 -15.087 9.477 1.00 72.20 H new ATOM 0 HG3 LYS A 151 3.547 -13.475 8.813 1.00 72.20 H new ATOM 0 HD2 LYS A 151 4.584 -13.371 10.941 1.00 34.02 H new ATOM 0 HD3 LYS A 151 3.035 -12.582 11.163 1.00 34.02 H new ATOM 0 HE2 LYS A 151 2.086 -14.707 12.074 1.00 21.23 H new ATOM 0 HE3 LYS A 151 3.639 -15.491 11.858 1.00 21.23 H new ATOM 0 HZ1 LYS A 151 3.351 -14.720 14.109 1.00 74.44 H new ATOM 0 HZ2 LYS A 151 4.628 -13.885 13.363 1.00 74.44 H new ATOM 0 HZ3 LYS A 151 3.124 -13.126 13.572 1.00 74.44 H new TER 2175 LYS A 151