USER MOD reduce.3.24.130724 H: found=0, std=0, add=2018, rem=0, adj=67 USER MOD reduce.3.24.130724 removed 2016 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 131 ASN :FLIP amide:sc= 0.91 F(o=0.99!,f=2.1) USER MOD Set 1.2: B 125 SER OG : rot 176:sc= 1.12 USER MOD Set 1.3: B 126 ASN :FLIP amide:sc= 0.0292 F(o=0.65,f=2.1) USER MOD Set 2.1: B 54 TYR OH : rot 30:sc= -0.508 USER MOD Set 2.2: B 119 HIS : +bothHN:sc= -5.07! C(o=-5.5!,f=-8.3!) USER MOD Set 2.3: B 128 THR OG1 : rot -44:sc= 0.0589 USER MOD Set 3.1: A 10 THR OG1 : rot 79:sc= 0.265 USER MOD Set 3.2: B 80 THR OG1 : rot 180:sc= 0.25 USER MOD Set 4.1: A 12 THR OG1 : rot 180:sc= 0 USER MOD Set 4.2: B 78 THR OG1 : rot 180:sc= -0.329 USER MOD Set 5.1: B 57 CYS SG : rot -88:sc= -1.9! USER MOD Set 5.2: B 124 TYR OH : rot -173:sc= 1.37 USER MOD Set 6.1: A 11 SER OG : rot 134:sc= 0.864 USER MOD Set 6.2: B 55 SER OG : rot -79:sc= 1.68 USER MOD Set 7.1: A 55 SER OG : rot -78:sc= 0.691 USER MOD Set 7.2: B 11 SER OG : rot -6:sc= 0.557 USER MOD Set 8.1: A 48 GLN : amide:sc= -0.12 K(o=0.66,f=-0.81!) USER MOD Set 8.2: B 7 THR OG1 : rot 119:sc= 1.31 USER MOD Set 8.3: B 21 SER OG : rot -96:sc= -0.532 USER MOD Set 9.1: A 45 ASN : amide:sc= -2.79! C(o=-1.7!,f=-11!) USER MOD Set 9.2: B 5 TYR OH : rot 180:sc= 0 USER MOD Set 9.3: B 25 LYS NZ :NH3+ -153:sc= 1.1 (180deg=0) USER MOD Set10.1: A 5 TYR OH : rot 180:sc= -0.82 USER MOD Set10.2: A 7 THR OG1 : rot -120:sc= 1.61 USER MOD Set10.3: A 21 SER OG : rot 85:sc= 0.636 USER MOD Set10.4: A 25 LYS NZ :NH3+ 175:sc= 1.14 (180deg=-0.005) USER MOD Set10.5: B 45 ASN : amide:sc= -0.525! C(o=-0.91!,f=-15!) USER MOD Set10.6: B 48 GLN : amide:sc= -2.95! C(o=-0.91!,f=-11!) USER MOD Single : A 1 MET CE :methyl 168:sc= -2.37 (180deg=-3.04) USER MOD Single : A 1 MET N :NH3+ -127:sc= 0.0847 (180deg=0) USER MOD Single : A 2 ASN : amide:sc= -0.0838 X(o=-0.084,f=-0.41) USER MOD Single : A 6 LYS NZ :NH3+ 174:sc= 2.34 (180deg=2.3) USER MOD Single : A 20 THR OG1 : rot -111:sc= -1.19 USER MOD Single : A 22 HIS : no HD1:sc= -0.0483 X(o=-0.048,f=-0.061) USER MOD Single : A 24 GLN : amide:sc= 0.168 X(o=0.17,f=-0.19) USER MOD Single : A 29 LYS NZ :NH3+ 175:sc= 0 (180deg=-0.0284) USER MOD Single : A 31 SER OG : rot -150:sc= -0.803 USER MOD Single : A 44 THR OG1 : rot 180:sc= -2.76! USER MOD Single : A 54 TYR OH : rot -15:sc= 0.315 USER MOD Single : A 57 CYS SG : rot 73:sc= -3.86! USER MOD Single : A 60 SER OG : rot -85:sc= 0.627 USER MOD Single : A 62 MET CE :methyl -109:sc= -0.529 (180deg=-2.81!) USER MOD Single : A 63 LYS NZ :NH3+ 163:sc= -0.027 (180deg=-0.268) USER MOD Single : A 68 GLN : amide:sc= -0.0559 X(o=-0.056,f=0) USER MOD Single : A 69 ASN : amide:sc= 0.898 K(o=0.9,f=0) USER MOD Single : A 70 LYS NZ :NH3+ 150:sc= 0.695 (180deg=0.247) USER MOD Single : A 71 GLN :FLIP amide:sc= 0 F(o=-0.84,f=0) USER MOD Single : A 72 THR OG1 : rot 180:sc= 0 USER MOD Single : A 77 THR OG1 : rot 53:sc= 0.867 USER MOD Single : A 78 THR OG1 : rot 180:sc= -0.0179 USER MOD Single : A 80 THR OG1 : rot -83:sc= 1.11 USER MOD Single : A 88 ASN : amide:sc= -0.968 X(o=-0.97,f=-1.3) USER MOD Single : A 112 LYS NZ :NH3+ 162:sc= -0.0525 (180deg=-0.355) USER MOD Single : A 113 THR OG1 : rot 180:sc= 0 USER MOD Single : A 119 HIS : no HE2:sc= 0.124 K(o=0.12,f=-4.6!) USER MOD Single : A 120 HIS : no HD1:sc= -0.609 X(o=-0.61,f=-1) USER MOD Single : A 122 CYS SG : rot -1:sc= -2.72 USER MOD Single : A 124 TYR OH : rot -118:sc= -1.69! USER MOD Single : A 125 SER OG : rot 5:sc= 0.42 USER MOD Single : A 126 ASN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 128 THR OG1 : rot -44:sc= 0.00443 USER MOD Single : A 130 ASN : amide:sc= -2.51 K(o=-2.5,f=-3.7!) USER MOD Single : B 1 MET CE :methyl 164:sc= -4.38! (180deg=-5.43!) USER MOD Single : B 1 MET N :NH3+ -117:sc= 0.105 (180deg=-0.000509) USER MOD Single : B 2 ASN : amide:sc= -0.0511 X(o=-0.051,f=-0.44) USER MOD Single : B 6 LYS NZ :NH3+ 166:sc= 2.38 (180deg=1.96) USER MOD Single : B 10 THR OG1 : rot 180:sc= 0 USER MOD Single : B 12 THR OG1 : rot 180:sc= 0 USER MOD Single : B 20 THR OG1 : rot -106:sc= 0.606 USER MOD Single : B 22 HIS : no HD1:sc= -0.0116 X(o=-0.012,f=-0.012) USER MOD Single : B 24 GLN : amide:sc= 0.119 X(o=0.12,f=-0.16) USER MOD Single : B 29 LYS NZ :NH3+ -174:sc= 0 (180deg=-0.05) USER MOD Single : B 31 SER OG : rot -14:sc= 0.29 USER MOD Single : B 44 THR OG1 : rot 180:sc= 0 USER MOD Single : B 60 SER OG : rot 180:sc= 0 USER MOD Single : B 62 MET CE :methyl -143:sc= -1.17 (180deg=-3.57!) USER MOD Single : B 63 LYS NZ :NH3+ 170:sc= -0.353! (180deg=-0.71!) USER MOD Single : B 68 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : B 69 ASN : amide:sc= -2.35 X(o=-2.4,f=-2.1!) USER MOD Single : B 70 LYS NZ :NH3+ -165:sc= -0.0579 (180deg=-0.312) USER MOD Single : B 71 GLN :FLIP amide:sc= 0 F(o=-1.3,f=0) USER MOD Single : B 72 THR OG1 : rot 180:sc= 0 USER MOD Single : B 77 THR OG1 : rot 27:sc= 0.901 USER MOD Single : B 88 ASN : amide:sc= -0.546 K(o=-0.55,f=-6.2!) USER MOD Single : B 112 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : B 113 THR OG1 : rot 180:sc= 0 USER MOD Single : B 120 HIS : no HD1:sc= 0 X(o=0,f=-0.005) USER MOD Single : B 122 CYS SG : rot -160:sc= -1.87! USER MOD Single : B 130 ASN : amide:sc= -0.667 X(o=-0.67,f=-1.1) USER MOD Single : B 131 ASN : amide:sc= 0 X(o=0,f=0) USER MOD ----------------------------------------------------------------- ATOM 1 N MET A 1 1.996 -0.067 1.356 1.00 60.05 N ATOM 2 CA MET A 1 2.443 0.330 -0.003 1.00 3.23 C ATOM 3 C MET A 1 3.337 -0.748 -0.619 1.00 42.13 C ATOM 4 O MET A 1 3.494 -1.834 -0.056 1.00 30.31 O ATOM 5 CB MET A 1 3.206 1.657 0.040 1.00 13.52 C ATOM 6 CG MET A 1 4.549 1.541 0.721 1.00 60.32 C ATOM 7 SD MET A 1 5.531 3.046 0.608 1.00 71.43 S ATOM 8 CE MET A 1 7.140 2.397 1.045 1.00 20.11 C ATOM 0 H1 MET A 1 0.960 -0.002 1.414 1.00 60.05 H new ATOM 0 H2 MET A 1 2.292 -1.045 1.547 1.00 60.05 H new ATOM 0 H3 MET A 1 2.423 0.568 2.061 1.00 60.05 H new ATOM 0 HA MET A 1 1.552 0.450 -0.619 1.00 3.23 H new ATOM 0 HB2 MET A 1 3.350 2.020 -0.977 1.00 13.52 H new ATOM 0 HB3 MET A 1 2.603 2.400 0.561 1.00 13.52 H new ATOM 0 HG2 MET A 1 4.397 1.292 1.771 1.00 60.32 H new ATOM 0 HG3 MET A 1 5.106 0.717 0.275 1.00 60.32 H new ATOM 0 HE1 MET A 1 7.905 3.140 0.821 1.00 20.11 H new ATOM 0 HE2 MET A 1 7.161 2.164 2.109 1.00 20.11 H new ATOM 0 HE3 MET A 1 7.335 1.491 0.471 1.00 20.11 H new ATOM 20 N ASN A 2 3.927 -0.434 -1.772 1.00 22.52 N ATOM 21 CA ASN A 2 4.854 -1.337 -2.454 1.00 14.33 C ATOM 22 C ASN A 2 6.201 -1.393 -1.724 1.00 22.14 C ATOM 23 O ASN A 2 7.179 -0.774 -2.141 1.00 72.55 O ATOM 24 CB ASN A 2 5.053 -0.890 -3.914 1.00 31.34 C ATOM 25 CG ASN A 2 6.067 -1.739 -4.667 1.00 75.52 C ATOM 26 OD1 ASN A 2 6.215 -2.933 -4.408 1.00 52.13 O ATOM 27 ND2 ASN A 2 6.770 -1.126 -5.608 1.00 35.23 N ATOM 0 H ASN A 2 3.777 0.450 -2.258 1.00 22.52 H new ATOM 0 HA ASN A 2 4.424 -2.339 -2.447 1.00 14.33 H new ATOM 0 HB2 ASN A 2 4.096 -0.932 -4.434 1.00 31.34 H new ATOM 0 HB3 ASN A 2 5.378 0.150 -3.928 1.00 31.34 H new ATOM 0 HD21 ASN A 2 7.463 -1.646 -6.147 1.00 35.23 H new ATOM 0 HD22 ASN A 2 6.618 -0.135 -5.793 1.00 35.23 H new ATOM 34 N ILE A 3 6.220 -2.085 -0.594 1.00 0.23 N ATOM 35 CA ILE A 3 7.446 -2.326 0.152 1.00 51.02 C ATOM 36 C ILE A 3 8.341 -3.339 -0.555 1.00 3.13 C ATOM 37 O ILE A 3 7.921 -4.458 -0.862 1.00 22.24 O ATOM 38 CB ILE A 3 7.124 -2.832 1.577 1.00 43.32 C ATOM 39 CG1 ILE A 3 6.281 -1.793 2.324 1.00 25.54 C ATOM 40 CG2 ILE A 3 8.408 -3.139 2.346 1.00 24.42 C ATOM 41 CD1 ILE A 3 7.044 -0.529 2.646 1.00 23.10 C ATOM 0 H ILE A 3 5.388 -2.494 -0.169 1.00 0.23 H new ATOM 0 HA ILE A 3 7.979 -1.377 0.215 1.00 51.02 H new ATOM 0 HB ILE A 3 6.551 -3.756 1.498 1.00 43.32 H new ATOM 0 HG12 ILE A 3 5.409 -1.540 1.721 1.00 25.54 H new ATOM 0 HG13 ILE A 3 5.911 -2.233 3.250 1.00 25.54 H new ATOM 0 HG21 ILE A 3 8.157 -3.493 3.346 1.00 24.42 H new ATOM 0 HG22 ILE A 3 8.973 -3.908 1.819 1.00 24.42 H new ATOM 0 HG23 ILE A 3 9.011 -2.235 2.422 1.00 24.42 H new ATOM 0 HD11 ILE A 3 6.391 0.165 3.175 1.00 23.10 H new ATOM 0 HD12 ILE A 3 7.901 -0.771 3.275 1.00 23.10 H new ATOM 0 HD13 ILE A 3 7.391 -0.068 1.721 1.00 23.10 H new ATOM 53 N LEU A 4 9.575 -2.930 -0.801 1.00 41.13 N ATOM 54 CA LEU A 4 10.586 -3.799 -1.399 1.00 42.04 C ATOM 55 C LEU A 4 11.217 -4.679 -0.332 1.00 41.22 C ATOM 56 O LEU A 4 11.392 -5.883 -0.524 1.00 74.21 O ATOM 57 CB LEU A 4 11.676 -2.967 -2.084 1.00 22.30 C ATOM 58 CG LEU A 4 11.191 -2.047 -3.209 1.00 5.11 C ATOM 59 CD1 LEU A 4 12.347 -1.208 -3.752 1.00 73.22 C ATOM 60 CD2 LEU A 4 10.532 -2.854 -4.328 1.00 52.13 C ATOM 0 H LEU A 4 9.908 -1.988 -0.594 1.00 41.13 H new ATOM 0 HA LEU A 4 10.098 -4.426 -2.145 1.00 42.04 H new ATOM 0 HB2 LEU A 4 12.173 -2.358 -1.329 1.00 22.30 H new ATOM 0 HB3 LEU A 4 12.426 -3.646 -2.491 1.00 22.30 H new ATOM 0 HG LEU A 4 10.442 -1.371 -2.797 1.00 5.11 H new ATOM 0 HD11 LEU A 4 11.983 -0.561 -4.550 1.00 73.22 H new ATOM 0 HD12 LEU A 4 12.761 -0.597 -2.950 1.00 73.22 H new ATOM 0 HD13 LEU A 4 13.122 -1.867 -4.144 1.00 73.22 H new ATOM 0 HD21 LEU A 4 10.196 -2.178 -5.115 1.00 52.13 H new ATOM 0 HD22 LEU A 4 11.252 -3.561 -4.740 1.00 52.13 H new ATOM 0 HD23 LEU A 4 9.677 -3.399 -3.928 1.00 52.13 H new ATOM 72 N TYR A 5 11.555 -4.071 0.800 1.00 24.01 N ATOM 73 CA TYR A 5 12.208 -4.795 1.890 1.00 4.44 C ATOM 74 C TYR A 5 11.606 -4.393 3.232 1.00 12.52 C ATOM 75 O TYR A 5 11.528 -3.214 3.544 1.00 21.34 O ATOM 76 CB TYR A 5 13.717 -4.504 1.875 1.00 54.43 C ATOM 77 CG TYR A 5 14.529 -5.319 2.868 1.00 2.54 C ATOM 78 CD1 TYR A 5 14.625 -4.941 4.203 1.00 4.50 C ATOM 79 CD2 TYR A 5 15.206 -6.463 2.464 1.00 14.20 C ATOM 80 CE1 TYR A 5 15.368 -5.681 5.103 1.00 2.54 C ATOM 81 CE2 TYR A 5 15.950 -7.210 3.359 1.00 4.33 C ATOM 82 CZ TYR A 5 16.028 -6.815 4.678 1.00 33.20 C ATOM 83 OH TYR A 5 16.761 -7.560 5.578 1.00 31.30 O ATOM 0 H TYR A 5 11.389 -3.082 0.989 1.00 24.01 H new ATOM 0 HA TYR A 5 12.050 -5.864 1.749 1.00 4.44 H new ATOM 0 HB2 TYR A 5 14.100 -4.692 0.872 1.00 54.43 H new ATOM 0 HB3 TYR A 5 13.871 -3.445 2.082 1.00 54.43 H new ATOM 0 HD1 TYR A 5 14.110 -4.054 4.542 1.00 4.50 H new ATOM 0 HD2 TYR A 5 15.150 -6.775 1.432 1.00 14.20 H new ATOM 0 HE1 TYR A 5 15.432 -5.372 6.136 1.00 2.54 H new ATOM 0 HE2 TYR A 5 16.467 -8.098 3.027 1.00 4.33 H new ATOM 0 HH TYR A 5 17.162 -8.327 5.118 1.00 31.30 H new ATOM 93 N LYS A 6 11.177 -5.375 4.017 1.00 51.40 N ATOM 94 CA LYS A 6 10.677 -5.127 5.367 1.00 43.32 C ATOM 95 C LYS A 6 11.232 -6.170 6.332 1.00 62.42 C ATOM 96 O LYS A 6 11.144 -7.375 6.082 1.00 13.53 O ATOM 97 CB LYS A 6 9.134 -5.113 5.410 1.00 1.54 C ATOM 98 CG LYS A 6 8.559 -5.033 6.829 1.00 51.03 C ATOM 99 CD LYS A 6 7.068 -4.677 6.858 1.00 30.33 C ATOM 100 CE LYS A 6 6.826 -3.196 6.567 1.00 61.32 C ATOM 101 NZ LYS A 6 5.402 -2.808 6.775 1.00 4.41 N1+ ATOM 0 H LYS A 6 11.165 -6.357 3.741 1.00 51.40 H new ATOM 0 HA LYS A 6 11.020 -4.139 5.675 1.00 43.32 H new ATOM 0 HB2 LYS A 6 8.771 -4.264 4.832 1.00 1.54 H new ATOM 0 HB3 LYS A 6 8.757 -6.013 4.925 1.00 1.54 H new ATOM 0 HG2 LYS A 6 8.707 -5.991 7.328 1.00 51.03 H new ATOM 0 HG3 LYS A 6 9.115 -4.288 7.398 1.00 51.03 H new ATOM 0 HD2 LYS A 6 6.537 -5.282 6.123 1.00 30.33 H new ATOM 0 HD3 LYS A 6 6.655 -4.926 7.835 1.00 30.33 H new ATOM 0 HE2 LYS A 6 7.464 -2.592 7.212 1.00 61.32 H new ATOM 0 HE3 LYS A 6 7.114 -2.977 5.539 1.00 61.32 H new ATOM 0 HZ1 LYS A 6 5.303 -1.779 6.666 1.00 4.41 H new ATOM 0 HZ2 LYS A 6 4.805 -3.290 6.073 1.00 4.41 H new ATOM 0 HZ3 LYS A 6 5.103 -3.085 7.732 1.00 4.41 H new ATOM 115 N THR A 7 11.810 -5.694 7.427 1.00 30.21 N ATOM 116 CA THR A 7 12.414 -6.552 8.437 1.00 33.22 C ATOM 117 C THR A 7 11.957 -6.107 9.833 1.00 54.23 C ATOM 118 O THR A 7 11.609 -4.940 10.031 1.00 73.02 O ATOM 119 CB THR A 7 13.960 -6.515 8.319 1.00 43.13 C ATOM 120 OG1 THR A 7 14.558 -7.492 9.183 1.00 11.53 O ATOM 121 CG2 THR A 7 14.513 -5.125 8.639 1.00 62.33 C ATOM 0 H THR A 7 11.873 -4.699 7.640 1.00 30.21 H new ATOM 0 HA THR A 7 12.090 -7.580 8.278 1.00 33.22 H new ATOM 0 HB THR A 7 14.214 -6.752 7.286 1.00 43.13 H new ATOM 0 HG1 THR A 7 15.147 -7.044 9.825 1.00 11.53 H new ATOM 0 HG21 THR A 7 15.599 -5.135 8.547 1.00 62.33 H new ATOM 0 HG22 THR A 7 14.096 -4.398 7.942 1.00 62.33 H new ATOM 0 HG23 THR A 7 14.238 -4.850 9.657 1.00 62.33 H new ATOM 129 N ALA A 8 11.956 -7.033 10.794 1.00 51.42 N ATOM 130 CA ALA A 8 11.365 -6.782 12.109 1.00 62.45 C ATOM 131 C ALA A 8 12.404 -6.778 13.226 1.00 64.34 C ATOM 132 O ALA A 8 13.332 -7.596 13.244 1.00 4.53 O ATOM 133 CB ALA A 8 10.292 -7.821 12.410 1.00 11.23 C ATOM 0 H ALA A 8 12.358 -7.964 10.686 1.00 51.42 H new ATOM 0 HA ALA A 8 10.920 -5.788 12.073 1.00 62.45 H new ATOM 0 HB1 ALA A 8 9.860 -7.624 13.391 1.00 11.23 H new ATOM 0 HB2 ALA A 8 9.511 -7.767 11.652 1.00 11.23 H new ATOM 0 HB3 ALA A 8 10.737 -8.816 12.403 1.00 11.23 H new ATOM 139 N ALA A 9 12.223 -5.855 14.161 1.00 62.04 N ATOM 140 CA ALA A 9 13.022 -5.790 15.376 1.00 13.24 C ATOM 141 C ALA A 9 12.094 -5.811 16.587 1.00 53.42 C ATOM 142 O ALA A 9 11.083 -5.119 16.605 1.00 45.34 O ATOM 143 CB ALA A 9 13.887 -4.533 15.378 1.00 65.14 C ATOM 0 H ALA A 9 11.513 -5.126 14.097 1.00 62.04 H new ATOM 0 HA ALA A 9 13.687 -6.652 15.421 1.00 13.24 H new ATOM 0 HB1 ALA A 9 14.478 -4.500 16.293 1.00 65.14 H new ATOM 0 HB2 ALA A 9 14.554 -4.549 14.516 1.00 65.14 H new ATOM 0 HB3 ALA A 9 13.248 -3.651 15.326 1.00 65.14 H new ATOM 149 N THR A 10 12.437 -6.603 17.586 1.00 61.23 N ATOM 150 CA THR A 10 11.632 -6.744 18.778 1.00 51.35 C ATOM 151 C THR A 10 12.487 -6.396 19.986 1.00 43.21 C ATOM 152 O THR A 10 13.613 -6.880 20.133 1.00 73.43 O ATOM 153 CB THR A 10 11.043 -8.176 18.911 1.00 34.35 C ATOM 154 OG1 THR A 10 10.083 -8.217 19.974 1.00 3.15 O ATOM 155 CG2 THR A 10 12.126 -9.222 19.165 1.00 70.40 C ATOM 0 H THR A 10 13.286 -7.168 17.590 1.00 61.23 H new ATOM 0 HA THR A 10 10.784 -6.062 18.715 1.00 51.35 H new ATOM 0 HB THR A 10 10.561 -8.415 17.963 1.00 34.35 H new ATOM 0 HG1 THR A 10 9.233 -7.844 19.661 1.00 3.15 H new ATOM 0 HG21 THR A 10 11.667 -10.207 19.251 1.00 70.40 H new ATOM 0 HG22 THR A 10 12.833 -9.222 18.336 1.00 70.40 H new ATOM 0 HG23 THR A 10 12.651 -8.984 20.090 1.00 70.40 H new ATOM 163 N SER A 11 11.968 -5.519 20.816 1.00 71.32 N ATOM 164 CA SER A 11 12.710 -5.016 21.953 1.00 2.43 C ATOM 165 C SER A 11 11.926 -5.225 23.246 1.00 11.12 C ATOM 166 O SER A 11 10.848 -4.658 23.437 1.00 53.54 O ATOM 167 CB SER A 11 13.031 -3.543 21.717 1.00 22.21 C ATOM 168 OG SER A 11 13.933 -3.390 20.635 1.00 52.01 O ATOM 0 H SER A 11 11.027 -5.136 20.724 1.00 71.32 H new ATOM 0 HA SER A 11 13.644 -5.567 22.059 1.00 2.43 H new ATOM 0 HB2 SER A 11 12.112 -2.995 21.510 1.00 22.21 H new ATOM 0 HB3 SER A 11 13.463 -3.111 22.620 1.00 22.21 H new ATOM 0 HG SER A 11 13.620 -2.671 20.047 1.00 52.01 H new ATOM 174 N THR A 12 12.470 -6.068 24.117 1.00 54.12 N ATOM 175 CA THR A 12 11.827 -6.436 25.366 1.00 52.53 C ATOM 176 C THR A 12 12.439 -5.667 26.541 1.00 72.12 C ATOM 177 O THR A 12 13.577 -5.194 26.462 1.00 13.04 O ATOM 178 CB THR A 12 11.998 -7.952 25.614 1.00 35.03 C ATOM 179 OG1 THR A 12 11.834 -8.671 24.382 1.00 61.53 O ATOM 180 CG2 THR A 12 10.991 -8.463 26.634 1.00 33.34 C ATOM 0 H THR A 12 13.375 -6.516 23.972 1.00 54.12 H new ATOM 0 HA THR A 12 10.769 -6.186 25.291 1.00 52.53 H new ATOM 0 HB THR A 12 13.001 -8.115 26.008 1.00 35.03 H new ATOM 0 HG1 THR A 12 11.945 -9.631 24.546 1.00 61.53 H new ATOM 0 HG21 THR A 12 11.138 -9.532 26.786 1.00 33.34 H new ATOM 0 HG22 THR A 12 11.133 -7.939 27.579 1.00 33.34 H new ATOM 0 HG23 THR A 12 9.980 -8.284 26.268 1.00 33.34 H new ATOM 188 N GLY A 13 11.686 -5.550 27.628 1.00 62.44 N ATOM 189 CA GLY A 13 12.209 -4.942 28.837 1.00 34.44 C ATOM 190 C GLY A 13 13.037 -5.931 29.636 1.00 13.14 C ATOM 191 O GLY A 13 12.616 -6.378 30.700 1.00 50.55 O ATOM 0 H GLY A 13 10.719 -5.867 27.694 1.00 62.44 H new ATOM 0 HA2 GLY A 13 12.821 -4.078 28.577 1.00 34.44 H new ATOM 0 HA3 GLY A 13 11.385 -4.576 29.449 1.00 34.44 H new ATOM 195 N GLY A 14 14.206 -6.288 29.096 1.00 62.02 N ATOM 196 CA GLY A 14 15.067 -7.289 29.721 1.00 43.32 C ATOM 197 C GLY A 14 15.467 -6.930 31.143 1.00 33.13 C ATOM 198 O GLY A 14 14.712 -7.172 32.085 1.00 44.52 O ATOM 0 H GLY A 14 14.575 -5.898 28.229 1.00 62.02 H new ATOM 0 HA2 GLY A 14 14.552 -8.250 29.727 1.00 43.32 H new ATOM 0 HA3 GLY A 14 15.966 -7.413 29.118 1.00 43.32 H new ATOM 202 N ARG A 15 16.669 -6.384 31.307 1.00 24.13 N ATOM 203 CA ARG A 15 17.110 -5.891 32.610 1.00 34.21 C ATOM 204 C ARG A 15 16.685 -4.437 32.761 1.00 4.22 C ATOM 205 O ARG A 15 16.048 -4.061 33.744 1.00 73.04 O ATOM 206 CB ARG A 15 18.628 -6.044 32.774 1.00 34.44 C ATOM 207 CG ARG A 15 19.100 -7.494 32.713 1.00 1.44 C ATOM 208 CD ARG A 15 20.577 -7.637 33.065 1.00 44.04 C ATOM 209 NE ARG A 15 20.847 -7.308 34.466 1.00 64.51 N ATOM 210 CZ ARG A 15 21.640 -8.028 35.262 1.00 22.54 C ATOM 211 NH1 ARG A 15 22.257 -9.107 34.794 1.00 12.40 N1+ ATOM 212 NH2 ARG A 15 21.816 -7.670 36.526 1.00 44.23 N ATOM 0 H ARG A 15 17.353 -6.272 30.558 1.00 24.13 H new ATOM 0 HA ARG A 15 16.642 -6.484 33.396 1.00 34.21 H new ATOM 0 HB2 ARG A 15 19.130 -5.473 31.993 1.00 34.44 H new ATOM 0 HB3 ARG A 15 18.929 -5.611 33.728 1.00 34.44 H new ATOM 0 HG2 ARG A 15 18.505 -8.097 33.399 1.00 1.44 H new ATOM 0 HG3 ARG A 15 18.928 -7.888 31.711 1.00 1.44 H new ATOM 0 HD2 ARG A 15 20.899 -8.659 32.865 1.00 44.04 H new ATOM 0 HD3 ARG A 15 21.167 -6.985 32.420 1.00 44.04 H new ATOM 0 HE ARG A 15 20.402 -6.478 34.857 1.00 64.51 H new ATOM 0 HH11 ARG A 15 22.126 -9.388 33.822 1.00 12.40 H new ATOM 0 HH12 ARG A 15 22.862 -9.654 35.406 1.00 12.40 H new ATOM 0 HH21 ARG A 15 21.345 -6.843 36.892 1.00 44.23 H new ATOM 0 HH22 ARG A 15 22.423 -8.222 37.133 1.00 44.23 H new ATOM 226 N ASP A 16 17.057 -3.616 31.782 1.00 4.14 N ATOM 227 CA ASP A 16 16.511 -2.267 31.667 1.00 22.02 C ATOM 228 C ASP A 16 15.927 -2.079 30.269 1.00 52.02 C ATOM 229 O ASP A 16 14.837 -1.521 30.112 1.00 74.22 O ATOM 230 CB ASP A 16 17.587 -1.213 31.948 1.00 50.13 C ATOM 231 CG ASP A 16 17.002 0.184 32.102 1.00 53.42 C ATOM 232 OD1 ASP A 16 16.623 0.548 33.231 1.00 45.04 O ATOM 233 OD2 ASP A 16 16.883 0.910 31.094 1.00 61.02 O1- ATOM 0 H ASP A 16 17.733 -3.861 31.058 1.00 4.14 H new ATOM 0 HA ASP A 16 15.723 -2.139 32.409 1.00 22.02 H new ATOM 0 HB2 ASP A 16 18.126 -1.481 32.857 1.00 50.13 H new ATOM 0 HB3 ASP A 16 18.313 -1.213 31.135 1.00 50.13 H new ATOM 238 N GLY A 17 16.651 -2.566 29.257 1.00 73.12 N ATOM 239 CA GLY A 17 16.092 -2.703 27.926 1.00 31.14 C ATOM 240 C GLY A 17 16.841 -3.754 27.134 1.00 63.12 C ATOM 241 O GLY A 17 18.019 -3.993 27.388 1.00 34.35 O ATOM 0 H GLY A 17 17.621 -2.869 29.342 1.00 73.12 H new ATOM 0 HA2 GLY A 17 15.039 -2.975 27.995 1.00 31.14 H new ATOM 0 HA3 GLY A 17 16.140 -1.746 27.406 1.00 31.14 H new ATOM 245 N ARG A 18 16.170 -4.394 26.189 1.00 71.41 N ATOM 246 CA ARG A 18 16.786 -5.446 25.381 1.00 64.41 C ATOM 247 C ARG A 18 16.269 -5.362 23.948 1.00 2.04 C ATOM 248 O ARG A 18 15.090 -5.597 23.696 1.00 73.24 O ATOM 249 CB ARG A 18 16.497 -6.825 26.014 1.00 30.54 C ATOM 250 CG ARG A 18 17.104 -8.025 25.279 1.00 21.30 C ATOM 251 CD ARG A 18 16.126 -8.645 24.285 1.00 2.42 C ATOM 252 NE ARG A 18 16.671 -9.841 23.639 1.00 61.43 N ATOM 253 CZ ARG A 18 15.930 -10.846 23.164 1.00 42.21 C ATOM 254 NH1 ARG A 18 14.611 -10.840 23.326 1.00 65.11 N1+ ATOM 255 NH2 ARG A 18 16.514 -11.849 22.520 1.00 11.32 N ATOM 0 H ARG A 18 15.194 -4.205 25.959 1.00 71.41 H new ATOM 0 HA ARG A 18 17.867 -5.311 25.355 1.00 64.41 H new ATOM 0 HB2 ARG A 18 16.870 -6.821 27.038 1.00 30.54 H new ATOM 0 HB3 ARG A 18 15.417 -6.962 26.068 1.00 30.54 H new ATOM 0 HG2 ARG A 18 18.004 -7.709 24.752 1.00 21.30 H new ATOM 0 HG3 ARG A 18 17.408 -8.779 26.006 1.00 21.30 H new ATOM 0 HD2 ARG A 18 15.202 -8.903 24.802 1.00 2.42 H new ATOM 0 HD3 ARG A 18 15.870 -7.908 23.523 1.00 2.42 H new ATOM 0 HE ARG A 18 17.684 -9.911 23.545 1.00 61.43 H new ATOM 0 HH11 ARG A 18 14.161 -10.066 23.815 1.00 65.11 H new ATOM 0 HH12 ARG A 18 14.049 -11.609 22.962 1.00 65.11 H new ATOM 0 HH21 ARG A 18 17.526 -11.851 22.389 1.00 11.32 H new ATOM 0 HH22 ARG A 18 15.951 -12.618 22.156 1.00 11.32 H new ATOM 269 N ALA A 19 17.161 -5.024 23.021 1.00 71.12 N ATOM 270 CA ALA A 19 16.796 -4.802 21.623 1.00 34.25 C ATOM 271 C ALA A 19 17.348 -5.915 20.740 1.00 41.03 C ATOM 272 O ALA A 19 18.555 -6.166 20.720 1.00 12.34 O ATOM 273 CB ALA A 19 17.311 -3.445 21.153 1.00 5.35 C ATOM 0 H ALA A 19 18.154 -4.896 23.216 1.00 71.12 H new ATOM 0 HA ALA A 19 15.709 -4.810 21.544 1.00 34.25 H new ATOM 0 HB1 ALA A 19 17.033 -3.291 20.110 1.00 5.35 H new ATOM 0 HB2 ALA A 19 16.872 -2.657 21.765 1.00 5.35 H new ATOM 0 HB3 ALA A 19 18.397 -3.415 21.247 1.00 5.35 H new ATOM 279 N THR A 20 16.464 -6.568 20.002 1.00 63.53 N ATOM 280 CA THR A 20 16.831 -7.711 19.184 1.00 0.02 C ATOM 281 C THR A 20 16.183 -7.630 17.821 1.00 61.21 C ATOM 282 O THR A 20 14.968 -7.590 17.714 1.00 50.32 O ATOM 283 CB THR A 20 16.378 -9.014 19.880 1.00 22.13 C ATOM 284 OG1 THR A 20 16.985 -9.082 21.173 1.00 4.20 O ATOM 285 CG2 THR A 20 16.743 -10.264 19.071 1.00 30.30 C ATOM 0 H THR A 20 15.476 -6.321 19.954 1.00 63.53 H new ATOM 0 HA THR A 20 17.914 -7.708 19.060 1.00 0.02 H new ATOM 0 HB THR A 20 15.291 -8.992 19.964 1.00 22.13 H new ATOM 0 HG1 THR A 20 17.645 -9.806 21.187 1.00 4.20 H new ATOM 0 HG21 THR A 20 16.403 -11.153 19.602 1.00 30.30 H new ATOM 0 HG22 THR A 20 16.261 -10.219 18.094 1.00 30.30 H new ATOM 0 HG23 THR A 20 17.824 -10.310 18.941 1.00 30.30 H new ATOM 293 N SER A 21 16.984 -7.619 16.769 1.00 52.22 N ATOM 294 CA SER A 21 16.431 -7.749 15.443 1.00 61.23 C ATOM 295 C SER A 21 15.911 -9.161 15.341 1.00 4.01 C ATOM 296 O SER A 21 16.721 -10.107 15.258 1.00 53.51 O ATOM 297 CB SER A 21 17.477 -7.474 14.357 1.00 62.30 C ATOM 298 OG SER A 21 17.116 -8.081 13.130 1.00 0.33 O ATOM 0 H SER A 21 17.999 -7.523 16.810 1.00 52.22 H new ATOM 0 HA SER A 21 15.639 -7.017 15.286 1.00 61.23 H new ATOM 0 HB2 SER A 21 17.584 -6.398 14.216 1.00 62.30 H new ATOM 0 HB3 SER A 21 18.447 -7.851 14.680 1.00 62.30 H new ATOM 0 HG SER A 21 16.515 -7.486 12.635 1.00 0.33 H new ATOM 304 N HIS A 22 14.570 -9.275 15.370 1.00 22.03 N ATOM 305 CA HIS A 22 13.860 -10.552 15.480 1.00 2.11 C ATOM 306 C HIS A 22 14.082 -11.391 14.239 1.00 71.44 C ATOM 307 O HIS A 22 13.838 -12.598 14.232 1.00 63.31 O ATOM 308 CB HIS A 22 12.355 -10.310 15.692 1.00 42.33 C ATOM 309 CG HIS A 22 11.551 -11.568 15.892 1.00 64.41 C ATOM 310 ND1 HIS A 22 11.466 -12.221 17.105 1.00 70.44 N ATOM 311 CD2 HIS A 22 10.789 -12.287 15.029 1.00 33.23 C ATOM 312 CE1 HIS A 22 10.687 -13.281 16.979 1.00 21.33 C ATOM 313 NE2 HIS A 22 10.265 -13.342 15.733 1.00 41.54 N ATOM 0 H HIS A 22 13.946 -8.470 15.317 1.00 22.03 H new ATOM 0 HA HIS A 22 14.254 -11.092 16.341 1.00 2.11 H new ATOM 0 HB2 HIS A 22 12.221 -9.664 16.560 1.00 42.33 H new ATOM 0 HB3 HIS A 22 11.960 -9.772 14.830 1.00 42.33 H new ATOM 0 HD2 HIS A 22 10.626 -12.069 13.984 1.00 33.23 H new ATOM 0 HE1 HIS A 22 10.439 -13.979 17.765 1.00 21.33 H new ATOM 0 HE2 HIS A 22 9.647 -14.059 15.352 1.00 41.54 H new ATOM 322 N ASP A 23 14.584 -10.740 13.200 1.00 65.30 N ATOM 323 CA ASP A 23 14.952 -11.414 11.964 1.00 52.23 C ATOM 324 C ASP A 23 16.332 -12.064 12.145 1.00 2.53 C ATOM 325 O ASP A 23 16.990 -12.462 11.183 1.00 21.54 O ATOM 326 CB ASP A 23 14.946 -10.392 10.813 1.00 41.44 C ATOM 327 CG ASP A 23 14.915 -11.023 9.426 1.00 73.43 C ATOM 328 OD1 ASP A 23 15.294 -10.337 8.449 1.00 71.33 O ATOM 329 OD2 ASP A 23 14.495 -12.193 9.303 1.00 13.13 O1- ATOM 0 H ASP A 23 14.747 -9.733 13.190 1.00 65.30 H new ATOM 0 HA ASP A 23 14.237 -12.199 11.719 1.00 52.23 H new ATOM 0 HB2 ASP A 23 14.080 -9.740 10.924 1.00 41.44 H new ATOM 0 HB3 ASP A 23 15.832 -9.762 10.895 1.00 41.44 H new ATOM 334 N GLN A 24 16.748 -12.144 13.421 1.00 30.45 N ATOM 335 CA GLN A 24 17.954 -12.850 13.853 1.00 23.53 C ATOM 336 C GLN A 24 19.209 -12.130 13.388 1.00 71.34 C ATOM 337 O GLN A 24 20.255 -12.752 13.170 1.00 22.01 O ATOM 338 CB GLN A 24 17.948 -14.308 13.360 1.00 42.54 C ATOM 339 CG GLN A 24 16.765 -15.127 13.870 1.00 72.53 C ATOM 340 CD GLN A 24 16.638 -15.101 15.384 1.00 14.50 C ATOM 341 OE1 GLN A 24 17.242 -15.915 16.083 1.00 45.33 O ATOM 342 NE2 GLN A 24 15.837 -14.177 15.897 1.00 4.22 N ATOM 0 H GLN A 24 16.241 -11.709 14.192 1.00 30.45 H new ATOM 0 HA GLN A 24 17.957 -12.861 14.943 1.00 23.53 H new ATOM 0 HB2 GLN A 24 17.938 -14.313 12.270 1.00 42.54 H new ATOM 0 HB3 GLN A 24 18.874 -14.791 13.673 1.00 42.54 H new ATOM 0 HG2 GLN A 24 15.846 -14.744 13.427 1.00 72.53 H new ATOM 0 HG3 GLN A 24 16.873 -16.159 13.537 1.00 72.53 H new ATOM 0 HE21 GLN A 24 15.355 -13.521 15.282 1.00 4.22 H new ATOM 0 HE22 GLN A 24 15.703 -14.122 16.907 1.00 4.22 H new ATOM 351 N LYS A 25 19.111 -10.812 13.267 1.00 22.35 N ATOM 352 CA LYS A 25 20.238 -10.001 12.828 1.00 24.04 C ATOM 353 C LYS A 25 20.774 -9.112 13.949 1.00 45.31 C ATOM 354 O LYS A 25 21.830 -8.498 13.788 1.00 73.44 O ATOM 355 CB LYS A 25 19.853 -9.167 11.597 1.00 30.31 C ATOM 356 CG LYS A 25 19.726 -10.003 10.323 1.00 12.14 C ATOM 357 CD LYS A 25 19.211 -9.191 9.136 1.00 61.23 C ATOM 358 CE LYS A 25 17.780 -8.715 9.355 1.00 52.51 C ATOM 359 NZ LYS A 25 17.184 -8.124 8.127 1.00 22.01 N1+ ATOM 0 H LYS A 25 18.262 -10.283 13.467 1.00 22.35 H new ATOM 0 HA LYS A 25 21.044 -10.680 12.549 1.00 24.04 H new ATOM 0 HB2 LYS A 25 18.906 -8.662 11.789 1.00 30.31 H new ATOM 0 HB3 LYS A 25 20.603 -8.391 11.442 1.00 30.31 H new ATOM 0 HG2 LYS A 25 20.698 -10.428 10.073 1.00 12.14 H new ATOM 0 HG3 LYS A 25 19.051 -10.839 10.507 1.00 12.14 H new ATOM 0 HD2 LYS A 25 19.860 -8.330 8.975 1.00 61.23 H new ATOM 0 HD3 LYS A 25 19.258 -9.798 8.232 1.00 61.23 H new ATOM 0 HE2 LYS A 25 17.168 -9.554 9.685 1.00 52.51 H new ATOM 0 HE3 LYS A 25 17.765 -7.975 10.155 1.00 52.51 H new ATOM 0 HZ1 LYS A 25 16.185 -7.893 8.302 1.00 22.01 H new ATOM 0 HZ2 LYS A 25 17.700 -7.258 7.873 1.00 22.01 H new ATOM 0 HZ3 LYS A 25 17.249 -8.807 7.346 1.00 22.01 H new ATOM 373 N LEU A 26 20.069 -9.022 15.088 1.00 32.33 N ATOM 374 CA LEU A 26 20.613 -8.264 16.224 1.00 24.31 C ATOM 375 C LEU A 26 20.075 -8.804 17.535 1.00 21.31 C ATOM 376 O LEU A 26 18.940 -9.252 17.582 1.00 11.34 O ATOM 377 CB LEU A 26 20.261 -6.777 16.077 1.00 35.55 C ATOM 378 CG LEU A 26 20.577 -5.882 17.286 1.00 2.25 C ATOM 379 CD1 LEU A 26 22.080 -5.748 17.501 1.00 31.22 C ATOM 380 CD2 LEU A 26 19.925 -4.517 17.109 1.00 74.42 C ATOM 0 H LEU A 26 19.155 -9.447 15.245 1.00 32.33 H new ATOM 0 HA LEU A 26 21.697 -8.374 16.229 1.00 24.31 H new ATOM 0 HB2 LEU A 26 20.793 -6.383 15.211 1.00 35.55 H new ATOM 0 HB3 LEU A 26 19.196 -6.697 15.861 1.00 35.55 H new ATOM 0 HG LEU A 26 20.164 -6.353 18.178 1.00 2.25 H new ATOM 0 HD11 LEU A 26 22.269 -5.109 18.364 1.00 31.22 H new ATOM 0 HD12 LEU A 26 22.511 -6.733 17.678 1.00 31.22 H new ATOM 0 HD13 LEU A 26 22.536 -5.306 16.615 1.00 31.22 H new ATOM 0 HD21 LEU A 26 20.154 -3.890 17.970 1.00 74.42 H new ATOM 0 HD22 LEU A 26 20.308 -4.045 16.204 1.00 74.42 H new ATOM 0 HD23 LEU A 26 18.845 -4.638 17.025 1.00 74.42 H new ATOM 392 N ASP A 27 20.893 -8.771 18.584 1.00 3.11 N ATOM 393 CA ASP A 27 20.462 -9.175 19.926 1.00 12.11 C ATOM 394 C ASP A 27 21.375 -8.561 20.984 1.00 11.44 C ATOM 395 O ASP A 27 22.455 -9.084 21.273 1.00 42.31 O ATOM 396 CB ASP A 27 20.434 -10.707 20.065 1.00 5.04 C ATOM 397 CG ASP A 27 20.178 -11.170 21.496 1.00 74.13 C ATOM 398 OD1 ASP A 27 19.072 -10.924 22.024 1.00 54.23 O ATOM 399 OD2 ASP A 27 21.079 -11.807 22.091 1.00 11.42 O1- ATOM 0 H ASP A 27 21.865 -8.467 18.533 1.00 3.11 H new ATOM 0 HA ASP A 27 19.448 -8.806 20.079 1.00 12.11 H new ATOM 0 HB2 ASP A 27 19.659 -11.111 19.414 1.00 5.04 H new ATOM 0 HB3 ASP A 27 21.384 -11.115 19.721 1.00 5.04 H new ATOM 404 N VAL A 28 20.951 -7.428 21.530 1.00 5.03 N ATOM 405 CA VAL A 28 21.704 -6.735 22.574 1.00 42.02 C ATOM 406 C VAL A 28 20.781 -6.178 23.645 1.00 62.12 C ATOM 407 O VAL A 28 19.557 -6.289 23.562 1.00 32.30 O ATOM 408 CB VAL A 28 22.576 -5.583 22.013 1.00 24.24 C ATOM 409 CG1 VAL A 28 23.817 -6.134 21.320 1.00 34.22 C ATOM 410 CG2 VAL A 28 21.764 -4.695 21.069 1.00 1.00 C ATOM 0 H VAL A 28 20.082 -6.964 21.266 1.00 5.03 H new ATOM 0 HA VAL A 28 22.364 -7.484 23.012 1.00 42.02 H new ATOM 0 HB VAL A 28 22.905 -4.966 22.849 1.00 24.24 H new ATOM 0 HG11 VAL A 28 24.415 -5.308 20.934 1.00 34.22 H new ATOM 0 HG12 VAL A 28 24.408 -6.707 22.034 1.00 34.22 H new ATOM 0 HG13 VAL A 28 23.516 -6.781 20.496 1.00 34.22 H new ATOM 0 HG21 VAL A 28 22.397 -3.894 20.688 1.00 1.00 H new ATOM 0 HG22 VAL A 28 21.394 -5.292 20.236 1.00 1.00 H new ATOM 0 HG23 VAL A 28 20.921 -4.265 21.609 1.00 1.00 H new ATOM 420 N LYS A 29 21.390 -5.574 24.650 1.00 24.10 N ATOM 421 CA LYS A 29 20.668 -5.023 25.781 1.00 44.35 C ATOM 422 C LYS A 29 21.230 -3.656 26.151 1.00 43.02 C ATOM 423 O LYS A 29 22.445 -3.446 26.130 1.00 12.55 O ATOM 424 CB LYS A 29 20.758 -6.003 26.958 1.00 13.02 C ATOM 425 CG LYS A 29 20.590 -5.365 28.335 1.00 22.53 C ATOM 426 CD LYS A 29 20.488 -6.415 29.439 1.00 24.23 C ATOM 427 CE LYS A 29 21.703 -7.336 29.472 1.00 1.41 C ATOM 428 NZ LYS A 29 22.959 -6.600 29.775 1.00 62.42 N1+ ATOM 0 H LYS A 29 22.401 -5.452 24.704 1.00 24.10 H new ATOM 0 HA LYS A 29 19.619 -4.885 25.520 1.00 44.35 H new ATOM 0 HB2 LYS A 29 19.994 -6.771 26.833 1.00 13.02 H new ATOM 0 HB3 LYS A 29 21.724 -6.506 26.921 1.00 13.02 H new ATOM 0 HG2 LYS A 29 21.436 -4.707 28.536 1.00 22.53 H new ATOM 0 HG3 LYS A 29 19.694 -4.744 28.341 1.00 22.53 H new ATOM 0 HD2 LYS A 29 20.385 -5.917 30.403 1.00 24.23 H new ATOM 0 HD3 LYS A 29 19.587 -7.010 29.290 1.00 24.23 H new ATOM 0 HE2 LYS A 29 21.548 -8.111 30.222 1.00 1.41 H new ATOM 0 HE3 LYS A 29 21.802 -7.839 28.510 1.00 1.41 H new ATOM 0 HZ1 LYS A 29 23.743 -7.276 29.871 1.00 62.42 H new ATOM 0 HZ2 LYS A 29 23.167 -5.936 29.002 1.00 62.42 H new ATOM 0 HZ3 LYS A 29 22.846 -6.073 30.664 1.00 62.42 H new ATOM 442 N LEU A 30 20.339 -2.728 26.473 1.00 2.53 N ATOM 443 CA LEU A 30 20.725 -1.385 26.861 1.00 41.03 C ATOM 444 C LEU A 30 20.082 -1.017 28.193 1.00 64.12 C ATOM 445 O LEU A 30 19.219 -1.756 28.711 1.00 54.30 O ATOM 446 CB LEU A 30 20.384 -0.352 25.756 1.00 11.12 C ATOM 447 CG LEU A 30 19.019 -0.473 25.039 1.00 54.41 C ATOM 448 CD1 LEU A 30 18.966 -1.700 24.129 1.00 21.32 C ATOM 449 CD2 LEU A 30 17.872 -0.476 26.040 1.00 54.12 C ATOM 0 H LEU A 30 19.332 -2.888 26.472 1.00 2.53 H new ATOM 0 HA LEU A 30 21.807 -1.363 26.988 1.00 41.03 H new ATOM 0 HB2 LEU A 30 20.440 0.642 26.200 1.00 11.12 H new ATOM 0 HB3 LEU A 30 21.165 -0.406 24.997 1.00 11.12 H new ATOM 0 HG LEU A 30 18.905 0.405 24.403 1.00 54.41 H new ATOM 0 HD11 LEU A 30 17.992 -1.751 23.643 1.00 21.32 H new ATOM 0 HD12 LEU A 30 19.746 -1.625 23.371 1.00 21.32 H new ATOM 0 HD13 LEU A 30 19.122 -2.600 24.723 1.00 21.32 H new ATOM 0 HD21 LEU A 30 16.925 -0.562 25.508 1.00 54.12 H new ATOM 0 HD22 LEU A 30 17.984 -1.321 26.720 1.00 54.12 H new ATOM 0 HD23 LEU A 30 17.884 0.453 26.610 1.00 54.12 H new ATOM 461 N SER A 31 20.504 0.112 28.745 1.00 75.34 N ATOM 462 CA SER A 31 20.002 0.560 30.033 1.00 34.22 C ATOM 463 C SER A 31 20.219 2.054 30.221 1.00 62.41 C ATOM 464 O SER A 31 21.191 2.617 29.714 1.00 64.13 O ATOM 465 CB SER A 31 20.680 -0.228 31.161 1.00 52.23 C ATOM 466 OG SER A 31 22.080 -0.276 30.981 1.00 11.31 O ATOM 0 H SER A 31 21.192 0.733 28.320 1.00 75.34 H new ATOM 0 HA SER A 31 18.928 0.375 30.065 1.00 34.22 H new ATOM 0 HB2 SER A 31 20.450 0.235 32.121 1.00 52.23 H new ATOM 0 HB3 SER A 31 20.280 -1.241 31.192 1.00 52.23 H new ATOM 0 HG SER A 31 22.431 -1.106 31.367 1.00 11.31 H new ATOM 472 N ALA A 32 19.297 2.686 30.941 1.00 52.21 N ATOM 473 CA ALA A 32 19.416 4.095 31.289 1.00 43.51 C ATOM 474 C ALA A 32 20.592 4.302 32.244 1.00 25.12 C ATOM 475 O ALA A 32 20.552 3.833 33.389 1.00 4.30 O ATOM 476 CB ALA A 32 18.120 4.592 31.921 1.00 22.44 C ATOM 0 H ALA A 32 18.452 2.238 31.297 1.00 52.21 H new ATOM 0 HA ALA A 32 19.600 4.670 30.381 1.00 43.51 H new ATOM 0 HB1 ALA A 32 18.221 5.647 32.177 1.00 22.44 H new ATOM 0 HB2 ALA A 32 17.299 4.467 31.215 1.00 22.44 H new ATOM 0 HB3 ALA A 32 17.912 4.018 32.824 1.00 22.44 H new ATOM 482 N PRO A 33 21.652 5.002 31.792 1.00 32.33 N ATOM 483 CA PRO A 33 22.862 5.210 32.594 1.00 35.40 C ATOM 484 C PRO A 33 22.536 5.845 33.945 1.00 50.42 C ATOM 485 O PRO A 33 22.095 6.995 34.014 1.00 70.53 O ATOM 486 CB PRO A 33 23.725 6.153 31.731 1.00 73.33 C ATOM 487 CG PRO A 33 22.783 6.726 30.721 1.00 10.15 C ATOM 488 CD PRO A 33 21.751 5.662 30.478 1.00 32.53 C ATOM 0 HA PRO A 33 23.368 4.274 32.829 1.00 35.40 H new ATOM 0 HB2 PRO A 33 24.179 6.937 32.337 1.00 73.33 H new ATOM 0 HB3 PRO A 33 24.539 5.612 31.249 1.00 73.33 H new ATOM 0 HG2 PRO A 33 22.322 7.642 31.091 1.00 10.15 H new ATOM 0 HG3 PRO A 33 23.306 6.982 29.799 1.00 10.15 H new ATOM 0 HD2 PRO A 33 20.797 6.087 30.165 1.00 32.53 H new ATOM 0 HD3 PRO A 33 22.062 4.967 29.698 1.00 32.53 H new ATOM 496 N ARG A 34 22.750 5.089 35.019 1.00 10.53 N ATOM 497 CA ARG A 34 22.408 5.551 36.361 1.00 33.33 C ATOM 498 C ARG A 34 23.288 6.730 36.789 1.00 40.12 C ATOM 499 O ARG A 34 23.049 7.351 37.824 1.00 0.24 O ATOM 500 CB ARG A 34 22.515 4.424 37.369 1.00 35.21 C ATOM 501 CG ARG A 34 21.684 4.686 38.614 1.00 34.41 C ATOM 502 CD ARG A 34 21.802 3.545 39.582 1.00 50.12 C ATOM 503 NE ARG A 34 21.017 3.752 40.797 1.00 3.50 N ATOM 504 CZ ARG A 34 20.757 2.796 41.690 1.00 2.33 C ATOM 505 NH1 ARG A 34 21.252 1.574 41.529 1.00 23.02 N1+ ATOM 506 NH2 ARG A 34 20.009 3.069 42.749 1.00 21.42 N ATOM 0 H ARG A 34 23.158 4.155 34.986 1.00 10.53 H new ATOM 0 HA ARG A 34 21.373 5.893 36.331 1.00 33.33 H new ATOM 0 HB2 ARG A 34 22.189 3.493 36.906 1.00 35.21 H new ATOM 0 HB3 ARG A 34 23.559 4.290 37.653 1.00 35.21 H new ATOM 0 HG2 ARG A 34 22.015 5.609 39.090 1.00 34.41 H new ATOM 0 HG3 ARG A 34 20.639 4.827 38.337 1.00 34.41 H new ATOM 0 HD2 ARG A 34 21.475 2.626 39.095 1.00 50.12 H new ATOM 0 HD3 ARG A 34 22.850 3.408 39.850 1.00 50.12 H new ATOM 0 HE ARG A 34 20.645 4.685 40.973 1.00 3.50 H new ATOM 0 HH11 ARG A 34 21.835 1.362 40.719 1.00 23.02 H new ATOM 0 HH12 ARG A 34 21.050 0.847 42.215 1.00 23.02 H new ATOM 0 HH21 ARG A 34 19.634 4.008 42.880 1.00 21.42 H new ATOM 0 HH22 ARG A 34 19.809 2.340 43.433 1.00 21.42 H new ATOM 520 N GLU A 35 24.282 7.037 35.960 1.00 72.31 N ATOM 521 CA GLU A 35 25.217 8.140 36.193 1.00 75.14 C ATOM 522 C GLU A 35 24.509 9.459 36.499 1.00 65.21 C ATOM 523 O GLU A 35 25.089 10.361 37.105 1.00 33.12 O ATOM 524 CB GLU A 35 26.127 8.281 34.971 1.00 20.34 C ATOM 525 CG GLU A 35 27.130 7.134 34.867 1.00 71.30 C ATOM 526 CD GLU A 35 28.019 7.207 33.640 1.00 31.03 C ATOM 527 OE1 GLU A 35 27.838 6.380 32.719 1.00 31.45 O ATOM 528 OE2 GLU A 35 28.906 8.085 33.598 1.00 43.03 O1- ATOM 0 H GLU A 35 24.465 6.523 35.098 1.00 72.31 H new ATOM 0 HA GLU A 35 25.809 7.904 37.077 1.00 75.14 H new ATOM 0 HB2 GLU A 35 25.518 8.313 34.068 1.00 20.34 H new ATOM 0 HB3 GLU A 35 26.664 9.228 35.027 1.00 20.34 H new ATOM 0 HG2 GLU A 35 27.757 7.130 35.759 1.00 71.30 H new ATOM 0 HG3 GLU A 35 26.587 6.189 34.855 1.00 71.30 H new ATOM 535 N LEU A 36 23.252 9.563 36.088 1.00 33.22 N ATOM 536 CA LEU A 36 22.462 10.768 36.314 1.00 32.24 C ATOM 537 C LEU A 36 21.256 10.448 37.194 1.00 55.25 C ATOM 538 O LEU A 36 20.182 11.029 37.031 1.00 40.24 O ATOM 539 CB LEU A 36 22.010 11.336 34.963 1.00 11.21 C ATOM 540 CG LEU A 36 23.143 11.560 33.947 1.00 24.22 C ATOM 541 CD1 LEU A 36 22.591 12.072 32.624 1.00 52.21 C ATOM 542 CD2 LEU A 36 24.200 12.513 34.505 1.00 63.44 C ATOM 0 H LEU A 36 22.754 8.823 35.593 1.00 33.22 H new ATOM 0 HA LEU A 36 23.070 11.513 36.828 1.00 32.24 H new ATOM 0 HB2 LEU A 36 21.278 10.657 34.526 1.00 11.21 H new ATOM 0 HB3 LEU A 36 21.502 12.285 35.135 1.00 11.21 H new ATOM 0 HG LEU A 36 23.624 10.599 33.762 1.00 24.22 H new ATOM 0 HD11 LEU A 36 23.411 12.223 31.922 1.00 52.21 H new ATOM 0 HD12 LEU A 36 21.892 11.343 32.215 1.00 52.21 H new ATOM 0 HD13 LEU A 36 22.074 13.018 32.787 1.00 52.21 H new ATOM 0 HD21 LEU A 36 24.989 12.654 33.766 1.00 63.44 H new ATOM 0 HD22 LEU A 36 23.740 13.475 34.732 1.00 63.44 H new ATOM 0 HD23 LEU A 36 24.626 12.091 35.415 1.00 63.44 H new ATOM 554 N GLY A 37 21.450 9.530 38.141 1.00 72.22 N ATOM 555 CA GLY A 37 20.354 9.079 38.981 1.00 12.23 C ATOM 556 C GLY A 37 19.325 8.320 38.168 1.00 31.23 C ATOM 557 O GLY A 37 18.118 8.511 38.330 1.00 41.24 O ATOM 0 H GLY A 37 22.349 9.091 38.340 1.00 72.22 H new ATOM 0 HA2 GLY A 37 20.739 8.440 39.775 1.00 12.23 H new ATOM 0 HA3 GLY A 37 19.883 9.936 39.462 1.00 12.23 H new ATOM 561 N GLY A 38 19.825 7.446 37.299 1.00 73.44 N ATOM 562 CA GLY A 38 18.984 6.767 36.325 1.00 31.42 C ATOM 563 C GLY A 38 18.253 5.574 36.902 1.00 22.15 C ATOM 564 O GLY A 38 17.360 5.732 37.734 1.00 21.21 O ATOM 0 H GLY A 38 20.812 7.193 37.252 1.00 73.44 H new ATOM 0 HA2 GLY A 38 18.256 7.474 35.927 1.00 31.42 H new ATOM 0 HA3 GLY A 38 19.600 6.438 35.488 1.00 31.42 H new ATOM 568 N ALA A 39 18.639 4.369 36.482 1.00 14.21 N ATOM 569 CA ALA A 39 17.927 3.165 36.882 1.00 43.43 C ATOM 570 C ALA A 39 18.861 2.167 37.549 1.00 63.22 C ATOM 571 O ALA A 39 18.630 1.770 38.694 1.00 3.43 O ATOM 572 CB ALA A 39 17.231 2.534 35.680 1.00 5.43 C ATOM 0 H ALA A 39 19.437 4.206 35.868 1.00 14.21 H new ATOM 0 HA ALA A 39 17.169 3.448 37.613 1.00 43.43 H new ATOM 0 HB1 ALA A 39 16.703 1.634 35.996 1.00 5.43 H new ATOM 0 HB2 ALA A 39 16.519 3.243 35.258 1.00 5.43 H new ATOM 0 HB3 ALA A 39 17.973 2.273 34.926 1.00 5.43 H new ATOM 578 N GLY A 40 19.916 1.758 36.849 1.00 15.31 N ATOM 579 CA GLY A 40 20.836 0.809 37.439 1.00 42.15 C ATOM 580 C GLY A 40 22.071 0.533 36.601 1.00 45.53 C ATOM 581 O GLY A 40 23.141 1.086 36.865 1.00 15.12 O ATOM 0 H GLY A 40 20.145 2.061 35.902 1.00 15.31 H new ATOM 0 HA2 GLY A 40 21.149 1.182 38.414 1.00 42.15 H new ATOM 0 HA3 GLY A 40 20.310 -0.130 37.611 1.00 42.15 H new ATOM 585 N ALA A 41 21.920 -0.322 35.595 1.00 5.32 N ATOM 586 CA ALA A 41 23.059 -0.849 34.841 1.00 5.21 C ATOM 587 C ALA A 41 23.691 0.187 33.915 1.00 44.21 C ATOM 588 O ALA A 41 23.272 1.348 33.866 1.00 13.22 O ATOM 589 CB ALA A 41 22.636 -2.069 34.037 1.00 40.21 C ATOM 0 H ALA A 41 21.014 -0.669 35.279 1.00 5.32 H new ATOM 0 HA ALA A 41 23.817 -1.128 35.573 1.00 5.21 H new ATOM 0 HB1 ALA A 41 23.491 -2.452 33.480 1.00 40.21 H new ATOM 0 HB2 ALA A 41 22.268 -2.841 34.713 1.00 40.21 H new ATOM 0 HB3 ALA A 41 21.845 -1.790 33.341 1.00 40.21 H new ATOM 595 N GLU A 42 24.711 -0.262 33.185 1.00 32.32 N ATOM 596 CA GLU A 42 25.425 0.574 32.230 1.00 71.23 C ATOM 597 C GLU A 42 24.865 0.373 30.855 1.00 1.12 C ATOM 598 O GLU A 42 24.459 1.302 30.152 1.00 55.43 O ATOM 599 CB GLU A 42 26.917 0.224 32.219 1.00 42.31 C ATOM 600 CG GLU A 42 27.522 0.026 33.599 1.00 52.14 C ATOM 601 CD GLU A 42 28.993 -0.342 33.521 1.00 31.41 C ATOM 602 OE1 GLU A 42 29.821 0.553 33.258 1.00 24.22 O ATOM 603 OE2 GLU A 42 29.325 -1.537 33.685 1.00 54.53 O1- ATOM 0 H GLU A 42 25.064 -1.217 33.242 1.00 32.32 H new ATOM 0 HA GLU A 42 25.303 1.615 32.529 1.00 71.23 H new ATOM 0 HB2 GLU A 42 27.060 -0.687 31.638 1.00 42.31 H new ATOM 0 HB3 GLU A 42 27.461 1.018 31.707 1.00 42.31 H new ATOM 0 HG2 GLU A 42 27.406 0.940 34.181 1.00 52.14 H new ATOM 0 HG3 GLU A 42 26.978 -0.758 34.125 1.00 52.14 H new ATOM 610 N GLY A 43 24.856 -0.879 30.541 1.00 3.30 N ATOM 611 CA GLY A 43 24.421 -1.388 29.248 1.00 20.41 C ATOM 612 C GLY A 43 24.900 -0.518 28.107 1.00 55.55 C ATOM 613 O GLY A 43 26.092 -0.226 27.997 1.00 25.21 O ATOM 0 H GLY A 43 25.157 -1.612 31.184 1.00 3.30 H new ATOM 0 HA2 GLY A 43 24.796 -2.402 29.113 1.00 20.41 H new ATOM 0 HA3 GLY A 43 23.333 -1.445 29.228 1.00 20.41 H new ATOM 617 N THR A 44 23.975 -0.100 27.260 1.00 1.14 N ATOM 618 CA THR A 44 24.257 0.900 26.249 1.00 0.00 C ATOM 619 C THR A 44 23.203 1.992 26.336 1.00 54.32 C ATOM 620 O THR A 44 22.115 1.764 26.876 1.00 53.24 O ATOM 621 CB THR A 44 24.296 0.281 24.831 1.00 74.01 C ATOM 622 OG1 THR A 44 23.109 -0.483 24.591 1.00 60.01 O ATOM 623 CG2 THR A 44 25.512 -0.619 24.667 1.00 54.14 C ATOM 0 H THR A 44 23.014 -0.442 27.255 1.00 1.14 H new ATOM 0 HA THR A 44 25.244 1.325 26.434 1.00 0.00 H new ATOM 0 HB THR A 44 24.358 1.096 24.110 1.00 74.01 H new ATOM 0 HG1 THR A 44 23.144 -0.868 23.691 1.00 60.01 H new ATOM 0 HG21 THR A 44 25.518 -1.043 23.663 1.00 54.14 H new ATOM 0 HG22 THR A 44 26.420 -0.036 24.820 1.00 54.14 H new ATOM 0 HG23 THR A 44 25.470 -1.424 25.400 1.00 54.14 H new ATOM 631 N ASN A 45 23.529 3.180 25.854 1.00 72.33 N ATOM 632 CA ASN A 45 22.595 4.297 25.902 1.00 33.43 C ATOM 633 C ASN A 45 21.791 4.333 24.610 1.00 24.30 C ATOM 634 O ASN A 45 22.368 4.280 23.527 1.00 63.01 O ATOM 635 CB ASN A 45 23.332 5.635 26.094 1.00 4.20 C ATOM 636 CG ASN A 45 24.313 5.634 27.258 1.00 5.33 C ATOM 637 OD1 ASN A 45 24.979 4.634 27.540 1.00 50.31 O ATOM 638 ND2 ASN A 45 24.410 6.761 27.945 1.00 41.45 N ATOM 0 H ASN A 45 24.429 3.397 25.426 1.00 72.33 H new ATOM 0 HA ASN A 45 21.930 4.155 26.754 1.00 33.43 H new ATOM 0 HB2 ASN A 45 23.870 5.878 25.178 1.00 4.20 H new ATOM 0 HB3 ASN A 45 22.597 6.425 26.251 1.00 4.20 H new ATOM 0 HD21 ASN A 45 25.051 6.823 28.736 1.00 41.45 H new ATOM 0 HD22 ASN A 45 23.844 7.568 27.683 1.00 41.45 H new ATOM 645 N PRO A 46 20.453 4.404 24.696 1.00 63.04 N ATOM 646 CA PRO A 46 19.588 4.476 23.513 1.00 61.02 C ATOM 647 C PRO A 46 19.997 5.612 22.567 1.00 4.44 C ATOM 648 O PRO A 46 19.934 5.466 21.344 1.00 23.02 O ATOM 649 CB PRO A 46 18.179 4.709 24.091 1.00 23.35 C ATOM 650 CG PRO A 46 18.378 5.038 25.536 1.00 42.23 C ATOM 651 CD PRO A 46 19.675 4.401 25.945 1.00 1.14 C ATOM 0 HA PRO A 46 19.651 3.572 22.907 1.00 61.02 H new ATOM 0 HB2 PRO A 46 17.673 5.523 23.571 1.00 23.35 H new ATOM 0 HB3 PRO A 46 17.557 3.821 23.975 1.00 23.35 H new ATOM 0 HG2 PRO A 46 18.411 6.117 25.687 1.00 42.23 H new ATOM 0 HG3 PRO A 46 17.552 4.657 26.138 1.00 42.23 H new ATOM 0 HD2 PRO A 46 20.173 4.968 26.732 1.00 1.14 H new ATOM 0 HD3 PRO A 46 19.526 3.390 26.325 1.00 1.14 H new ATOM 659 N GLU A 47 20.452 6.725 23.143 1.00 25.31 N ATOM 660 CA GLU A 47 20.885 7.884 22.363 1.00 53.11 C ATOM 661 C GLU A 47 22.205 7.556 21.673 1.00 42.42 C ATOM 662 O GLU A 47 22.456 7.948 20.534 1.00 0.52 O ATOM 663 CB GLU A 47 21.070 9.119 23.266 1.00 52.55 C ATOM 664 CG GLU A 47 19.834 9.514 24.079 1.00 35.10 C ATOM 665 CD GLU A 47 19.467 8.506 25.161 1.00 32.04 C ATOM 666 OE1 GLU A 47 20.387 7.882 25.741 1.00 53.13 O ATOM 667 OE2 GLU A 47 18.258 8.335 25.432 1.00 62.13 O1- ATOM 0 H GLU A 47 20.530 6.848 24.152 1.00 25.31 H new ATOM 0 HA GLU A 47 20.119 8.113 21.622 1.00 53.11 H new ATOM 0 HB2 GLU A 47 21.894 8.928 23.954 1.00 52.55 H new ATOM 0 HB3 GLU A 47 21.364 9.965 22.644 1.00 52.55 H new ATOM 0 HG2 GLU A 47 20.010 10.484 24.543 1.00 35.10 H new ATOM 0 HG3 GLU A 47 18.987 9.633 23.403 1.00 35.10 H new ATOM 674 N GLN A 48 23.031 6.819 22.398 1.00 41.14 N ATOM 675 CA GLN A 48 24.334 6.365 21.922 1.00 71.11 C ATOM 676 C GLN A 48 24.169 5.363 20.777 1.00 34.04 C ATOM 677 O GLN A 48 24.911 5.395 19.794 1.00 32.22 O ATOM 678 CB GLN A 48 25.075 5.733 23.106 1.00 12.45 C ATOM 679 CG GLN A 48 26.321 4.940 22.757 1.00 72.35 C ATOM 680 CD GLN A 48 26.908 4.252 23.979 1.00 3.55 C ATOM 681 OE1 GLN A 48 26.507 3.142 24.342 1.00 43.42 O ATOM 682 NE2 GLN A 48 27.872 4.895 24.612 1.00 72.04 N ATOM 0 H GLN A 48 22.815 6.514 23.347 1.00 41.14 H new ATOM 0 HA GLN A 48 24.909 7.205 21.533 1.00 71.11 H new ATOM 0 HB2 GLN A 48 25.354 6.525 23.801 1.00 12.45 H new ATOM 0 HB3 GLN A 48 24.384 5.075 23.634 1.00 12.45 H new ATOM 0 HG2 GLN A 48 26.078 4.194 22.001 1.00 72.35 H new ATOM 0 HG3 GLN A 48 27.066 5.605 22.321 1.00 72.35 H new ATOM 0 HE21 GLN A 48 28.176 5.811 24.282 1.00 72.04 H new ATOM 0 HE22 GLN A 48 28.312 4.476 25.431 1.00 72.04 H new ATOM 691 N LEU A 49 23.177 4.490 20.914 1.00 51.33 N ATOM 692 CA LEU A 49 22.876 3.484 19.903 1.00 61.13 C ATOM 693 C LEU A 49 22.367 4.174 18.635 1.00 21.55 C ATOM 694 O LEU A 49 22.821 3.880 17.528 1.00 71.11 O ATOM 695 CB LEU A 49 21.841 2.485 20.466 1.00 4.20 C ATOM 696 CG LEU A 49 21.573 1.207 19.639 1.00 31.10 C ATOM 697 CD1 LEU A 49 20.688 1.495 18.429 1.00 0.52 C ATOM 698 CD2 LEU A 49 22.888 0.556 19.204 1.00 52.41 C ATOM 0 H LEU A 49 22.561 4.460 21.726 1.00 51.33 H new ATOM 0 HA LEU A 49 23.775 2.926 19.644 1.00 61.13 H new ATOM 0 HB2 LEU A 49 22.170 2.182 21.460 1.00 4.20 H new ATOM 0 HB3 LEU A 49 20.895 3.012 20.590 1.00 4.20 H new ATOM 0 HG LEU A 49 21.037 0.508 20.281 1.00 31.10 H new ATOM 0 HD11 LEU A 49 20.522 0.573 17.872 1.00 0.52 H new ATOM 0 HD12 LEU A 49 19.731 1.894 18.765 1.00 0.52 H new ATOM 0 HD13 LEU A 49 21.179 2.224 17.785 1.00 0.52 H new ATOM 0 HD21 LEU A 49 22.675 -0.342 18.623 1.00 52.41 H new ATOM 0 HD22 LEU A 49 23.456 1.257 18.593 1.00 52.41 H new ATOM 0 HD23 LEU A 49 23.470 0.288 20.086 1.00 52.41 H new ATOM 710 N PHE A 50 21.429 5.100 18.817 1.00 3.42 N ATOM 711 CA PHE A 50 20.891 5.898 17.715 1.00 25.51 C ATOM 712 C PHE A 50 22.006 6.692 17.032 1.00 64.45 C ATOM 713 O PHE A 50 22.059 6.772 15.806 1.00 15.22 O ATOM 714 CB PHE A 50 19.798 6.836 18.248 1.00 52.14 C ATOM 715 CG PHE A 50 19.366 7.924 17.289 1.00 40.34 C ATOM 716 CD1 PHE A 50 18.638 7.629 16.145 1.00 40.14 C ATOM 717 CD2 PHE A 50 19.670 9.248 17.556 1.00 31.01 C ATOM 718 CE1 PHE A 50 18.227 8.632 15.288 1.00 11.20 C ATOM 719 CE2 PHE A 50 19.268 10.254 16.702 1.00 34.34 C ATOM 720 CZ PHE A 50 18.544 9.947 15.565 1.00 61.21 C ATOM 0 H PHE A 50 21.021 5.319 19.726 1.00 3.42 H new ATOM 0 HA PHE A 50 20.453 5.233 16.971 1.00 25.51 H new ATOM 0 HB2 PHE A 50 18.926 6.239 18.513 1.00 52.14 H new ATOM 0 HB3 PHE A 50 20.156 7.302 19.166 1.00 52.14 H new ATOM 0 HD1 PHE A 50 18.389 6.602 15.922 1.00 40.14 H new ATOM 0 HD2 PHE A 50 20.230 9.497 18.445 1.00 31.01 H new ATOM 0 HE1 PHE A 50 17.659 8.388 14.403 1.00 11.20 H new ATOM 0 HE2 PHE A 50 19.519 11.281 16.922 1.00 34.34 H new ATOM 0 HZ PHE A 50 18.227 10.733 14.896 1.00 61.21 H new ATOM 730 N ALA A 51 22.886 7.278 17.837 1.00 33.43 N ATOM 731 CA ALA A 51 24.040 8.019 17.327 1.00 33.33 C ATOM 732 C ALA A 51 24.915 7.143 16.433 1.00 4.13 C ATOM 733 O ALA A 51 25.222 7.509 15.293 1.00 52.03 O ATOM 734 CB ALA A 51 24.863 8.562 18.483 1.00 51.41 C ATOM 0 H ALA A 51 22.823 7.255 18.855 1.00 33.43 H new ATOM 0 HA ALA A 51 23.666 8.848 16.726 1.00 33.33 H new ATOM 0 HB1 ALA A 51 25.720 9.112 18.093 1.00 51.41 H new ATOM 0 HB2 ALA A 51 24.247 9.229 19.086 1.00 51.41 H new ATOM 0 HB3 ALA A 51 25.213 7.735 19.100 1.00 51.41 H new ATOM 740 N ALA A 52 25.315 5.989 16.962 1.00 32.43 N ATOM 741 CA ALA A 52 26.162 5.054 16.228 1.00 41.10 C ATOM 742 C ALA A 52 25.470 4.608 14.945 1.00 30.53 C ATOM 743 O ALA A 52 26.077 4.578 13.870 1.00 13.40 O ATOM 744 CB ALA A 52 26.502 3.850 17.103 1.00 51.43 C ATOM 0 H ALA A 52 25.064 5.679 17.901 1.00 32.43 H new ATOM 0 HA ALA A 52 27.090 5.558 15.960 1.00 41.10 H new ATOM 0 HB1 ALA A 52 27.134 3.160 16.543 1.00 51.43 H new ATOM 0 HB2 ALA A 52 27.032 4.186 17.994 1.00 51.43 H new ATOM 0 HB3 ALA A 52 25.583 3.343 17.397 1.00 51.43 H new ATOM 750 N GLY A 53 24.186 4.284 15.069 1.00 32.23 N ATOM 751 CA GLY A 53 23.401 3.867 13.926 1.00 45.35 C ATOM 752 C GLY A 53 23.335 4.937 12.860 1.00 24.44 C ATOM 753 O GLY A 53 23.651 4.684 11.706 1.00 23.31 O ATOM 0 H GLY A 53 23.674 4.304 15.951 1.00 32.23 H new ATOM 0 HA2 GLY A 53 23.832 2.960 13.502 1.00 45.35 H new ATOM 0 HA3 GLY A 53 22.391 3.618 14.252 1.00 45.35 H new ATOM 757 N TYR A 54 22.951 6.144 13.262 1.00 20.42 N ATOM 758 CA TYR A 54 22.801 7.268 12.338 1.00 1.52 C ATOM 759 C TYR A 54 24.113 7.526 11.592 1.00 10.14 C ATOM 760 O TYR A 54 24.138 7.593 10.362 1.00 3.35 O ATOM 761 CB TYR A 54 22.364 8.527 13.118 1.00 4.31 C ATOM 762 CG TYR A 54 21.910 9.717 12.268 1.00 71.40 C ATOM 763 CD1 TYR A 54 22.050 9.736 10.879 1.00 61.33 C ATOM 764 CD2 TYR A 54 21.326 10.830 12.873 1.00 12.15 C ATOM 765 CE1 TYR A 54 21.625 10.819 10.128 1.00 65.13 C ATOM 766 CE2 TYR A 54 20.902 11.914 12.127 1.00 14.31 C ATOM 767 CZ TYR A 54 21.053 11.904 10.757 1.00 61.32 C ATOM 768 OH TYR A 54 20.619 12.982 10.012 1.00 14.13 O ATOM 0 H TYR A 54 22.735 6.373 14.232 1.00 20.42 H new ATOM 0 HA TYR A 54 22.035 7.024 11.602 1.00 1.52 H new ATOM 0 HB2 TYR A 54 21.549 8.251 13.787 1.00 4.31 H new ATOM 0 HB3 TYR A 54 23.196 8.849 13.745 1.00 4.31 H new ATOM 0 HD1 TYR A 54 22.499 8.889 10.380 1.00 61.33 H new ATOM 0 HD2 TYR A 54 21.203 10.845 13.946 1.00 12.15 H new ATOM 0 HE1 TYR A 54 21.741 10.814 9.054 1.00 65.13 H new ATOM 0 HE2 TYR A 54 20.454 12.766 12.616 1.00 14.31 H new ATOM 0 HH TYR A 54 20.998 12.930 9.110 1.00 14.13 H new ATOM 778 N SER A 55 25.201 7.647 12.344 1.00 11.10 N ATOM 779 CA SER A 55 26.501 7.953 11.761 1.00 22.53 C ATOM 780 C SER A 55 26.922 6.866 10.769 1.00 50.31 C ATOM 781 O SER A 55 27.243 7.162 9.617 1.00 23.31 O ATOM 782 CB SER A 55 27.549 8.126 12.866 1.00 0.44 C ATOM 783 OG SER A 55 27.598 6.993 13.720 1.00 35.10 O ATOM 0 H SER A 55 25.208 7.538 13.358 1.00 11.10 H new ATOM 0 HA SER A 55 26.423 8.891 11.211 1.00 22.53 H new ATOM 0 HB2 SER A 55 28.529 8.287 12.417 1.00 0.44 H new ATOM 0 HB3 SER A 55 27.317 9.015 13.453 1.00 0.44 H new ATOM 0 HG SER A 55 26.847 7.024 14.348 1.00 35.10 H new ATOM 789 N ALA A 56 26.887 5.610 11.213 1.00 25.24 N ATOM 790 CA ALA A 56 27.261 4.481 10.365 1.00 63.14 C ATOM 791 C ALA A 56 26.342 4.383 9.146 1.00 34.41 C ATOM 792 O ALA A 56 26.795 4.135 8.029 1.00 72.41 O ATOM 793 CB ALA A 56 27.230 3.186 11.167 1.00 2.41 C ATOM 0 H ALA A 56 26.603 5.349 12.157 1.00 25.24 H new ATOM 0 HA ALA A 56 28.277 4.644 10.006 1.00 63.14 H new ATOM 0 HB1 ALA A 56 27.511 2.352 10.523 1.00 2.41 H new ATOM 0 HB2 ALA A 56 27.932 3.256 11.998 1.00 2.41 H new ATOM 0 HB3 ALA A 56 26.225 3.022 11.555 1.00 2.41 H new ATOM 799 N CYS A 57 25.048 4.602 9.373 1.00 43.11 N ATOM 800 CA CYS A 57 24.049 4.544 8.310 1.00 65.50 C ATOM 801 C CYS A 57 24.310 5.623 7.269 1.00 1.30 C ATOM 802 O CYS A 57 24.080 5.411 6.078 1.00 31.43 O ATOM 803 CB CYS A 57 22.630 4.680 8.876 1.00 74.40 C ATOM 804 SG CYS A 57 22.137 3.305 9.942 1.00 3.24 S ATOM 0 H CYS A 57 24.666 4.823 10.292 1.00 43.11 H new ATOM 0 HA CYS A 57 24.130 3.569 7.829 1.00 65.50 H new ATOM 0 HB2 CYS A 57 22.562 5.609 9.442 1.00 74.40 H new ATOM 0 HB3 CYS A 57 21.924 4.758 8.049 1.00 74.40 H new ATOM 0 HG CYS A 57 22.762 3.391 11.078 1.00 3.24 H new ATOM 810 N PHE A 58 24.773 6.786 7.727 1.00 12.51 N ATOM 811 CA PHE A 58 25.023 7.918 6.840 1.00 55.51 C ATOM 812 C PHE A 58 25.968 7.508 5.707 1.00 60.31 C ATOM 813 O PHE A 58 25.864 8.015 4.586 1.00 54.45 O ATOM 814 CB PHE A 58 25.607 9.100 7.629 1.00 64.12 C ATOM 815 CG PHE A 58 25.569 10.404 6.871 1.00 32.51 C ATOM 816 CD1 PHE A 58 26.695 10.886 6.216 1.00 53.31 C ATOM 817 CD2 PHE A 58 24.397 11.143 6.813 1.00 40.52 C ATOM 818 CE1 PHE A 58 26.649 12.079 5.520 1.00 60.42 C ATOM 819 CE2 PHE A 58 24.347 12.336 6.120 1.00 51.42 C ATOM 820 CZ PHE A 58 25.473 12.803 5.472 1.00 5.31 C ATOM 0 H PHE A 58 24.982 6.967 8.709 1.00 12.51 H new ATOM 0 HA PHE A 58 24.075 8.232 6.403 1.00 55.51 H new ATOM 0 HB2 PHE A 58 25.053 9.214 8.561 1.00 64.12 H new ATOM 0 HB3 PHE A 58 26.639 8.874 7.897 1.00 64.12 H new ATOM 0 HD1 PHE A 58 27.616 10.323 6.251 1.00 53.31 H new ATOM 0 HD2 PHE A 58 23.513 10.781 7.316 1.00 40.52 H new ATOM 0 HE1 PHE A 58 27.531 12.445 5.015 1.00 60.42 H new ATOM 0 HE2 PHE A 58 23.428 12.903 6.085 1.00 51.42 H new ATOM 0 HZ PHE A 58 25.435 13.735 4.927 1.00 5.31 H new ATOM 830 N LEU A 59 26.873 6.576 6.005 1.00 64.51 N ATOM 831 CA LEU A 59 27.781 6.032 4.996 1.00 63.33 C ATOM 832 C LEU A 59 26.984 5.283 3.927 1.00 14.15 C ATOM 833 O LEU A 59 27.133 5.546 2.734 1.00 3.51 O ATOM 834 CB LEU A 59 28.830 5.097 5.632 1.00 74.12 C ATOM 835 CG LEU A 59 29.976 5.792 6.400 1.00 31.41 C ATOM 836 CD1 LEU A 59 29.450 6.587 7.590 1.00 61.22 C ATOM 837 CD2 LEU A 59 31.015 4.767 6.858 1.00 2.33 C ATOM 0 H LEU A 59 26.997 6.182 6.938 1.00 64.51 H new ATOM 0 HA LEU A 59 28.312 6.864 4.533 1.00 63.33 H new ATOM 0 HB2 LEU A 59 28.318 4.420 6.316 1.00 74.12 H new ATOM 0 HB3 LEU A 59 29.267 4.483 4.844 1.00 74.12 H new ATOM 0 HG LEU A 59 30.454 6.494 5.717 1.00 31.41 H new ATOM 0 HD11 LEU A 59 30.284 7.062 8.107 1.00 61.22 H new ATOM 0 HD12 LEU A 59 28.757 7.352 7.239 1.00 61.22 H new ATOM 0 HD13 LEU A 59 28.933 5.916 8.276 1.00 61.22 H new ATOM 0 HD21 LEU A 59 31.814 5.275 7.397 1.00 2.33 H new ATOM 0 HD22 LEU A 59 30.541 4.037 7.515 1.00 2.33 H new ATOM 0 HD23 LEU A 59 31.431 4.257 5.989 1.00 2.33 H new ATOM 849 N SER A 60 26.126 4.367 4.368 1.00 34.05 N ATOM 850 CA SER A 60 25.282 3.592 3.462 1.00 74.40 C ATOM 851 C SER A 60 24.363 4.521 2.655 1.00 42.34 C ATOM 852 O SER A 60 24.116 4.301 1.462 1.00 41.15 O ATOM 853 CB SER A 60 24.452 2.584 4.266 1.00 52.34 C ATOM 854 OG SER A 60 25.271 1.861 5.172 1.00 74.20 O ATOM 0 H SER A 60 25.996 4.142 5.354 1.00 34.05 H new ATOM 0 HA SER A 60 25.918 3.051 2.761 1.00 74.40 H new ATOM 0 HB2 SER A 60 23.669 3.107 4.815 1.00 52.34 H new ATOM 0 HB3 SER A 60 23.956 1.891 3.586 1.00 52.34 H new ATOM 0 HG SER A 60 25.676 1.098 4.709 1.00 74.20 H new ATOM 860 N ALA A 61 23.874 5.573 3.311 1.00 5.22 N ATOM 861 CA ALA A 61 23.033 6.569 2.660 1.00 61.10 C ATOM 862 C ALA A 61 23.804 7.242 1.531 1.00 23.52 C ATOM 863 O ALA A 61 23.326 7.331 0.398 1.00 64.15 O ATOM 864 CB ALA A 61 22.544 7.602 3.675 1.00 23.00 C ATOM 0 H ALA A 61 24.049 5.755 4.299 1.00 5.22 H new ATOM 0 HA ALA A 61 22.160 6.073 2.237 1.00 61.10 H new ATOM 0 HB1 ALA A 61 21.917 8.338 3.172 1.00 23.00 H new ATOM 0 HB2 ALA A 61 21.965 7.103 4.452 1.00 23.00 H new ATOM 0 HB3 ALA A 61 23.401 8.103 4.126 1.00 23.00 H new ATOM 870 N MET A 62 25.021 7.687 1.844 1.00 1.42 N ATOM 871 CA MET A 62 25.890 8.299 0.845 1.00 22.23 C ATOM 872 C MET A 62 26.383 7.262 -0.155 1.00 52.25 C ATOM 873 O MET A 62 26.815 7.613 -1.248 1.00 52.11 O ATOM 874 CB MET A 62 27.088 9.008 1.488 1.00 12.31 C ATOM 875 CG MET A 62 26.759 10.369 2.087 1.00 13.45 C ATOM 876 SD MET A 62 28.183 11.478 2.068 1.00 13.34 S ATOM 877 CE MET A 62 28.508 11.573 0.303 1.00 61.32 C ATOM 0 H MET A 62 25.424 7.634 2.779 1.00 1.42 H new ATOM 0 HA MET A 62 25.294 9.046 0.321 1.00 22.23 H new ATOM 0 HB2 MET A 62 27.498 8.369 2.270 1.00 12.31 H new ATOM 0 HB3 MET A 62 27.868 9.133 0.737 1.00 12.31 H new ATOM 0 HG2 MET A 62 25.939 10.822 1.529 1.00 13.45 H new ATOM 0 HG3 MET A 62 26.414 10.240 3.113 1.00 13.45 H new ATOM 0 HE1 MET A 62 29.427 11.034 0.073 1.00 61.32 H new ATOM 0 HE2 MET A 62 27.678 11.126 -0.244 1.00 61.32 H new ATOM 0 HE3 MET A 62 28.616 12.617 0.009 1.00 61.32 H new ATOM 887 N LYS A 63 26.336 5.989 0.224 1.00 50.31 N ATOM 888 CA LYS A 63 26.680 4.913 -0.697 1.00 32.21 C ATOM 889 C LYS A 63 25.631 4.846 -1.803 1.00 55.33 C ATOM 890 O LYS A 63 25.962 4.729 -2.986 1.00 31.21 O ATOM 891 CB LYS A 63 26.771 3.561 0.031 1.00 32.54 C ATOM 892 CG LYS A 63 27.175 2.402 -0.878 1.00 62.32 C ATOM 893 CD LYS A 63 28.596 2.569 -1.411 1.00 52.53 C ATOM 894 CE LYS A 63 28.912 1.561 -2.509 1.00 52.13 C ATOM 895 NZ LYS A 63 28.104 1.807 -3.735 1.00 51.23 N1+ ATOM 0 H LYS A 63 26.065 5.679 1.157 1.00 50.31 H new ATOM 0 HA LYS A 63 27.659 5.122 -1.128 1.00 32.21 H new ATOM 0 HB2 LYS A 63 27.493 3.643 0.843 1.00 32.54 H new ATOM 0 HB3 LYS A 63 25.806 3.336 0.484 1.00 32.54 H new ATOM 0 HG2 LYS A 63 27.101 1.465 -0.327 1.00 62.32 H new ATOM 0 HG3 LYS A 63 26.479 2.336 -1.714 1.00 62.32 H new ATOM 0 HD2 LYS A 63 28.722 3.580 -1.799 1.00 52.53 H new ATOM 0 HD3 LYS A 63 29.307 2.450 -0.593 1.00 52.53 H new ATOM 0 HE2 LYS A 63 29.972 1.613 -2.756 1.00 52.13 H new ATOM 0 HE3 LYS A 63 28.719 0.553 -2.143 1.00 52.13 H new ATOM 0 HZ1 LYS A 63 28.534 1.308 -4.540 1.00 51.23 H new ATOM 0 HZ2 LYS A 63 27.135 1.458 -3.588 1.00 51.23 H new ATOM 0 HZ3 LYS A 63 28.078 2.827 -3.935 1.00 51.23 H new ATOM 909 N PHE A 64 24.362 4.930 -1.406 1.00 54.13 N ATOM 910 CA PHE A 64 23.261 4.982 -2.366 1.00 15.41 C ATOM 911 C PHE A 64 23.355 6.254 -3.210 1.00 43.31 C ATOM 912 O PHE A 64 23.213 6.214 -4.434 1.00 31.42 O ATOM 913 CB PHE A 64 21.907 4.919 -1.642 1.00 54.23 C ATOM 914 CG PHE A 64 20.721 5.139 -2.556 1.00 22.52 C ATOM 915 CD1 PHE A 64 20.512 4.320 -3.657 1.00 70.34 C ATOM 916 CD2 PHE A 64 19.823 6.172 -2.317 1.00 44.41 C ATOM 917 CE1 PHE A 64 19.436 4.527 -4.499 1.00 70.35 C ATOM 918 CE2 PHE A 64 18.744 6.380 -3.156 1.00 31.33 C ATOM 919 CZ PHE A 64 18.552 5.558 -4.250 1.00 62.32 C ATOM 0 H PHE A 64 24.072 4.963 -0.429 1.00 54.13 H new ATOM 0 HA PHE A 64 23.337 4.118 -3.026 1.00 15.41 H new ATOM 0 HB2 PHE A 64 21.808 3.947 -1.159 1.00 54.23 H new ATOM 0 HB3 PHE A 64 21.891 5.670 -0.853 1.00 54.23 H new ATOM 0 HD1 PHE A 64 21.199 3.511 -3.858 1.00 70.34 H new ATOM 0 HD2 PHE A 64 19.970 6.820 -1.466 1.00 44.41 H new ATOM 0 HE1 PHE A 64 19.286 3.882 -5.352 1.00 70.35 H new ATOM 0 HE2 PHE A 64 18.052 7.184 -2.956 1.00 31.33 H new ATOM 0 HZ PHE A 64 17.712 5.722 -4.909 1.00 62.32 H new ATOM 929 N VAL A 65 23.606 7.383 -2.546 1.00 22.12 N ATOM 930 CA VAL A 65 23.762 8.664 -3.234 1.00 1.13 C ATOM 931 C VAL A 65 24.883 8.588 -4.265 1.00 2.04 C ATOM 932 O VAL A 65 24.697 8.932 -5.433 1.00 1.42 O ATOM 933 CB VAL A 65 24.064 9.817 -2.247 1.00 51.41 C ATOM 934 CG1 VAL A 65 24.419 11.093 -3.007 1.00 35.23 C ATOM 935 CG2 VAL A 65 22.879 10.050 -1.312 1.00 41.32 C ATOM 0 H VAL A 65 23.706 7.436 -1.532 1.00 22.12 H new ATOM 0 HA VAL A 65 22.815 8.872 -3.731 1.00 1.13 H new ATOM 0 HB VAL A 65 24.923 9.534 -1.638 1.00 51.41 H new ATOM 0 HG11 VAL A 65 24.628 11.893 -2.297 1.00 35.23 H new ATOM 0 HG12 VAL A 65 25.300 10.916 -3.624 1.00 35.23 H new ATOM 0 HG13 VAL A 65 23.583 11.382 -3.643 1.00 35.23 H new ATOM 0 HG21 VAL A 65 23.111 10.865 -0.626 1.00 41.32 H new ATOM 0 HG22 VAL A 65 21.998 10.310 -1.899 1.00 41.32 H new ATOM 0 HG23 VAL A 65 22.681 9.142 -0.743 1.00 41.32 H new ATOM 945 N ALA A 66 26.039 8.122 -3.826 1.00 10.53 N ATOM 946 CA ALA A 66 27.192 7.978 -4.700 1.00 34.24 C ATOM 947 C ALA A 66 26.874 7.010 -5.835 1.00 52.01 C ATOM 948 O ALA A 66 27.386 7.145 -6.946 1.00 55.45 O ATOM 949 CB ALA A 66 28.403 7.508 -3.897 1.00 2.15 C ATOM 0 H ALA A 66 26.205 7.835 -2.862 1.00 10.53 H new ATOM 0 HA ALA A 66 27.431 8.946 -5.139 1.00 34.24 H new ATOM 0 HB1 ALA A 66 29.261 7.403 -4.561 1.00 2.15 H new ATOM 0 HB2 ALA A 66 28.631 8.239 -3.121 1.00 2.15 H new ATOM 0 HB3 ALA A 66 28.182 6.546 -3.435 1.00 2.15 H new ATOM 955 N GLY A 67 25.983 6.065 -5.550 1.00 41.30 N ATOM 956 CA GLY A 67 25.608 5.061 -6.526 1.00 41.44 C ATOM 957 C GLY A 67 24.762 5.636 -7.642 1.00 65.01 C ATOM 958 O GLY A 67 24.828 5.173 -8.784 1.00 24.21 O ATOM 0 H GLY A 67 25.510 5.978 -4.650 1.00 41.30 H new ATOM 0 HA2 GLY A 67 26.508 4.613 -6.948 1.00 41.44 H new ATOM 0 HA3 GLY A 67 25.057 4.262 -6.030 1.00 41.44 H new ATOM 962 N GLN A 68 23.977 6.667 -7.328 1.00 2.22 N ATOM 963 CA GLN A 68 23.098 7.286 -8.319 1.00 3.22 C ATOM 964 C GLN A 68 23.815 8.456 -8.975 1.00 13.50 C ATOM 965 O GLN A 68 23.493 8.856 -10.092 1.00 73.33 O ATOM 966 CB GLN A 68 21.777 7.746 -7.683 1.00 70.02 C ATOM 967 CG GLN A 68 21.949 8.647 -6.469 1.00 23.14 C ATOM 968 CD GLN A 68 20.644 9.265 -6.011 1.00 11.52 C ATOM 969 OE1 GLN A 68 20.269 10.354 -6.449 1.00 54.51 O ATOM 970 NE2 GLN A 68 19.941 8.571 -5.133 1.00 55.13 N ATOM 0 H GLN A 68 23.932 7.089 -6.400 1.00 2.22 H new ATOM 0 HA GLN A 68 22.853 6.544 -9.079 1.00 3.22 H new ATOM 0 HB2 GLN A 68 21.190 8.275 -8.434 1.00 70.02 H new ATOM 0 HB3 GLN A 68 21.202 6.867 -7.391 1.00 70.02 H new ATOM 0 HG2 GLN A 68 22.380 8.070 -5.651 1.00 23.14 H new ATOM 0 HG3 GLN A 68 22.658 9.440 -6.707 1.00 23.14 H new ATOM 0 HE21 GLN A 68 20.289 7.673 -4.796 1.00 55.13 H new ATOM 0 HE22 GLN A 68 19.051 8.933 -4.792 1.00 55.13 H new ATOM 979 N ASN A 69 24.810 8.975 -8.265 1.00 45.10 N ATOM 980 CA ASN A 69 25.652 10.057 -8.763 1.00 61.12 C ATOM 981 C ASN A 69 26.821 9.502 -9.573 1.00 41.24 C ATOM 982 O ASN A 69 27.635 10.263 -10.100 1.00 42.44 O ATOM 983 CB ASN A 69 26.166 10.907 -7.592 1.00 43.31 C ATOM 984 CG ASN A 69 25.182 11.985 -7.170 1.00 21.20 C ATOM 985 OD1 ASN A 69 25.242 13.118 -7.650 1.00 73.01 O ATOM 986 ND2 ASN A 69 24.263 11.642 -6.281 1.00 73.35 N ATOM 0 H ASN A 69 25.056 8.658 -7.327 1.00 45.10 H new ATOM 0 HA ASN A 69 25.053 10.689 -9.419 1.00 61.12 H new ATOM 0 HB2 ASN A 69 26.373 10.258 -6.741 1.00 43.31 H new ATOM 0 HB3 ASN A 69 27.110 11.373 -7.874 1.00 43.31 H new ATOM 0 HD21 ASN A 69 23.573 12.326 -5.971 1.00 73.35 H new ATOM 0 HD22 ASN A 69 24.245 10.694 -5.906 1.00 73.35 H new ATOM 993 N LYS A 70 26.896 8.171 -9.653 1.00 63.25 N ATOM 994 CA LYS A 70 27.919 7.478 -10.442 1.00 32.31 C ATOM 995 C LYS A 70 29.328 7.811 -9.937 1.00 12.34 C ATOM 996 O LYS A 70 30.305 7.729 -10.685 1.00 70.50 O ATOM 997 CB LYS A 70 27.778 7.822 -11.940 1.00 4.35 C ATOM 998 CG LYS A 70 26.673 7.048 -12.670 1.00 13.20 C ATOM 999 CD LYS A 70 25.349 7.074 -11.911 1.00 32.43 C ATOM 1000 CE LYS A 70 24.168 6.702 -12.801 1.00 4.32 C ATOM 1001 NZ LYS A 70 22.876 6.742 -12.063 1.00 52.12 N1+ ATOM 0 H LYS A 70 26.250 7.544 -9.173 1.00 63.25 H new ATOM 0 HA LYS A 70 27.767 6.406 -10.321 1.00 32.31 H new ATOM 0 HB2 LYS A 70 27.581 8.890 -12.037 1.00 4.35 H new ATOM 0 HB3 LYS A 70 28.729 7.627 -12.436 1.00 4.35 H new ATOM 0 HG2 LYS A 70 26.529 7.475 -13.663 1.00 13.20 H new ATOM 0 HG3 LYS A 70 26.989 6.014 -12.810 1.00 13.20 H new ATOM 0 HD2 LYS A 70 25.400 6.382 -11.070 1.00 32.43 H new ATOM 0 HD3 LYS A 70 25.190 8.069 -11.496 1.00 32.43 H new ATOM 0 HE2 LYS A 70 24.123 7.387 -13.648 1.00 4.32 H new ATOM 0 HE3 LYS A 70 24.322 5.702 -13.208 1.00 4.32 H new ATOM 0 HZ1 LYS A 70 22.109 6.990 -12.720 1.00 52.12 H new ATOM 0 HZ2 LYS A 70 22.686 5.809 -11.645 1.00 52.12 H new ATOM 0 HZ3 LYS A 70 22.929 7.455 -11.308 1.00 52.12 H new ATOM 1015 N GLN A 71 29.428 8.156 -8.660 1.00 41.25 N ATOM 1016 CA GLN A 71 30.706 8.521 -8.049 1.00 41.44 C ATOM 1017 C GLN A 71 31.122 7.490 -7.004 1.00 11.15 C ATOM 1018 O GLN A 71 30.327 6.636 -6.599 1.00 3.32 O ATOM 1019 CB GLN A 71 30.622 9.910 -7.401 1.00 65.11 C ATOM 1020 CG GLN A 71 29.422 10.077 -6.475 1.00 11.32 C ATOM 1021 CD GLN A 71 29.684 11.008 -5.309 1.00 14.24 C ATOM 1022 OE1 GLN A 71 30.055 10.426 -4.187 1.00 4.02 O flip ATOM 1023 NE2 GLN A 71 29.514 12.221 -5.406 1.00 60.02 N flip ATOM 0 H GLN A 71 28.634 8.192 -8.020 1.00 41.25 H new ATOM 0 HA GLN A 71 31.457 8.544 -8.839 1.00 41.44 H new ATOM 0 HB2 GLN A 71 31.536 10.094 -6.836 1.00 65.11 H new ATOM 0 HB3 GLN A 71 30.574 10.666 -8.185 1.00 65.11 H new ATOM 0 HG2 GLN A 71 28.579 10.457 -7.051 1.00 11.32 H new ATOM 0 HG3 GLN A 71 29.131 9.099 -6.091 1.00 11.32 H new ATOM 0 HE21 GLN A 71 29.226 12.626 -6.297 1.00 60.02 H new ATOM 0 HE22 GLN A 71 29.661 12.823 -4.596 1.00 60.02 H new ATOM 1032 N THR A 72 32.369 7.587 -6.567 1.00 0.13 N ATOM 1033 CA THR A 72 32.919 6.696 -5.555 1.00 33.54 C ATOM 1034 C THR A 72 33.393 7.506 -4.349 1.00 64.51 C ATOM 1035 O THR A 72 33.861 8.636 -4.496 1.00 2.32 O ATOM 1036 CB THR A 72 34.095 5.868 -6.126 1.00 55.21 C ATOM 1037 OG1 THR A 72 35.054 6.737 -6.747 1.00 1.42 O ATOM 1038 CG2 THR A 72 33.608 4.839 -7.144 1.00 71.13 C ATOM 0 H THR A 72 33.030 8.287 -6.905 1.00 0.13 H new ATOM 0 HA THR A 72 32.133 6.008 -5.243 1.00 33.54 H new ATOM 0 HB THR A 72 34.562 5.338 -5.296 1.00 55.21 H new ATOM 0 HG1 THR A 72 35.795 6.204 -7.104 1.00 1.42 H new ATOM 0 HG21 THR A 72 34.458 4.274 -7.526 1.00 71.13 H new ATOM 0 HG22 THR A 72 32.905 4.157 -6.665 1.00 71.13 H new ATOM 0 HG23 THR A 72 33.112 5.350 -7.969 1.00 71.13 H new ATOM 1046 N LEU A 73 33.253 6.933 -3.159 1.00 24.22 N ATOM 1047 CA LEU A 73 33.657 7.601 -1.925 1.00 2.33 C ATOM 1048 C LEU A 73 34.901 6.932 -1.335 1.00 44.11 C ATOM 1049 O LEU A 73 35.083 5.720 -1.472 1.00 52.40 O ATOM 1050 CB LEU A 73 32.503 7.571 -0.911 1.00 54.54 C ATOM 1051 CG LEU A 73 31.270 8.406 -1.291 1.00 53.14 C ATOM 1052 CD1 LEU A 73 30.143 8.188 -0.284 1.00 63.13 C ATOM 1053 CD2 LEU A 73 31.634 9.888 -1.391 1.00 44.41 C ATOM 0 H LEU A 73 32.860 6.002 -3.021 1.00 24.22 H new ATOM 0 HA LEU A 73 33.901 8.639 -2.152 1.00 2.33 H new ATOM 0 HB2 LEU A 73 32.191 6.536 -0.772 1.00 54.54 H new ATOM 0 HB3 LEU A 73 32.877 7.923 0.050 1.00 54.54 H new ATOM 0 HG LEU A 73 30.919 8.077 -2.269 1.00 53.14 H new ATOM 0 HD11 LEU A 73 29.279 8.787 -0.570 1.00 63.13 H new ATOM 0 HD12 LEU A 73 29.865 7.134 -0.271 1.00 63.13 H new ATOM 0 HD13 LEU A 73 30.479 8.487 0.709 1.00 63.13 H new ATOM 0 HD21 LEU A 73 30.748 10.463 -1.661 1.00 44.41 H new ATOM 0 HD22 LEU A 73 32.013 10.235 -0.430 1.00 44.41 H new ATOM 0 HD23 LEU A 73 32.401 10.024 -2.154 1.00 44.41 H new ATOM 1065 N PRO A 74 35.791 7.719 -0.699 1.00 14.33 N ATOM 1066 CA PRO A 74 36.965 7.183 0.004 1.00 71.54 C ATOM 1067 C PRO A 74 36.562 6.290 1.173 1.00 22.35 C ATOM 1068 O PRO A 74 35.996 6.765 2.155 1.00 71.04 O ATOM 1069 CB PRO A 74 37.690 8.439 0.519 1.00 0.31 C ATOM 1070 CG PRO A 74 37.163 9.558 -0.314 1.00 75.32 C ATOM 1071 CD PRO A 74 35.738 9.192 -0.625 1.00 21.31 C ATOM 0 HA PRO A 74 37.582 6.562 -0.645 1.00 71.54 H new ATOM 0 HB2 PRO A 74 37.488 8.605 1.577 1.00 0.31 H new ATOM 0 HB3 PRO A 74 38.770 8.343 0.412 1.00 0.31 H new ATOM 0 HG2 PRO A 74 37.217 10.505 0.222 1.00 75.32 H new ATOM 0 HG3 PRO A 74 37.746 9.676 -1.227 1.00 75.32 H new ATOM 0 HD2 PRO A 74 35.053 9.534 0.151 1.00 21.31 H new ATOM 0 HD3 PRO A 74 35.402 9.633 -1.564 1.00 21.31 H new ATOM 1079 N ALA A 75 36.865 5.002 1.075 1.00 74.43 N ATOM 1080 CA ALA A 75 36.481 4.041 2.108 1.00 72.21 C ATOM 1081 C ALA A 75 37.354 4.170 3.358 1.00 34.41 C ATOM 1082 O ALA A 75 37.189 3.425 4.323 1.00 42.34 O ATOM 1083 CB ALA A 75 36.536 2.619 1.557 1.00 2.05 C ATOM 0 H ALA A 75 37.376 4.596 0.291 1.00 74.43 H new ATOM 0 HA ALA A 75 35.456 4.265 2.403 1.00 72.21 H new ATOM 0 HB1 ALA A 75 36.248 1.915 2.338 1.00 2.05 H new ATOM 0 HB2 ALA A 75 35.850 2.528 0.715 1.00 2.05 H new ATOM 0 HB3 ALA A 75 37.550 2.397 1.224 1.00 2.05 H new ATOM 1089 N ASP A 76 38.269 5.128 3.338 1.00 35.21 N ATOM 1090 CA ASP A 76 39.191 5.347 4.451 1.00 24.42 C ATOM 1091 C ASP A 76 38.632 6.391 5.421 1.00 33.35 C ATOM 1092 O ASP A 76 39.287 6.784 6.385 1.00 61.01 O ATOM 1093 CB ASP A 76 40.551 5.786 3.895 1.00 72.44 C ATOM 1094 CG ASP A 76 41.643 5.874 4.955 1.00 23.12 C ATOM 1095 OD1 ASP A 76 41.900 4.856 5.633 1.00 55.31 O ATOM 1096 OD2 ASP A 76 42.266 6.948 5.092 1.00 42.23 O1- ATOM 0 H ASP A 76 38.396 5.773 2.558 1.00 35.21 H new ATOM 0 HA ASP A 76 39.315 4.418 5.008 1.00 24.42 H new ATOM 0 HB2 ASP A 76 40.862 5.083 3.122 1.00 72.44 H new ATOM 0 HB3 ASP A 76 40.442 6.759 3.416 1.00 72.44 H new ATOM 1101 N THR A 77 37.403 6.823 5.161 1.00 11.55 N ATOM 1102 CA THR A 77 36.744 7.828 5.990 1.00 12.43 C ATOM 1103 C THR A 77 36.222 7.219 7.295 1.00 50.31 C ATOM 1104 O THR A 77 36.112 5.995 7.432 1.00 30.02 O ATOM 1105 CB THR A 77 35.578 8.510 5.225 1.00 41.10 C ATOM 1106 OG1 THR A 77 34.898 9.439 6.079 1.00 73.42 O ATOM 1107 CG2 THR A 77 34.578 7.481 4.709 1.00 73.22 C ATOM 0 H THR A 77 36.839 6.491 4.378 1.00 11.55 H new ATOM 0 HA THR A 77 37.492 8.583 6.234 1.00 12.43 H new ATOM 0 HB THR A 77 36.008 9.039 4.374 1.00 41.10 H new ATOM 0 HG1 THR A 77 35.548 10.056 6.475 1.00 73.42 H new ATOM 0 HG21 THR A 77 33.774 7.990 4.178 1.00 73.22 H new ATOM 0 HG22 THR A 77 35.082 6.792 4.031 1.00 73.22 H new ATOM 0 HG23 THR A 77 34.163 6.924 5.549 1.00 73.22 H new ATOM 1115 N THR A 78 35.922 8.086 8.255 1.00 13.54 N ATOM 1116 CA THR A 78 35.365 7.685 9.540 1.00 2.03 C ATOM 1117 C THR A 78 34.444 8.796 10.053 1.00 41.21 C ATOM 1118 O THR A 78 34.677 9.974 9.773 1.00 33.42 O ATOM 1119 CB THR A 78 36.490 7.441 10.579 1.00 65.01 C ATOM 1120 OG1 THR A 78 37.534 6.645 9.998 1.00 41.13 O ATOM 1121 CG2 THR A 78 35.954 6.744 11.828 1.00 52.04 C ATOM 0 H THR A 78 36.059 9.092 8.163 1.00 13.54 H new ATOM 0 HA THR A 78 34.808 6.758 9.405 1.00 2.03 H new ATOM 0 HB THR A 78 36.888 8.413 10.872 1.00 65.01 H new ATOM 0 HG1 THR A 78 38.240 6.498 10.661 1.00 41.13 H new ATOM 0 HG21 THR A 78 36.768 6.588 12.535 1.00 52.04 H new ATOM 0 HG22 THR A 78 35.186 7.365 12.290 1.00 52.04 H new ATOM 0 HG23 THR A 78 35.525 5.781 11.551 1.00 52.04 H new ATOM 1129 N VAL A 79 33.411 8.430 10.798 1.00 13.33 N ATOM 1130 CA VAL A 79 32.514 9.407 11.407 1.00 51.35 C ATOM 1131 C VAL A 79 32.399 9.138 12.894 1.00 40.33 C ATOM 1132 O VAL A 79 32.176 8.009 13.309 1.00 15.54 O ATOM 1133 CB VAL A 79 31.095 9.377 10.777 1.00 73.54 C ATOM 1134 CG1 VAL A 79 30.149 10.334 11.507 1.00 32.33 C ATOM 1135 CG2 VAL A 79 31.160 9.725 9.295 1.00 4.51 C ATOM 0 H VAL A 79 33.171 7.459 10.997 1.00 13.33 H new ATOM 0 HA VAL A 79 32.941 10.394 11.227 1.00 51.35 H new ATOM 0 HB VAL A 79 30.703 8.365 10.881 1.00 73.54 H new ATOM 0 HG11 VAL A 79 29.162 10.293 11.045 1.00 32.33 H new ATOM 0 HG12 VAL A 79 30.072 10.041 12.554 1.00 32.33 H new ATOM 0 HG13 VAL A 79 30.538 11.350 11.442 1.00 32.33 H new ATOM 0 HG21 VAL A 79 30.156 9.699 8.871 1.00 4.51 H new ATOM 0 HG22 VAL A 79 31.579 10.724 9.174 1.00 4.51 H new ATOM 0 HG23 VAL A 79 31.791 9.002 8.779 1.00 4.51 H new ATOM 1145 N THR A 80 32.583 10.163 13.702 1.00 3.21 N ATOM 1146 CA THR A 80 32.417 10.019 15.139 1.00 52.54 C ATOM 1147 C THR A 80 31.152 10.733 15.603 1.00 43.34 C ATOM 1148 O THR A 80 31.064 11.960 15.537 1.00 4.30 O ATOM 1149 CB THR A 80 33.636 10.566 15.905 1.00 61.00 C ATOM 1150 OG1 THR A 80 34.845 10.115 15.272 1.00 41.24 O ATOM 1151 CG2 THR A 80 33.615 10.095 17.356 1.00 20.33 C ATOM 0 H THR A 80 32.846 11.099 13.394 1.00 3.21 H new ATOM 0 HA THR A 80 32.329 8.954 15.355 1.00 52.54 H new ATOM 0 HB THR A 80 33.596 11.655 15.890 1.00 61.00 H new ATOM 0 HG1 THR A 80 35.061 9.212 15.585 1.00 41.24 H new ATOM 0 HG21 THR A 80 34.484 10.492 17.880 1.00 20.33 H new ATOM 0 HG22 THR A 80 32.706 10.450 17.841 1.00 20.33 H new ATOM 0 HG23 THR A 80 33.640 9.006 17.385 1.00 20.33 H new ATOM 1159 N ALA A 81 30.168 9.958 16.037 1.00 63.21 N ATOM 1160 CA ALA A 81 28.932 10.508 16.574 1.00 75.00 C ATOM 1161 C ALA A 81 29.045 10.633 18.087 1.00 14.40 C ATOM 1162 O ALA A 81 28.983 9.634 18.806 1.00 73.21 O ATOM 1163 CB ALA A 81 27.745 9.632 16.193 1.00 42.42 C ATOM 0 H ALA A 81 30.203 8.939 16.027 1.00 63.21 H new ATOM 0 HA ALA A 81 28.768 11.498 16.148 1.00 75.00 H new ATOM 0 HB1 ALA A 81 26.830 10.060 16.604 1.00 42.42 H new ATOM 0 HB2 ALA A 81 27.665 9.579 15.107 1.00 42.42 H new ATOM 0 HB3 ALA A 81 27.889 8.629 16.595 1.00 42.42 H new ATOM 1169 N GLU A 82 29.238 11.855 18.561 1.00 71.31 N ATOM 1170 CA GLU A 82 29.397 12.116 19.982 1.00 72.51 C ATOM 1171 C GLU A 82 28.157 12.829 20.506 1.00 53.13 C ATOM 1172 O GLU A 82 27.936 14.001 20.211 1.00 25.01 O ATOM 1173 CB GLU A 82 30.660 12.958 20.210 1.00 74.00 C ATOM 1174 CG GLU A 82 31.018 13.163 21.675 1.00 3.23 C ATOM 1175 CD GLU A 82 32.385 13.801 21.855 1.00 23.22 C ATOM 1176 OE1 GLU A 82 33.379 13.058 21.988 1.00 3.55 O ATOM 1177 OE2 GLU A 82 32.480 15.045 21.843 1.00 51.44 O1- ATOM 0 H GLU A 82 29.288 12.688 17.975 1.00 71.31 H new ATOM 0 HA GLU A 82 29.510 11.178 20.526 1.00 72.51 H new ATOM 0 HB2 GLU A 82 31.499 12.478 19.707 1.00 74.00 H new ATOM 0 HB3 GLU A 82 30.523 13.933 19.741 1.00 74.00 H new ATOM 0 HG2 GLU A 82 30.262 13.791 22.146 1.00 3.23 H new ATOM 0 HG3 GLU A 82 30.999 12.202 22.189 1.00 3.23 H new ATOM 1184 N VAL A 83 27.347 12.113 21.274 1.00 31.40 N ATOM 1185 CA VAL A 83 26.066 12.635 21.735 1.00 74.25 C ATOM 1186 C VAL A 83 26.103 12.940 23.220 1.00 12.15 C ATOM 1187 O VAL A 83 26.744 12.232 23.995 1.00 3.30 O ATOM 1188 CB VAL A 83 24.905 11.655 21.446 1.00 22.15 C ATOM 1189 CG1 VAL A 83 24.705 11.500 19.945 1.00 60.03 C ATOM 1190 CG2 VAL A 83 25.152 10.296 22.105 1.00 42.03 C ATOM 0 H VAL A 83 27.554 11.166 21.592 1.00 31.40 H new ATOM 0 HA VAL A 83 25.889 13.556 21.180 1.00 74.25 H new ATOM 0 HB VAL A 83 23.994 12.071 21.876 1.00 22.15 H new ATOM 0 HG11 VAL A 83 23.885 10.807 19.757 1.00 60.03 H new ATOM 0 HG12 VAL A 83 24.469 12.470 19.507 1.00 60.03 H new ATOM 0 HG13 VAL A 83 25.618 11.112 19.494 1.00 60.03 H new ATOM 0 HG21 VAL A 83 24.319 9.628 21.884 1.00 42.03 H new ATOM 0 HG22 VAL A 83 26.075 9.866 21.717 1.00 42.03 H new ATOM 0 HG23 VAL A 83 25.238 10.425 23.184 1.00 42.03 H new ATOM 1200 N GLY A 84 25.405 13.994 23.605 1.00 33.12 N ATOM 1201 CA GLY A 84 25.355 14.396 24.989 1.00 23.12 C ATOM 1202 C GLY A 84 23.963 14.797 25.407 1.00 64.22 C ATOM 1203 O GLY A 84 23.103 15.043 24.565 1.00 21.33 O ATOM 0 H GLY A 84 24.865 14.585 22.972 1.00 33.12 H new ATOM 0 HA2 GLY A 84 25.701 13.576 25.618 1.00 23.12 H new ATOM 0 HA3 GLY A 84 26.037 15.231 25.150 1.00 23.12 H new ATOM 1207 N ILE A 85 23.745 14.856 26.704 1.00 23.52 N ATOM 1208 CA ILE A 85 22.474 15.261 27.269 1.00 1.40 C ATOM 1209 C ILE A 85 22.730 16.230 28.409 1.00 61.15 C ATOM 1210 O ILE A 85 23.577 15.973 29.282 1.00 10.52 O ATOM 1211 CB ILE A 85 21.648 14.034 27.760 1.00 52.02 C ATOM 1212 CG1 ILE A 85 20.312 14.470 28.410 1.00 53.33 C ATOM 1213 CG2 ILE A 85 22.473 13.179 28.720 1.00 35.55 C ATOM 1214 CD1 ILE A 85 20.391 14.751 29.901 1.00 71.32 C ATOM 0 H ILE A 85 24.451 14.622 27.402 1.00 23.52 H new ATOM 0 HA ILE A 85 21.883 15.751 26.495 1.00 1.40 H new ATOM 0 HB ILE A 85 21.401 13.428 26.888 1.00 52.02 H new ATOM 0 HG12 ILE A 85 19.953 15.366 27.904 1.00 53.33 H new ATOM 0 HG13 ILE A 85 19.570 13.690 28.240 1.00 53.33 H new ATOM 0 HG21 ILE A 85 21.879 12.328 29.051 1.00 35.55 H new ATOM 0 HG22 ILE A 85 23.368 12.821 28.211 1.00 35.55 H new ATOM 0 HG23 ILE A 85 22.762 13.778 29.584 1.00 35.55 H new ATOM 0 HD11 ILE A 85 19.409 15.049 30.268 1.00 71.32 H new ATOM 0 HD12 ILE A 85 20.716 13.852 30.424 1.00 71.32 H new ATOM 0 HD13 ILE A 85 21.105 15.554 30.083 1.00 71.32 H new ATOM 1226 N GLY A 86 22.024 17.354 28.364 1.00 43.44 N ATOM 1227 CA GLY A 86 22.120 18.368 29.398 1.00 64.20 C ATOM 1228 C GLY A 86 20.817 19.128 29.540 1.00 43.21 C ATOM 1229 O GLY A 86 19.921 18.966 28.708 1.00 31.32 O ATOM 0 H GLY A 86 21.374 17.584 27.613 1.00 43.44 H new ATOM 0 HA2 GLY A 86 22.377 17.900 30.348 1.00 64.20 H new ATOM 0 HA3 GLY A 86 22.925 19.062 29.157 1.00 64.20 H new ATOM 1233 N PRO A 87 20.670 19.955 30.588 1.00 20.43 N ATOM 1234 CA PRO A 87 19.442 20.720 30.816 1.00 73.43 C ATOM 1235 C PRO A 87 19.274 21.856 29.803 1.00 33.24 C ATOM 1236 O PRO A 87 20.218 22.601 29.520 1.00 11.41 O ATOM 1237 CB PRO A 87 19.615 21.266 32.236 1.00 75.13 C ATOM 1238 CG PRO A 87 21.094 21.340 32.437 1.00 24.22 C ATOM 1239 CD PRO A 87 21.690 20.220 31.623 1.00 44.21 C ATOM 0 HA PRO A 87 18.548 20.108 30.699 1.00 73.43 H new ATOM 0 HB2 PRO A 87 19.151 22.247 32.342 1.00 75.13 H new ATOM 0 HB3 PRO A 87 19.148 20.611 32.972 1.00 75.13 H new ATOM 0 HG2 PRO A 87 21.482 22.305 32.112 1.00 24.22 H new ATOM 0 HG3 PRO A 87 21.349 21.232 33.491 1.00 24.22 H new ATOM 0 HD2 PRO A 87 22.643 20.510 31.180 1.00 44.21 H new ATOM 0 HD3 PRO A 87 21.878 19.337 32.234 1.00 44.21 H new ATOM 1247 N ASN A 88 18.064 21.977 29.274 1.00 50.13 N ATOM 1248 CA ASN A 88 17.742 22.975 28.255 1.00 62.23 C ATOM 1249 C ASN A 88 17.225 24.254 28.906 1.00 31.22 C ATOM 1250 O ASN A 88 16.599 24.204 29.967 1.00 11.01 O ATOM 1251 CB ASN A 88 16.675 22.428 27.299 1.00 63.43 C ATOM 1252 CG ASN A 88 16.406 23.342 26.108 1.00 21.32 C ATOM 1253 OD1 ASN A 88 15.262 23.499 25.684 1.00 63.22 O ATOM 1254 ND2 ASN A 88 17.453 23.932 25.547 1.00 22.41 N ATOM 0 H ASN A 88 17.275 21.387 29.538 1.00 50.13 H new ATOM 0 HA ASN A 88 18.651 23.199 27.697 1.00 62.23 H new ATOM 0 HB2 ASN A 88 16.991 21.451 26.934 1.00 63.43 H new ATOM 0 HB3 ASN A 88 15.746 22.278 27.850 1.00 63.43 H new ATOM 0 HD21 ASN A 88 17.323 24.539 24.737 1.00 22.41 H new ATOM 0 HD22 ASN A 88 18.388 23.779 25.925 1.00 22.41 H new ATOM 1261 N GLU A 89 17.469 25.384 28.249 1.00 43.32 N ATOM 1262 CA GLU A 89 17.040 26.693 28.744 1.00 2.23 C ATOM 1263 C GLU A 89 15.523 26.745 28.958 1.00 10.40 C ATOM 1264 O GLU A 89 15.028 27.511 29.787 1.00 74.31 O ATOM 1265 CB GLU A 89 17.473 27.789 27.759 1.00 13.04 C ATOM 1266 CG GLU A 89 16.892 27.622 26.357 1.00 64.14 C ATOM 1267 CD GLU A 89 17.336 28.714 25.396 1.00 35.31 C ATOM 1268 OE1 GLU A 89 16.972 29.888 25.616 1.00 70.11 O ATOM 1269 OE2 GLU A 89 18.036 28.401 24.406 1.00 74.23 O1- ATOM 0 H GLU A 89 17.968 25.421 27.360 1.00 43.32 H new ATOM 0 HA GLU A 89 17.517 26.862 29.710 1.00 2.23 H new ATOM 0 HB2 GLU A 89 17.171 28.759 28.154 1.00 13.04 H new ATOM 0 HB3 GLU A 89 18.561 27.796 27.693 1.00 13.04 H new ATOM 0 HG2 GLU A 89 17.190 26.652 25.959 1.00 64.14 H new ATOM 0 HG3 GLU A 89 15.804 27.620 26.418 1.00 64.14 H new ATOM 1276 N GLU A 90 14.797 25.927 28.200 1.00 62.24 N ATOM 1277 CA GLU A 90 13.336 25.873 28.286 1.00 33.11 C ATOM 1278 C GLU A 90 12.876 25.254 29.612 1.00 41.22 C ATOM 1279 O GLU A 90 11.751 25.485 30.063 1.00 23.51 O ATOM 1280 CB GLU A 90 12.777 25.079 27.099 1.00 62.35 C ATOM 1281 CG GLU A 90 11.287 24.785 27.202 1.00 2.12 C ATOM 1282 CD GLU A 90 10.703 24.224 25.915 1.00 32.41 C ATOM 1283 OE1 GLU A 90 10.530 22.991 25.806 1.00 34.55 O ATOM 1284 OE2 GLU A 90 10.419 25.023 24.997 1.00 15.02 O1- ATOM 0 H GLU A 90 15.198 25.287 27.514 1.00 62.24 H new ATOM 0 HA GLU A 90 12.952 26.892 28.249 1.00 33.11 H new ATOM 0 HB2 GLU A 90 12.965 25.636 26.181 1.00 62.35 H new ATOM 0 HB3 GLU A 90 13.319 24.137 27.017 1.00 62.35 H new ATOM 0 HG2 GLU A 90 11.117 24.075 28.012 1.00 2.12 H new ATOM 0 HG3 GLU A 90 10.759 25.701 27.465 1.00 2.12 H new ATOM 1291 N GLY A 91 13.756 24.485 30.237 1.00 4.53 N ATOM 1292 CA GLY A 91 13.436 23.830 31.500 1.00 50.31 C ATOM 1293 C GLY A 91 13.162 22.348 31.325 1.00 52.42 C ATOM 1294 O GLY A 91 12.309 21.776 32.005 1.00 50.31 O ATOM 0 H GLY A 91 14.697 24.298 29.891 1.00 4.53 H new ATOM 0 HA2 GLY A 91 14.263 23.965 32.197 1.00 50.31 H new ATOM 0 HA3 GLY A 91 12.564 24.309 31.945 1.00 50.31 H new ATOM 1298 N GLY A 92 13.888 21.734 30.399 1.00 31.10 N ATOM 1299 CA GLY A 92 13.786 20.301 30.171 1.00 44.24 C ATOM 1300 C GLY A 92 15.146 19.702 29.873 1.00 74.12 C ATOM 1301 O GLY A 92 16.163 20.231 30.319 1.00 42.22 O ATOM 0 H GLY A 92 14.556 22.210 29.792 1.00 31.10 H new ATOM 0 HA2 GLY A 92 13.356 19.819 31.049 1.00 44.24 H new ATOM 0 HA3 GLY A 92 13.109 20.109 29.339 1.00 44.24 H new ATOM 1305 N PHE A 93 15.174 18.609 29.119 1.00 65.13 N ATOM 1306 CA PHE A 93 16.431 17.991 28.704 1.00 72.25 C ATOM 1307 C PHE A 93 16.713 18.319 27.245 1.00 30.35 C ATOM 1308 O PHE A 93 15.792 18.604 26.477 1.00 35.35 O ATOM 1309 CB PHE A 93 16.389 16.470 28.899 1.00 70.53 C ATOM 1310 CG PHE A 93 16.244 16.046 30.338 1.00 33.33 C ATOM 1311 CD1 PHE A 93 15.144 15.304 30.755 1.00 41.34 C ATOM 1312 CD2 PHE A 93 17.210 16.386 31.275 1.00 64.21 C ATOM 1313 CE1 PHE A 93 15.013 14.914 32.072 1.00 2.11 C ATOM 1314 CE2 PHE A 93 17.082 15.997 32.596 1.00 3.04 C ATOM 1315 CZ PHE A 93 15.983 15.259 32.995 1.00 12.34 C ATOM 0 H PHE A 93 14.339 18.130 28.781 1.00 65.13 H new ATOM 0 HA PHE A 93 17.230 18.393 29.327 1.00 72.25 H new ATOM 0 HB2 PHE A 93 15.558 16.062 28.324 1.00 70.53 H new ATOM 0 HB3 PHE A 93 17.302 16.035 28.492 1.00 70.53 H new ATOM 0 HD1 PHE A 93 14.383 15.030 30.039 1.00 41.34 H new ATOM 0 HD2 PHE A 93 18.071 16.961 30.969 1.00 64.21 H new ATOM 0 HE1 PHE A 93 14.153 14.339 32.382 1.00 2.11 H new ATOM 0 HE2 PHE A 93 17.840 16.270 33.315 1.00 3.04 H new ATOM 0 HZ PHE A 93 15.882 14.953 34.026 1.00 12.34 H new ATOM 1325 N ALA A 94 17.983 18.278 26.869 1.00 73.43 N ATOM 1326 CA ALA A 94 18.391 18.564 25.504 1.00 60.33 C ATOM 1327 C ALA A 94 19.510 17.624 25.084 1.00 65.32 C ATOM 1328 O ALA A 94 20.493 17.444 25.816 1.00 32.10 O ATOM 1329 CB ALA A 94 18.830 20.019 25.368 1.00 64.21 C ATOM 0 H ALA A 94 18.753 18.047 27.497 1.00 73.43 H new ATOM 0 HA ALA A 94 17.538 18.405 24.845 1.00 60.33 H new ATOM 0 HB1 ALA A 94 19.132 20.213 24.339 1.00 64.21 H new ATOM 0 HB2 ALA A 94 18.001 20.675 25.633 1.00 64.21 H new ATOM 0 HB3 ALA A 94 19.671 20.209 26.035 1.00 64.21 H new ATOM 1335 N LEU A 95 19.335 17.007 23.921 1.00 31.23 N ATOM 1336 CA LEU A 95 20.328 16.102 23.356 1.00 75.45 C ATOM 1337 C LEU A 95 21.174 16.837 22.327 1.00 41.42 C ATOM 1338 O LEU A 95 20.649 17.402 21.367 1.00 2.34 O ATOM 1339 CB LEU A 95 19.652 14.872 22.717 1.00 51.22 C ATOM 1340 CG LEU A 95 19.278 13.736 23.688 1.00 42.15 C ATOM 1341 CD1 LEU A 95 20.535 13.070 24.249 1.00 64.34 C ATOM 1342 CD2 LEU A 95 18.403 14.259 24.823 1.00 71.23 C ATOM 0 H LEU A 95 18.502 17.120 23.344 1.00 31.23 H new ATOM 0 HA LEU A 95 20.973 15.751 24.161 1.00 75.45 H new ATOM 0 HB2 LEU A 95 18.747 15.202 22.207 1.00 51.22 H new ATOM 0 HB3 LEU A 95 20.319 14.469 21.955 1.00 51.22 H new ATOM 0 HG LEU A 95 18.710 12.990 23.132 1.00 42.15 H new ATOM 0 HD11 LEU A 95 20.249 12.271 24.933 1.00 64.34 H new ATOM 0 HD12 LEU A 95 21.123 12.655 23.430 1.00 64.34 H new ATOM 0 HD13 LEU A 95 21.130 13.809 24.785 1.00 64.34 H new ATOM 0 HD21 LEU A 95 18.151 13.439 25.496 1.00 71.23 H new ATOM 0 HD22 LEU A 95 18.944 15.028 25.374 1.00 71.23 H new ATOM 0 HD23 LEU A 95 17.488 14.684 24.411 1.00 71.23 H new ATOM 1354 N ASP A 96 22.476 16.821 22.547 1.00 51.32 N ATOM 1355 CA ASP A 96 23.439 17.483 21.672 1.00 15.24 C ATOM 1356 C ASP A 96 24.250 16.434 20.925 1.00 33.43 C ATOM 1357 O ASP A 96 25.048 15.709 21.522 1.00 1.11 O ATOM 1358 CB ASP A 96 24.373 18.362 22.500 1.00 62.10 C ATOM 1359 CG ASP A 96 25.432 19.076 21.665 1.00 42.14 C ATOM 1360 OD1 ASP A 96 26.637 18.780 21.848 1.00 0.44 O ATOM 1361 OD2 ASP A 96 25.067 19.935 20.832 1.00 11.32 O1- ATOM 0 H ASP A 96 22.903 16.346 23.342 1.00 51.32 H new ATOM 0 HA ASP A 96 22.905 18.107 20.955 1.00 15.24 H new ATOM 0 HB2 ASP A 96 23.781 19.105 23.035 1.00 62.10 H new ATOM 0 HB3 ASP A 96 24.868 17.747 23.252 1.00 62.10 H new ATOM 1366 N VAL A 97 24.020 16.343 19.631 1.00 3.45 N ATOM 1367 CA VAL A 97 24.658 15.328 18.795 1.00 33.41 C ATOM 1368 C VAL A 97 25.732 15.953 17.912 1.00 35.23 C ATOM 1369 O VAL A 97 25.424 16.668 16.972 1.00 5.33 O ATOM 1370 CB VAL A 97 23.616 14.623 17.885 1.00 12.11 C ATOM 1371 CG1 VAL A 97 24.277 13.540 17.030 1.00 31.40 C ATOM 1372 CG2 VAL A 97 22.467 14.047 18.715 1.00 41.42 C ATOM 0 H VAL A 97 23.390 16.964 19.124 1.00 3.45 H new ATOM 0 HA VAL A 97 25.112 14.596 19.463 1.00 33.41 H new ATOM 0 HB VAL A 97 23.199 15.370 17.210 1.00 12.11 H new ATOM 0 HG11 VAL A 97 23.525 13.062 16.402 1.00 31.40 H new ATOM 0 HG12 VAL A 97 25.043 13.991 16.399 1.00 31.40 H new ATOM 0 HG13 VAL A 97 24.735 12.794 17.679 1.00 31.40 H new ATOM 0 HG21 VAL A 97 21.750 13.558 18.055 1.00 41.42 H new ATOM 0 HG22 VAL A 97 22.860 13.320 19.425 1.00 41.42 H new ATOM 0 HG23 VAL A 97 21.971 14.852 19.257 1.00 41.42 H new ATOM 1382 N GLU A 98 26.988 15.648 18.196 1.00 23.12 N ATOM 1383 CA GLU A 98 28.105 16.167 17.412 1.00 44.32 C ATOM 1384 C GLU A 98 28.569 15.125 16.402 1.00 21.31 C ATOM 1385 O GLU A 98 29.131 14.093 16.771 1.00 34.12 O ATOM 1386 CB GLU A 98 29.268 16.585 18.325 1.00 13.10 C ATOM 1387 CG GLU A 98 28.949 17.783 19.214 1.00 35.31 C ATOM 1388 CD GLU A 98 30.165 18.295 19.970 1.00 11.53 C ATOM 1389 OE1 GLU A 98 30.256 18.072 21.196 1.00 51.52 O ATOM 1390 OE2 GLU A 98 31.038 18.927 19.339 1.00 21.24 O1- ATOM 0 H GLU A 98 27.264 15.040 18.967 1.00 23.12 H new ATOM 0 HA GLU A 98 27.764 17.051 16.873 1.00 44.32 H new ATOM 0 HB2 GLU A 98 29.546 15.740 18.955 1.00 13.10 H new ATOM 0 HB3 GLU A 98 30.135 16.822 17.709 1.00 13.10 H new ATOM 0 HG2 GLU A 98 28.543 18.587 18.600 1.00 35.31 H new ATOM 0 HG3 GLU A 98 28.174 17.504 19.928 1.00 35.31 H new ATOM 1397 N LEU A 99 28.314 15.394 15.127 1.00 4.53 N ATOM 1398 CA LEU A 99 28.717 14.497 14.053 1.00 32.31 C ATOM 1399 C LEU A 99 30.052 14.946 13.468 1.00 52.01 C ATOM 1400 O LEU A 99 30.123 15.965 12.775 1.00 21.43 O ATOM 1401 CB LEU A 99 27.642 14.447 12.955 1.00 42.25 C ATOM 1402 CG LEU A 99 26.290 13.851 13.384 1.00 64.41 C ATOM 1403 CD1 LEU A 99 25.298 13.862 12.221 1.00 73.33 C ATOM 1404 CD2 LEU A 99 26.470 12.432 13.923 1.00 23.33 C ATOM 0 H LEU A 99 27.826 16.232 14.811 1.00 4.53 H new ATOM 0 HA LEU A 99 28.832 13.494 14.464 1.00 32.31 H new ATOM 0 HB2 LEU A 99 27.474 15.460 12.588 1.00 42.25 H new ATOM 0 HB3 LEU A 99 28.028 13.865 12.118 1.00 42.25 H new ATOM 0 HG LEU A 99 25.886 14.472 14.183 1.00 64.41 H new ATOM 0 HD11 LEU A 99 24.349 13.436 12.548 1.00 73.33 H new ATOM 0 HD12 LEU A 99 25.140 14.888 11.888 1.00 73.33 H new ATOM 0 HD13 LEU A 99 25.697 13.270 11.397 1.00 73.33 H new ATOM 0 HD21 LEU A 99 25.501 12.030 14.220 1.00 23.33 H new ATOM 0 HD22 LEU A 99 26.902 11.800 13.147 1.00 23.33 H new ATOM 0 HD23 LEU A 99 27.135 12.452 14.786 1.00 23.33 H new ATOM 1416 N ARG A 100 31.099 14.179 13.750 1.00 15.15 N ATOM 1417 CA ARG A 100 32.444 14.482 13.275 1.00 11.05 C ATOM 1418 C ARG A 100 32.757 13.644 12.042 1.00 44.33 C ATOM 1419 O ARG A 100 32.918 12.429 12.134 1.00 60.34 O ATOM 1420 CB ARG A 100 33.474 14.195 14.378 1.00 62.13 C ATOM 1421 CG ARG A 100 34.908 14.466 13.949 1.00 11.51 C ATOM 1422 CD ARG A 100 35.902 14.233 15.080 1.00 61.51 C ATOM 1423 NE ARG A 100 35.967 12.834 15.516 1.00 42.53 N ATOM 1424 CZ ARG A 100 36.616 12.421 16.612 1.00 32.53 C ATOM 1425 NH1 ARG A 100 37.189 13.298 17.429 1.00 73.43 N1+ ATOM 1426 NH2 ARG A 100 36.677 11.126 16.899 1.00 1.52 N ATOM 0 H ARG A 100 31.040 13.331 14.313 1.00 15.15 H new ATOM 0 HA ARG A 100 32.496 15.539 13.013 1.00 11.05 H new ATOM 0 HB2 ARG A 100 33.242 14.806 15.250 1.00 62.13 H new ATOM 0 HB3 ARG A 100 33.385 13.153 14.686 1.00 62.13 H new ATOM 0 HG2 ARG A 100 35.161 13.822 13.107 1.00 11.51 H new ATOM 0 HG3 ARG A 100 34.992 15.495 13.600 1.00 11.51 H new ATOM 0 HD2 ARG A 100 36.893 14.552 14.755 1.00 61.51 H new ATOM 0 HD3 ARG A 100 35.628 14.859 15.930 1.00 61.51 H new ATOM 0 HE ARG A 100 35.489 12.133 14.950 1.00 42.53 H new ATOM 0 HH11 ARG A 100 37.137 14.296 17.224 1.00 73.43 H new ATOM 0 HH12 ARG A 100 37.681 12.974 18.261 1.00 73.43 H new ATOM 0 HH21 ARG A 100 36.230 10.446 16.285 1.00 1.52 H new ATOM 0 HH22 ARG A 100 37.171 10.811 17.734 1.00 1.52 H new ATOM 1440 N VAL A 101 32.843 14.297 10.888 1.00 42.14 N ATOM 1441 CA VAL A 101 33.013 13.594 9.620 1.00 72.23 C ATOM 1442 C VAL A 101 34.455 13.701 9.144 1.00 42.25 C ATOM 1443 O VAL A 101 34.848 14.715 8.569 1.00 41.22 O ATOM 1444 CB VAL A 101 32.065 14.160 8.530 1.00 14.41 C ATOM 1445 CG1 VAL A 101 32.192 13.366 7.228 1.00 25.41 C ATOM 1446 CG2 VAL A 101 30.618 14.170 9.028 1.00 42.30 C ATOM 0 H VAL A 101 32.798 15.313 10.804 1.00 42.14 H new ATOM 0 HA VAL A 101 32.762 12.547 9.788 1.00 72.23 H new ATOM 0 HB VAL A 101 32.360 15.189 8.322 1.00 14.41 H new ATOM 0 HG11 VAL A 101 31.517 13.783 6.480 1.00 25.41 H new ATOM 0 HG12 VAL A 101 33.218 13.425 6.864 1.00 25.41 H new ATOM 0 HG13 VAL A 101 31.932 12.323 7.411 1.00 25.41 H new ATOM 0 HG21 VAL A 101 29.968 14.570 8.250 1.00 42.30 H new ATOM 0 HG22 VAL A 101 30.310 13.153 9.271 1.00 42.30 H new ATOM 0 HG23 VAL A 101 30.544 14.794 9.919 1.00 42.30 H new ATOM 1456 N ALA A 102 35.243 12.664 9.395 1.00 43.12 N ATOM 1457 CA ALA A 102 36.644 12.657 8.998 1.00 40.03 C ATOM 1458 C ALA A 102 36.795 12.035 7.618 1.00 12.52 C ATOM 1459 O ALA A 102 36.759 10.812 7.467 1.00 73.10 O ATOM 1460 CB ALA A 102 37.485 11.903 10.024 1.00 44.05 C ATOM 0 H ALA A 102 34.935 11.817 9.872 1.00 43.12 H new ATOM 0 HA ALA A 102 37.001 13.686 8.955 1.00 40.03 H new ATOM 0 HB1 ALA A 102 38.529 11.907 9.712 1.00 44.05 H new ATOM 0 HB2 ALA A 102 37.395 12.388 10.996 1.00 44.05 H new ATOM 0 HB3 ALA A 102 37.133 10.874 10.098 1.00 44.05 H new ATOM 1466 N LEU A 103 36.954 12.885 6.613 1.00 73.31 N ATOM 1467 CA LEU A 103 37.063 12.442 5.232 1.00 63.24 C ATOM 1468 C LEU A 103 38.504 12.639 4.751 1.00 11.33 C ATOM 1469 O LEU A 103 39.007 13.763 4.732 1.00 24.41 O ATOM 1470 CB LEU A 103 36.074 13.236 4.357 1.00 41.13 C ATOM 1471 CG LEU A 103 35.514 12.506 3.119 1.00 32.24 C ATOM 1472 CD1 LEU A 103 36.615 12.110 2.139 1.00 55.32 C ATOM 1473 CD2 LEU A 103 34.681 11.302 3.533 1.00 41.41 C ATOM 0 H LEU A 103 37.011 13.896 6.732 1.00 73.31 H new ATOM 0 HA LEU A 103 36.813 11.384 5.157 1.00 63.24 H new ATOM 0 HB2 LEU A 103 35.235 13.542 4.982 1.00 41.13 H new ATOM 0 HB3 LEU A 103 36.570 14.147 4.021 1.00 41.13 H new ATOM 0 HG LEU A 103 34.863 13.206 2.595 1.00 32.24 H new ATOM 0 HD11 LEU A 103 36.174 11.599 1.283 1.00 55.32 H new ATOM 0 HD12 LEU A 103 37.137 13.004 1.798 1.00 55.32 H new ATOM 0 HD13 LEU A 103 37.321 11.444 2.635 1.00 55.32 H new ATOM 0 HD21 LEU A 103 34.296 10.803 2.644 1.00 41.41 H new ATOM 0 HD22 LEU A 103 35.302 10.608 4.099 1.00 41.41 H new ATOM 0 HD23 LEU A 103 33.847 11.632 4.153 1.00 41.41 H new ATOM 1485 N PRO A 104 39.197 11.546 4.390 1.00 73.52 N ATOM 1486 CA PRO A 104 40.599 11.599 3.956 1.00 62.42 C ATOM 1487 C PRO A 104 40.774 12.250 2.590 1.00 45.15 C ATOM 1488 O PRO A 104 39.888 12.178 1.734 1.00 0.45 O ATOM 1489 CB PRO A 104 41.003 10.124 3.896 1.00 24.31 C ATOM 1490 CG PRO A 104 39.729 9.406 3.626 1.00 63.40 C ATOM 1491 CD PRO A 104 38.676 10.166 4.380 1.00 45.41 C ATOM 0 HA PRO A 104 41.206 12.202 4.631 1.00 62.42 H new ATOM 0 HB2 PRO A 104 41.736 9.944 3.110 1.00 24.31 H new ATOM 0 HB3 PRO A 104 41.454 9.796 4.833 1.00 24.31 H new ATOM 0 HG2 PRO A 104 39.509 9.384 2.559 1.00 63.40 H new ATOM 0 HG3 PRO A 104 39.783 8.370 3.962 1.00 63.40 H new ATOM 0 HD2 PRO A 104 37.706 10.106 3.887 1.00 45.41 H new ATOM 0 HD3 PRO A 104 38.545 9.778 5.390 1.00 45.41 H new ATOM 1499 N GLY A 105 41.929 12.872 2.397 1.00 54.45 N ATOM 1500 CA GLY A 105 42.253 13.505 1.126 1.00 13.33 C ATOM 1501 C GLY A 105 41.339 14.670 0.785 1.00 43.42 C ATOM 1502 O GLY A 105 41.303 15.122 -0.363 1.00 1.41 O ATOM 0 H GLY A 105 42.658 12.952 3.106 1.00 54.45 H new ATOM 0 HA2 GLY A 105 43.284 13.858 1.156 1.00 13.33 H new ATOM 0 HA3 GLY A 105 42.194 12.761 0.332 1.00 13.33 H new ATOM 1506 N LEU A 106 40.604 15.159 1.780 1.00 4.51 N ATOM 1507 CA LEU A 106 39.634 16.234 1.582 1.00 40.14 C ATOM 1508 C LEU A 106 39.979 17.444 2.448 1.00 43.11 C ATOM 1509 O LEU A 106 40.420 17.304 3.591 1.00 42.33 O ATOM 1510 CB LEU A 106 38.220 15.719 1.901 1.00 65.03 C ATOM 1511 CG LEU A 106 37.109 16.781 2.024 1.00 43.51 C ATOM 1512 CD1 LEU A 106 36.959 17.597 0.745 1.00 44.14 C ATOM 1513 CD2 LEU A 106 35.786 16.117 2.388 1.00 41.21 C ATOM 0 H LEU A 106 40.663 14.824 2.742 1.00 4.51 H new ATOM 0 HA LEU A 106 39.668 16.553 0.540 1.00 40.14 H new ATOM 0 HB2 LEU A 106 37.931 15.013 1.123 1.00 65.03 H new ATOM 0 HB3 LEU A 106 38.264 15.162 2.837 1.00 65.03 H new ATOM 0 HG LEU A 106 37.396 17.470 2.819 1.00 43.51 H new ATOM 0 HD11 LEU A 106 36.166 18.334 0.874 1.00 44.14 H new ATOM 0 HD12 LEU A 106 37.897 18.108 0.527 1.00 44.14 H new ATOM 0 HD13 LEU A 106 36.707 16.934 -0.082 1.00 44.14 H new ATOM 0 HD21 LEU A 106 35.009 16.877 2.472 1.00 41.21 H new ATOM 0 HD22 LEU A 106 35.512 15.402 1.612 1.00 41.21 H new ATOM 0 HD23 LEU A 106 35.890 15.597 3.340 1.00 41.21 H new ATOM 1525 N ASP A 107 39.812 18.630 1.874 1.00 72.42 N ATOM 1526 CA ASP A 107 40.005 19.884 2.595 1.00 14.02 C ATOM 1527 C ASP A 107 38.797 20.176 3.473 1.00 1.12 C ATOM 1528 O ASP A 107 37.661 19.939 3.065 1.00 10.24 O ATOM 1529 CB ASP A 107 40.203 21.042 1.610 1.00 13.35 C ATOM 1530 CG ASP A 107 41.547 20.997 0.898 1.00 12.43 C ATOM 1531 OD1 ASP A 107 41.648 20.327 -0.154 1.00 14.01 O ATOM 1532 OD2 ASP A 107 42.505 21.637 1.380 1.00 2.52 O1- ATOM 0 H ASP A 107 39.540 18.750 0.898 1.00 72.42 H new ATOM 0 HA ASP A 107 40.893 19.786 3.219 1.00 14.02 H new ATOM 0 HB2 ASP A 107 39.405 21.021 0.868 1.00 13.35 H new ATOM 0 HB3 ASP A 107 40.114 21.987 2.147 1.00 13.35 H new ATOM 1537 N ALA A 108 39.047 20.706 4.662 1.00 41.30 N ATOM 1538 CA ALA A 108 37.981 21.060 5.597 1.00 54.32 C ATOM 1539 C ALA A 108 37.036 22.092 4.983 1.00 74.35 C ATOM 1540 O ALA A 108 35.816 22.003 5.137 1.00 33.14 O ATOM 1541 CB ALA A 108 38.581 21.590 6.893 1.00 73.33 C ATOM 0 H ALA A 108 39.987 20.903 5.007 1.00 41.30 H new ATOM 0 HA ALA A 108 37.401 20.163 5.816 1.00 54.32 H new ATOM 0 HB1 ALA A 108 37.780 21.852 7.584 1.00 73.33 H new ATOM 0 HB2 ALA A 108 39.212 20.823 7.342 1.00 73.33 H new ATOM 0 HB3 ALA A 108 39.181 22.475 6.681 1.00 73.33 H new ATOM 1547 N ALA A 109 37.614 23.060 4.273 1.00 23.13 N ATOM 1548 CA ALA A 109 36.844 24.128 3.636 1.00 64.13 C ATOM 1549 C ALA A 109 35.796 23.554 2.684 1.00 31.24 C ATOM 1550 O ALA A 109 34.650 24.006 2.657 1.00 41.21 O ATOM 1551 CB ALA A 109 37.777 25.081 2.894 1.00 33.23 C ATOM 0 H ALA A 109 38.621 23.126 4.124 1.00 23.13 H new ATOM 0 HA ALA A 109 36.322 24.684 4.415 1.00 64.13 H new ATOM 0 HB1 ALA A 109 37.191 25.871 2.424 1.00 33.23 H new ATOM 0 HB2 ALA A 109 38.482 25.522 3.599 1.00 33.23 H new ATOM 0 HB3 ALA A 109 38.325 24.531 2.128 1.00 33.23 H new ATOM 1557 N ALA A 110 36.199 22.553 1.907 1.00 73.25 N ATOM 1558 CA ALA A 110 35.293 21.893 0.971 1.00 12.34 C ATOM 1559 C ALA A 110 34.383 20.922 1.714 1.00 44.05 C ATOM 1560 O ALA A 110 33.195 20.801 1.408 1.00 34.04 O ATOM 1561 CB ALA A 110 36.081 21.167 -0.112 1.00 53.00 C ATOM 0 H ALA A 110 37.148 22.180 1.907 1.00 73.25 H new ATOM 0 HA ALA A 110 34.673 22.651 0.492 1.00 12.34 H new ATOM 0 HB1 ALA A 110 35.390 20.681 -0.801 1.00 53.00 H new ATOM 0 HB2 ALA A 110 36.694 21.884 -0.659 1.00 53.00 H new ATOM 0 HB3 ALA A 110 36.724 20.416 0.347 1.00 53.00 H new ATOM 1567 N ALA A 111 34.950 20.247 2.709 1.00 5.14 N ATOM 1568 CA ALA A 111 34.212 19.282 3.516 1.00 43.54 C ATOM 1569 C ALA A 111 32.983 19.931 4.137 1.00 4.44 C ATOM 1570 O ALA A 111 31.940 19.296 4.283 1.00 54.13 O ATOM 1571 CB ALA A 111 35.116 18.691 4.589 1.00 13.31 C ATOM 0 H ALA A 111 35.928 20.353 2.977 1.00 5.14 H new ATOM 0 HA ALA A 111 33.874 18.473 2.869 1.00 43.54 H new ATOM 0 HB1 ALA A 111 34.553 17.972 5.184 1.00 13.31 H new ATOM 0 HB2 ALA A 111 35.960 18.189 4.117 1.00 13.31 H new ATOM 0 HB3 ALA A 111 35.483 19.488 5.235 1.00 13.31 H new ATOM 1577 N LYS A 112 33.115 21.207 4.487 1.00 1.14 N ATOM 1578 CA LYS A 112 31.996 21.988 5.002 1.00 13.13 C ATOM 1579 C LYS A 112 30.807 21.938 4.045 1.00 74.23 C ATOM 1580 O LYS A 112 29.678 21.674 4.464 1.00 4.50 O ATOM 1581 CB LYS A 112 32.417 23.445 5.235 1.00 13.05 C ATOM 1582 CG LYS A 112 33.235 23.660 6.504 1.00 32.13 C ATOM 1583 CD LYS A 112 32.410 23.372 7.756 1.00 10.41 C ATOM 1584 CE LYS A 112 33.147 23.770 9.028 1.00 22.11 C ATOM 1585 NZ LYS A 112 33.433 25.230 9.074 1.00 2.23 N1+ ATOM 0 H LYS A 112 33.992 21.724 4.423 1.00 1.14 H new ATOM 0 HA LYS A 112 31.694 21.550 5.953 1.00 13.13 H new ATOM 0 HB2 LYS A 112 32.999 23.786 4.378 1.00 13.05 H new ATOM 0 HB3 LYS A 112 31.523 24.067 5.281 1.00 13.05 H new ATOM 0 HG2 LYS A 112 34.112 23.012 6.487 1.00 32.13 H new ATOM 0 HG3 LYS A 112 33.598 24.687 6.534 1.00 32.13 H new ATOM 0 HD2 LYS A 112 31.465 23.913 7.700 1.00 10.41 H new ATOM 0 HD3 LYS A 112 32.168 22.310 7.794 1.00 10.41 H new ATOM 0 HE2 LYS A 112 32.549 23.490 9.896 1.00 22.11 H new ATOM 0 HE3 LYS A 112 34.083 23.215 9.093 1.00 22.11 H new ATOM 0 HZ1 LYS A 112 33.649 25.511 10.052 1.00 2.23 H new ATOM 0 HZ2 LYS A 112 34.248 25.443 8.465 1.00 2.23 H new ATOM 0 HZ3 LYS A 112 32.602 25.757 8.738 1.00 2.23 H new ATOM 1599 N THR A 113 31.062 22.177 2.760 1.00 31.43 N ATOM 1600 CA THR A 113 29.992 22.218 1.772 1.00 60.21 C ATOM 1601 C THR A 113 29.498 20.809 1.451 1.00 74.22 C ATOM 1602 O THR A 113 28.305 20.601 1.229 1.00 73.22 O ATOM 1603 CB THR A 113 30.429 22.945 0.468 1.00 31.33 C ATOM 1604 OG1 THR A 113 29.285 23.532 -0.173 1.00 10.35 O ATOM 1605 CG2 THR A 113 31.115 22.003 -0.517 1.00 32.43 C ATOM 0 H THR A 113 31.995 22.344 2.383 1.00 31.43 H new ATOM 0 HA THR A 113 29.174 22.790 2.210 1.00 60.21 H new ATOM 0 HB THR A 113 31.144 23.715 0.757 1.00 31.33 H new ATOM 0 HG1 THR A 113 29.568 23.989 -0.992 1.00 10.35 H new ATOM 0 HG21 THR A 113 31.401 22.557 -1.411 1.00 32.43 H new ATOM 0 HG22 THR A 113 32.005 21.577 -0.054 1.00 32.43 H new ATOM 0 HG23 THR A 113 30.430 21.201 -0.791 1.00 32.43 H new ATOM 1613 N LEU A 114 30.415 19.843 1.448 1.00 23.12 N ATOM 1614 CA LEU A 114 30.070 18.459 1.131 1.00 20.51 C ATOM 1615 C LEU A 114 29.168 17.871 2.214 1.00 41.04 C ATOM 1616 O LEU A 114 28.114 17.306 1.921 1.00 13.34 O ATOM 1617 CB LEU A 114 31.336 17.606 0.966 1.00 61.01 C ATOM 1618 CG LEU A 114 32.308 18.079 -0.130 1.00 11.45 C ATOM 1619 CD1 LEU A 114 33.457 17.087 -0.303 1.00 1.51 C ATOM 1620 CD2 LEU A 114 31.571 18.300 -1.451 1.00 50.51 C ATOM 0 H LEU A 114 31.401 19.993 1.661 1.00 23.12 H new ATOM 0 HA LEU A 114 29.527 18.451 0.186 1.00 20.51 H new ATOM 0 HB2 LEU A 114 31.868 17.587 1.917 1.00 61.01 H new ATOM 0 HB3 LEU A 114 31.038 16.581 0.747 1.00 61.01 H new ATOM 0 HG LEU A 114 32.733 19.033 0.182 1.00 11.45 H new ATOM 0 HD11 LEU A 114 34.131 17.443 -1.083 1.00 1.51 H new ATOM 0 HD12 LEU A 114 34.004 16.997 0.635 1.00 1.51 H new ATOM 0 HD13 LEU A 114 33.057 16.113 -0.585 1.00 1.51 H new ATOM 0 HD21 LEU A 114 32.278 18.634 -2.211 1.00 50.51 H new ATOM 0 HD22 LEU A 114 31.109 17.366 -1.771 1.00 50.51 H new ATOM 0 HD23 LEU A 114 30.800 19.058 -1.315 1.00 50.51 H new ATOM 1632 N VAL A 115 29.579 18.032 3.466 1.00 72.22 N ATOM 1633 CA VAL A 115 28.799 17.550 4.602 1.00 32.34 C ATOM 1634 C VAL A 115 27.471 18.296 4.684 1.00 1.13 C ATOM 1635 O VAL A 115 26.435 17.714 5.033 1.00 25.22 O ATOM 1636 CB VAL A 115 29.580 17.718 5.935 1.00 63.01 C ATOM 1637 CG1 VAL A 115 28.708 17.374 7.142 1.00 14.41 C ATOM 1638 CG2 VAL A 115 30.842 16.857 5.926 1.00 35.24 C ATOM 0 H VAL A 115 30.451 18.494 3.722 1.00 72.22 H new ATOM 0 HA VAL A 115 28.609 16.488 4.449 1.00 32.34 H new ATOM 0 HB VAL A 115 29.869 18.766 6.021 1.00 63.01 H new ATOM 0 HG11 VAL A 115 29.286 17.503 8.057 1.00 14.41 H new ATOM 0 HG12 VAL A 115 27.841 18.034 7.165 1.00 14.41 H new ATOM 0 HG13 VAL A 115 28.374 16.339 7.066 1.00 14.41 H new ATOM 0 HG21 VAL A 115 31.377 16.986 6.867 1.00 35.24 H new ATOM 0 HG22 VAL A 115 30.567 15.809 5.806 1.00 35.24 H new ATOM 0 HG23 VAL A 115 31.484 17.160 5.099 1.00 35.24 H new ATOM 1648 N ASP A 116 27.511 19.583 4.345 1.00 34.11 N ATOM 1649 CA ASP A 116 26.319 20.428 4.362 1.00 22.44 C ATOM 1650 C ASP A 116 25.261 19.857 3.423 1.00 4.20 C ATOM 1651 O ASP A 116 24.183 19.449 3.862 1.00 63.50 O ATOM 1652 CB ASP A 116 26.676 21.861 3.934 1.00 1.42 C ATOM 1653 CG ASP A 116 25.598 22.880 4.283 1.00 43.12 C ATOM 1654 OD1 ASP A 116 25.873 23.777 5.112 1.00 62.34 O ATOM 1655 OD2 ASP A 116 24.480 22.794 3.735 1.00 50.12 O1- ATOM 0 H ASP A 116 28.361 20.065 4.054 1.00 34.11 H new ATOM 0 HA ASP A 116 25.922 20.451 5.377 1.00 22.44 H new ATOM 0 HB2 ASP A 116 27.611 22.153 4.412 1.00 1.42 H new ATOM 0 HB3 ASP A 116 26.849 21.879 2.858 1.00 1.42 H new ATOM 1660 N ARG A 117 25.601 19.777 2.134 1.00 43.12 N ATOM 1661 CA ARG A 117 24.669 19.296 1.120 1.00 25.23 C ATOM 1662 C ARG A 117 24.266 17.856 1.411 1.00 51.42 C ATOM 1663 O ARG A 117 23.120 17.467 1.202 1.00 42.42 O ATOM 1664 CB ARG A 117 25.303 19.414 -0.271 1.00 4.30 C ATOM 1665 CG ARG A 117 26.637 18.691 -0.392 1.00 3.24 C ATOM 1666 CD ARG A 117 27.345 19.001 -1.701 1.00 12.41 C ATOM 1667 NE ARG A 117 26.653 18.411 -2.851 1.00 15.40 N ATOM 1668 CZ ARG A 117 27.150 18.346 -4.091 1.00 54.12 C ATOM 1669 NH1 ARG A 117 28.350 18.841 -4.375 1.00 44.31 N1+ ATOM 1670 NH2 ARG A 117 26.432 17.786 -5.052 1.00 65.24 N ATOM 0 H ARG A 117 26.517 20.040 1.771 1.00 43.12 H new ATOM 0 HA ARG A 117 23.769 19.911 1.144 1.00 25.23 H new ATOM 0 HB2 ARG A 117 24.612 19.012 -1.012 1.00 4.30 H new ATOM 0 HB3 ARG A 117 25.447 20.468 -0.508 1.00 4.30 H new ATOM 0 HG2 ARG A 117 27.279 18.976 0.442 1.00 3.24 H new ATOM 0 HG3 ARG A 117 26.473 17.616 -0.316 1.00 3.24 H new ATOM 0 HD2 ARG A 117 27.410 20.081 -1.832 1.00 12.41 H new ATOM 0 HD3 ARG A 117 28.367 18.623 -1.659 1.00 12.41 H new ATOM 0 HE ARG A 117 25.724 18.021 -2.694 1.00 15.40 H new ATOM 0 HH11 ARG A 117 28.908 19.279 -3.642 1.00 44.31 H new ATOM 0 HH12 ARG A 117 28.714 18.783 -5.326 1.00 44.31 H new ATOM 0 HH21 ARG A 117 25.508 17.408 -4.844 1.00 65.24 H new ATOM 0 HH22 ARG A 117 26.803 17.732 -6.001 1.00 65.24 H new ATOM 1684 N ALA A 118 25.218 17.079 1.914 1.00 40.10 N ATOM 1685 CA ALA A 118 24.967 15.689 2.287 1.00 45.33 C ATOM 1686 C ALA A 118 23.849 15.598 3.327 1.00 63.41 C ATOM 1687 O ALA A 118 22.944 14.773 3.209 1.00 0.11 O ATOM 1688 CB ALA A 118 26.243 15.038 2.809 1.00 44.02 C ATOM 0 H ALA A 118 26.177 17.389 2.074 1.00 40.10 H new ATOM 0 HA ALA A 118 24.644 15.149 1.397 1.00 45.33 H new ATOM 0 HB1 ALA A 118 26.038 14.003 3.082 1.00 44.02 H new ATOM 0 HB2 ALA A 118 27.008 15.064 2.033 1.00 44.02 H new ATOM 0 HB3 ALA A 118 26.596 15.581 3.685 1.00 44.02 H new ATOM 1694 N HIS A 119 23.903 16.469 4.337 1.00 52.13 N ATOM 1695 CA HIS A 119 22.895 16.477 5.400 1.00 15.33 C ATOM 1696 C HIS A 119 21.622 17.204 4.965 1.00 0.40 C ATOM 1697 O HIS A 119 20.672 17.314 5.740 1.00 63.33 O ATOM 1698 CB HIS A 119 23.463 17.106 6.680 1.00 54.45 C ATOM 1699 CG HIS A 119 24.375 16.185 7.433 1.00 21.21 C ATOM 1700 ND1 HIS A 119 25.688 15.967 7.080 1.00 2.34 N ATOM 1701 CD2 HIS A 119 24.147 15.405 8.517 1.00 20.34 C ATOM 1702 CE1 HIS A 119 26.227 15.092 7.910 1.00 52.23 C ATOM 1703 NE2 HIS A 119 25.314 14.736 8.792 1.00 74.13 N ATOM 0 H HIS A 119 24.631 17.176 4.441 1.00 52.13 H new ATOM 0 HA HIS A 119 22.629 15.441 5.608 1.00 15.33 H new ATOM 0 HB2 HIS A 119 24.007 18.014 6.421 1.00 54.45 H new ATOM 0 HB3 HIS A 119 22.639 17.402 7.329 1.00 54.45 H new ATOM 0 HD1 HIS A 119 26.170 16.412 6.299 1.00 2.34 H new ATOM 0 HD2 HIS A 119 23.219 15.324 9.064 1.00 20.34 H new ATOM 0 HE1 HIS A 119 27.244 14.730 7.872 1.00 52.23 H new ATOM 1712 N HIS A 120 21.612 17.708 3.734 1.00 43.52 N ATOM 1713 CA HIS A 120 20.405 18.297 3.151 1.00 31.45 C ATOM 1714 C HIS A 120 19.699 17.270 2.268 1.00 61.14 C ATOM 1715 O HIS A 120 18.480 17.107 2.340 1.00 43.11 O ATOM 1716 CB HIS A 120 20.736 19.556 2.328 1.00 2.24 C ATOM 1717 CG HIS A 120 21.024 20.778 3.156 1.00 45.12 C ATOM 1718 ND1 HIS A 120 20.549 22.030 2.836 1.00 44.32 N ATOM 1719 CD2 HIS A 120 21.756 20.937 4.283 1.00 50.50 C ATOM 1720 CE1 HIS A 120 20.977 22.902 3.726 1.00 65.24 C ATOM 1721 NE2 HIS A 120 21.715 22.269 4.618 1.00 75.14 N ATOM 0 H HIS A 120 22.425 17.721 3.119 1.00 43.52 H new ATOM 0 HA HIS A 120 19.745 18.591 3.967 1.00 31.45 H new ATOM 0 HB2 HIS A 120 21.600 19.347 1.697 1.00 2.24 H new ATOM 0 HB3 HIS A 120 19.900 19.771 1.662 1.00 2.24 H new ATOM 0 HD2 HIS A 120 22.277 20.159 4.821 1.00 50.50 H new ATOM 0 HE1 HIS A 120 20.760 23.960 3.726 1.00 65.24 H new ATOM 0 HE2 HIS A 120 22.177 22.696 5.421 1.00 75.14 H new ATOM 1730 N VAL A 121 20.479 16.566 1.453 1.00 33.11 N ATOM 1731 CA VAL A 121 19.935 15.590 0.513 1.00 23.21 C ATOM 1732 C VAL A 121 19.603 14.277 1.216 1.00 3.02 C ATOM 1733 O VAL A 121 18.681 13.565 0.811 1.00 30.52 O ATOM 1734 CB VAL A 121 20.913 15.314 -0.664 1.00 61.42 C ATOM 1735 CG1 VAL A 121 21.224 16.602 -1.425 1.00 74.54 C ATOM 1736 CG2 VAL A 121 22.200 14.647 -0.170 1.00 44.31 C ATOM 0 H VAL A 121 21.495 16.654 1.425 1.00 33.11 H new ATOM 0 HA VAL A 121 19.020 16.021 0.107 1.00 23.21 H new ATOM 0 HB VAL A 121 20.423 14.623 -1.350 1.00 61.42 H new ATOM 0 HG11 VAL A 121 21.910 16.384 -2.244 1.00 74.54 H new ATOM 0 HG12 VAL A 121 20.301 17.019 -1.827 1.00 74.54 H new ATOM 0 HG13 VAL A 121 21.684 17.322 -0.748 1.00 74.54 H new ATOM 0 HG21 VAL A 121 22.864 14.467 -1.015 1.00 44.31 H new ATOM 0 HG22 VAL A 121 22.696 15.300 0.548 1.00 44.31 H new ATOM 0 HG23 VAL A 121 21.957 13.699 0.310 1.00 44.31 H new ATOM 1746 N CYS A 122 20.352 13.952 2.268 1.00 31.44 N ATOM 1747 CA CYS A 122 20.136 12.706 2.996 1.00 53.14 C ATOM 1748 C CYS A 122 20.290 12.885 4.511 1.00 23.34 C ATOM 1749 O CYS A 122 21.274 12.436 5.103 1.00 24.32 O ATOM 1750 CB CYS A 122 21.093 11.622 2.488 1.00 50.43 C ATOM 1751 SG CYS A 122 20.849 11.187 0.751 1.00 72.12 S ATOM 0 H CYS A 122 21.109 14.531 2.633 1.00 31.44 H new ATOM 0 HA CYS A 122 19.108 12.396 2.810 1.00 53.14 H new ATOM 0 HB2 CYS A 122 22.119 11.963 2.627 1.00 50.43 H new ATOM 0 HB3 CYS A 122 20.969 10.727 3.098 1.00 50.43 H new ATOM 0 HG CYS A 122 19.869 11.887 0.262 1.00 72.12 H new ATOM 1757 N PRO A 123 19.338 13.585 5.153 1.00 50.40 N ATOM 1758 CA PRO A 123 19.188 13.554 6.598 1.00 60.03 C ATOM 1759 C PRO A 123 18.238 12.422 6.993 1.00 74.45 C ATOM 1760 O PRO A 123 17.316 12.103 6.238 1.00 30.15 O ATOM 1761 CB PRO A 123 18.575 14.924 6.900 1.00 24.23 C ATOM 1762 CG PRO A 123 17.747 15.246 5.692 1.00 34.14 C ATOM 1763 CD PRO A 123 18.348 14.485 4.525 1.00 45.03 C ATOM 0 HA PRO A 123 20.115 13.376 7.142 1.00 60.03 H new ATOM 0 HB2 PRO A 123 17.964 14.894 7.802 1.00 24.23 H new ATOM 0 HB3 PRO A 123 19.347 15.676 7.063 1.00 24.23 H new ATOM 0 HG2 PRO A 123 16.708 14.955 5.848 1.00 34.14 H new ATOM 0 HG3 PRO A 123 17.752 16.318 5.496 1.00 34.14 H new ATOM 0 HD2 PRO A 123 17.588 13.924 3.981 1.00 45.03 H new ATOM 0 HD3 PRO A 123 18.819 15.159 3.810 1.00 45.03 H new ATOM 1771 N TYR A 124 18.454 11.807 8.155 1.00 53.44 N ATOM 1772 CA TYR A 124 17.598 10.697 8.584 1.00 1.24 C ATOM 1773 C TYR A 124 16.148 11.179 8.673 1.00 42.34 C ATOM 1774 O TYR A 124 15.200 10.424 8.451 1.00 23.13 O ATOM 1775 CB TYR A 124 18.077 10.120 9.930 1.00 65.44 C ATOM 1776 CG TYR A 124 17.824 8.631 10.067 1.00 10.42 C ATOM 1777 CD1 TYR A 124 17.365 8.069 11.256 1.00 42.12 C ATOM 1778 CD2 TYR A 124 18.043 7.782 8.985 1.00 13.25 C ATOM 1779 CE1 TYR A 124 17.134 6.711 11.354 1.00 14.31 C ATOM 1780 CE2 TYR A 124 17.816 6.426 9.081 1.00 12.12 C ATOM 1781 CZ TYR A 124 17.362 5.895 10.263 1.00 5.42 C ATOM 1782 OH TYR A 124 17.132 4.544 10.357 1.00 60.35 O ATOM 0 H TYR A 124 19.199 12.051 8.807 1.00 53.44 H new ATOM 0 HA TYR A 124 17.658 9.894 7.849 1.00 1.24 H new ATOM 0 HB2 TYR A 124 19.144 10.312 10.041 1.00 65.44 H new ATOM 0 HB3 TYR A 124 17.573 10.644 10.742 1.00 65.44 H new ATOM 0 HD1 TYR A 124 17.188 8.703 12.112 1.00 42.12 H new ATOM 0 HD2 TYR A 124 18.398 8.194 8.052 1.00 13.25 H new ATOM 0 HE1 TYR A 124 16.776 6.288 12.281 1.00 14.31 H new ATOM 0 HE2 TYR A 124 17.994 5.784 8.231 1.00 12.12 H new ATOM 0 HH TYR A 124 17.971 4.058 10.212 1.00 60.35 H new ATOM 1792 N SER A 125 16.016 12.458 8.997 1.00 23.21 N ATOM 1793 CA SER A 125 14.755 13.185 8.955 1.00 62.44 C ATOM 1794 C SER A 125 15.091 14.671 8.857 1.00 2.13 C ATOM 1795 O SER A 125 16.047 15.120 9.482 1.00 5.11 O ATOM 1796 CB SER A 125 13.915 12.908 10.215 1.00 61.32 C ATOM 1797 OG SER A 125 13.632 11.527 10.359 1.00 44.54 O ATOM 0 H SER A 125 16.801 13.032 9.304 1.00 23.21 H new ATOM 0 HA SER A 125 14.164 12.863 8.098 1.00 62.44 H new ATOM 0 HB2 SER A 125 14.450 13.264 11.095 1.00 61.32 H new ATOM 0 HB3 SER A 125 12.981 13.468 10.161 1.00 61.32 H new ATOM 0 HG SER A 125 14.103 11.022 9.664 1.00 44.54 H new ATOM 1803 N ASN A 126 14.347 15.440 8.071 1.00 23.44 N ATOM 1804 CA ASN A 126 14.649 16.870 7.933 1.00 73.42 C ATOM 1805 C ASN A 126 14.593 17.561 9.295 1.00 24.25 C ATOM 1806 O ASN A 126 15.354 18.489 9.566 1.00 64.13 O ATOM 1807 CB ASN A 126 13.705 17.554 6.930 1.00 54.23 C ATOM 1808 CG ASN A 126 14.071 17.247 5.483 1.00 23.41 C ATOM 1809 OD1 ASN A 126 14.898 17.935 4.878 1.00 4.50 O ATOM 1810 ND2 ASN A 126 13.457 16.222 4.913 1.00 5.31 N ATOM 0 H ASN A 126 13.547 15.113 7.529 1.00 23.44 H new ATOM 0 HA ASN A 126 15.661 16.961 7.539 1.00 73.42 H new ATOM 0 HB2 ASN A 126 12.682 17.230 7.119 1.00 54.23 H new ATOM 0 HB3 ASN A 126 13.732 18.632 7.087 1.00 54.23 H new ATOM 0 HD21 ASN A 126 13.662 15.979 3.944 1.00 5.31 H new ATOM 0 HD22 ASN A 126 12.779 15.675 5.443 1.00 5.31 H new ATOM 1817 N ALA A 127 13.723 17.064 10.166 1.00 54.04 N ATOM 1818 CA ALA A 127 13.542 17.624 11.503 1.00 54.10 C ATOM 1819 C ALA A 127 14.569 17.072 12.500 1.00 52.15 C ATOM 1820 O ALA A 127 14.505 17.363 13.687 1.00 1.24 O ATOM 1821 CB ALA A 127 12.128 17.346 11.993 1.00 41.33 C ATOM 0 H ALA A 127 13.123 16.263 9.968 1.00 54.04 H new ATOM 0 HA ALA A 127 13.700 18.701 11.437 1.00 54.10 H new ATOM 0 HB1 ALA A 127 11.999 17.766 12.991 1.00 41.33 H new ATOM 0 HB2 ALA A 127 11.410 17.803 11.312 1.00 41.33 H new ATOM 0 HB3 ALA A 127 11.960 16.270 12.028 1.00 41.33 H new ATOM 1827 N THR A 128 15.535 16.302 12.020 1.00 1.20 N ATOM 1828 CA THR A 128 16.465 15.610 12.916 1.00 2.03 C ATOM 1829 C THR A 128 17.704 16.463 13.105 1.00 41.31 C ATOM 1830 O THR A 128 18.589 16.132 13.888 1.00 64.41 O ATOM 1831 CB THR A 128 16.876 14.206 12.386 1.00 53.22 C ATOM 1832 OG1 THR A 128 17.295 13.371 13.473 1.00 44.43 O ATOM 1833 CG2 THR A 128 18.017 14.291 11.370 1.00 73.21 C ATOM 0 H THR A 128 15.699 16.138 11.027 1.00 1.20 H new ATOM 0 HA THR A 128 15.952 15.458 13.866 1.00 2.03 H new ATOM 0 HB THR A 128 16.001 13.782 11.894 1.00 53.22 H new ATOM 0 HG1 THR A 128 17.883 13.880 14.069 1.00 44.43 H new ATOM 0 HG21 THR A 128 18.273 13.289 11.026 1.00 73.21 H new ATOM 0 HG22 THR A 128 17.703 14.898 10.521 1.00 73.21 H new ATOM 0 HG23 THR A 128 18.889 14.747 11.839 1.00 73.21 H new ATOM 1841 N ARG A 129 17.753 17.564 12.365 1.00 15.30 N ATOM 1842 CA ARG A 129 18.904 18.449 12.386 1.00 1.24 C ATOM 1843 C ARG A 129 18.522 19.842 12.891 1.00 21.22 C ATOM 1844 O ARG A 129 19.228 20.426 13.714 1.00 60.25 O ATOM 1845 CB ARG A 129 19.525 18.521 10.987 1.00 61.34 C ATOM 1846 CG ARG A 129 18.571 18.976 9.886 1.00 45.30 C ATOM 1847 CD ARG A 129 19.321 19.318 8.605 1.00 1.10 C ATOM 1848 NE ARG A 129 20.336 20.351 8.840 1.00 10.14 N ATOM 1849 CZ ARG A 129 20.534 21.413 8.058 1.00 72.04 C ATOM 1850 NH1 ARG A 129 19.824 21.578 6.949 1.00 12.15 N1+ ATOM 1851 NH2 ARG A 129 21.452 22.313 8.394 1.00 55.55 N ATOM 0 H ARG A 129 17.004 17.864 11.741 1.00 15.30 H new ATOM 0 HA ARG A 129 19.643 18.046 13.079 1.00 1.24 H new ATOM 0 HB2 ARG A 129 20.375 19.203 11.017 1.00 61.34 H new ATOM 0 HB3 ARG A 129 19.915 17.537 10.727 1.00 61.34 H new ATOM 0 HG2 ARG A 129 17.844 18.189 9.684 1.00 45.30 H new ATOM 0 HG3 ARG A 129 18.011 19.848 10.225 1.00 45.30 H new ATOM 0 HD2 ARG A 129 19.797 18.421 8.210 1.00 1.10 H new ATOM 0 HD3 ARG A 129 18.615 19.664 7.849 1.00 1.10 H new ATOM 0 HE ARG A 129 20.933 20.250 9.661 1.00 10.14 H new ATOM 0 HH11 ARG A 129 19.119 20.889 6.688 1.00 12.15 H new ATOM 0 HH12 ARG A 129 19.983 22.394 6.358 1.00 12.15 H new ATOM 0 HH21 ARG A 129 22.000 22.189 9.245 1.00 55.55 H new ATOM 0 HH22 ARG A 129 21.609 23.128 7.801 1.00 55.55 H new ATOM 1865 N ASN A 130 17.412 20.381 12.390 1.00 53.23 N ATOM 1866 CA ASN A 130 16.904 21.670 12.874 1.00 71.44 C ATOM 1867 C ASN A 130 16.179 21.496 14.200 1.00 71.52 C ATOM 1868 O ASN A 130 16.517 22.140 15.196 1.00 41.25 O ATOM 1869 CB ASN A 130 15.975 22.349 11.858 1.00 51.21 C ATOM 1870 CG ASN A 130 15.330 21.356 10.943 1.00 65.44 C ATOM 1871 OD1 ASN A 130 14.251 20.833 11.214 1.00 64.05 O ATOM 1872 ND2 ASN A 130 16.019 21.071 9.862 1.00 32.23 N ATOM 0 H ASN A 130 16.849 19.952 11.655 1.00 53.23 H new ATOM 0 HA ASN A 130 17.769 22.317 13.015 1.00 71.44 H new ATOM 0 HB2 ASN A 130 15.204 22.909 12.388 1.00 51.21 H new ATOM 0 HB3 ASN A 130 16.544 23.069 11.270 1.00 51.21 H new ATOM 0 HD21 ASN A 130 15.663 20.384 9.197 1.00 32.23 H new ATOM 0 HD22 ASN A 130 16.910 21.536 9.688 1.00 32.23 H new ATOM 1879 N ASN A 131 15.185 20.611 14.205 1.00 23.53 N ATOM 1880 CA ASN A 131 14.362 20.384 15.389 1.00 43.51 C ATOM 1881 C ASN A 131 15.195 19.740 16.493 1.00 71.03 C ATOM 1882 O ASN A 131 15.123 20.136 17.659 1.00 72.12 O ATOM 1883 CB ASN A 131 13.160 19.489 15.049 1.00 43.33 C ATOM 1884 CG ASN A 131 12.070 19.526 16.112 1.00 4.41 C ATOM 1885 OD1 ASN A 131 11.867 20.684 16.729 1.00 52.34 O flip ATOM 1886 ND2 ASN A 131 11.401 18.524 16.362 1.00 53.22 N flip ATOM 0 H ASN A 131 14.930 20.038 13.400 1.00 23.53 H new ATOM 0 HA ASN A 131 13.990 21.347 15.739 1.00 43.51 H new ATOM 0 HB2 ASN A 131 12.739 19.803 14.094 1.00 43.33 H new ATOM 0 HB3 ASN A 131 13.503 18.462 14.924 1.00 43.33 H new ATOM 0 HD21 ASN A 131 11.586 17.651 15.868 1.00 53.22 H new ATOM 0 HD22 ASN A 131 10.662 18.566 17.064 1.00 53.22 H new ATOM 1893 N VAL A 132 15.999 18.753 16.110 1.00 22.24 N ATOM 1894 CA VAL A 132 16.877 18.058 17.044 1.00 51.15 C ATOM 1895 C VAL A 132 18.274 18.674 16.984 1.00 30.12 C ATOM 1896 O VAL A 132 18.785 18.949 15.898 1.00 33.10 O ATOM 1897 CB VAL A 132 16.949 16.543 16.719 1.00 54.43 C ATOM 1898 CG1 VAL A 132 17.754 15.791 17.780 1.00 31.31 C ATOM 1899 CG2 VAL A 132 15.540 15.955 16.571 1.00 70.22 C ATOM 0 H VAL A 132 16.060 18.414 15.150 1.00 22.24 H new ATOM 0 HA VAL A 132 16.471 18.168 18.050 1.00 51.15 H new ATOM 0 HB VAL A 132 17.467 16.423 15.767 1.00 54.43 H new ATOM 0 HG11 VAL A 132 17.788 14.731 17.527 1.00 31.31 H new ATOM 0 HG12 VAL A 132 18.768 16.188 17.817 1.00 31.31 H new ATOM 0 HG13 VAL A 132 17.280 15.917 18.753 1.00 31.31 H new ATOM 0 HG21 VAL A 132 15.612 14.891 16.343 1.00 70.22 H new ATOM 0 HG22 VAL A 132 14.990 16.090 17.502 1.00 70.22 H new ATOM 0 HG23 VAL A 132 15.016 16.465 15.762 1.00 70.22 H new ATOM 1909 N ALA A 133 18.878 18.906 18.145 1.00 44.32 N ATOM 1910 CA ALA A 133 20.156 19.608 18.222 1.00 45.42 C ATOM 1911 C ALA A 133 21.310 18.736 17.750 1.00 30.31 C ATOM 1912 O ALA A 133 21.784 17.855 18.471 1.00 14.22 O ATOM 1913 CB ALA A 133 20.399 20.114 19.642 1.00 22.23 C ATOM 0 H ALA A 133 18.502 18.617 19.048 1.00 44.32 H new ATOM 0 HA ALA A 133 20.106 20.465 17.550 1.00 45.42 H new ATOM 0 HB1 ALA A 133 21.355 20.635 19.684 1.00 22.23 H new ATOM 0 HB2 ALA A 133 19.600 20.799 19.926 1.00 22.23 H new ATOM 0 HB3 ALA A 133 20.415 19.270 20.331 1.00 22.23 H new ATOM 1919 N VAL A 134 21.742 18.980 16.518 1.00 55.21 N ATOM 1920 CA VAL A 134 22.891 18.296 15.952 1.00 14.23 C ATOM 1921 C VAL A 134 23.932 19.312 15.482 1.00 75.02 C ATOM 1922 O VAL A 134 23.627 20.223 14.707 1.00 44.45 O ATOM 1923 CB VAL A 134 22.493 17.379 14.770 1.00 13.33 C ATOM 1924 CG1 VAL A 134 23.713 16.635 14.243 1.00 2.32 C ATOM 1925 CG2 VAL A 134 21.402 16.394 15.186 1.00 40.12 C ATOM 0 H VAL A 134 21.306 19.654 15.889 1.00 55.21 H new ATOM 0 HA VAL A 134 23.315 17.670 16.737 1.00 14.23 H new ATOM 0 HB VAL A 134 22.095 18.005 13.972 1.00 13.33 H new ATOM 0 HG11 VAL A 134 23.418 15.994 13.412 1.00 2.32 H new ATOM 0 HG12 VAL A 134 24.457 17.354 13.900 1.00 2.32 H new ATOM 0 HG13 VAL A 134 24.138 16.024 15.039 1.00 2.32 H new ATOM 0 HG21 VAL A 134 21.140 15.761 14.338 1.00 40.12 H new ATOM 0 HG22 VAL A 134 21.766 15.772 16.004 1.00 40.12 H new ATOM 0 HG23 VAL A 134 20.520 16.945 15.514 1.00 40.12 H new ATOM 1935 N ARG A 135 25.146 19.155 15.983 1.00 5.32 N ATOM 1936 CA ARG A 135 26.271 20.013 15.651 1.00 35.41 C ATOM 1937 C ARG A 135 27.164 19.318 14.618 1.00 62.34 C ATOM 1938 O ARG A 135 27.682 18.226 14.867 1.00 24.24 O ATOM 1939 CB ARG A 135 27.054 20.310 16.936 1.00 72.41 C ATOM 1940 CG ARG A 135 28.154 21.350 16.790 1.00 24.53 C ATOM 1941 CD ARG A 135 28.799 21.651 18.138 1.00 72.30 C ATOM 1942 NE ARG A 135 29.751 22.758 18.063 1.00 54.11 N ATOM 1943 CZ ARG A 135 29.661 23.873 18.787 1.00 2.05 C ATOM 1944 NH1 ARG A 135 28.654 24.047 19.639 1.00 12.22 N1+ ATOM 1945 NH2 ARG A 135 30.586 24.812 18.661 1.00 32.21 N ATOM 0 H ARG A 135 25.381 18.414 16.644 1.00 5.32 H new ATOM 0 HA ARG A 135 25.919 20.950 15.219 1.00 35.41 H new ATOM 0 HB2 ARG A 135 26.354 20.647 17.701 1.00 72.41 H new ATOM 0 HB3 ARG A 135 27.497 19.382 17.297 1.00 72.41 H new ATOM 0 HG2 ARG A 135 28.910 20.990 16.093 1.00 24.53 H new ATOM 0 HG3 ARG A 135 27.741 22.266 16.367 1.00 24.53 H new ATOM 0 HD2 ARG A 135 28.022 21.891 18.864 1.00 72.30 H new ATOM 0 HD3 ARG A 135 29.310 20.759 18.501 1.00 72.30 H new ATOM 0 HE ARG A 135 30.534 22.671 17.415 1.00 54.11 H new ATOM 0 HH11 ARG A 135 27.942 23.323 19.742 1.00 12.22 H new ATOM 0 HH12 ARG A 135 28.594 24.904 20.189 1.00 12.22 H new ATOM 0 HH21 ARG A 135 31.362 24.680 18.012 1.00 32.21 H new ATOM 0 HH22 ARG A 135 30.523 25.668 19.212 1.00 32.21 H new ATOM 1959 N LEU A 136 27.321 19.940 13.454 1.00 14.32 N ATOM 1960 CA LEU A 136 28.123 19.371 12.376 1.00 2.32 C ATOM 1961 C LEU A 136 29.573 19.840 12.458 1.00 50.04 C ATOM 1962 O LEU A 136 29.861 21.036 12.389 1.00 1.31 O ATOM 1963 CB LEU A 136 27.514 19.730 11.011 1.00 33.50 C ATOM 1964 CG LEU A 136 26.278 18.903 10.616 1.00 40.54 C ATOM 1965 CD1 LEU A 136 25.664 19.420 9.317 1.00 3.54 C ATOM 1966 CD2 LEU A 136 26.652 17.428 10.483 1.00 32.41 C ATOM 0 H LEU A 136 26.901 20.843 13.232 1.00 14.32 H new ATOM 0 HA LEU A 136 28.118 18.287 12.487 1.00 2.32 H new ATOM 0 HB2 LEU A 136 27.240 20.785 11.018 1.00 33.50 H new ATOM 0 HB3 LEU A 136 28.278 19.604 10.244 1.00 33.50 H new ATOM 0 HG LEU A 136 25.531 19.007 11.403 1.00 40.54 H new ATOM 0 HD11 LEU A 136 24.792 18.817 9.061 1.00 3.54 H new ATOM 0 HD12 LEU A 136 25.362 20.459 9.446 1.00 3.54 H new ATOM 0 HD13 LEU A 136 26.399 19.353 8.515 1.00 3.54 H new ATOM 0 HD21 LEU A 136 25.769 16.853 10.203 1.00 32.41 H new ATOM 0 HD22 LEU A 136 27.418 17.315 9.715 1.00 32.41 H new ATOM 0 HD23 LEU A 136 27.036 17.063 11.435 1.00 32.41 H new ATOM 1978 N VAL A 137 30.476 18.881 12.608 1.00 24.14 N ATOM 1979 CA VAL A 137 31.906 19.147 12.674 1.00 11.21 C ATOM 1980 C VAL A 137 32.642 18.292 11.642 1.00 22.22 C ATOM 1981 O VAL A 137 32.638 17.064 11.714 1.00 60.11 O ATOM 1982 CB VAL A 137 32.465 18.892 14.107 1.00 74.42 C ATOM 1983 CG1 VAL A 137 31.735 17.730 14.778 1.00 2.12 C ATOM 1984 CG2 VAL A 137 33.975 18.633 14.084 1.00 51.44 C ATOM 0 H VAL A 137 30.236 17.893 12.688 1.00 24.14 H new ATOM 0 HA VAL A 137 32.071 20.199 12.443 1.00 11.21 H new ATOM 0 HB VAL A 137 32.289 19.796 14.691 1.00 74.42 H new ATOM 0 HG11 VAL A 137 32.143 17.572 15.776 1.00 2.12 H new ATOM 0 HG12 VAL A 137 30.673 17.962 14.853 1.00 2.12 H new ATOM 0 HG13 VAL A 137 31.868 16.826 14.184 1.00 2.12 H new ATOM 0 HG21 VAL A 137 34.330 18.459 15.100 1.00 51.44 H new ATOM 0 HG22 VAL A 137 34.184 17.756 13.472 1.00 51.44 H new ATOM 0 HG23 VAL A 137 34.486 19.499 13.664 1.00 51.44 H new ATOM 1994 N VAL A 138 33.251 18.949 10.664 1.00 43.23 N ATOM 1995 CA VAL A 138 33.974 18.251 9.608 1.00 53.11 C ATOM 1996 C VAL A 138 35.445 18.098 9.993 1.00 13.33 C ATOM 1997 O VAL A 138 36.050 19.005 10.580 1.00 44.02 O ATOM 1998 CB VAL A 138 33.857 18.952 8.230 1.00 15.42 C ATOM 1999 CG1 VAL A 138 32.420 19.392 7.964 1.00 20.25 C ATOM 2000 CG2 VAL A 138 34.823 20.121 8.122 1.00 13.44 C ATOM 0 H VAL A 138 33.259 19.965 10.579 1.00 43.23 H new ATOM 0 HA VAL A 138 33.512 17.269 9.505 1.00 53.11 H new ATOM 0 HB VAL A 138 34.132 18.230 7.462 1.00 15.42 H new ATOM 0 HG11 VAL A 138 32.363 19.881 6.992 1.00 20.25 H new ATOM 0 HG12 VAL A 138 31.765 18.520 7.970 1.00 20.25 H new ATOM 0 HG13 VAL A 138 32.103 20.089 8.740 1.00 20.25 H new ATOM 0 HG21 VAL A 138 34.717 20.592 7.145 1.00 13.44 H new ATOM 0 HG22 VAL A 138 34.601 20.850 8.902 1.00 13.44 H new ATOM 0 HG23 VAL A 138 35.845 19.761 8.242 1.00 13.44 H new ATOM 2010 N ALA A 139 35.993 16.933 9.706 1.00 53.03 N ATOM 2011 CA ALA A 139 37.369 16.602 10.067 1.00 12.31 C ATOM 2012 C ALA A 139 38.145 16.112 8.848 1.00 73.13 C ATOM 2013 O ALA A 139 37.554 15.619 7.882 1.00 43.50 O ATOM 2014 CB ALA A 139 37.387 15.551 11.170 1.00 22.50 C ATOM 0 H ALA A 139 35.502 16.185 9.216 1.00 53.03 H new ATOM 0 HA ALA A 139 37.854 17.505 10.438 1.00 12.31 H new ATOM 0 HB1 ALA A 139 38.419 15.313 11.429 1.00 22.50 H new ATOM 0 HB2 ALA A 139 36.871 15.937 12.049 1.00 22.50 H new ATOM 0 HB3 ALA A 139 36.884 14.649 10.821 1.00 22.50 H new TER 2020 ALA A 139 ATOM 2021 N MET B 1 26.867 23.545 25.410 1.00 72.34 N ATOM 2022 CA MET B 1 26.151 23.876 26.638 1.00 63.32 C ATOM 2023 C MET B 1 26.638 23.017 27.807 1.00 71.35 C ATOM 2024 O MET B 1 27.586 22.240 27.665 1.00 2.40 O ATOM 2025 CB MET B 1 24.647 23.681 26.455 1.00 41.04 C ATOM 2026 CG MET B 1 24.255 22.238 26.242 1.00 5.33 C ATOM 2027 SD MET B 1 22.469 21.994 26.261 1.00 24.33 S ATOM 2028 CE MET B 1 22.384 20.220 26.455 1.00 72.42 C ATOM 0 H1 MET B 1 27.406 24.374 25.088 1.00 72.34 H new ATOM 0 H2 MET B 1 27.520 22.756 25.591 1.00 72.34 H new ATOM 0 H3 MET B 1 26.186 23.268 24.675 1.00 72.34 H new ATOM 0 HA MET B 1 26.352 24.923 26.864 1.00 63.32 H new ATOM 0 HB2 MET B 1 24.128 24.066 27.333 1.00 41.04 H new ATOM 0 HB3 MET B 1 24.312 24.271 25.602 1.00 41.04 H new ATOM 0 HG2 MET B 1 24.655 21.894 25.288 1.00 5.33 H new ATOM 0 HG3 MET B 1 24.710 21.623 27.019 1.00 5.33 H new ATOM 0 HE1 MET B 1 21.379 19.936 26.767 1.00 72.42 H new ATOM 0 HE2 MET B 1 22.619 19.739 25.506 1.00 72.42 H new ATOM 0 HE3 MET B 1 23.102 19.902 27.211 1.00 72.42 H new ATOM 2038 N ASN B 2 25.974 23.152 28.956 1.00 33.33 N ATOM 2039 CA ASN B 2 26.319 22.377 30.148 1.00 51.30 C ATOM 2040 C ASN B 2 25.785 20.948 30.037 1.00 60.31 C ATOM 2041 O ASN B 2 24.773 20.588 30.643 1.00 61.35 O ATOM 2042 CB ASN B 2 25.771 23.058 31.410 1.00 21.53 C ATOM 2043 CG ASN B 2 26.101 22.298 32.688 1.00 32.42 C ATOM 2044 OD1 ASN B 2 27.144 21.647 32.793 1.00 51.33 O ATOM 2045 ND2 ASN B 2 25.214 22.379 33.668 1.00 42.33 N ATOM 0 H ASN B 2 25.192 23.793 29.086 1.00 33.33 H new ATOM 0 HA ASN B 2 27.405 22.332 30.223 1.00 51.30 H new ATOM 0 HB2 ASN B 2 26.179 24.066 31.478 1.00 21.53 H new ATOM 0 HB3 ASN B 2 24.689 23.157 31.322 1.00 21.53 H new ATOM 0 HD21 ASN B 2 25.381 21.893 34.549 1.00 42.33 H new ATOM 0 HD22 ASN B 2 24.363 22.928 33.542 1.00 42.33 H new ATOM 2052 N ILE B 3 26.446 20.160 29.204 1.00 21.23 N ATOM 2053 CA ILE B 3 26.135 18.747 29.054 1.00 72.42 C ATOM 2054 C ILE B 3 26.408 17.986 30.349 1.00 64.03 C ATOM 2055 O ILE B 3 27.496 18.081 30.923 1.00 40.30 O ATOM 2056 CB ILE B 3 26.963 18.120 27.905 1.00 60.30 C ATOM 2057 CG1 ILE B 3 26.641 18.817 26.574 1.00 50.54 C ATOM 2058 CG2 ILE B 3 26.696 16.621 27.803 1.00 62.10 C ATOM 2059 CD1 ILE B 3 25.244 18.538 26.073 1.00 13.01 C ATOM 0 H ILE B 3 27.213 20.481 28.613 1.00 21.23 H new ATOM 0 HA ILE B 3 25.075 18.669 28.814 1.00 72.42 H new ATOM 0 HB ILE B 3 28.021 18.263 28.125 1.00 60.30 H new ATOM 0 HG12 ILE B 3 26.767 19.893 26.696 1.00 50.54 H new ATOM 0 HG13 ILE B 3 27.360 18.495 25.821 1.00 50.54 H new ATOM 0 HG21 ILE B 3 27.288 16.201 26.990 1.00 62.10 H new ATOM 0 HG22 ILE B 3 26.972 16.138 28.740 1.00 62.10 H new ATOM 0 HG23 ILE B 3 25.637 16.453 27.606 1.00 62.10 H new ATOM 0 HD11 ILE B 3 25.084 19.061 25.130 1.00 13.01 H new ATOM 0 HD12 ILE B 3 25.120 17.466 25.919 1.00 13.01 H new ATOM 0 HD13 ILE B 3 24.518 18.885 26.808 1.00 13.01 H new ATOM 2071 N LEU B 4 25.413 17.233 30.797 1.00 23.11 N ATOM 2072 CA LEU B 4 25.539 16.409 31.994 1.00 23.43 C ATOM 2073 C LEU B 4 26.248 15.101 31.662 1.00 41.14 C ATOM 2074 O LEU B 4 27.120 14.649 32.405 1.00 62.34 O ATOM 2075 CB LEU B 4 24.157 16.113 32.593 1.00 50.44 C ATOM 2076 CG LEU B 4 23.350 17.345 33.029 1.00 31.23 C ATOM 2077 CD1 LEU B 4 21.973 16.928 33.548 1.00 75.25 C ATOM 2078 CD2 LEU B 4 24.112 18.146 34.085 1.00 11.04 C ATOM 0 H LEU B 4 24.500 17.175 30.345 1.00 23.11 H new ATOM 0 HA LEU B 4 26.129 16.959 32.727 1.00 23.43 H new ATOM 0 HB2 LEU B 4 23.573 15.558 31.859 1.00 50.44 H new ATOM 0 HB3 LEU B 4 24.286 15.460 33.456 1.00 50.44 H new ATOM 0 HG LEU B 4 23.206 17.987 32.160 1.00 31.23 H new ATOM 0 HD11 LEU B 4 21.415 17.814 33.852 1.00 75.25 H new ATOM 0 HD12 LEU B 4 21.428 16.410 32.759 1.00 75.25 H new ATOM 0 HD13 LEU B 4 22.093 16.263 34.403 1.00 75.25 H new ATOM 0 HD21 LEU B 4 23.522 19.014 34.379 1.00 11.04 H new ATOM 0 HD22 LEU B 4 24.293 17.518 34.957 1.00 11.04 H new ATOM 0 HD23 LEU B 4 25.065 18.478 33.672 1.00 11.04 H new ATOM 2090 N TYR B 5 25.866 14.491 30.539 1.00 23.42 N ATOM 2091 CA TYR B 5 26.471 13.222 30.118 1.00 44.15 C ATOM 2092 C TYR B 5 26.678 13.201 28.608 1.00 24.15 C ATOM 2093 O TYR B 5 25.759 13.489 27.856 1.00 75.34 O ATOM 2094 CB TYR B 5 25.576 12.046 30.551 1.00 21.21 C ATOM 2095 CG TYR B 5 26.097 10.670 30.157 1.00 10.12 C ATOM 2096 CD1 TYR B 5 25.961 10.200 28.852 1.00 52.12 C ATOM 2097 CD2 TYR B 5 26.720 9.837 31.088 1.00 71.12 C ATOM 2098 CE1 TYR B 5 26.431 8.957 28.485 1.00 75.45 C ATOM 2099 CE2 TYR B 5 27.191 8.593 30.719 1.00 10.31 C ATOM 2100 CZ TYR B 5 27.047 8.158 29.421 1.00 52.51 C ATOM 2101 OH TYR B 5 27.519 6.914 29.057 1.00 25.44 O ATOM 0 H TYR B 5 25.148 14.849 29.909 1.00 23.42 H new ATOM 0 HA TYR B 5 27.445 13.123 30.598 1.00 44.15 H new ATOM 0 HB2 TYR B 5 25.457 12.078 31.634 1.00 21.21 H new ATOM 0 HB3 TYR B 5 24.585 12.182 30.117 1.00 21.21 H new ATOM 0 HD1 TYR B 5 25.478 10.822 28.113 1.00 52.12 H new ATOM 0 HD2 TYR B 5 26.835 10.170 32.109 1.00 71.12 H new ATOM 0 HE1 TYR B 5 26.316 8.612 27.468 1.00 75.45 H new ATOM 0 HE2 TYR B 5 27.673 7.960 31.450 1.00 10.31 H new ATOM 0 HH TYR B 5 27.927 6.479 29.834 1.00 25.44 H new ATOM 2111 N LYS B 6 27.885 12.855 28.166 1.00 30.03 N ATOM 2112 CA LYS B 6 28.188 12.750 26.739 1.00 63.12 C ATOM 2113 C LYS B 6 29.040 11.515 26.451 1.00 12.41 C ATOM 2114 O LYS B 6 29.991 11.219 27.177 1.00 54.02 O ATOM 2115 CB LYS B 6 28.894 14.026 26.242 1.00 22.40 C ATOM 2116 CG LYS B 6 29.376 13.953 24.791 1.00 43.31 C ATOM 2117 CD LYS B 6 29.671 15.336 24.201 1.00 65.01 C ATOM 2118 CE LYS B 6 28.390 16.121 23.913 1.00 23.11 C ATOM 2119 NZ LYS B 6 28.660 17.409 23.218 1.00 52.41 N1+ ATOM 0 H LYS B 6 28.673 12.642 28.778 1.00 30.03 H new ATOM 0 HA LYS B 6 27.247 12.643 26.199 1.00 63.12 H new ATOM 0 HB2 LYS B 6 28.210 14.869 26.344 1.00 22.40 H new ATOM 0 HB3 LYS B 6 29.749 14.229 26.887 1.00 22.40 H new ATOM 0 HG2 LYS B 6 30.276 13.341 24.741 1.00 43.31 H new ATOM 0 HG3 LYS B 6 28.619 13.457 24.184 1.00 43.31 H new ATOM 0 HD2 LYS B 6 30.294 15.901 24.895 1.00 65.01 H new ATOM 0 HD3 LYS B 6 30.242 15.223 23.279 1.00 65.01 H new ATOM 0 HE2 LYS B 6 27.724 15.513 23.301 1.00 23.11 H new ATOM 0 HE3 LYS B 6 27.869 16.319 24.850 1.00 23.11 H new ATOM 0 HZ1 LYS B 6 27.771 17.790 22.835 1.00 52.41 H new ATOM 0 HZ2 LYS B 6 29.066 18.089 23.892 1.00 52.41 H new ATOM 0 HZ3 LYS B 6 29.332 17.250 22.440 1.00 52.41 H new ATOM 2133 N THR B 7 28.680 10.795 25.391 1.00 10.14 N ATOM 2134 CA THR B 7 29.411 9.610 24.960 1.00 42.05 C ATOM 2135 C THR B 7 29.762 9.726 23.477 1.00 63.52 C ATOM 2136 O THR B 7 29.001 10.307 22.694 1.00 72.52 O ATOM 2137 CB THR B 7 28.597 8.310 25.206 1.00 0.35 C ATOM 2138 OG1 THR B 7 29.356 7.171 24.786 1.00 0.11 O ATOM 2139 CG2 THR B 7 27.256 8.324 24.468 1.00 24.11 C ATOM 0 H THR B 7 27.873 11.018 24.808 1.00 10.14 H new ATOM 0 HA THR B 7 30.324 9.550 25.552 1.00 42.05 H new ATOM 0 HB THR B 7 28.393 8.252 26.275 1.00 0.35 H new ATOM 0 HG1 THR B 7 29.510 6.580 25.552 1.00 0.11 H new ATOM 0 HG21 THR B 7 26.721 7.396 24.669 1.00 24.11 H new ATOM 0 HG22 THR B 7 26.660 9.169 24.813 1.00 24.11 H new ATOM 0 HG23 THR B 7 27.431 8.417 23.396 1.00 24.11 H new ATOM 2147 N ALA B 8 30.921 9.192 23.101 1.00 4.15 N ATOM 2148 CA ALA B 8 31.385 9.237 21.719 1.00 51.31 C ATOM 2149 C ALA B 8 31.355 7.846 21.098 1.00 33.43 C ATOM 2150 O ALA B 8 31.788 6.870 21.718 1.00 64.22 O ATOM 2151 CB ALA B 8 32.795 9.814 21.649 1.00 24.44 C ATOM 0 H ALA B 8 31.560 8.720 23.741 1.00 4.15 H new ATOM 0 HA ALA B 8 30.714 9.884 21.154 1.00 51.31 H new ATOM 0 HB1 ALA B 8 33.126 9.841 20.611 1.00 24.44 H new ATOM 0 HB2 ALA B 8 32.795 10.825 22.056 1.00 24.44 H new ATOM 0 HB3 ALA B 8 33.473 9.189 22.230 1.00 24.44 H new ATOM 2157 N ALA B 9 30.843 7.756 19.878 1.00 21.22 N ATOM 2158 CA ALA B 9 30.811 6.500 19.142 1.00 20.22 C ATOM 2159 C ALA B 9 31.470 6.678 17.779 1.00 31.45 C ATOM 2160 O ALA B 9 31.142 7.603 17.036 1.00 1.21 O ATOM 2161 CB ALA B 9 29.375 6.000 18.996 1.00 3.15 C ATOM 0 H ALA B 9 30.441 8.546 19.374 1.00 21.22 H new ATOM 0 HA ALA B 9 31.371 5.749 19.700 1.00 20.22 H new ATOM 0 HB1 ALA B 9 29.371 5.061 18.443 1.00 3.15 H new ATOM 0 HB2 ALA B 9 28.943 5.842 19.984 1.00 3.15 H new ATOM 0 HB3 ALA B 9 28.785 6.741 18.456 1.00 3.15 H new ATOM 2167 N THR B 10 32.408 5.798 17.463 1.00 33.23 N ATOM 2168 CA THR B 10 33.144 5.868 16.214 1.00 64.31 C ATOM 2169 C THR B 10 32.583 4.860 15.217 1.00 63.33 C ATOM 2170 O THR B 10 32.451 3.671 15.517 1.00 30.04 O ATOM 2171 CB THR B 10 34.660 5.620 16.435 1.00 62.43 C ATOM 2172 OG1 THR B 10 35.357 5.626 15.179 1.00 21.44 O ATOM 2173 CG2 THR B 10 34.920 4.301 17.160 1.00 23.24 C ATOM 0 H THR B 10 32.678 5.019 18.064 1.00 33.23 H new ATOM 0 HA THR B 10 33.026 6.874 15.810 1.00 64.31 H new ATOM 0 HB THR B 10 35.032 6.430 17.063 1.00 62.43 H new ATOM 0 HG1 THR B 10 36.312 5.470 15.334 1.00 21.44 H new ATOM 0 HG21 THR B 10 35.993 4.165 17.295 1.00 23.24 H new ATOM 0 HG22 THR B 10 34.431 4.319 18.134 1.00 23.24 H new ATOM 0 HG23 THR B 10 34.522 3.476 16.569 1.00 23.24 H new ATOM 2181 N SER B 11 32.225 5.351 14.045 1.00 64.42 N ATOM 2182 CA SER B 11 31.729 4.516 12.969 1.00 20.54 C ATOM 2183 C SER B 11 32.684 4.585 11.779 1.00 44.42 C ATOM 2184 O SER B 11 32.856 5.634 11.154 1.00 74.01 O ATOM 2185 CB SER B 11 30.310 4.956 12.589 1.00 74.14 C ATOM 2186 OG SER B 11 30.235 6.357 12.400 1.00 11.25 O ATOM 0 H SER B 11 32.271 6.343 13.813 1.00 64.42 H new ATOM 0 HA SER B 11 31.681 3.477 13.295 1.00 20.54 H new ATOM 0 HB2 SER B 11 30.003 4.447 11.675 1.00 74.14 H new ATOM 0 HB3 SER B 11 29.613 4.655 13.371 1.00 74.14 H new ATOM 0 HG SER B 11 31.089 6.767 12.650 1.00 11.25 H new ATOM 2192 N THR B 12 33.328 3.464 11.491 1.00 44.31 N ATOM 2193 CA THR B 12 34.342 3.393 10.450 1.00 14.13 C ATOM 2194 C THR B 12 33.787 2.741 9.180 1.00 53.42 C ATOM 2195 O THR B 12 32.756 2.062 9.214 1.00 32.44 O ATOM 2196 CB THR B 12 35.546 2.564 10.953 1.00 2.30 C ATOM 2197 OG1 THR B 12 35.817 2.887 12.326 1.00 14.42 O ATOM 2198 CG2 THR B 12 36.792 2.833 10.119 1.00 31.31 C ATOM 0 H THR B 12 33.163 2.579 11.971 1.00 44.31 H new ATOM 0 HA THR B 12 34.654 4.410 10.214 1.00 14.13 H new ATOM 0 HB THR B 12 35.290 1.509 10.860 1.00 2.30 H new ATOM 0 HG1 THR B 12 36.579 2.359 12.642 1.00 14.42 H new ATOM 0 HG21 THR B 12 37.620 2.235 10.499 1.00 31.31 H new ATOM 0 HG22 THR B 12 36.599 2.567 9.080 1.00 31.31 H new ATOM 0 HG23 THR B 12 37.050 3.890 10.181 1.00 31.31 H new ATOM 2206 N GLY B 13 34.476 2.960 8.064 1.00 25.11 N ATOM 2207 CA GLY B 13 34.146 2.275 6.831 1.00 71.12 C ATOM 2208 C GLY B 13 34.626 0.834 6.845 1.00 70.11 C ATOM 2209 O GLY B 13 35.655 0.508 6.249 1.00 42.34 O ATOM 0 H GLY B 13 35.263 3.605 7.994 1.00 25.11 H new ATOM 0 HA2 GLY B 13 33.067 2.298 6.679 1.00 71.12 H new ATOM 0 HA3 GLY B 13 34.598 2.801 5.990 1.00 71.12 H new ATOM 2213 N GLY B 14 33.909 -0.015 7.583 1.00 21.54 N ATOM 2214 CA GLY B 14 34.200 -1.445 7.602 1.00 31.21 C ATOM 2215 C GLY B 14 33.853 -2.128 6.286 1.00 73.40 C ATOM 2216 O GLY B 14 34.283 -1.687 5.220 1.00 13.01 O ATOM 0 H GLY B 14 33.125 0.264 8.173 1.00 21.54 H new ATOM 0 HA2 GLY B 14 35.258 -1.594 7.817 1.00 31.21 H new ATOM 0 HA3 GLY B 14 33.641 -1.916 8.411 1.00 31.21 H new ATOM 2220 N ARG B 15 33.086 -3.221 6.353 1.00 12.42 N ATOM 2221 CA ARG B 15 32.637 -3.905 5.138 1.00 62.32 C ATOM 2222 C ARG B 15 31.727 -2.981 4.333 1.00 53.41 C ATOM 2223 O ARG B 15 31.975 -2.726 3.153 1.00 34.04 O ATOM 2224 CB ARG B 15 31.897 -5.205 5.501 1.00 22.32 C ATOM 2225 CG ARG B 15 31.272 -5.950 4.315 1.00 23.03 C ATOM 2226 CD ARG B 15 32.306 -6.435 3.293 1.00 52.22 C ATOM 2227 NE ARG B 15 32.742 -5.374 2.375 1.00 65.14 N ATOM 2228 CZ ARG B 15 32.924 -5.542 1.062 1.00 55.23 C ATOM 2229 NH1 ARG B 15 32.697 -6.724 0.498 1.00 21.14 N1+ ATOM 2230 NH2 ARG B 15 33.332 -4.526 0.313 1.00 51.30 N ATOM 0 H ARG B 15 32.767 -3.646 7.224 1.00 12.42 H new ATOM 0 HA ARG B 15 33.506 -4.162 4.532 1.00 62.32 H new ATOM 0 HB2 ARG B 15 32.595 -5.874 6.003 1.00 22.32 H new ATOM 0 HB3 ARG B 15 31.110 -4.969 6.217 1.00 22.32 H new ATOM 0 HG2 ARG B 15 30.710 -6.806 4.688 1.00 23.03 H new ATOM 0 HG3 ARG B 15 30.559 -5.293 3.817 1.00 23.03 H new ATOM 0 HD2 ARG B 15 33.173 -6.831 3.821 1.00 52.22 H new ATOM 0 HD3 ARG B 15 31.882 -7.256 2.716 1.00 52.22 H new ATOM 0 HE ARG B 15 32.917 -4.448 2.766 1.00 65.14 H new ATOM 0 HH11 ARG B 15 32.382 -7.509 1.068 1.00 21.14 H new ATOM 0 HH12 ARG B 15 32.838 -6.846 -0.505 1.00 21.14 H new ATOM 0 HH21 ARG B 15 33.507 -3.616 0.739 1.00 51.30 H new ATOM 0 HH22 ARG B 15 33.471 -4.655 -0.689 1.00 51.30 H new ATOM 2244 N ASP B 16 30.681 -2.489 4.984 1.00 43.23 N ATOM 2245 CA ASP B 16 29.844 -1.432 4.419 1.00 64.45 C ATOM 2246 C ASP B 16 29.753 -0.289 5.421 1.00 45.23 C ATOM 2247 O ASP B 16 29.872 0.883 5.065 1.00 44.01 O ATOM 2248 CB ASP B 16 28.452 -1.979 4.098 1.00 65.33 C ATOM 2249 CG ASP B 16 27.541 -0.956 3.425 1.00 54.31 C ATOM 2250 OD1 ASP B 16 26.539 -0.539 4.049 1.00 24.34 O ATOM 2251 OD2 ASP B 16 27.816 -0.586 2.263 1.00 12.23 O1- ATOM 0 H ASP B 16 30.389 -2.805 5.909 1.00 43.23 H new ATOM 0 HA ASP B 16 30.285 -1.065 3.492 1.00 64.45 H new ATOM 0 HB2 ASP B 16 28.552 -2.849 3.449 1.00 65.33 H new ATOM 0 HB3 ASP B 16 27.983 -2.322 5.020 1.00 65.33 H new ATOM 2256 N GLY B 17 29.583 -0.653 6.694 1.00 22.41 N ATOM 2257 CA GLY B 17 29.699 0.312 7.767 1.00 74.22 C ATOM 2258 C GLY B 17 30.064 -0.353 9.080 1.00 32.04 C ATOM 2259 O GLY B 17 29.771 -1.528 9.288 1.00 11.23 O ATOM 0 H GLY B 17 29.367 -1.603 6.996 1.00 22.41 H new ATOM 0 HA2 GLY B 17 30.457 1.052 7.511 1.00 74.22 H new ATOM 0 HA3 GLY B 17 28.756 0.847 7.879 1.00 74.22 H new ATOM 2263 N ARG B 18 30.719 0.394 9.955 1.00 41.41 N ATOM 2264 CA ARG B 18 31.084 -0.083 11.288 1.00 45.30 C ATOM 2265 C ARG B 18 30.483 0.855 12.325 1.00 1.35 C ATOM 2266 O ARG B 18 30.367 2.048 12.075 1.00 0.54 O ATOM 2267 CB ARG B 18 32.620 -0.118 11.440 1.00 74.40 C ATOM 2268 CG ARG B 18 33.120 -0.319 12.876 1.00 53.04 C ATOM 2269 CD ARG B 18 33.145 -1.786 13.297 1.00 43.11 C ATOM 2270 NE ARG B 18 34.179 -2.545 12.587 1.00 64.22 N ATOM 2271 CZ ARG B 18 34.953 -3.476 13.157 1.00 63.34 C ATOM 2272 NH1 ARG B 18 34.876 -3.716 14.464 1.00 23.22 N1+ ATOM 2273 NH2 ARG B 18 35.825 -4.153 12.420 1.00 54.01 N ATOM 0 H ARG B 18 31.015 1.351 9.764 1.00 41.41 H new ATOM 0 HA ARG B 18 30.699 -1.093 11.433 1.00 45.30 H new ATOM 0 HB2 ARG B 18 33.014 -0.921 10.817 1.00 74.40 H new ATOM 0 HB3 ARG B 18 33.031 0.815 11.055 1.00 74.40 H new ATOM 0 HG2 ARG B 18 34.123 0.097 12.967 1.00 53.04 H new ATOM 0 HG3 ARG B 18 32.480 0.239 13.560 1.00 53.04 H new ATOM 0 HD2 ARG B 18 33.320 -1.852 14.371 1.00 43.11 H new ATOM 0 HD3 ARG B 18 32.170 -2.235 13.105 1.00 43.11 H new ATOM 0 HE ARG B 18 34.317 -2.351 11.595 1.00 64.22 H new ATOM 0 HH11 ARG B 18 34.222 -3.188 15.042 1.00 23.22 H new ATOM 0 HH12 ARG B 18 35.471 -4.428 14.888 1.00 23.22 H new ATOM 0 HH21 ARG B 18 35.904 -3.963 11.421 1.00 54.01 H new ATOM 0 HH22 ARG B 18 36.416 -4.863 12.853 1.00 54.01 H new ATOM 2287 N ALA B 19 30.080 0.316 13.467 1.00 25.44 N ATOM 2288 CA ALA B 19 29.642 1.134 14.589 1.00 25.14 C ATOM 2289 C ALA B 19 30.285 0.622 15.872 1.00 64.21 C ATOM 2290 O ALA B 19 30.127 -0.544 16.235 1.00 14.23 O ATOM 2291 CB ALA B 19 28.120 1.120 14.696 1.00 63.23 C ATOM 0 H ALA B 19 30.047 -0.688 13.641 1.00 25.44 H new ATOM 0 HA ALA B 19 29.954 2.166 14.428 1.00 25.14 H new ATOM 0 HB1 ALA B 19 27.809 1.736 15.540 1.00 63.23 H new ATOM 0 HB2 ALA B 19 27.687 1.517 13.778 1.00 63.23 H new ATOM 0 HB3 ALA B 19 27.775 0.097 14.847 1.00 63.23 H new ATOM 2297 N THR B 20 30.994 1.504 16.555 1.00 63.15 N ATOM 2298 CA THR B 20 31.713 1.152 17.773 1.00 31.24 C ATOM 2299 C THR B 20 31.595 2.275 18.795 1.00 2.34 C ATOM 2300 O THR B 20 32.129 3.364 18.597 1.00 75.11 O ATOM 2301 CB THR B 20 33.210 0.886 17.459 1.00 15.15 C ATOM 2302 OG1 THR B 20 33.322 -0.101 16.419 1.00 53.32 O ATOM 2303 CG2 THR B 20 33.974 0.415 18.695 1.00 14.05 C ATOM 0 H THR B 20 31.089 2.483 16.284 1.00 63.15 H new ATOM 0 HA THR B 20 31.271 0.245 18.185 1.00 31.24 H new ATOM 0 HB THR B 20 33.651 1.827 17.130 1.00 15.15 H new ATOM 0 HG1 THR B 20 33.615 -0.952 16.806 1.00 53.32 H new ATOM 0 HG21 THR B 20 35.017 0.240 18.433 1.00 14.05 H new ATOM 0 HG22 THR B 20 33.918 1.179 19.470 1.00 14.05 H new ATOM 0 HG23 THR B 20 33.533 -0.510 19.065 1.00 14.05 H new ATOM 2311 N SER B 21 30.886 2.012 19.884 1.00 21.31 N ATOM 2312 CA SER B 21 30.772 2.987 20.948 1.00 32.44 C ATOM 2313 C SER B 21 32.087 3.002 21.695 1.00 11.23 C ATOM 2314 O SER B 21 32.455 1.987 22.322 1.00 42.34 O ATOM 2315 CB SER B 21 29.616 2.674 21.893 1.00 31.41 C ATOM 2316 OG SER B 21 29.417 3.741 22.794 1.00 74.21 O ATOM 0 H SER B 21 30.387 1.138 20.049 1.00 21.31 H new ATOM 0 HA SER B 21 30.557 3.967 20.521 1.00 32.44 H new ATOM 0 HB2 SER B 21 28.706 2.499 21.319 1.00 31.41 H new ATOM 0 HB3 SER B 21 29.826 1.758 22.445 1.00 31.41 H new ATOM 0 HG SER B 21 29.886 3.552 23.634 1.00 74.21 H new ATOM 2322 N HIS B 22 32.757 4.163 21.612 1.00 5.04 N ATOM 2323 CA HIS B 22 34.169 4.333 21.960 1.00 32.51 C ATOM 2324 C HIS B 22 34.416 4.175 23.455 1.00 35.24 C ATOM 2325 O HIS B 22 35.558 4.015 23.881 1.00 73.12 O ATOM 2326 CB HIS B 22 34.650 5.709 21.466 1.00 3.43 C ATOM 2327 CG HIS B 22 36.116 5.984 21.664 1.00 12.52 C ATOM 2328 ND1 HIS B 22 37.095 5.511 20.818 1.00 31.42 N ATOM 2329 CD2 HIS B 22 36.759 6.729 22.595 1.00 34.34 C ATOM 2330 CE1 HIS B 22 38.271 5.955 21.218 1.00 23.12 C ATOM 2331 NE2 HIS B 22 38.098 6.697 22.293 1.00 12.42 N ATOM 0 H HIS B 22 32.318 5.027 21.293 1.00 5.04 H new ATOM 0 HA HIS B 22 34.740 3.546 21.467 1.00 32.51 H new ATOM 0 HB2 HIS B 22 34.420 5.797 20.404 1.00 3.43 H new ATOM 0 HB3 HIS B 22 34.079 6.482 21.980 1.00 3.43 H new ATOM 0 HD2 HIS B 22 36.302 7.252 23.422 1.00 34.34 H new ATOM 0 HE1 HIS B 22 39.218 5.745 20.743 1.00 23.12 H new ATOM 0 HE2 HIS B 22 38.836 7.169 22.814 1.00 12.42 H new ATOM 2340 N ASP B 23 33.348 4.179 24.248 1.00 44.12 N ATOM 2341 CA ASP B 23 33.468 3.877 25.677 1.00 0.24 C ATOM 2342 C ASP B 23 33.535 2.362 25.870 1.00 62.21 C ATOM 2343 O ASP B 23 33.432 1.847 26.983 1.00 40.03 O ATOM 2344 CB ASP B 23 32.312 4.494 26.489 1.00 12.04 C ATOM 2345 CG ASP B 23 30.922 4.154 25.974 1.00 5.31 C ATOM 2346 OD1 ASP B 23 29.968 4.872 26.346 1.00 63.54 O ATOM 2347 OD2 ASP B 23 30.772 3.184 25.198 1.00 33.23 O1- ATOM 0 H ASP B 23 32.400 4.385 23.934 1.00 44.12 H new ATOM 0 HA ASP B 23 34.387 4.326 26.053 1.00 0.24 H new ATOM 0 HB2 ASP B 23 32.393 4.160 27.523 1.00 12.04 H new ATOM 0 HB3 ASP B 23 32.428 5.578 26.494 1.00 12.04 H new ATOM 2352 N GLN B 24 33.722 1.680 24.739 1.00 3.35 N ATOM 2353 CA GLN B 24 34.010 0.249 24.675 1.00 64.10 C ATOM 2354 C GLN B 24 32.791 -0.571 25.026 1.00 11.02 C ATOM 2355 O GLN B 24 32.897 -1.747 25.390 1.00 0.33 O ATOM 2356 CB GLN B 24 35.194 -0.109 25.586 1.00 41.34 C ATOM 2357 CG GLN B 24 36.481 0.622 25.225 1.00 71.43 C ATOM 2358 CD GLN B 24 36.882 0.411 23.776 1.00 54.02 C ATOM 2359 OE1 GLN B 24 37.566 -0.556 23.439 1.00 54.01 O ATOM 2360 NE2 GLN B 24 36.481 1.331 22.912 1.00 4.32 N ATOM 0 H GLN B 24 33.676 2.120 23.820 1.00 3.35 H new ATOM 0 HA GLN B 24 34.286 0.009 23.648 1.00 64.10 H new ATOM 0 HB2 GLN B 24 34.931 0.123 26.618 1.00 41.34 H new ATOM 0 HB3 GLN B 24 35.369 -1.184 25.535 1.00 41.34 H new ATOM 0 HG2 GLN B 24 36.354 1.688 25.412 1.00 71.43 H new ATOM 0 HG3 GLN B 24 37.285 0.278 25.875 1.00 71.43 H new ATOM 0 HE21 GLN B 24 35.915 2.118 23.231 1.00 4.32 H new ATOM 0 HE22 GLN B 24 36.738 1.253 21.928 1.00 4.32 H new ATOM 2369 N LYS B 25 31.623 0.036 24.871 1.00 34.11 N ATOM 2370 CA LYS B 25 30.380 -0.661 25.129 1.00 33.22 C ATOM 2371 C LYS B 25 29.739 -1.165 23.838 1.00 40.01 C ATOM 2372 O LYS B 25 28.831 -1.997 23.897 1.00 34.42 O ATOM 2373 CB LYS B 25 29.404 0.223 25.915 1.00 20.21 C ATOM 2374 CG LYS B 25 29.920 0.620 27.301 1.00 22.43 C ATOM 2375 CD LYS B 25 28.839 1.290 28.146 1.00 41.25 C ATOM 2376 CE LYS B 25 28.236 2.498 27.441 1.00 25.52 C ATOM 2377 NZ LYS B 25 27.165 3.142 28.254 1.00 5.33 N1+ ATOM 0 H LYS B 25 31.514 1.004 24.569 1.00 34.11 H new ATOM 0 HA LYS B 25 30.617 -1.532 25.741 1.00 33.22 H new ATOM 0 HB2 LYS B 25 29.200 1.126 25.340 1.00 20.21 H new ATOM 0 HB3 LYS B 25 28.457 -0.305 26.026 1.00 20.21 H new ATOM 0 HG2 LYS B 25 30.287 -0.267 27.819 1.00 22.43 H new ATOM 0 HG3 LYS B 25 30.766 1.298 27.192 1.00 22.43 H new ATOM 0 HD2 LYS B 25 28.052 0.569 28.368 1.00 41.25 H new ATOM 0 HD3 LYS B 25 29.265 1.601 29.100 1.00 41.25 H new ATOM 0 HE2 LYS B 25 29.021 3.226 27.233 1.00 25.52 H new ATOM 0 HE3 LYS B 25 27.825 2.189 26.480 1.00 25.52 H new ATOM 0 HZ1 LYS B 25 26.493 3.623 27.623 1.00 5.33 H new ATOM 0 HZ2 LYS B 25 26.664 2.416 28.805 1.00 5.33 H new ATOM 0 HZ3 LYS B 25 27.590 3.836 28.901 1.00 5.33 H new ATOM 2391 N LEU B 26 30.193 -0.698 22.659 1.00 71.52 N ATOM 2392 CA LEU B 26 29.641 -1.238 21.416 1.00 40.15 C ATOM 2393 C LEU B 26 30.730 -1.411 20.369 1.00 62.33 C ATOM 2394 O LEU B 26 31.591 -0.552 20.233 1.00 50.50 O ATOM 2395 CB LEU B 26 28.528 -0.324 20.888 1.00 64.14 C ATOM 2396 CG LEU B 26 27.921 -0.731 19.539 1.00 70.42 C ATOM 2397 CD1 LEU B 26 27.207 -2.077 19.640 1.00 23.12 C ATOM 2398 CD2 LEU B 26 26.977 0.356 19.030 1.00 31.22 C ATOM 0 H LEU B 26 30.909 0.020 22.547 1.00 71.52 H new ATOM 0 HA LEU B 26 29.217 -2.220 21.627 1.00 40.15 H new ATOM 0 HB2 LEU B 26 27.730 -0.288 21.629 1.00 64.14 H new ATOM 0 HB3 LEU B 26 28.925 0.687 20.797 1.00 64.14 H new ATOM 0 HG LEU B 26 28.732 -0.843 18.820 1.00 70.42 H new ATOM 0 HD11 LEU B 26 26.787 -2.340 18.669 1.00 23.12 H new ATOM 0 HD12 LEU B 26 27.918 -2.844 19.947 1.00 23.12 H new ATOM 0 HD13 LEU B 26 26.406 -2.010 20.376 1.00 23.12 H new ATOM 0 HD21 LEU B 26 26.555 0.052 18.072 1.00 31.22 H new ATOM 0 HD22 LEU B 26 26.173 0.506 19.750 1.00 31.22 H new ATOM 0 HD23 LEU B 26 27.529 1.287 18.904 1.00 31.22 H new ATOM 2410 N ASP B 27 30.689 -2.531 19.650 1.00 22.45 N ATOM 2411 CA ASP B 27 31.614 -2.788 18.546 1.00 53.33 C ATOM 2412 C ASP B 27 31.034 -3.833 17.595 1.00 42.15 C ATOM 2413 O ASP B 27 31.162 -5.037 17.823 1.00 22.10 O ATOM 2414 CB ASP B 27 32.985 -3.248 19.067 1.00 24.13 C ATOM 2415 CG ASP B 27 33.930 -3.651 17.943 1.00 15.20 C ATOM 2416 OD1 ASP B 27 34.118 -2.853 16.995 1.00 3.40 O ATOM 2417 OD2 ASP B 27 34.507 -4.758 18.010 1.00 21.30 O1- ATOM 0 H ASP B 27 30.019 -3.282 19.814 1.00 22.45 H new ATOM 0 HA ASP B 27 31.753 -1.854 18.002 1.00 53.33 H new ATOM 0 HB2 ASP B 27 33.438 -2.444 19.648 1.00 24.13 H new ATOM 0 HB3 ASP B 27 32.849 -4.092 19.743 1.00 24.13 H new ATOM 2422 N VAL B 28 30.366 -3.355 16.551 1.00 42.42 N ATOM 2423 CA VAL B 28 29.779 -4.213 15.519 1.00 61.03 C ATOM 2424 C VAL B 28 29.827 -3.524 14.163 1.00 62.05 C ATOM 2425 O VAL B 28 30.269 -2.385 14.047 1.00 71.42 O ATOM 2426 CB VAL B 28 28.309 -4.606 15.826 1.00 35.33 C ATOM 2427 CG1 VAL B 28 28.247 -5.685 16.901 1.00 44.41 C ATOM 2428 CG2 VAL B 28 27.492 -3.377 16.229 1.00 74.12 C ATOM 0 H VAL B 28 30.214 -2.359 16.393 1.00 42.42 H new ATOM 0 HA VAL B 28 30.376 -5.125 15.506 1.00 61.03 H new ATOM 0 HB VAL B 28 27.870 -5.017 14.917 1.00 35.33 H new ATOM 0 HG11 VAL B 28 27.206 -5.943 17.098 1.00 44.41 H new ATOM 0 HG12 VAL B 28 28.782 -6.571 16.559 1.00 44.41 H new ATOM 0 HG13 VAL B 28 28.708 -5.314 17.816 1.00 44.41 H new ATOM 0 HG21 VAL B 28 26.465 -3.676 16.440 1.00 74.12 H new ATOM 0 HG22 VAL B 28 27.929 -2.926 17.120 1.00 74.12 H new ATOM 0 HG23 VAL B 28 27.499 -2.652 15.415 1.00 74.12 H new ATOM 2438 N LYS B 29 29.362 -4.225 13.143 1.00 64.31 N ATOM 2439 CA LYS B 29 29.377 -3.727 11.776 1.00 24.45 C ATOM 2440 C LYS B 29 28.009 -3.927 11.127 1.00 31.35 C ATOM 2441 O LYS B 29 27.326 -4.920 11.389 1.00 25.23 O ATOM 2442 CB LYS B 29 30.500 -4.447 10.997 1.00 11.40 C ATOM 2443 CG LYS B 29 30.297 -4.575 9.481 1.00 53.23 C ATOM 2444 CD LYS B 29 29.552 -5.857 9.090 1.00 3.25 C ATOM 2445 CE LYS B 29 30.257 -7.110 9.605 1.00 32.51 C ATOM 2446 NZ LYS B 29 31.649 -7.227 9.093 1.00 50.55 N1+ ATOM 0 H LYS B 29 28.962 -5.158 13.239 1.00 64.31 H new ATOM 0 HA LYS B 29 29.581 -2.656 11.764 1.00 24.45 H new ATOM 0 HB2 LYS B 29 31.435 -3.916 11.174 1.00 11.40 H new ATOM 0 HB3 LYS B 29 30.618 -5.448 11.413 1.00 11.40 H new ATOM 0 HG2 LYS B 29 29.740 -3.711 9.119 1.00 53.23 H new ATOM 0 HG3 LYS B 29 31.268 -4.558 8.986 1.00 53.23 H new ATOM 0 HD2 LYS B 29 28.538 -5.822 9.488 1.00 3.25 H new ATOM 0 HD3 LYS B 29 29.467 -5.910 8.005 1.00 3.25 H new ATOM 0 HE2 LYS B 29 30.274 -7.093 10.695 1.00 32.51 H new ATOM 0 HE3 LYS B 29 29.688 -7.991 9.309 1.00 32.51 H new ATOM 0 HZ1 LYS B 29 32.051 -8.140 9.386 1.00 50.55 H new ATOM 0 HZ2 LYS B 29 31.643 -7.168 8.055 1.00 50.55 H new ATOM 0 HZ3 LYS B 29 32.227 -6.454 9.480 1.00 50.55 H new ATOM 2460 N LEU B 30 27.610 -2.976 10.286 1.00 60.42 N ATOM 2461 CA LEU B 30 26.345 -3.052 9.572 1.00 43.12 C ATOM 2462 C LEU B 30 26.578 -2.915 8.069 1.00 50.11 C ATOM 2463 O LEU B 30 27.683 -2.540 7.625 1.00 72.32 O ATOM 2464 CB LEU B 30 25.321 -2.009 10.093 1.00 4.40 C ATOM 2465 CG LEU B 30 25.826 -0.579 10.408 1.00 61.23 C ATOM 2466 CD1 LEU B 30 26.722 -0.557 11.645 1.00 42.23 C ATOM 2467 CD2 LEU B 30 26.529 0.045 9.206 1.00 52.40 C ATOM 0 H LEU B 30 28.153 -2.137 10.083 1.00 60.42 H new ATOM 0 HA LEU B 30 25.909 -4.033 9.762 1.00 43.12 H new ATOM 0 HB2 LEU B 30 24.526 -1.925 9.352 1.00 4.40 H new ATOM 0 HB3 LEU B 30 24.870 -2.410 11.001 1.00 4.40 H new ATOM 0 HG LEU B 30 24.949 0.029 10.629 1.00 61.23 H new ATOM 0 HD11 LEU B 30 27.056 0.463 11.834 1.00 42.23 H new ATOM 0 HD12 LEU B 30 26.162 -0.921 12.506 1.00 42.23 H new ATOM 0 HD13 LEU B 30 27.588 -1.198 11.478 1.00 42.23 H new ATOM 0 HD21 LEU B 30 26.870 1.048 9.464 1.00 52.40 H new ATOM 0 HD22 LEU B 30 27.385 -0.569 8.926 1.00 52.40 H new ATOM 0 HD23 LEU B 30 25.835 0.102 8.368 1.00 52.40 H new ATOM 2479 N SER B 31 25.546 -3.233 7.289 1.00 24.22 N ATOM 2480 CA SER B 31 25.671 -3.286 5.840 1.00 21.40 C ATOM 2481 C SER B 31 24.310 -3.196 5.160 1.00 43.34 C ATOM 2482 O SER B 31 23.359 -3.875 5.560 1.00 1.33 O ATOM 2483 CB SER B 31 26.374 -4.587 5.417 1.00 62.35 C ATOM 2484 OG SER B 31 27.661 -4.695 6.006 1.00 3.34 O ATOM 0 H SER B 31 24.615 -3.457 7.640 1.00 24.22 H new ATOM 0 HA SER B 31 26.267 -2.429 5.527 1.00 21.40 H new ATOM 0 HB2 SER B 31 25.765 -5.443 5.709 1.00 62.35 H new ATOM 0 HB3 SER B 31 26.465 -4.617 4.331 1.00 62.35 H new ATOM 0 HG SER B 31 27.923 -3.828 6.381 1.00 3.34 H new ATOM 2490 N ALA B 32 24.229 -2.350 4.139 1.00 40.52 N ATOM 2491 CA ALA B 32 23.051 -2.277 3.292 1.00 75.13 C ATOM 2492 C ALA B 32 23.004 -3.505 2.376 1.00 31.44 C ATOM 2493 O ALA B 32 23.898 -3.703 1.549 1.00 42.31 O ATOM 2494 CB ALA B 32 23.066 -0.991 2.471 1.00 44.15 C ATOM 0 H ALA B 32 24.973 -1.702 3.879 1.00 40.52 H new ATOM 0 HA ALA B 32 22.158 -2.267 3.917 1.00 75.13 H new ATOM 0 HB1 ALA B 32 22.177 -0.951 1.841 1.00 44.15 H new ATOM 0 HB2 ALA B 32 23.075 -0.132 3.141 1.00 44.15 H new ATOM 0 HB3 ALA B 32 23.957 -0.971 1.843 1.00 44.15 H new ATOM 2500 N PRO B 33 21.973 -4.359 2.517 1.00 64.54 N ATOM 2501 CA PRO B 33 21.861 -5.588 1.725 1.00 71.30 C ATOM 2502 C PRO B 33 21.764 -5.298 0.225 1.00 44.54 C ATOM 2503 O PRO B 33 21.315 -4.226 -0.190 1.00 60.20 O ATOM 2504 CB PRO B 33 20.573 -6.247 2.248 1.00 5.21 C ATOM 2505 CG PRO B 33 19.810 -5.146 2.904 1.00 53.32 C ATOM 2506 CD PRO B 33 20.842 -4.195 3.449 1.00 34.02 C ATOM 0 HA PRO B 33 22.738 -6.226 1.831 1.00 71.30 H new ATOM 0 HB2 PRO B 33 20.000 -6.693 1.435 1.00 5.21 H new ATOM 0 HB3 PRO B 33 20.798 -7.046 2.955 1.00 5.21 H new ATOM 0 HG2 PRO B 33 19.156 -4.645 2.190 1.00 53.32 H new ATOM 0 HG3 PRO B 33 19.175 -5.532 3.701 1.00 53.32 H new ATOM 0 HD2 PRO B 33 20.477 -3.168 3.463 1.00 34.02 H new ATOM 0 HD3 PRO B 33 21.122 -4.447 4.472 1.00 34.02 H new ATOM 2514 N ARG B 34 22.188 -6.261 -0.584 1.00 0.10 N ATOM 2515 CA ARG B 34 22.163 -6.123 -2.038 1.00 23.43 C ATOM 2516 C ARG B 34 20.727 -6.159 -2.557 1.00 64.55 C ATOM 2517 O ARG B 34 20.474 -5.844 -3.721 1.00 62.12 O ATOM 2518 CB ARG B 34 23.007 -7.236 -2.686 1.00 33.02 C ATOM 2519 CG ARG B 34 24.365 -6.772 -3.209 1.00 11.34 C ATOM 2520 CD ARG B 34 24.242 -5.764 -4.345 1.00 70.25 C ATOM 2521 NE ARG B 34 25.559 -5.331 -4.818 1.00 41.11 N ATOM 2522 CZ ARG B 34 25.799 -4.799 -6.016 1.00 71.43 C ATOM 2523 NH1 ARG B 34 24.813 -4.612 -6.887 1.00 70.13 N1+ ATOM 2524 NH2 ARG B 34 27.039 -4.455 -6.341 1.00 21.32 N ATOM 0 H ARG B 34 22.556 -7.154 -0.256 1.00 0.10 H new ATOM 0 HA ARG B 34 22.593 -5.158 -2.307 1.00 23.43 H new ATOM 0 HB2 ARG B 34 23.164 -8.029 -1.955 1.00 33.02 H new ATOM 0 HB3 ARG B 34 22.442 -7.670 -3.511 1.00 33.02 H new ATOM 0 HG2 ARG B 34 24.932 -6.326 -2.392 1.00 11.34 H new ATOM 0 HG3 ARG B 34 24.932 -7.636 -3.555 1.00 11.34 H new ATOM 0 HD2 ARG B 34 23.685 -6.209 -5.170 1.00 70.25 H new ATOM 0 HD3 ARG B 34 23.673 -4.899 -4.006 1.00 70.25 H new ATOM 0 HE ARG B 34 26.350 -5.445 -4.184 1.00 41.11 H new ATOM 0 HH11 ARG B 34 23.859 -4.877 -6.642 1.00 70.13 H new ATOM 0 HH12 ARG B 34 25.010 -4.204 -7.801 1.00 70.13 H new ATOM 0 HH21 ARG B 34 27.799 -4.599 -5.676 1.00 21.32 H new ATOM 0 HH22 ARG B 34 27.232 -4.047 -7.256 1.00 21.32 H new ATOM 2538 N GLU B 35 19.795 -6.533 -1.676 1.00 42.24 N ATOM 2539 CA GLU B 35 18.368 -6.567 -2.003 1.00 63.02 C ATOM 2540 C GLU B 35 17.936 -5.260 -2.667 1.00 12.03 C ATOM 2541 O GLU B 35 17.248 -5.253 -3.688 1.00 54.43 O ATOM 2542 CB GLU B 35 17.535 -6.776 -0.729 1.00 72.41 C ATOM 2543 CG GLU B 35 18.022 -7.909 0.165 1.00 31.33 C ATOM 2544 CD GLU B 35 18.008 -9.270 -0.514 1.00 34.33 C ATOM 2545 OE1 GLU B 35 19.022 -9.637 -1.142 1.00 72.42 O ATOM 2546 OE2 GLU B 35 16.992 -9.990 -0.394 1.00 24.25 O1- ATOM 0 H GLU B 35 20.008 -6.819 -0.720 1.00 42.24 H new ATOM 0 HA GLU B 35 18.201 -7.395 -2.692 1.00 63.02 H new ATOM 0 HB2 GLU B 35 17.536 -5.850 -0.154 1.00 72.41 H new ATOM 0 HB3 GLU B 35 16.502 -6.973 -1.014 1.00 72.41 H new ATOM 0 HG2 GLU B 35 19.037 -7.688 0.497 1.00 31.33 H new ATOM 0 HG3 GLU B 35 17.397 -7.951 1.057 1.00 31.33 H new ATOM 2553 N LEU B 36 18.370 -4.155 -2.075 1.00 53.04 N ATOM 2554 CA LEU B 36 17.970 -2.821 -2.509 1.00 1.52 C ATOM 2555 C LEU B 36 19.095 -2.147 -3.290 1.00 52.10 C ATOM 2556 O LEU B 36 19.088 -0.930 -3.487 1.00 30.14 O ATOM 2557 CB LEU B 36 17.597 -1.994 -1.275 1.00 63.52 C ATOM 2558 CG LEU B 36 16.552 -2.656 -0.363 1.00 20.23 C ATOM 2559 CD1 LEU B 36 16.465 -1.942 0.978 1.00 52.43 C ATOM 2560 CD2 LEU B 36 15.187 -2.696 -1.050 1.00 15.21 C ATOM 0 H LEU B 36 19.009 -4.157 -1.280 1.00 53.04 H new ATOM 0 HA LEU B 36 17.109 -2.896 -3.173 1.00 1.52 H new ATOM 0 HB2 LEU B 36 18.499 -1.802 -0.694 1.00 63.52 H new ATOM 0 HB3 LEU B 36 17.216 -1.026 -1.602 1.00 63.52 H new ATOM 0 HG LEU B 36 16.869 -3.681 -0.173 1.00 20.23 H new ATOM 0 HD11 LEU B 36 15.718 -2.431 1.603 1.00 52.43 H new ATOM 0 HD12 LEU B 36 17.435 -1.980 1.474 1.00 52.43 H new ATOM 0 HD13 LEU B 36 16.180 -0.902 0.819 1.00 52.43 H new ATOM 0 HD21 LEU B 36 14.461 -3.168 -0.389 1.00 15.21 H new ATOM 0 HD22 LEU B 36 14.864 -1.680 -1.277 1.00 15.21 H new ATOM 0 HD23 LEU B 36 15.262 -3.268 -1.975 1.00 15.21 H new ATOM 2572 N GLY B 37 20.045 -2.952 -3.753 1.00 22.45 N ATOM 2573 CA GLY B 37 21.187 -2.427 -4.479 1.00 25.41 C ATOM 2574 C GLY B 37 22.251 -1.879 -3.551 1.00 51.22 C ATOM 2575 O GLY B 37 22.871 -0.855 -3.839 1.00 30.40 O ATOM 0 H GLY B 37 20.044 -3.965 -3.637 1.00 22.45 H new ATOM 0 HA2 GLY B 37 21.617 -3.216 -5.097 1.00 25.41 H new ATOM 0 HA3 GLY B 37 20.855 -1.639 -5.154 1.00 25.41 H new ATOM 2579 N GLY B 38 22.451 -2.560 -2.423 1.00 53.33 N ATOM 2580 CA GLY B 38 23.459 -2.144 -1.470 1.00 54.12 C ATOM 2581 C GLY B 38 24.819 -2.745 -1.772 1.00 61.21 C ATOM 2582 O GLY B 38 25.259 -2.759 -2.922 1.00 64.12 O ATOM 0 H GLY B 38 21.929 -3.394 -2.155 1.00 53.33 H new ATOM 0 HA2 GLY B 38 23.535 -1.057 -1.476 1.00 54.12 H new ATOM 0 HA3 GLY B 38 23.150 -2.436 -0.466 1.00 54.12 H new ATOM 2586 N ALA B 39 25.469 -3.268 -0.742 1.00 3.10 N ATOM 2587 CA ALA B 39 26.827 -3.798 -0.861 1.00 71.25 C ATOM 2588 C ALA B 39 26.816 -5.320 -0.890 1.00 4.43 C ATOM 2589 O ALA B 39 27.685 -5.949 -1.496 1.00 31.41 O ATOM 2590 CB ALA B 39 27.691 -3.296 0.291 1.00 12.41 C ATOM 0 H ALA B 39 25.076 -3.338 0.196 1.00 3.10 H new ATOM 0 HA ALA B 39 27.251 -3.444 -1.801 1.00 71.25 H new ATOM 0 HB1 ALA B 39 28.699 -3.697 0.191 1.00 12.41 H new ATOM 0 HB2 ALA B 39 27.730 -2.207 0.269 1.00 12.41 H new ATOM 0 HB3 ALA B 39 27.262 -3.624 1.238 1.00 12.41 H new ATOM 2596 N GLY B 40 25.819 -5.907 -0.239 1.00 23.34 N ATOM 2597 CA GLY B 40 25.716 -7.353 -0.181 1.00 31.44 C ATOM 2598 C GLY B 40 26.602 -7.943 0.892 1.00 1.42 C ATOM 2599 O GLY B 40 27.725 -8.372 0.617 1.00 53.13 O ATOM 0 H GLY B 40 25.078 -5.406 0.251 1.00 23.34 H new ATOM 0 HA2 GLY B 40 24.680 -7.635 0.009 1.00 31.44 H new ATOM 0 HA3 GLY B 40 25.989 -7.775 -1.148 1.00 31.44 H new ATOM 2603 N ALA B 41 26.090 -7.957 2.113 1.00 13.10 N ATOM 2604 CA ALA B 41 26.820 -8.481 3.261 1.00 45.11 C ATOM 2605 C ALA B 41 25.862 -8.726 4.417 1.00 24.05 C ATOM 2606 O ALA B 41 24.875 -8.001 4.579 1.00 14.44 O ATOM 2607 CB ALA B 41 27.930 -7.522 3.682 1.00 11.53 C ATOM 0 H ALA B 41 25.159 -7.607 2.338 1.00 13.10 H new ATOM 0 HA ALA B 41 27.281 -9.427 2.977 1.00 45.11 H new ATOM 0 HB1 ALA B 41 28.461 -7.934 4.540 1.00 11.53 H new ATOM 0 HB2 ALA B 41 28.627 -7.387 2.855 1.00 11.53 H new ATOM 0 HB3 ALA B 41 27.496 -6.559 3.952 1.00 11.53 H new ATOM 2613 N GLU B 42 26.152 -9.743 5.215 1.00 15.20 N ATOM 2614 CA GLU B 42 25.297 -10.113 6.337 1.00 53.20 C ATOM 2615 C GLU B 42 25.702 -9.351 7.598 1.00 74.14 C ATOM 2616 O GLU B 42 26.386 -9.874 8.483 1.00 53.42 O ATOM 2617 CB GLU B 42 25.333 -11.629 6.558 1.00 21.14 C ATOM 2618 CG GLU B 42 26.736 -12.198 6.705 1.00 73.23 C ATOM 2619 CD GLU B 42 26.742 -13.714 6.759 1.00 72.34 C ATOM 2620 OE1 GLU B 42 27.224 -14.349 5.792 1.00 61.42 O ATOM 2621 OE2 GLU B 42 26.233 -14.281 7.750 1.00 61.14 O1- ATOM 0 H GLU B 42 26.978 -10.331 5.106 1.00 15.20 H new ATOM 0 HA GLU B 42 24.270 -9.835 6.102 1.00 53.20 H new ATOM 0 HB2 GLU B 42 24.759 -11.869 7.453 1.00 21.14 H new ATOM 0 HB3 GLU B 42 24.838 -12.120 5.720 1.00 21.14 H new ATOM 0 HG2 GLU B 42 27.350 -11.864 5.868 1.00 73.23 H new ATOM 0 HG3 GLU B 42 27.192 -11.803 7.613 1.00 73.23 H new ATOM 2628 N GLY B 43 25.313 -8.088 7.635 1.00 33.24 N ATOM 2629 CA GLY B 43 25.536 -7.255 8.803 1.00 35.43 C ATOM 2630 C GLY B 43 24.229 -6.893 9.478 1.00 2.13 C ATOM 2631 O GLY B 43 23.445 -7.774 9.840 1.00 72.12 O ATOM 0 H GLY B 43 24.839 -7.616 6.865 1.00 33.24 H new ATOM 0 HA2 GLY B 43 26.179 -7.780 9.509 1.00 35.43 H new ATOM 0 HA3 GLY B 43 26.060 -6.346 8.509 1.00 35.43 H new ATOM 2635 N THR B 44 23.994 -5.601 9.653 1.00 33.20 N ATOM 2636 CA THR B 44 22.743 -5.109 10.196 1.00 33.40 C ATOM 2637 C THR B 44 22.157 -4.041 9.271 1.00 35.03 C ATOM 2638 O THR B 44 22.901 -3.289 8.636 1.00 4.14 O ATOM 2639 CB THR B 44 22.962 -4.531 11.612 1.00 13.15 C ATOM 2640 OG1 THR B 44 23.540 -5.538 12.454 1.00 1.03 O ATOM 2641 CG2 THR B 44 21.652 -4.045 12.216 1.00 34.45 C ATOM 0 H THR B 44 24.665 -4.868 9.422 1.00 33.20 H new ATOM 0 HA THR B 44 22.040 -5.939 10.267 1.00 33.40 H new ATOM 0 HB THR B 44 23.637 -3.679 11.536 1.00 13.15 H new ATOM 0 HG1 THR B 44 23.681 -5.172 13.352 1.00 1.03 H new ATOM 0 HG21 THR B 44 21.837 -3.644 13.212 1.00 34.45 H new ATOM 0 HG22 THR B 44 21.227 -3.265 11.584 1.00 34.45 H new ATOM 0 HG23 THR B 44 20.952 -4.878 12.285 1.00 34.45 H new ATOM 2649 N ASN B 45 20.828 -4.011 9.174 1.00 4.01 N ATOM 2650 CA ASN B 45 20.119 -3.032 8.351 1.00 51.43 C ATOM 2651 C ASN B 45 20.022 -1.690 9.088 1.00 21.43 C ATOM 2652 O ASN B 45 19.843 -1.669 10.309 1.00 31.35 O ATOM 2653 CB ASN B 45 18.712 -3.546 8.018 1.00 71.14 C ATOM 2654 CG ASN B 45 18.717 -4.847 7.240 1.00 11.33 C ATOM 2655 OD1 ASN B 45 18.788 -5.934 7.822 1.00 33.20 O ATOM 2656 ND2 ASN B 45 18.612 -4.753 5.926 1.00 55.34 N ATOM 0 H ASN B 45 20.214 -4.663 9.662 1.00 4.01 H new ATOM 0 HA ASN B 45 20.674 -2.887 7.424 1.00 51.43 H new ATOM 0 HB2 ASN B 45 18.156 -3.687 8.945 1.00 71.14 H new ATOM 0 HB3 ASN B 45 18.183 -2.788 7.441 1.00 71.14 H new ATOM 0 HD21 ASN B 45 18.587 -5.598 5.355 1.00 55.34 H new ATOM 0 HD22 ASN B 45 18.556 -3.836 5.483 1.00 55.34 H new ATOM 2663 N PRO B 46 20.135 -0.560 8.358 1.00 54.41 N ATOM 2664 CA PRO B 46 20.134 0.790 8.954 1.00 2.04 C ATOM 2665 C PRO B 46 18.835 1.118 9.699 1.00 14.41 C ATOM 2666 O PRO B 46 18.829 1.298 10.925 1.00 12.32 O ATOM 2667 CB PRO B 46 20.312 1.725 7.741 1.00 21.50 C ATOM 2668 CG PRO B 46 20.870 0.858 6.662 1.00 13.22 C ATOM 2669 CD PRO B 46 20.277 -0.504 6.890 1.00 31.44 C ATOM 0 HA PRO B 46 20.916 0.891 9.707 1.00 2.04 H new ATOM 0 HB2 PRO B 46 19.362 2.166 7.440 1.00 21.50 H new ATOM 0 HB3 PRO B 46 20.987 2.549 7.974 1.00 21.50 H new ATOM 0 HG2 PRO B 46 20.606 1.240 5.676 1.00 13.22 H new ATOM 0 HG3 PRO B 46 21.958 0.825 6.710 1.00 13.22 H new ATOM 0 HD2 PRO B 46 19.317 -0.616 6.387 1.00 31.44 H new ATOM 0 HD3 PRO B 46 20.927 -1.295 6.516 1.00 31.44 H new ATOM 2677 N GLU B 47 17.732 1.172 8.954 1.00 51.12 N ATOM 2678 CA GLU B 47 16.440 1.560 9.516 1.00 42.23 C ATOM 2679 C GLU B 47 16.001 0.556 10.576 1.00 51.31 C ATOM 2680 O GLU B 47 15.313 0.904 11.537 1.00 51.34 O ATOM 2681 CB GLU B 47 15.371 1.698 8.410 1.00 43.35 C ATOM 2682 CG GLU B 47 14.997 0.396 7.698 1.00 13.13 C ATOM 2683 CD GLU B 47 16.173 -0.274 7.007 1.00 41.12 C ATOM 2684 OE1 GLU B 47 16.752 -1.215 7.587 1.00 53.12 O ATOM 2685 OE2 GLU B 47 16.542 0.156 5.899 1.00 73.03 O1- ATOM 0 H GLU B 47 17.708 0.952 7.958 1.00 51.12 H new ATOM 0 HA GLU B 47 16.552 2.535 9.990 1.00 42.23 H new ATOM 0 HB2 GLU B 47 14.469 2.125 8.850 1.00 43.35 H new ATOM 0 HB3 GLU B 47 15.730 2.409 7.667 1.00 43.35 H new ATOM 0 HG2 GLU B 47 14.569 -0.296 8.423 1.00 13.13 H new ATOM 0 HG3 GLU B 47 14.222 0.604 6.960 1.00 13.13 H new ATOM 2692 N GLN B 48 16.419 -0.690 10.393 1.00 65.22 N ATOM 2693 CA GLN B 48 16.180 -1.750 11.362 1.00 23.21 C ATOM 2694 C GLN B 48 16.921 -1.457 12.665 1.00 44.13 C ATOM 2695 O GLN B 48 16.383 -1.648 13.757 1.00 15.51 O ATOM 2696 CB GLN B 48 16.663 -3.081 10.791 1.00 21.32 C ATOM 2697 CG GLN B 48 16.298 -4.295 11.630 1.00 64.34 C ATOM 2698 CD GLN B 48 16.951 -5.560 11.111 1.00 23.41 C ATOM 2699 OE1 GLN B 48 16.380 -6.641 11.188 1.00 3.40 O ATOM 2700 NE2 GLN B 48 18.169 -5.437 10.603 1.00 12.54 N ATOM 0 H GLN B 48 16.934 -0.994 9.567 1.00 65.22 H new ATOM 0 HA GLN B 48 15.111 -1.803 11.568 1.00 23.21 H new ATOM 0 HB2 GLN B 48 16.246 -3.206 9.792 1.00 21.32 H new ATOM 0 HB3 GLN B 48 17.747 -3.043 10.681 1.00 21.32 H new ATOM 0 HG2 GLN B 48 16.603 -4.127 12.663 1.00 64.34 H new ATOM 0 HG3 GLN B 48 15.215 -4.421 11.634 1.00 64.34 H new ATOM 0 HE21 GLN B 48 18.612 -4.519 10.556 1.00 12.54 H new ATOM 0 HE22 GLN B 48 18.664 -6.260 10.259 1.00 12.54 H new ATOM 2709 N LEU B 49 18.167 -1.005 12.533 1.00 25.52 N ATOM 2710 CA LEU B 49 18.996 -0.668 13.685 1.00 12.42 C ATOM 2711 C LEU B 49 18.324 0.455 14.472 1.00 73.15 C ATOM 2712 O LEU B 49 18.178 0.374 15.696 1.00 22.33 O ATOM 2713 CB LEU B 49 20.412 -0.270 13.208 1.00 25.41 C ATOM 2714 CG LEU B 49 21.501 -0.105 14.294 1.00 55.21 C ATOM 2715 CD1 LEU B 49 21.332 1.201 15.067 1.00 20.42 C ATOM 2716 CD2 LEU B 49 21.501 -1.300 15.247 1.00 31.54 C ATOM 0 H LEU B 49 18.625 -0.864 11.633 1.00 25.52 H new ATOM 0 HA LEU B 49 19.101 -1.530 14.344 1.00 12.42 H new ATOM 0 HB2 LEU B 49 20.754 -1.023 12.498 1.00 25.41 H new ATOM 0 HB3 LEU B 49 20.333 0.670 12.662 1.00 25.41 H new ATOM 0 HG LEU B 49 22.466 -0.066 13.788 1.00 55.21 H new ATOM 0 HD11 LEU B 49 22.115 1.281 15.821 1.00 20.42 H new ATOM 0 HD12 LEU B 49 21.403 2.043 14.379 1.00 20.42 H new ATOM 0 HD13 LEU B 49 20.357 1.212 15.554 1.00 20.42 H new ATOM 0 HD21 LEU B 49 22.275 -1.163 16.003 1.00 31.54 H new ATOM 0 HD22 LEU B 49 20.529 -1.378 15.733 1.00 31.54 H new ATOM 0 HD23 LEU B 49 21.700 -2.213 14.686 1.00 31.54 H new ATOM 2728 N PHE B 50 17.897 1.488 13.752 1.00 74.53 N ATOM 2729 CA PHE B 50 17.151 2.592 14.353 1.00 13.24 C ATOM 2730 C PHE B 50 15.873 2.085 15.015 1.00 54.12 C ATOM 2731 O PHE B 50 15.553 2.468 16.137 1.00 20.22 O ATOM 2732 CB PHE B 50 16.812 3.648 13.294 1.00 14.34 C ATOM 2733 CG PHE B 50 15.819 4.690 13.755 1.00 61.31 C ATOM 2734 CD1 PHE B 50 16.151 5.609 14.742 1.00 53.13 C ATOM 2735 CD2 PHE B 50 14.554 4.759 13.190 1.00 53.22 C ATOM 2736 CE1 PHE B 50 15.248 6.567 15.154 1.00 14.14 C ATOM 2737 CE2 PHE B 50 13.647 5.714 13.599 1.00 22.12 C ATOM 2738 CZ PHE B 50 13.993 6.620 14.583 1.00 62.30 C ATOM 0 H PHE B 50 18.055 1.585 12.749 1.00 74.53 H new ATOM 0 HA PHE B 50 17.779 3.049 15.118 1.00 13.24 H new ATOM 0 HB2 PHE B 50 17.731 4.148 12.988 1.00 14.34 H new ATOM 0 HB3 PHE B 50 16.413 3.147 12.412 1.00 14.34 H new ATOM 0 HD1 PHE B 50 17.131 5.573 15.194 1.00 53.13 H new ATOM 0 HD2 PHE B 50 14.276 4.055 12.419 1.00 53.22 H new ATOM 0 HE1 PHE B 50 15.523 7.274 15.922 1.00 14.14 H new ATOM 0 HE2 PHE B 50 12.666 5.754 13.150 1.00 22.12 H new ATOM 0 HZ PHE B 50 13.283 7.368 14.904 1.00 62.30 H new ATOM 2748 N ALA B 51 15.145 1.230 14.302 1.00 24.13 N ATOM 2749 CA ALA B 51 13.908 0.642 14.811 1.00 31.22 C ATOM 2750 C ALA B 51 14.122 -0.003 16.178 1.00 63.22 C ATOM 2751 O ALA B 51 13.406 0.296 17.135 1.00 61.14 O ATOM 2752 CB ALA B 51 13.373 -0.389 13.825 1.00 4.33 C ATOM 0 H ALA B 51 15.393 0.926 13.361 1.00 24.13 H new ATOM 0 HA ALA B 51 13.177 1.443 14.926 1.00 31.22 H new ATOM 0 HB1 ALA B 51 12.451 -0.821 14.214 1.00 4.33 H new ATOM 0 HB2 ALA B 51 13.172 0.093 12.868 1.00 4.33 H new ATOM 0 HB3 ALA B 51 14.113 -1.178 13.686 1.00 4.33 H new ATOM 2758 N ALA B 52 15.114 -0.884 16.259 1.00 2.41 N ATOM 2759 CA ALA B 52 15.439 -1.579 17.501 1.00 55.02 C ATOM 2760 C ALA B 52 15.818 -0.585 18.599 1.00 53.11 C ATOM 2761 O ALA B 52 15.324 -0.666 19.727 1.00 74.31 O ATOM 2762 CB ALA B 52 16.569 -2.577 17.271 1.00 43.35 C ATOM 0 H ALA B 52 15.712 -1.136 15.472 1.00 2.41 H new ATOM 0 HA ALA B 52 14.554 -2.124 17.828 1.00 55.02 H new ATOM 0 HB1 ALA B 52 16.800 -3.087 18.206 1.00 43.35 H new ATOM 0 HB2 ALA B 52 16.261 -3.309 16.525 1.00 43.35 H new ATOM 0 HB3 ALA B 52 17.455 -2.049 16.918 1.00 43.35 H new ATOM 2768 N GLY B 53 16.681 0.364 18.248 1.00 41.34 N ATOM 2769 CA GLY B 53 17.131 1.359 19.204 1.00 4.13 C ATOM 2770 C GLY B 53 15.996 2.222 19.721 1.00 15.42 C ATOM 2771 O GLY B 53 15.915 2.500 20.916 1.00 73.22 O ATOM 0 H GLY B 53 17.078 0.461 17.314 1.00 41.34 H new ATOM 0 HA2 GLY B 53 17.615 0.859 20.043 1.00 4.13 H new ATOM 0 HA3 GLY B 53 17.882 1.995 18.736 1.00 4.13 H new ATOM 2775 N TYR B 54 15.107 2.626 18.821 1.00 15.35 N ATOM 2776 CA TYR B 54 14.004 3.515 19.166 1.00 21.24 C ATOM 2777 C TYR B 54 12.912 2.761 19.925 1.00 2.44 C ATOM 2778 O TYR B 54 12.281 3.318 20.818 1.00 55.40 O ATOM 2779 CB TYR B 54 13.435 4.181 17.901 1.00 22.10 C ATOM 2780 CG TYR B 54 12.263 5.122 18.156 1.00 24.43 C ATOM 2781 CD1 TYR B 54 12.199 5.900 19.312 1.00 33.43 C ATOM 2782 CD2 TYR B 54 11.221 5.230 17.241 1.00 20.22 C ATOM 2783 CE1 TYR B 54 11.132 6.749 19.545 1.00 54.12 C ATOM 2784 CE2 TYR B 54 10.155 6.080 17.467 1.00 11.21 C ATOM 2785 CZ TYR B 54 10.114 6.835 18.621 1.00 15.31 C ATOM 2786 OH TYR B 54 9.049 7.679 18.856 1.00 73.14 O ATOM 0 H TYR B 54 15.129 2.349 17.839 1.00 15.35 H new ATOM 0 HA TYR B 54 14.386 4.297 19.822 1.00 21.24 H new ATOM 0 HB2 TYR B 54 14.232 4.739 17.409 1.00 22.10 H new ATOM 0 HB3 TYR B 54 13.116 3.403 17.208 1.00 22.10 H new ATOM 0 HD1 TYR B 54 12.996 5.838 20.038 1.00 33.43 H new ATOM 0 HD2 TYR B 54 11.245 4.639 16.337 1.00 20.22 H new ATOM 0 HE1 TYR B 54 11.097 7.342 20.447 1.00 54.12 H new ATOM 0 HE2 TYR B 54 9.357 6.153 16.743 1.00 11.21 H new ATOM 0 HH TYR B 54 9.349 8.442 19.393 1.00 73.14 H new ATOM 2796 N SER B 55 12.695 1.494 19.580 1.00 62.44 N ATOM 2797 CA SER B 55 11.700 0.680 20.277 1.00 11.44 C ATOM 2798 C SER B 55 12.148 0.432 21.718 1.00 45.34 C ATOM 2799 O SER B 55 11.362 0.567 22.658 1.00 23.33 O ATOM 2800 CB SER B 55 11.468 -0.643 19.534 1.00 71.55 C ATOM 2801 OG SER B 55 12.693 -1.289 19.245 1.00 22.42 O ATOM 0 H SER B 55 13.189 1.011 18.829 1.00 62.44 H new ATOM 0 HA SER B 55 10.753 1.219 20.298 1.00 11.44 H new ATOM 0 HB2 SER B 55 10.842 -1.298 20.140 1.00 71.55 H new ATOM 0 HB3 SER B 55 10.927 -0.453 18.607 1.00 71.55 H new ATOM 0 HG SER B 55 13.107 -0.870 18.462 1.00 22.42 H new ATOM 2807 N ALA B 56 13.425 0.093 21.880 1.00 72.32 N ATOM 2808 CA ALA B 56 14.010 -0.083 23.206 1.00 72.14 C ATOM 2809 C ALA B 56 14.021 1.245 23.963 1.00 34.31 C ATOM 2810 O ALA B 56 13.682 1.305 25.145 1.00 51.54 O ATOM 2811 CB ALA B 56 15.420 -0.648 23.089 1.00 11.32 C ATOM 0 H ALA B 56 14.074 -0.065 21.109 1.00 72.32 H new ATOM 0 HA ALA B 56 13.401 -0.791 23.767 1.00 72.14 H new ATOM 0 HB1 ALA B 56 15.845 -0.774 24.085 1.00 11.32 H new ATOM 0 HB2 ALA B 56 15.384 -1.613 22.584 1.00 11.32 H new ATOM 0 HB3 ALA B 56 16.041 0.039 22.514 1.00 11.32 H new ATOM 2817 N CYS B 57 14.401 2.309 23.257 1.00 24.02 N ATOM 2818 CA CYS B 57 14.430 3.652 23.828 1.00 54.22 C ATOM 2819 C CYS B 57 13.034 4.082 24.259 1.00 22.14 C ATOM 2820 O CYS B 57 12.867 4.762 25.270 1.00 1.03 O ATOM 2821 CB CYS B 57 14.985 4.655 22.812 1.00 72.40 C ATOM 2822 SG CYS B 57 15.168 6.337 23.450 1.00 42.35 S ATOM 0 H CYS B 57 14.695 2.264 22.281 1.00 24.02 H new ATOM 0 HA CYS B 57 15.081 3.633 24.702 1.00 54.22 H new ATOM 0 HB2 CYS B 57 15.956 4.303 22.465 1.00 72.40 H new ATOM 0 HB3 CYS B 57 14.326 4.678 21.944 1.00 72.40 H new ATOM 0 HG CYS B 57 14.058 6.990 23.276 1.00 42.35 H new ATOM 2828 N PHE B 58 12.035 3.675 23.482 1.00 34.03 N ATOM 2829 CA PHE B 58 10.649 4.026 23.757 1.00 42.11 C ATOM 2830 C PHE B 58 10.241 3.479 25.122 1.00 1.15 C ATOM 2831 O PHE B 58 9.481 4.107 25.858 1.00 52.32 O ATOM 2832 CB PHE B 58 9.733 3.471 22.656 1.00 13.13 C ATOM 2833 CG PHE B 58 8.426 4.211 22.522 1.00 50.11 C ATOM 2834 CD1 PHE B 58 7.250 3.699 23.056 1.00 2.44 C ATOM 2835 CD2 PHE B 58 8.380 5.431 21.862 1.00 25.34 C ATOM 2836 CE1 PHE B 58 6.058 4.389 22.931 1.00 5.05 C ATOM 2837 CE2 PHE B 58 7.193 6.122 21.734 1.00 25.32 C ATOM 2838 CZ PHE B 58 6.031 5.602 22.269 1.00 52.03 C ATOM 0 H PHE B 58 12.163 3.097 22.651 1.00 34.03 H new ATOM 0 HA PHE B 58 10.549 5.111 23.770 1.00 42.11 H new ATOM 0 HB2 PHE B 58 10.261 3.510 21.703 1.00 13.13 H new ATOM 0 HB3 PHE B 58 9.526 2.421 22.863 1.00 13.13 H new ATOM 0 HD1 PHE B 58 7.267 2.752 23.574 1.00 2.44 H new ATOM 0 HD2 PHE B 58 9.285 5.845 21.443 1.00 25.34 H new ATOM 0 HE1 PHE B 58 5.150 3.981 23.350 1.00 5.05 H new ATOM 0 HE2 PHE B 58 7.172 7.069 21.216 1.00 25.32 H new ATOM 0 HZ PHE B 58 5.101 6.143 22.170 1.00 52.03 H new ATOM 2848 N LEU B 59 10.774 2.305 25.455 1.00 60.43 N ATOM 2849 CA LEU B 59 10.549 1.699 26.761 1.00 11.12 C ATOM 2850 C LEU B 59 11.223 2.533 27.851 1.00 60.54 C ATOM 2851 O LEU B 59 10.656 2.749 28.921 1.00 64.41 O ATOM 2852 CB LEU B 59 11.080 0.257 26.784 1.00 33.41 C ATOM 2853 CG LEU B 59 10.374 -0.719 25.827 1.00 23.42 C ATOM 2854 CD1 LEU B 59 11.037 -2.097 25.870 1.00 12.45 C ATOM 2855 CD2 LEU B 59 8.887 -0.821 26.165 1.00 24.24 C ATOM 0 H LEU B 59 11.367 1.754 24.834 1.00 60.43 H new ATOM 0 HA LEU B 59 9.476 1.673 26.953 1.00 11.12 H new ATOM 0 HB2 LEU B 59 12.142 0.275 26.540 1.00 33.41 H new ATOM 0 HB3 LEU B 59 10.992 -0.129 27.800 1.00 33.41 H new ATOM 0 HG LEU B 59 10.468 -0.331 24.813 1.00 23.42 H new ATOM 0 HD11 LEU B 59 10.521 -2.770 25.186 1.00 12.45 H new ATOM 0 HD12 LEU B 59 12.082 -2.008 25.572 1.00 12.45 H new ATOM 0 HD13 LEU B 59 10.981 -2.496 26.883 1.00 12.45 H new ATOM 0 HD21 LEU B 59 8.404 -1.516 25.478 1.00 24.24 H new ATOM 0 HD22 LEU B 59 8.770 -1.182 27.187 1.00 24.24 H new ATOM 0 HD23 LEU B 59 8.424 0.162 26.072 1.00 24.24 H new ATOM 2867 N SER B 60 12.434 3.006 27.561 1.00 44.21 N ATOM 2868 CA SER B 60 13.186 3.841 28.495 1.00 2.40 C ATOM 2869 C SER B 60 12.471 5.177 28.731 1.00 73.23 C ATOM 2870 O SER B 60 12.404 5.664 29.860 1.00 65.55 O ATOM 2871 CB SER B 60 14.604 4.074 27.961 1.00 63.24 C ATOM 2872 OG SER B 60 15.249 2.839 27.685 1.00 24.13 O ATOM 0 H SER B 60 12.917 2.824 26.681 1.00 44.21 H new ATOM 0 HA SER B 60 13.250 3.323 29.452 1.00 2.40 H new ATOM 0 HB2 SER B 60 14.561 4.678 27.054 1.00 63.24 H new ATOM 0 HB3 SER B 60 15.185 4.637 28.692 1.00 63.24 H new ATOM 0 HG SER B 60 16.152 3.010 27.344 1.00 24.13 H new ATOM 2878 N ALA B 61 11.921 5.752 27.663 1.00 21.42 N ATOM 2879 CA ALA B 61 11.185 7.013 27.748 1.00 31.00 C ATOM 2880 C ALA B 61 9.890 6.815 28.532 1.00 42.41 C ATOM 2881 O ALA B 61 9.602 7.550 29.478 1.00 44.10 O ATOM 2882 CB ALA B 61 10.897 7.552 26.350 1.00 4.34 C ATOM 0 H ALA B 61 11.972 5.362 26.722 1.00 21.42 H new ATOM 0 HA ALA B 61 11.797 7.745 28.276 1.00 31.00 H new ATOM 0 HB1 ALA B 61 10.349 8.491 26.428 1.00 4.34 H new ATOM 0 HB2 ALA B 61 11.837 7.723 25.825 1.00 4.34 H new ATOM 0 HB3 ALA B 61 10.299 6.828 25.797 1.00 4.34 H new ATOM 2888 N MET B 62 9.125 5.799 28.137 1.00 64.12 N ATOM 2889 CA MET B 62 7.889 5.432 28.829 1.00 62.41 C ATOM 2890 C MET B 62 8.189 5.113 30.297 1.00 51.11 C ATOM 2891 O MET B 62 7.359 5.335 31.181 1.00 53.32 O ATOM 2892 CB MET B 62 7.242 4.220 28.133 1.00 4.11 C ATOM 2893 CG MET B 62 5.911 3.748 28.730 1.00 71.00 C ATOM 2894 SD MET B 62 4.487 4.765 28.265 1.00 51.43 S ATOM 2895 CE MET B 62 4.659 6.178 29.351 1.00 33.40 C ATOM 0 H MET B 62 9.342 5.210 27.333 1.00 64.12 H new ATOM 0 HA MET B 62 7.192 6.269 28.791 1.00 62.41 H new ATOM 0 HB2 MET B 62 7.082 4.469 27.084 1.00 4.11 H new ATOM 0 HB3 MET B 62 7.947 3.389 28.159 1.00 4.11 H new ATOM 0 HG2 MET B 62 5.728 2.721 28.415 1.00 71.00 H new ATOM 0 HG3 MET B 62 5.996 3.737 29.817 1.00 71.00 H new ATOM 0 HE1 MET B 62 3.673 6.510 29.675 1.00 33.40 H new ATOM 0 HE2 MET B 62 5.252 5.898 30.222 1.00 33.40 H new ATOM 0 HE3 MET B 62 5.157 6.988 28.818 1.00 33.40 H new ATOM 2905 N LYS B 63 9.394 4.601 30.541 1.00 72.03 N ATOM 2906 CA LYS B 63 9.851 4.283 31.891 1.00 43.00 C ATOM 2907 C LYS B 63 10.103 5.564 32.686 1.00 70.35 C ATOM 2908 O LYS B 63 9.650 5.699 33.822 1.00 23.43 O ATOM 2909 CB LYS B 63 11.134 3.447 31.821 1.00 31.31 C ATOM 2910 CG LYS B 63 11.657 2.974 33.175 1.00 20.13 C ATOM 2911 CD LYS B 63 12.990 2.244 33.029 1.00 10.22 C ATOM 2912 CE LYS B 63 12.896 1.082 32.044 1.00 1.23 C ATOM 2913 NZ LYS B 63 14.205 0.413 31.854 1.00 55.13 N1+ ATOM 0 H LYS B 63 10.077 4.396 29.812 1.00 72.03 H new ATOM 0 HA LYS B 63 9.076 3.708 32.398 1.00 43.00 H new ATOM 0 HB2 LYS B 63 10.951 2.576 31.192 1.00 31.31 H new ATOM 0 HB3 LYS B 63 11.910 4.036 31.332 1.00 31.31 H new ATOM 0 HG2 LYS B 63 11.779 3.829 33.839 1.00 20.13 H new ATOM 0 HG3 LYS B 63 10.926 2.312 33.639 1.00 20.13 H new ATOM 0 HD2 LYS B 63 13.753 2.945 32.692 1.00 10.22 H new ATOM 0 HD3 LYS B 63 13.308 1.870 34.002 1.00 10.22 H new ATOM 0 HE2 LYS B 63 12.167 0.357 32.406 1.00 1.23 H new ATOM 0 HE3 LYS B 63 12.532 1.448 31.084 1.00 1.23 H new ATOM 0 HZ1 LYS B 63 14.070 -0.467 31.316 1.00 55.13 H new ATOM 0 HZ2 LYS B 63 14.845 1.044 31.331 1.00 55.13 H new ATOM 0 HZ3 LYS B 63 14.620 0.192 32.782 1.00 55.13 H new ATOM 2927 N PHE B 64 10.827 6.503 32.076 1.00 21.33 N ATOM 2928 CA PHE B 64 11.117 7.788 32.710 1.00 32.24 C ATOM 2929 C PHE B 64 9.811 8.515 33.026 1.00 14.21 C ATOM 2930 O PHE B 64 9.685 9.181 34.058 1.00 73.11 O ATOM 2931 CB PHE B 64 12.014 8.649 31.806 1.00 30.41 C ATOM 2932 CG PHE B 64 12.388 9.982 32.412 1.00 63.34 C ATOM 2933 CD1 PHE B 64 13.196 10.043 33.543 1.00 43.42 C ATOM 2934 CD2 PHE B 64 11.931 11.170 31.859 1.00 31.33 C ATOM 2935 CE1 PHE B 64 13.535 11.260 34.104 1.00 55.11 C ATOM 2936 CE2 PHE B 64 12.269 12.387 32.417 1.00 33.41 C ATOM 2937 CZ PHE B 64 13.071 12.432 33.542 1.00 14.04 C ATOM 0 H PHE B 64 11.224 6.397 31.142 1.00 21.33 H new ATOM 0 HA PHE B 64 11.654 7.609 33.641 1.00 32.24 H new ATOM 0 HB2 PHE B 64 12.925 8.095 31.579 1.00 30.41 H new ATOM 0 HB3 PHE B 64 11.502 8.821 30.859 1.00 30.41 H new ATOM 0 HD1 PHE B 64 13.562 9.129 33.988 1.00 43.42 H new ATOM 0 HD2 PHE B 64 11.303 11.142 30.981 1.00 31.33 H new ATOM 0 HE1 PHE B 64 14.163 11.294 34.982 1.00 55.11 H new ATOM 0 HE2 PHE B 64 11.907 13.303 31.975 1.00 33.41 H new ATOM 0 HZ PHE B 64 13.334 13.383 33.981 1.00 14.04 H new ATOM 2947 N VAL B 65 8.841 8.371 32.129 1.00 75.05 N ATOM 2948 CA VAL B 65 7.499 8.880 32.360 1.00 40.30 C ATOM 2949 C VAL B 65 6.870 8.167 33.553 1.00 43.44 C ATOM 2950 O VAL B 65 6.354 8.804 34.469 1.00 35.52 O ATOM 2951 CB VAL B 65 6.594 8.698 31.117 1.00 54.45 C ATOM 2952 CG1 VAL B 65 5.135 8.985 31.466 1.00 70.43 C ATOM 2953 CG2 VAL B 65 7.065 9.590 29.968 1.00 51.21 C ATOM 0 H VAL B 65 8.963 7.903 31.231 1.00 75.05 H new ATOM 0 HA VAL B 65 7.583 9.947 32.565 1.00 40.30 H new ATOM 0 HB VAL B 65 6.667 7.661 30.790 1.00 54.45 H new ATOM 0 HG11 VAL B 65 4.516 8.852 30.579 1.00 70.43 H new ATOM 0 HG12 VAL B 65 4.805 8.298 32.245 1.00 70.43 H new ATOM 0 HG13 VAL B 65 5.041 10.011 31.823 1.00 70.43 H new ATOM 0 HG21 VAL B 65 6.415 9.446 29.105 1.00 51.21 H new ATOM 0 HG22 VAL B 65 7.029 10.634 30.279 1.00 51.21 H new ATOM 0 HG23 VAL B 65 8.088 9.327 29.699 1.00 51.21 H new ATOM 2963 N ALA B 66 6.942 6.842 33.546 1.00 30.22 N ATOM 2964 CA ALA B 66 6.381 6.027 34.617 1.00 74.13 C ATOM 2965 C ALA B 66 6.958 6.428 35.971 1.00 44.35 C ATOM 2966 O ALA B 66 6.271 6.380 36.996 1.00 34.23 O ATOM 2967 CB ALA B 66 6.639 4.549 34.346 1.00 23.44 C ATOM 0 H ALA B 66 7.388 6.304 32.803 1.00 30.22 H new ATOM 0 HA ALA B 66 5.305 6.197 34.645 1.00 74.13 H new ATOM 0 HB1 ALA B 66 6.215 3.952 35.153 1.00 23.44 H new ATOM 0 HB2 ALA B 66 6.174 4.266 33.402 1.00 23.44 H new ATOM 0 HB3 ALA B 66 7.713 4.372 34.289 1.00 23.44 H new ATOM 2973 N GLY B 67 8.213 6.858 35.957 1.00 23.35 N ATOM 2974 CA GLY B 67 8.904 7.213 37.185 1.00 73.24 C ATOM 2975 C GLY B 67 8.355 8.487 37.798 1.00 45.13 C ATOM 2976 O GLY B 67 8.360 8.659 39.017 1.00 75.04 O ATOM 0 H GLY B 67 8.770 6.968 35.110 1.00 23.35 H new ATOM 0 HA2 GLY B 67 8.812 6.397 37.902 1.00 73.24 H new ATOM 0 HA3 GLY B 67 9.967 7.338 36.980 1.00 73.24 H new ATOM 2980 N GLN B 68 7.867 9.376 36.943 1.00 2.12 N ATOM 2981 CA GLN B 68 7.323 10.656 37.382 1.00 44.13 C ATOM 2982 C GLN B 68 5.801 10.581 37.444 1.00 40.32 C ATOM 2983 O GLN B 68 5.146 11.428 38.045 1.00 64.50 O ATOM 2984 CB GLN B 68 7.783 11.772 36.437 1.00 33.05 C ATOM 2985 CG GLN B 68 7.497 11.485 34.974 1.00 52.44 C ATOM 2986 CD GLN B 68 7.935 12.609 34.058 1.00 54.32 C ATOM 2987 OE1 GLN B 68 7.187 13.553 33.812 1.00 53.51 O ATOM 2988 NE2 GLN B 68 9.149 12.514 33.539 1.00 53.21 N ATOM 0 H GLN B 68 7.837 9.233 35.934 1.00 2.12 H new ATOM 0 HA GLN B 68 7.693 10.883 38.382 1.00 44.13 H new ATOM 0 HB2 GLN B 68 7.290 12.702 36.719 1.00 33.05 H new ATOM 0 HB3 GLN B 68 8.854 11.927 36.566 1.00 33.05 H new ATOM 0 HG2 GLN B 68 8.006 10.566 34.683 1.00 52.44 H new ATOM 0 HG3 GLN B 68 6.429 11.313 34.845 1.00 52.44 H new ATOM 0 HE21 GLN B 68 9.740 11.715 33.767 1.00 53.21 H new ATOM 0 HE22 GLN B 68 9.493 13.240 32.911 1.00 53.21 H new ATOM 2997 N ASN B 69 5.253 9.545 36.815 1.00 21.43 N ATOM 2998 CA ASN B 69 3.813 9.285 36.821 1.00 41.54 C ATOM 2999 C ASN B 69 3.445 8.337 37.961 1.00 23.00 C ATOM 3000 O ASN B 69 2.272 8.013 38.158 1.00 34.41 O ATOM 3001 CB ASN B 69 3.367 8.699 35.471 1.00 65.13 C ATOM 3002 CG ASN B 69 3.195 9.744 34.374 1.00 21.52 C ATOM 3003 OD1 ASN B 69 2.316 9.624 33.517 1.00 65.21 O ATOM 3004 ND2 ASN B 69 4.045 10.757 34.372 1.00 45.52 N ATOM 0 H ASN B 69 5.793 8.861 36.286 1.00 21.43 H new ATOM 0 HA ASN B 69 3.293 10.230 36.977 1.00 41.54 H new ATOM 0 HB2 ASN B 69 4.100 7.961 35.146 1.00 65.13 H new ATOM 0 HB3 ASN B 69 2.423 8.171 35.608 1.00 65.13 H new ATOM 0 HD21 ASN B 69 3.986 11.471 33.646 1.00 45.52 H new ATOM 0 HD22 ASN B 69 4.760 10.825 35.097 1.00 45.52 H new ATOM 3011 N LYS B 70 4.468 7.885 38.691 1.00 4.22 N ATOM 3012 CA LYS B 70 4.299 7.030 39.866 1.00 71.04 C ATOM 3013 C LYS B 70 3.615 5.717 39.507 1.00 55.13 C ATOM 3014 O LYS B 70 3.043 5.035 40.363 1.00 71.33 O ATOM 3015 CB LYS B 70 3.548 7.776 40.978 1.00 43.15 C ATOM 3016 CG LYS B 70 4.456 8.665 41.826 1.00 61.50 C ATOM 3017 CD LYS B 70 5.430 9.475 40.973 1.00 21.25 C ATOM 3018 CE LYS B 70 6.257 10.434 41.817 1.00 20.34 C ATOM 3019 NZ LYS B 70 5.412 11.433 42.519 1.00 73.12 N1+ ATOM 0 H LYS B 70 5.442 8.104 38.481 1.00 4.22 H new ATOM 0 HA LYS B 70 5.290 6.779 40.245 1.00 71.04 H new ATOM 0 HB2 LYS B 70 2.765 8.389 40.531 1.00 43.15 H new ATOM 0 HB3 LYS B 70 3.055 7.050 41.624 1.00 43.15 H new ATOM 0 HG2 LYS B 70 3.845 9.344 42.420 1.00 61.50 H new ATOM 0 HG3 LYS B 70 5.017 8.046 42.526 1.00 61.50 H new ATOM 0 HD2 LYS B 70 6.094 8.797 40.437 1.00 21.25 H new ATOM 0 HD3 LYS B 70 4.875 10.037 40.222 1.00 21.25 H new ATOM 0 HE2 LYS B 70 6.832 9.868 42.550 1.00 20.34 H new ATOM 0 HE3 LYS B 70 6.974 10.951 41.179 1.00 20.34 H new ATOM 0 HZ1 LYS B 70 6.010 12.208 42.869 1.00 73.12 H new ATOM 0 HZ2 LYS B 70 4.703 11.813 41.859 1.00 73.12 H new ATOM 0 HZ3 LYS B 70 4.930 10.978 43.320 1.00 73.12 H new ATOM 3033 N GLN B 71 3.716 5.358 38.241 1.00 41.03 N ATOM 3034 CA GLN B 71 3.201 4.094 37.744 1.00 14.44 C ATOM 3035 C GLN B 71 4.363 3.139 37.505 1.00 73.31 C ATOM 3036 O GLN B 71 5.522 3.556 37.468 1.00 34.15 O ATOM 3037 CB GLN B 71 2.394 4.301 36.454 1.00 1.40 C ATOM 3038 CG GLN B 71 3.129 5.106 35.389 1.00 33.32 C ATOM 3039 CD GLN B 71 2.780 4.696 33.971 1.00 34.04 C ATOM 3040 OE1 GLN B 71 3.602 3.830 33.409 1.00 74.24 O flip ATOM 3041 NE2 GLN B 71 1.815 5.181 33.382 1.00 0.43 N flip ATOM 0 H GLN B 71 4.158 5.935 37.526 1.00 41.03 H new ATOM 0 HA GLN B 71 2.529 3.665 38.487 1.00 14.44 H new ATOM 0 HB2 GLN B 71 2.130 3.327 36.042 1.00 1.40 H new ATOM 0 HB3 GLN B 71 1.460 4.807 36.698 1.00 1.40 H new ATOM 0 HG2 GLN B 71 2.898 6.163 35.520 1.00 33.32 H new ATOM 0 HG3 GLN B 71 4.203 4.994 35.537 1.00 33.32 H new ATOM 0 HE21 GLN B 71 1.208 5.847 33.860 1.00 0.43 H new ATOM 0 HE22 GLN B 71 1.622 4.917 32.416 1.00 0.43 H new ATOM 3050 N THR B 72 4.054 1.866 37.348 1.00 1.35 N ATOM 3051 CA THR B 72 5.071 0.842 37.164 1.00 51.41 C ATOM 3052 C THR B 72 4.783 0.037 35.905 1.00 74.12 C ATOM 3053 O THR B 72 3.632 -0.301 35.627 1.00 25.05 O ATOM 3054 CB THR B 72 5.136 -0.106 38.382 1.00 13.02 C ATOM 3055 OG1 THR B 72 3.821 -0.594 38.692 1.00 4.22 O ATOM 3056 CG2 THR B 72 5.726 0.599 39.601 1.00 71.50 C ATOM 0 H THR B 72 3.098 1.511 37.344 1.00 1.35 H new ATOM 0 HA THR B 72 6.035 1.342 37.064 1.00 51.41 H new ATOM 0 HB THR B 72 5.786 -0.943 38.125 1.00 13.02 H new ATOM 0 HG1 THR B 72 3.869 -1.196 39.464 1.00 4.22 H new ATOM 0 HG21 THR B 72 5.759 -0.094 40.442 1.00 71.50 H new ATOM 0 HG22 THR B 72 6.736 0.939 39.371 1.00 71.50 H new ATOM 0 HG23 THR B 72 5.105 1.456 39.861 1.00 71.50 H new ATOM 3064 N LEU B 73 5.829 -0.255 35.147 1.00 74.12 N ATOM 3065 CA LEU B 73 5.693 -1.002 33.905 1.00 52.35 C ATOM 3066 C LEU B 73 6.227 -2.423 34.080 1.00 64.24 C ATOM 3067 O LEU B 73 7.266 -2.627 34.713 1.00 14.14 O ATOM 3068 CB LEU B 73 6.447 -0.276 32.782 1.00 75.15 C ATOM 3069 CG LEU B 73 5.904 1.111 32.423 1.00 62.34 C ATOM 3070 CD1 LEU B 73 6.817 1.793 31.411 1.00 33.12 C ATOM 3071 CD2 LEU B 73 4.477 1.010 31.885 1.00 51.14 C ATOM 0 H LEU B 73 6.786 0.016 35.372 1.00 74.12 H new ATOM 0 HA LEU B 73 4.638 -1.065 33.638 1.00 52.35 H new ATOM 0 HB2 LEU B 73 7.492 -0.175 33.074 1.00 75.15 H new ATOM 0 HB3 LEU B 73 6.425 -0.900 31.889 1.00 75.15 H new ATOM 0 HG LEU B 73 5.881 1.718 33.328 1.00 62.34 H new ATOM 0 HD11 LEU B 73 6.418 2.777 31.166 1.00 33.12 H new ATOM 0 HD12 LEU B 73 7.815 1.902 31.836 1.00 33.12 H new ATOM 0 HD13 LEU B 73 6.872 1.188 30.506 1.00 33.12 H new ATOM 0 HD21 LEU B 73 4.111 2.006 31.636 1.00 51.14 H new ATOM 0 HD22 LEU B 73 4.468 0.386 30.991 1.00 51.14 H new ATOM 0 HD23 LEU B 73 3.833 0.565 32.644 1.00 51.14 H new ATOM 3083 N PRO B 74 5.511 -3.422 33.534 1.00 22.31 N ATOM 3084 CA PRO B 74 5.934 -4.829 33.581 1.00 33.15 C ATOM 3085 C PRO B 74 7.205 -5.074 32.765 1.00 51.21 C ATOM 3086 O PRO B 74 7.351 -4.547 31.665 1.00 62.01 O ATOM 3087 CB PRO B 74 4.743 -5.581 32.958 1.00 23.12 C ATOM 3088 CG PRO B 74 4.053 -4.561 32.119 1.00 12.13 C ATOM 3089 CD PRO B 74 4.221 -3.256 32.839 1.00 51.43 C ATOM 0 HA PRO B 74 6.175 -5.152 34.594 1.00 33.15 H new ATOM 0 HB2 PRO B 74 5.078 -6.427 32.358 1.00 23.12 H new ATOM 0 HB3 PRO B 74 4.079 -5.978 33.726 1.00 23.12 H new ATOM 0 HG2 PRO B 74 4.489 -4.516 31.121 1.00 12.13 H new ATOM 0 HG3 PRO B 74 2.998 -4.806 31.995 1.00 12.13 H new ATOM 0 HD2 PRO B 74 4.241 -2.414 32.148 1.00 51.43 H new ATOM 0 HD3 PRO B 74 3.406 -3.074 33.540 1.00 51.43 H new ATOM 3097 N ALA B 75 8.110 -5.889 33.296 1.00 24.41 N ATOM 3098 CA ALA B 75 9.356 -6.221 32.604 1.00 71.53 C ATOM 3099 C ALA B 75 9.099 -7.241 31.494 1.00 71.01 C ATOM 3100 O ALA B 75 9.980 -7.548 30.690 1.00 12.42 O ATOM 3101 CB ALA B 75 10.386 -6.757 33.594 1.00 50.55 C ATOM 0 H ALA B 75 8.006 -6.335 34.207 1.00 24.41 H new ATOM 0 HA ALA B 75 9.751 -5.313 32.150 1.00 71.53 H new ATOM 0 HB1 ALA B 75 11.307 -7.000 33.065 1.00 50.55 H new ATOM 0 HB2 ALA B 75 10.591 -6.000 34.351 1.00 50.55 H new ATOM 0 HB3 ALA B 75 9.996 -7.655 34.074 1.00 50.55 H new ATOM 3107 N ASP B 76 7.873 -7.757 31.455 1.00 24.20 N ATOM 3108 CA ASP B 76 7.482 -8.755 30.458 1.00 60.22 C ATOM 3109 C ASP B 76 6.974 -8.086 29.179 1.00 14.12 C ATOM 3110 O ASP B 76 6.566 -8.754 28.229 1.00 34.13 O ATOM 3111 CB ASP B 76 6.403 -9.681 31.045 1.00 21.51 C ATOM 3112 CG ASP B 76 6.111 -10.888 30.162 1.00 33.51 C ATOM 3113 OD1 ASP B 76 5.074 -10.891 29.461 1.00 23.44 O ATOM 3114 OD2 ASP B 76 6.916 -11.843 30.179 1.00 41.11 O1- ATOM 0 H ASP B 76 7.129 -7.500 32.104 1.00 24.20 H new ATOM 0 HA ASP B 76 8.360 -9.347 30.198 1.00 60.22 H new ATOM 0 HB2 ASP B 76 6.723 -10.026 32.028 1.00 21.51 H new ATOM 0 HB3 ASP B 76 5.484 -9.113 31.190 1.00 21.51 H new ATOM 3119 N THR B 77 7.022 -6.764 29.154 1.00 44.41 N ATOM 3120 CA THR B 77 6.515 -5.996 28.022 1.00 1.21 C ATOM 3121 C THR B 77 7.499 -6.018 26.853 1.00 31.44 C ATOM 3122 O THR B 77 8.699 -6.262 27.036 1.00 72.52 O ATOM 3123 CB THR B 77 6.215 -4.537 28.426 1.00 44.03 C ATOM 3124 OG1 THR B 77 5.589 -3.838 27.342 1.00 73.25 O ATOM 3125 CG2 THR B 77 7.488 -3.797 28.829 1.00 30.02 C ATOM 0 H THR B 77 7.408 -6.195 29.908 1.00 44.41 H new ATOM 0 HA THR B 77 5.585 -6.468 27.704 1.00 1.21 H new ATOM 0 HB THR B 77 5.542 -4.568 29.283 1.00 44.03 H new ATOM 0 HG1 THR B 77 5.108 -4.477 26.776 1.00 73.25 H new ATOM 0 HG21 THR B 77 7.241 -2.773 29.108 1.00 30.02 H new ATOM 0 HG22 THR B 77 7.950 -4.302 29.677 1.00 30.02 H new ATOM 0 HG23 THR B 77 8.184 -3.787 27.990 1.00 30.02 H new ATOM 3133 N THR B 78 6.987 -5.776 25.652 1.00 70.31 N ATOM 3134 CA THR B 78 7.805 -5.771 24.448 1.00 64.53 C ATOM 3135 C THR B 78 7.247 -4.776 23.427 1.00 71.23 C ATOM 3136 O THR B 78 6.039 -4.543 23.368 1.00 64.44 O ATOM 3137 CB THR B 78 7.841 -7.182 23.806 1.00 53.44 C ATOM 3138 OG1 THR B 78 8.079 -8.181 24.810 1.00 34.22 O ATOM 3139 CG2 THR B 78 8.921 -7.283 22.733 1.00 23.30 C ATOM 0 H THR B 78 6.000 -5.579 25.487 1.00 70.31 H new ATOM 0 HA THR B 78 8.815 -5.476 24.732 1.00 64.53 H new ATOM 0 HB THR B 78 6.871 -7.351 23.338 1.00 53.44 H new ATOM 0 HG1 THR B 78 8.098 -9.067 24.392 1.00 34.22 H new ATOM 0 HG21 THR B 78 8.917 -8.286 22.305 1.00 23.30 H new ATOM 0 HG22 THR B 78 8.723 -6.553 21.948 1.00 23.30 H new ATOM 0 HG23 THR B 78 9.896 -7.083 23.178 1.00 23.30 H new ATOM 3147 N VAL B 79 8.130 -4.197 22.628 1.00 22.45 N ATOM 3148 CA VAL B 79 7.735 -3.344 21.514 1.00 23.02 C ATOM 3149 C VAL B 79 8.458 -3.798 20.260 1.00 31.21 C ATOM 3150 O VAL B 79 9.690 -3.816 20.214 1.00 14.34 O ATOM 3151 CB VAL B 79 8.037 -1.845 21.783 1.00 21.11 C ATOM 3152 CG1 VAL B 79 7.795 -1.002 20.527 1.00 1.41 C ATOM 3153 CG2 VAL B 79 7.183 -1.332 22.938 1.00 54.24 C ATOM 0 H VAL B 79 9.139 -4.304 22.732 1.00 22.45 H new ATOM 0 HA VAL B 79 6.656 -3.437 21.387 1.00 23.02 H new ATOM 0 HB VAL B 79 9.089 -1.754 22.055 1.00 21.11 H new ATOM 0 HG11 VAL B 79 8.014 0.044 20.743 1.00 1.41 H new ATOM 0 HG12 VAL B 79 8.445 -1.350 19.724 1.00 1.41 H new ATOM 0 HG13 VAL B 79 6.754 -1.099 20.219 1.00 1.41 H new ATOM 0 HG21 VAL B 79 7.405 -0.280 23.115 1.00 54.24 H new ATOM 0 HG22 VAL B 79 6.128 -1.443 22.688 1.00 54.24 H new ATOM 0 HG23 VAL B 79 7.405 -1.906 23.837 1.00 54.24 H new ATOM 3163 N THR B 80 7.692 -4.194 19.253 1.00 72.42 N ATOM 3164 CA THR B 80 8.264 -4.707 18.021 1.00 23.21 C ATOM 3165 C THR B 80 8.144 -3.675 16.904 1.00 63.22 C ATOM 3166 O THR B 80 7.048 -3.372 16.435 1.00 42.43 O ATOM 3167 CB THR B 80 7.586 -6.026 17.594 1.00 22.40 C ATOM 3168 OG1 THR B 80 7.573 -6.948 18.699 1.00 71.34 O ATOM 3169 CG2 THR B 80 8.320 -6.656 16.417 1.00 64.25 C ATOM 0 H THR B 80 6.672 -4.169 19.267 1.00 72.42 H new ATOM 0 HA THR B 80 9.319 -4.910 18.207 1.00 23.21 H new ATOM 0 HB THR B 80 6.564 -5.802 17.289 1.00 22.40 H new ATOM 0 HG1 THR B 80 7.140 -7.783 18.423 1.00 71.34 H new ATOM 0 HG21 THR B 80 7.824 -7.584 16.134 1.00 64.25 H new ATOM 0 HG22 THR B 80 8.311 -5.967 15.572 1.00 64.25 H new ATOM 0 HG23 THR B 80 9.351 -6.868 16.702 1.00 64.25 H new ATOM 3177 N ALA B 81 9.278 -3.127 16.502 1.00 41.34 N ATOM 3178 CA ALA B 81 9.341 -2.155 15.425 1.00 73.43 C ATOM 3179 C ALA B 81 9.703 -2.857 14.122 1.00 13.31 C ATOM 3180 O ALA B 81 10.840 -3.302 13.946 1.00 32.14 O ATOM 3181 CB ALA B 81 10.363 -1.071 15.753 1.00 31.52 C ATOM 0 H ALA B 81 10.185 -3.345 16.916 1.00 41.34 H new ATOM 0 HA ALA B 81 8.366 -1.682 15.310 1.00 73.43 H new ATOM 0 HB1 ALA B 81 10.401 -0.348 14.938 1.00 31.52 H new ATOM 0 HB2 ALA B 81 10.074 -0.565 16.674 1.00 31.52 H new ATOM 0 HB3 ALA B 81 11.346 -1.525 15.882 1.00 31.52 H new ATOM 3187 N GLU B 82 8.736 -2.983 13.223 1.00 50.12 N ATOM 3188 CA GLU B 82 8.976 -3.624 11.935 1.00 53.10 C ATOM 3189 C GLU B 82 9.078 -2.549 10.855 1.00 51.21 C ATOM 3190 O GLU B 82 8.129 -1.798 10.614 1.00 13.21 O ATOM 3191 CB GLU B 82 7.871 -4.647 11.616 1.00 51.24 C ATOM 3192 CG GLU B 82 8.158 -5.492 10.377 1.00 31.41 C ATOM 3193 CD GLU B 82 7.210 -6.676 10.223 1.00 63.34 C ATOM 3194 OE1 GLU B 82 6.087 -6.486 9.716 1.00 35.34 O ATOM 3195 OE2 GLU B 82 7.596 -7.806 10.597 1.00 71.23 O1- ATOM 0 H GLU B 82 7.781 -2.652 13.360 1.00 50.12 H new ATOM 0 HA GLU B 82 9.916 -4.175 11.971 1.00 53.10 H new ATOM 0 HB2 GLU B 82 7.741 -5.307 12.473 1.00 51.24 H new ATOM 0 HB3 GLU B 82 6.928 -4.118 11.474 1.00 51.24 H new ATOM 0 HG2 GLU B 82 8.087 -4.861 9.491 1.00 31.41 H new ATOM 0 HG3 GLU B 82 9.183 -5.860 10.426 1.00 31.41 H new ATOM 3202 N VAL B 83 10.248 -2.456 10.237 1.00 40.31 N ATOM 3203 CA VAL B 83 10.534 -1.405 9.268 1.00 71.44 C ATOM 3204 C VAL B 83 10.523 -1.949 7.849 1.00 35.11 C ATOM 3205 O VAL B 83 10.898 -3.094 7.608 1.00 1.44 O ATOM 3206 CB VAL B 83 11.905 -0.744 9.544 1.00 65.23 C ATOM 3207 CG1 VAL B 83 11.845 0.105 10.808 1.00 71.22 C ATOM 3208 CG2 VAL B 83 12.998 -1.807 9.654 1.00 51.35 C ATOM 0 H VAL B 83 11.022 -3.102 10.392 1.00 40.31 H new ATOM 0 HA VAL B 83 9.749 -0.656 9.372 1.00 71.44 H new ATOM 0 HB VAL B 83 12.149 -0.089 8.707 1.00 65.23 H new ATOM 0 HG11 VAL B 83 12.818 0.562 10.986 1.00 71.22 H new ATOM 0 HG12 VAL B 83 11.094 0.886 10.686 1.00 71.22 H new ATOM 0 HG13 VAL B 83 11.579 -0.525 11.657 1.00 71.22 H new ATOM 0 HG21 VAL B 83 13.956 -1.325 9.848 1.00 51.35 H new ATOM 0 HG22 VAL B 83 12.762 -2.488 10.472 1.00 51.35 H new ATOM 0 HG23 VAL B 83 13.056 -2.367 8.721 1.00 51.35 H new ATOM 3218 N GLY B 84 10.094 -1.111 6.921 1.00 51.11 N ATOM 3219 CA GLY B 84 10.059 -1.470 5.527 1.00 52.45 C ATOM 3220 C GLY B 84 10.445 -0.303 4.650 1.00 30.33 C ATOM 3221 O GLY B 84 10.356 0.851 5.067 1.00 4.21 O ATOM 0 H GLY B 84 9.763 -0.167 7.119 1.00 51.11 H new ATOM 0 HA2 GLY B 84 10.738 -2.303 5.347 1.00 52.45 H new ATOM 0 HA3 GLY B 84 9.058 -1.811 5.262 1.00 52.45 H new ATOM 3225 N ILE B 85 10.868 -0.606 3.437 1.00 72.33 N ATOM 3226 CA ILE B 85 11.296 0.401 2.482 1.00 70.35 C ATOM 3227 C ILE B 85 10.804 0.017 1.094 1.00 24.30 C ATOM 3228 O ILE B 85 10.933 -1.143 0.681 1.00 65.43 O ATOM 3229 CB ILE B 85 12.845 0.559 2.495 1.00 43.15 C ATOM 3230 CG1 ILE B 85 13.338 1.590 1.449 1.00 73.10 C ATOM 3231 CG2 ILE B 85 13.522 -0.794 2.288 1.00 2.22 C ATOM 3232 CD1 ILE B 85 13.598 1.016 0.067 1.00 22.31 C ATOM 0 H ILE B 85 10.925 -1.561 3.084 1.00 72.33 H new ATOM 0 HA ILE B 85 10.867 1.363 2.762 1.00 70.35 H new ATOM 0 HB ILE B 85 13.124 0.945 3.476 1.00 43.15 H new ATOM 0 HG12 ILE B 85 12.596 2.384 1.364 1.00 73.10 H new ATOM 0 HG13 ILE B 85 14.256 2.049 1.816 1.00 73.10 H new ATOM 0 HG21 ILE B 85 14.604 -0.665 2.300 1.00 2.22 H new ATOM 0 HG22 ILE B 85 13.229 -1.474 3.088 1.00 2.22 H new ATOM 0 HG23 ILE B 85 13.217 -1.210 1.328 1.00 2.22 H new ATOM 0 HD11 ILE B 85 13.939 1.809 -0.598 1.00 22.31 H new ATOM 0 HD12 ILE B 85 14.363 0.243 0.132 1.00 22.31 H new ATOM 0 HD13 ILE B 85 12.678 0.583 -0.326 1.00 22.31 H new ATOM 3244 N GLY B 86 10.229 0.992 0.397 1.00 43.24 N ATOM 3245 CA GLY B 86 9.708 0.777 -0.944 1.00 50.02 C ATOM 3246 C GLY B 86 9.795 2.039 -1.782 1.00 52.30 C ATOM 3247 O GLY B 86 10.092 3.107 -1.248 1.00 42.02 O ATOM 0 H GLY B 86 10.113 1.944 0.744 1.00 43.24 H new ATOM 0 HA2 GLY B 86 10.268 -0.023 -1.429 1.00 50.02 H new ATOM 0 HA3 GLY B 86 8.670 0.449 -0.884 1.00 50.02 H new ATOM 3251 N PRO B 87 9.552 1.953 -3.102 1.00 42.21 N ATOM 3252 CA PRO B 87 9.640 3.107 -4.001 1.00 30.25 C ATOM 3253 C PRO B 87 8.493 4.091 -3.772 1.00 61.30 C ATOM 3254 O PRO B 87 7.320 3.708 -3.789 1.00 52.32 O ATOM 3255 CB PRO B 87 9.556 2.490 -5.414 1.00 44.10 C ATOM 3256 CG PRO B 87 9.672 1.013 -5.213 1.00 14.42 C ATOM 3257 CD PRO B 87 9.154 0.744 -3.829 1.00 45.13 C ATOM 0 HA PRO B 87 10.553 3.680 -3.841 1.00 30.25 H new ATOM 0 HB2 PRO B 87 8.614 2.747 -5.899 1.00 44.10 H new ATOM 0 HB3 PRO B 87 10.356 2.863 -6.053 1.00 44.10 H new ATOM 0 HG2 PRO B 87 9.092 0.470 -5.959 1.00 14.42 H new ATOM 0 HG3 PRO B 87 10.707 0.685 -5.313 1.00 14.42 H new ATOM 0 HD2 PRO B 87 8.073 0.602 -3.820 1.00 45.13 H new ATOM 0 HD3 PRO B 87 9.597 -0.154 -3.397 1.00 45.13 H new ATOM 3265 N ASN B 88 8.841 5.354 -3.562 1.00 53.24 N ATOM 3266 CA ASN B 88 7.857 6.409 -3.344 1.00 21.43 C ATOM 3267 C ASN B 88 7.165 6.746 -4.665 1.00 21.10 C ATOM 3268 O ASN B 88 7.699 6.449 -5.737 1.00 51.23 O ATOM 3269 CB ASN B 88 8.558 7.652 -2.769 1.00 72.30 C ATOM 3270 CG ASN B 88 7.593 8.761 -2.384 1.00 63.22 C ATOM 3271 OD1 ASN B 88 7.239 9.603 -3.205 1.00 5.32 O ATOM 3272 ND2 ASN B 88 7.168 8.772 -1.130 1.00 3.11 N ATOM 0 H ASN B 88 9.809 5.676 -3.538 1.00 53.24 H new ATOM 0 HA ASN B 88 7.104 6.070 -2.633 1.00 21.43 H new ATOM 0 HB2 ASN B 88 9.136 7.362 -1.892 1.00 72.30 H new ATOM 0 HB3 ASN B 88 9.266 8.034 -3.504 1.00 72.30 H new ATOM 0 HD21 ASN B 88 6.523 9.498 -0.816 1.00 3.11 H new ATOM 0 HD22 ASN B 88 7.485 8.055 -0.478 1.00 3.11 H new ATOM 3279 N GLU B 89 5.990 7.369 -4.595 1.00 65.22 N ATOM 3280 CA GLU B 89 5.236 7.726 -5.799 1.00 51.32 C ATOM 3281 C GLU B 89 5.993 8.767 -6.633 1.00 22.42 C ATOM 3282 O GLU B 89 5.694 8.972 -7.809 1.00 11.02 O ATOM 3283 CB GLU B 89 3.835 8.235 -5.427 1.00 62.31 C ATOM 3284 CG GLU B 89 3.825 9.502 -4.575 1.00 11.15 C ATOM 3285 CD GLU B 89 2.419 9.900 -4.144 1.00 24.23 C ATOM 3286 OE1 GLU B 89 1.720 10.584 -4.924 1.00 4.32 O ATOM 3287 OE2 GLU B 89 1.999 9.519 -3.028 1.00 35.35 O1- ATOM 0 H GLU B 89 5.539 7.637 -3.720 1.00 65.22 H new ATOM 0 HA GLU B 89 5.123 6.829 -6.408 1.00 51.32 H new ATOM 0 HB2 GLU B 89 3.276 8.425 -6.344 1.00 62.31 H new ATOM 0 HB3 GLU B 89 3.307 7.447 -4.889 1.00 62.31 H new ATOM 0 HG2 GLU B 89 4.443 9.347 -3.691 1.00 11.15 H new ATOM 0 HG3 GLU B 89 4.275 10.319 -5.139 1.00 11.15 H new ATOM 3294 N GLU B 90 6.973 9.419 -6.009 1.00 52.12 N ATOM 3295 CA GLU B 90 7.865 10.349 -6.706 1.00 15.12 C ATOM 3296 C GLU B 90 8.869 9.584 -7.577 1.00 74.05 C ATOM 3297 O GLU B 90 9.425 10.124 -8.533 1.00 53.12 O ATOM 3298 CB GLU B 90 8.613 11.225 -5.687 1.00 14.23 C ATOM 3299 CG GLU B 90 9.729 12.060 -6.302 1.00 30.33 C ATOM 3300 CD GLU B 90 10.446 12.936 -5.290 1.00 5.15 C ATOM 3301 OE1 GLU B 90 11.328 12.426 -4.565 1.00 54.43 O ATOM 3302 OE2 GLU B 90 10.139 14.145 -5.220 1.00 12.50 O1- ATOM 0 H GLU B 90 7.172 9.320 -5.013 1.00 52.12 H new ATOM 0 HA GLU B 90 7.262 10.988 -7.352 1.00 15.12 H new ATOM 0 HB2 GLU B 90 7.900 11.890 -5.200 1.00 14.23 H new ATOM 0 HB3 GLU B 90 9.034 10.586 -4.911 1.00 14.23 H new ATOM 0 HG2 GLU B 90 10.452 11.396 -6.776 1.00 30.33 H new ATOM 0 HG3 GLU B 90 9.312 12.690 -7.088 1.00 30.33 H new ATOM 3309 N GLY B 91 9.077 8.316 -7.246 1.00 72.20 N ATOM 3310 CA GLY B 91 10.045 7.490 -7.955 1.00 12.11 C ATOM 3311 C GLY B 91 11.323 7.280 -7.161 1.00 71.02 C ATOM 3312 O GLY B 91 12.265 6.644 -7.638 1.00 5.53 O ATOM 0 H GLY B 91 8.588 7.837 -6.490 1.00 72.20 H new ATOM 0 HA2 GLY B 91 9.597 6.522 -8.179 1.00 12.11 H new ATOM 0 HA3 GLY B 91 10.287 7.958 -8.909 1.00 12.11 H new ATOM 3316 N GLY B 92 11.349 7.810 -5.942 1.00 60.34 N ATOM 3317 CA GLY B 92 12.489 7.613 -5.059 1.00 61.32 C ATOM 3318 C GLY B 92 12.222 6.502 -4.069 1.00 12.52 C ATOM 3319 O GLY B 92 11.445 5.594 -4.359 1.00 70.13 O ATOM 0 H GLY B 92 10.598 8.375 -5.547 1.00 60.34 H new ATOM 0 HA2 GLY B 92 13.374 7.374 -5.649 1.00 61.32 H new ATOM 0 HA3 GLY B 92 12.703 8.538 -4.524 1.00 61.32 H new ATOM 3323 N PHE B 93 12.850 6.563 -2.902 1.00 71.13 N ATOM 3324 CA PHE B 93 12.578 5.604 -1.835 1.00 4.00 C ATOM 3325 C PHE B 93 11.683 6.223 -0.769 1.00 73.12 C ATOM 3326 O PHE B 93 11.636 7.447 -0.608 1.00 63.14 O ATOM 3327 CB PHE B 93 13.879 5.093 -1.195 1.00 42.41 C ATOM 3328 CG PHE B 93 14.637 4.097 -2.042 1.00 52.32 C ATOM 3329 CD1 PHE B 93 16.023 4.031 -1.991 1.00 72.40 C ATOM 3330 CD2 PHE B 93 13.962 3.216 -2.881 1.00 72.15 C ATOM 3331 CE1 PHE B 93 16.717 3.114 -2.757 1.00 54.33 C ATOM 3332 CE2 PHE B 93 14.654 2.299 -3.649 1.00 20.53 C ATOM 3333 CZ PHE B 93 16.032 2.248 -3.588 1.00 20.53 C ATOM 0 H PHE B 93 13.551 7.266 -2.669 1.00 71.13 H new ATOM 0 HA PHE B 93 12.061 4.755 -2.283 1.00 4.00 H new ATOM 0 HB2 PHE B 93 14.527 5.944 -0.988 1.00 42.41 H new ATOM 0 HB3 PHE B 93 13.642 4.632 -0.236 1.00 42.41 H new ATOM 0 HD1 PHE B 93 16.565 4.705 -1.344 1.00 72.40 H new ATOM 0 HD2 PHE B 93 12.884 3.249 -2.933 1.00 72.15 H new ATOM 0 HE1 PHE B 93 17.795 3.074 -2.706 1.00 54.33 H new ATOM 0 HE2 PHE B 93 14.117 1.622 -4.297 1.00 20.53 H new ATOM 0 HZ PHE B 93 16.574 1.533 -4.189 1.00 20.53 H new ATOM 3343 N ALA B 94 10.972 5.364 -0.056 1.00 22.42 N ATOM 3344 CA ALA B 94 10.092 5.774 1.025 1.00 62.21 C ATOM 3345 C ALA B 94 10.126 4.726 2.126 1.00 42.21 C ATOM 3346 O ALA B 94 10.160 3.525 1.845 1.00 61.15 O ATOM 3347 CB ALA B 94 8.669 5.970 0.517 1.00 43.22 C ATOM 0 H ALA B 94 10.990 4.356 -0.213 1.00 22.42 H new ATOM 0 HA ALA B 94 10.438 6.727 1.425 1.00 62.21 H new ATOM 0 HB1 ALA B 94 8.027 6.277 1.343 1.00 43.22 H new ATOM 0 HB2 ALA B 94 8.661 6.740 -0.254 1.00 43.22 H new ATOM 0 HB3 ALA B 94 8.300 5.034 0.099 1.00 43.22 H new ATOM 3353 N LEU B 95 10.140 5.181 3.371 1.00 51.40 N ATOM 3354 CA LEU B 95 10.214 4.287 4.521 1.00 52.52 C ATOM 3355 C LEU B 95 8.840 4.100 5.152 1.00 31.45 C ATOM 3356 O LEU B 95 7.988 4.990 5.101 1.00 74.21 O ATOM 3357 CB LEU B 95 11.217 4.818 5.561 1.00 5.44 C ATOM 3358 CG LEU B 95 12.699 4.489 5.283 1.00 70.54 C ATOM 3359 CD1 LEU B 95 12.957 2.990 5.435 1.00 3.52 C ATOM 3360 CD2 LEU B 95 13.117 4.963 3.891 1.00 13.14 C ATOM 0 H LEU B 95 10.101 6.171 3.613 1.00 51.40 H new ATOM 0 HA LEU B 95 10.564 3.316 4.171 1.00 52.52 H new ATOM 0 HB2 LEU B 95 11.109 5.901 5.624 1.00 5.44 H new ATOM 0 HB3 LEU B 95 10.950 4.413 6.537 1.00 5.44 H new ATOM 0 HG LEU B 95 13.302 5.022 6.018 1.00 70.54 H new ATOM 0 HD11 LEU B 95 14.008 2.779 5.235 1.00 3.52 H new ATOM 0 HD12 LEU B 95 12.712 2.680 6.451 1.00 3.52 H new ATOM 0 HD13 LEU B 95 12.336 2.440 4.728 1.00 3.52 H new ATOM 0 HD21 LEU B 95 14.166 4.718 3.723 1.00 13.14 H new ATOM 0 HD22 LEU B 95 12.503 4.468 3.138 1.00 13.14 H new ATOM 0 HD23 LEU B 95 12.980 6.042 3.818 1.00 13.14 H new ATOM 3372 N ASP B 96 8.645 2.923 5.725 1.00 51.23 N ATOM 3373 CA ASP B 96 7.405 2.557 6.406 1.00 11.24 C ATOM 3374 C ASP B 96 7.757 1.825 7.687 1.00 14.30 C ATOM 3375 O ASP B 96 8.250 0.705 7.648 1.00 55.22 O ATOM 3376 CB ASP B 96 6.576 1.635 5.515 1.00 22.11 C ATOM 3377 CG ASP B 96 5.277 1.173 6.164 1.00 4.43 C ATOM 3378 OD1 ASP B 96 5.190 -0.011 6.569 1.00 73.12 O ATOM 3379 OD2 ASP B 96 4.328 1.980 6.264 1.00 73.53 O1- ATOM 0 H ASP B 96 9.348 2.184 5.733 1.00 51.23 H new ATOM 0 HA ASP B 96 6.828 3.455 6.626 1.00 11.24 H new ATOM 0 HB2 ASP B 96 6.344 2.153 4.585 1.00 22.11 H new ATOM 0 HB3 ASP B 96 7.173 0.762 5.253 1.00 22.11 H new ATOM 3384 N VAL B 97 7.511 2.450 8.813 1.00 43.21 N ATOM 3385 CA VAL B 97 7.891 1.870 10.099 1.00 65.34 C ATOM 3386 C VAL B 97 6.685 1.725 11.017 1.00 4.12 C ATOM 3387 O VAL B 97 6.049 2.706 11.389 1.00 1.23 O ATOM 3388 CB VAL B 97 9.009 2.695 10.792 1.00 44.15 C ATOM 3389 CG1 VAL B 97 8.683 4.183 10.781 1.00 31.14 C ATOM 3390 CG2 VAL B 97 9.250 2.202 12.221 1.00 13.32 C ATOM 0 H VAL B 97 7.051 3.358 8.876 1.00 43.21 H new ATOM 0 HA VAL B 97 8.288 0.875 9.897 1.00 65.34 H new ATOM 0 HB VAL B 97 9.928 2.549 10.224 1.00 44.15 H new ATOM 0 HG11 VAL B 97 9.484 4.735 11.273 1.00 31.14 H new ATOM 0 HG12 VAL B 97 8.585 4.526 9.751 1.00 31.14 H new ATOM 0 HG13 VAL B 97 7.746 4.354 11.311 1.00 31.14 H new ATOM 0 HG21 VAL B 97 10.038 2.797 12.683 1.00 13.32 H new ATOM 0 HG22 VAL B 97 8.332 2.303 12.800 1.00 13.32 H new ATOM 0 HG23 VAL B 97 9.552 1.155 12.199 1.00 13.32 H new ATOM 3400 N GLU B 98 6.374 0.486 11.370 1.00 55.41 N ATOM 3401 CA GLU B 98 5.251 0.191 12.245 1.00 61.25 C ATOM 3402 C GLU B 98 5.751 -0.201 13.636 1.00 55.42 C ATOM 3403 O GLU B 98 6.493 -1.178 13.797 1.00 74.01 O ATOM 3404 CB GLU B 98 4.371 -0.914 11.637 1.00 43.20 C ATOM 3405 CG GLU B 98 5.131 -2.173 11.237 1.00 33.43 C ATOM 3406 CD GLU B 98 4.247 -3.199 10.551 1.00 35.25 C ATOM 3407 OE1 GLU B 98 3.613 -4.014 11.257 1.00 70.42 O ATOM 3408 OE2 GLU B 98 4.169 -3.192 9.299 1.00 74.42 O1- ATOM 0 H GLU B 98 6.890 -0.337 11.060 1.00 55.41 H new ATOM 0 HA GLU B 98 4.639 1.087 12.347 1.00 61.25 H new ATOM 0 HB2 GLU B 98 3.598 -1.184 12.357 1.00 43.20 H new ATOM 0 HB3 GLU B 98 3.863 -0.516 10.758 1.00 43.20 H new ATOM 0 HG2 GLU B 98 5.950 -1.902 10.571 1.00 33.43 H new ATOM 0 HG3 GLU B 98 5.578 -2.620 12.125 1.00 33.43 H new ATOM 3415 N LEU B 99 5.363 0.591 14.629 1.00 61.12 N ATOM 3416 CA LEU B 99 5.753 0.357 16.012 1.00 54.24 C ATOM 3417 C LEU B 99 4.654 -0.413 16.728 1.00 51.12 C ATOM 3418 O LEU B 99 3.564 0.118 16.947 1.00 12.44 O ATOM 3419 CB LEU B 99 6.013 1.690 16.732 1.00 60.12 C ATOM 3420 CG LEU B 99 7.103 2.577 16.108 1.00 42.10 C ATOM 3421 CD1 LEU B 99 7.274 3.862 16.913 1.00 24.34 C ATOM 3422 CD2 LEU B 99 8.427 1.822 16.003 1.00 1.13 C ATOM 0 H LEU B 99 4.771 1.411 14.497 1.00 61.12 H new ATOM 0 HA LEU B 99 6.673 -0.227 16.024 1.00 54.24 H new ATOM 0 HB2 LEU B 99 5.081 2.255 16.761 1.00 60.12 H new ATOM 0 HB3 LEU B 99 6.289 1.477 17.765 1.00 60.12 H new ATOM 0 HG LEU B 99 6.788 2.844 15.099 1.00 42.10 H new ATOM 0 HD11 LEU B 99 8.050 4.477 16.456 1.00 24.34 H new ATOM 0 HD12 LEU B 99 6.333 4.413 16.923 1.00 24.34 H new ATOM 0 HD13 LEU B 99 7.561 3.616 17.935 1.00 24.34 H new ATOM 0 HD21 LEU B 99 9.182 2.471 15.559 1.00 1.13 H new ATOM 0 HD22 LEU B 99 8.751 1.516 16.998 1.00 1.13 H new ATOM 0 HD23 LEU B 99 8.294 0.939 15.378 1.00 1.13 H new ATOM 3434 N ARG B 100 4.939 -1.659 17.083 1.00 53.41 N ATOM 3435 CA ARG B 100 3.954 -2.524 17.720 1.00 2.45 C ATOM 3436 C ARG B 100 4.171 -2.542 19.222 1.00 14.01 C ATOM 3437 O ARG B 100 5.192 -3.035 19.705 1.00 24.14 O ATOM 3438 CB ARG B 100 4.046 -3.948 17.164 1.00 53.52 C ATOM 3439 CG ARG B 100 3.861 -4.031 15.656 1.00 13.43 C ATOM 3440 CD ARG B 100 3.922 -5.467 15.170 1.00 64.11 C ATOM 3441 NE ARG B 100 3.819 -5.573 13.712 1.00 3.43 N ATOM 3442 CZ ARG B 100 3.444 -6.677 13.066 1.00 52.33 C ATOM 3443 NH1 ARG B 100 3.021 -7.739 13.741 1.00 41.53 N1+ ATOM 3444 NH2 ARG B 100 3.467 -6.708 11.743 1.00 11.32 N ATOM 0 H ARG B 100 5.850 -2.095 16.940 1.00 53.41 H new ATOM 0 HA ARG B 100 2.960 -2.130 17.506 1.00 2.45 H new ATOM 0 HB2 ARG B 100 5.017 -4.368 17.425 1.00 53.52 H new ATOM 0 HB3 ARG B 100 3.290 -4.567 17.648 1.00 53.52 H new ATOM 0 HG2 ARG B 100 2.902 -3.592 15.381 1.00 13.43 H new ATOM 0 HG3 ARG B 100 4.634 -3.444 15.160 1.00 13.43 H new ATOM 0 HD2 ARG B 100 4.858 -5.918 15.498 1.00 64.11 H new ATOM 0 HD3 ARG B 100 3.115 -6.037 15.630 1.00 64.11 H new ATOM 0 HE ARG B 100 4.049 -4.749 13.156 1.00 3.43 H new ATOM 0 HH11 ARG B 100 2.982 -7.713 14.760 1.00 41.53 H new ATOM 0 HH12 ARG B 100 2.735 -8.581 13.241 1.00 41.53 H new ATOM 0 HH21 ARG B 100 3.771 -5.888 11.219 1.00 11.32 H new ATOM 0 HH22 ARG B 100 3.180 -7.552 11.248 1.00 11.32 H new ATOM 3458 N VAL B 101 3.212 -1.994 19.951 1.00 41.00 N ATOM 3459 CA VAL B 101 3.313 -1.873 21.396 1.00 50.20 C ATOM 3460 C VAL B 101 2.558 -3.003 22.081 1.00 3.30 C ATOM 3461 O VAL B 101 1.331 -3.063 22.010 1.00 1.54 O ATOM 3462 CB VAL B 101 2.752 -0.515 21.876 1.00 60.12 C ATOM 3463 CG1 VAL B 101 2.734 -0.432 23.402 1.00 22.35 C ATOM 3464 CG2 VAL B 101 3.561 0.634 21.276 1.00 51.31 C ATOM 0 H VAL B 101 2.346 -1.622 19.560 1.00 41.00 H new ATOM 0 HA VAL B 101 4.368 -1.933 21.661 1.00 50.20 H new ATOM 0 HB VAL B 101 1.722 -0.430 21.531 1.00 60.12 H new ATOM 0 HG11 VAL B 101 2.334 0.534 23.709 1.00 22.35 H new ATOM 0 HG12 VAL B 101 2.106 -1.228 23.802 1.00 22.35 H new ATOM 0 HG13 VAL B 101 3.749 -0.543 23.784 1.00 22.35 H new ATOM 0 HG21 VAL B 101 3.155 1.584 21.622 1.00 51.31 H new ATOM 0 HG22 VAL B 101 4.602 0.548 21.589 1.00 51.31 H new ATOM 0 HG23 VAL B 101 3.504 0.590 20.188 1.00 51.31 H new ATOM 3474 N ALA B 102 3.297 -3.899 22.726 1.00 24.03 N ATOM 3475 CA ALA B 102 2.699 -4.997 23.470 1.00 53.32 C ATOM 3476 C ALA B 102 2.985 -4.836 24.958 1.00 44.40 C ATOM 3477 O ALA B 102 4.090 -5.128 25.428 1.00 4.42 O ATOM 3478 CB ALA B 102 3.228 -6.334 22.959 1.00 42.24 C ATOM 0 H ALA B 102 4.317 -3.884 22.747 1.00 24.03 H new ATOM 0 HA ALA B 102 1.619 -4.979 23.321 1.00 53.32 H new ATOM 0 HB1 ALA B 102 2.772 -7.146 23.525 1.00 42.24 H new ATOM 0 HB2 ALA B 102 2.980 -6.444 21.903 1.00 42.24 H new ATOM 0 HB3 ALA B 102 4.310 -6.369 23.083 1.00 42.24 H new ATOM 3484 N LEU B 103 1.990 -4.358 25.689 1.00 61.44 N ATOM 3485 CA LEU B 103 2.105 -4.174 27.130 1.00 72.24 C ATOM 3486 C LEU B 103 1.147 -5.138 27.824 1.00 41.41 C ATOM 3487 O LEU B 103 -0.062 -5.094 27.581 1.00 40.11 O ATOM 3488 CB LEU B 103 1.783 -2.718 27.517 1.00 55.34 C ATOM 3489 CG LEU B 103 2.066 -2.340 28.985 1.00 34.43 C ATOM 3490 CD1 LEU B 103 3.558 -2.402 29.281 1.00 40.33 C ATOM 3491 CD2 LEU B 103 1.518 -0.951 29.310 1.00 1.40 C ATOM 0 H LEU B 103 1.085 -4.088 25.305 1.00 61.44 H new ATOM 0 HA LEU B 103 3.127 -4.383 27.446 1.00 72.24 H new ATOM 0 HB2 LEU B 103 2.359 -2.054 26.872 1.00 55.34 H new ATOM 0 HB3 LEU B 103 0.730 -2.530 27.309 1.00 55.34 H new ATOM 0 HG LEU B 103 1.556 -3.065 29.619 1.00 34.43 H new ATOM 0 HD11 LEU B 103 3.734 -2.131 30.322 1.00 40.33 H new ATOM 0 HD12 LEU B 103 3.923 -3.414 29.102 1.00 40.33 H new ATOM 0 HD13 LEU B 103 4.087 -1.705 28.631 1.00 40.33 H new ATOM 0 HD21 LEU B 103 1.731 -0.710 30.351 1.00 1.40 H new ATOM 0 HD22 LEU B 103 1.991 -0.213 28.662 1.00 1.40 H new ATOM 0 HD23 LEU B 103 0.440 -0.938 29.148 1.00 1.40 H new ATOM 3503 N PRO B 104 1.663 -6.038 28.677 1.00 3.11 N ATOM 3504 CA PRO B 104 0.840 -7.057 29.320 1.00 24.44 C ATOM 3505 C PRO B 104 -0.105 -6.458 30.353 1.00 5.10 C ATOM 3506 O PRO B 104 0.235 -5.497 31.046 1.00 15.44 O ATOM 3507 CB PRO B 104 1.855 -7.994 29.975 1.00 10.11 C ATOM 3508 CG PRO B 104 3.082 -7.175 30.168 1.00 31.23 C ATOM 3509 CD PRO B 104 3.073 -6.119 29.093 1.00 74.24 C ATOM 0 HA PRO B 104 0.191 -7.568 28.609 1.00 24.44 H new ATOM 0 HB2 PRO B 104 1.482 -8.374 30.926 1.00 10.11 H new ATOM 0 HB3 PRO B 104 2.056 -8.859 29.343 1.00 10.11 H new ATOM 0 HG2 PRO B 104 3.091 -6.719 31.158 1.00 31.23 H new ATOM 0 HG3 PRO B 104 3.976 -7.794 30.094 1.00 31.23 H new ATOM 0 HD2 PRO B 104 3.432 -5.162 29.472 1.00 74.24 H new ATOM 0 HD3 PRO B 104 3.719 -6.394 28.259 1.00 74.24 H new ATOM 3517 N GLY B 105 -1.292 -7.038 30.440 1.00 72.34 N ATOM 3518 CA GLY B 105 -2.315 -6.529 31.332 1.00 21.00 C ATOM 3519 C GLY B 105 -2.916 -5.219 30.846 1.00 53.31 C ATOM 3520 O GLY B 105 -3.586 -4.515 31.603 1.00 21.33 O ATOM 0 H GLY B 105 -1.568 -7.860 29.903 1.00 72.34 H new ATOM 0 HA2 GLY B 105 -3.106 -7.272 31.433 1.00 21.00 H new ATOM 0 HA3 GLY B 105 -1.887 -6.382 32.324 1.00 21.00 H new ATOM 3524 N LEU B 106 -2.676 -4.893 29.577 1.00 45.40 N ATOM 3525 CA LEU B 106 -3.176 -3.653 28.981 1.00 45.21 C ATOM 3526 C LEU B 106 -4.121 -3.944 27.816 1.00 60.53 C ATOM 3527 O LEU B 106 -3.883 -4.856 27.019 1.00 55.33 O ATOM 3528 CB LEU B 106 -2.005 -2.776 28.502 1.00 22.13 C ATOM 3529 CG LEU B 106 -2.393 -1.572 27.620 1.00 5.55 C ATOM 3530 CD1 LEU B 106 -3.300 -0.603 28.374 1.00 53.52 C ATOM 3531 CD2 LEU B 106 -1.152 -0.853 27.104 1.00 55.01 C ATOM 0 H LEU B 106 -2.135 -5.474 28.937 1.00 45.40 H new ATOM 0 HA LEU B 106 -3.733 -3.115 29.748 1.00 45.21 H new ATOM 0 HB2 LEU B 106 -1.470 -2.406 29.377 1.00 22.13 H new ATOM 0 HB3 LEU B 106 -1.309 -3.403 27.945 1.00 22.13 H new ATOM 0 HG LEU B 106 -2.948 -1.955 26.764 1.00 5.55 H new ATOM 0 HD11 LEU B 106 -3.556 0.235 27.726 1.00 53.52 H new ATOM 0 HD12 LEU B 106 -4.211 -1.119 28.677 1.00 53.52 H new ATOM 0 HD13 LEU B 106 -2.781 -0.232 29.258 1.00 53.52 H new ATOM 0 HD21 LEU B 106 -1.452 -0.008 26.485 1.00 55.01 H new ATOM 0 HD22 LEU B 106 -0.563 -0.493 27.948 1.00 55.01 H new ATOM 0 HD23 LEU B 106 -0.552 -1.543 26.510 1.00 55.01 H new ATOM 3543 N ASP B 107 -5.197 -3.165 27.740 1.00 0.12 N ATOM 3544 CA ASP B 107 -6.136 -3.222 26.620 1.00 50.41 C ATOM 3545 C ASP B 107 -5.660 -2.326 25.485 1.00 24.13 C ATOM 3546 O ASP B 107 -5.053 -1.280 25.727 1.00 45.41 O ATOM 3547 CB ASP B 107 -7.540 -2.772 27.055 1.00 1.44 C ATOM 3548 CG ASP B 107 -8.354 -3.881 27.702 1.00 20.21 C ATOM 3549 OD1 ASP B 107 -8.858 -3.679 28.830 1.00 63.12 O ATOM 3550 OD2 ASP B 107 -8.512 -4.954 27.080 1.00 14.11 O1- ATOM 0 H ASP B 107 -5.443 -2.477 28.451 1.00 0.12 H new ATOM 0 HA ASP B 107 -6.182 -4.256 26.279 1.00 50.41 H new ATOM 0 HB2 ASP B 107 -7.447 -1.943 27.756 1.00 1.44 H new ATOM 0 HB3 ASP B 107 -8.079 -2.395 26.186 1.00 1.44 H new ATOM 3555 N ALA B 108 -5.966 -2.718 24.254 1.00 12.24 N ATOM 3556 CA ALA B 108 -5.588 -1.938 23.081 1.00 21.33 C ATOM 3557 C ALA B 108 -6.237 -0.555 23.120 1.00 4.44 C ATOM 3558 O ALA B 108 -5.613 0.445 22.767 1.00 12.01 O ATOM 3559 CB ALA B 108 -5.976 -2.674 21.807 1.00 34.32 C ATOM 0 H ALA B 108 -6.477 -3.575 24.041 1.00 12.24 H new ATOM 0 HA ALA B 108 -4.506 -1.807 23.090 1.00 21.33 H new ATOM 0 HB1 ALA B 108 -5.687 -2.079 20.941 1.00 34.32 H new ATOM 0 HB2 ALA B 108 -5.465 -3.636 21.773 1.00 34.32 H new ATOM 0 HB3 ALA B 108 -7.054 -2.835 21.794 1.00 34.32 H new ATOM 3565 N ALA B 109 -7.490 -0.511 23.575 1.00 61.34 N ATOM 3566 CA ALA B 109 -8.246 0.740 23.662 1.00 64.51 C ATOM 3567 C ALA B 109 -7.499 1.787 24.493 1.00 34.40 C ATOM 3568 O ALA B 109 -7.456 2.968 24.136 1.00 22.24 O ATOM 3569 CB ALA B 109 -9.627 0.478 24.253 1.00 34.53 C ATOM 0 H ALA B 109 -8.006 -1.332 23.891 1.00 61.34 H new ATOM 0 HA ALA B 109 -8.360 1.137 22.653 1.00 64.51 H new ATOM 0 HB1 ALA B 109 -10.181 1.415 24.313 1.00 34.53 H new ATOM 0 HB2 ALA B 109 -10.168 -0.223 23.617 1.00 34.53 H new ATOM 0 HB3 ALA B 109 -9.521 0.054 25.252 1.00 34.53 H new ATOM 3575 N ALA B 110 -6.920 1.353 25.607 1.00 13.42 N ATOM 3576 CA ALA B 110 -6.129 2.237 26.459 1.00 72.03 C ATOM 3577 C ALA B 110 -4.748 2.456 25.851 1.00 4.25 C ATOM 3578 O ALA B 110 -4.196 3.565 25.885 1.00 22.41 O ATOM 3579 CB ALA B 110 -6.019 1.661 27.867 1.00 4.12 C ATOM 0 H ALA B 110 -6.983 0.392 25.943 1.00 13.42 H new ATOM 0 HA ALA B 110 -6.631 3.202 26.527 1.00 72.03 H new ATOM 0 HB1 ALA B 110 -5.427 2.332 28.489 1.00 4.12 H new ATOM 0 HB2 ALA B 110 -7.016 1.554 28.295 1.00 4.12 H new ATOM 0 HB3 ALA B 110 -5.536 0.685 27.824 1.00 4.12 H new ATOM 3585 N ALA B 111 -4.206 1.391 25.269 1.00 64.14 N ATOM 3586 CA ALA B 111 -2.899 1.441 24.628 1.00 51.51 C ATOM 3587 C ALA B 111 -2.862 2.526 23.557 1.00 2.23 C ATOM 3588 O ALA B 111 -1.842 3.184 23.367 1.00 42.41 O ATOM 3589 CB ALA B 111 -2.549 0.083 24.034 1.00 4.22 C ATOM 0 H ALA B 111 -4.657 0.477 25.229 1.00 64.14 H new ATOM 0 HA ALA B 111 -2.154 1.690 25.384 1.00 51.51 H new ATOM 0 HB1 ALA B 111 -1.570 0.135 23.558 1.00 4.22 H new ATOM 0 HB2 ALA B 111 -2.528 -0.666 24.826 1.00 4.22 H new ATOM 0 HB3 ALA B 111 -3.298 -0.194 23.292 1.00 4.22 H new ATOM 3595 N LYS B 112 -3.992 2.722 22.875 1.00 32.30 N ATOM 3596 CA LYS B 112 -4.110 3.758 21.851 1.00 34.20 C ATOM 3597 C LYS B 112 -3.705 5.118 22.411 1.00 24.41 C ATOM 3598 O LYS B 112 -2.890 5.824 21.815 1.00 32.01 O ATOM 3599 CB LYS B 112 -5.551 3.826 21.317 1.00 45.31 C ATOM 3600 CG LYS B 112 -5.988 2.584 20.545 1.00 74.45 C ATOM 3601 CD LYS B 112 -5.313 2.479 19.177 1.00 63.04 C ATOM 3602 CE LYS B 112 -5.777 3.580 18.226 1.00 72.33 C ATOM 3603 NZ LYS B 112 -5.333 3.335 16.827 1.00 62.21 N1+ ATOM 0 H LYS B 112 -4.841 2.174 23.015 1.00 32.30 H new ATOM 0 HA LYS B 112 -3.439 3.500 21.032 1.00 34.20 H new ATOM 0 HB2 LYS B 112 -6.231 3.978 22.155 1.00 45.31 H new ATOM 0 HB3 LYS B 112 -5.646 4.696 20.668 1.00 45.31 H new ATOM 0 HG2 LYS B 112 -5.755 1.695 21.131 1.00 74.45 H new ATOM 0 HG3 LYS B 112 -7.070 2.604 20.413 1.00 74.45 H new ATOM 0 HD2 LYS B 112 -4.232 2.538 19.300 1.00 63.04 H new ATOM 0 HD3 LYS B 112 -5.531 1.505 18.739 1.00 63.04 H new ATOM 0 HE2 LYS B 112 -6.865 3.648 18.254 1.00 72.33 H new ATOM 0 HE3 LYS B 112 -5.389 4.540 18.566 1.00 72.33 H new ATOM 0 HZ1 LYS B 112 -5.670 4.106 16.216 1.00 62.21 H new ATOM 0 HZ2 LYS B 112 -4.294 3.296 16.794 1.00 62.21 H new ATOM 0 HZ3 LYS B 112 -5.724 2.432 16.492 1.00 62.21 H new ATOM 3617 N THR B 113 -4.259 5.470 23.569 1.00 71.03 N ATOM 3618 CA THR B 113 -3.993 6.769 24.173 1.00 12.30 C ATOM 3619 C THR B 113 -2.592 6.795 24.783 1.00 72.03 C ATOM 3620 O THR B 113 -1.903 7.813 24.730 1.00 34.03 O ATOM 3621 CB THR B 113 -5.052 7.146 25.250 1.00 51.23 C ATOM 3622 OG1 THR B 113 -5.146 8.572 25.369 1.00 15.33 O ATOM 3623 CG2 THR B 113 -4.706 6.565 26.615 1.00 55.23 C ATOM 0 H THR B 113 -4.892 4.875 24.104 1.00 71.03 H new ATOM 0 HA THR B 113 -4.056 7.512 23.378 1.00 12.30 H new ATOM 0 HB THR B 113 -6.004 6.727 24.925 1.00 51.23 H new ATOM 0 HG1 THR B 113 -5.815 8.800 26.047 1.00 15.33 H new ATOM 0 HG21 THR B 113 -5.471 6.852 27.337 1.00 55.23 H new ATOM 0 HG22 THR B 113 -4.661 5.478 26.547 1.00 55.23 H new ATOM 0 HG23 THR B 113 -3.739 6.949 26.939 1.00 55.23 H new ATOM 3631 N LEU B 114 -2.166 5.663 25.351 1.00 42.02 N ATOM 3632 CA LEU B 114 -0.852 5.582 25.987 1.00 34.43 C ATOM 3633 C LEU B 114 0.258 5.807 24.961 1.00 70.23 C ATOM 3634 O LEU B 114 1.191 6.582 25.196 1.00 14.10 O ATOM 3635 CB LEU B 114 -0.665 4.230 26.692 1.00 61.41 C ATOM 3636 CG LEU B 114 -1.699 3.914 27.790 1.00 44.12 C ATOM 3637 CD1 LEU B 114 -1.334 2.633 28.535 1.00 65.44 C ATOM 3638 CD2 LEU B 114 -1.839 5.090 28.757 1.00 20.12 C ATOM 0 H LEU B 114 -2.707 4.799 25.383 1.00 42.02 H new ATOM 0 HA LEU B 114 -0.793 6.369 26.739 1.00 34.43 H new ATOM 0 HB2 LEU B 114 -0.702 3.439 25.943 1.00 61.41 H new ATOM 0 HB3 LEU B 114 0.331 4.204 27.135 1.00 61.41 H new ATOM 0 HG LEU B 114 -2.664 3.755 27.309 1.00 44.12 H new ATOM 0 HD11 LEU B 114 -2.080 2.434 29.304 1.00 65.44 H new ATOM 0 HD12 LEU B 114 -1.305 1.800 27.833 1.00 65.44 H new ATOM 0 HD13 LEU B 114 -0.355 2.749 29.001 1.00 65.44 H new ATOM 0 HD21 LEU B 114 -2.574 4.845 29.524 1.00 20.12 H new ATOM 0 HD22 LEU B 114 -0.877 5.291 29.228 1.00 20.12 H new ATOM 0 HD23 LEU B 114 -2.166 5.974 28.210 1.00 20.12 H new ATOM 3650 N VAL B 115 0.137 5.143 23.818 1.00 61.11 N ATOM 3651 CA VAL B 115 1.105 5.285 22.739 1.00 23.35 C ATOM 3652 C VAL B 115 1.013 6.680 22.127 1.00 63.55 C ATOM 3653 O VAL B 115 2.029 7.275 21.760 1.00 10.54 O ATOM 3654 CB VAL B 115 0.888 4.213 21.639 1.00 32.23 C ATOM 3655 CG1 VAL B 115 1.918 4.357 20.519 1.00 53.51 C ATOM 3656 CG2 VAL B 115 0.937 2.809 22.241 1.00 32.34 C ATOM 0 H VAL B 115 -0.626 4.498 23.614 1.00 61.11 H new ATOM 0 HA VAL B 115 2.099 5.141 23.163 1.00 23.35 H new ATOM 0 HB VAL B 115 -0.100 4.369 21.206 1.00 32.23 H new ATOM 0 HG11 VAL B 115 1.742 3.593 19.762 1.00 53.51 H new ATOM 0 HG12 VAL B 115 1.827 5.344 20.066 1.00 53.51 H new ATOM 0 HG13 VAL B 115 2.921 4.237 20.929 1.00 53.51 H new ATOM 0 HG21 VAL B 115 0.783 2.070 21.454 1.00 32.34 H new ATOM 0 HG22 VAL B 115 1.909 2.646 22.706 1.00 32.34 H new ATOM 0 HG23 VAL B 115 0.154 2.708 22.992 1.00 32.34 H new ATOM 3666 N ASP B 116 -0.208 7.202 22.040 1.00 33.05 N ATOM 3667 CA ASP B 116 -0.440 8.534 21.484 1.00 4.03 C ATOM 3668 C ASP B 116 0.327 9.587 22.274 1.00 43.14 C ATOM 3669 O ASP B 116 1.075 10.386 21.700 1.00 21.31 O ATOM 3670 CB ASP B 116 -1.932 8.886 21.498 1.00 75.43 C ATOM 3671 CG ASP B 116 -2.217 10.219 20.813 1.00 20.42 C ATOM 3672 OD1 ASP B 116 -2.396 11.236 21.517 1.00 45.35 O ATOM 3673 OD2 ASP B 116 -2.253 10.260 19.559 1.00 32.45 O1- ATOM 0 H ASP B 116 -1.054 6.722 22.348 1.00 33.05 H new ATOM 0 HA ASP B 116 -0.087 8.523 20.453 1.00 4.03 H new ATOM 0 HB2 ASP B 116 -2.494 8.096 21.000 1.00 75.43 H new ATOM 0 HB3 ASP B 116 -2.284 8.927 22.529 1.00 75.43 H new ATOM 3678 N ARG B 117 0.144 9.572 23.594 1.00 65.05 N ATOM 3679 CA ARG B 117 0.770 10.556 24.462 1.00 30.34 C ATOM 3680 C ARG B 117 2.281 10.332 24.536 1.00 41.22 C ATOM 3681 O ARG B 117 3.055 11.273 24.381 1.00 22.44 O ATOM 3682 CB ARG B 117 0.146 10.508 25.866 1.00 5.33 C ATOM 3683 CG ARG B 117 0.196 9.126 26.501 1.00 52.02 C ATOM 3684 CD ARG B 117 -0.576 9.053 27.809 1.00 70.20 C ATOM 3685 NE ARG B 117 0.078 9.817 28.881 1.00 35.41 N ATOM 3686 CZ ARG B 117 0.167 9.419 30.154 1.00 33.14 C ATOM 3687 NH1 ARG B 117 -0.340 8.250 30.533 1.00 12.31 N1+ ATOM 3688 NH2 ARG B 117 0.772 10.195 31.047 1.00 12.43 N ATOM 0 H ARG B 117 -0.434 8.887 24.081 1.00 65.05 H new ATOM 0 HA ARG B 117 0.595 11.545 24.040 1.00 30.34 H new ATOM 0 HB2 ARG B 117 0.666 11.216 26.511 1.00 5.33 H new ATOM 0 HB3 ARG B 117 -0.892 10.835 25.806 1.00 5.33 H new ATOM 0 HG2 ARG B 117 -0.211 8.395 25.802 1.00 52.02 H new ATOM 0 HG3 ARG B 117 1.235 8.851 26.681 1.00 52.02 H new ATOM 0 HD2 ARG B 117 -1.585 9.436 27.656 1.00 70.20 H new ATOM 0 HD3 ARG B 117 -0.673 8.011 28.114 1.00 70.20 H new ATOM 0 HE ARG B 117 0.494 10.716 28.636 1.00 35.41 H new ATOM 0 HH11 ARG B 117 -0.801 7.649 29.850 1.00 12.31 H new ATOM 0 HH12 ARG B 117 -0.268 7.954 31.506 1.00 12.31 H new ATOM 0 HH21 ARG B 117 1.166 11.091 30.760 1.00 12.43 H new ATOM 0 HH22 ARG B 117 0.842 9.895 32.019 1.00 12.43 H new ATOM 3702 N ALA B 118 2.699 9.080 24.739 1.00 61.11 N ATOM 3703 CA ALA B 118 4.120 8.759 24.893 1.00 4.01 C ATOM 3704 C ALA B 118 4.907 9.146 23.642 1.00 4.12 C ATOM 3705 O ALA B 118 5.962 9.777 23.722 1.00 22.32 O ATOM 3706 CB ALA B 118 4.300 7.275 25.204 1.00 4.44 C ATOM 0 H ALA B 118 2.076 8.275 24.800 1.00 61.11 H new ATOM 0 HA ALA B 118 4.511 9.339 25.729 1.00 4.01 H new ATOM 0 HB1 ALA B 118 5.361 7.053 25.315 1.00 4.44 H new ATOM 0 HB2 ALA B 118 3.779 7.032 26.130 1.00 4.44 H new ATOM 0 HB3 ALA B 118 3.888 6.680 24.389 1.00 4.44 H new ATOM 3712 N HIS B 119 4.357 8.798 22.483 1.00 53.54 N ATOM 3713 CA HIS B 119 5.009 9.058 21.198 1.00 31.05 C ATOM 3714 C HIS B 119 4.906 10.543 20.829 1.00 22.51 C ATOM 3715 O HIS B 119 5.394 10.969 19.781 1.00 73.21 O ATOM 3716 CB HIS B 119 4.361 8.175 20.116 1.00 24.30 C ATOM 3717 CG HIS B 119 5.106 8.106 18.813 1.00 50.32 C ATOM 3718 ND1 HIS B 119 6.184 7.269 18.603 1.00 33.22 N ATOM 3719 CD2 HIS B 119 4.894 8.736 17.634 1.00 55.12 C ATOM 3720 CE1 HIS B 119 6.596 7.386 17.354 1.00 74.31 C ATOM 3721 NE2 HIS B 119 5.831 8.268 16.747 1.00 22.51 N ATOM 0 H HIS B 119 3.454 8.331 22.405 1.00 53.54 H new ATOM 0 HA HIS B 119 6.068 8.812 21.273 1.00 31.05 H new ATOM 0 HB2 HIS B 119 4.256 7.164 20.510 1.00 24.30 H new ATOM 0 HB3 HIS B 119 3.355 8.547 19.921 1.00 24.30 H new ATOM 0 HD1 HIS B 119 6.598 6.655 19.304 1.00 33.22 H new ATOM 0 HD2 HIS B 119 4.129 9.471 17.429 1.00 55.12 H new ATOM 0 HE1 HIS B 119 7.420 6.850 16.907 1.00 74.31 H new ATOM 0 HE2 HIS B 119 5.920 8.558 15.773 1.00 22.51 H new ATOM 3730 N HIS B 120 4.245 11.319 21.691 1.00 35.12 N ATOM 3731 CA HIS B 120 4.086 12.759 21.487 1.00 61.52 C ATOM 3732 C HIS B 120 4.939 13.555 22.478 1.00 22.12 C ATOM 3733 O HIS B 120 5.552 14.556 22.113 1.00 21.30 O ATOM 3734 CB HIS B 120 2.611 13.151 21.638 1.00 61.10 C ATOM 3735 CG HIS B 120 2.312 14.579 21.284 1.00 45.20 C ATOM 3736 ND1 HIS B 120 1.962 15.532 22.213 1.00 23.40 N ATOM 3737 CD2 HIS B 120 2.294 15.208 20.083 1.00 61.34 C ATOM 3738 CE1 HIS B 120 1.742 16.680 21.603 1.00 14.23 C ATOM 3739 NE2 HIS B 120 1.938 16.513 20.310 1.00 33.30 N ATOM 0 H HIS B 120 3.808 10.969 22.544 1.00 35.12 H new ATOM 0 HA HIS B 120 4.423 12.997 20.478 1.00 61.52 H new ATOM 0 HB2 HIS B 120 2.007 12.498 21.007 1.00 61.10 H new ATOM 0 HB3 HIS B 120 2.303 12.972 22.668 1.00 61.10 H new ATOM 0 HD2 HIS B 120 2.519 14.764 19.125 1.00 61.34 H new ATOM 0 HE1 HIS B 120 1.450 17.603 22.082 1.00 14.23 H new ATOM 0 HE2 HIS B 120 1.841 17.235 19.596 1.00 33.30 H new ATOM 3748 N VAL B 121 4.975 13.100 23.733 1.00 53.34 N ATOM 3749 CA VAL B 121 5.610 13.860 24.816 1.00 2.11 C ATOM 3750 C VAL B 121 7.076 13.474 25.016 1.00 31.12 C ATOM 3751 O VAL B 121 7.869 14.286 25.495 1.00 43.14 O ATOM 3752 CB VAL B 121 4.854 13.685 26.161 1.00 52.03 C ATOM 3753 CG1 VAL B 121 3.397 14.119 26.022 1.00 41.33 C ATOM 3754 CG2 VAL B 121 4.945 12.242 26.664 1.00 63.42 C ATOM 0 H VAL B 121 4.572 12.210 24.026 1.00 53.34 H new ATOM 0 HA VAL B 121 5.564 14.905 24.509 1.00 2.11 H new ATOM 0 HB VAL B 121 5.334 14.327 26.900 1.00 52.03 H new ATOM 0 HG11 VAL B 121 2.886 13.988 26.976 1.00 41.33 H new ATOM 0 HG12 VAL B 121 3.356 15.168 25.729 1.00 41.33 H new ATOM 0 HG13 VAL B 121 2.907 13.511 25.261 1.00 41.33 H new ATOM 0 HG21 VAL B 121 4.406 12.151 27.607 1.00 63.42 H new ATOM 0 HG22 VAL B 121 4.503 11.571 25.927 1.00 63.42 H new ATOM 0 HG23 VAL B 121 5.991 11.975 26.816 1.00 63.42 H new ATOM 3764 N CYS B 122 7.439 12.244 24.655 1.00 64.23 N ATOM 3765 CA CYS B 122 8.814 11.773 24.835 1.00 24.42 C ATOM 3766 C CYS B 122 9.294 10.944 23.637 1.00 23.34 C ATOM 3767 O CYS B 122 9.662 9.777 23.784 1.00 74.53 O ATOM 3768 CB CYS B 122 8.921 10.960 26.132 1.00 15.34 C ATOM 3769 SG CYS B 122 8.422 11.878 27.608 1.00 14.44 S ATOM 0 H CYS B 122 6.807 11.560 24.239 1.00 64.23 H new ATOM 0 HA CYS B 122 9.463 12.646 24.903 1.00 24.42 H new ATOM 0 HB2 CYS B 122 8.302 10.068 26.043 1.00 15.34 H new ATOM 0 HB3 CYS B 122 9.950 10.623 26.255 1.00 15.34 H new ATOM 0 HG CYS B 122 8.922 11.307 28.664 1.00 14.44 H new ATOM 3775 N PRO B 123 9.277 11.528 22.420 1.00 45.45 N ATOM 3776 CA PRO B 123 9.819 10.901 21.228 1.00 1.30 C ATOM 3777 C PRO B 123 11.204 11.454 20.878 1.00 21.43 C ATOM 3778 O PRO B 123 11.803 12.191 21.662 1.00 1.12 O ATOM 3779 CB PRO B 123 8.789 11.324 20.183 1.00 65.25 C ATOM 3780 CG PRO B 123 8.368 12.706 20.605 1.00 12.41 C ATOM 3781 CD PRO B 123 8.702 12.842 22.081 1.00 30.51 C ATOM 0 HA PRO B 123 9.964 9.825 21.320 1.00 1.30 H new ATOM 0 HB2 PRO B 123 9.219 11.329 19.181 1.00 65.25 H new ATOM 0 HB3 PRO B 123 7.941 10.640 20.162 1.00 65.25 H new ATOM 0 HG2 PRO B 123 8.890 13.463 20.020 1.00 12.41 H new ATOM 0 HG3 PRO B 123 7.301 12.852 20.436 1.00 12.41 H new ATOM 0 HD2 PRO B 123 9.411 13.650 22.260 1.00 30.51 H new ATOM 0 HD3 PRO B 123 7.815 13.059 22.676 1.00 30.51 H new ATOM 3789 N TYR B 124 11.706 11.098 19.701 1.00 44.15 N ATOM 3790 CA TYR B 124 12.941 11.686 19.185 1.00 41.53 C ATOM 3791 C TYR B 124 12.635 13.023 18.509 1.00 41.03 C ATOM 3792 O TYR B 124 13.535 13.821 18.252 1.00 24.42 O ATOM 3793 CB TYR B 124 13.639 10.718 18.208 1.00 11.44 C ATOM 3794 CG TYR B 124 14.483 9.654 18.897 1.00 34.02 C ATOM 3795 CD1 TYR B 124 15.581 9.076 18.257 1.00 62.34 C ATOM 3796 CD2 TYR B 124 14.203 9.248 20.199 1.00 4.11 C ATOM 3797 CE1 TYR B 124 16.361 8.131 18.893 1.00 22.14 C ATOM 3798 CE2 TYR B 124 14.979 8.299 20.835 1.00 2.53 C ATOM 3799 CZ TYR B 124 16.057 7.745 20.179 1.00 65.35 C ATOM 3800 OH TYR B 124 16.837 6.809 20.815 1.00 21.31 O ATOM 0 H TYR B 124 11.279 10.406 19.085 1.00 44.15 H new ATOM 0 HA TYR B 124 13.623 11.865 20.017 1.00 41.53 H new ATOM 0 HB2 TYR B 124 12.883 10.228 17.594 1.00 11.44 H new ATOM 0 HB3 TYR B 124 14.274 11.292 17.534 1.00 11.44 H new ATOM 0 HD1 TYR B 124 15.824 9.373 17.248 1.00 62.34 H new ATOM 0 HD2 TYR B 124 13.364 9.683 20.721 1.00 4.11 H new ATOM 0 HE1 TYR B 124 17.208 7.696 18.383 1.00 22.14 H new ATOM 0 HE2 TYR B 124 14.742 7.992 21.843 1.00 2.53 H new ATOM 0 HH TYR B 124 16.425 6.567 21.671 1.00 21.31 H new ATOM 3810 N SER B 125 11.347 13.248 18.242 1.00 44.35 N ATOM 3811 CA SER B 125 10.859 14.481 17.631 1.00 1.10 C ATOM 3812 C SER B 125 9.358 14.371 17.386 1.00 64.23 C ATOM 3813 O SER B 125 8.820 13.270 17.295 1.00 63.41 O ATOM 3814 CB SER B 125 11.579 14.759 16.299 1.00 3.32 C ATOM 3815 OG SER B 125 11.010 15.871 15.624 1.00 24.10 O ATOM 0 H SER B 125 10.610 12.573 18.446 1.00 44.35 H new ATOM 0 HA SER B 125 11.064 15.307 18.312 1.00 1.10 H new ATOM 0 HB2 SER B 125 12.636 14.948 16.488 1.00 3.32 H new ATOM 0 HB3 SER B 125 11.522 13.877 15.662 1.00 3.32 H new ATOM 0 HG SER B 125 11.529 16.063 14.815 1.00 24.10 H new ATOM 3821 N ASN B 126 8.684 15.511 17.299 1.00 74.24 N ATOM 3822 CA ASN B 126 7.284 15.555 16.870 1.00 34.45 C ATOM 3823 C ASN B 126 7.174 14.978 15.462 1.00 33.32 C ATOM 3824 O ASN B 126 6.178 14.345 15.097 1.00 24.11 O ATOM 3825 CB ASN B 126 6.743 16.996 16.908 1.00 64.21 C ATOM 3826 CG ASN B 126 7.510 17.940 15.994 1.00 24.21 C ATOM 3827 OD1 ASN B 126 8.551 18.564 16.522 1.00 13.11 O flip ATOM 3828 ND2 ASN B 126 7.167 18.108 14.822 1.00 21.23 N flip ATOM 0 H ASN B 126 9.083 16.423 17.520 1.00 74.24 H new ATOM 0 HA ASN B 126 6.682 14.958 17.555 1.00 34.45 H new ATOM 0 HB2 ASN B 126 5.692 16.992 16.619 1.00 64.21 H new ATOM 0 HB3 ASN B 126 6.791 17.370 17.931 1.00 64.21 H new ATOM 0 HD21 ASN B 126 6.359 17.609 14.451 1.00 21.23 H new ATOM 0 HD22 ASN B 126 7.692 18.746 14.224 1.00 21.23 H new ATOM 3835 N ALA B 127 8.238 15.172 14.694 1.00 42.24 N ATOM 3836 CA ALA B 127 8.314 14.720 13.312 1.00 65.30 C ATOM 3837 C ALA B 127 8.389 13.193 13.199 1.00 53.42 C ATOM 3838 O ALA B 127 8.516 12.659 12.101 1.00 63.33 O ATOM 3839 CB ALA B 127 9.528 15.351 12.647 1.00 44.52 C ATOM 0 H ALA B 127 9.079 15.651 15.016 1.00 42.24 H new ATOM 0 HA ALA B 127 7.399 15.032 12.808 1.00 65.30 H new ATOM 0 HB1 ALA B 127 9.591 15.016 11.612 1.00 44.52 H new ATOM 0 HB2 ALA B 127 9.434 16.437 12.672 1.00 44.52 H new ATOM 0 HB3 ALA B 127 10.431 15.053 13.180 1.00 44.52 H new ATOM 3845 N THR B 128 8.248 12.486 14.316 1.00 13.32 N ATOM 3846 CA THR B 128 8.450 11.041 14.333 1.00 55.14 C ATOM 3847 C THR B 128 7.100 10.367 14.189 1.00 13.14 C ATOM 3848 O THR B 128 6.968 9.146 14.287 1.00 21.45 O ATOM 3849 CB THR B 128 9.146 10.570 15.640 1.00 41.45 C ATOM 3850 OG1 THR B 128 9.717 9.265 15.460 1.00 41.22 O ATOM 3851 CG2 THR B 128 8.166 10.524 16.810 1.00 11.25 C ATOM 0 H THR B 128 7.995 12.888 15.219 1.00 13.32 H new ATOM 0 HA THR B 128 9.105 10.768 13.506 1.00 55.14 H new ATOM 0 HB THR B 128 9.931 11.291 15.867 1.00 41.45 H new ATOM 0 HG1 THR B 128 9.075 8.688 14.995 1.00 41.22 H new ATOM 0 HG21 THR B 128 8.687 10.191 17.708 1.00 11.25 H new ATOM 0 HG22 THR B 128 7.753 11.519 16.978 1.00 11.25 H new ATOM 0 HG23 THR B 128 7.358 9.830 16.580 1.00 11.25 H new ATOM 3859 N ARG B 129 6.083 11.194 13.997 1.00 41.51 N ATOM 3860 CA ARG B 129 4.733 10.710 13.804 1.00 75.21 C ATOM 3861 C ARG B 129 4.048 11.444 12.656 1.00 73.32 C ATOM 3862 O ARG B 129 3.515 10.825 11.736 1.00 44.41 O ATOM 3863 CB ARG B 129 3.942 10.865 15.111 1.00 21.01 C ATOM 3864 CG ARG B 129 3.869 12.283 15.669 1.00 45.10 C ATOM 3865 CD ARG B 129 3.094 12.325 16.982 1.00 21.21 C ATOM 3866 NE ARG B 129 1.739 11.778 16.844 1.00 2.44 N ATOM 3867 CZ ARG B 129 0.944 11.465 17.870 1.00 0.21 C ATOM 3868 NH1 ARG B 129 1.377 11.606 19.117 1.00 5.12 N1+ ATOM 3869 NH2 ARG B 129 -0.280 11.001 17.644 1.00 44.44 N ATOM 0 H ARG B 129 6.173 12.210 13.971 1.00 41.51 H new ATOM 0 HA ARG B 129 4.769 9.654 13.537 1.00 75.21 H new ATOM 0 HB2 ARG B 129 2.926 10.505 14.946 1.00 21.01 H new ATOM 0 HB3 ARG B 129 4.390 10.219 15.866 1.00 21.01 H new ATOM 0 HG2 ARG B 129 4.877 12.666 15.827 1.00 45.10 H new ATOM 0 HG3 ARG B 129 3.390 12.938 14.941 1.00 45.10 H new ATOM 0 HD2 ARG B 129 3.636 11.760 17.740 1.00 21.21 H new ATOM 0 HD3 ARG B 129 3.034 13.355 17.334 1.00 21.21 H new ATOM 0 HE ARG B 129 1.381 11.627 15.901 1.00 2.44 H new ATOM 0 HH11 ARG B 129 2.319 11.954 19.293 1.00 5.12 H new ATOM 0 HH12 ARG B 129 0.767 11.366 19.899 1.00 5.12 H new ATOM 0 HH21 ARG B 129 -0.612 10.884 16.687 1.00 44.44 H new ATOM 0 HH22 ARG B 129 -0.887 10.762 18.428 1.00 44.44 H new ATOM 3883 N ASN B 130 4.070 12.766 12.723 1.00 21.53 N ATOM 3884 CA ASN B 130 3.373 13.606 11.757 1.00 53.34 C ATOM 3885 C ASN B 130 4.142 13.738 10.447 1.00 22.35 C ATOM 3886 O ASN B 130 3.548 13.944 9.386 1.00 70.41 O ATOM 3887 CB ASN B 130 3.110 14.976 12.378 1.00 70.21 C ATOM 3888 CG ASN B 130 2.237 14.863 13.615 1.00 33.52 C ATOM 3889 OD1 ASN B 130 1.306 14.060 13.662 1.00 60.32 O ATOM 3890 ND2 ASN B 130 2.562 15.623 14.638 1.00 74.14 N ATOM 0 H ASN B 130 4.569 13.287 13.445 1.00 21.53 H new ATOM 0 HA ASN B 130 2.424 13.129 11.511 1.00 53.34 H new ATOM 0 HB2 ASN B 130 4.058 15.446 12.641 1.00 70.21 H new ATOM 0 HB3 ASN B 130 2.625 15.622 11.646 1.00 70.21 H new ATOM 0 HD21 ASN B 130 2.035 15.558 15.509 1.00 74.14 H new ATOM 0 HD22 ASN B 130 3.341 16.277 14.560 1.00 74.14 H new ATOM 3897 N ASN B 131 5.462 13.624 10.524 1.00 34.23 N ATOM 3898 CA ASN B 131 6.322 13.825 9.355 1.00 31.43 C ATOM 3899 C ASN B 131 6.715 12.491 8.729 1.00 54.44 C ATOM 3900 O ASN B 131 6.702 12.335 7.505 1.00 13.44 O ATOM 3901 CB ASN B 131 7.584 14.598 9.758 1.00 3.33 C ATOM 3902 CG ASN B 131 8.445 14.989 8.564 1.00 61.21 C ATOM 3903 OD1 ASN B 131 9.360 14.263 8.173 1.00 75.43 O ATOM 3904 ND2 ASN B 131 8.156 16.143 7.977 1.00 34.33 N ATOM 0 H ASN B 131 5.964 13.394 11.381 1.00 34.23 H new ATOM 0 HA ASN B 131 5.762 14.401 8.618 1.00 31.43 H new ATOM 0 HB2 ASN B 131 7.295 15.498 10.302 1.00 3.33 H new ATOM 0 HB3 ASN B 131 8.175 13.988 10.442 1.00 3.33 H new ATOM 0 HD21 ASN B 131 8.699 16.456 7.173 1.00 34.33 H new ATOM 0 HD22 ASN B 131 7.390 16.717 8.330 1.00 34.33 H new ATOM 3911 N VAL B 132 7.046 11.527 9.580 1.00 52.13 N ATOM 3912 CA VAL B 132 7.571 10.240 9.127 1.00 11.30 C ATOM 3913 C VAL B 132 6.473 9.183 9.136 1.00 11.32 C ATOM 3914 O VAL B 132 5.651 9.137 10.053 1.00 35.23 O ATOM 3915 CB VAL B 132 8.761 9.775 10.011 1.00 15.30 C ATOM 3916 CG1 VAL B 132 9.304 8.422 9.544 1.00 32.53 C ATOM 3917 CG2 VAL B 132 9.870 10.830 10.019 1.00 3.12 C ATOM 0 H VAL B 132 6.960 11.611 10.593 1.00 52.13 H new ATOM 0 HA VAL B 132 7.933 10.370 8.107 1.00 11.30 H new ATOM 0 HB VAL B 132 8.394 9.652 11.030 1.00 15.30 H new ATOM 0 HG11 VAL B 132 10.136 8.124 10.182 1.00 32.53 H new ATOM 0 HG12 VAL B 132 8.514 7.673 9.603 1.00 32.53 H new ATOM 0 HG13 VAL B 132 9.649 8.505 8.513 1.00 32.53 H new ATOM 0 HG21 VAL B 132 10.695 10.486 10.643 1.00 3.12 H new ATOM 0 HG22 VAL B 132 10.227 10.990 9.002 1.00 3.12 H new ATOM 0 HG23 VAL B 132 9.479 11.766 10.418 1.00 3.12 H new ATOM 3927 N ALA B 133 6.464 8.345 8.101 1.00 53.04 N ATOM 3928 CA ALA B 133 5.463 7.297 7.959 1.00 53.01 C ATOM 3929 C ALA B 133 5.655 6.216 9.005 1.00 72.23 C ATOM 3930 O ALA B 133 6.308 5.187 8.772 1.00 0.23 O ATOM 3931 CB ALA B 133 5.491 6.719 6.549 1.00 11.23 C ATOM 0 H ALA B 133 7.147 8.375 7.344 1.00 53.04 H new ATOM 0 HA ALA B 133 4.479 7.737 8.122 1.00 53.01 H new ATOM 0 HB1 ALA B 133 4.736 5.937 6.461 1.00 11.23 H new ATOM 0 HB2 ALA B 133 5.281 7.509 5.828 1.00 11.23 H new ATOM 0 HB3 ALA B 133 6.476 6.297 6.348 1.00 11.23 H new ATOM 3937 N VAL B 134 5.108 6.490 10.177 1.00 34.41 N ATOM 3938 CA VAL B 134 5.140 5.559 11.279 1.00 31.34 C ATOM 3939 C VAL B 134 3.730 5.088 11.606 1.00 33.12 C ATOM 3940 O VAL B 134 2.840 5.898 11.875 1.00 12.15 O ATOM 3941 CB VAL B 134 5.760 6.188 12.544 1.00 33.43 C ATOM 3942 CG1 VAL B 134 5.940 5.120 13.611 1.00 61.10 C ATOM 3943 CG2 VAL B 134 7.083 6.880 12.225 1.00 5.41 C ATOM 0 H VAL B 134 4.630 7.367 10.386 1.00 34.41 H new ATOM 0 HA VAL B 134 5.760 4.716 10.972 1.00 31.34 H new ATOM 0 HB VAL B 134 5.082 6.952 12.924 1.00 33.43 H new ATOM 0 HG11 VAL B 134 6.378 5.567 14.503 1.00 61.10 H new ATOM 0 HG12 VAL B 134 4.971 4.688 13.860 1.00 61.10 H new ATOM 0 HG13 VAL B 134 6.600 4.338 13.236 1.00 61.10 H new ATOM 0 HG21 VAL B 134 7.496 7.314 13.136 1.00 5.41 H new ATOM 0 HG22 VAL B 134 7.786 6.152 11.819 1.00 5.41 H new ATOM 0 HG23 VAL B 134 6.914 7.669 11.492 1.00 5.41 H new ATOM 3953 N ARG B 135 3.527 3.784 11.563 1.00 11.21 N ATOM 3954 CA ARG B 135 2.251 3.194 11.926 1.00 24.23 C ATOM 3955 C ARG B 135 2.276 2.782 13.389 1.00 24.22 C ATOM 3956 O ARG B 135 2.938 1.811 13.763 1.00 54.44 O ATOM 3957 CB ARG B 135 1.947 1.987 11.031 1.00 74.32 C ATOM 3958 CG ARG B 135 0.606 1.306 11.305 1.00 34.13 C ATOM 3959 CD ARG B 135 -0.576 2.270 11.176 1.00 2.43 C ATOM 3960 NE ARG B 135 -0.976 2.836 12.469 1.00 1.50 N ATOM 3961 CZ ARG B 135 -1.159 4.138 12.708 1.00 23.13 C ATOM 3962 NH1 ARG B 135 -0.846 5.045 11.787 1.00 1.54 N1+ ATOM 3963 NH2 ARG B 135 -1.622 4.531 13.886 1.00 14.33 N ATOM 0 H ARG B 135 4.236 3.108 11.278 1.00 11.21 H new ATOM 0 HA ARG B 135 1.462 3.932 11.780 1.00 24.23 H new ATOM 0 HB2 ARG B 135 1.968 2.310 9.990 1.00 74.32 H new ATOM 0 HB3 ARG B 135 2.743 1.252 11.153 1.00 74.32 H new ATOM 0 HG2 ARG B 135 0.473 0.478 10.609 1.00 34.13 H new ATOM 0 HG3 ARG B 135 0.616 0.880 12.308 1.00 34.13 H new ATOM 0 HD2 ARG B 135 -0.310 3.078 10.495 1.00 2.43 H new ATOM 0 HD3 ARG B 135 -1.423 1.746 10.734 1.00 2.43 H new ATOM 0 HE ARG B 135 -1.125 2.188 13.242 1.00 1.50 H new ATOM 0 HH11 ARG B 135 -0.463 4.749 10.889 1.00 1.54 H new ATOM 0 HH12 ARG B 135 -0.989 6.037 11.978 1.00 1.54 H new ATOM 0 HH21 ARG B 135 -1.837 3.841 14.606 1.00 14.33 H new ATOM 0 HH22 ARG B 135 -1.763 5.524 14.073 1.00 14.33 H new ATOM 3977 N LEU B 136 1.594 3.553 14.221 1.00 62.51 N ATOM 3978 CA LEU B 136 1.461 3.223 15.624 1.00 72.41 C ATOM 3979 C LEU B 136 0.430 2.127 15.794 1.00 41.21 C ATOM 3980 O LEU B 136 -0.776 2.364 15.714 1.00 33.52 O ATOM 3981 CB LEU B 136 1.099 4.465 16.438 1.00 60.04 C ATOM 3982 CG LEU B 136 2.215 5.512 16.501 1.00 34.22 C ATOM 3983 CD1 LEU B 136 1.779 6.730 17.315 1.00 41.31 C ATOM 3984 CD2 LEU B 136 3.488 4.888 17.075 1.00 0.00 C ATOM 0 H LEU B 136 1.123 4.414 13.944 1.00 62.51 H new ATOM 0 HA LEU B 136 2.416 2.856 15.999 1.00 72.41 H new ATOM 0 HB2 LEU B 136 0.208 4.923 16.007 1.00 60.04 H new ATOM 0 HB3 LEU B 136 0.842 4.160 17.453 1.00 60.04 H new ATOM 0 HG LEU B 136 2.427 5.856 15.489 1.00 34.22 H new ATOM 0 HD11 LEU B 136 2.590 7.458 17.344 1.00 41.31 H new ATOM 0 HD12 LEU B 136 0.902 7.182 16.852 1.00 41.31 H new ATOM 0 HD13 LEU B 136 1.534 6.420 18.331 1.00 41.31 H new ATOM 0 HD21 LEU B 136 4.276 5.640 17.116 1.00 0.00 H new ATOM 0 HD22 LEU B 136 3.289 4.516 18.080 1.00 0.00 H new ATOM 0 HD23 LEU B 136 3.807 4.063 16.439 1.00 0.00 H new ATOM 3996 N VAL B 137 0.932 0.924 15.991 1.00 22.01 N ATOM 3997 CA VAL B 137 0.106 -0.264 16.112 1.00 61.13 C ATOM 3998 C VAL B 137 0.195 -0.821 17.529 1.00 31.22 C ATOM 3999 O VAL B 137 1.253 -1.248 17.988 1.00 63.04 O ATOM 4000 CB VAL B 137 0.506 -1.335 15.052 1.00 72.22 C ATOM 4001 CG1 VAL B 137 1.990 -1.235 14.712 1.00 20.11 C ATOM 4002 CG2 VAL B 137 0.156 -2.750 15.520 1.00 5.14 C ATOM 0 H VAL B 137 1.932 0.741 16.072 1.00 22.01 H new ATOM 0 HA VAL B 137 -0.931 0.010 15.917 1.00 61.13 H new ATOM 0 HB VAL B 137 -0.071 -1.132 14.150 1.00 72.22 H new ATOM 0 HG11 VAL B 137 2.245 -1.992 13.971 1.00 20.11 H new ATOM 0 HG12 VAL B 137 2.205 -0.245 14.309 1.00 20.11 H new ATOM 0 HG13 VAL B 137 2.581 -1.396 15.613 1.00 20.11 H new ATOM 0 HG21 VAL B 137 0.449 -3.469 14.755 1.00 5.14 H new ATOM 0 HG22 VAL B 137 0.687 -2.969 16.447 1.00 5.14 H new ATOM 0 HG23 VAL B 137 -0.918 -2.821 15.692 1.00 5.14 H new ATOM 4012 N VAL B 138 -0.927 -0.776 18.221 1.00 51.04 N ATOM 4013 CA VAL B 138 -1.017 -1.245 19.594 1.00 24.22 C ATOM 4014 C VAL B 138 -1.554 -2.669 19.605 1.00 70.52 C ATOM 4015 O VAL B 138 -2.442 -3.018 18.814 1.00 62.24 O ATOM 4016 CB VAL B 138 -1.909 -0.335 20.469 1.00 51.45 C ATOM 4017 CG1 VAL B 138 -1.569 1.134 20.241 1.00 13.13 C ATOM 4018 CG2 VAL B 138 -3.379 -0.615 20.213 1.00 0.20 C ATOM 0 H VAL B 138 -1.804 -0.413 17.848 1.00 51.04 H new ATOM 0 HA VAL B 138 -0.015 -1.217 20.022 1.00 24.22 H new ATOM 0 HB VAL B 138 -1.710 -0.560 21.517 1.00 51.45 H new ATOM 0 HG11 VAL B 138 -2.208 1.757 20.867 1.00 13.13 H new ATOM 0 HG12 VAL B 138 -0.525 1.310 20.500 1.00 13.13 H new ATOM 0 HG13 VAL B 138 -1.730 1.386 19.193 1.00 13.13 H new ATOM 0 HG21 VAL B 138 -3.988 0.037 20.839 1.00 0.20 H new ATOM 0 HG22 VAL B 138 -3.608 -0.427 19.164 1.00 0.20 H new ATOM 0 HG23 VAL B 138 -3.598 -1.656 20.452 1.00 0.20 H new ATOM 4028 N ALA B 139 -0.973 -3.494 20.450 1.00 41.23 N ATOM 4029 CA ALA B 139 -1.308 -4.915 20.502 1.00 52.34 C ATOM 4030 C ALA B 139 -2.561 -5.150 21.354 1.00 22.31 C ATOM 4031 O ALA B 139 -3.667 -5.253 20.776 1.00 10.42 O ATOM 4032 CB ALA B 139 -0.124 -5.720 21.034 1.00 71.35 C ATOM 4033 OXT ALA B 139 -2.436 -5.229 22.592 1.00 0.00 O1- ATOM 0 H ALA B 139 -0.258 -3.208 21.119 1.00 41.23 H new ATOM 0 HA ALA B 139 -1.526 -5.256 19.490 1.00 52.34 H new ATOM 0 HB1 ALA B 139 -0.388 -6.777 21.067 1.00 71.35 H new ATOM 0 HB2 ALA B 139 0.735 -5.581 20.377 1.00 71.35 H new ATOM 0 HB3 ALA B 139 0.127 -5.377 22.038 1.00 71.35 H new TER 4039 ALA B 139