#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2efi s SER 2 N 0.00 4.27 -0.20 1.61 0.01 -1.26 -5.00 113.70 113.14 2efi s SER 2 Ca 0.00 -0.36 -0.19 0.00 1.31 0.00 0.00 55.95 56.71 2efi s SER 2 Cb 0.00 -1.72 -0.20 0.00 0.21 0.00 0.00 66.02 64.31 2efi s SER 2 CO 0.00 0.03 0.21 -1.20 0.41 0.00 0.00 173.24 172.69 2efi n SER 3 N 4.48 1.90 0.00 2.44 7.64 -1.26 -5.10 113.62 123.73 2efi n SER 3 Ca -0.18 0.38 0.00 0.00 1.01 0.00 0.00 58.87 60.08 2efi n SER 3 Cb 0.51 -0.94 0.00 0.00 -1.01 0.00 0.00 64.21 62.77 2efi n SER 3 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2efi n GLY 4 N 1.51 0.15 0.07 0.23 0.00 -1.26 -4.68 105.19 101.21 2efi n GLY 4 Ca -0.33 -1.90 -0.11 0.00 0.00 0.00 0.00 46.02 43.67 2efi n GLY 4 CO 0.00 0.00 0.00 1.48 0.00 0.00 0.00 173.32 174.80 2efi h SER 5 N 0.00 -0.01 -5.34 1.61 4.64 -2.07 -3.48 113.55 108.90 2efi h SER 5 Ca 0.00 -0.76 -0.35 0.00 -0.47 0.00 0.00 61.79 60.21 2efi h SER 5 Cb 0.00 0.00 0.13 0.00 -0.31 0.00 0.00 62.40 62.22 2efi h SER 5 CO 0.00 0.84 -0.62 -0.24 -0.87 0.00 0.00 176.83 175.94 2efi n SER 6 N -4.68 -5.34 -2.68 4.97 2.88 -1.26 -4.93 113.62 102.58 2efi n SER 6 Ca -0.08 -0.50 -0.05 0.00 -1.33 0.00 0.00 58.87 56.91 2efi n SER 6 Cb 0.37 -4.58 0.08 0.00 -0.75 0.00 0.00 64.21 59.33 2efi n SER 6 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2efi n GLY 7 N -1.75 -1.31 2.47 0.46 0.00 -1.26 -5.03 105.19 98.77 2efi n GLY 7 Ca -0.03 0.80 -0.18 0.00 0.00 0.00 0.00 46.02 46.60 2efi n GLY 7 CO 0.00 0.00 0.00 1.15 0.00 0.00 0.00 173.32 174.47 2efi n MET 8 N 1.34 2.70 -1.54 1.61 0.00 -1.26 -5.09 117.12 114.89 2efi n MET 8 Ca 0.02 -4.00 -0.55 0.00 0.00 0.00 0.00 57.70 53.17 2efi n MET 8 Cb 0.70 -1.93 -0.07 0.00 0.00 0.00 0.00 33.22 31.92 2efi n MET 8 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175.97 175.97 2efi n ALA 9 N -0.45 -2.28 0.82 3.17 0.00 -1.26 -4.79 120.51 115.71 2efi n ALA 9 Ca 0.29 0.55 0.08 0.00 0.00 0.00 0.00 53.44 54.35 2efi n ALA 9 Cb 0.79 -1.91 0.41 0.00 0.00 0.00 0.00 19.45 18.74 2efi n ALA 9 CO 0.00 0.00 0.00 -0.35 0.00 0.00 0.00 177.50 177.15 2efi n PRO 10 N 1.93 0.33 -4.02 0.00 -0.04 -1.26 -4.60 135.00 127.33 2efi n PRO 10 Ca 0.19 0.09 -0.35 0.00 -0.04 0.00 0.00 63.50 63.38 2efi n PRO 10 Cb 0.15 -1.50 -0.13 0.00 -0.04 0.00 0.00 33.50 31.98 2efi n PRO 10 CO 0.00 0.00 0.00 0.15 -0.04 0.00 0.00 175.50 175.61 2efi s LYS 11 N -2.34 3.60 -0.96 0.54 1.02 -1.26 -5.01 119.74 115.33 2efi s LYS 11 Ca 0.18 -0.52 -0.24 0.00 0.02 0.00 0.00 55.97 55.41 2efi s LYS 11 Cb 0.10 -3.10 -0.15 0.00 -0.52 0.00 0.00 37.83 34.16 2efi s LYS 11 CO 0.21 -0.03 1.92 1.04 -0.92 0.00 0.00 175.35 177.57 2efi n GLN 12 N 4.37 1.27 -4.38 1.68 1.13 -1.26 -4.88 117.38 115.31 2efi n GLN 12 Ca -0.17 -2.08 -0.30 0.00 -1.94 0.00 0.00 57.00 52.50 2efi n GLN 12 Cb 0.52 -3.42 -0.11 0.00 0.11 0.00 0.00 30.24 27.34 2efi n GLN 12 CO 0.00 0.00 0.00 -0.51 -1.44 0.00 0.00 177.06 175.11 2efi s ASP 13 N 6.32 4.10 0.66 1.08 1.01 -1.26 -5.12 116.67 123.45 2efi s ASP 13 Ca 0.67 -0.44 -0.15 0.00 0.71 0.00 0.00 52.55 53.34 2efi s ASP 13 Cb 0.05 -0.70 -0.00 0.00 1.01 0.00 0.00 42.92 43.27 2efi s ASP 13 CO 0.16 0.21 1.11 -2.16 0.21 0.00 0.00 175.17 174.69 2efi s PRO 14 N -1.94 2.80 -0.11 8.23 0.04 -1.26 -5.05 135.00 137.72 2efi s PRO 14 Ca 0.18 1.39 -0.05 0.00 0.04 0.00 0.00 61.00 62.57 2efi s PRO 14 Cb -0.11 -1.95 -0.04 0.00 0.04 0.00 0.00 34.50 32.45 2efi s PRO 14 CO 0.10 -1.25 0.08 0.21 0.04 0.00 0.00 177.00 176.18 2efi s LYS 15 N -4.09 3.27 0.88 4.56 2.20 -1.26 -5.01 119.74 120.29 2efi s LYS 15 Ca 0.67 -0.26 -0.11 0.00 -0.36 0.00 0.00 55.97 55.91 2efi s LYS 15 Cb -0.21 -3.02 0.12 0.00 -1.51 0.00 0.00 37.83 33.21 2efi s LYS 15 CO 0.41 0.73 1.09 -1.25 -0.36 0.00 0.00 175.35 175.97 2efi s PRO 16 N -0.91 1.39 -0.21 4.03 0.04 -1.26 -5.02 135.00 133.06 2efi s PRO 16 Ca 0.14 0.87 -0.05 0.00 0.04 0.00 0.00 61.00 62.00 2efi s PRO 16 Cb -0.12 -1.82 -0.11 0.00 0.04 0.00 0.00 34.50 32.49 2efi s PRO 16 CO 0.03 -2.16 -0.23 1.63 0.04 0.00 0.00 177.00 176.31 2efi n LYS 17 N -3.84 0.47 -2.39 4.56 5.02 -1.26 -5.01 118.16 115.71 2efi n LYS 17 Ca 0.07 0.16 -0.28 0.00 -2.02 0.00 0.00 58.31 56.24 2efi n LYS 17 Cb 0.55 -1.32 0.01 0.00 -0.02 0.00 0.00 35.03 34.25 2efi n LYS 17 CO 0.00 0.00 0.00 -0.06 -0.52 0.00 0.00 177.40 176.82 2efi s PHE 18 N -2.39 3.48 0.28 2.13 0.40 -1.26 -5.10 117.98 115.52 2efi s PHE 18 Ca -0.28 0.87 0.12 0.00 -0.60 0.00 0.00 56.93 57.03 2efi s PHE 18 Cb 0.09 -2.54 -0.05 0.00 0.51 0.00 0.00 43.02 41.03 2efi s PHE 18 CO 0.41 -0.55 -0.19 1.14 0.70 0.00 0.00 175.22 176.73 2efi s GLN 19 N -4.92 1.71 -0.07 0.44 -2.07 -1.26 -5.05 119.66 108.44 2efi s GLN 19 Ca 0.51 -1.77 -0.30 0.00 -1.82 0.00 0.00 55.36 51.98 2efi s GLN 19 Cb -0.11 -1.78 -0.04 0.00 -1.09 0.00 0.00 33.01 30.00 2efi s GLN 19 CO 0.47 0.32 1.40 -1.21 -1.32 0.00 0.00 175.29 174.95 2efi s GLU 20 N -3.52 4.25 0.00 9.60 2.02 -1.26 -2.75 118.70 127.04 2efi s GLU 20 Ca 0.30 1.90 0.00 0.00 0.02 0.00 0.00 54.97 57.19 2efi s GLU 20 Cb -0.05 -3.72 0.00 0.00 0.10 0.00 0.00 34.13 30.46 2efi s GLU 20 CO 0.15 -0.67 0.00 0.41 0.02 0.00 0.00 175.26 175.18 2efi n GLY 21 N 3.72 2.52 3.73 -1.39 0.00 0.87 -5.01 105.19 109.64 2efi n GLY 21 Ca 0.14 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.75 2efi n GLY 21 CO 0.00 0.00 0.00 1.85 0.00 0.00 0.00 173.32 175.17 2efi s GLU 22 N -0.35 4.73 0.54 1.61 2.56 -1.11 -4.81 118.70 121.87 2efi s GLU 22 Ca 0.00 1.45 -0.22 0.00 0.00 0.00 0.00 54.97 56.20 2efi s GLU 22 Cb 0.00 -3.35 -0.05 0.00 2.00 0.00 0.00 34.13 32.73 2efi s GLU 22 CO 0.00 0.29 1.31 0.50 -0.56 0.00 0.00 175.26 176.80 2efi s ARG 23 N -0.28 3.22 0.12 4.30 6.06 -1.26 -2.20 118.95 128.91 2efi s ARG 23 Ca 0.45 2.12 -0.24 0.00 -2.50 0.00 0.00 55.73 55.56 2efi s ARG 23 Cb -0.24 -2.25 0.07 0.00 0.06 0.00 0.00 34.95 32.59 2efi s ARG 23 CO 0.30 -1.09 0.64 0.14 -2.50 0.00 0.00 175.30 172.80 2efi s VAL 24 N -1.37 0.00 -0.20 7.11 -7.23 -0.49 -4.19 120.40 114.04 2efi s VAL 24 Ca 0.71 0.00 -0.06 0.00 -1.81 0.00 0.00 61.98 60.82 2efi s VAL 24 Cb -0.38 -1.00 -0.03 0.00 0.56 0.00 0.00 36.38 35.53 2efi s VAL 24 CO 0.44 0.00 0.03 -0.76 -0.31 0.00 0.00 175.10 174.50 2efi s LEU 25 N -2.59 3.44 -0.04 1.32 1.43 -1.24 -2.20 118.68 118.81 2efi s LEU 25 Ca 0.01 -0.13 -0.04 0.00 -1.03 0.00 0.00 54.13 52.94 2efi s LEU 25 Cb -0.01 -1.88 -0.04 0.00 0.03 0.00 0.00 46.19 44.29 2efi s LEU 25 CO -0.11 0.08 0.15 0.00 0.23 0.00 0.00 176.35 176.70 2efi s PHE 27 N -1.20 2.97 -0.14 0.00 0.08 -1.01 -2.78 117.98 115.89 2efi s PHE 27 Ca 0.23 -0.39 0.17 0.00 0.12 0.00 0.00 56.93 57.05 2efi s PHE 27 Cb -0.12 -3.70 -0.07 0.00 -0.57 0.00 0.00 43.02 38.55 2efi s PHE 27 CO 0.13 -1.13 1.01 1.25 -0.10 0.00 0.00 175.22 176.38 2efi h HIS 28 N 9.09 0.00 0.00 0.36 -0.00 -1.93 -3.50 115.15 119.17 2efi h HIS 28 Ca -0.27 0.00 0.00 0.00 -0.00 0.00 0.00 60.37 60.10 2efi h HIS 28 Cb 1.09 0.00 0.00 0.00 -0.00 0.00 0.00 27.41 28.50 2efi h HIS 28 CO 0.80 0.50 0.00 0.41 -0.00 0.00 0.00 177.93 179.64 2efi n GLY 29 N 1.33 -0.43 0.00 5.26 0.00 -1.26 -4.94 105.19 105.15 2efi n GLY 29 Ca -0.06 0.25 0.07 0.00 0.00 0.00 0.00 46.02 46.28 2efi n GLY 29 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2efi n PRO 30 N 0.00 0.49 -4.12 1.61 -0.04 -1.26 -4.76 135.00 126.92 2efi n PRO 30 Ca 0.00 0.00 -0.14 0.00 -0.04 0.00 0.00 63.50 63.32 2efi n PRO 30 Cb 0.00 -1.42 -0.06 0.00 -0.04 0.00 0.00 33.50 31.98 2efi n PRO 30 CO 0.00 0.00 0.00 -0.51 -0.04 0.00 0.00 175.50 174.95 2efi s LEU 31 N -1.84 1.02 0.15 1.53 1.43 -1.26 -4.97 118.68 114.73 2efi s LEU 31 Ca 0.20 -1.42 0.09 0.00 -1.03 0.00 0.00 54.13 51.97 2efi s LEU 31 Cb 0.09 1.23 -0.04 0.00 0.03 0.00 0.00 46.19 47.50 2efi s LEU 31 CO 0.15 -1.17 -0.13 -0.76 0.23 0.00 0.00 176.35 174.67 2efi s LEU 32 N -3.21 2.87 0.09 1.79 1.43 -1.26 -3.52 118.68 116.88 2efi s LEU 32 Ca 0.32 -0.55 0.05 0.00 -1.03 0.00 0.00 54.13 52.92 2efi s LEU 32 Cb 0.01 -1.63 -0.03 0.00 0.03 0.00 0.00 46.19 44.56 2efi s LEU 32 CO 0.18 0.14 -0.13 -0.31 0.23 0.00 0.00 176.35 176.47 2efi s TYR 33 N -1.43 1.18 0.12 0.29 1.51 -1.12 -4.86 117.35 113.04 2efi s TYR 33 Ca 0.22 -0.53 -0.30 0.00 -1.01 0.00 0.00 57.07 55.44 2efi s TYR 33 Cb -0.10 -0.65 -0.06 0.00 -0.11 0.00 0.00 41.96 41.04 2efi s TYR 33 CO 0.13 0.05 1.09 -2.00 -1.11 0.00 0.00 175.55 173.71 2efi s GLU 34 N -2.21 4.57 0.39 -0.62 2.12 -1.26 -2.90 118.70 118.79 2efi s GLU 34 Ca 0.02 1.66 -0.15 0.00 0.36 0.00 0.00 54.97 56.86 2efi s GLU 34 Cb -0.07 -3.33 0.05 0.00 0.26 0.00 0.00 34.13 31.05 2efi s GLU 34 CO 0.02 0.01 0.78 0.00 -0.54 0.00 0.00 175.26 175.52 2efi s ALA 35 N 0.22 -0.64 -0.03 6.30 0.00 -0.93 -2.62 121.76 124.06 2efi s ALA 35 Ca 0.51 -0.82 -0.08 0.00 0.00 0.00 0.00 51.96 51.58 2efi s ALA 35 Cb -0.28 0.69 0.01 0.00 0.00 0.00 0.00 23.12 23.54 2efi s ALA 35 CO 0.32 -0.97 0.17 0.21 0.00 0.00 0.00 175.76 175.49 2efi s LYS 36 N -2.25 0.40 -0.19 0.00 2.36 -1.24 -1.39 119.74 117.42 2efi s LYS 36 Ca 0.16 -0.13 -0.29 0.00 -2.55 0.00 0.00 55.97 53.17 2efi s LYS 36 Cb -0.05 0.17 -0.05 0.00 -1.05 0.00 0.00 37.83 36.86 2efi s LYS 36 CO 0.12 -0.09 1.95 0.00 1.55 0.00 0.00 175.35 178.88 2efi n VAL 38 N 6.94 1.67 -3.89 0.00 0.31 0.20 -0.09 118.33 123.47 2efi n VAL 38 Ca 0.24 -0.57 -0.09 0.00 -0.01 0.00 0.00 64.34 63.90 2efi n VAL 38 Cb 0.45 -1.67 -0.07 0.00 -0.91 0.00 0.00 33.84 31.64 2efi n VAL 38 CO 0.00 0.00 0.00 -0.54 -1.32 0.00 0.00 176.83 174.97 2efi s LYS 39 N -2.53 1.04 -0.30 5.55 1.02 -1.13 -4.79 119.74 118.60 2efi s LYS 39 Ca -0.27 -1.05 -0.02 0.00 0.02 0.00 0.00 55.97 54.65 2efi s LYS 39 Cb 0.08 0.37 0.10 0.00 -0.52 0.00 0.00 37.83 37.86 2efi s LYS 39 CO 0.69 -0.37 0.10 0.08 -0.92 0.00 0.00 175.35 174.93 2efi s VAL 40 N -3.91 0.64 0.32 3.17 1.01 -1.26 -0.44 120.40 119.93 2efi s VAL 40 Ca 0.11 -1.19 0.08 0.00 0.00 0.00 0.00 61.98 60.98 2efi s VAL 40 Cb 0.04 -1.47 -0.04 0.00 0.00 0.00 0.00 36.38 34.91 2efi s VAL 40 CO -0.05 -0.65 0.17 0.00 0.00 0.00 0.00 175.10 174.57 2efi s ALA 41 N 1.74 3.56 -0.04 5.51 0.00 -0.60 -4.97 121.76 126.96 2efi s ALA 41 Ca 0.09 -1.70 -0.02 0.00 0.00 0.00 0.00 51.96 50.33 2efi s ALA 41 Cb -0.17 -0.93 0.03 0.00 0.00 0.00 0.00 23.12 22.05 2efi s ALA 41 CO -0.26 0.09 0.05 0.42 0.00 0.00 0.00 175.76 176.06 2efi s ILE 42 N -2.34 -0.08 0.29 0.00 1.01 -1.26 0.16 121.20 118.98 2efi s ILE 42 Ca 0.37 0.40 -0.15 0.00 0.00 0.00 0.00 60.65 61.27 2efi s ILE 42 Cb -0.05 -0.17 0.01 0.00 0.01 0.00 0.00 42.46 42.27 2efi s ILE 42 CO 0.24 0.18 0.61 -0.54 0.00 0.00 0.00 174.94 175.43 2efi s LYS 43 N 2.09 1.78 -1.48 2.79 1.02 -0.39 -4.93 119.74 120.62 2efi s LYS 43 Ca 0.04 -1.25 -0.17 0.00 0.02 0.00 0.00 55.97 54.61 2efi s LYS 43 Cb -0.12 0.54 0.17 0.00 -0.52 0.00 0.00 37.83 37.90 2efi s LYS 43 CO -0.03 -0.79 0.53 -0.25 -0.92 0.00 0.00 175.35 173.89 2efi n ASP 44 N -0.69 -2.25 -3.78 2.83 9.92 -1.26 0.10 116.55 121.42 2efi n ASP 44 Ca -0.03 -0.82 -0.27 0.00 -0.53 0.00 0.00 54.79 53.14 2efi n ASP 44 Cb 0.61 -1.93 0.04 0.00 -0.64 0.00 0.00 41.12 39.20 2efi n ASP 44 CO 0.00 0.00 0.00 0.29 0.13 0.00 0.00 177.20 177.62 2efi n LYS 45 N -3.84 -6.15 -3.70 -1.24 4.76 -1.26 -4.98 118.16 101.75 2efi n LYS 45 Ca 0.08 0.67 -0.13 0.00 -2.87 0.00 0.00 58.31 56.06 2efi n LYS 45 Cb 0.48 -5.57 -0.09 0.00 -1.84 0.00 0.00 35.03 28.00 2efi n LYS 45 CO 0.00 0.00 0.00 1.14 -1.37 0.00 0.00 177.40 177.17 2efi s GLN 46 N -6.39 0.58 -0.24 1.97 -2.07 0.29 -5.09 119.66 108.71 2efi s GLN 46 Ca 0.52 0.70 -0.20 0.00 -1.82 0.00 0.00 55.36 54.56 2efi s GLN 46 Cb -0.25 0.28 -0.02 0.00 -1.09 0.00 0.00 33.01 31.93 2efi s GLN 46 CO 0.80 -0.07 0.61 0.08 -1.32 0.00 0.00 175.29 175.38 2efi s VAL 47 N 0.27 5.01 0.33 3.63 1.01 -1.26 -1.26 120.40 128.14 2efi s VAL 47 Ca -0.00 1.10 0.08 0.00 0.00 0.00 0.00 61.98 63.16 2efi s VAL 47 Cb -0.03 -3.92 -0.04 0.00 0.00 0.00 0.00 36.38 32.39 2efi s VAL 47 CO 0.01 0.07 0.17 -0.54 0.00 0.00 0.00 175.10 174.81 2efi s LYS 48 N 2.26 2.48 -0.11 2.72 -0.14 0.12 -2.26 119.74 124.82 2efi s LYS 48 Ca 0.26 -1.46 -0.04 0.00 -1.36 0.00 0.00 55.97 53.37 2efi s LYS 48 Cb -0.16 -2.27 0.05 0.00 -1.68 0.00 0.00 37.83 33.78 2efi s LYS 48 CO 0.09 0.13 0.22 0.71 -0.76 0.00 0.00 175.35 175.75 2efi s TYR 49 N -2.38 -0.32 -0.60 3.18 1.51 0.23 -1.56 117.35 117.42 2efi s TYR 49 Ca 0.38 0.79 -0.27 0.00 -1.01 0.00 0.00 57.07 56.96 2efi s TYR 49 Cb -0.04 -0.05 -0.01 0.00 -0.11 0.00 0.00 41.96 41.74 2efi s TYR 49 CO 0.24 -0.28 1.76 0.12 -1.11 0.00 0.00 175.55 176.28 2efi s PHE 50 N 1.87 1.78 0.42 2.71 5.36 0.42 -1.85 117.98 128.69 2efi s PHE 50 Ca -0.03 0.67 -0.14 0.00 -0.96 0.00 0.00 56.93 56.46 2efi s PHE 50 Cb -0.11 -4.17 -0.08 0.00 -0.34 0.00 0.00 43.02 38.31 2efi s PHE 50 CO -0.08 -2.31 0.84 0.42 -1.46 0.00 0.00 175.22 172.63 2efi s ILE 51 N 8.33 4.65 -0.38 3.12 -1.09 -0.90 0.62 121.20 135.55 2efi s ILE 51 Ca 0.64 0.96 0.01 0.00 -2.23 0.00 0.00 60.65 60.03 2efi s ILE 51 Cb -0.13 -3.68 0.12 0.00 -1.58 0.00 0.00 42.46 37.19 2efi s ILE 51 CO 0.21 -0.46 0.16 -2.28 -1.23 0.00 0.00 174.94 171.35 2efi s HIS 52 N -2.32 2.02 -0.20 3.97 5.65 -1.13 -3.74 115.29 119.54 2efi s HIS 52 Ca 0.55 -2.19 -0.31 0.00 0.25 0.00 0.00 55.06 53.37 2efi s HIS 52 Cb -0.10 -1.91 -0.08 0.00 -1.18 0.00 0.00 32.58 29.32 2efi s HIS 52 CO 0.26 -0.84 2.15 0.66 -0.65 0.00 0.00 174.74 176.32 2efi n TYR 53 N 4.15 1.99 -1.08 3.88 4.02 -1.26 -3.73 117.16 125.13 2efi n TYR 53 Ca 0.04 -0.05 -0.43 0.00 -0.01 0.00 0.00 57.90 57.46 2efi n TYR 53 Cb 0.38 -2.68 -0.06 0.00 -0.02 0.00 0.00 39.34 36.96 2efi n TYR 53 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2efi n SER 54 N 10.19 0.01 0.00 7.72 2.88 -1.08 -4.18 113.62 129.16 2efi n SER 54 Ca 0.31 0.83 0.00 0.00 -1.33 0.00 0.00 58.87 58.68 2efi n SER 54 Cb 0.37 -0.66 0.00 0.00 -0.75 0.00 0.00 64.21 63.17 2efi n SER 54 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42 2efi n GLY 55 N 1.12 2.75 0.34 0.46 0.00 -1.26 -4.90 105.19 103.69 2efi n GLY 55 Ca 0.15 -0.52 0.14 0.00 0.00 0.00 0.00 46.02 45.79 2efi n GLY 55 CO 0.00 0.00 0.00 0.11 0.00 0.00 0.00 173.32 173.43 2efi h TRP 56 N 0.00 -0.01 -3.47 1.61 0.09 -2.04 -3.42 115.95 108.71 2efi h TRP 56 Ca 0.00 0.07 -0.44 0.00 0.09 0.00 0.00 58.89 58.60 2efi h TRP 56 Cb 0.00 0.16 -0.14 0.00 0.08 0.00 0.00 29.16 29.27 2efi h TRP 56 CO 0.00 -0.42 -0.56 -0.80 0.09 0.00 0.00 178.44 176.75 2efi s ASN 57 N -5.01 1.88 -0.69 0.11 -0.87 -1.26 -5.06 114.94 104.04 2efi s ASN 57 Ca -0.13 -1.53 -0.32 0.00 -1.57 0.00 0.00 52.86 49.31 2efi s ASN 57 Cb 0.29 0.31 -0.16 0.00 -0.02 0.00 0.00 41.25 41.67 2efi s ASN 57 CO 0.78 -0.83 2.47 0.29 -2.57 0.00 0.00 177.10 177.23 2efi n LYS 58 N -0.65 0.46 -1.87 -0.60 4.01 -1.26 -4.79 118.16 113.46 2efi n LYS 58 Ca -0.01 0.06 -0.41 0.00 -0.51 0.00 0.00 58.31 57.43 2efi n LYS 58 Cb 0.65 -2.16 -0.01 0.00 -0.51 0.00 0.00 35.03 33.01 2efi n LYS 58 CO 0.00 0.00 0.00 0.09 -1.11 0.00 0.00 177.40 176.38 2efi n ASN 59 N 11.36 6.16 -1.31 4.39 4.13 -1.26 -4.40 115.26 134.33 2efi n ASN 59 Ca 0.53 -2.92 -0.12 0.00 1.68 0.00 0.00 54.58 53.74 2efi n ASN 59 Cb 0.19 -1.52 -0.01 0.00 -1.54 0.00 0.00 39.78 36.89 2efi n ASN 59 CO 0.00 0.00 0.00 0.79 0.28 0.00 0.00 177.26 178.33 2efi n TRP 60 N 3.98 -0.48 -1.00 3.10 8.01 -1.26 -4.68 117.44 125.10 2efi n TRP 60 Ca 0.56 0.00 -0.33 0.00 -1.31 0.00 0.00 57.50 56.42 2efi n TRP 60 Cb 0.32 -2.65 -0.01 0.00 -2.01 0.00 0.00 31.31 26.95 2efi n TRP 60 CO 0.00 0.00 0.00 -0.25 -1.01 0.00 0.00 177.69 176.43 2efi n ASP 61 N -0.27 -1.62 -3.94 -0.99 9.92 -1.26 -4.97 116.55 113.41 2efi n ASP 61 Ca -0.14 0.71 -0.08 0.00 -0.53 0.00 0.00 54.79 54.74 2efi n ASP 61 Cb 0.57 -0.68 -0.04 0.00 -0.64 0.00 0.00 41.12 40.33 2efi n ASP 61 CO 0.00 0.00 0.00 -1.83 0.13 0.00 0.00 177.20 175.50 2efi s GLU 62 N -0.75 1.64 -0.09 -1.24 -1.05 -1.25 -5.05 118.70 110.91 2efi s GLU 62 Ca 0.46 -1.16 -0.12 0.00 -0.15 0.00 0.00 54.97 53.99 2efi s GLU 62 Cb -0.57 0.52 -0.05 0.00 -0.44 0.00 0.00 34.13 33.59 2efi s GLU 62 CO 0.45 -0.71 0.30 -1.58 0.95 0.00 0.00 175.26 174.66 2efi s TRP 63 N -3.97 3.60 0.07 4.83 0.52 -1.26 -2.13 118.94 120.59 2efi s TRP 63 Ca 0.18 0.73 0.04 0.00 0.02 0.00 0.00 56.10 57.08 2efi s TRP 63 Cb -0.03 -2.22 -0.03 0.00 -1.15 0.00 0.00 33.47 30.05 2efi s TRP 63 CO 0.08 0.52 -0.13 0.14 0.02 0.00 0.00 176.95 177.59 2efi s VAL 64 N -0.51 1.00 0.89 4.03 -7.23 -0.77 -4.91 120.40 112.90 2efi s VAL 64 Ca 0.19 -1.30 -0.15 0.00 -1.81 0.00 0.00 61.98 58.91 2efi s VAL 64 Cb -0.14 -1.01 0.22 0.00 0.56 0.00 0.00 36.38 36.00 2efi s VAL 64 CO 0.07 -0.28 0.79 -0.81 -0.31 0.00 0.00 175.10 174.56 2efi n PRO 65 N 1.24 -2.56 0.04 4.82 -0.04 -1.26 0.76 135.00 138.00 2efi n PRO 65 Ca -0.21 -1.26 0.14 0.00 -0.04 0.00 0.00 63.50 62.13 2efi n PRO 65 Cb 0.55 -1.18 0.52 0.00 -0.04 0.00 0.00 33.50 33.34 2efi n PRO 65 CO 0.00 0.00 0.00 -1.91 -0.04 0.00 0.00 175.50 173.55 2efi n GLU 66 N -3.91 0.11 0.01 0.54 2.13 -0.96 -3.29 120.64 115.27 2efi n GLU 66 Ca 0.11 0.09 -0.05 0.00 0.66 0.00 0.00 57.16 57.97 2efi n GLU 66 Cb 0.42 -1.63 -0.11 0.00 0.27 0.00 0.00 31.44 30.39 2efi n GLU 66 CO 0.00 0.00 0.00 1.03 -0.41 0.00 0.00 177.13 177.75 2efi h SER 67 N 0.00 0.00 -0.30 4.31 0.87 -1.92 -3.32 113.55 113.20 2efi h SER 67 Ca 0.00 0.00 0.00 0.00 -1.23 0.00 0.00 61.79 60.56 2efi h SER 67 Cb 0.60 0.00 0.00 0.00 -0.44 0.00 0.00 62.40 62.56 2efi h SER 67 CO 0.00 0.82 0.00 0.54 -0.53 0.00 0.00 176.83 177.66 2efi n ARG 68 N -3.01 2.64 -4.74 2.24 1.74 -1.21 -4.83 116.66 109.50 2efi n ARG 68 Ca -0.12 -1.48 -0.24 0.00 -0.77 0.00 0.00 57.85 55.24 2efi n ARG 68 Cb 0.95 -1.73 -0.16 0.00 -1.02 0.00 0.00 32.46 30.50 2efi n ARG 68 CO 0.00 0.00 0.00 0.08 -1.52 0.00 0.00 177.63 176.19 2efi s VAL 69 N -1.78 1.27 0.44 1.55 1.01 -1.25 -2.40 120.40 119.25 2efi s VAL 69 Ca 0.26 -0.65 0.07 0.00 0.00 0.00 0.00 61.98 61.66 2efi s VAL 69 Cb 0.18 -1.08 -0.03 0.00 0.00 0.00 0.00 36.38 35.45 2efi s VAL 69 CO 0.10 0.37 0.26 -0.76 0.00 0.00 0.00 175.10 175.07 2efi s LEU 70 N -0.08 3.09 -0.01 3.92 1.43 -0.63 -4.90 118.68 121.49 2efi s LEU 70 Ca -0.00 -1.04 0.13 0.00 -1.03 0.00 0.00 54.13 52.19 2efi s LEU 70 Cb -0.09 -1.53 0.40 0.00 0.03 0.00 0.00 46.19 45.00 2efi s LEU 70 CO 0.01 -0.68 1.32 0.29 0.23 0.00 0.00 176.35 177.52 2efi n LYS 71 N -1.41 2.14 -3.99 1.70 4.01 -1.26 -3.60 118.16 115.75 2efi n LYS 71 Ca -0.01 -1.63 -0.33 0.00 -0.51 0.00 0.00 58.31 55.84 2efi n LYS 71 Cb 0.64 -1.40 -0.01 0.00 -0.51 0.00 0.00 35.03 33.75 2efi n LYS 71 CO 0.00 0.00 0.00 0.98 -1.11 0.00 0.00 177.40 177.27 2efi n TYR 72 N 0.77 -1.90 -3.98 2.13 9.36 -1.26 -4.82 117.16 117.46 2efi n TYR 72 Ca 0.15 0.77 -0.21 0.00 3.32 0.00 0.00 57.90 61.93 2efi n TYR 72 Cb 0.41 -3.20 -0.03 0.00 -0.63 0.00 0.00 39.34 35.90 2efi n TYR 72 CO 0.00 0.00 0.00 0.14 0.22 0.00 0.00 176.86 177.22 2efi s VAL 73 N -3.22 4.80 0.10 2.97 -7.23 -1.26 -4.87 120.40 111.69 2efi s VAL 73 Ca 0.67 -1.16 -0.19 0.00 -1.81 0.00 0.00 61.98 59.49 2efi s VAL 73 Cb -0.36 -3.63 -0.04 0.00 0.56 0.00 0.00 36.38 32.91 2efi s VAL 73 CO 0.82 -0.32 1.03 -0.90 -0.31 0.00 0.00 175.10 175.43 2efi n ASP 74 N -1.34 -0.65 -0.14 4.85 5.68 -1.26 -0.24 116.55 123.46 2efi n ASP 74 Ca -0.08 1.18 -0.08 0.00 -0.50 0.00 0.00 54.79 55.31 2efi n ASP 74 Cb 0.58 -0.18 -0.06 0.00 -1.14 0.00 0.00 41.12 40.31 2efi n ASP 74 CO 0.00 0.00 0.00 0.74 -1.33 0.00 0.00 177.20 176.61 2efi h THR 75 N 0.00 0.00 -0.77 2.12 2.02 -2.00 0.25 112.91 114.52 2efi h THR 75 Ca 0.10 0.00 0.14 0.00 0.77 0.00 0.00 66.41 67.42 2efi h THR 75 Cb 0.25 0.00 -0.09 0.00 -1.74 0.00 0.00 68.15 66.57 2efi h THR 75 CO -0.58 0.00 0.33 0.78 0.37 0.00 0.00 175.52 176.43 2efi h ASN 76 N -0.17 0.34 -0.52 4.18 2.35 -1.25 -0.88 115.58 119.63 2efi h ASN 76 Ca 0.06 0.10 0.05 0.00 -0.55 0.00 0.00 56.30 55.96 2efi h ASN 76 Cb 0.33 0.07 -0.05 0.00 0.05 0.00 0.00 38.32 38.72 2efi h ASN 76 CO -0.43 0.13 0.26 -0.07 -1.65 0.00 0.00 177.43 175.67 2efi h LEU 77 N 0.49 0.36 -1.29 1.61 3.38 0.14 -1.04 115.31 118.96 2efi h LEU 77 Ca 0.42 0.03 0.25 0.00 0.09 0.00 0.00 57.88 58.68 2efi h LEU 77 Cb 0.63 -0.03 -0.03 0.00 0.09 0.00 0.00 40.66 41.31 2efi h LEU 77 CO -0.39 0.25 1.02 1.56 0.09 0.00 0.00 178.44 180.97 2efi h GLN 78 N 0.50 0.00 0.00 1.13 4.20 0.88 -1.69 115.11 120.13 2efi h GLN 78 Ca 0.23 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.94 2efi h GLN 78 Cb 0.15 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.93 2efi h GLN 78 CO -0.17 0.00 -0.44 1.17 -0.67 0.00 0.00 178.83 178.72 2efi n LYS 79 N -3.35 0.30 -0.40 1.46 4.81 -0.44 -3.33 118.16 117.21 2efi n LYS 79 Ca 0.19 0.30 0.32 0.00 -0.87 0.00 0.00 58.31 58.25 2efi n LYS 79 Cb 1.30 -1.22 0.52 0.00 0.02 0.00 0.00 35.03 35.65 2efi n LYS 79 CO 0.00 0.00 0.00 0.94 1.17 0.00 0.00 177.40 179.51 2efi n GLN 80 N -3.70 -0.02 -0.03 1.64 7.27 -0.75 0.20 117.38 122.00 2efi n GLN 80 Ca -0.06 0.83 -0.19 0.00 0.07 0.00 0.00 57.00 57.65 2efi n GLN 80 Cb 0.23 -1.74 -0.13 0.00 2.41 0.00 0.00 30.24 31.00 2efi n GLN 80 CO 0.00 0.00 0.00 0.07 0.07 0.00 0.00 177.06 177.20 2efi h ARG 81 N 0.00 0.13 -0.95 3.69 0.11 -1.53 -2.83 114.38 113.00 2efi h ARG 81 Ca 0.64 -0.22 0.20 0.00 0.10 0.00 0.00 59.98 60.70 2efi h ARG 81 Cb 2.26 0.08 -0.08 0.00 1.11 0.00 0.00 29.97 33.34 2efi h ARG 81 CO -0.20 1.11 0.61 1.05 0.10 0.00 0.00 179.97 182.64 2efi h GLU 82 N -0.68 0.50 0.02 0.08 4.11 0.23 -1.15 114.58 117.69 2efi h GLU 82 Ca -0.18 -0.03 -0.00 0.00 0.07 0.00 0.00 59.36 59.22 2efi h GLU 82 Cb 1.40 -0.11 0.00 0.00 0.50 0.00 0.00 28.75 30.54 2efi h GLU 82 CO 0.01 0.33 -0.01 -0.07 0.07 0.00 0.00 179.01 179.34 2efi h LEU 83 N 0.52 -0.02 -1.93 3.06 3.38 -1.28 0.34 115.31 119.38 2efi h LEU 83 Ca 0.51 -0.77 0.31 0.00 0.09 0.00 0.00 57.88 58.02 2efi h LEU 83 Cb 1.12 0.00 -0.05 0.00 0.09 0.00 0.00 40.66 41.82 2efi h LEU 83 CO -0.25 0.81 0.77 1.56 0.09 0.00 0.00 178.44 181.42 2efi h GLN 84 N -0.90 0.04 0.01 1.13 4.20 -1.11 -0.67 115.11 117.83 2efi h GLN 84 Ca -0.00 -0.00 -0.38 0.00 0.06 0.00 0.00 58.65 58.33 2efi h GLN 84 Cb 0.79 -0.01 -0.05 0.00 0.30 0.00 0.00 27.48 28.50 2efi h GLN 84 CO 0.00 0.03 -2.10 0.36 -0.67 0.00 0.00 178.83 176.46 2efi n LYS 85 N -4.26 0.61 -0.36 1.46 2.85 -0.50 -4.30 118.16 113.66 2efi n LYS 85 Ca 0.23 0.34 0.33 0.00 -1.05 0.00 0.00 58.31 58.16 2efi n LYS 85 Cb 1.11 -1.60 0.67 0.00 -0.65 0.00 0.00 35.03 34.56 2efi n LYS 85 CO 0.00 0.00 0.00 0.00 -0.05 0.00 0.00 177.40 177.35 2efi h ALA 86 N -0.59 2.83 -3.14 0.58 0.00 0.38 -3.28 119.26 116.05 2efi h ALA 86 Ca -0.55 0.01 -0.58 0.00 0.00 0.00 0.00 54.91 53.78 2efi h ALA 86 Cb 1.61 0.09 -0.40 0.00 0.00 0.00 0.00 17.79 19.08 2efi h ALA 86 CO -0.26 -1.24 -0.76 -0.80 0.00 0.00 0.00 179.25 176.19 2efi s ASN 87 N -5.04 4.01 -0.07 0.00 0.01 -0.32 -4.97 114.94 108.56 2efi s ASN 87 Ca -0.07 -1.66 -0.02 0.00 -0.71 0.00 0.00 52.86 50.41 2efi s ASN 87 Cb 0.25 -0.86 -0.26 0.00 0.41 0.00 0.00 41.25 40.79 2efi s ASN 87 CO 0.81 -0.41 0.56 1.56 -1.51 0.00 0.00 177.10 178.10 2efi h GLN 88 N 8.06 0.22 -0.42 -0.60 1.08 -1.75 -3.19 115.11 118.50 2efi h GLN 88 Ca -0.13 -0.37 -0.07 0.00 -1.45 0.00 0.00 58.65 56.63 2efi h GLN 88 Cb 1.01 0.14 -0.02 0.00 -0.05 0.00 0.00 27.48 28.56 2efi h GLN 88 CO 0.47 1.04 0.00 0.93 -0.95 0.00 0.00 178.83 180.33 2efi h GLU 89 N 0.06 0.74 0.53 1.46 4.39 -1.93 -2.02 114.58 117.81 2efi h GLU 89 Ca -0.35 -0.24 -0.03 0.00 0.34 0.00 0.00 59.36 59.09 2efi h GLU 89 Cb 2.03 -0.07 0.01 0.00 -0.10 0.00 0.00 28.75 30.62 2efi h GLU 89 CO 0.11 0.82 -0.26 1.96 -1.16 0.00 0.00 179.01 180.48 2efi h GLN 90 N 0.58 -0.69 -0.95 2.33 7.50 -1.99 -1.51 115.11 120.37 2efi h GLN 90 Ca 0.12 0.05 0.26 0.00 0.50 0.00 0.00 58.65 59.57 2efi h GLN 90 Cb 0.48 0.16 -0.13 0.00 0.05 0.00 0.00 27.48 28.04 2efi h GLN 90 CO 0.02 -0.46 0.46 -0.92 -1.50 0.00 0.00 178.83 176.43 2efi h TYR 91 N -0.92 0.77 -0.03 2.96 5.03 -1.63 0.81 116.97 123.95 2efi h TYR 91 Ca -0.07 0.04 -0.08 0.00 2.58 0.00 0.00 58.73 61.19 2efi h TYR 91 Cb 0.55 -0.19 -0.01 0.00 1.55 0.00 0.00 36.73 38.63 2efi h TYR 91 CO 0.05 -0.09 -0.37 0.00 -1.32 0.00 0.00 178.16 176.44 2efi h ALA 92 N 1.77 1.33 -0.78 1.82 0.00 -1.33 -2.84 119.26 119.22 2efi h ALA 92 Ca 0.63 -0.35 0.05 0.00 0.00 0.00 0.00 54.91 55.24 2efi h ALA 92 Cb 1.28 -0.07 -0.05 0.00 0.00 0.00 0.00 17.79 18.96 2efi h ALA 92 CO -0.56 0.49 0.51 1.49 0.00 0.00 0.00 179.25 181.18 2efi h GLU 93 N 0.06 0.86 -1.95 0.00 4.22 0.17 -2.57 114.58 115.37 2efi h GLU 93 Ca 0.00 -0.05 -0.76 0.00 0.08 0.00 0.00 59.36 58.63 2efi h GLU 93 Cb 0.68 -0.20 -0.28 0.00 0.50 0.00 0.00 28.75 29.46 2efi h GLU 93 CO 0.05 0.57 1.00 0.41 -2.18 0.00 0.00 179.01 178.87 2efi n GLY 94 N -1.43 5.55 3.29 1.92 0.00 -1.07 -4.94 105.19 108.50 2efi n GLY 94 Ca 0.11 -2.48 -0.33 0.00 0.00 0.00 0.00 46.02 43.32 2efi n GLY 94 CO 0.00 0.00 0.00 0.54 0.00 0.00 0.00 173.32 173.86 2efi s LYS 95 N -4.05 3.24 1.15 1.61 -0.14 -0.97 -5.05 119.74 115.52 2efi s LYS 95 Ca 0.52 -0.75 -0.13 0.00 -1.36 0.00 0.00 55.97 54.26 2efi s LYS 95 Cb 0.44 -2.58 0.28 0.00 -1.68 0.00 0.00 37.83 34.29 2efi s LYS 95 CO -0.40 0.10 1.04 0.00 -0.76 0.00 0.00 175.35 175.32 2efi s MET 96 N 0.61 -0.80 0.14 1.68 0.23 -1.26 -4.99 119.30 114.91 2efi s MET 96 Ca -0.09 0.91 -0.16 0.00 -1.03 0.00 0.00 55.69 55.33 2efi s MET 96 Cb -0.16 -1.56 -0.07 0.00 -1.53 0.00 0.00 34.83 31.51 2efi s MET 96 CO 0.03 -3.67 0.58 1.03 -2.03 0.00 0.00 175.02 170.96 2efi s ARG 97 N -4.47 4.05 0.63 3.16 0.52 -1.26 -4.94 118.95 116.64 2efi s ARG 97 Ca 0.68 0.58 0.00 0.00 -0.52 0.00 0.00 55.73 56.48 2efi s ARG 97 Cb -0.25 -2.98 0.00 0.00 0.52 0.00 0.00 34.95 32.24 2efi s ARG 97 CO 0.64 0.50 0.00 0.41 0.02 0.00 0.00 175.30 176.87 2efi n GLY 98 N 0.95 -2.00 3.88 -3.53 0.00 -1.26 -4.93 105.19 98.30 2efi n GLY 98 Ca -0.06 -1.38 -0.29 0.00 0.00 0.00 0.00 46.02 44.29 2efi n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2efi n ALA 99 N -0.74 -1.37 -0.10 4.61 0.00 -1.26 -5.21 120.51 116.45 2efi n ALA 99 Ca 0.00 0.17 0.00 0.00 0.00 0.00 0.00 53.44 53.61 2efi n ALA 99 Cb 0.10 -4.27 0.00 0.00 0.00 0.00 0.00 19.45 15.28 2efi n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50