#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2efi n SER 2 N 0.00 1.30 -0.37 1.61 3.41 -1.26 -4.76 113.62 113.55 2efi n SER 2 Ca 0.00 0.19 -0.04 0.00 -0.26 0.00 0.00 58.87 58.76 2efi n SER 2 Cb 0.00 -0.46 -0.01 0.00 -0.26 0.00 0.00 64.21 63.48 2efi n SER 2 CO 0.00 0.00 0.00 -1.20 -0.16 0.00 0.00 175.04 173.68 2efi n SER 3 N -3.73 -0.74 -3.50 4.04 7.64 -1.26 -4.75 113.62 111.32 2efi n SER 3 Ca -0.05 1.63 -0.09 0.00 1.01 0.00 0.00 58.87 61.38 2efi n SER 3 Cb 0.18 -0.32 -0.02 0.00 -1.01 0.00 0.00 64.21 63.04 2efi n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2efi s GLY 4 N -3.19 -0.48 0.06 0.23 0.00 -1.26 -5.18 107.32 97.50 2efi s GLY 4 Ca -0.12 0.98 -0.02 0.00 0.00 0.00 0.00 44.72 45.56 2efi s GLY 4 CO 0.63 0.34 -0.00 -0.56 0.00 0.00 0.00 173.10 173.51 2efi s SER 5 N -2.46 0.44 -1.43 1.64 0.01 -1.26 -4.88 113.70 105.75 2efi s SER 5 Ca 0.04 -0.97 -0.07 0.00 1.31 0.00 0.00 55.95 56.26 2efi s SER 5 Cb -0.01 0.22 0.04 0.00 0.21 0.00 0.00 66.02 66.48 2efi s SER 5 CO -0.09 -0.62 0.81 -1.20 0.41 0.00 0.00 173.24 172.55 2efi n SER 6 N 0.08 -2.80 0.00 2.44 7.64 -1.26 -4.62 113.62 115.11 2efi n SER 6 Ca -0.14 -0.82 0.00 0.00 1.01 0.00 0.00 58.87 58.92 2efi n SER 6 Cb 0.61 -3.86 0.00 0.00 -1.01 0.00 0.00 64.21 59.96 2efi n SER 6 CO 0.00 0.00 0.00 0.61 -3.01 0.00 0.00 175.04 172.64 2efi n GLY 7 N -1.66 2.78 3.58 0.23 0.00 -1.26 -4.77 105.19 104.08 2efi n GLY 7 Ca -0.14 -0.28 -0.26 0.00 0.00 0.00 0.00 46.02 45.34 2efi n GLY 7 CO 0.00 0.00 0.00 1.06 0.00 0.00 0.00 173.32 174.38 2efi s MET 8 N 0.00 1.88 0.33 1.61 -1.94 -1.26 -5.01 119.30 114.91 2efi s MET 8 Ca 0.00 -2.06 -0.24 0.00 -1.71 0.00 0.00 55.69 51.68 2efi s MET 8 Cb 0.00 -1.45 -0.16 0.00 2.01 0.00 0.00 34.83 35.23 2efi s MET 8 CO 0.00 -0.08 0.30 0.00 -0.01 0.00 0.00 175.02 175.24 2efi n ALA 9 N -0.89 -2.76 -2.18 3.03 0.00 -1.26 -4.83 120.51 111.61 2efi n ALA 9 Ca -0.04 0.24 -0.42 0.00 0.00 0.00 0.00 53.44 53.22 2efi n ALA 9 Cb 0.67 -1.56 -0.03 0.00 0.00 0.00 0.00 19.45 18.53 2efi n ALA 9 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.50 176.25 2efi s PRO 10 N -1.06 4.29 0.51 0.00 0.04 -1.26 -5.02 135.00 132.49 2efi s PRO 10 Ca 0.61 2.02 -0.04 0.00 0.04 0.00 0.00 61.00 63.64 2efi s PRO 10 Cb -0.74 -3.49 -0.01 0.00 0.04 0.00 0.00 34.50 30.30 2efi s PRO 10 CO 0.60 -0.55 0.79 0.21 0.04 0.00 0.00 177.00 178.09 2efi s LYS 11 N 2.06 3.18 0.00 4.56 2.20 -1.26 -4.95 119.74 125.53 2efi s LYS 11 Ca 0.65 -0.09 -0.04 0.00 -0.36 0.00 0.00 55.97 56.13 2efi s LYS 11 Cb -0.34 -2.40 -0.18 0.00 -1.51 0.00 0.00 37.83 33.40 2efi s LYS 11 CO 0.28 -0.39 2.92 0.94 -0.36 0.00 0.00 175.35 178.74 2efi n GLN 12 N -2.31 1.56 -3.86 4.03 -0.06 -1.26 -4.78 117.38 110.70 2efi n GLN 12 Ca 0.02 -0.68 -0.10 0.00 -2.00 0.00 0.00 57.00 54.23 2efi n GLN 12 Cb 0.57 -1.75 -0.08 0.00 -4.06 0.00 0.00 30.24 24.92 2efi n GLN 12 CO 0.00 0.00 0.00 -0.51 -0.20 0.00 0.00 177.06 176.35 2efi s ASP 13 N 2.10 0.07 0.60 1.69 1.11 -1.26 -5.16 116.67 115.81 2efi s ASP 13 Ca 0.46 -0.43 -0.17 0.00 0.18 0.00 0.00 52.55 52.59 2efi s ASP 13 Cb 0.22 0.28 -0.03 0.00 1.07 0.00 0.00 42.92 44.46 2efi s ASP 13 CO 0.00 -0.57 1.12 -2.16 1.18 0.00 0.00 175.17 174.74 2efi s PRO 14 N -2.71 3.09 -0.13 8.23 0.04 -1.26 -5.05 135.00 137.21 2efi s PRO 14 Ca -0.04 1.50 0.01 0.00 0.04 0.00 0.00 61.00 62.52 2efi s PRO 14 Cb -0.00 -1.98 -0.00 0.00 0.04 0.00 0.00 34.50 32.55 2efi s PRO 14 CO -0.05 -1.04 -0.17 0.21 0.04 0.00 0.00 177.00 175.99 2efi s LYS 15 N -3.67 3.22 0.74 4.56 2.20 -1.26 -5.02 119.74 120.50 2efi s LYS 15 Ca 0.70 -0.77 -0.12 0.00 -0.36 0.00 0.00 55.97 55.42 2efi s LYS 15 Cb -0.22 -2.54 0.04 0.00 -1.51 0.00 0.00 37.83 33.60 2efi s LYS 15 CO 0.34 0.11 1.10 -1.25 -0.36 0.00 0.00 175.35 175.29 2efi s PRO 16 N 0.57 2.42 -0.19 4.03 0.04 -1.26 -5.01 135.00 135.59 2efi s PRO 16 Ca -0.10 1.24 -0.02 0.00 0.04 0.00 0.00 61.00 62.16 2efi s PRO 16 Cb -0.16 -1.91 -0.11 0.00 0.04 0.00 0.00 34.50 32.35 2efi s PRO 16 CO 0.04 -1.53 -0.19 1.63 0.04 0.00 0.00 177.00 176.98 2efi n LYS 17 N -3.18 0.46 -2.44 4.56 5.02 -1.26 -5.01 118.16 116.31 2efi n LYS 17 Ca 0.10 0.13 -0.30 0.00 -2.02 0.00 0.00 58.31 56.21 2efi n LYS 17 Cb 0.53 -1.33 -0.02 0.00 -0.02 0.00 0.00 35.03 34.19 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 -2.38 3.53 0.28 2.13 0.40 -1.26 -5.09 117.98 115.59 2efi s PHE 18 Ca -0.26 1.17 0.11 0.00 -0.60 0.00 0.00 56.93 57.34 2efi s PHE 18 Cb 0.08 -2.57 -0.05 0.00 0.51 0.00 0.00 43.02 40.99 2efi s PHE 18 CO 0.41 -0.36 -0.13 -0.65 0.70 0.00 0.00 175.22 175.20 2efi s GLN 19 N -4.43 1.88 0.11 0.44 -1.52 -1.26 -5.04 119.66 109.83 2efi s GLN 19 Ca 0.53 -1.69 -0.31 0.00 -1.95 0.00 0.00 55.36 51.95 2efi s GLN 19 Cb -0.10 -1.88 -0.07 0.00 -0.22 0.00 0.00 33.01 30.74 2efi s GLN 19 CO 0.40 0.32 1.27 -1.21 -0.25 0.00 0.00 175.29 175.82 2efi s GLU 20 N -3.57 4.40 0.00 2.91 2.02 -1.26 -2.87 118.70 120.32 2efi s GLU 20 Ca 0.31 1.92 0.00 0.00 0.02 0.00 0.00 54.97 57.21 2efi s GLU 20 Cb -0.05 -3.28 0.00 0.00 0.10 0.00 0.00 34.13 30.90 2efi s GLU 20 CO 0.17 -0.29 0.00 0.41 0.02 0.00 0.00 175.26 175.56 2efi n GLY 21 N 3.08 2.87 3.78 -1.39 0.00 0.91 -5.01 105.19 109.44 2efi n GLY 21 Ca 0.09 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.72 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 -0.87 4.55 0.37 1.61 2.56 -1.14 -4.83 118.70 120.95 2efi s GLU 22 Ca 0.00 1.17 -0.27 0.00 0.00 0.00 0.00 54.97 55.87 2efi s GLU 22 Cb 0.00 -3.14 -0.09 0.00 2.00 0.00 0.00 34.13 32.90 2efi s GLU 22 CO 0.00 0.50 1.23 0.50 -0.56 0.00 0.00 175.26 176.93 2efi s ARG 23 N -1.42 4.20 0.19 4.30 3.52 -1.26 -2.10 118.95 126.37 2efi s ARG 23 Ca 0.39 2.02 -0.20 0.00 -0.13 0.00 0.00 55.73 57.81 2efi s ARG 23 Cb -0.22 -2.88 0.04 0.00 -1.56 0.00 0.00 34.95 30.34 2efi s ARG 23 CO 0.26 -0.25 0.57 0.14 -0.81 0.00 0.00 175.30 175.20 2efi s VAL 24 N -1.26 0.02 -0.20 7.11 -7.23 -0.65 -4.42 120.40 113.76 2efi s VAL 24 Ca 0.53 -0.48 -0.05 0.00 -1.81 0.00 0.00 61.98 60.16 2efi s VAL 24 Cb -0.35 -1.36 -0.02 0.00 0.56 0.00 0.00 36.38 35.20 2efi s VAL 24 CO 0.45 -0.08 0.00 -0.76 -0.31 0.00 0.00 175.10 174.41 2efi s LEU 25 N -2.82 3.25 -0.12 1.32 1.43 -1.24 -2.41 118.68 118.08 2efi s LEU 25 Ca 0.06 -0.21 -0.05 0.00 -1.03 0.00 0.00 54.13 52.90 2efi s LEU 25 Cb -0.01 -1.82 -0.04 0.00 0.03 0.00 0.00 46.19 44.35 2efi s LEU 25 CO -0.06 0.06 0.05 0.00 0.23 0.00 0.00 176.35 176.62 2efi s PHE 27 N -0.51 2.51 -0.57 0.00 0.08 -0.86 -3.25 117.98 115.37 2efi s PHE 27 Ca 0.10 -0.17 0.01 0.00 0.12 0.00 0.00 56.93 56.99 2efi s PHE 27 Cb -0.12 -4.44 0.44 0.00 -0.57 0.00 0.00 43.02 38.33 2efi s PHE 27 CO 0.02 -1.80 1.75 1.58 -0.10 0.00 0.00 175.22 176.67 2efi n HIS 28 N 8.49 3.08 0.00 0.36 -0.00 -1.22 -5.03 115.22 120.90 2efi n HIS 28 Ca 0.01 -2.73 0.00 0.00 -0.00 0.00 0.00 57.72 55.00 2efi n HIS 28 Cb 0.48 -1.04 0.00 0.00 -0.00 0.00 0.00 29.99 29.43 2efi n HIS 28 CO 0.00 0.00 0.00 0.41 -0.00 0.00 0.00 176.34 176.75 2efi n GLY 29 N -0.79 0.44 0.00 1.57 0.00 -1.26 -4.68 105.19 100.47 2efi n GLY 29 Ca 0.55 -2.08 0.05 0.00 0.00 0.00 0.00 46.02 44.55 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 -4.07 1.61 -0.04 -1.26 -4.71 135.00 127.02 2efi n PRO 30 Ca 0.00 0.00 -0.08 0.00 -0.04 0.00 0.00 63.50 63.38 2efi n PRO 30 Cb 0.00 -1.34 -0.10 0.00 -0.04 0.00 0.00 33.50 32.01 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 -1.68 2.43 -0.05 1.53 1.43 -1.26 -4.92 118.68 116.16 2efi s LEU 31 Ca 0.16 -0.87 -0.03 0.00 -1.03 0.00 0.00 54.13 52.35 2efi s LEU 31 Cb 0.07 0.13 -0.04 0.00 0.03 0.00 0.00 46.19 46.39 2efi s LEU 31 CO 0.12 -0.50 0.14 -0.76 0.23 0.00 0.00 176.35 175.58 2efi s LEU 32 N -2.56 4.23 -0.04 1.79 1.43 -1.26 -3.43 118.68 118.84 2efi s LEU 32 Ca 0.02 0.33 0.04 0.00 -1.03 0.00 0.00 54.13 53.49 2efi s LEU 32 Cb 0.03 -2.33 -0.00 0.00 0.03 0.00 0.00 46.19 43.92 2efi s LEU 32 CO -0.07 0.32 -0.15 -0.31 0.23 0.00 0.00 176.35 176.37 2efi s TYR 33 N -1.18 1.49 0.26 0.29 1.51 -1.20 -4.88 117.35 113.64 2efi s TYR 33 Ca 0.22 -0.41 -0.31 0.00 -1.01 0.00 0.00 57.07 55.56 2efi s TYR 33 Cb -0.12 -1.01 -0.12 0.00 -0.11 0.00 0.00 41.96 40.59 2efi s TYR 33 CO 0.12 -0.14 1.58 -1.91 -1.11 0.00 0.00 175.55 174.09 2efi n GLU 34 N 3.15 2.54 -3.88 -0.62 2.13 -1.26 -3.45 120.64 119.25 2efi n GLU 34 Ca -0.18 0.91 -0.10 0.00 0.66 0.00 0.00 57.16 58.45 2efi n GLU 34 Cb 0.53 -2.67 0.00 0.00 0.27 0.00 0.00 31.44 29.57 2efi n GLU 34 CO 0.00 0.00 0.00 0.00 -0.41 0.00 0.00 177.13 176.72 2efi s ALA 35 N 0.22 -0.46 -0.03 4.31 0.00 -1.01 -2.54 121.76 122.25 2efi s ALA 35 Ca 0.67 -0.86 -0.05 0.00 0.00 0.00 0.00 51.96 51.71 2efi s ALA 35 Cb -0.54 0.81 0.01 0.00 0.00 0.00 0.00 23.12 23.40 2efi s ALA 35 CO 0.46 -0.95 0.13 0.21 0.00 0.00 0.00 175.76 175.61 2efi s LYS 36 N -2.74 0.28 -0.26 0.00 2.36 -1.25 -1.63 119.74 116.50 2efi s LYS 36 Ca 0.18 -0.04 -0.28 0.00 -2.55 0.00 0.00 55.97 53.28 2efi s LYS 36 Cb -0.04 0.12 -0.04 0.00 -1.05 0.00 0.00 37.83 36.82 2efi s LYS 36 CO 0.13 -0.05 2.14 0.00 1.55 0.00 0.00 175.35 179.12 2efi h VAL 38 N 7.11 0.74 -3.72 0.00 2.07 -0.16 0.26 116.25 122.55 2efi h VAL 38 Ca -0.38 -2.39 -0.08 0.00 0.82 0.00 0.00 66.70 64.66 2efi h VAL 38 Cb 1.23 2.59 -0.13 0.00 -1.52 0.00 0.00 31.29 33.46 2efi h VAL 38 CO 0.99 0.87 -0.26 -0.54 0.02 0.00 0.00 177.57 178.65 2efi s LYS 39 N -2.56 1.08 -0.28 1.57 1.02 -1.15 -4.79 119.74 114.64 2efi s LYS 39 Ca -0.20 -1.01 -0.02 0.00 0.02 0.00 0.00 55.97 54.75 2efi s LYS 39 Cb 0.06 0.40 0.09 0.00 -0.52 0.00 0.00 37.83 37.86 2efi s LYS 39 CO 0.79 -0.40 0.09 0.08 -0.92 0.00 0.00 175.35 175.00 2efi s VAL 40 N -3.90 0.51 0.34 3.17 1.01 -1.26 -0.65 120.40 119.61 2efi s VAL 40 Ca 0.11 -1.01 0.09 0.00 0.00 0.00 0.00 61.98 61.16 2efi s VAL 40 Cb 0.03 -1.31 -0.05 0.00 0.00 0.00 0.00 36.38 35.05 2efi s VAL 40 CO -0.05 -0.58 0.04 0.00 0.00 0.00 0.00 175.10 174.50 2efi s ALA 41 N 1.82 3.26 -0.08 5.51 0.00 -0.30 -4.99 121.76 126.97 2efi s ALA 41 Ca 0.07 -1.94 -0.03 0.00 0.00 0.00 0.00 51.96 50.07 2efi s ALA 41 Cb -0.17 -0.44 0.04 0.00 0.00 0.00 0.00 23.12 22.55 2efi s ALA 41 CO -0.25 0.06 0.06 0.42 0.00 0.00 0.00 175.76 176.05 2efi s ILE 42 N -2.50 -0.02 0.27 0.00 1.01 -1.26 -0.30 121.20 118.40 2efi s ILE 42 Ca 0.35 0.22 -0.09 0.00 0.00 0.00 0.00 60.65 61.14 2efi s ILE 42 Cb -0.00 -0.33 -0.01 0.00 0.01 0.00 0.00 42.46 42.13 2efi s ILE 42 CO 0.20 0.07 0.44 -1.59 0.00 0.00 0.00 174.94 174.05 2efi s LYS 43 N 2.13 1.61 -1.02 2.79 -2.85 -0.29 -4.90 119.74 117.21 2efi s LYS 43 Ca 0.04 -1.44 -0.10 0.00 -1.00 0.00 0.00 55.97 53.46 2efi s LYS 43 Cb -0.13 0.44 0.10 0.00 -2.06 0.00 0.00 37.83 36.17 2efi s LYS 43 CO -0.05 -0.66 0.34 -3.47 0.10 0.00 0.00 175.35 171.61 2efi n ASP 44 N -0.66 -2.19 -3.63 0.03 2.03 -1.26 0.12 116.55 110.99 2efi n ASP 44 Ca -0.01 -0.33 -0.25 0.00 0.52 0.00 0.00 54.79 54.72 2efi n ASP 44 Cb 0.62 -1.90 0.07 0.00 -0.72 0.00 0.00 41.12 39.19 2efi n ASP 44 CO 0.00 0.00 0.00 0.29 -1.92 0.00 0.00 177.20 175.57 2efi n LYS 45 N -3.37 -7.44 -3.72 -0.67 4.76 -1.26 -4.99 118.16 101.46 2efi n LYS 45 Ca 0.03 0.79 -0.13 0.00 -2.87 0.00 0.00 58.31 56.12 2efi n LYS 45 Cb 0.50 -5.81 -0.09 0.00 -1.84 0.00 0.00 35.03 27.78 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 -6.35 0.55 -0.27 1.97 -2.07 0.33 -5.04 119.66 108.77 2efi s GLN 46 Ca 0.59 0.43 -0.19 0.00 -1.82 0.00 0.00 55.36 54.37 2efi s GLN 46 Cb -0.27 0.26 -0.02 0.00 -1.09 0.00 0.00 33.01 31.89 2efi s GLN 46 CO 0.73 -0.10 0.55 0.08 -1.32 0.00 0.00 175.29 175.23 2efi s VAL 47 N -0.13 5.04 0.22 3.63 1.01 -1.26 -1.13 120.40 127.76 2efi s VAL 47 Ca -0.03 0.88 0.09 0.00 0.00 0.00 0.00 61.98 62.92 2efi s VAL 47 Cb -0.03 -3.87 -0.04 0.00 0.00 0.00 0.00 36.38 32.43 2efi s VAL 47 CO 0.02 0.03 -0.01 -0.54 0.00 0.00 0.00 175.10 174.60 2efi s LYS 48 N 2.38 2.30 -0.04 2.72 -0.14 0.59 -2.40 119.74 125.16 2efi s LYS 48 Ca 0.22 -1.27 -0.01 0.00 -1.36 0.00 0.00 55.97 53.55 2efi s LYS 48 Cb -0.15 -2.24 0.03 0.00 -1.68 0.00 0.00 37.83 33.78 2efi s LYS 48 CO 0.10 0.41 0.01 0.71 -0.76 0.00 0.00 175.35 175.82 2efi s TYR 49 N -2.00 0.38 -0.62 3.18 1.51 0.11 -1.16 117.35 118.76 2efi s TYR 49 Ca 0.29 -0.00 -0.26 0.00 -1.01 0.00 0.00 57.07 56.08 2efi s TYR 49 Cb -0.08 -0.55 -0.03 0.00 -0.11 0.00 0.00 41.96 41.20 2efi s TYR 49 CO 0.19 -0.20 1.90 0.12 -1.11 0.00 0.00 175.55 176.45 2efi s PHE 50 N 1.53 1.63 0.33 2.71 5.36 0.17 -2.20 117.98 127.51 2efi s PHE 50 Ca -0.03 0.83 -0.18 0.00 -0.96 0.00 0.00 56.93 56.60 2efi s PHE 50 Cb -0.13 -4.05 -0.09 0.00 -0.34 0.00 0.00 43.02 38.41 2efi s PHE 50 CO -0.03 -2.28 0.80 0.42 -1.46 0.00 0.00 175.22 172.66 2efi s ILE 51 N 9.37 4.56 -0.45 3.12 -1.09 -0.79 0.62 121.20 136.55 2efi s ILE 51 Ca 0.69 1.19 0.03 0.00 -2.23 0.00 0.00 60.65 60.34 2efi s ILE 51 Cb -0.12 -3.68 0.12 0.00 -1.58 0.00 0.00 42.46 37.20 2efi s ILE 51 CO 0.20 -0.12 0.20 -2.28 -1.23 0.00 0.00 174.94 171.70 2efi s HIS 52 N -1.92 2.90 -0.48 3.97 5.65 -1.17 -3.32 115.29 120.92 2efi s HIS 52 Ca 0.54 -2.85 -0.28 0.00 0.25 0.00 0.00 55.06 52.71 2efi s HIS 52 Cb -0.12 -2.53 -0.09 0.00 -1.18 0.00 0.00 32.58 28.66 2efi s HIS 52 CO 0.17 -0.81 2.39 0.66 -0.65 0.00 0.00 174.74 176.51 2efi n TYR 53 N 3.59 1.45 -1.48 3.88 4.01 -1.26 -3.93 117.16 123.41 2efi n TYR 53 Ca 0.05 0.13 -0.61 0.00 -0.16 0.00 0.00 57.90 57.30 2efi n TYR 53 Cb 0.35 -2.61 -0.10 0.00 -0.31 0.00 0.00 39.34 36.67 2efi n TYR 53 CO 0.00 0.00 0.00 0.45 -0.46 0.00 0.00 176.86 176.85 2efi n SER 54 N 13.69 0.98 0.00 7.72 2.88 -1.05 -4.75 113.62 133.09 2efi n SER 54 Ca 0.40 0.95 0.00 0.00 -1.33 0.00 0.00 58.87 58.89 2efi n SER 54 Cb 0.42 -0.83 0.00 0.00 -0.75 0.00 0.00 64.21 63.05 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 4.93 -0.57 0.07 0.46 0.00 -1.26 -5.01 105.19 103.81 2efi n GLY 55 Ca 0.37 -1.13 -0.11 0.00 0.00 0.00 0.00 46.02 45.14 2efi n GLY 55 CO 0.00 0.00 0.00 1.49 0.00 0.00 0.00 173.32 174.81 2efi h TRP 56 N 0.00 0.00 -0.84 1.61 4.06 -2.03 -3.33 115.95 115.41 2efi h TRP 56 Ca 0.00 0.00 0.34 0.00 2.06 0.00 0.00 58.89 61.29 2efi h TRP 56 Cb 0.00 0.00 -0.13 0.00 -1.00 0.00 0.00 29.16 28.03 2efi h TRP 56 CO 0.00 0.79 0.48 -1.71 -3.56 0.00 0.00 178.44 174.43 2efi n ASN 57 N -4.62 0.25 -3.39 -3.49 2.85 -1.26 -4.67 115.26 100.93 2efi n ASN 57 Ca -0.11 1.25 -0.19 0.00 -0.11 0.00 0.00 54.58 55.42 2efi n ASN 57 Cb 0.39 -0.61 -0.03 0.00 1.24 0.00 0.00 39.78 40.76 2efi n ASN 57 CO 0.00 0.00 0.00 2.29 -2.11 0.00 0.00 177.26 177.44 2efi n LYS 58 N -4.66 -2.12 0.00 1.20 2.85 -1.25 -4.68 118.16 109.50 2efi n LYS 58 Ca 0.30 0.11 0.00 0.00 -1.05 0.00 0.00 58.31 57.67 2efi n LYS 58 Cb 1.05 -4.66 0.00 0.00 -0.65 0.00 0.00 35.03 30.77 2efi n LYS 58 CO 0.00 0.00 0.00 -1.71 -0.05 0.00 0.00 177.40 175.64 2efi n ASN 59 N -1.96 1.43 0.18 -5.58 5.15 -1.26 -4.66 115.26 108.57 2efi n ASN 59 Ca 0.04 0.00 0.14 0.00 -0.60 0.00 0.00 54.58 54.16 2efi n ASN 59 Cb 0.49 0.00 0.48 0.00 -0.53 0.00 0.00 39.78 40.22 2efi n ASN 59 CO 0.00 0.00 0.00 -0.50 1.40 0.00 0.00 177.26 178.16 2efi h TRP 60 N 0.00 0.00 -0.60 1.20 6.55 -1.94 -3.41 115.95 117.75 2efi h TRP 60 Ca 0.00 0.00 -0.81 0.00 0.95 0.00 0.00 58.89 59.03 2efi h TRP 60 Cb 1.00 0.00 -0.01 0.00 -0.86 0.00 0.00 29.16 29.28 2efi h TRP 60 CO 0.00 0.00 1.01 -0.40 -1.05 0.00 0.00 178.44 178.00 2efi n ASP 61 N -2.99 1.12 -4.17 -3.49 5.68 -1.26 -4.91 116.55 106.52 2efi n ASP 61 Ca 0.05 0.92 -0.23 0.00 -0.50 0.00 0.00 54.79 55.04 2efi n ASP 61 Cb 0.84 -0.92 -0.09 0.00 -1.14 0.00 0.00 41.12 39.81 2efi n ASP 61 CO 0.00 0.00 0.00 -1.83 -1.33 0.00 0.00 177.20 174.04 2efi s GLU 62 N 4.50 1.77 -0.05 0.11 -1.05 -1.21 -4.97 118.70 117.80 2efi s GLU 62 Ca 1.11 -2.04 -0.16 0.00 -0.15 0.00 0.00 54.97 53.74 2efi s GLU 62 Cb -1.45 -0.54 -0.05 0.00 -0.44 0.00 0.00 34.13 31.66 2efi s GLU 62 CO 0.72 -0.40 0.42 -1.58 0.95 0.00 0.00 175.26 175.38 2efi s TRP 63 N -3.34 3.64 0.07 4.83 0.52 -1.26 -1.88 118.94 121.52 2efi s TRP 63 Ca 0.30 0.93 0.04 0.00 0.02 0.00 0.00 56.10 57.39 2efi s TRP 63 Cb 0.05 -2.38 -0.03 0.00 -1.15 0.00 0.00 33.47 29.96 2efi s TRP 63 CO 0.15 0.45 -0.11 0.14 0.02 0.00 0.00 176.95 177.60 2efi s VAL 64 N -0.38 0.93 1.18 4.03 -7.23 -0.93 -4.92 120.40 113.08 2efi s VAL 64 Ca 0.24 -1.35 -0.18 0.00 -1.81 0.00 0.00 61.98 58.87 2efi s VAL 64 Cb -0.16 -1.05 0.28 0.00 0.56 0.00 0.00 36.38 36.01 2efi s VAL 64 CO 0.12 -0.36 1.11 -2.16 -0.31 0.00 0.00 175.10 173.49 2efi s PRO 65 N -2.01 -1.06 0.00 4.82 0.04 -1.26 0.08 135.00 135.61 2efi s PRO 65 Ca -0.02 -0.01 0.21 0.00 0.04 0.00 0.00 61.00 61.23 2efi s PRO 65 Cb -0.08 -1.61 0.92 0.00 0.04 0.00 0.00 34.50 33.77 2efi s PRO 65 CO 0.01 -3.61 1.69 -1.91 0.04 0.00 0.00 177.00 173.22 2efi n GLU 66 N -4.70 0.02 0.00 4.56 0.00 -1.01 -2.83 120.64 116.68 2efi n GLU 66 Ca 0.12 0.13 -0.10 0.00 0.00 0.00 0.00 57.16 57.31 2efi n GLU 66 Cb 0.59 -1.50 -0.14 0.00 0.00 0.00 0.00 31.44 30.39 2efi n GLU 66 CO 0.00 0.00 0.00 1.03 0.00 0.00 0.00 177.13 178.16 2efi h SER 67 N 0.00 0.08 1.23 4.31 0.87 -1.91 -3.31 113.55 114.82 2efi h SER 67 Ca 0.00 -0.15 0.00 0.00 -1.23 0.00 0.00 61.79 60.41 2efi h SER 67 Cb 0.36 -0.03 0.00 0.00 -0.44 0.00 0.00 62.40 62.29 2efi h SER 67 CO 0.00 1.13 0.00 0.54 -0.53 0.00 0.00 176.83 177.97 2efi n ARG 68 N -3.17 0.14 -3.72 2.24 1.74 -1.13 -4.77 116.66 107.98 2efi n ARG 68 Ca -0.16 0.12 -0.37 0.00 -0.77 0.00 0.00 57.85 56.67 2efi n ARG 68 Cb 1.03 -1.66 -0.06 0.00 -1.02 0.00 0.00 32.46 30.75 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 -3.06 5.36 0.48 1.55 1.01 -1.20 -2.04 120.40 122.50 2efi s VAL 69 Ca 0.12 0.40 0.05 0.00 0.00 0.00 0.00 61.98 62.55 2efi s VAL 69 Cb 0.15 -3.52 -0.02 0.00 0.00 0.00 0.00 36.38 33.00 2efi s VAL 69 CO 0.56 0.55 0.18 -0.76 0.00 0.00 0.00 175.10 175.63 2efi s LEU 70 N -0.58 2.76 -0.01 3.92 1.43 -0.54 -4.91 118.68 120.76 2efi s LEU 70 Ca 0.16 -1.30 0.16 0.00 -1.03 0.00 0.00 54.13 52.11 2efi s LEU 70 Cb -0.13 -1.14 0.46 0.00 0.03 0.00 0.00 46.19 45.41 2efi s LEU 70 CO 0.05 -0.78 1.38 0.29 0.23 0.00 0.00 176.35 177.52 2efi n LYS 71 N -1.38 2.26 -4.13 1.70 4.01 -1.26 -3.71 118.16 115.65 2efi n LYS 71 Ca -0.06 -1.86 -0.31 0.00 -0.51 0.00 0.00 58.31 55.57 2efi n LYS 71 Cb 0.65 -1.43 -0.04 0.00 -0.51 0.00 0.00 35.03 33.71 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 0.98 -1.59 -3.99 2.13 4.19 -1.26 -4.88 117.16 112.73 2efi n TYR 72 Ca 0.17 0.74 -0.22 0.00 3.31 0.00 0.00 57.90 61.90 2efi n TYR 72 Cb 0.45 -3.23 -0.05 0.00 0.49 0.00 0.00 39.34 37.00 2efi n TYR 72 CO 0.00 0.00 0.00 0.14 0.91 0.00 0.00 176.86 177.91 2efi s VAL 73 N -3.79 3.26 0.06 2.97 -7.23 -1.26 -4.89 120.40 109.52 2efi s VAL 73 Ca 0.28 -1.57 -0.12 0.00 -1.81 0.00 0.00 61.98 58.76 2efi s VAL 73 Cb -0.15 -3.06 -0.03 0.00 0.56 0.00 0.00 36.38 33.69 2efi s VAL 73 CO 0.93 -0.19 0.90 0.47 -0.31 0.00 0.00 175.10 176.90 2efi n ASP 74 N -1.23 -0.42 -0.26 4.85 8.00 -1.26 -0.21 116.55 126.02 2efi n ASP 74 Ca -0.03 1.00 -0.09 0.00 0.71 0.00 0.00 54.79 56.38 2efi n ASP 74 Cb 0.61 -0.24 -0.08 0.00 -0.02 0.00 0.00 41.12 41.39 2efi n ASP 74 CO 0.00 0.00 0.00 0.74 -0.39 0.00 0.00 177.20 177.55 2efi h THR 75 N 0.00 0.00 -0.71 -3.53 2.02 -2.00 0.23 112.91 108.92 2efi h THR 75 Ca 0.06 0.00 0.12 0.00 0.77 0.00 0.00 66.41 67.36 2efi h THR 75 Cb 0.16 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.49 2efi h THR 75 CO -0.38 0.00 0.30 0.78 0.37 0.00 0.00 175.52 176.59 2efi h ASN 76 N -0.10 0.31 -0.62 4.18 2.35 -1.19 -1.15 115.58 119.36 2efi h ASN 76 Ca 0.10 0.09 0.06 0.00 -0.55 0.00 0.00 56.30 56.01 2efi h ASN 76 Cb 0.37 0.05 -0.06 0.00 0.05 0.00 0.00 38.32 38.73 2efi h ASN 76 CO -0.65 0.15 0.32 -0.07 -1.65 0.00 0.00 177.43 175.53 2efi h LEU 77 N 0.47 0.45 -1.84 1.61 3.38 0.23 -0.84 115.31 118.77 2efi h LEU 77 Ca 0.37 0.04 0.40 0.00 0.09 0.00 0.00 57.88 58.79 2efi h LEU 77 Cb 0.50 -0.04 -0.06 0.00 0.09 0.00 0.00 40.66 41.16 2efi h LEU 77 CO -0.35 0.29 1.10 1.56 0.09 0.00 0.00 178.44 181.13 2efi h GLN 78 N 0.59 0.00 0.00 1.13 4.20 0.61 -1.65 115.11 119.99 2efi h GLN 78 Ca 0.28 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.99 2efi h GLN 78 Cb 0.22 0.00 0.00 0.00 0.30 0.00 0.00 27.48 28.00 2efi h GLN 78 CO -0.20 0.00 -0.52 1.17 -0.67 0.00 0.00 178.83 178.61 2efi n LYS 79 N -3.89 0.37 -0.37 1.46 4.81 -0.39 -3.24 118.16 116.91 2efi n LYS 79 Ca 0.31 0.37 0.30 0.00 -0.87 0.00 0.00 58.31 58.42 2efi n LYS 79 Cb 1.53 -1.40 0.49 0.00 0.02 0.00 0.00 35.03 35.67 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 -4.07 -0.02 -0.06 1.64 7.27 -0.78 0.17 117.38 121.53 2efi n GLN 80 Ca -0.07 0.83 -0.18 0.00 0.07 0.00 0.00 57.00 57.64 2efi n GLN 80 Cb 0.27 -1.70 -0.13 0.00 2.41 0.00 0.00 30.24 31.09 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 0.06 -1.02 3.69 0.11 -1.51 -2.90 114.38 112.81 2efi h ARG 81 Ca 0.62 -0.10 0.25 0.00 0.10 0.00 0.00 59.98 60.85 2efi h ARG 81 Cb 2.13 0.04 -0.09 0.00 1.11 0.00 0.00 29.97 33.16 2efi h ARG 81 CO -0.23 1.05 0.65 1.05 0.10 0.00 0.00 179.97 182.59 2efi h GLU 82 N -0.85 0.43 0.08 0.08 4.11 0.17 0.93 114.58 119.53 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 1.27 -0.10 0.00 0.00 0.50 0.00 0.00 28.75 30.42 2efi h GLU 82 CO -0.05 0.28 -0.04 -0.07 0.07 0.00 0.00 179.01 179.20 2efi h LEU 83 N 0.44 -0.09 -1.84 3.06 3.38 -1.25 -1.08 115.31 117.93 2efi h LEU 83 Ca 0.59 -0.35 0.10 0.00 0.09 0.00 0.00 57.88 58.31 2efi h LEU 83 Cb 1.40 0.02 -0.01 0.00 0.09 0.00 0.00 40.66 42.16 2efi h LEU 83 CO -0.31 0.55 0.50 1.56 0.09 0.00 0.00 178.44 180.83 2efi h GLN 84 N -0.98 0.00 0.02 1.13 4.20 -1.17 0.29 115.11 118.60 2efi h GLN 84 Ca -0.01 0.00 -0.32 0.00 0.06 0.00 0.00 58.65 58.38 2efi h GLN 84 Cb 0.44 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.16 2efi h GLN 84 CO 0.02 0.00 -1.94 0.36 -0.67 0.00 0.00 178.83 176.60 2efi n LYS 85 N -3.43 0.66 -0.13 1.46 2.85 0.26 -4.28 118.16 115.55 2efi n LYS 85 Ca 0.06 0.21 -0.09 0.00 -1.05 0.00 0.00 58.31 57.44 2efi n LYS 85 Cb 0.65 -1.71 -0.01 0.00 -0.65 0.00 0.00 35.03 33.31 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 0.84 0.49 -3.58 0.58 0.00 0.90 -3.38 119.26 115.12 2efi h ALA 86 Ca -0.38 -0.15 -0.65 0.00 0.00 0.00 0.00 54.91 53.73 2efi h ALA 86 Cb 2.07 -0.15 -0.40 0.00 0.00 0.00 0.00 17.79 19.31 2efi h ALA 86 CO 0.06 0.11 -0.69 -0.80 0.00 0.00 0.00 179.25 177.93 2efi s ASN 87 N -5.86 4.61 -0.16 0.00 0.01 -0.61 -4.95 114.94 107.97 2efi s ASN 87 Ca -0.13 -2.45 -0.24 0.00 -0.71 0.00 0.00 52.86 49.32 2efi s ASN 87 Cb 0.10 -1.63 -0.23 0.00 0.41 0.00 0.00 41.25 39.90 2efi s ASN 87 CO 0.75 -0.33 0.53 1.56 -1.51 0.00 0.00 177.10 178.10 2efi h GLN 88 N 7.23 0.03 -0.68 -0.60 4.20 -1.75 -3.10 115.11 120.45 2efi h GLN 88 Ca -0.05 -0.06 0.10 0.00 0.06 0.00 0.00 58.65 58.70 2efi h GLN 88 Cb 0.98 0.02 -0.08 0.00 0.30 0.00 0.00 27.48 28.70 2efi h GLN 88 CO 0.58 1.03 0.30 0.93 -0.67 0.00 0.00 178.83 181.00 2efi h GLU 89 N -0.91 0.49 -0.24 1.46 5.08 -1.94 0.18 114.58 118.70 2efi h GLU 89 Ca -0.18 -0.03 -0.02 0.00 -1.00 0.00 0.00 59.36 58.13 2efi h GLU 89 Cb 1.22 -0.11 -0.01 0.00 0.50 0.00 0.00 28.75 30.35 2efi h GLU 89 CO -0.08 0.33 0.07 1.96 -1.00 0.00 0.00 179.01 180.29 2efi h GLN 90 N 0.51 0.38 -0.13 2.33 4.20 -1.96 -2.22 115.11 118.22 2efi h GLN 90 Ca 0.35 -0.09 -0.00 0.00 0.06 0.00 0.00 58.65 58.97 2efi h GLN 90 Cb 0.42 -0.05 -0.01 0.00 0.30 0.00 0.00 27.48 28.14 2efi h GLN 90 CO -0.30 0.48 0.08 -0.92 -0.67 0.00 0.00 178.83 177.49 2efi h TYR 91 N 0.22 0.16 -0.65 2.96 3.20 -1.29 -2.80 116.97 118.77 2efi h TYR 91 Ca 0.08 0.00 0.09 0.00 3.14 0.00 0.00 58.73 62.04 2efi h TYR 91 Cb 0.26 -0.05 -0.07 0.00 1.54 0.00 0.00 36.73 38.41 2efi h TYR 91 CO 0.01 0.13 0.29 0.00 -1.64 0.00 0.00 178.16 176.95 2efi h ALA 92 N 1.02 0.87 -0.22 1.82 0.00 -0.62 -3.41 119.26 118.72 2efi h ALA 92 Ca 0.05 0.06 -0.56 0.00 0.00 0.00 0.00 54.91 54.46 2efi h ALA 92 Cb 0.02 -0.00 -0.07 0.00 0.00 0.00 0.00 17.79 17.74 2efi h ALA 92 CO -0.01 -0.11 1.64 -1.91 0.00 0.00 0.00 179.25 178.85 2efi n GLU 93 N -4.92 0.16 0.00 0.00 2.13 -0.84 0.32 120.64 117.49 2efi n GLU 93 Ca 0.10 0.02 0.00 0.00 0.66 0.00 0.00 57.16 57.93 2efi n GLU 93 Cb 0.27 -1.74 0.00 0.00 0.27 0.00 0.00 31.44 30.24 2efi n GLU 93 CO 0.00 0.00 0.00 0.41 -0.41 0.00 0.00 177.13 177.13 2efi n GLY 94 N 6.66 3.39 3.65 8.31 0.00 -1.26 -5.03 105.19 120.92 2efi n GLY 94 Ca 0.60 -1.05 -0.43 0.00 0.00 0.00 0.00 46.02 45.14 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 0.00 4.14 0.18 1.61 1.02 0.15 -4.91 119.74 121.93 2efi s LYS 95 Ca 0.00 1.88 -0.26 0.00 0.02 0.00 0.00 55.97 57.61 2efi s LYS 95 Cb 0.00 -3.91 0.04 0.00 -0.52 0.00 0.00 37.83 33.44 2efi s LYS 95 CO 0.00 -0.86 1.55 0.52 -0.92 0.00 0.00 175.35 175.64 2efi h MET 96 N 9.18 -0.08 -5.39 1.68 2.86 -1.98 -3.37 114.93 117.83 2efi h MET 96 Ca -0.33 0.01 -0.62 0.00 -2.06 0.00 0.00 59.70 56.69 2efi h MET 96 Cb 1.14 0.02 -0.12 0.00 0.06 0.00 0.00 31.60 32.70 2efi h MET 96 CO 0.97 -0.05 -0.51 0.50 1.06 0.00 0.00 176.91 178.87 2efi s ARG 97 N -5.72 3.91 -0.29 1.72 3.52 -1.26 -5.08 118.95 115.76 2efi s ARG 97 Ca -0.13 -0.24 -0.22 0.00 -0.13 0.00 0.00 55.73 55.00 2efi s ARG 97 Cb 0.14 -3.28 0.14 0.00 -1.56 0.00 0.00 34.95 30.38 2efi s ARG 97 CO 0.66 0.42 1.06 0.20 -0.81 0.00 0.00 175.30 176.82 2efi s GLY 98 N -0.01 -0.05 -0.10 8.12 0.00 -1.26 -5.06 107.32 108.96 2efi s GLY 98 Ca 0.08 2.91 -0.33 0.00 0.00 0.00 0.00 44.72 47.39 2efi s GLY 98 CO 0.00 2.07 1.23 0.00 0.00 0.00 0.00 173.10 176.40 2efi s ALA 99 N 0.54 -2.12 -2.87 3.20 0.00 -1.26 -5.13 121.76 114.12 2efi s ALA 99 Ca -0.00 1.16 0.25 0.00 0.00 0.00 0.00 51.96 53.37 2efi s ALA 99 Cb -0.05 0.12 0.41 0.00 0.00 0.00 0.00 23.12 23.61 2efi s ALA 99 CO -0.10 -0.80 1.39 0.00 0.00 0.00 0.00 175.76 176.25