#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 3.60 0.03 1.61 0.01 -1.26 -5.09 113.70 112.61 2efi s SER 2 Ca 0.00 -0.97 -0.28 0.00 1.31 0.00 0.00 55.95 56.02 2efi s SER 2 Cb 0.00 -1.35 0.10 0.00 0.21 0.00 0.00 66.02 64.98 2efi s SER 2 CO 0.00 -0.13 1.21 -0.55 0.41 0.00 0.00 173.24 174.18 2efi s SER 3 N 1.31 -0.03 0.58 2.44 0.15 -1.26 -5.16 113.70 111.73 2efi s SER 3 Ca -0.02 -0.28 -0.20 0.00 0.70 0.00 0.00 55.95 56.15 2efi s SER 3 Cb -0.17 0.25 -0.04 0.00 -1.71 0.00 0.00 66.02 64.35 2efi s SER 3 CO -0.08 -0.47 1.24 -0.83 1.20 0.00 0.00 173.24 174.30 2efi s GLY 4 N -3.35 2.79 -0.88 9.45 0.00 -1.26 -4.97 107.32 109.10 2efi s GLY 4 Ca 0.21 1.09 -0.06 0.00 0.00 0.00 0.00 44.72 45.97 2efi s GLY 4 CO -0.01 1.52 0.78 -0.56 0.00 0.00 0.00 173.10 174.84 2efi s SER 5 N -1.42 6.26 -0.09 1.64 0.01 -1.26 -5.00 113.70 113.84 2efi s SER 5 Ca 0.76 -3.36 -0.04 0.00 1.31 0.00 0.00 55.95 54.62 2efi s SER 5 Cb -0.33 -2.01 0.05 0.00 0.21 0.00 0.00 66.02 63.93 2efi s SER 5 CO 0.37 -0.30 0.18 -0.44 0.41 0.00 0.00 173.24 173.46 2efi s SER 6 N 0.71 0.26 0.00 2.44 0.01 -1.26 -5.12 113.70 110.74 2efi s SER 6 Ca 0.25 0.39 0.00 0.00 1.31 0.00 0.00 55.95 57.89 2efi s SER 6 Cb -0.11 0.33 0.00 0.00 0.21 0.00 0.00 66.02 66.45 2efi s SER 6 CO -0.09 -0.20 0.00 0.61 0.41 0.00 0.00 173.24 173.97 2efi n GLY 7 N 4.80 2.48 3.81 3.44 0.00 -1.26 -5.16 105.19 113.30 2efi n GLY 7 Ca -0.15 0.30 -0.32 0.00 0.00 0.00 0.00 46.02 45.85 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 3.06 0.03 1.61 1.00 -1.26 -5.08 119.30 118.66 2efi s MET 8 Ca 0.00 1.06 0.03 0.00 0.00 0.00 0.00 55.69 56.77 2efi s MET 8 Cb 0.00 -2.00 -0.02 0.00 0.00 0.00 0.00 34.83 32.81 2efi s MET 8 CO 0.00 -1.01 -0.09 0.00 0.00 0.00 0.00 175.02 173.92 2efi s ALA 9 N -2.81 0.67 1.03 3.03 0.00 -1.26 -5.16 121.76 117.25 2efi s ALA 9 Ca 0.60 -0.67 -0.02 0.00 0.00 0.00 0.00 51.96 51.87 2efi s ALA 9 Cb -0.15 -0.03 0.03 0.00 0.00 0.00 0.00 23.12 22.97 2efi s ALA 9 CO 0.48 0.06 0.12 -0.35 0.00 0.00 0.00 175.76 176.06 2efi n PRO 10 N 1.85 -1.25 -1.63 0.00 -0.04 -1.26 -4.90 135.00 127.78 2efi n PRO 10 Ca -0.20 -0.18 -0.30 0.00 -0.04 0.00 0.00 63.50 62.77 2efi n PRO 10 Cb 0.55 -0.17 -0.04 0.00 -0.04 0.00 0.00 33.50 33.80 2efi n PRO 10 CO 0.00 0.00 0.00 1.63 -0.04 0.00 0.00 175.50 177.09 2efi n LYS 11 N -1.86 2.99 -3.80 0.54 4.01 -1.26 -4.94 118.16 113.85 2efi n LYS 11 Ca 0.02 -2.65 -0.21 0.00 -0.51 0.00 0.00 58.31 54.96 2efi n LYS 11 Cb 0.06 -2.27 -0.04 0.00 -0.51 0.00 0.00 35.03 32.27 2efi n LYS 11 CO 0.00 0.00 0.00 -1.14 -1.11 0.00 0.00 177.40 175.15 2efi s GLN 12 N -1.58 2.69 0.45 1.97 0.74 -1.26 -5.07 119.66 117.61 2efi s GLN 12 Ca 0.58 -1.33 -0.18 0.00 0.05 0.00 0.00 55.36 54.48 2efi s GLN 12 Cb 0.33 -2.45 -0.14 0.00 1.10 0.00 0.00 33.01 31.84 2efi s GLN 12 CO -0.19 0.06 -0.06 -0.40 -0.55 0.00 0.00 175.29 174.15 2efi n ASP 13 N -1.38 -3.29 -4.74 6.67 5.68 -1.26 -4.90 116.55 113.32 2efi n ASP 13 Ca -0.01 0.67 -0.30 0.00 -0.50 0.00 0.00 54.79 54.64 2efi n ASP 13 Cb 0.60 -0.82 0.12 0.00 -1.14 0.00 0.00 41.12 39.88 2efi n ASP 13 CO 0.00 0.00 0.00 -2.16 -1.33 0.00 0.00 177.20 173.71 2efi s PRO 14 N -0.96 1.72 -0.12 0.11 0.04 -1.26 -5.04 135.00 129.49 2efi s PRO 14 Ca 0.55 0.98 -0.06 0.00 0.04 0.00 0.00 61.00 62.51 2efi s PRO 14 Cb -0.51 -1.85 -0.04 0.00 0.04 0.00 0.00 34.50 32.14 2efi s PRO 14 CO 0.62 -1.96 0.11 0.21 0.04 0.00 0.00 177.00 176.02 2efi s LYS 15 N -4.92 3.43 0.89 4.56 2.20 -1.26 -5.02 119.74 119.61 2efi s LYS 15 Ca 0.62 -0.20 -0.11 0.00 -0.36 0.00 0.00 55.97 55.92 2efi s LYS 15 Cb -0.18 -3.13 0.12 0.00 -1.51 0.00 0.00 37.83 33.14 2efi s LYS 15 CO 0.56 0.71 1.09 -1.25 -0.36 0.00 0.00 175.35 176.11 2efi s PRO 16 N -0.84 1.34 -0.23 4.03 0.04 -1.26 -5.01 135.00 133.07 2efi s PRO 16 Ca 0.14 0.85 0.01 0.00 0.04 0.00 0.00 61.00 62.03 2efi s PRO 16 Cb -0.12 -1.82 -0.14 0.00 0.04 0.00 0.00 34.50 32.46 2efi s PRO 16 CO 0.03 -2.19 -0.21 1.63 0.04 0.00 0.00 177.00 176.30 2efi n LYS 17 N -3.85 0.56 -2.78 4.56 5.02 -1.26 -5.00 118.16 115.41 2efi n LYS 17 Ca 0.07 0.14 -0.28 0.00 -2.02 0.00 0.00 58.31 56.22 2efi n LYS 17 Cb 0.55 -1.44 -0.01 0.00 -0.02 0.00 0.00 35.03 34.10 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 -2.45 3.53 0.21 2.13 0.40 -1.26 -5.10 117.98 115.43 2efi s PHE 18 Ca -0.31 0.85 0.11 0.00 -0.60 0.00 0.00 56.93 56.98 2efi s PHE 18 Cb 0.08 -2.31 -0.04 0.00 0.51 0.00 0.00 43.02 41.26 2efi s PHE 18 CO 0.51 -0.18 -0.22 -0.65 0.70 0.00 0.00 175.22 175.39 2efi s GLN 19 N -4.37 1.61 0.26 0.44 -0.21 -1.26 -5.05 119.66 111.07 2efi s GLN 19 Ca 0.48 -1.54 -0.30 0.00 0.02 0.00 0.00 55.36 54.02 2efi s GLN 19 Cb -0.10 -1.87 -0.10 0.00 1.00 0.00 0.00 33.01 31.94 2efi s GLN 19 CO 0.39 0.39 1.47 -1.21 -2.12 0.00 0.00 175.29 174.21 2efi s GLU 20 N -2.84 4.24 0.00 2.91 2.02 -1.26 -2.41 118.70 121.36 2efi s GLU 20 Ca 0.23 2.35 0.00 0.00 0.02 0.00 0.00 54.97 57.57 2efi s GLU 20 Cb -0.07 -3.10 0.00 0.00 0.10 0.00 0.00 34.13 31.06 2efi s GLU 20 CO 0.11 -0.46 0.00 0.41 0.02 0.00 0.00 175.26 175.35 2efi n GLY 21 N 2.20 3.17 3.74 -1.39 0.00 0.95 -4.97 105.19 108.89 2efi n GLY 21 Ca 0.07 0.00 -0.41 0.00 0.00 0.00 0.00 46.02 45.68 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 -0.39 4.49 0.03 1.61 2.56 -1.01 -4.74 118.70 121.24 2efi s GLU 22 Ca 0.00 1.87 -0.30 0.00 0.00 0.00 0.00 54.97 56.53 2efi s GLU 22 Cb 0.00 -3.25 -0.06 0.00 2.00 0.00 0.00 34.13 32.82 2efi s GLU 22 CO 0.00 -0.10 1.35 0.50 -0.56 0.00 0.00 175.26 176.45 2efi s ARG 23 N -0.14 4.32 0.18 4.30 3.52 -1.26 -2.18 118.95 127.69 2efi s ARG 23 Ca 0.53 1.93 -0.00 0.00 -0.13 0.00 0.00 55.73 58.06 2efi s ARG 23 Cb -0.32 -3.47 -0.04 0.00 -1.56 0.00 0.00 34.95 29.55 2efi s ARG 23 CO 0.36 -0.49 0.08 0.14 -0.81 0.00 0.00 175.30 174.58 2efi s VAL 24 N 1.93 0.23 -0.26 7.11 -7.23 0.14 -4.37 120.40 117.95 2efi s VAL 24 Ca 0.62 -1.97 -0.06 0.00 -1.81 0.00 0.00 61.98 58.76 2efi s VAL 24 Cb -0.32 -2.32 -0.01 0.00 0.56 0.00 0.00 36.38 34.30 2efi s VAL 24 CO 0.27 -0.22 0.04 -0.76 -0.31 0.00 0.00 175.10 174.12 2efi s LEU 25 N -3.15 3.42 0.31 1.32 1.43 -1.23 -1.95 118.68 118.83 2efi s LEU 25 Ca 0.32 -0.41 0.00 0.00 -1.03 0.00 0.00 54.13 53.01 2efi s LEU 25 Cb 0.07 -1.86 -0.04 0.00 0.03 0.00 0.00 46.19 44.39 2efi s LEU 25 CO 0.08 -0.08 0.51 0.00 0.23 0.00 0.00 176.35 177.09 2efi s PHE 27 N -2.20 3.43 -0.37 0.00 0.08 -1.02 -2.84 117.98 115.06 2efi s PHE 27 Ca 0.40 -1.89 0.06 0.00 0.12 0.00 0.00 56.93 55.62 2efi s PHE 27 Cb -0.10 -3.26 0.50 0.00 -0.57 0.00 0.00 43.02 39.59 2efi s PHE 27 CO 0.34 -0.94 1.54 1.58 -0.10 0.00 0.00 175.22 177.63 2efi n HIS 28 N 4.84 1.98 0.00 0.36 -0.00 -1.25 -5.05 115.22 116.10 2efi n HIS 28 Ca -0.07 -2.02 0.00 0.00 -0.00 0.00 0.00 57.72 55.62 2efi n HIS 28 Cb 0.42 -0.66 0.00 0.00 -0.00 0.00 0.00 29.99 29.74 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 -1.00 0.80 0.00 1.57 0.00 -1.26 -4.79 105.19 100.51 2efi n GLY 29 Ca 0.43 -1.88 0.05 0.00 0.00 0.00 0.00 46.02 44.63 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 0.48 -4.02 1.61 -0.04 -1.26 -4.67 135.00 127.10 2efi n PRO 30 Ca 0.00 0.00 -0.12 0.00 -0.04 0.00 0.00 63.50 63.34 2efi n PRO 30 Cb 0.00 -1.35 -0.12 0.00 -0.04 0.00 0.00 33.50 31.99 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 -1.71 2.18 0.20 1.53 1.43 -1.26 -4.96 118.68 116.09 2efi s LEU 31 Ca 0.16 -0.39 -0.14 0.00 -1.03 0.00 0.00 54.13 52.74 2efi s LEU 31 Cb 0.08 -0.06 -0.07 0.00 0.03 0.00 0.00 46.19 46.16 2efi s LEU 31 CO 0.13 -0.17 0.59 -0.76 0.23 0.00 0.00 176.35 176.37 2efi s LEU 32 N -1.10 4.26 -0.02 1.79 1.43 -1.26 -3.84 118.68 119.95 2efi s LEU 32 Ca -0.09 1.10 0.04 0.00 -1.03 0.00 0.00 54.13 54.15 2efi s LEU 32 Cb -0.07 -3.51 -0.01 0.00 0.03 0.00 0.00 46.19 42.63 2efi s LEU 32 CO -0.00 0.01 -0.15 -0.31 0.23 0.00 0.00 176.35 176.13 2efi s TYR 33 N -1.62 1.34 0.16 0.29 1.51 -1.13 -4.87 117.35 113.02 2efi s TYR 33 Ca 0.43 -0.27 -0.31 0.00 -1.01 0.00 0.00 57.07 55.90 2efi s TYR 33 Cb -0.14 -0.87 -0.09 0.00 -0.11 0.00 0.00 41.96 40.75 2efi s TYR 33 CO 0.20 -0.04 1.51 -2.00 -1.11 0.00 0.00 175.55 174.10 2efi s GLU 34 N -0.28 4.25 0.28 -0.62 2.12 -1.26 -2.80 118.70 120.39 2efi s GLU 34 Ca 0.04 2.28 -0.14 0.00 0.36 0.00 0.00 54.97 57.51 2efi s GLU 34 Cb -0.06 -3.18 0.01 0.00 0.26 0.00 0.00 34.13 31.16 2efi s GLU 34 CO -0.00 -0.55 0.56 0.00 -0.54 0.00 0.00 175.26 174.74 2efi s ALA 35 N 1.05 -0.40 0.03 6.30 0.00 -0.82 -2.03 121.76 125.89 2efi s ALA 35 Ca 0.68 -0.81 0.04 0.00 0.00 0.00 0.00 51.96 51.87 2efi s ALA 35 Cb -0.42 0.99 -0.02 0.00 0.00 0.00 0.00 23.12 23.67 2efi s ALA 35 CO 0.32 -0.90 -0.11 0.21 0.00 0.00 0.00 175.76 175.27 2efi s LYS 36 N -3.71 0.77 -0.53 0.00 2.36 -1.25 -0.68 119.74 116.70 2efi s LYS 36 Ca 0.20 -0.67 -0.27 0.00 -2.55 0.00 0.00 55.97 52.68 2efi s LYS 36 Cb -0.02 -0.73 -0.04 0.00 -1.05 0.00 0.00 37.83 35.99 2efi s LYS 36 CO 0.10 0.18 2.05 0.00 1.55 0.00 0.00 175.35 179.23 2efi h VAL 38 N 7.16 1.51 -3.98 0.00 2.07 0.10 0.27 116.25 123.38 2efi h VAL 38 Ca -0.27 -2.22 -0.12 0.00 0.82 0.00 0.00 66.70 64.91 2efi h VAL 38 Cb 1.20 2.89 -0.12 0.00 -1.52 0.00 0.00 31.29 33.75 2efi h VAL 38 CO 1.17 0.63 -0.32 -0.54 0.02 0.00 0.00 177.57 178.53 2efi s LYS 39 N -2.86 1.33 -0.23 1.57 1.02 -1.10 -4.78 119.74 114.68 2efi s LYS 39 Ca -0.14 -1.33 -0.04 0.00 0.02 0.00 0.00 55.97 54.48 2efi s LYS 39 Cb 0.02 0.39 0.08 0.00 -0.52 0.00 0.00 37.83 37.79 2efi s LYS 39 CO 0.80 -0.51 0.09 0.08 -0.92 0.00 0.00 175.35 174.89 2efi s VAL 40 N -4.04 0.21 0.27 3.17 1.01 -1.26 -0.33 120.40 119.43 2efi s VAL 40 Ca 0.25 -0.63 0.09 0.00 0.00 0.00 0.00 61.98 61.70 2efi s VAL 40 Cb 0.03 -0.98 -0.04 0.00 0.00 0.00 0.00 36.38 35.39 2efi s VAL 40 CO 0.07 -0.46 0.00 0.00 0.00 0.00 0.00 175.10 174.71 2efi s ALA 41 N 1.98 3.18 -0.04 5.51 0.00 -0.91 -4.98 121.76 126.50 2efi s ALA 41 Ca 0.05 -1.66 -0.01 0.00 0.00 0.00 0.00 51.96 50.33 2efi s ALA 41 Cb -0.16 -0.77 0.03 0.00 0.00 0.00 0.00 23.12 22.22 2efi s ALA 41 CO -0.20 0.26 0.03 0.42 0.00 0.00 0.00 175.76 176.27 2efi s ILE 42 N -2.33 0.05 0.32 0.00 1.01 -1.26 -0.13 121.20 118.85 2efi s ILE 42 Ca 0.32 0.27 -0.18 0.00 0.00 0.00 0.00 60.65 61.05 2efi s ILE 42 Cb -0.06 -0.24 0.04 0.00 0.01 0.00 0.00 42.46 42.22 2efi s ILE 42 CO 0.20 0.17 0.79 -0.54 0.00 0.00 0.00 174.94 175.57 2efi s LYS 43 N 1.74 1.97 -0.79 2.79 1.02 -0.12 -4.94 119.74 121.41 2efi s LYS 43 Ca -0.00 -1.20 -0.05 0.00 0.02 0.00 0.00 55.97 54.73 2efi s LYS 43 Cb -0.13 0.59 0.05 0.00 -0.52 0.00 0.00 37.83 37.83 2efi s LYS 43 CO -0.03 -0.91 0.20 -3.47 -0.92 0.00 0.00 175.35 170.21 2efi n ASP 44 N -1.01 -2.38 -3.29 2.83 2.03 -1.26 0.11 116.55 113.57 2efi n ASP 44 Ca -0.06 -0.02 -0.23 0.00 0.52 0.00 0.00 54.79 55.00 2efi n ASP 44 Cb 0.60 -2.07 0.06 0.00 -0.72 0.00 0.00 41.12 38.99 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 -3.07 -6.77 -3.72 -0.67 4.01 -1.26 -4.99 118.16 101.68 2efi n LYS 45 Ca -0.02 0.82 -0.14 0.00 -0.51 0.00 0.00 58.31 58.46 2efi n LYS 45 Cb 0.53 -5.72 -0.08 0.00 -0.51 0.00 0.00 35.03 29.24 2efi n LYS 45 CO 0.00 0.00 0.00 1.14 -1.11 0.00 0.00 177.40 177.43 2efi s GLN 46 N -6.08 0.72 -0.22 1.97 -2.07 0.30 -5.08 119.66 109.20 2efi s GLN 46 Ca 0.48 -0.10 -0.09 0.00 -1.82 0.00 0.00 55.36 53.83 2efi s GLN 46 Cb -0.21 0.33 -0.04 0.00 -1.09 0.00 0.00 33.01 31.99 2efi s GLN 46 CO 0.60 -0.20 0.10 0.08 -1.32 0.00 0.00 175.29 174.55 2efi s VAL 47 N -1.26 4.91 0.45 3.63 1.01 -1.26 -0.94 120.40 126.93 2efi s VAL 47 Ca -0.13 0.02 0.05 0.00 0.00 0.00 0.00 61.98 61.93 2efi s VAL 47 Cb -0.04 -3.26 -0.04 0.00 0.00 0.00 0.00 36.38 33.03 2efi s VAL 47 CO 0.05 0.38 0.09 -0.54 0.00 0.00 0.00 175.10 175.09 2efi s LYS 48 N 0.94 2.13 -0.19 2.72 1.02 0.81 -1.75 119.74 125.41 2efi s LYS 48 Ca 0.05 -2.10 -0.07 0.00 0.02 0.00 0.00 55.97 53.88 2efi s LYS 48 Cb -0.14 -1.75 0.09 0.00 -0.52 0.00 0.00 37.83 35.51 2efi s LYS 48 CO 0.03 -0.20 0.40 0.71 -0.92 0.00 0.00 175.35 175.37 2efi s TYR 49 N -2.73 -0.75 -0.45 3.18 1.51 0.22 -2.13 117.35 116.19 2efi s TYR 49 Ca 0.29 1.46 -0.27 0.00 -1.01 0.00 0.00 57.07 57.54 2efi s TYR 49 Cb 0.05 0.27 -0.05 0.00 -0.11 0.00 0.00 41.96 42.12 2efi s TYR 49 CO 0.16 -0.46 2.19 0.12 -1.11 0.00 0.00 175.55 176.45 2efi s PHE 50 N 2.53 1.30 0.38 2.71 5.36 0.55 -2.89 117.98 127.92 2efi s PHE 50 Ca -0.02 1.12 -0.15 0.00 -0.96 0.00 0.00 56.93 56.92 2efi s PHE 50 Cb -0.12 -3.81 -0.09 0.00 -0.34 0.00 0.00 43.02 38.66 2efi s PHE 50 CO -0.12 -2.79 0.81 0.42 -1.46 0.00 0.00 175.22 172.08 2efi s ILE 51 N 10.30 4.63 -0.40 3.12 -1.09 -1.19 0.83 121.20 137.41 2efi s ILE 51 Ca 0.89 1.01 0.01 0.00 -2.23 0.00 0.00 60.65 60.34 2efi s ILE 51 Cb -0.19 -3.65 0.13 0.00 -1.58 0.00 0.00 42.46 37.17 2efi s ILE 51 CO 0.27 -0.34 0.19 -2.28 -1.23 0.00 0.00 174.94 171.55 2efi s HIS 52 N -2.18 1.89 -0.30 3.97 5.65 -1.15 -4.15 115.29 119.02 2efi s HIS 52 Ca 0.56 -2.22 -0.39 0.00 0.25 0.00 0.00 55.06 53.26 2efi s HIS 52 Cb -0.10 -1.82 -0.15 0.00 -1.18 0.00 0.00 32.58 29.33 2efi s HIS 52 CO 0.21 -0.82 1.89 0.66 -0.65 0.00 0.00 174.74 176.04 2efi n TYR 53 N 3.93 1.91 -0.21 3.88 4.01 -1.26 -3.78 117.16 125.64 2efi n TYR 53 Ca 0.06 0.45 -0.08 0.00 -0.16 0.00 0.00 57.90 58.17 2efi n TYR 53 Cb 0.37 -2.48 0.02 0.00 -0.31 0.00 0.00 39.34 36.94 2efi n TYR 53 CO 0.00 0.00 0.00 1.03 -0.46 0.00 0.00 176.86 177.43 2efi h SER 54 N 8.72 0.93 -0.43 7.72 0.87 -1.79 -3.27 113.55 126.31 2efi h SER 54 Ca -0.40 -0.25 0.04 0.00 -1.23 0.00 0.00 61.79 59.95 2efi h SER 54 Cb 1.32 -0.25 -0.05 0.00 -0.44 0.00 0.00 62.40 62.99 2efi h SER 54 CO 0.98 0.94 -0.25 0.61 -0.53 0.00 0.00 176.83 178.58 2efi n GLY 55 N -0.58 -2.02 3.15 5.77 0.00 -1.26 -4.40 105.19 105.85 2efi n GLY 55 Ca 0.03 0.68 -0.25 0.00 0.00 0.00 0.00 46.02 46.48 2efi n GLY 55 CO 0.00 0.00 0.00 -0.98 0.00 0.00 0.00 173.32 172.34 2efi s TRP 56 N -4.42 1.57 0.34 1.61 0.51 -1.23 -5.12 118.94 112.20 2efi s TRP 56 Ca -0.05 -0.34 -0.29 0.00 -2.12 0.00 0.00 56.10 53.30 2efi s TRP 56 Cb 0.05 -1.02 -0.11 0.00 -0.81 0.00 0.00 33.47 31.58 2efi s TRP 56 CO 0.27 -0.06 1.47 -0.80 -0.51 0.00 0.00 176.95 177.32 2efi s ASN 57 N -0.27 6.45 -1.60 2.95 -0.87 -1.26 -2.70 114.94 117.63 2efi s ASN 57 Ca 0.04 2.93 -0.06 0.00 -1.57 0.00 0.00 52.86 54.20 2efi s ASN 57 Cb -0.08 -2.65 0.06 0.00 -0.02 0.00 0.00 41.25 38.55 2efi s ASN 57 CO 0.00 -0.81 0.24 1.17 -2.57 0.00 0.00 177.10 175.14 2efi n LYS 58 N 1.04 -1.47 -2.54 -0.60 0.00 -1.26 -4.79 118.16 108.53 2efi n LYS 58 Ca 0.03 0.17 -0.43 0.00 0.00 0.00 0.00 58.31 58.08 2efi n LYS 58 Cb 0.39 -4.07 0.00 0.00 0.00 0.00 0.00 35.03 31.35 2efi n LYS 58 CO 0.00 0.00 0.00 -1.71 0.00 0.00 0.00 177.40 175.69 2efi n ASN 59 N -2.81 4.89 -4.34 3.14 5.15 -1.10 -4.40 115.26 115.78 2efi n ASN 59 Ca -0.21 -2.92 -0.39 0.00 -0.60 0.00 0.00 54.58 50.46 2efi n ASN 59 Cb 0.63 -1.73 -0.05 0.00 -0.53 0.00 0.00 39.78 38.11 2efi n ASN 59 CO 0.00 0.00 0.00 0.79 1.40 0.00 0.00 177.26 179.45 2efi n TRP 60 N 8.01 -1.53 -0.90 1.20 8.01 -1.26 -4.78 117.44 126.19 2efi n TRP 60 Ca 0.48 0.76 -0.28 0.00 -1.31 0.00 0.00 57.50 57.15 2efi n TRP 60 Cb 0.45 -2.55 0.01 0.00 -2.01 0.00 0.00 31.31 27.21 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 -2.59 -2.73 -3.80 -0.99 9.92 -1.26 -4.99 116.55 110.11 2efi n ASP 61 Ca 0.09 0.46 -0.11 0.00 -0.53 0.00 0.00 54.79 54.71 2efi n ASP 61 Cb 0.48 -0.61 -0.08 0.00 -0.64 0.00 0.00 41.12 40.27 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 -0.76 0.79 0.11 -1.24 1.03 -1.26 -5.08 118.70 112.29 2efi s GLU 62 Ca 0.41 -0.64 -0.22 0.00 0.03 0.00 0.00 54.97 54.55 2efi s GLU 62 Cb -0.35 0.33 -0.07 0.00 -0.80 0.00 0.00 34.13 33.24 2efi s GLU 62 CO 0.49 -0.25 0.68 -1.58 -1.33 0.00 0.00 175.26 173.26 2efi s TRP 63 N -2.84 3.84 0.08 4.83 0.52 -1.26 -3.14 118.94 120.97 2efi s TRP 63 Ca -0.03 1.45 0.05 0.00 0.02 0.00 0.00 56.10 57.59 2efi s TRP 63 Cb 0.00 -2.64 -0.03 0.00 -1.15 0.00 0.00 33.47 29.65 2efi s TRP 63 CO -0.05 0.52 -0.13 0.14 0.02 0.00 0.00 176.95 177.45 2efi s VAL 64 N -1.01 1.11 0.00 4.03 -7.23 -1.14 -4.94 120.40 111.22 2efi s VAL 64 Ca 0.33 -1.42 0.00 0.00 -1.81 0.00 0.00 61.98 59.07 2efi s VAL 64 Cb -0.21 -1.18 0.00 0.00 0.56 0.00 0.00 36.38 35.54 2efi s VAL 64 CO 0.22 -0.31 0.00 -0.81 -0.31 0.00 0.00 175.10 173.89 2efi n PRO 65 N 1.04 -0.21 0.04 4.82 -0.04 -1.26 0.69 135.00 140.08 2efi n PRO 65 Ca -0.19 0.00 0.12 0.00 -0.04 0.00 0.00 63.50 63.38 2efi n PRO 65 Cb 0.55 0.00 0.14 0.00 -0.04 0.00 0.00 33.50 34.15 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 -0.90 0.23 0.09 0.54 2.13 -0.72 -3.84 120.64 118.17 2efi n GLU 66 Ca 0.00 0.04 0.11 0.00 0.66 0.00 0.00 57.16 57.97 2efi n GLU 66 Cb 0.00 -1.62 -0.00 0.00 0.27 0.00 0.00 31.44 30.09 2efi n GLU 66 CO 0.00 0.00 0.00 0.45 -0.41 0.00 0.00 177.13 177.17 2efi n SER 67 N -1.93 0.78 -0.07 4.31 2.88 -1.26 -3.78 113.62 114.54 2efi n SER 67 Ca 0.03 0.28 0.13 0.00 -1.33 0.00 0.00 58.87 57.98 2efi n SER 67 Cb 0.42 0.55 0.41 0.00 -0.75 0.00 0.00 64.21 64.84 2efi n SER 67 CO 0.00 0.00 0.00 0.54 -1.23 0.00 0.00 175.04 174.35 2efi n ARG 68 N -2.60 0.30 -4.54 -1.46 1.74 -1.25 -4.84 116.66 104.01 2efi n ARG 68 Ca -0.00 -0.14 -0.34 0.00 -0.77 0.00 0.00 57.85 56.60 2efi n ARG 68 Cb 0.54 -1.50 -0.11 0.00 -1.02 0.00 0.00 32.46 30.38 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 -2.80 3.87 0.32 1.55 1.01 -1.25 -2.42 120.40 120.68 2efi s VAL 69 Ca 0.18 -0.44 0.08 0.00 0.00 0.00 0.00 61.98 61.80 2efi s VAL 69 Cb 0.19 -2.60 -0.04 0.00 0.00 0.00 0.00 36.38 33.92 2efi s VAL 69 CO 0.59 0.58 0.13 -0.76 0.00 0.00 0.00 175.10 175.64 2efi s LEU 70 N -0.89 3.32 0.00 3.92 1.43 -0.70 -4.92 118.68 120.84 2efi s LEU 70 Ca 0.13 -0.68 0.07 0.00 -1.03 0.00 0.00 54.13 52.62 2efi s LEU 70 Cb -0.11 -1.83 0.31 0.00 0.03 0.00 0.00 46.19 44.60 2efi s LEU 70 CO 0.02 -0.22 1.22 0.29 0.23 0.00 0.00 176.35 177.89 2efi n LYS 71 N -1.12 1.19 -4.02 1.70 4.01 -1.26 -3.57 118.16 115.10 2efi n LYS 71 Ca -0.04 -0.30 -0.32 0.00 -0.51 0.00 0.00 58.31 57.15 2efi n LYS 71 Cb 0.60 -1.13 0.00 0.00 -0.51 0.00 0.00 35.03 34.00 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 -0.32 -2.03 -3.87 2.13 4.19 -1.26 -4.93 117.16 111.07 2efi n TYR 72 Ca 0.06 0.85 -0.21 0.00 3.31 0.00 0.00 57.90 61.91 2efi n TYR 72 Cb 0.09 -3.60 -0.03 0.00 0.49 0.00 0.00 39.34 36.29 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 -3.37 4.36 0.10 2.97 -7.23 -1.26 -4.87 120.40 111.10 2efi s VAL 73 Ca 0.61 -1.21 -0.19 0.00 -1.81 0.00 0.00 61.98 59.39 2efi s VAL 73 Cb -0.32 -3.47 -0.04 0.00 0.56 0.00 0.00 36.38 33.11 2efi s VAL 73 CO 0.87 -0.26 1.05 0.47 -0.31 0.00 0.00 175.10 176.91 2efi n ASP 74 N -1.38 -0.63 -0.20 4.85 8.00 -1.26 -0.16 116.55 125.77 2efi n ASP 74 Ca -0.05 1.19 -0.12 0.00 0.71 0.00 0.00 54.79 56.52 2efi n ASP 74 Cb 0.58 -0.20 -0.08 0.00 -0.02 0.00 0.00 41.12 41.40 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 0.02 -0.87 -3.53 2.02 -2.00 0.15 112.91 108.69 2efi h THR 75 Ca 0.10 0.00 0.10 0.00 0.77 0.00 0.00 66.41 67.38 2efi h THR 75 Cb 0.25 0.02 -0.08 0.00 -1.74 0.00 0.00 68.15 66.60 2efi h THR 75 CO -0.56 0.00 0.51 0.78 0.37 0.00 0.00 175.52 176.62 2efi h ASN 76 N -0.30 0.74 -0.61 4.18 2.35 -0.98 -1.58 115.58 119.38 2efi h ASN 76 Ca 0.11 0.05 0.03 0.00 -0.55 0.00 0.00 56.30 55.94 2efi h ASN 76 Cb 0.56 -0.09 -0.04 0.00 0.05 0.00 0.00 38.32 38.80 2efi h ASN 76 CO -0.67 0.41 0.37 -0.07 -1.65 0.00 0.00 177.43 175.81 2efi h LEU 77 N 0.84 0.59 -1.24 1.61 3.38 0.20 -1.95 115.31 118.74 2efi h LEU 77 Ca 0.43 0.01 0.39 0.00 0.09 0.00 0.00 57.88 58.80 2efi h LEU 77 Cb 0.41 -0.12 -0.14 0.00 0.09 0.00 0.00 40.66 40.90 2efi h LEU 77 CO -0.26 0.41 0.72 1.56 0.09 0.00 0.00 178.44 180.96 2efi h GLN 78 N 0.72 0.15 0.00 1.13 1.08 0.18 -0.69 115.11 117.68 2efi h GLN 78 Ca 0.25 -0.01 0.00 0.00 -1.45 0.00 0.00 58.65 57.44 2efi h GLN 78 Cb 0.04 -0.03 0.00 0.00 -0.05 0.00 0.00 27.48 27.44 2efi h GLN 78 CO -0.11 0.10 -0.05 -0.22 -0.95 0.00 0.00 178.83 177.60 2efi h LYS 79 N 0.15 0.00 -0.97 1.46 3.64 -1.42 -2.78 116.57 116.65 2efi h LYS 79 Ca 0.79 0.00 0.33 0.00 -1.27 0.00 0.00 60.65 60.50 2efi h LYS 79 Cb 2.22 0.00 -0.09 0.00 -0.41 0.00 0.00 32.23 33.95 2efi h LYS 79 CO -0.51 0.00 0.63 0.94 -2.27 0.00 0.00 179.45 178.24 2efi n GLN 80 N -2.97 -0.02 0.00 1.90 7.27 -0.93 0.23 117.38 122.86 2efi n GLN 80 Ca -0.01 0.84 -0.18 0.00 0.07 0.00 0.00 57.00 57.72 2efi n GLN 80 Cb 0.02 -1.67 -0.14 0.00 2.41 0.00 0.00 30.24 30.86 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 0.19 -0.87 3.69 0.11 -1.27 -2.48 114.38 113.75 2efi h ARG 81 Ca 0.60 -0.33 0.16 0.00 0.10 0.00 0.00 59.98 60.51 2efi h ARG 81 Cb 1.98 0.12 -0.07 0.00 1.11 0.00 0.00 29.97 33.11 2efi h ARG 81 CO -0.29 1.16 0.56 1.05 0.10 0.00 0.00 179.97 182.55 2efi h GLU 82 N -0.58 0.55 0.01 0.08 4.11 0.32 0.34 114.58 119.40 2efi h GLU 82 Ca -0.12 -0.03 -0.00 0.00 0.07 0.00 0.00 59.36 59.27 2efi h GLU 82 Cb 1.45 -0.12 0.00 0.00 0.50 0.00 0.00 28.75 30.57 2efi h GLU 82 CO 0.08 0.36 -0.00 -0.07 0.07 0.00 0.00 179.01 179.45 2efi h LEU 83 N 0.56 -0.01 -2.00 3.06 3.38 -1.20 0.19 115.31 119.29 2efi h LEU 83 Ca 0.44 -0.78 0.18 0.00 0.09 0.00 0.00 57.88 57.81 2efi h LEU 83 Cb 0.86 0.00 -0.03 0.00 0.09 0.00 0.00 40.66 41.59 2efi h LEU 83 CO -0.19 0.85 0.48 1.56 0.09 0.00 0.00 178.44 181.23 2efi h GLN 84 N -0.96 0.00 0.03 1.13 4.20 -0.97 -0.80 115.11 117.74 2efi h GLN 84 Ca -0.00 0.00 -0.35 0.00 0.06 0.00 0.00 58.65 58.36 2efi h GLN 84 Cb 0.79 0.00 -0.05 0.00 0.30 0.00 0.00 27.48 28.52 2efi h GLN 84 CO 0.00 0.00 -2.10 0.36 -0.67 0.00 0.00 178.83 176.42 2efi n LYS 85 N -4.24 0.68 -0.29 1.46 2.85 0.07 -4.25 118.16 114.44 2efi n LYS 85 Ca 0.12 0.18 0.01 0.00 -1.05 0.00 0.00 58.31 57.56 2efi n LYS 85 Cb 0.72 -1.65 0.14 0.00 -0.65 0.00 0.00 35.03 33.59 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 0.63 1.11 -3.18 0.58 0.00 0.77 -3.36 119.26 115.81 2efi h ALA 86 Ca -0.44 0.01 -0.60 0.00 0.00 0.00 0.00 54.91 53.88 2efi h ALA 86 Cb 2.07 -0.19 -0.40 0.00 0.00 0.00 0.00 17.79 19.27 2efi h ALA 86 CO 0.04 0.18 -0.75 -0.80 0.00 0.00 0.00 179.25 177.92 2efi s ASN 87 N -5.69 4.04 -0.07 0.00 0.01 -0.63 -5.00 114.94 107.59 2efi s ASN 87 Ca -0.13 -1.90 -0.00 0.00 -0.71 0.00 0.00 52.86 50.12 2efi s ASN 87 Cb 0.18 -0.99 -0.00 0.00 0.41 0.00 0.00 41.25 40.85 2efi s ASN 87 CO 0.78 -0.38 -0.01 1.56 -1.51 0.00 0.00 177.10 177.54 2efi h GLN 88 N 7.76 0.00 -0.37 -0.60 7.50 -1.74 -3.24 115.11 124.42 2efi h GLN 88 Ca -0.10 0.00 0.03 0.00 0.50 0.00 0.00 58.65 59.09 2efi h GLN 88 Cb 1.00 0.00 -0.05 0.00 0.05 0.00 0.00 27.48 28.48 2efi h GLN 88 CO 0.48 0.00 -0.25 0.93 -1.50 0.00 0.00 178.83 178.49 2efi h GLU 89 N -0.66 -0.03 -0.90 1.46 5.08 -1.94 0.78 114.58 118.37 2efi h GLU 89 Ca 0.00 0.00 0.15 0.00 -1.00 0.00 0.00 59.36 58.52 2efi h GLU 89 Cb 0.02 0.01 -0.16 0.00 0.50 0.00 0.00 28.75 29.12 2efi h GLU 89 CO 0.00 -0.02 -0.33 1.96 -1.00 0.00 0.00 179.01 179.62 2efi h GLN 90 N -0.03 -0.03 -0.90 2.33 4.20 -1.95 0.91 115.11 119.63 2efi h GLN 90 Ca 0.06 0.00 0.09 0.00 0.06 0.00 0.00 58.65 58.86 2efi h GLN 90 Cb 0.19 0.01 -0.07 0.00 0.30 0.00 0.00 27.48 27.91 2efi h GLN 90 CO -0.37 -0.02 0.58 -0.92 -0.67 0.00 0.00 178.83 177.44 2efi h TYR 91 N -0.03 0.99 -0.22 2.96 5.03 -1.03 -2.03 116.97 122.63 2efi h TYR 91 Ca 0.36 0.03 -0.11 0.00 2.58 0.00 0.00 58.73 61.58 2efi h TYR 91 Cb 0.61 -0.32 -0.00 0.00 1.55 0.00 0.00 36.73 38.57 2efi h TYR 91 CO -0.78 0.46 -0.30 0.00 -1.32 0.00 0.00 178.16 176.23 2efi h ALA 92 N 1.54 0.34 -1.25 1.82 0.00 0.28 -3.43 119.26 118.56 2efi h ALA 92 Ca 0.42 -0.40 -0.72 0.00 0.00 0.00 0.00 54.91 54.20 2efi h ALA 92 Cb 0.37 -0.07 0.07 0.00 0.00 0.00 0.00 17.79 18.17 2efi h ALA 92 CO -0.18 0.35 0.01 0.39 0.00 0.00 0.00 179.25 179.83 2efi n GLU 93 N -4.32 0.39 0.00 0.00 1.02 0.89 -1.00 120.64 117.62 2efi n GLU 93 Ca -0.05 0.14 0.00 0.00 -0.02 0.00 0.00 57.16 57.23 2efi n GLU 93 Cb 0.47 -1.54 0.00 0.00 -0.02 0.00 0.00 31.44 30.36 2efi n GLU 93 CO 0.00 0.00 0.00 0.41 1.18 0.00 0.00 177.13 178.72 2efi n GLY 94 N 1.83 2.74 3.77 0.62 0.00 -1.26 -4.99 105.19 107.89 2efi n GLY 94 Ca 0.18 -0.69 -0.34 0.00 0.00 0.00 0.00 46.02 45.17 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 3.04 -0.52 1.61 1.02 -0.17 -4.99 119.74 119.73 2efi s LYS 95 Ca 0.00 1.58 -0.17 0.00 0.02 0.00 0.00 55.97 57.40 2efi s LYS 95 Cb 0.00 -1.96 0.09 0.00 -0.52 0.00 0.00 37.83 35.43 2efi s LYS 95 CO 0.00 -1.10 0.54 1.41 -0.92 0.00 0.00 175.35 175.28 2efi s MET 96 N -3.59 3.03 1.10 1.68 1.75 -1.26 -5.06 119.30 116.95 2efi s MET 96 Ca 0.72 -1.33 -0.15 0.00 -1.25 0.00 0.00 55.69 53.68 2efi s MET 96 Cb -0.24 -4.19 0.23 0.00 2.84 0.00 0.00 34.83 33.46 2efi s MET 96 CO 0.34 -1.25 0.49 2.89 -0.65 0.00 0.00 175.02 176.84 2efi n ARG 97 N 5.66 -2.90 0.00 4.11 1.85 -1.26 -4.95 116.66 119.18 2efi n ARG 97 Ca -0.11 -0.86 0.00 0.00 -1.00 0.00 0.00 57.85 55.88 2efi n ARG 97 Cb 0.43 -1.57 0.00 0.00 -1.05 0.00 0.00 32.46 30.27 2efi n ARG 97 CO 0.00 0.00 0.00 0.41 -0.01 0.00 0.00 177.63 178.03 2efi n GLY 98 N 2.32 0.81 4.13 2.89 0.00 -1.26 -5.04 105.19 109.05 2efi n GLY 98 Ca 0.08 -2.02 -0.31 0.00 0.00 0.00 0.00 46.02 43.77 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 -1.00 -1.71 1.89 4.61 0.00 -1.26 -5.33 120.51 117.71 2efi n ALA 99 Ca 0.00 -0.20 0.16 0.00 0.00 0.00 0.00 53.44 53.40 2efi n ALA 99 Cb 0.00 -2.13 0.86 0.00 0.00 0.00 0.00 19.45 18.18 2efi n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50