#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 1.42 -0.70 1.61 0.01 -1.26 -5.11 113.70 109.67 2efi s SER 2 Ca 0.00 -0.78 -0.13 0.00 1.31 0.00 0.00 55.95 56.35 2efi s SER 2 Cb 0.00 0.01 0.18 0.00 0.21 0.00 0.00 66.02 66.42 2efi s SER 2 CO 0.00 -0.25 0.62 -0.55 0.41 0.00 0.00 173.24 173.48 2efi s SER 3 N -2.34 6.34 -0.09 2.44 0.15 -1.26 -4.91 113.70 114.02 2efi s SER 3 Ca 0.04 -2.43 -0.02 0.00 0.70 0.00 0.00 55.95 54.24 2efi s SER 3 Cb -0.04 -2.15 -0.01 0.00 -1.71 0.00 0.00 66.02 62.12 2efi s SER 3 CO 0.00 -0.63 -0.04 1.23 1.20 0.00 0.00 173.24 175.00 2efi h GLY 4 N 8.01 0.00 -5.28 9.45 0.00 -2.09 -3.45 103.07 109.71 2efi h GLY 4 Ca -0.03 0.00 -0.58 0.00 0.00 0.00 0.00 47.33 46.72 2efi h GLY 4 CO 0.82 0.00 0.57 -0.56 0.00 0.00 0.00 176.54 177.37 2efi s SER 5 N -5.19 7.01 -0.01 0.19 0.01 -1.26 -5.03 113.70 109.43 2efi s SER 5 Ca -0.04 1.26 -0.12 0.00 1.31 0.00 0.00 55.95 58.36 2efi s SER 5 Cb 0.01 -2.49 0.01 0.00 0.21 0.00 0.00 66.02 63.76 2efi s SER 5 CO 0.06 -0.52 0.24 -0.44 0.41 0.00 0.00 173.24 172.99 2efi s SER 6 N 1.21 -0.11 0.00 2.44 0.01 -1.26 -5.13 113.70 110.85 2efi s SER 6 Ca 0.41 -0.02 0.00 0.00 1.31 0.00 0.00 55.95 57.64 2efi s SER 6 Cb -0.16 0.27 0.00 0.00 0.21 0.00 0.00 66.02 66.34 2efi s SER 6 CO 0.10 -0.42 0.00 0.61 0.41 0.00 0.00 173.24 173.94 2efi n GLY 7 N 1.35 0.73 3.73 3.44 0.00 -1.26 -5.10 105.19 108.08 2efi n GLY 7 Ca -0.22 -1.68 -0.37 0.00 0.00 0.00 0.00 46.02 43.76 2efi n GLY 7 CO 0.00 0.00 0.00 -0.29 0.00 0.00 0.00 173.32 173.03 2efi s MET 8 N -1.83 2.50 -0.24 1.61 1.75 -1.26 -5.03 119.30 116.80 2efi s MET 8 Ca 0.00 2.03 -0.27 0.00 -1.25 0.00 0.00 55.69 56.20 2efi s MET 8 Cb 0.00 -1.84 0.13 0.00 2.84 0.00 0.00 34.83 35.96 2efi s MET 8 CO 0.00 -1.63 1.07 0.00 -0.65 0.00 0.00 175.02 173.81 2efi s ALA 9 N -1.46 -1.99 -1.70 4.11 0.00 -1.26 -5.01 121.76 114.44 2efi s ALA 9 Ca 0.82 1.76 0.15 0.00 0.00 0.00 0.00 51.96 54.69 2efi s ALA 9 Cb -0.36 -1.22 0.84 0.00 0.00 0.00 0.00 23.12 22.38 2efi s ALA 9 CO 0.40 -0.25 1.38 -0.35 0.00 0.00 0.00 175.76 176.94 2efi n PRO 10 N 1.57 0.35 -2.27 0.00 -0.04 -1.26 -4.74 135.00 128.61 2efi n PRO 10 Ca -0.11 0.08 -0.42 0.00 -0.04 0.00 0.00 63.50 63.00 2efi n PRO 10 Cb 0.57 -1.50 -0.03 0.00 -0.04 0.00 0.00 33.50 32.50 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 -2.30 4.25 0.09 0.54 -0.14 -1.26 -4.94 119.74 115.99 2efi s LYS 11 Ca 0.19 1.89 -0.35 0.00 -1.36 0.00 0.00 55.97 56.33 2efi s LYS 11 Cb 0.10 -3.72 -0.15 0.00 -1.68 0.00 0.00 37.83 32.39 2efi s LYS 11 CO 0.20 -0.66 1.55 0.00 -0.76 0.00 0.00 175.35 175.69 2efi n GLN 12 N 6.10 1.82 -3.59 1.68 10.64 -1.26 -4.95 117.38 127.82 2efi n GLN 12 Ca 0.14 0.66 -0.06 0.00 -1.83 0.00 0.00 57.00 55.91 2efi n GLN 12 Cb 0.44 -2.39 -0.03 0.00 -0.86 0.00 0.00 30.24 27.39 2efi n GLN 12 CO 0.00 0.00 0.00 -0.51 -1.83 0.00 0.00 177.06 174.72 2efi s ASP 13 N 1.26 -0.19 0.98 2.61 1.01 -1.26 -5.18 116.67 115.90 2efi s ASP 13 Ca 0.83 0.11 -0.12 0.00 0.71 0.00 0.00 52.55 54.07 2efi s ASP 13 Cb -0.78 0.18 0.18 0.00 1.01 0.00 0.00 42.92 43.51 2efi s ASP 13 CO 0.43 -0.25 1.09 -2.16 0.21 0.00 0.00 175.17 174.50 2efi s PRO 14 N -1.84 0.60 -0.06 8.23 0.04 -1.26 -5.06 135.00 135.64 2efi s PRO 14 Ca 0.06 0.58 0.05 0.00 0.04 0.00 0.00 61.00 61.74 2efi s PRO 14 Cb -0.01 -1.75 -0.01 0.00 0.04 0.00 0.00 34.50 32.77 2efi s PRO 14 CO -0.04 -2.63 -0.22 0.21 0.04 0.00 0.00 177.00 174.35 2efi s LYS 15 N -4.96 2.58 0.76 4.56 2.47 -1.26 -5.08 119.74 118.82 2efi s LYS 15 Ca 0.65 -0.85 -0.11 0.00 -1.56 0.00 0.00 55.97 54.10 2efi s LYS 15 Cb -0.18 -2.24 0.05 0.00 -1.46 0.00 0.00 37.83 34.00 2efi s LYS 15 CO 0.57 0.43 1.09 -1.25 0.16 0.00 0.00 175.35 176.35 2efi s PRO 16 N -0.26 2.33 -0.26 4.03 0.04 -1.26 -5.01 135.00 134.62 2efi s PRO 16 Ca -0.00 1.20 -0.03 0.00 0.04 0.00 0.00 61.00 62.21 2efi s PRO 16 Cb -0.13 -1.90 -0.16 0.00 0.04 0.00 0.00 34.50 32.35 2efi s PRO 16 CO 0.03 -1.59 -0.25 1.63 0.04 0.00 0.00 177.00 176.86 2efi n LYS 17 N -3.36 0.64 -2.47 4.56 5.02 -1.26 -4.99 118.16 116.29 2efi n LYS 17 Ca 0.09 0.19 -0.27 0.00 -2.02 0.00 0.00 58.31 56.30 2efi n LYS 17 Cb 0.53 -1.52 0.02 0.00 -0.02 0.00 0.00 35.03 34.04 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 -2.52 3.33 0.23 2.13 0.40 -1.26 -5.11 117.98 115.19 2efi s PHE 18 Ca -0.36 0.68 0.10 0.00 -0.60 0.00 0.00 56.93 56.75 2efi s PHE 18 Cb 0.11 -2.61 -0.05 0.00 0.51 0.00 0.00 43.02 40.98 2efi s PHE 18 CO 0.57 -0.67 -0.19 -0.65 0.70 0.00 0.00 175.22 174.99 2efi s GLN 19 N -4.91 1.49 0.09 0.44 -1.52 -1.26 -5.06 119.66 108.93 2efi s GLN 19 Ca 0.52 -1.62 -0.31 0.00 -1.95 0.00 0.00 55.36 52.00 2efi s GLN 19 Cb -0.10 -1.52 -0.07 0.00 -0.22 0.00 0.00 33.01 31.09 2efi s GLN 19 CO 0.45 0.29 1.40 -1.21 -0.25 0.00 0.00 175.29 175.97 2efi s GLU 20 N -3.31 4.31 0.00 2.91 2.02 -1.26 -2.58 118.70 120.78 2efi s GLU 20 Ca 0.24 2.06 0.00 0.00 0.02 0.00 0.00 54.97 57.29 2efi s GLU 20 Cb -0.04 -3.33 0.00 0.00 0.10 0.00 0.00 34.13 30.86 2efi s GLU 20 CO 0.11 -0.47 0.00 0.41 0.02 0.00 0.00 175.26 175.32 2efi n GLY 21 N 3.54 1.73 3.69 -1.39 0.00 0.38 -5.02 105.19 108.12 2efi n GLY 21 Ca 0.12 0.00 -0.40 0.00 0.00 0.00 0.00 46.02 45.74 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 -0.85 4.34 0.37 1.61 2.12 -1.07 -4.85 118.70 120.37 2efi s GLU 22 Ca 0.00 0.79 -0.27 0.00 0.36 0.00 0.00 54.97 55.85 2efi s GLU 22 Cb 0.00 -3.51 -0.11 0.00 0.26 0.00 0.00 34.13 30.77 2efi s GLU 22 CO 0.00 -0.09 1.29 -2.13 -0.54 0.00 0.00 175.26 173.80 2efi n ARG 23 N 4.40 2.09 -3.94 4.30 0.63 -1.26 -2.49 116.66 120.39 2efi n ARG 23 Ca -0.01 0.74 -0.09 0.00 -0.92 0.00 0.00 57.85 57.56 2efi n ARG 23 Cb 0.50 -2.36 -0.06 0.00 0.45 0.00 0.00 32.46 30.99 2efi n ARG 23 CO 0.00 0.00 0.00 0.14 -2.51 0.00 0.00 177.63 175.26 2efi s VAL 24 N -1.13 0.03 -0.17 5.15 -7.23 -0.19 -4.37 120.40 112.49 2efi s VAL 24 Ca 0.57 -1.29 -0.01 0.00 -1.81 0.00 0.00 61.98 59.44 2efi s VAL 24 Cb -0.54 -1.94 -0.00 0.00 0.56 0.00 0.00 36.38 34.45 2efi s VAL 24 CO 0.61 -0.14 -0.13 -0.76 -0.31 0.00 0.00 175.10 174.37 2efi s LEU 25 N -2.97 2.57 -0.02 1.32 1.43 -1.24 -2.01 118.68 117.76 2efi s LEU 25 Ca 0.18 -0.45 -0.04 0.00 -1.03 0.00 0.00 54.13 52.79 2efi s LEU 25 Cb 0.01 -1.60 -0.04 0.00 0.03 0.00 0.00 46.19 44.59 2efi s LEU 25 CO 0.03 0.06 0.20 0.00 0.23 0.00 0.00 176.35 176.87 2efi s PHE 27 N -1.27 2.78 -0.53 0.00 0.08 -1.01 -3.21 117.98 114.82 2efi s PHE 27 Ca 0.25 -0.55 0.02 0.00 0.12 0.00 0.00 56.93 56.77 2efi s PHE 27 Cb -0.13 -4.14 0.58 0.00 -0.57 0.00 0.00 43.02 38.76 2efi s PHE 27 CO 0.16 -1.49 1.95 1.58 -0.10 0.00 0.00 175.22 177.32 2efi n HIS 28 N 7.28 3.09 0.00 0.36 -0.00 -1.19 -5.02 115.22 119.75 2efi n HIS 28 Ca -0.04 -2.31 0.00 0.00 -0.00 0.00 0.00 57.72 55.36 2efi n HIS 28 Cb 0.45 -1.13 0.00 0.00 -0.00 0.00 0.00 29.99 29.31 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 -1.05 0.16 0.00 1.57 0.00 -1.26 -4.63 105.19 99.97 2efi n GLY 29 Ca 0.60 -1.96 0.05 0.00 0.00 0.00 0.00 46.02 44.72 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 -4.20 1.61 -0.04 -1.26 -4.73 135.00 126.87 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 -1.34 -0.10 0.00 -0.04 0.00 0.00 33.50 32.02 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 -1.67 2.00 0.14 1.53 1.43 -1.26 -4.90 118.68 115.95 2efi s LEU 31 Ca 0.16 -1.18 0.08 0.00 -1.03 0.00 0.00 54.13 52.16 2efi s LEU 31 Cb 0.07 0.09 -0.04 0.00 0.03 0.00 0.00 46.19 46.34 2efi s LEU 31 CO 0.12 -0.63 -0.09 -0.76 0.23 0.00 0.00 176.35 175.22 2efi s LEU 32 N -3.12 3.03 0.09 1.79 1.43 -1.26 -3.15 118.68 117.49 2efi s LEU 32 Ca 0.23 -0.46 0.03 0.00 -1.03 0.00 0.00 54.13 52.91 2efi s LEU 32 Cb 0.07 -1.78 -0.03 0.00 0.03 0.00 0.00 46.19 44.47 2efi s LEU 32 CO 0.03 0.14 -0.10 -0.31 0.23 0.00 0.00 176.35 176.34 2efi s TYR 33 N -1.42 1.00 0.14 0.29 1.51 -1.20 -4.84 117.35 112.84 2efi s TYR 33 Ca 0.23 -0.64 -0.30 0.00 -1.01 0.00 0.00 57.07 55.35 2efi s TYR 33 Cb -0.10 -0.56 -0.07 0.00 -0.11 0.00 0.00 41.96 41.12 2efi s TYR 33 CO 0.15 -0.02 1.09 -2.00 -1.11 0.00 0.00 175.55 173.65 2efi s GLU 34 N -2.62 4.59 0.38 -0.62 2.12 -1.26 -3.26 118.70 118.02 2efi s GLU 34 Ca 0.03 1.67 -0.14 0.00 0.36 0.00 0.00 54.97 56.89 2efi s GLU 34 Cb -0.04 -3.31 0.05 0.00 0.26 0.00 0.00 34.13 31.09 2efi s GLU 34 CO -0.00 0.04 0.74 0.00 -0.54 0.00 0.00 175.26 175.51 2efi s ALA 35 N 0.04 -0.52 -0.01 6.30 0.00 -0.85 -2.75 121.76 123.96 2efi s ALA 35 Ca 0.50 -0.86 -0.05 0.00 0.00 0.00 0.00 51.96 51.56 2efi s ALA 35 Cb -0.28 0.75 -0.00 0.00 0.00 0.00 0.00 23.12 23.59 2efi s ALA 35 CO 0.33 -0.96 0.09 0.21 0.00 0.00 0.00 175.76 175.43 2efi s LYS 36 N -2.43 0.33 -0.60 0.00 2.36 -1.24 -1.02 119.74 117.14 2efi s LYS 36 Ca 0.18 -0.27 -0.26 0.00 -2.55 0.00 0.00 55.97 53.06 2efi s LYS 36 Cb -0.04 0.14 -0.02 0.00 -1.05 0.00 0.00 37.83 36.85 2efi s LYS 36 CO 0.13 -0.07 1.89 0.00 1.55 0.00 0.00 175.35 178.85 2efi h VAL 38 N 6.93 1.43 -3.84 0.00 2.07 0.13 0.11 116.25 123.08 2efi h VAL 38 Ca -0.26 -2.45 -0.10 0.00 0.82 0.00 0.00 66.70 64.71 2efi h VAL 38 Cb 1.17 2.98 -0.12 0.00 -1.52 0.00 0.00 31.29 33.80 2efi h VAL 38 CO 1.21 0.71 -0.28 -0.54 0.02 0.00 0.00 177.57 178.70 2efi s LYS 39 N -2.70 1.22 -0.22 1.57 1.02 -1.06 -4.76 119.74 114.82 2efi s LYS 39 Ca -0.12 -1.17 -0.03 0.00 0.02 0.00 0.00 55.97 54.66 2efi s LYS 39 Cb 0.03 0.40 0.07 0.00 -0.52 0.00 0.00 37.83 37.80 2efi s LYS 39 CO 0.86 -0.46 0.08 0.08 -0.92 0.00 0.00 175.35 174.99 2efi s VAL 40 N -3.97 0.27 0.25 3.17 1.01 -1.26 0.57 120.40 120.43 2efi s VAL 40 Ca 0.18 -0.59 0.09 0.00 0.00 0.00 0.00 61.98 61.66 2efi s VAL 40 Cb 0.03 -0.97 -0.04 0.00 0.00 0.00 0.00 36.38 35.40 2efi s VAL 40 CO 0.01 -0.40 0.01 0.00 0.00 0.00 0.00 175.10 174.73 2efi s ALA 41 N 1.96 3.20 -0.11 5.51 0.00 -0.96 -4.97 121.76 126.39 2efi s ALA 41 Ca 0.03 -1.59 -0.02 0.00 0.00 0.00 0.00 51.96 50.39 2efi s ALA 41 Cb -0.17 -0.85 0.04 0.00 0.00 0.00 0.00 23.12 22.14 2efi s ALA 41 CO -0.16 0.30 0.01 0.42 0.00 0.00 0.00 175.76 176.32 2efi s ILE 42 N -2.21 0.44 0.21 0.00 1.01 -1.26 0.18 121.20 119.57 2efi s ILE 42 Ca 0.31 -0.07 -0.15 0.00 0.00 0.00 0.00 60.65 60.74 2efi s ILE 42 Cb -0.07 -0.68 0.01 0.00 0.01 0.00 0.00 42.46 41.73 2efi s ILE 42 CO 0.20 0.14 0.47 -0.54 0.00 0.00 0.00 174.94 175.21 2efi s LYS 43 N 1.93 1.40 -1.24 2.79 1.02 0.19 -4.91 119.74 120.92 2efi s LYS 43 Ca 0.04 -1.04 -0.07 0.00 0.02 0.00 0.00 55.97 54.92 2efi s LYS 43 Cb -0.13 0.48 0.05 0.00 -0.52 0.00 0.00 37.83 37.71 2efi s LYS 43 CO -0.06 -0.58 0.40 -3.47 -0.92 0.00 0.00 175.35 170.72 2efi n ASP 44 N -0.33 -3.90 -2.26 2.83 -0.08 -1.26 0.43 116.55 111.98 2efi n ASP 44 Ca -0.07 -0.25 -0.20 0.00 -1.51 0.00 0.00 54.79 52.76 2efi n ASP 44 Cb 0.62 -3.24 -0.01 0.00 2.34 0.00 0.00 41.12 40.83 2efi n ASP 44 CO 0.00 0.00 0.00 0.29 0.12 0.00 0.00 177.20 177.61 2efi n LYS 45 N -3.55 -1.62 -3.98 -0.67 4.01 -1.26 -4.98 118.16 106.12 2efi n LYS 45 Ca -0.05 0.95 -0.09 0.00 -0.51 0.00 0.00 58.31 58.61 2efi n LYS 45 Cb 0.56 -5.55 -0.11 0.00 -0.51 0.00 0.00 35.03 29.42 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 -4.99 0.36 -0.26 1.97 -2.07 0.17 -5.06 119.66 109.77 2efi s GLN 46 Ca 0.00 -0.64 -0.08 0.00 -1.82 0.00 0.00 55.36 52.83 2efi s GLN 46 Cb -0.00 0.13 -0.02 0.00 -1.09 0.00 0.00 33.01 32.03 2efi s GLN 46 CO 0.00 -0.06 0.09 0.08 -1.32 0.00 0.00 175.29 174.08 2efi s VAL 47 N -1.66 4.37 0.53 3.63 1.01 -1.26 -0.64 120.40 126.38 2efi s VAL 47 Ca -0.14 -0.24 0.06 0.00 0.00 0.00 0.00 61.98 61.66 2efi s VAL 47 Cb -0.08 -3.10 0.03 0.00 0.00 0.00 0.00 36.38 33.23 2efi s VAL 47 CO -0.01 0.27 0.43 -0.54 0.00 0.00 0.00 175.10 175.24 2efi s LYS 48 N 1.61 2.29 -0.21 2.72 1.02 0.13 -1.51 119.74 125.79 2efi s LYS 48 Ca 0.06 -1.91 -0.09 0.00 0.02 0.00 0.00 55.97 54.05 2efi s LYS 48 Cb -0.16 -2.19 0.09 0.00 -0.52 0.00 0.00 37.83 35.06 2efi s LYS 48 CO 0.04 -0.57 0.47 0.71 -0.92 0.00 0.00 175.35 175.08 2efi s TYR 49 N -2.72 -0.85 -0.60 3.18 1.51 0.28 -2.28 117.35 115.89 2efi s TYR 49 Ca 0.39 1.63 -0.26 0.00 -1.01 0.00 0.00 57.07 57.81 2efi s TYR 49 Cb -0.02 0.39 -0.04 0.00 -0.11 0.00 0.00 41.96 42.18 2efi s TYR 49 CO 0.24 -0.48 2.00 0.12 -1.11 0.00 0.00 175.55 176.32 2efi s PHE 50 N 2.28 1.52 0.42 2.71 5.36 0.19 -2.35 117.98 128.11 2efi s PHE 50 Ca -0.05 0.98 -0.14 0.00 -0.96 0.00 0.00 56.93 56.77 2efi s PHE 50 Cb -0.11 -3.96 -0.08 0.00 -0.34 0.00 0.00 43.02 38.54 2efi s PHE 50 CO -0.14 -2.33 0.84 0.42 -1.46 0.00 0.00 175.22 172.55 2efi s ILE 51 N 9.95 4.67 -0.34 3.12 -1.09 -0.96 0.86 121.20 137.41 2efi s ILE 51 Ca 0.75 0.90 0.00 0.00 -2.23 0.00 0.00 60.65 60.07 2efi s ILE 51 Cb -0.13 -3.70 0.11 0.00 -1.58 0.00 0.00 42.46 37.16 2efi s ILE 51 CO 0.21 -0.50 0.13 -2.28 -1.23 0.00 0.00 174.94 171.27 2efi s HIS 52 N -2.36 1.90 -0.20 3.97 5.65 -1.10 -3.53 115.29 119.61 2efi s HIS 52 Ca 0.55 -1.97 -0.30 0.00 0.25 0.00 0.00 55.06 53.58 2efi s HIS 52 Cb -0.10 -1.83 -0.07 0.00 -1.18 0.00 0.00 32.58 29.40 2efi s HIS 52 CO 0.28 -0.86 2.16 0.66 -0.65 0.00 0.00 174.74 176.32 2efi n TYR 53 N 4.51 2.01 -0.25 3.88 4.02 -1.26 -3.70 117.16 126.38 2efi n TYR 53 Ca 0.01 -0.08 0.13 0.00 -0.01 0.00 0.00 57.90 57.95 2efi n TYR 53 Cb 0.40 -2.70 0.25 0.00 -0.02 0.00 0.00 39.34 37.28 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 10.40 -0.02 -3.93 7.72 2.88 -1.11 -4.49 113.62 125.07 2efi n SER 54 Ca 0.30 1.22 -0.55 0.00 -1.33 0.00 0.00 58.87 58.51 2efi n SER 54 Cb 0.39 -0.47 -0.08 0.00 -0.75 0.00 0.00 64.21 63.30 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 -1.33 0.08 0.59 0.46 0.00 -1.26 -4.68 105.19 99.06 2efi n GLY 55 Ca 0.19 0.80 0.39 0.00 0.00 0.00 0.00 46.02 47.40 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 3.85 0.00 -0.30 1.61 4.06 -2.02 -3.38 115.95 119.77 2efi h TRP 56 Ca -0.38 0.00 -0.27 0.00 2.06 0.00 0.00 58.89 60.30 2efi h TRP 56 Cb 1.16 0.00 -0.06 0.00 -1.00 0.00 0.00 29.16 29.25 2efi h TRP 56 CO 0.53 0.00 1.28 -1.71 -3.56 0.00 0.00 178.44 174.98 2efi n ASN 57 N -3.69 0.31 -2.96 -3.49 2.85 -1.26 -4.88 115.26 102.14 2efi n ASN 57 Ca 0.31 -0.76 -0.15 0.00 -0.11 0.00 0.00 54.58 53.88 2efi n ASN 57 Cb 1.61 -1.09 0.11 0.00 1.24 0.00 0.00 39.78 41.65 2efi n ASN 57 CO 0.00 0.00 0.00 1.17 -2.11 0.00 0.00 177.26 176.32 2efi n LYS 58 N 7.44 -1.00 -2.01 1.20 3.00 -1.26 -4.01 118.16 121.51 2efi n LYS 58 Ca 0.57 -0.97 -0.07 0.00 -0.00 0.00 0.00 58.31 57.84 2efi n LYS 58 Cb 0.27 -0.71 -0.01 0.00 0.00 0.00 0.00 35.03 34.58 2efi n LYS 58 CO 0.00 0.00 0.00 0.27 0.00 0.00 0.00 177.40 177.67 2efi n ASN 59 N -3.55 -2.40 -0.01 3.14 0.23 -1.26 -4.67 115.26 106.73 2efi n ASN 59 Ca 0.08 0.27 -0.01 0.00 -0.53 0.00 0.00 54.58 54.39 2efi n ASN 59 Cb 0.29 -2.22 -0.02 0.00 -2.08 0.00 0.00 39.78 35.74 2efi n ASN 59 CO 0.00 0.00 0.00 0.79 -0.93 0.00 0.00 177.26 177.12 2efi n TRP 60 N -2.46 0.00 -0.94 -2.53 7.02 -1.26 -5.06 117.44 112.21 2efi n TRP 60 Ca -0.08 0.00 -0.30 0.00 -1.02 0.00 0.00 57.50 56.10 2efi n TRP 60 Cb 0.45 -0.13 0.01 0.00 -2.42 0.00 0.00 31.31 29.22 2efi n TRP 60 CO 0.00 0.00 0.00 -0.40 -2.02 0.00 0.00 177.69 175.27 2efi n ASP 61 N -2.16 -3.29 -3.97 -0.99 5.68 -1.26 -4.99 116.55 105.57 2efi n ASP 61 Ca -0.04 0.43 -0.09 0.00 -0.50 0.00 0.00 54.79 54.59 2efi n ASP 61 Cb 0.58 -0.65 -0.08 0.00 -1.14 0.00 0.00 41.12 39.83 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 -0.96 0.84 -0.12 0.11 -1.05 -1.23 -5.02 118.70 111.27 2efi s GLU 62 Ca 0.42 -1.13 -0.20 0.00 -0.15 0.00 0.00 54.97 53.91 2efi s GLU 62 Cb -0.34 0.30 -0.04 0.00 -0.44 0.00 0.00 34.13 33.62 2efi s GLU 62 CO 0.55 -0.25 0.56 -1.58 0.95 0.00 0.00 175.26 175.48 2efi s TRP 63 N -3.92 3.50 0.11 4.83 0.52 -1.26 -2.27 118.94 120.45 2efi s TRP 63 Ca 0.10 0.97 0.08 0.00 0.02 0.00 0.00 56.10 57.28 2efi s TRP 63 Cb 0.06 -2.66 -0.04 0.00 -1.15 0.00 0.00 33.47 29.68 2efi s TRP 63 CO -0.07 0.08 -0.21 0.14 0.02 0.00 0.00 176.95 176.91 2efi s VAL 64 N 0.92 1.75 0.00 4.03 -7.23 -0.99 -4.90 120.40 113.98 2efi s VAL 64 Ca 0.29 -1.60 0.00 0.00 -1.81 0.00 0.00 61.98 58.86 2efi s VAL 64 Cb -0.16 -1.61 0.00 0.00 0.56 0.00 0.00 36.38 35.17 2efi s VAL 64 CO 0.12 -0.08 0.00 -0.81 -0.31 0.00 0.00 175.10 174.02 2efi n PRO 65 N 0.98 -1.02 0.00 4.82 -0.04 -1.26 0.10 135.00 138.58 2efi n PRO 65 Ca -0.19 0.00 0.13 0.00 -0.04 0.00 0.00 63.50 63.40 2efi n PRO 65 Cb 0.54 0.00 0.41 0.00 -0.04 0.00 0.00 33.50 34.41 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 -1.51 0.34 0.03 0.54 2.13 -0.57 -3.60 120.64 118.00 2efi n GLU 66 Ca 0.00 -0.16 0.11 0.00 0.66 0.00 0.00 57.16 57.77 2efi n GLU 66 Cb 0.00 -1.50 -0.08 0.00 0.27 0.00 0.00 31.44 30.13 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 -1.19 0.41 -1.46 4.31 2.88 -1.26 -4.04 113.62 113.27 2efi n SER 67 Ca 0.09 0.00 0.07 0.00 -1.33 0.00 0.00 58.87 57.71 2efi n SER 67 Cb 0.33 1.28 0.31 0.00 -0.75 0.00 0.00 64.21 65.38 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 -2.28 3.53 -4.65 -1.46 1.74 -1.24 -4.89 116.66 107.42 2efi n ARG 68 Ca -0.01 -2.47 -0.22 0.00 -0.77 0.00 0.00 57.85 54.38 2efi n ARG 68 Cb 0.53 -1.88 -0.15 0.00 -1.02 0.00 0.00 32.46 29.94 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 -1.95 1.11 0.28 1.55 1.01 -1.25 -2.40 120.40 118.74 2efi s VAL 69 Ca 0.44 -0.60 0.09 0.00 0.00 0.00 0.00 61.98 61.91 2efi s VAL 69 Cb 0.29 -0.93 -0.04 0.00 0.00 0.00 0.00 36.38 35.70 2efi s VAL 69 CO 0.19 0.31 0.02 -0.76 0.00 0.00 0.00 175.10 174.87 2efi s LEU 70 N -0.31 3.22 0.00 3.92 1.43 -0.89 -4.92 118.68 121.13 2efi s LEU 70 Ca 0.05 -0.66 0.03 0.00 -1.03 0.00 0.00 54.13 52.52 2efi s LEU 70 Cb -0.06 -1.72 0.18 0.00 0.03 0.00 0.00 46.19 44.62 2efi s LEU 70 CO -0.00 -0.05 1.04 0.29 0.23 0.00 0.00 176.35 177.85 2efi n LYS 71 N -0.94 0.92 -3.99 1.70 4.01 -1.26 -3.59 118.16 115.01 2efi n LYS 71 Ca -0.06 0.00 -0.29 0.00 -0.51 0.00 0.00 58.31 57.45 2efi n LYS 71 Cb 0.59 -1.05 -0.01 0.00 -0.51 0.00 0.00 35.03 34.05 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 -0.55 -1.83 -4.07 2.13 4.19 -1.26 -4.92 117.16 110.85 2efi n TYR 72 Ca 0.02 0.80 -0.22 0.00 3.31 0.00 0.00 57.90 61.82 2efi n TYR 72 Cb 0.01 -3.66 -0.05 0.00 0.49 0.00 0.00 39.34 36.13 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 -3.62 4.06 0.09 2.97 -7.23 -1.26 -4.89 120.40 110.52 2efi s VAL 73 Ca 0.32 -1.47 -0.18 0.00 -1.81 0.00 0.00 61.98 58.84 2efi s VAL 73 Cb -0.17 -3.27 -0.04 0.00 0.56 0.00 0.00 36.38 33.46 2efi s VAL 73 CO 0.88 -0.31 1.02 -0.67 -0.31 0.00 0.00 175.10 175.71 2efi n ASP 74 N -1.19 -0.63 -0.20 4.85 2.03 -1.26 0.06 116.55 120.22 2efi n ASP 74 Ca -0.06 1.16 -0.09 0.00 0.52 0.00 0.00 54.79 56.32 2efi n ASP 74 Cb 0.59 -0.19 -0.05 0.00 -0.72 0.00 0.00 41.12 40.75 2efi n ASP 74 CO 0.00 0.00 0.00 0.74 -1.92 0.00 0.00 177.20 176.02 2efi h THR 75 N 0.00 0.07 -0.88 5.18 2.02 -2.00 0.16 112.91 117.46 2efi h THR 75 Ca 0.09 0.00 0.07 0.00 0.77 0.00 0.00 66.41 67.34 2efi h THR 75 Cb 0.24 0.07 -0.06 0.00 -1.74 0.00 0.00 68.15 66.66 2efi h THR 75 CO -0.56 0.00 0.55 0.78 0.37 0.00 0.00 175.52 176.66 2efi h ASN 76 N -0.25 0.85 -0.69 4.18 2.35 -0.75 -1.94 115.58 119.33 2efi h ASN 76 Ca 0.16 0.02 0.03 0.00 -0.55 0.00 0.00 56.30 55.96 2efi h ASN 76 Cb 0.56 -0.16 -0.04 0.00 0.05 0.00 0.00 38.32 38.73 2efi h ASN 76 CO -0.68 0.54 0.43 -0.07 -1.65 0.00 0.00 177.43 175.99 2efi h LEU 77 N 0.98 0.71 -1.85 1.61 3.38 0.21 -1.23 115.31 119.13 2efi h LEU 77 Ca 0.39 0.00 0.23 0.00 0.09 0.00 0.00 57.88 58.59 2efi h LEU 77 Cb 0.20 -0.15 -0.03 0.00 0.09 0.00 0.00 40.66 40.77 2efi h LEU 77 CO -0.18 0.49 0.71 1.56 0.09 0.00 0.00 178.44 181.11 2efi h GLN 78 N 0.84 0.00 0.00 1.13 4.20 -0.05 -2.10 115.11 119.14 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 0.02 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.80 2efi h GLN 78 CO -0.11 0.00 -0.13 -0.22 -0.67 0.00 0.00 178.83 177.70 2efi h LYS 79 N 0.00 0.00 -1.11 1.46 3.64 -1.26 -3.07 116.57 116.22 2efi h LYS 79 Ca 0.38 0.00 0.37 0.00 -1.27 0.00 0.00 60.65 60.14 2efi h LYS 79 Cb 1.81 0.00 -0.10 0.00 -0.41 0.00 0.00 32.23 33.52 2efi h LYS 79 CO -0.00 0.00 0.73 0.94 -2.27 0.00 0.00 179.45 178.85 2efi n GLN 80 N -3.37 -0.02 0.03 1.90 7.27 -0.99 0.24 117.38 122.44 2efi n GLN 80 Ca -0.02 0.94 -0.19 0.00 0.07 0.00 0.00 57.00 57.80 2efi n GLN 80 Cb 0.07 -1.89 -0.13 0.00 2.41 0.00 0.00 30.24 30.70 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 0.35 -0.76 3.69 0.11 -1.54 -2.05 114.38 114.18 2efi h ARG 81 Ca 0.68 -0.49 0.09 0.00 0.10 0.00 0.00 59.98 60.36 2efi h ARG 81 Cb 2.26 0.17 -0.05 0.00 1.11 0.00 0.00 29.97 33.46 2efi h ARG 81 CO -0.31 1.19 0.50 1.05 0.10 0.00 0.00 179.97 182.49 2efi h GLU 82 N -0.25 0.68 0.01 0.08 4.11 0.32 -1.05 114.58 118.47 2efi h GLU 82 Ca -0.12 -0.04 -0.00 0.00 0.07 0.00 0.00 59.36 59.27 2efi h GLU 82 Cb 1.51 -0.15 0.00 0.00 0.50 0.00 0.00 28.75 30.61 2efi h GLU 82 CO 0.14 0.45 -0.00 -0.07 0.07 0.00 0.00 179.01 179.60 2efi h LEU 83 N 0.70 -0.01 -1.95 3.06 3.38 -1.23 0.18 115.31 119.44 2efi h LEU 83 Ca 0.34 -0.86 0.23 0.00 0.09 0.00 0.00 57.88 57.69 2efi h LEU 83 Cb 0.41 0.00 -0.04 0.00 0.09 0.00 0.00 40.66 41.13 2efi h LEU 83 CO -0.12 0.89 0.59 1.56 0.09 0.00 0.00 178.44 181.45 2efi h GLN 84 N -0.93 0.04 0.06 1.13 4.20 -1.07 -1.73 115.11 116.80 2efi h GLN 84 Ca -0.00 -0.00 -0.36 0.00 0.06 0.00 0.00 58.65 58.35 2efi h GLN 84 Cb 0.86 -0.01 -0.04 0.00 0.30 0.00 0.00 27.48 28.60 2efi h GLN 84 CO 0.00 0.03 -2.04 0.36 -0.67 0.00 0.00 178.83 176.51 2efi n LYS 85 N -4.31 0.68 -0.33 1.46 2.85 -0.42 -4.29 118.16 113.80 2efi n LYS 85 Ca 0.17 0.29 0.19 0.00 -1.05 0.00 0.00 58.31 57.91 2efi n LYS 85 Cb 0.87 -1.65 0.40 0.00 -0.65 0.00 0.00 35.03 34.00 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 -0.15 1.73 -3.44 0.58 0.00 0.21 -3.29 119.26 114.90 2efi h ALA 86 Ca -0.48 0.17 -0.62 0.00 0.00 0.00 0.00 54.91 53.98 2efi h ALA 86 Cb 1.83 0.13 -0.40 0.00 0.00 0.00 0.00 17.79 19.35 2efi h ALA 86 CO -0.06 -0.42 -0.74 -0.80 0.00 0.00 0.00 179.25 177.23 2efi s ASN 87 N -5.07 4.43 -0.09 0.00 0.01 -0.78 -4.99 114.94 108.46 2efi s ASN 87 Ca -0.11 -1.94 -0.11 0.00 -0.71 0.00 0.00 52.86 50.00 2efi s ASN 87 Cb 0.28 -1.28 -0.08 0.00 0.41 0.00 0.00 41.25 40.57 2efi s ASN 87 CO 0.79 -0.39 0.38 1.56 -1.51 0.00 0.00 177.10 177.92 2efi h GLN 88 N 7.81 -0.12 -0.69 -0.60 4.20 -1.76 -2.89 115.11 121.05 2efi h GLN 88 Ca -0.08 0.01 0.11 0.00 0.06 0.00 0.00 58.65 58.75 2efi h GLN 88 Cb 1.02 0.03 -0.08 0.00 0.30 0.00 0.00 27.48 28.74 2efi h GLN 88 CO 0.50 0.14 0.29 1.05 -0.67 0.00 0.00 178.83 180.14 2efi h GLU 89 N -1.00 0.46 -0.12 1.46 4.11 -1.94 0.53 114.58 118.08 2efi h GLU 89 Ca -0.01 -0.03 0.01 0.00 0.07 0.00 0.00 59.36 59.40 2efi h GLU 89 Cb 0.32 -0.10 -0.01 0.00 0.50 0.00 0.00 28.75 29.45 2efi h GLU 89 CO 0.02 0.31 0.02 1.96 0.07 0.00 0.00 179.01 181.39 2efi h GLN 90 N 0.47 0.08 0.50 1.06 1.08 -1.99 -2.50 115.11 113.82 2efi h GLN 90 Ca 0.36 -0.00 -0.02 0.00 -1.45 0.00 0.00 58.65 57.53 2efi h GLN 90 Cb 0.47 -0.02 0.00 0.00 -0.05 0.00 0.00 27.48 27.89 2efi h GLN 90 CO -0.33 0.05 -0.24 -0.92 -0.95 0.00 0.00 178.83 176.43 2efi h TYR 91 N 0.08 -0.62 -0.94 2.96 3.20 -1.12 -2.87 116.97 117.65 2efi h TYR 91 Ca 0.05 -0.01 0.28 0.00 3.14 0.00 0.00 58.73 62.18 2efi h TYR 91 Cb 0.04 0.21 -0.16 0.00 1.54 0.00 0.00 36.73 38.36 2efi h TYR 91 CO -0.12 -0.37 0.21 0.00 -1.64 0.00 0.00 178.16 176.25 2efi h ALA 92 N -0.24 1.38 -0.86 1.82 0.00 -0.84 0.22 119.26 120.75 2efi h ALA 92 Ca -0.07 0.27 0.19 0.00 0.00 0.00 0.00 54.91 55.31 2efi h ALA 92 Cb 0.54 0.42 -0.16 0.00 0.00 0.00 0.00 17.79 18.59 2efi h ALA 92 CO 0.11 -0.58 -0.10 1.49 0.00 0.00 0.00 179.25 180.17 2efi h GLU 93 N 0.11 0.03 -0.14 0.00 4.22 -1.21 -0.18 114.58 117.40 2efi h GLU 93 Ca 0.62 -0.00 -0.07 0.00 0.08 0.00 0.00 59.36 59.99 2efi h GLU 93 Cb 1.33 -0.01 -0.00 0.00 0.50 0.00 0.00 28.75 30.57 2efi h GLU 93 CO -0.77 0.02 -0.17 0.78 -2.18 0.00 0.00 179.01 176.69 2efi h GLY 94 N 0.03 0.40 -1.28 1.92 0.00 -0.66 -3.45 103.07 100.03 2efi h GLY 94 Ca 0.45 -0.43 -0.47 0.00 0.00 0.00 0.00 47.33 46.88 2efi h GLY 94 CO -0.83 0.39 -0.19 0.28 0.00 0.00 0.00 176.54 176.18 2efi n LYS 95 N -4.52 -1.77 -3.88 4.80 5.02 -0.08 -5.00 118.16 112.73 2efi n LYS 95 Ca -0.06 -0.48 -0.30 0.00 -2.02 0.00 0.00 58.31 55.45 2efi n LYS 95 Cb 0.39 -2.11 -0.14 0.00 -0.02 0.00 0.00 35.03 33.15 2efi n LYS 95 CO 0.00 0.00 0.00 0.00 -0.52 0.00 0.00 177.40 176.88 2efi s MET 96 N -4.22 1.51 -0.00 1.97 0.23 -1.26 -4.94 119.30 112.58 2efi s MET 96 Ca 0.65 -2.07 -0.23 0.00 -1.03 0.00 0.00 55.69 53.01 2efi s MET 96 Cb -0.22 -2.87 -0.14 0.00 -1.53 0.00 0.00 34.83 30.07 2efi s MET 96 CO 0.64 -1.06 1.02 -0.09 -2.03 0.00 0.00 175.02 173.50 2efi h ARG 97 N 7.06 -0.64 0.00 3.16 1.12 -1.94 -3.47 114.38 119.66 2efi h ARG 97 Ca -0.06 0.04 0.00 0.00 -1.11 0.00 0.00 59.98 58.85 2efi h ARG 97 Cb 0.95 0.15 0.00 0.00 -0.01 0.00 0.00 29.97 31.06 2efi h ARG 97 CO 0.56 -0.35 0.00 0.41 -3.11 0.00 0.00 179.97 177.48 2efi n GLY 98 N -0.24 3.77 3.72 2.80 0.00 -1.26 -4.53 105.19 109.44 2efi n GLY 98 Ca -0.10 -0.05 -0.38 0.00 0.00 0.00 0.00 46.02 45.49 2efi n GLY 98 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 173.32 173.32 2efi s ALA 99 N -1.79 3.45 0.00 4.61 0.00 -1.26 -5.34 121.76 121.42 2efi s ALA 99 Ca 0.00 -0.13 0.00 0.00 0.00 0.00 0.00 51.96 51.83 2efi s ALA 99 Cb 0.00 -2.73 0.00 0.00 0.00 0.00 0.00 23.12 20.39 2efi s ALA 99 CO 0.00 -0.05 0.33 0.00 0.00 0.00 0.00 175.76 176.05