#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 0.78 -0.19 1.61 0.15 -1.26 -5.05 113.70 109.75 2efi s SER 2 Ca 0.00 0.08 -0.16 0.00 0.70 0.00 0.00 55.95 56.57 2efi s SER 2 Cb 0.00 -0.10 -0.11 0.00 -1.71 0.00 0.00 66.02 64.10 2efi s SER 2 CO 0.00 -0.21 -0.03 -1.54 1.20 0.00 0.00 173.24 172.65 2efi n SER 3 N 4.95 1.86 -4.08 5.45 3.41 -1.26 -4.99 113.62 118.96 2efi n SER 3 Ca -0.11 0.49 -0.42 0.00 -0.26 0.00 0.00 58.87 58.56 2efi n SER 3 Cb 0.50 -0.90 0.01 0.00 -0.26 0.00 0.00 64.21 63.56 2efi n SER 3 CO 0.00 0.00 0.00 0.61 -0.16 0.00 0.00 175.04 175.49 2efi n GLY 4 N 1.49 -0.70 3.26 5.00 0.00 -1.26 -4.93 105.19 108.04 2efi n GLY 4 Ca -0.24 0.29 -0.17 0.00 0.00 0.00 0.00 46.02 45.90 2efi n GLY 4 CO 0.00 0.00 0.00 -1.35 0.00 0.00 0.00 173.32 171.97 2efi s SER 5 N -3.71 1.26 0.13 1.61 1.04 -1.26 -5.18 113.70 107.59 2efi s SER 5 Ca 0.42 -1.66 -0.25 0.00 0.48 0.00 0.00 55.95 54.94 2efi s SER 5 Cb -0.23 0.51 0.07 0.00 0.10 0.00 0.00 66.02 66.47 2efi s SER 5 CO 0.90 -1.01 0.76 -0.44 0.98 0.00 0.00 173.24 174.43 2efi s SER 6 N -3.31 -0.40 0.16 7.02 0.01 -1.26 -5.19 113.70 110.72 2efi s SER 6 Ca 0.40 -0.17 -0.03 0.00 1.31 0.00 0.00 55.95 57.46 2efi s SER 6 Cb 0.04 0.54 0.01 0.00 0.21 0.00 0.00 66.02 66.82 2efi s SER 6 CO 0.23 -0.93 0.26 0.61 0.41 0.00 0.00 173.24 173.83 2efi n GLY 7 N -0.37 2.15 3.59 3.44 0.00 -1.26 -5.11 105.19 107.64 2efi n GLY 7 Ca -0.11 -1.30 -0.43 0.00 0.00 0.00 0.00 46.02 44.19 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 -2.19 3.58 0.02 1.61 -2.45 -1.26 -4.98 119.30 113.63 2efi s MET 8 Ca 0.09 0.61 -0.08 0.00 -1.25 0.00 0.00 55.69 55.07 2efi s MET 8 Cb -0.01 -3.99 0.00 0.00 1.25 0.00 0.00 34.83 32.08 2efi s MET 8 CO 0.07 -1.57 0.15 0.00 1.05 0.00 0.00 175.02 174.73 2efi s ALA 9 N 5.07 -0.31 1.16 4.11 0.00 -1.26 -5.17 121.76 125.36 2efi s ALA 9 Ca 0.52 -0.23 -0.18 0.00 0.00 0.00 0.00 51.96 52.07 2efi s ALA 9 Cb -0.10 0.18 0.27 0.00 0.00 0.00 0.00 23.12 23.47 2efi s ALA 9 CO 0.30 -0.27 1.10 -1.25 0.00 0.00 0.00 175.76 175.64 2efi s PRO 10 N -1.93 -0.89 -0.24 0.00 0.04 -1.26 -5.01 135.00 125.70 2efi s PRO 10 Ca -0.10 0.06 0.13 0.00 0.04 0.00 0.00 61.00 61.13 2efi s PRO 10 Cb -0.05 -1.62 0.46 0.00 0.04 0.00 0.00 34.50 33.33 2efi s PRO 10 CO -0.01 -3.52 1.17 0.36 0.04 0.00 0.00 177.00 175.05 2efi n LYS 11 N -4.65 2.47 0.11 4.56 0.00 -1.26 -4.79 118.16 114.61 2efi n LYS 11 Ca 0.11 -3.66 0.10 0.00 -0.00 0.00 0.00 58.31 54.86 2efi n LYS 11 Cb 0.59 -1.79 0.45 0.00 -0.00 0.00 0.00 35.03 34.28 2efi n LYS 11 CO 0.00 0.00 0.00 1.04 0.00 0.00 0.00 177.40 178.44 2efi n GLN 12 N -0.65 0.13 -4.13 -1.58 1.13 -1.26 -4.66 117.38 106.36 2efi n GLN 12 Ca 0.27 0.49 -0.26 0.00 -1.94 0.00 0.00 57.00 55.57 2efi n GLN 12 Cb 0.89 -1.82 -0.06 0.00 0.11 0.00 0.00 30.24 29.36 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 -3.89 5.30 1.11 1.08 1.01 -1.26 -5.12 116.67 114.89 2efi s ASP 13 Ca 0.02 -0.23 -0.16 0.00 0.71 0.00 0.00 52.55 52.89 2efi s ASP 13 Cb 0.07 -1.31 0.24 0.00 1.01 0.00 0.00 42.92 42.94 2efi s ASP 13 CO 0.26 0.06 1.10 -2.16 0.21 0.00 0.00 175.17 174.64 2efi s PRO 14 N -3.17 -0.47 -0.09 8.23 0.04 -1.26 -5.06 135.00 133.22 2efi s PRO 14 Ca 0.30 0.21 0.02 0.00 0.04 0.00 0.00 61.00 61.57 2efi s PRO 14 Cb -0.09 -1.66 -0.02 0.00 0.04 0.00 0.00 34.50 32.77 2efi s PRO 14 CO 0.22 -3.26 -0.15 0.21 0.04 0.00 0.00 177.00 174.05 2efi s LYS 15 N -5.18 2.93 0.74 4.56 2.36 -1.26 -5.08 119.74 118.81 2efi s LYS 15 Ca 0.68 -0.72 -0.12 0.00 -2.55 0.00 0.00 55.97 53.26 2efi s LYS 15 Cb -0.14 -2.46 0.04 0.00 -1.05 0.00 0.00 37.83 34.22 2efi s LYS 15 CO 0.57 0.39 1.10 -1.25 1.55 0.00 0.00 175.35 177.71 2efi s PRO 16 N -0.13 2.40 -0.25 4.03 0.04 -1.26 -5.01 135.00 134.83 2efi s PRO 16 Ca -0.02 1.23 -0.08 0.00 0.04 0.00 0.00 61.00 62.17 2efi s PRO 16 Cb -0.14 -1.91 -0.16 0.00 0.04 0.00 0.00 34.50 32.33 2efi s PRO 16 CO 0.04 -1.54 -0.16 1.63 0.04 0.00 0.00 177.00 177.01 2efi n LYS 17 N -3.22 0.63 -2.97 4.56 5.02 -1.26 -4.97 118.16 115.95 2efi n LYS 17 Ca 0.09 0.26 -0.31 0.00 -2.02 0.00 0.00 58.31 56.33 2efi n LYS 17 Cb 0.53 -1.56 -0.04 0.00 -0.02 0.00 0.00 35.03 33.94 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 -2.50 3.44 0.20 2.13 0.40 -1.26 -5.09 117.98 115.29 2efi s PHE 18 Ca -0.34 1.09 0.09 0.00 -0.60 0.00 0.00 56.93 57.16 2efi s PHE 18 Cb 0.11 -2.46 -0.04 0.00 0.51 0.00 0.00 43.02 41.13 2efi s PHE 18 CO 0.58 -0.03 -0.06 -0.65 0.70 0.00 0.00 175.22 175.76 2efi s GLN 19 N -3.53 2.17 0.39 0.44 -0.21 -1.26 -5.04 119.66 112.61 2efi s GLN 19 Ca 0.52 -1.27 -0.27 0.00 0.02 0.00 0.00 55.36 54.36 2efi s GLN 19 Cb -0.10 -2.20 -0.09 0.00 1.00 0.00 0.00 33.01 31.62 2efi s GLN 19 CO 0.26 0.43 1.33 -1.21 -2.12 0.00 0.00 175.29 173.98 2efi s GLU 20 N -3.01 4.07 0.00 2.91 8.01 -1.26 -2.44 118.70 126.97 2efi s GLU 20 Ca 0.27 2.24 0.00 0.00 0.01 0.00 0.00 54.97 57.48 2efi s GLU 20 Cb -0.08 -2.86 0.00 0.00 -4.31 0.00 0.00 34.13 26.88 2efi s GLU 20 CO 0.17 -0.44 0.00 0.41 0.01 0.00 0.00 175.26 175.41 2efi n GLY 21 N 0.67 2.05 3.73 -1.39 0.00 0.52 -4.99 105.19 105.78 2efi n GLY 21 Ca 0.02 0.00 -0.39 0.00 0.00 0.00 0.00 46.02 45.65 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 -0.44 4.39 0.47 1.61 2.12 -1.02 -4.83 118.70 120.99 2efi s GLU 22 Ca 0.00 0.75 -0.24 0.00 0.36 0.00 0.00 54.97 55.84 2efi s GLU 22 Cb 0.00 -3.41 -0.07 0.00 0.26 0.00 0.00 34.13 30.90 2efi s GLU 22 CO 0.00 0.18 1.39 0.50 -0.54 0.00 0.00 175.26 176.79 2efi s ARG 23 N 0.46 3.58 0.18 4.30 3.52 -1.26 -1.61 118.95 128.12 2efi s ARG 23 Ca 0.33 2.33 -0.21 0.00 -0.13 0.00 0.00 55.73 58.05 2efi s ARG 23 Cb -0.17 -2.56 0.05 0.00 -1.56 0.00 0.00 34.95 30.71 2efi s ARG 23 CO 0.16 -0.87 0.59 0.14 -0.81 0.00 0.00 175.30 174.51 2efi s VAL 24 N -1.24 0.01 -0.17 7.11 -7.23 0.16 -4.55 120.40 114.49 2efi s VAL 24 Ca 0.63 -0.33 -0.05 0.00 -1.81 0.00 0.00 61.98 60.43 2efi s VAL 24 Cb -0.42 -1.25 -0.03 0.00 0.56 0.00 0.00 36.38 35.24 2efi s VAL 24 CO 0.53 -0.05 -0.01 -0.76 -0.31 0.00 0.00 175.10 174.50 2efi s LEU 25 N -2.80 3.38 -0.07 1.32 1.43 -1.25 -1.83 118.68 118.85 2efi s LEU 25 Ca 0.04 -0.09 -0.03 0.00 -1.03 0.00 0.00 54.13 53.03 2efi s LEU 25 Cb -0.01 -1.83 -0.04 0.00 0.03 0.00 0.00 46.19 44.34 2efi s LEU 25 CO -0.08 0.16 0.05 0.00 0.23 0.00 0.00 176.35 176.70 2efi s PHE 27 N -0.99 2.95 -0.23 0.00 0.08 -0.87 -3.36 117.98 115.56 2efi s PHE 27 Ca 0.16 0.48 0.14 0.00 0.12 0.00 0.00 56.93 57.83 2efi s PHE 27 Cb -0.12 -3.94 0.60 0.00 -0.57 0.00 0.00 43.02 38.99 2efi s PHE 27 CO 0.05 -1.06 1.53 1.58 -0.10 0.00 0.00 175.22 177.23 2efi n HIS 28 N 7.13 1.35 0.00 0.36 -0.00 -1.20 -5.06 115.22 117.80 2efi n HIS 28 Ca 0.07 -1.03 0.00 0.00 -0.00 0.00 0.00 57.72 56.76 2efi n HIS 28 Cb 0.48 -0.43 0.00 0.00 -0.00 0.00 0.00 29.99 30.05 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 -0.43 0.25 0.00 1.57 0.00 -1.26 -4.72 105.19 100.60 2efi n GLY 29 Ca 0.27 -1.67 0.05 0.00 0.00 0.00 0.00 46.02 44.68 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 -4.19 1.61 -0.04 -1.26 -4.74 135.00 126.87 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 -1.33 -0.10 0.00 -0.04 0.00 0.00 33.50 32.03 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 -1.66 1.37 0.17 1.53 1.43 -1.26 -4.89 118.68 115.37 2efi s LEU 31 Ca 0.16 -1.33 0.10 0.00 -1.03 0.00 0.00 54.13 52.02 2efi s LEU 31 Cb 0.07 0.33 -0.04 0.00 0.03 0.00 0.00 46.19 46.58 2efi s LEU 31 CO 0.12 -0.80 -0.19 -0.76 0.23 0.00 0.00 176.35 174.95 2efi s LEU 32 N -3.14 2.63 0.05 1.79 1.43 -1.26 -3.27 118.68 116.91 2efi s LEU 32 Ca 0.34 -0.71 0.03 0.00 -1.03 0.00 0.00 54.13 52.76 2efi s LEU 32 Cb 0.07 -1.39 -0.03 0.00 0.03 0.00 0.00 46.19 44.88 2efi s LEU 32 CO 0.09 0.13 -0.10 -0.31 0.23 0.00 0.00 176.35 176.39 2efi s TYR 33 N -1.52 0.84 0.15 0.29 1.51 -1.21 -4.81 117.35 112.60 2efi s TYR 33 Ca 0.21 -0.47 -0.30 0.00 -1.01 0.00 0.00 57.07 55.49 2efi s TYR 33 Cb -0.09 -0.49 -0.08 0.00 -0.11 0.00 0.00 41.96 41.19 2efi s TYR 33 CO 0.11 -0.04 1.26 -2.00 -1.11 0.00 0.00 175.55 173.78 2efi s GLU 34 N -1.58 4.42 0.36 -0.62 2.12 -1.26 -3.25 118.70 118.89 2efi s GLU 34 Ca -0.07 1.94 -0.12 0.00 0.36 0.00 0.00 54.97 57.08 2efi s GLU 34 Cb -0.10 -3.25 0.03 0.00 0.26 0.00 0.00 34.13 31.08 2efi s GLU 34 CO 0.01 -0.23 0.67 0.00 -0.54 0.00 0.00 175.26 175.17 2efi s ALA 35 N 0.41 -0.25 -0.05 6.30 0.00 -0.76 -2.60 121.76 124.81 2efi s ALA 35 Ca 0.57 -0.98 -0.09 0.00 0.00 0.00 0.00 51.96 51.46 2efi s ALA 35 Cb -0.34 0.86 0.02 0.00 0.00 0.00 0.00 23.12 23.66 2efi s ALA 35 CO 0.34 -0.92 0.21 0.21 0.00 0.00 0.00 175.76 175.60 2efi s LYS 36 N -2.73 0.39 -0.02 0.00 2.36 -1.25 -0.67 119.74 117.82 2efi s LYS 36 Ca 0.20 0.01 -0.30 0.00 -2.55 0.00 0.00 55.97 53.34 2efi s LYS 36 Cb -0.03 0.17 -0.08 0.00 -1.05 0.00 0.00 37.83 36.84 2efi s LYS 36 CO 0.14 -0.08 1.94 0.00 1.55 0.00 0.00 175.35 178.90 2efi n VAL 38 N 5.88 1.04 -3.60 0.00 0.31 0.24 -0.35 118.33 121.83 2efi n VAL 38 Ca 0.21 -0.72 -0.10 0.00 -0.01 0.00 0.00 64.34 63.72 2efi n VAL 38 Cb 0.42 -0.42 -0.02 0.00 -0.91 0.00 0.00 33.84 32.91 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 -2.60 1.46 -0.22 5.55 1.02 -1.15 -4.84 119.74 118.96 2efi s LYS 39 Ca -0.09 -0.67 -0.03 0.00 0.02 0.00 0.00 55.97 55.20 2efi s LYS 39 Cb 0.07 0.59 0.07 0.00 -0.52 0.00 0.00 37.83 38.04 2efi s LYS 39 CO 0.76 -0.66 0.08 0.08 -0.92 0.00 0.00 175.35 174.69 2efi s VAL 40 N -3.78 0.30 0.28 3.17 1.01 -1.26 -0.70 120.40 119.41 2efi s VAL 40 Ca 0.05 -0.61 0.09 0.00 0.00 0.00 0.00 61.98 61.52 2efi s VAL 40 Cb -0.03 -0.99 -0.04 0.00 0.00 0.00 0.00 36.38 35.32 2efi s VAL 40 CO -0.05 -0.39 0.01 0.00 0.00 0.00 0.00 175.10 174.67 2efi s ALA 41 N 1.94 3.19 -0.17 5.51 0.00 -0.84 -4.98 121.76 126.41 2efi s ALA 41 Ca 0.03 -1.69 -0.05 0.00 0.00 0.00 0.00 51.96 50.26 2efi s ALA 41 Cb -0.17 -0.74 0.06 0.00 0.00 0.00 0.00 23.12 22.27 2efi s ALA 41 CO -0.16 0.24 0.09 0.42 0.00 0.00 0.00 175.76 176.34 2efi s ILE 42 N -2.34 -0.05 0.28 0.00 1.01 -1.26 -0.05 121.20 118.79 2efi s ILE 42 Ca 0.32 -0.17 -0.07 0.00 0.00 0.00 0.00 60.65 60.73 2efi s ILE 42 Cb -0.06 -0.59 -0.01 0.00 0.01 0.00 0.00 42.46 41.82 2efi s ILE 42 CO 0.20 -0.26 0.42 -1.59 0.00 0.00 0.00 174.94 173.71 2efi s LYS 43 N 2.12 1.64 -0.61 2.79 -2.85 -0.26 -4.88 119.74 117.69 2efi s LYS 43 Ca 0.02 -1.52 0.00 0.00 -1.00 0.00 0.00 55.97 53.47 2efi s LYS 43 Cb -0.16 0.43 0.00 0.00 -2.06 0.00 0.00 37.83 36.04 2efi s LYS 43 CO -0.09 -0.67 0.00 -0.25 0.10 0.00 0.00 175.35 174.45 2efi n ASP 44 N -0.79 -2.43 -2.67 0.03 9.92 -1.26 0.88 116.55 120.22 2efi n ASP 44 Ca -0.00 0.30 -0.17 0.00 -0.53 0.00 0.00 54.79 54.38 2efi n ASP 44 Cb 0.62 -2.20 0.05 0.00 -0.64 0.00 0.00 41.12 38.95 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 -2.42 -5.42 -3.73 -1.24 4.76 -1.26 -5.01 118.16 103.83 2efi n LYS 45 Ca -0.08 0.62 -0.14 0.00 -2.87 0.00 0.00 58.31 55.85 2efi n LYS 45 Cb 0.49 -5.00 -0.08 0.00 -1.84 0.00 0.00 35.03 28.60 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 -5.85 0.69 -0.33 1.97 -2.07 0.25 -5.10 119.66 109.23 2efi s GLN 46 Ca 0.39 -0.08 -0.12 0.00 -1.82 0.00 0.00 55.36 53.74 2efi s GLN 46 Cb -0.17 0.31 -0.02 0.00 -1.09 0.00 0.00 33.01 32.04 2efi s GLN 46 CO 0.48 -0.19 0.21 0.08 -1.32 0.00 0.00 175.29 174.56 2efi s VAL 47 N -1.17 5.11 0.47 3.63 1.01 -1.26 -1.11 120.40 127.07 2efi s VAL 47 Ca -0.12 -0.25 0.07 0.00 0.00 0.00 0.00 61.98 61.68 2efi s VAL 47 Cb -0.04 -3.61 0.01 0.00 0.00 0.00 0.00 36.38 32.73 2efi s VAL 47 CO 0.05 0.02 0.44 -0.54 0.00 0.00 0.00 175.10 175.07 2efi s LYS 48 N 1.70 2.44 -0.18 2.72 1.02 0.93 -1.52 119.74 126.86 2efi s LYS 48 Ca 0.06 -1.66 -0.08 0.00 0.02 0.00 0.00 55.97 54.30 2efi s LYS 48 Cb -0.17 -2.35 0.07 0.00 -0.52 0.00 0.00 37.83 34.86 2efi s LYS 48 CO 0.09 -0.38 0.41 0.71 -0.92 0.00 0.00 175.35 175.27 2efi s TYR 49 N -2.57 -0.66 -0.59 3.18 1.51 0.28 -1.99 117.35 116.51 2efi s TYR 49 Ca 0.46 1.36 -0.27 0.00 -1.01 0.00 0.00 57.07 57.62 2efi s TYR 49 Cb -0.03 0.27 -0.02 0.00 -0.11 0.00 0.00 41.96 42.07 2efi s TYR 49 CO 0.28 -0.39 1.81 0.12 -1.11 0.00 0.00 175.55 176.26 2efi s PHE 50 N 1.84 1.73 0.44 2.71 5.36 0.12 -2.11 117.98 128.07 2efi s PHE 50 Ca -0.07 0.73 -0.15 0.00 -0.96 0.00 0.00 56.93 56.48 2efi s PHE 50 Cb -0.10 -4.13 -0.08 0.00 -0.34 0.00 0.00 43.02 38.37 2efi s PHE 50 CO -0.13 -2.33 0.88 0.42 -1.46 0.00 0.00 175.22 172.61 2efi s ILE 51 N 8.64 4.61 -0.39 3.12 -1.09 -1.16 0.81 121.20 135.74 2efi s ILE 51 Ca 0.66 1.04 0.01 0.00 -2.23 0.00 0.00 60.65 60.13 2efi s ILE 51 Cb -0.13 -3.69 0.13 0.00 -1.58 0.00 0.00 42.46 37.18 2efi s ILE 51 CO 0.22 -0.52 0.19 -2.28 -1.23 0.00 0.00 174.94 171.32 2efi s HIS 52 N -2.40 1.77 -0.20 3.97 5.65 -1.13 -4.15 115.29 118.81 2efi s HIS 52 Ca 0.56 -2.14 -0.32 0.00 0.25 0.00 0.00 55.06 53.41 2efi s HIS 52 Cb -0.10 -1.74 -0.09 0.00 -1.18 0.00 0.00 32.58 29.47 2efi s HIS 52 CO 0.27 -0.82 2.09 0.66 -0.65 0.00 0.00 174.74 176.29 2efi n TYR 53 N 3.98 2.01 -2.10 3.88 4.02 -1.26 -3.76 117.16 123.93 2efi n TYR 53 Ca 0.06 0.01 -0.42 0.00 -0.01 0.00 0.00 57.90 57.54 2efi n TYR 53 Cb 0.37 -2.66 -0.03 0.00 -0.02 0.00 0.00 39.34 37.00 2efi n TYR 53 CO 0.00 0.00 0.00 0.45 -1.01 0.00 0.00 176.86 176.30 2efi s SER 54 N 6.47 6.75 0.00 7.72 0.15 -1.07 -3.35 113.70 130.37 2efi s SER 54 Ca 1.00 2.47 0.00 0.00 0.70 0.00 0.00 55.95 60.12 2efi s SER 54 Cb -0.60 -2.60 0.00 0.00 -1.71 0.00 0.00 66.02 61.11 2efi s SER 54 CO 0.45 -0.68 0.00 0.61 1.20 0.00 0.00 173.24 174.82 2efi n GLY 55 N 3.10 1.58 3.64 9.45 0.00 -1.26 -4.93 105.19 116.77 2efi n GLY 55 Ca 0.10 -0.20 -0.04 0.00 0.00 0.00 0.00 46.02 45.89 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 -2.00 -0.67 1.01 1.61 0.52 -1.21 -5.17 118.94 113.03 2efi s TRP 56 Ca 0.00 1.35 -0.16 0.00 0.02 0.00 0.00 56.10 57.31 2efi s TRP 56 Cb 0.00 0.40 0.09 0.00 -1.15 0.00 0.00 33.47 32.81 2efi s TRP 56 CO 0.00 -0.33 -0.05 0.09 0.02 0.00 0.00 176.95 176.68 2efi n ASN 57 N 3.69 -2.76 -2.84 2.95 4.13 -1.26 -4.72 115.26 114.46 2efi n ASN 57 Ca -0.18 -0.24 -0.29 0.00 1.68 0.00 0.00 54.58 55.55 2efi n ASN 57 Cb 0.58 -0.77 -0.08 0.00 -1.54 0.00 0.00 39.78 37.97 2efi n ASN 57 CO 0.00 0.00 0.00 0.29 0.28 0.00 0.00 177.26 177.83 2efi n LYS 58 N -1.05 3.09 -0.03 3.52 5.02 -1.26 -3.97 118.16 123.48 2efi n LYS 58 Ca 0.03 -1.77 -0.05 0.00 -2.02 0.00 0.00 58.31 54.50 2efi n LYS 58 Cb 0.47 -2.51 -0.03 0.00 -0.02 0.00 0.00 35.03 32.94 2efi n LYS 58 CO 0.00 0.00 0.00 -1.71 -0.52 0.00 0.00 177.40 175.17 2efi n ASN 59 N 3.18 2.68 -0.65 4.39 5.15 -1.26 -4.62 115.26 124.13 2efi n ASN 59 Ca 0.66 -0.00 0.05 0.00 -0.60 0.00 0.00 54.58 54.69 2efi n ASN 59 Cb 0.48 -0.12 0.15 0.00 -0.53 0.00 0.00 39.78 39.76 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 -2.84 0.47 -2.03 1.20 8.01 -1.25 -4.91 117.44 116.08 2efi n TRP 60 Ca -0.11 -0.23 -0.42 0.00 -1.31 0.00 0.00 57.50 55.43 2efi n TRP 60 Cb 0.61 -0.01 -0.03 0.00 -2.01 0.00 0.00 31.31 29.87 2efi n TRP 60 CO 0.00 0.00 0.00 -0.51 -1.01 0.00 0.00 177.69 176.17 2efi s ASP 61 N -0.98 6.68 0.06 -0.99 1.11 -1.26 -4.91 116.67 116.37 2efi s ASP 61 Ca 0.23 2.55 -0.05 0.00 0.18 0.00 0.00 52.55 55.45 2efi s ASP 61 Cb 0.12 -2.60 -0.02 0.00 1.07 0.00 0.00 42.92 41.49 2efi s ASP 61 CO 0.15 -0.74 0.09 -1.83 1.18 0.00 0.00 175.17 174.03 2efi s GLU 62 N 0.70 0.70 0.07 8.23 -1.05 -1.26 -5.06 118.70 121.03 2efi s GLU 62 Ca 0.65 -1.00 -0.20 0.00 -0.15 0.00 0.00 54.97 54.27 2efi s GLU 62 Cb -0.41 0.27 -0.07 0.00 -0.44 0.00 0.00 34.13 33.48 2efi s GLU 62 CO 0.34 -0.18 0.59 -1.58 0.95 0.00 0.00 175.26 175.38 2efi s TRP 63 N -3.58 3.80 0.08 4.83 0.52 -1.26 -2.99 118.94 120.33 2efi s TRP 63 Ca 0.03 1.29 0.05 0.00 0.02 0.00 0.00 56.10 57.50 2efi s TRP 63 Cb 0.05 -2.54 -0.03 0.00 -1.15 0.00 0.00 33.47 29.80 2efi s TRP 63 CO -0.09 0.55 -0.15 0.14 0.02 0.00 0.00 176.95 177.42 2efi s VAL 64 N -0.98 1.18 0.10 4.03 -7.23 -0.90 -4.91 120.40 111.69 2efi s VAL 64 Ca 0.30 -1.39 -0.02 0.00 -1.81 0.00 0.00 61.98 59.07 2efi s VAL 64 Cb -0.20 -1.17 0.02 0.00 0.56 0.00 0.00 36.38 35.59 2efi s VAL 64 CO 0.19 -0.25 0.09 -0.81 -0.31 0.00 0.00 175.10 174.02 2efi n PRO 65 N 1.15 -1.19 0.00 4.82 -0.04 -1.26 0.10 135.00 138.58 2efi n PRO 65 Ca -0.20 -0.14 0.14 0.00 -0.04 0.00 0.00 63.50 63.25 2efi n PRO 65 Cb 0.54 -0.13 0.50 0.00 -0.04 0.00 0.00 33.50 34.38 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 -1.78 0.95 -0.02 0.54 2.13 -0.58 -3.64 120.64 118.24 2efi n GLU 66 Ca 0.01 -0.47 0.08 0.00 0.66 0.00 0.00 57.16 57.44 2efi n GLU 66 Cb 0.05 -1.49 -0.17 0.00 0.27 0.00 0.00 31.44 30.10 2efi n GLU 66 CO 0.00 0.00 0.00 0.43 -0.41 0.00 0.00 177.13 177.15 2efi n SER 67 N -0.61 0.01 0.11 4.31 7.64 -1.26 -4.21 113.62 119.60 2efi n SER 67 Ca 0.15 0.01 0.12 0.00 1.01 0.00 0.00 58.87 60.15 2efi n SER 67 Cb 0.32 1.84 0.21 0.00 -1.01 0.00 0.00 64.21 65.57 2efi n SER 67 CO 0.00 0.00 0.00 0.03 -3.01 0.00 0.00 175.04 172.06 2efi h ARG 68 N 0.00 0.00 -6.09 1.43 3.08 -1.92 -3.46 114.38 107.41 2efi h ARG 68 Ca -0.07 0.00 -0.58 0.00 0.07 0.00 0.00 59.98 59.39 2efi h ARG 68 Cb 1.17 0.00 -0.03 0.00 0.08 0.00 0.00 29.97 31.19 2efi h ARG 68 CO 0.00 0.00 -0.38 0.08 -1.07 0.00 0.00 179.97 178.60 2efi s VAL 69 N -3.18 5.25 0.38 2.04 1.01 -1.25 -2.06 120.40 122.58 2efi s VAL 69 Ca 0.07 -0.21 0.08 0.00 0.00 0.00 0.00 61.98 61.91 2efi s VAL 69 Cb 0.11 -3.65 -0.07 0.00 0.00 0.00 0.00 36.38 32.76 2efi s VAL 69 CO 0.69 0.02 -0.03 -0.76 0.00 0.00 0.00 175.10 175.01 2efi s LEU 70 N -2.78 2.79 0.00 3.92 1.43 -0.78 -4.93 118.68 118.32 2efi s LEU 70 Ca 0.38 -1.30 0.11 0.00 -1.03 0.00 0.00 54.13 52.30 2efi s LEU 70 Cb -0.12 -0.91 0.51 0.00 0.03 0.00 0.00 46.19 45.70 2efi s LEU 70 CO 0.27 -0.36 1.36 0.29 0.23 0.00 0.00 176.35 178.14 2efi n LYS 71 N -0.88 1.33 -4.09 1.70 4.01 -1.26 -3.94 118.16 115.03 2efi n LYS 71 Ca -0.05 -0.50 -0.28 0.00 -0.51 0.00 0.00 58.31 56.97 2efi n LYS 71 Cb 0.65 -1.22 -0.04 0.00 -0.51 0.00 0.00 35.03 33.91 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 -0.18 -1.54 -4.09 2.13 4.19 -1.26 -4.95 117.16 111.46 2efi n TYR 72 Ca 0.10 0.71 -0.23 0.00 3.31 0.00 0.00 57.90 61.79 2efi n TYR 72 Cb 0.15 -3.39 -0.06 0.00 0.49 0.00 0.00 39.34 36.53 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 -4.01 3.22 0.15 2.97 -7.23 -1.26 -4.90 120.40 109.34 2efi s VAL 73 Ca 0.08 -1.66 -0.15 0.00 -1.81 0.00 0.00 61.98 58.43 2efi s VAL 73 Cb -0.04 -3.01 0.10 0.00 0.56 0.00 0.00 36.38 33.99 2efi s VAL 73 CO 0.92 -0.21 1.09 0.47 -0.31 0.00 0.00 175.10 177.06 2efi n ASP 74 N -1.15 -0.54 0.10 4.85 8.00 -1.26 -0.10 116.55 126.44 2efi n ASP 74 Ca -0.04 1.24 -0.14 0.00 0.71 0.00 0.00 54.79 56.56 2efi n ASP 74 Cb 0.61 -0.25 -0.09 0.00 -0.02 0.00 0.00 41.12 41.37 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 -0.95 -3.53 2.02 -2.00 0.10 112.91 108.55 2efi h THR 75 Ca 0.21 0.00 0.17 0.00 0.77 0.00 0.00 66.41 67.56 2efi h THR 75 Cb 0.38 0.00 -0.08 0.00 -1.74 0.00 0.00 68.15 66.71 2efi h THR 75 CO -0.69 0.00 0.60 0.78 0.37 0.00 0.00 175.52 176.58 2efi h ASN 76 N -0.66 0.68 -0.37 4.18 2.35 -0.99 -0.86 115.58 119.91 2efi h ASN 76 Ca -0.01 0.06 -0.01 0.00 -0.55 0.00 0.00 56.30 55.80 2efi h ASN 76 Cb 0.66 -0.07 -0.02 0.00 0.05 0.00 0.00 38.32 38.95 2efi h ASN 76 CO -0.25 0.30 0.21 -0.07 -1.65 0.00 0.00 177.43 175.97 2efi h LEU 77 N 0.70 0.46 -1.49 1.61 3.38 0.59 -1.64 115.31 118.92 2efi h LEU 77 Ca 0.51 -0.08 0.00 0.00 0.09 0.00 0.00 57.88 58.40 2efi h LEU 77 Cb 0.86 -0.12 -0.00 0.00 0.09 0.00 0.00 40.66 41.49 2efi h LEU 77 CO -0.27 0.40 0.51 1.56 0.09 0.00 0.00 178.44 180.73 2efi h GLN 78 N 0.48 0.00 0.00 1.13 4.20 0.48 -2.15 115.11 119.24 2efi h GLN 78 Ca 0.13 0.00 0.00 0.00 0.06 0.00 0.00 58.65 58.84 2efi h GLN 78 Cb 0.04 0.00 0.00 0.00 0.30 0.00 0.00 27.48 27.82 2efi h GLN 78 CO -0.02 0.00 -0.32 1.17 -0.67 0.00 0.00 178.83 178.99 2efi n LYS 79 N -2.80 0.22 -0.49 1.46 4.81 -0.67 -3.38 118.16 117.31 2efi n LYS 79 Ca -0.01 0.28 0.39 0.00 -0.87 0.00 0.00 58.31 58.10 2efi n LYS 79 Cb 0.54 -1.11 0.62 0.00 0.02 0.00 0.00 35.03 35.11 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 -3.38 -0.01 0.08 1.64 7.27 -0.89 0.24 117.38 122.32 2efi n GLN 80 Ca -0.04 0.96 -0.22 0.00 0.07 0.00 0.00 57.00 57.77 2efi n GLN 80 Cb 0.16 -2.05 -0.15 0.00 2.41 0.00 0.00 30.24 30.61 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 0.37 -0.78 3.69 0.11 -1.59 -2.61 114.38 113.57 2efi h ARG 81 Ca 0.75 -0.64 0.07 0.00 0.10 0.00 0.00 59.98 60.26 2efi h ARG 81 Cb 2.75 0.24 -0.05 0.00 1.11 0.00 0.00 29.97 34.02 2efi h ARG 81 CO -0.19 1.31 0.51 1.05 0.10 0.00 0.00 179.97 182.75 2efi h GLU 82 N -0.19 0.80 0.09 0.08 4.11 0.30 -1.61 114.58 118.16 2efi h GLU 82 Ca -0.20 -0.05 -0.00 0.00 0.07 0.00 0.00 59.36 59.18 2efi h GLU 82 Cb 1.83 -0.18 0.00 0.00 0.50 0.00 0.00 28.75 30.90 2efi h GLU 82 CO 0.18 0.53 -0.04 -0.07 0.07 0.00 0.00 179.01 179.68 2efi h LEU 83 N 0.82 -0.10 -1.64 3.06 3.38 -1.29 0.24 115.31 119.78 2efi h LEU 83 Ca 0.34 -0.44 0.32 0.00 0.09 0.00 0.00 57.88 58.20 2efi h LEU 83 Cb 0.27 0.03 -0.08 0.00 0.09 0.00 0.00 40.66 40.97 2efi h LEU 83 CO -0.12 0.55 0.78 1.56 0.09 0.00 0.00 178.44 181.29 2efi h GLN 84 N -0.93 0.19 0.10 1.13 4.20 -1.28 -0.33 115.11 118.19 2efi h GLN 84 Ca -0.01 -0.01 -0.34 0.00 0.06 0.00 0.00 58.65 58.35 2efi h GLN 84 Cb 0.53 -0.04 -0.02 0.00 0.30 0.00 0.00 27.48 28.25 2efi h GLN 84 CO 0.02 0.12 -1.84 0.36 -0.67 0.00 0.00 178.83 176.83 2efi n LYS 85 N -4.44 0.72 -0.23 1.46 2.85 -0.62 -4.23 118.16 113.67 2efi n LYS 85 Ca 0.27 0.33 0.00 0.00 -1.05 0.00 0.00 58.31 57.86 2efi n LYS 85 Cb 1.11 -1.72 0.08 0.00 -0.65 0.00 0.00 35.03 33.84 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 -0.05 0.46 -3.26 0.58 0.00 0.12 -3.23 119.26 113.88 2efi h ALA 86 Ca -0.41 0.26 -0.66 0.00 0.00 0.00 0.00 54.91 54.10 2efi h ALA 86 Cb 1.88 0.51 -0.39 0.00 0.00 0.00 0.00 17.79 19.80 2efi h ALA 86 CO 0.03 -0.42 -0.50 -0.80 0.00 0.00 0.00 179.25 177.56 2efi s ASN 87 N -5.24 4.76 -0.07 0.00 0.01 -0.65 -4.94 114.94 108.82 2efi s ASN 87 Ca -0.14 -3.04 -0.22 0.00 -0.71 0.00 0.00 52.86 48.74 2efi s ASN 87 Cb 0.20 -1.73 -0.18 0.00 0.41 0.00 0.00 41.25 39.95 2efi s ASN 87 CO 0.74 -0.27 0.86 1.56 -1.51 0.00 0.00 177.10 178.49 2efi h GLN 88 N 6.61 -0.12 -0.39 -0.60 4.20 -1.73 -2.85 115.11 120.24 2efi h GLN 88 Ca -0.03 0.01 0.08 0.00 0.06 0.00 0.00 58.65 58.77 2efi h GLN 88 Cb 0.90 0.03 -0.08 0.00 0.30 0.00 0.00 27.48 28.63 2efi h GLN 88 CO 0.71 0.41 -0.12 0.93 -0.67 0.00 0.00 178.83 180.09 2efi h GLU 89 N -0.83 -0.03 0.00 1.46 5.08 -1.92 0.60 114.58 118.94 2efi h GLU 89 Ca -0.01 0.00 -0.00 0.00 -1.00 0.00 0.00 59.36 58.35 2efi h GLU 89 Cb 0.59 0.01 -0.00 0.00 0.50 0.00 0.00 28.75 29.84 2efi h GLU 89 CO 0.02 -0.02 -0.00 0.37 -1.00 0.00 0.00 179.01 178.38 2efi h GLN 90 N -0.03 0.00 0.05 2.33 4.15 -1.95 0.18 115.11 119.84 2efi h GLN 90 Ca 0.19 0.00 -0.26 0.00 0.77 0.00 0.00 58.65 59.35 2efi h GLN 90 Cb 0.31 0.00 -0.02 0.00 0.21 0.00 0.00 27.48 27.98 2efi h GLN 90 CO -0.41 0.00 -1.32 -0.92 -1.93 0.00 0.00 178.83 174.25 2efi h TYR 91 N 0.00 0.19 0.02 3.99 5.03 -0.53 -3.33 116.97 122.34 2efi h TYR 91 Ca -0.00 -0.14 -0.24 0.00 2.58 0.00 0.00 58.73 60.93 2efi h TYR 91 Cb 0.01 -0.01 0.01 0.00 1.55 0.00 0.00 36.73 38.29 2efi h TYR 91 CO 0.00 1.14 -0.99 0.00 -1.32 0.00 0.00 178.16 176.99 2efi h ALA 92 N 0.80 0.30 -2.02 1.82 0.00 0.10 -3.39 119.26 116.87 2efi h ALA 92 Ca -0.15 -0.72 -0.62 0.00 0.00 0.00 0.00 54.91 53.42 2efi h ALA 92 Cb 1.91 -0.00 0.03 0.00 0.00 0.00 0.00 17.79 19.73 2efi h ALA 92 CO 0.14 0.81 1.00 0.39 0.00 0.00 0.00 179.25 181.59 2efi n GLU 93 N -3.74 2.05 -0.92 0.00 -0.58 0.53 0.23 120.64 118.20 2efi n GLU 93 Ca -0.08 0.75 0.00 0.00 -0.42 0.00 0.00 57.16 57.41 2efi n GLU 93 Cb 0.86 -2.56 0.00 0.00 -0.57 0.00 0.00 31.44 29.17 2efi n GLU 93 CO 0.00 0.00 0.00 0.41 -0.48 0.00 0.00 177.13 177.06 2efi n GLY 94 N 4.13 0.50 2.95 0.62 0.00 -1.26 -4.95 105.19 107.18 2efi n GLY 94 Ca 0.22 0.00 -0.30 0.00 0.00 0.00 0.00 46.02 45.94 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 -0.50 2.03 -0.48 1.61 1.02 0.14 -5.06 119.74 118.49 2efi s LYS 95 Ca 0.00 -2.68 -0.28 0.00 0.02 0.00 0.00 55.97 53.03 2efi s LYS 95 Cb 0.00 -3.34 0.01 0.00 -0.52 0.00 0.00 37.83 33.98 2efi s LYS 95 CO 0.00 -1.12 1.46 1.41 -0.92 0.00 0.00 175.35 176.17 2efi s MET 96 N -0.38 3.39 -0.09 1.68 -2.45 -1.26 -4.78 119.30 115.42 2efi s MET 96 Ca 0.18 0.73 -0.30 0.00 -1.25 0.00 0.00 55.69 55.05 2efi s MET 96 Cb -0.24 -4.10 0.11 0.00 1.25 0.00 0.00 34.83 31.85 2efi s MET 96 CO -0.01 -1.81 0.91 0.50 1.05 0.00 0.00 175.02 175.66 2efi s ARG 97 N 5.34 0.75 0.00 4.11 6.06 -1.26 -5.14 118.95 128.81 2efi s ARG 97 Ca 0.59 -0.00 0.00 0.00 -2.50 0.00 0.00 55.73 53.81 2efi s ARG 97 Cb -0.13 0.35 0.00 0.00 0.06 0.00 0.00 34.95 35.23 2efi s ARG 97 CO 0.29 -0.27 0.00 0.41 -2.50 0.00 0.00 175.30 173.23 2efi n GLY 98 N 0.40 -0.76 3.53 8.12 0.00 -1.26 -5.02 105.19 110.20 2efi n GLY 98 Ca -0.11 0.37 -0.26 0.00 0.00 0.00 0.00 46.02 46.02 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 0.00 -1.11 1.56 4.61 0.00 -1.26 -5.36 120.51 118.95 2efi n ALA 99 Ca 0.00 0.08 0.14 0.00 0.00 0.00 0.00 53.44 53.67 2efi n ALA 99 Cb 0.00 -3.04 0.58 0.00 0.00 0.00 0.00 19.45 16.99 2efi n ALA 99 CO 0.00 0.00 0.00 0.00 0.00 0.00 0.00 177.50 177.50