#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em3 s SER 2 N 0.00 -0.54 -0.09 1.61 0.01 -1.26 -5.16 113.70 108.26 2em3 s SER 2 Ca 0.00 0.56 0.01 0.00 1.31 0.00 0.00 55.95 57.82 2em3 s SER 2 Cb 0.00 0.48 -0.02 0.00 0.21 0.00 0.00 66.02 66.69 2em3 s SER 2 CO 0.00 -0.57 -0.11 -0.94 0.41 0.00 0.00 173.24 172.03 2em3 s SER 3 N -1.23 4.22 0.00 2.44 1.04 -1.26 -5.05 113.70 113.86 2em3 s SER 3 Ca -0.12 -0.21 0.00 0.00 0.48 0.00 0.00 55.95 56.11 2em3 s SER 3 Cb -0.01 -1.29 0.00 0.00 0.10 0.00 0.00 66.02 64.82 2em3 s SER 3 CO 0.08 0.26 0.00 0.61 0.98 0.00 0.00 173.24 175.18 2em3 n GLY 4 N 2.88 1.41 2.85 7.32 0.00 -1.26 -5.16 105.19 113.24 2em3 n GLY 4 Ca -0.18 0.34 -0.16 0.00 0.00 0.00 0.00 46.02 46.02 2em3 n GLY 4 CO 0.00 0.00 0.00 -0.56 0.00 0.00 0.00 173.32 172.76 2em3 s SER 5 N 0.00 0.89 -0.38 1.61 0.01 -1.26 -5.12 113.70 109.45 2em3 s SER 5 Ca 0.00 0.14 -0.05 0.00 1.31 0.00 0.00 55.95 57.36 2em3 s SER 5 Cb 0.00 0.52 0.08 0.00 0.21 0.00 0.00 66.02 66.83 2em3 s SER 5 CO 0.00 -0.29 0.17 -0.55 0.41 0.00 0.00 173.24 172.98 2em3 s SER 6 N 2.37 5.28 0.00 2.44 0.15 -1.26 -5.06 113.70 117.62 2em3 s SER 6 Ca 0.05 -1.65 0.00 0.00 0.70 0.00 0.00 55.95 55.05 2em3 s SER 6 Cb -0.14 -1.85 0.00 0.00 -1.71 0.00 0.00 66.02 62.32 2em3 s SER 6 CO -0.10 -0.46 0.00 0.61 1.20 0.00 0.00 173.24 174.48 2em3 n GLY 7 N 4.71 0.86 2.23 9.45 0.00 -1.26 -4.95 105.19 116.22 2em3 n GLY 7 Ca -0.08 -0.41 -0.28 0.00 0.00 0.00 0.00 46.02 45.25 2em3 n GLY 7 CO 0.00 0.00 0.00 -0.37 0.00 0.00 0.00 173.32 172.95 2em3 n THR 8 N 0.00 3.36 0.00 2.61 5.66 -1.26 -5.02 114.28 119.64 2em3 n THR 8 Ca 0.00 -2.45 0.00 0.00 -3.05 0.00 0.00 64.05 58.55 2em3 n THR 8 Cb 0.00 -0.79 0.00 0.00 -1.55 0.00 0.00 70.33 67.99 2em3 n THR 8 CO 0.00 0.00 0.00 0.61 -3.05 0.00 0.00 175.07 172.63 2em3 n GLY 9 N -1.04 1.99 3.61 1.09 0.00 -1.26 -4.97 105.19 104.61 2em3 n GLY 9 Ca 0.60 -1.96 -0.39 0.00 0.00 0.00 0.00 46.02 44.27 2em3 n GLY 9 CO 0.00 0.00 0.00 -0.54 0.00 0.00 0.00 173.32 172.78 2em3 s GLU 10 N -2.56 4.03 0.34 1.61 0.41 -1.26 -5.05 118.70 116.21 2em3 s GLU 10 Ca 0.00 0.00 -0.29 0.00 -0.41 0.00 0.00 54.97 54.27 2em3 s GLU 10 Cb 0.00 -3.64 -0.11 0.00 -1.78 0.00 0.00 34.13 28.60 2em3 s GLU 10 CO 0.00 -0.23 1.42 0.15 -0.49 0.00 0.00 175.26 176.11 2em3 s LYS 11 N 1.91 4.22 0.15 1.61 3.01 -1.26 -4.89 119.74 124.49 2em3 s LYS 11 Ca 0.14 2.41 0.20 0.00 -1.01 0.00 0.00 55.97 57.70 2em3 s LYS 11 Cb -0.16 -3.02 0.82 0.00 -1.01 0.00 0.00 37.83 34.46 2em3 s LYS 11 CO 0.10 -0.39 1.60 -0.35 0.51 0.00 0.00 175.35 176.82 2em3 n PRO 12 N 0.85 0.11 -3.74 -1.68 -0.04 -1.26 -4.57 135.00 124.67 2em3 n PRO 12 Ca 0.01 0.35 -0.37 0.00 -0.04 0.00 0.00 63.50 63.46 2em3 n PRO 12 Cb 0.40 -1.72 -0.12 0.00 -0.04 0.00 0.00 33.50 32.02 2em3 n PRO 12 CO 0.00 0.00 0.00 0.71 -0.04 0.00 0.00 175.50 176.17 2em3 s TYR 13 N -3.19 3.10 -0.06 0.54 2.02 -1.26 -5.07 117.35 113.43 2em3 s TYR 13 Ca 0.05 -0.56 -0.03 0.00 -0.37 0.00 0.00 57.07 56.17 2em3 s TYR 13 Cb 0.09 -2.25 0.04 0.00 -0.40 0.00 0.00 41.96 39.44 2em3 s TYR 13 CO 0.33 -0.42 0.13 -2.00 -1.57 0.00 0.00 175.55 172.03 2em3 s GLU 14 N 1.59 0.06 0.72 -0.62 2.56 -1.26 -2.38 118.70 119.38 2em3 s GLU 14 Ca 0.05 0.39 -0.12 0.00 0.00 0.00 0.00 54.97 55.30 2em3 s GLU 14 Cb -0.16 -0.22 0.03 0.00 2.00 0.00 0.00 34.13 35.78 2em3 s GLU 14 CO 0.04 -0.20 1.11 0.00 -0.56 0.00 0.00 175.26 175.64 2em3 n LYS 16 N -3.08 2.01 0.07 0.00 2.85 -1.26 -3.56 118.16 115.20 2em3 n LYS 16 Ca 0.07 -0.01 -0.04 0.00 -1.05 0.00 0.00 58.31 57.28 2em3 n LYS 16 Cb 0.58 -1.30 -0.02 0.00 -0.65 0.00 0.00 35.03 33.64 2em3 n LYS 16 CO 0.00 0.00 0.00 0.28 -0.05 0.00 0.00 177.40 177.63 2em3 h VAL 17 N 0.00 0.00 0.00 0.58 2.07 -1.99 -3.37 116.25 113.53 2em3 h VAL 17 Ca -0.29 -0.44 -0.02 0.00 0.82 0.00 0.00 66.70 66.76 2em3 h VAL 17 Cb 1.64 0.00 -0.00 0.00 -1.52 0.00 0.00 31.29 31.40 2em3 h VAL 17 CO 0.02 0.00 -1.04 0.00 0.02 0.00 0.00 177.57 176.57 2em3 n SER 19 N -2.71 -3.27 -4.65 0.00 7.64 -1.23 -5.02 113.62 104.37 2em3 n SER 19 Ca -0.01 -0.39 -0.35 0.00 1.01 0.00 0.00 58.87 59.13 2em3 n SER 19 Cb 0.59 -3.55 -0.10 0.00 -1.01 0.00 0.00 64.21 60.14 2em3 n SER 19 CO 0.00 0.00 0.00 -0.75 -3.01 0.00 0.00 175.04 171.28 2em3 s LYS 20 N -5.32 3.02 0.23 1.43 2.20 -1.26 -4.77 119.74 115.26 2em3 s LYS 20 Ca 0.17 -0.43 0.02 0.00 -0.36 0.00 0.00 55.97 55.36 2em3 s LYS 20 Cb -0.07 -2.78 -0.04 0.00 -1.51 0.00 0.00 37.83 33.43 2em3 s LYS 20 CO 0.48 0.66 0.38 0.00 -0.36 0.00 0.00 175.35 176.51 2em3 s ALA 21 N -0.76 3.87 0.04 3.13 0.00 -1.26 -1.79 121.76 125.00 2em3 s ALA 21 Ca 0.12 -1.02 -0.01 0.00 0.00 0.00 0.00 51.96 51.05 2em3 s ALA 21 Cb -0.11 -1.88 -0.03 0.00 0.00 0.00 0.00 23.12 21.09 2em3 s ALA 21 CO 0.02 0.32 -0.03 -0.06 0.00 0.00 0.00 175.76 176.01 2em3 s PHE 22 N -1.95 0.45 0.01 0.00 0.40 -1.00 -5.01 117.98 110.89 2em3 s PHE 22 Ca 0.36 -0.91 -0.18 0.00 -0.60 0.00 0.00 56.93 55.60 2em3 s PHE 22 Cb -0.10 -0.33 -0.28 0.00 0.51 0.00 0.00 43.02 42.82 2em3 s PHE 22 CO 0.30 -0.32 1.05 1.79 0.70 0.00 0.00 175.22 178.74 2em3 h THR 23 N 3.58 1.39 -2.05 0.64 1.35 -1.99 -3.38 112.91 112.45 2em3 h THR 23 Ca -0.33 -2.34 -0.58 0.00 -0.55 0.00 0.00 66.41 62.61 2em3 h THR 23 Cb 1.16 2.78 -0.11 0.00 -1.73 0.00 0.00 68.15 70.25 2em3 h THR 23 CO 0.59 0.69 -0.65 -1.10 -0.25 0.00 0.00 175.52 174.80 2em3 s GLN 24 N -2.93 2.07 0.05 4.72 -0.21 -1.26 -4.92 119.66 117.18 2em3 s GLN 24 Ca -0.12 -1.66 -0.17 0.00 0.02 0.00 0.00 55.36 53.43 2em3 s GLN 24 Cb 0.04 -1.97 -0.17 0.00 1.00 0.00 0.00 33.01 31.91 2em3 s GLN 24 CO 0.87 0.24 1.25 1.57 -2.12 0.00 0.00 175.29 177.10 2em3 h LYS 25 N 1.91 0.56 -1.08 2.91 2.10 -2.00 -3.19 116.57 117.78 2em3 h LYS 25 Ca -0.43 -0.44 0.32 0.00 -2.00 0.00 0.00 60.65 58.11 2em3 h LYS 25 Cb 1.25 0.09 -0.13 0.00 -0.90 0.00 0.00 32.23 32.54 2em3 h LYS 25 CO 0.64 1.06 0.66 0.00 -2.00 0.00 0.00 179.45 179.81 2em3 h ALA 26 N 0.50 2.18 -0.16 0.07 0.00 -1.98 0.30 119.26 120.16 2em3 h ALA 26 Ca -0.03 0.13 -0.06 0.00 0.00 0.00 0.00 54.91 54.95 2em3 h ALA 26 Cb 1.14 0.12 -0.00 0.00 0.00 0.00 0.00 17.79 19.05 2em3 h ALA 26 CO 0.11 -0.73 -0.15 1.25 0.00 0.00 0.00 179.25 179.73 2em3 h HIS 27 N 0.32 0.46 0.82 0.00 2.76 -1.97 -1.74 115.15 115.80 2em3 h HIS 27 Ca 0.71 -0.14 -0.04 0.00 -2.20 0.00 0.00 60.37 58.70 2em3 h HIS 27 Cb 1.78 -0.10 0.01 0.00 1.55 0.00 0.00 27.41 30.65 2em3 h HIS 27 CO -0.01 0.76 -0.40 1.25 -1.30 0.00 0.00 177.93 178.24 2em3 h LEU 28 N 0.03 -0.94 -0.60 0.26 5.85 -0.57 -2.36 115.31 116.99 2em3 h LEU 28 Ca 0.03 0.03 0.12 0.00 0.84 0.00 0.00 57.88 58.89 2em3 h LEU 28 Cb 0.68 0.24 -0.09 0.00 0.37 0.00 0.00 40.66 41.86 2em3 h LEU 28 CO 0.04 -0.59 0.10 0.00 -0.34 0.00 0.00 178.44 177.65 2em3 h ALA 29 N -1.23 0.68 0.00 1.25 0.00 -0.87 0.55 119.26 119.65 2em3 h ALA 29 Ca -0.11 0.14 0.00 0.00 0.00 0.00 0.00 54.91 54.94 2em3 h ALA 29 Cb 0.86 0.21 0.00 0.00 0.00 0.00 0.00 17.79 18.85 2em3 h ALA 29 CO 0.19 -0.33 0.00 1.96 0.00 0.00 0.00 179.25 181.07 2em3 h GLN 30 N 0.22 0.00 0.02 0.00 1.08 -1.28 -2.69 115.11 112.46 2em3 h GLN 30 Ca 0.31 0.00 -0.34 0.00 -1.45 0.00 0.00 58.65 57.17 2em3 h GLN 30 Cb 0.48 0.00 -0.05 0.00 -0.05 0.00 0.00 27.48 27.86 2em3 h GLN 30 CO -0.43 0.00 -1.89 1.58 -0.95 0.00 0.00 178.83 177.14 2em3 n HIS 31 N -2.77 0.65 -0.16 2.96 -0.00 0.16 -4.06 115.22 112.00 2em3 n HIS 31 Ca -0.02 0.24 0.27 0.00 0.46 0.00 0.00 57.72 58.66 2em3 n HIS 31 Cb 0.08 -1.07 0.47 0.00 -0.12 0.00 0.00 29.99 29.35 2em3 n HIS 31 CO 0.00 0.00 0.00 1.96 0.46 0.00 0.00 176.34 178.76 2em3 h GLN 32 N -0.72 0.00 0.13 1.57 4.20 -0.17 1.91 115.11 122.02 2em3 h GLN 32 Ca -0.49 0.00 -0.31 0.00 0.06 0.00 0.00 58.65 57.91 2em3 h GLN 32 Cb 1.58 0.00 -0.00 0.00 0.30 0.00 0.00 27.48 29.36 2em3 h GLN 32 CO -0.21 0.00 -1.54 1.57 -0.67 0.00 0.00 178.83 177.98 2em3 h LYS 33 N 0.00 0.27 -0.70 1.46 2.10 -1.72 -3.31 116.57 114.67 2em3 h LYS 33 Ca 0.44 -0.45 0.15 0.00 -2.00 0.00 0.00 60.65 58.78 2em3 h LYS 33 Cb 2.66 0.17 -0.04 0.00 -0.90 0.00 0.00 32.23 34.11 2em3 h LYS 33 CO -0.00 1.14 0.47 0.00 -2.00 0.00 0.00 179.45 179.05 2em3 h THR 34 N 0.07 0.79 -3.35 0.07 1.03 0.29 -3.42 112.91 108.38 2em3 h THR 34 Ca -0.25 -0.11 -0.43 0.00 -0.01 0.00 0.00 66.41 65.61 2em3 h THR 34 Cb 2.02 0.44 0.20 0.00 -1.07 0.00 0.00 68.15 69.74 2em3 h THR 34 CO 0.17 0.06 0.03 -1.00 -0.01 0.00 0.00 175.52 174.77 2em3 s HIS 35 N -5.32 1.10 -0.11 0.00 3.76 -1.12 -5.04 115.29 108.57 2em3 s HIS 35 Ca -0.07 0.95 0.03 0.00 -0.15 0.00 0.00 55.06 55.82 2em3 s HIS 35 Cb 0.21 -3.13 -0.00 0.00 1.11 0.00 0.00 32.58 30.77 2em3 s HIS 35 CO 0.76 -3.90 -0.22 0.99 -0.85 0.00 0.00 174.74 171.52 2em3 s THR 36 N -2.59 2.20 0.00 1.30 2.01 -1.26 -5.07 115.64 112.23 2em3 s THR 36 Ca 0.68 -0.97 0.00 0.00 0.31 0.00 0.00 61.69 61.72 2em3 s THR 36 Cb -0.20 -1.85 0.00 0.00 0.01 0.00 0.00 72.50 70.45 2em3 s THR 36 CO 0.61 0.55 0.00 0.61 -0.69 0.00 0.00 174.62 175.71 2em3 n GLY 37 N 3.59 1.47 1.95 4.40 0.00 -1.26 -5.03 105.19 110.31 2em3 n GLY 37 Ca -0.19 0.35 -0.20 0.00 0.00 0.00 0.00 46.02 45.98 2em3 n GLY 37 CO 0.00 0.00 0.00 1.18 0.00 0.00 0.00 173.32 174.50 2em3 n GLU 38 N 0.00 2.24 -1.22 1.61 1.02 -1.26 -5.03 120.64 118.00 2em3 n GLU 38 Ca 0.00 -3.14 -0.37 0.00 -0.02 0.00 0.00 57.16 53.62 2em3 n GLU 38 Cb 0.00 -2.10 0.04 0.00 -0.02 0.00 0.00 31.44 29.36 2em3 n GLU 38 CO 0.00 0.00 0.00 0.36 1.18 0.00 0.00 177.13 178.67 2em3 n LYS 39 N -1.10 0.16 -1.12 3.49 0.00 -1.26 -4.95 118.16 113.38 2em3 n LYS 39 Ca 0.53 0.07 -0.29 0.00 -0.00 0.00 0.00 58.31 58.62 2em3 n LYS 39 Cb 1.34 -1.40 0.21 0.00 -0.00 0.00 0.00 35.03 35.18 2em3 n LYS 39 CO 0.00 0.00 0.00 -1.25 0.00 0.00 0.00 177.40 176.15 2em3 s PRO 40 N -2.00 -0.37 -0.88 -1.58 0.04 -1.26 -5.00 135.00 123.95 2em3 s PRO 40 Ca 0.58 0.25 -0.01 0.00 0.04 0.00 0.00 61.00 61.86 2em3 s PRO 40 Cb -0.38 -1.67 0.22 0.00 0.04 0.00 0.00 34.50 32.71 2em3 s PRO 40 CO 0.65 -3.21 0.75 -1.12 0.04 0.00 0.00 177.00 174.11 2em3 s SER 41 N -3.64 5.88 0.58 6.66 0.01 -1.26 -5.01 113.70 116.92 2em3 s SER 41 Ca 0.68 -3.75 0.00 0.00 1.31 0.00 0.00 55.95 54.19 2em3 s SER 41 Cb -0.15 -1.88 0.00 0.00 0.21 0.00 0.00 66.02 64.20 2em3 s SER 41 CO 0.57 -0.17 0.00 0.61 0.41 0.00 0.00 173.24 174.66 2em3 n GLY 42 N 2.28 -4.40 0.12 3.44 0.00 -1.26 -3.95 105.19 101.42 2em3 n GLY 42 Ca 0.21 -0.76 0.11 0.00 0.00 0.00 0.00 46.02 45.58 2em3 n GLY 42 CO 0.00 0.00 0.00 -1.55 0.00 0.00 0.00 173.32 171.77 2em3 n PRO 43 N -1.80 0.18 -3.60 1.61 -0.04 -1.26 -4.62 135.00 125.46 2em3 n PRO 43 Ca 0.00 0.41 -0.16 0.00 -0.04 0.00 0.00 63.50 63.71 2em3 n PRO 43 Cb 0.26 -1.84 -0.07 0.00 -0.04 0.00 0.00 33.50 31.81 2em3 n PRO 43 CO 0.00 0.00 0.00 0.45 -0.04 0.00 0.00 175.50 175.91 2em3 s SER 44 N -4.13 -0.61 -1.15 3.54 0.15 -1.26 -4.97 113.70 105.27 2em3 s SER 44 Ca 0.04 0.89 -0.02 0.00 0.70 0.00 0.00 55.95 57.56 2em3 s SER 44 Cb 0.09 0.84 -0.03 0.00 -1.71 0.00 0.00 66.02 65.22 2em3 s SER 44 CO 0.38 -0.43 0.96 -0.24 1.20 0.00 0.00 173.24 175.11 2em3 n SER 45 N 1.72 -3.73 0.00 5.45 2.88 -1.26 -5.14 113.62 113.54 2em3 n SER 45 Ca -0.17 -0.66 0.00 0.00 -1.33 0.00 0.00 58.87 56.71 2em3 n SER 45 Cb 0.56 -5.11 0.00 0.00 -0.75 0.00 0.00 64.21 58.92 2em3 n SER 45 CO 0.00 0.00 0.00 0.61 -1.23 0.00 0.00 175.04 174.42