#PDB cf residue atom bb_p bb_s bb_f chi_p chi_s HB-D HB-I REF pred #--------------------------------------------------------------------------------------------- 2em3 n SER 2 N 0.00 -5.14 -3.10 1.61 7.64 -1.26 -3.16 113.62 110.21 2em3 n SER 2 Ca 0.00 0.31 -0.17 0.00 1.01 0.00 0.00 58.87 60.02 2em3 n SER 2 Cb 0.00 -0.76 0.07 0.00 -1.01 0.00 0.00 64.21 62.51 2em3 n SER 2 CO 0.00 0.00 0.00 -1.20 -3.01 0.00 0.00 175.04 170.83 2em3 n SER 3 N 3.08 -3.88 -4.79 6.43 7.64 -1.26 -5.00 113.62 115.84 2em3 n SER 3 Ca 0.01 -0.49 -0.36 0.00 1.01 0.00 0.00 58.87 59.04 2em3 n SER 3 Cb 0.51 -4.40 -0.07 0.00 -1.01 0.00 0.00 64.21 59.24 2em3 n SER 3 CO 0.00 0.00 0.00 -0.83 -3.01 0.00 0.00 175.04 171.20 2em3 s GLY 4 N -3.72 2.08 0.07 0.23 0.00 -1.19 -5.10 107.32 99.70 2em3 s GLY 4 Ca 0.25 -0.67 0.05 0.00 0.00 0.00 0.00 44.72 44.35 2em3 s GLY 4 CO 0.62 -0.12 -0.06 -1.35 0.00 0.00 0.00 173.10 172.19 2em3 s SER 5 N -0.31 4.65 1.39 1.64 1.04 -1.26 -5.12 113.70 115.73 2em3 s SER 5 Ca 0.11 -0.25 -0.23 0.00 0.48 0.00 0.00 55.95 56.05 2em3 s SER 5 Cb -0.12 -1.02 0.36 0.00 0.10 0.00 0.00 66.02 65.34 2em3 s SER 5 CO 0.01 0.21 0.98 -0.44 0.98 0.00 0.00 173.24 174.98 2em3 s SER 6 N -2.01 -0.76 0.00 7.02 0.01 -1.26 -4.96 113.70 111.74 2em3 s SER 6 Ca 0.21 0.68 0.00 0.00 1.31 0.00 0.00 55.95 58.16 2em3 s SER 6 Cb -0.11 -0.92 0.00 0.00 0.21 0.00 0.00 66.02 65.20 2em3 s SER 6 CO 0.13 -5.16 0.00 0.61 0.41 0.00 0.00 173.24 169.24 2em3 n GLY 7 N 0.69 0.01 3.64 3.44 0.00 -1.26 -5.11 105.19 106.60 2em3 n GLY 7 Ca 0.14 -0.02 -0.43 0.00 0.00 0.00 0.00 46.02 45.72 2em3 n GLY 7 CO 0.00 0.00 0.00 -1.59 0.00 0.00 0.00 173.32 171.73 2em3 s THR 8 N -1.26 3.42 -0.28 2.61 2.01 -1.26 -4.95 115.64 115.93 2em3 s THR 8 Ca 0.00 0.49 -0.16 0.00 0.31 0.00 0.00 61.69 62.33 2em3 s THR 8 Cb 0.00 -3.40 0.11 0.00 0.01 0.00 0.00 72.50 69.22 2em3 s THR 8 CO 0.00 -0.13 0.80 -0.83 -0.69 0.00 0.00 174.62 173.77 2em3 s GLY 9 N 4.64 -0.39 -0.58 4.40 0.00 -1.26 -5.04 107.32 109.08 2em3 s GLY 9 Ca 0.80 2.71 0.01 0.00 0.00 0.00 0.00 44.72 48.24 2em3 s GLY 9 CO 0.33 2.53 1.77 -1.84 0.00 0.00 0.00 173.10 175.89 2em3 n GLU 10 N 4.15 2.97 -4.76 2.90 0.28 -1.26 -4.96 120.64 119.95 2em3 n GLU 10 Ca -0.19 -3.61 -0.24 0.00 -0.16 0.00 0.00 57.16 52.96 2em3 n GLU 10 Cb 0.58 -2.28 -0.15 0.00 1.43 0.00 0.00 31.44 31.01 2em3 n GLU 10 CO 0.00 0.00 0.00 0.15 -0.16 0.00 0.00 177.13 177.12 2em3 s LYS 11 N -3.79 1.34 0.46 3.44 1.02 -1.26 -5.02 119.74 115.93 2em3 s LYS 11 Ca 0.59 -0.58 0.31 0.00 0.02 0.00 0.00 55.97 56.31 2em3 s LYS 11 Cb 0.47 -1.29 1.28 0.00 -0.52 0.00 0.00 37.83 37.77 2em3 s LYS 11 CO -0.06 0.34 1.91 -1.00 -0.92 0.00 0.00 175.35 175.62 2em3 h PRO 12 N 5.79 0.00 -4.75 -1.68 0.13 -1.93 -3.39 132.00 126.17 2em3 h PRO 12 Ca -0.36 0.00 -0.67 0.00 -0.87 0.00 0.00 66.00 64.10 2em3 h PRO 12 Cb 1.16 0.00 -0.36 0.00 0.13 0.00 0.00 31.00 31.92 2em3 h PRO 12 CO 0.48 0.00 -0.72 0.71 -0.23 0.00 0.00 178.00 178.24 2em3 s TYR 13 N -3.57 3.44 -0.13 1.56 2.02 -1.26 -5.07 117.35 114.35 2em3 s TYR 13 Ca 0.02 -2.41 -0.04 0.00 -0.37 0.00 0.00 57.07 54.27 2em3 s TYR 13 Cb 0.09 -2.41 0.06 0.00 -0.40 0.00 0.00 41.96 39.30 2em3 s TYR 13 CO 0.49 -0.89 0.16 -2.00 -1.57 0.00 0.00 175.55 171.74 2em3 s GLU 14 N 1.09 0.08 0.93 -0.62 2.12 -1.26 -0.24 118.70 120.80 2em3 s GLU 14 Ca -0.00 0.35 -0.12 0.00 0.36 0.00 0.00 54.97 55.56 2em3 s GLU 14 Cb -0.20 -0.79 0.15 0.00 0.26 0.00 0.00 34.13 33.55 2em3 s GLU 14 CO -0.05 -0.46 1.09 0.00 -0.54 0.00 0.00 175.26 175.30 2em3 n LYS 16 N -4.04 0.32 0.11 0.00 4.81 -1.26 -3.66 118.16 114.44 2em3 n LYS 16 Ca 0.07 0.14 -0.07 0.00 -0.87 0.00 0.00 58.31 57.58 2em3 n LYS 16 Cb 0.55 -1.04 -0.04 0.00 0.02 0.00 0.00 35.03 34.52 2em3 n LYS 16 CO 0.00 0.00 0.00 0.28 1.17 0.00 0.00 177.40 178.85 2em3 h VAL 17 N -0.56 0.00 0.00 3.15 2.07 -1.99 -3.08 116.25 115.84 2em3 h VAL 17 Ca -0.30 0.00 0.00 0.00 0.82 0.00 0.00 66.70 67.22 2em3 h VAL 17 Cb 1.16 0.00 0.00 0.00 -1.52 0.00 0.00 31.29 30.93 2em3 h VAL 17 CO -0.18 0.00 -0.32 0.00 0.02 0.00 0.00 177.57 177.08 2em3 n SER 19 N -2.32 -4.96 -4.70 0.00 7.64 -1.17 -4.97 113.62 103.15 2em3 n SER 19 Ca 0.04 0.04 -0.40 0.00 1.01 0.00 0.00 58.87 59.56 2em3 n SER 19 Cb 0.45 -4.04 -0.05 0.00 -1.01 0.00 0.00 64.21 59.56 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 -4.66 4.38 0.20 1.43 2.20 -1.26 -4.67 119.74 117.36 2em3 s LYS 20 Ca 0.00 0.86 -0.09 0.00 -0.36 0.00 0.00 55.97 56.38 2em3 s LYS 20 Cb 0.00 -3.48 -0.07 0.00 -1.51 0.00 0.00 37.83 32.77 2em3 s LYS 20 CO 0.00 -0.04 0.52 0.00 -0.36 0.00 0.00 175.35 175.47 2em3 s ALA 21 N 1.16 3.61 0.27 3.13 0.00 -1.26 -0.53 121.76 128.13 2em3 s ALA 21 Ca 0.36 -0.31 0.01 0.00 0.00 0.00 0.00 51.96 52.03 2em3 s ALA 21 Cb -0.17 -2.39 -0.05 0.00 0.00 0.00 0.00 23.12 20.51 2em3 s ALA 21 CO 0.16 0.53 0.09 -0.06 0.00 0.00 0.00 175.76 176.49 2em3 s PHE 22 N -1.75 1.58 -0.22 0.00 0.40 0.67 -4.97 117.98 113.69 2em3 s PHE 22 Ca 0.45 -1.17 0.10 0.00 -0.60 0.00 0.00 56.93 55.72 2em3 s PHE 22 Cb -0.12 -0.93 -0.20 0.00 0.51 0.00 0.00 43.02 42.28 2em3 s PHE 22 CO 0.21 -0.31 -0.06 0.25 0.70 0.00 0.00 175.22 176.01 2em3 n THR 23 N -0.49 1.37 -4.42 0.64 -2.24 -1.26 -4.09 114.28 103.80 2em3 n THR 23 Ca -0.00 -0.70 -0.25 0.00 -2.27 0.00 0.00 64.05 60.83 2em3 n THR 23 Cb 0.66 -0.89 -0.11 0.00 -2.10 0.00 0.00 70.33 67.89 2em3 n THR 23 CO 0.00 0.00 0.00 -1.10 -0.57 0.00 0.00 175.07 173.40 2em3 s GLN 24 N -2.48 1.51 0.00 -0.78 -0.21 -1.26 -4.87 119.66 111.57 2em3 s GLN 24 Ca -0.20 -1.57 -0.25 0.00 0.02 0.00 0.00 55.36 53.36 2em3 s GLN 24 Cb 0.07 -1.72 -0.15 0.00 1.00 0.00 0.00 33.01 32.20 2em3 s GLN 24 CO 0.69 0.36 1.13 -0.22 -2.12 0.00 0.00 175.29 175.13 2em3 h LYS 25 N 2.97 -0.56 -0.85 2.91 3.64 -1.98 -3.00 116.57 119.70 2em3 h LYS 25 Ca -0.44 0.04 0.30 0.00 -1.27 0.00 0.00 60.65 59.28 2em3 h LYS 25 Cb 1.22 0.13 -0.15 0.00 -0.41 0.00 0.00 32.23 33.01 2em3 h LYS 25 CO 0.52 -0.25 0.25 0.00 -2.27 0.00 0.00 179.45 177.69 2em3 n ALA 26 N -2.57 0.66 0.13 5.00 0.00 -1.26 0.65 120.51 123.13 2em3 n ALA 26 Ca -0.10 0.88 -0.13 0.00 0.00 0.00 0.00 53.44 54.09 2em3 n ALA 26 Cb 0.29 -0.77 -0.08 0.00 0.00 0.00 0.00 19.45 18.89 2em3 n ALA 26 CO 0.00 0.00 0.00 0.45 0.00 0.00 0.00 177.50 177.95 2em3 h HIS 27 N 0.00 -0.30 0.76 0.00 3.86 -1.97 -1.50 115.15 116.00 2em3 h HIS 27 Ca 0.62 -0.01 -0.04 0.00 -1.16 0.00 0.00 60.37 59.79 2em3 h HIS 27 Cb 1.50 0.10 0.01 0.00 1.06 0.00 0.00 27.41 30.08 2em3 h HIS 27 CO -0.21 -0.00 -0.37 1.25 0.86 0.00 0.00 177.93 179.46 2em3 h LEU 28 N -0.59 -0.87 -0.72 2.43 5.85 0.36 -1.24 115.31 120.54 2em3 h LEU 28 Ca -0.03 0.03 0.14 0.00 0.84 0.00 0.00 57.88 58.86 2em3 h LEU 28 Cb 0.43 0.22 -0.14 0.00 0.37 0.00 0.00 40.66 41.55 2em3 h LEU 28 CO 0.05 -0.50 -0.23 0.00 -0.34 0.00 0.00 178.44 177.42 2em3 h ALA 29 N -1.29 0.35 -0.29 1.25 0.00 0.09 0.61 119.26 119.97 2em3 h ALA 29 Ca -0.10 0.26 -0.03 0.00 0.00 0.00 0.00 54.91 55.04 2em3 h ALA 29 Cb 0.79 0.63 -0.02 0.00 0.00 0.00 0.00 17.79 19.19 2em3 h ALA 29 CO 0.17 -0.48 0.06 0.37 0.00 0.00 0.00 179.25 179.37 2em3 h GLN 30 N -0.04 0.42 0.41 0.00 5.75 -1.28 -3.12 115.11 117.25 2em3 h GLN 30 Ca 0.33 -0.06 -0.02 0.00 -0.15 0.00 0.00 58.65 58.74 2em3 h GLN 30 Cb 0.55 -0.08 0.00 0.00 1.07 0.00 0.00 27.48 29.02 2em3 h GLN 30 CO -0.75 0.40 -0.20 1.25 -2.65 0.00 0.00 178.83 176.88 2em3 h HIS 31 N 0.42 -0.51 -0.82 3.99 2.76 0.13 -3.21 115.15 117.91 2em3 h HIS 31 Ca 0.10 -0.01 0.33 0.00 -2.20 0.00 0.00 60.37 58.59 2em3 h HIS 31 Cb 0.18 0.17 -0.13 0.00 1.55 0.00 0.00 27.41 29.18 2em3 h HIS 31 CO 0.01 -0.22 0.47 1.04 -1.30 0.00 0.00 177.93 177.92 2em3 n GLN 32 N -5.15 -0.04 -0.29 5.26 1.13 0.87 0.83 117.38 119.98 2em3 n GLN 32 Ca -0.08 1.02 0.04 0.00 -1.94 0.00 0.00 57.00 56.04 2em3 n GLN 32 Cb 0.26 -1.87 0.12 0.00 0.11 0.00 0.00 30.24 28.85 2em3 n GLN 32 CO 0.00 0.00 0.00 0.87 -1.44 0.00 0.00 177.06 176.49 2em3 h LYS 33 N 0.00 0.01 -1.01 -1.09 1.57 -1.55 0.76 116.57 115.26 2em3 h LYS 33 Ca 0.65 -0.00 0.25 0.00 -1.87 0.00 0.00 60.65 59.68 2em3 h LYS 33 Cb 1.81 -0.00 -0.08 0.00 0.08 0.00 0.00 32.23 34.03 2em3 h LYS 33 CO -0.53 0.00 0.66 0.00 -0.57 0.00 0.00 179.45 179.01 2em3 h THR 34 N 0.01 0.57 -1.75 -0.16 1.03 0.24 -3.35 112.91 109.49 2em3 h THR 34 Ca 0.41 -0.13 -0.47 0.00 -0.01 0.00 0.00 66.41 66.21 2em3 h THR 34 Cb 0.65 0.15 -0.05 0.00 -1.07 0.00 0.00 68.15 67.83 2em3 h THR 34 CO -0.85 0.07 1.20 -1.00 -0.01 0.00 0.00 175.52 174.93 2em3 s HIS 35 N -5.45 1.81 -1.24 0.00 3.76 0.26 -4.90 115.29 109.53 2em3 s HIS 35 Ca -0.08 0.57 -0.20 0.00 -0.15 0.00 0.00 55.06 55.20 2em3 s HIS 35 Cb 0.24 -4.18 0.03 0.00 1.11 0.00 0.00 32.58 29.78 2em3 s HIS 35 CO 0.79 -2.15 1.76 0.99 -0.85 0.00 0.00 174.74 175.29 2em3 s THR 36 N 8.63 3.95 1.07 1.30 2.01 -1.26 -4.97 115.64 126.37 2em3 s THR 36 Ca 0.62 -1.55 -0.15 0.00 0.31 0.00 0.00 61.69 60.93 2em3 s THR 36 Cb -0.10 -5.01 0.22 0.00 0.01 0.00 0.00 72.50 67.62 2em3 s THR 36 CO 0.14 -1.76 1.11 -0.83 -0.69 0.00 0.00 174.62 172.59 2em3 s GLY 37 N 4.91 1.57 0.06 4.40 0.00 -1.26 -5.05 107.32 111.95 2em3 s GLY 37 Ca 0.57 -0.61 0.02 0.00 0.00 0.00 0.00 44.72 44.70 2em3 s GLY 37 CO 0.07 0.10 0.09 1.85 0.00 0.00 0.00 173.10 175.22 2em3 s GLU 38 N -5.16 2.97 -0.94 2.90 2.56 -1.26 -5.06 118.70 114.70 2em3 s GLU 38 Ca 0.67 -0.63 -0.03 0.00 0.00 0.00 0.00 54.97 54.99 2em3 s GLU 38 Cb -0.15 -2.78 0.24 0.00 2.00 0.00 0.00 34.13 33.44 2em3 s GLU 38 CO 0.57 0.59 0.88 1.63 -0.56 0.00 0.00 175.26 178.36 2em3 n LYS 39 N 0.58 2.90 -0.05 4.30 4.01 -1.26 -4.87 118.16 123.77 2em3 n LYS 39 Ca -0.09 -4.49 -0.10 0.00 -0.51 0.00 0.00 58.31 53.13 2em3 n LYS 39 Cb 0.52 -2.44 0.05 0.00 -0.51 0.00 0.00 35.03 32.65 2em3 n LYS 39 CO 0.00 0.00 0.00 -1.00 -1.11 0.00 0.00 177.40 175.29 2em3 h PRO 40 N 6.03 0.71 -0.40 1.97 0.13 -2.05 -3.45 132.00 134.94 2em3 h PRO 40 Ca 0.17 -0.37 0.23 0.00 -0.87 0.00 0.00 66.00 65.16 2em3 h PRO 40 Cb 0.81 0.01 -0.23 0.00 0.13 0.00 0.00 31.00 31.72 2em3 h PRO 40 CO 0.91 0.99 0.24 -1.54 -0.23 0.00 0.00 178.00 178.37 2em3 s SER 41 N -6.86 -0.37 0.00 1.44 1.04 -1.26 -5.11 113.70 102.58 2em3 s SER 41 Ca -0.09 0.33 0.00 0.00 0.48 0.00 0.00 55.95 56.68 2em3 s SER 41 Cb 0.12 1.35 0.00 0.00 0.10 0.00 0.00 66.02 67.59 2em3 s SER 41 CO 0.85 -0.07 0.00 0.61 0.98 0.00 0.00 173.24 175.61 2em3 n GLY 42 N 5.20 0.67 3.69 7.32 0.00 -1.26 -4.98 105.19 115.82 2em3 n GLY 42 Ca -0.08 0.00 -0.29 0.00 0.00 0.00 0.00 46.02 45.66 2em3 n GLY 42 CO 0.00 0.00 0.00 2.56 0.00 0.00 0.00 173.32 175.88 2em3 s PRO 43 N -0.31 0.60 0.78 1.61 0.04 -1.26 -5.04 135.00 131.42 2em3 s PRO 43 Ca 0.00 0.58 -0.11 0.00 0.04 0.00 0.00 61.00 61.51 2em3 s PRO 43 Cb 0.00 -1.75 0.06 0.00 0.04 0.00 0.00 34.50 32.84 2em3 s PRO 43 CO 0.00 -2.63 1.10 -1.54 0.04 0.00 0.00 177.00 173.96 2em3 s SER 44 N -3.45 4.72 -1.21 6.66 1.04 -1.26 -4.94 113.70 115.26 2em3 s SER 44 Ca 0.65 1.28 -0.18 0.00 0.48 0.00 0.00 55.95 58.18 2em3 s SER 44 Cb -0.18 -2.04 0.09 0.00 0.10 0.00 0.00 66.02 63.99 2em3 s SER 44 CO 0.57 -1.82 1.60 -0.55 0.98 0.00 0.00 173.24 174.02 2em3 s SER 45 N -3.99 6.80 0.00 7.02 0.15 -1.26 -5.24 113.70 117.18 2em3 s SER 45 Ca 0.60 -2.32 0.00 0.00 0.70 0.00 0.00 55.95 54.94 2em3 s SER 45 Cb -0.14 -2.54 0.00 0.00 -1.71 0.00 0.00 66.02 61.63 2em3 s SER 45 CO 0.54 -1.16 0.00 0.61 1.20 0.00 0.00 173.24 174.42